G4LZ18_SCHMA Loading...

Voltage-gated potassium channel,putative

AlphaFold DB , UniProt , Accession G4LZ18, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 678 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	40.4	Very low	44.3	Very low	212 Å²	212	122.5 Å²	122.5	100%	1.044	64%	0.64	S	S	*	*				0	-54.7	0	-84.9	-177.6	144	0	0	111.4	I3 A4 W5	M1-I3 VanDerWaalsContact C-N 3.35Å; M1-I3 PolarHBondContact O-N 3.2Å; M1-A4 WeakPolarHBondContact O-CB 3.48Å; M1-A4 PolarHBondContact O-N 3.11Å; M1-W5 PolarHBondContact O-N 3.45Å
2	E	42.5	Very low	43.1	Very low	162 Å²	162	119.5 Å²	119.5	76%	0.757	64%	0.637	S	S	*	*	H	α-helix	trans	-57.3	-40.6	179.9	-149.5	167	-161.1	0	0	113.8	A4 W5 N6	E2-A4 PolarHBondContact O-N 2.83Å; E2-W5 PolarHBondContact O-N 3.14Å; E2-N6 PolarHBondContact O-N 3.06Å; E2-N6 VanDerWaalsContact O-N 3.08Å
3	I	59.8	Low	41.8	Very low	133 Å²	133	120 Å²	120	68%	0.682	65%	0.647	S	S	*	*	H	α-helix	trans	-66.1	-37.2	174.2	-61.1	171.3	0	0	0	112.2	M1 N7	M1-I3 VanDerWaalsContact C-N 3.35Å; M1-I3 PolarHBondContact O-N 3.2Å; I3-N7 PolarHBondContact O-N 2.92Å
4	A	46.2	Very low	40.7	Very low	56 Å²	56	119.8 Å²	119.8	46%	0.463	65%	0.652	S	S	.	*	H	α-helix	trans	-71.9	-36	178.8	0	0	0	0	0	111.4	M1 E2 N7 I8	M1-A4 WeakPolarHBondContact O-CB 3.48Å; M1-A4 PolarHBondContact O-N 3.11Å; E2-A4 PolarHBondContact O-N 2.83Å; A4-N7 PolarHBondContact O-N 3.36Å; A4-I8 WeakPolarHBondContact O-CG1 3.47Å; A4-I8 PolarHBondContact O-N 3.46Å
5	W	39.7	Very low	39.6	Very low	189 Å²	189	120.1 Å²	120.1	72%	0.716	66%	0.659	S	S	*	*	H	α-helix	trans	-64.7	-44.8	175.1	-160.8	-87.6	0	0	0	111.4	M1 E2 N7 I8 T9	M1-W5 PolarHBondContact O-N 3.45Å; E2-W5 PolarHBondContact O-N 3.14Å; W5-N7 VanDerWaalsContact C-N 3.31Å; W5-N7 PolarHBondContact O-N 3.25Å; W5-I8 PolarHBondContact O-N 3.32Å; W5-T9 PolarHBondContact O-N 3.27Å; W5-T9 PolarHBondContact O-OG1 3.16Å
6	N	50.1	Low	38.8	Very low	84 Å²	84	120.1 Å²	120.1	45%	0.449	66%	0.664	S	S	.	*	H	α-helix	trans	-66	-30.8	178.4	-72.5	-9.5	0	0	0	113.2	E2 T9 N10	E2-N6 PolarHBondContact O-N 3.06Å; E2-N6 VanDerWaalsContact O-N 3.08Å; N6-T9 WeakPolarHBondContact CA-OG1 3.43Å; N6-T9 PolarHBondContact O-OG1 2.93Å; N6-T9 VanDerWaalsContact O-OG1 3.06Å; N6-N10 WeakPolarHBondContact O-CB 3.49Å; N6-N10 VanDerWaalsContact O-CG 3.22Å; N6-N10 PolarHBondContact O-N 3.34Å; N6-N10 PolarHBondContact O-ND2 3.28Å
7	N	46.5	Very low	37.9	Very low	104 Å²	104	123.1 Å²	123.1	56%	0.556	68%	0.679	S	S	*	*	H	α-helix	trans	-74.5	-30.7	177.3	-77.7	-7.7	0	0	0	112.9	I3 A4 W5 S11	I3-N7 PolarHBondContact O-N 2.92Å; A4-N7 PolarHBondContact O-N 3.36Å; W5-N7 VanDerWaalsContact C-N 3.31Å; W5-N7 PolarHBondContact O-N 3.25Å; N7-S11 PolarHBondContact O-N 3.07Å; N7-S11 PolarHBondContact O-OG 3.4Å
8	I	43.7	Very low	37.4	Very low	118 Å²	118	121.6 Å²	121.6	61%	0.605	68%	0.678	S	S	*	*	H	α-helix	trans	-72.1	-38.8	175.2	-65.5	167.7	0	0	0	110.1	A4 W5 S11 S12	A4-I8 WeakPolarHBondContact O-CG1 3.47Å; A4-I8 PolarHBondContact O-N 3.46Å; W5-I8 PolarHBondContact O-N 3.32Å; I8-S11 PolarHBondContact O-OG 2.82Å; I8-S12 PolarHBondContact O-OG 3.17Å
9	T	42.8	Very low	36.7	Very low	70 Å²	70	122 Å²	122	43%	0.429	69%	0.69	S	S	.	*	H	α-helix	trans	-73.5	-31.4	178.4	54	0	0	0	0	112.9	W5 N6	W5-T9 PolarHBondContact O-N 3.27Å; W5-T9 PolarHBondContact O-OG1 3.16Å; N6-T9 WeakPolarHBondContact CA-OG1 3.43Å; N6-T9 PolarHBondContact O-OG1 2.93Å; N6-T9 VanDerWaalsContact O-OG1 3.06Å
10	N	39.9	Very low	36.3	Very low	121 Å²	121	120.3 Å²	120.3	65%	0.647	69%	0.692	S	S	*	*	H	α-helix	trans	-83.2	-9.6	-178.8	-71.8	-7	0	0	0	114.3	N6	N6-N10 WeakPolarHBondContact O-CB 3.49Å; N6-N10 VanDerWaalsContact O-CG 3.22Å; N6-N10 PolarHBondContact O-N 3.34Å; N6-N10 PolarHBondContact O-ND2 3.28Å
11	S	35.2	Very low	35.9	Very low	99 Å²	99	120.2 Å²	120.2	69%	0.692	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	3.3	-179.9	49	0	0	0	0	114.3	N7 I8	N7-S11 PolarHBondContact O-N 3.07Å; N7-S11 PolarHBondContact O-OG 3.4Å; I8-S11 PolarHBondContact O-OG 2.82Å
12	S	29.9	Very low	35.2	Very low	86 Å²	86	118.1 Å²	118.1	60%	0.601	69%	0.689	S	S	*	*			trans	-118.2	25.9	-177.1	40.7	0	0	0	0	114.2	I8 V14	I8-S12 PolarHBondContact O-OG 3.17Å; S12-V14 VanDerWaalsContact C-N 3.26Å; S12-V14 PolarHBondContact O-N 3.45Å
13	T	26.6	Very low	34.5	Very low	126 Å²	126	117.8 Å²	117.8	77%	0.773	69%	0.691	S	S	*	*			trans	-76.9	76.8	164.6	32.2	0	0	0	0	110.6
14	V	26.3	Very low	32.9	Very low	117 Å²	117	117.3 Å²	117.3	71%	0.709	69%	0.694	S	S	*	*			trans	-85.5	109.3	157.9	176.1	0	0	0	0	106.7	S12 T16	S12-V14 VanDerWaalsContact C-N 3.26Å; S12-V14 PolarHBondContact O-N 3.45Å; V14-T16 PolarHBondContact O-N 3.12Å
15	T	24.4	Very low	32	Very low	125 Å²	125	123.6 Å²	123.6	77%	0.767	71%	0.714	S	S	*	*			trans	-53.9	101.8	172.7	44.2	0	0	0	0	110.4
16	T	26.2	Very low	31.3	Very low	120 Å²	120	120.1 Å²	120.1	74%	0.736	71%	0.714	S	S	*	*			trans	-103.7	95.5	162.5	42.5	0	0	0	0	107.8	V14 S18	V14-T16 PolarHBondContact O-N 3.12Å; T16-S18 PolarHBondContact O-N 2.92Å; T16-S18 VanDerWaalsContact O-N 3.09Å
17	N	23.4	Very low	30.2	Very low	170 Å²	170	122.1 Å²	122.1	91%	0.909	73%	0.729	S	S	*	*			trans	-65.6	98.3	163.3	-81.1	-19.6	0	0	0	108
18	S	28.5	Very low	29.1	Very low	96 Å²	96	126.3 Å²	126.3	67%	0.671	74%	0.743	S	S	*	*			trans	-141.2	104.9	158.8	64.4	0	0	0	0	109.9	T16 A20	T16-S18 PolarHBondContact O-N 2.92Å; T16-S18 VanDerWaalsContact O-N 3.09Å; S18-A20 PolarHBondContact O-N 2.85Å
19	S	25.3	Very low	28.3	Very low	130 Å²	130	126 Å²	126	91%	0.909	75%	0.746	S	S	*	*			trans	-51.9	113.2	163.6	47	0	0	0	0	110.8
20	A	28.1	Very low	27.5	Very low	88 Å²	88	129.4 Å²	129.4	73%	0.727	76%	0.762	S	S	*	*			trans	-125.2	135.5	164.3	0	0	0	0	0	109.2	S18	S18-A20 PolarHBondContact O-N 2.85Å
21	P	27.9	Very low	26.9	Very low	119 Å²	119	130.1 Å²	130.1	77%	0.773	77%	0.766	S	S	*	*			trans	-84.3	147.7	-164.9	-2.2	22.1	0	0	0	112.5	I23	P21-I23 PolarHBondContact O-N 3.26Å; P21-I23 VanDerWaalsContact O-N 3.11Å
22	N	25.8	Very low	26.6	Very low	167 Å²	167	131.5 Å²	131.5	89%	0.893	77%	0.765	S	S	*	*			trans	-54.5	107.9	173.6	-79.1	-25.7	0	0	0	111.8
23	I	28	Very low	26.5	Very low	155 Å²	155	134 Å²	134	80%	0.795	78%	0.777	S	S	*	*			trans	-93.3	116.6	164	-60.7	175.4	0	0	0	107.1	P21 E25	P21-I23 PolarHBondContact O-N 3.26Å; P21-I23 VanDerWaalsContact O-N 3.11Å; I23-E25 PolarHBondContact O-N 3.21Å
24	T	27.2	Very low	26.7	Very low	124 Å²	124	134.6 Å²	134.6	76%	0.761	78%	0.78	S	S	*	*			trans	-75.7	108.3	175	29.8	0	0	0	0	109.1	T26	T24-T26 PolarHBondContact O-N 2.76Å
25	E	26.6	Very low	26.9	Very low	187 Å²	187	131.6 Å²	131.6	87%	0.874	77%	0.773	S	S	*	*			trans	-71.1	111.7	171.4	-77.7	-175	160.5	0	0	109.8	I23 V27	I23-E25 PolarHBondContact O-N 3.21Å; E25-V27 PolarHBondContact O-N 2.76Å
26	T	25.7	Very low	27.1	Very low	116 Å²	116	132 Å²	132	71%	0.712	78%	0.778	S	S	*	*			trans	-80.2	112.3	173.8	20.2	0	0	0	0	108.6	T24 F28	T24-T26 PolarHBondContact O-N 2.76Å; T26-F28 PolarHBondContact O-N 2.93Å; T26-F28 VanDerWaalsContact O-N 3.15Å
27	V	25.4	Very low	27.2	Very low	127 Å²	127	131.9 Å²	131.9	77%	0.77	78%	0.777	S	S	*	*			trans	-70.7	105.4	176.2	178	0	0	0	0	109	E25 T29	E25-V27 PolarHBondContact O-N 2.76Å; V27-T29 PolarHBondContact O-N 3.39Å
28	F	24.3	Very low	27.5	Very low	192 Å²	192	130.2 Å²	130.2	84%	0.842	77%	0.768	S	S	*	*			trans	-67.8	110.1	169.1	-86.7	-90.8	0	0	0	109.7	T26 N30	T26-F28 PolarHBondContact O-N 2.93Å; T26-F28 VanDerWaalsContact O-N 3.15Å; F28-N30 PolarHBondContact O-N 3.37Å
29	T	26.3	Very low	27.4	Very low	111 Å²	111	131.2 Å²	131.2	68%	0.681	77%	0.77	S	S	*	*			trans	-82	105	167.7	42.7	0	0	0	0	108.2	V27 N31	V27-T29 PolarHBondContact O-N 3.39Å; T29-N31 PolarHBondContact O-N 3.16Å; T29-N31 VanDerWaalsContact O-N 3.15Å
30	N	26.7	Very low	27.5	Very low	141 Å²	141	130.7 Å²	130.7	75%	0.754	76%	0.764	S	S	*	*			trans	-81.3	96.5	179.5	-136.7	5.9	0	0	0	109	F28 N32	F28-N30 PolarHBondContact O-N 3.37Å; N30-N32 VanDerWaalsContact C-N 3.34Å; N30-N32 PolarHBondContact O-N 3.43Å
31	N	26.8	Very low	27.5	Very low	137 Å²	137	134 Å²	134	73%	0.733	77%	0.77	S	S	*	*			trans	-74.7	81.6	172.5	-77.4	-22.9	0	0	0	110	T29 T33	T29-N31 PolarHBondContact O-N 3.16Å; T29-N31 VanDerWaalsContact O-N 3.15Å; N31-T33 PolarHBondContact O-N 2.71Å
32	N	30.1	Very low	27.3	Very low	128 Å²	128	134.8 Å²	134.8	68%	0.684	77%	0.772	S	S	*	*			trans	-94.9	92.8	165.7	-81.8	-13.2	0	0	0	109.7	N30 V34	N30-N32 VanDerWaalsContact C-N 3.34Å; N30-N32 PolarHBondContact O-N 3.43Å; N32-V34 PolarHBondContact O-N 3.49Å
33	T	27.4	Very low	27.4	Very low	138 Å²	138	134 Å²	134	85%	0.847	77%	0.766	S	S	*	*			trans	-56.2	106	159.1	43.4	0	0	0	0	109.8	N31	N31-T33 PolarHBondContact O-N 2.71Å
34	V	30.4	Very low	27.2	Very low	138 Å²	138	131.5 Å²	131.5	84%	0.836	76%	0.76	S	S	*	*			trans	-100	114.3	165.3	-179.8	0	0	0	0	107.3	N32	N32-V34 PolarHBondContact O-N 3.49Å
35	G	29.6	Very low	27	Very low	54 Å²	54	133.5 Å²	133.5	56%	0.557	77%	0.766	S	S	*	*			trans	-70.6	164.4	-178.4	0	0	0	0	0	113.7
36	P	28.7	Very low	27	Very low	135 Å²	135	129.4 Å²	129.4	88%	0.877	76%	0.758	S	S	*	*			trans	-93.5	106.7	-173.5	34.6	-27.2	0	0	0	111.5
37	T	28	Very low	26.9	Very low	116 Å²	116	131.6 Å²	131.6	71%	0.712	77%	0.765	S	S	*	*			trans	-155.2	127.5	169.9	49	0	0	0	0	104
38	D	29.8	Very low	27	Very low	136 Å²	136	129.4 Å²	129.4	73%	0.727	76%	0.756	S	S	*	*			cis	-157.3	151.9	22.5	-81.2	-48.7	0	0	0	108.6
39	T	26.5	Very low	26.9	Very low	117 Å²	117	128.2 Å²	128.2	72%	0.718	76%	0.758	S	S	*	*			trans	28.2	124.6	151.3	56.5	0	0	0	0	120.8	N41	T39-N41 PolarHBondContact O-N 3.04Å
40	P	27.8	Very low	26.8	Very low	119 Å²	119	129.2 Å²	129.2	77%	0.773	76%	0.758	S	S	*	*			trans	-69.3	125.1	172.7	30.4	-32.6	0	0	0	110.5	V42	P40-V42 PolarHBondContact O-N 2.77Å
41	N	27.7	Very low	26.6	Very low	158 Å²	158	129.5 Å²	129.5	85%	0.845	76%	0.759	S	S	*	*			trans	-59	106.6	171.1	-87.2	-36.3	0	0	0	110	T39 I43	T39-N41 PolarHBondContact O-N 3.04Å; N41-I43 PolarHBondContact O-N 3.49Å; N41-I43 VanDerWaalsContact O-N 3.1Å
42	V	24.7	Very low	26.3	Very low	135 Å²	135	129.3 Å²	129.3	82%	0.818	76%	0.756	S	S	*	*			trans	-68.6	97.5	166.8	177.9	0	0	0	0	107.1	P40	P40-V42 PolarHBondContact O-N 2.77Å
43	I	27.2	Very low	26	Very low	149 Å²	149	128.8 Å²	128.8	76%	0.764	75%	0.753	S	S	*	*			trans	-81.6	126	166.1	-60.7	178.3	0	0	0	107.1	N41	N41-I43 PolarHBondContact O-N 3.49Å; N41-I43 VanDerWaalsContact O-N 3.1Å
44	P	25	Very low	25.8	Very low	104 Å²	104	128.8 Å²	128.8	68%	0.675	75%	0.748	S	S	*	*			trans	-71.5	145.5	-171.3	-5	18.6	0	0	0	112.5	S46	P44-S46 PolarHBondContact O-N 3.38Å; P44-S46 VanDerWaalsContact O-N 3.1Å
45	N	22.4	Very low	25.4	Very low	165 Å²	165	132.7 Å²	132.7	88%	0.882	75%	0.748	S	S	*	*			trans	-47.2	111.3	162.5	-81	-19.8	0	0	0	110.7
46	S	26.7	Very low	25.2	Very low	102 Å²	102	136.5 Å²	136.5	71%	0.713	76%	0.76	S	S	*	*			trans	-112.1	101.7	156.5	63.2	0	0	0	0	108.3	P44 S48	P44-S46 PolarHBondContact O-N 3.38Å; P44-S46 VanDerWaalsContact O-N 3.1Å; S46-S48 PolarHBondContact O-N 2.97Å
47	D	24	Very low	25	Very low	162 Å²	162	134.5 Å²	134.5	87%	0.866	75%	0.749	S	S	*	*			trans	-54.8	103	160.5	-74.5	-47.5	0	0	0	109
48	S	26.9	Very low	24.8	Very low	81 Å²	81	132.2 Å²	132.2	57%	0.566	75%	0.748	S	S	*	*			trans	-133.3	94.7	160.9	63.2	0	0	0	0	108.7	S46 I50	S46-S48 PolarHBondContact O-N 2.97Å; S48-I50 PolarHBondContact O-N 3.44Å
49	N	23.1	Very low	24.5	Very low	167 Å²	167	132.6 Å²	132.6	89%	0.893	75%	0.75	S	S	*	*			trans	-54.6	79.4	159.6	-75.3	-48.5	0	0	0	109.6	L51	N49-L51 VanDerWaalsContact C-N 3.28Å; N49-L51 PolarHBondContact O-N 2.64Å
50	I	23.1	Very low	24.4	Very low	131 Å²	131	133.3 Å²	133.3	67%	0.672	75%	0.754	S	S	*	*			trans	-87.6	84.5	166.5	-58.1	-180	0	0	0	106	S48 I52	S48-I50 PolarHBondContact O-N 3.44Å; I50-I52 VanDerWaalsContact C-N 3.27Å; I50-I52 HydrophobicContact CG2-CG1 3.96Å; I50-I52 PolarHBondContact O-N 3.49Å
51	L	22	Very low	24.1	Very low	148 Å²	148	133.3 Å²	133.3	78%	0.775	75%	0.752	S	S	*	*			trans	-63	91.7	165.2	-166.3	82.1	0	0	0	107.1	N49 N53	N49-L51 VanDerWaalsContact C-N 3.28Å; N49-L51 PolarHBondContact O-N 2.64Å; L51-N53 PolarHBondContact O-N 3.29Å
52	I	22.4	Very low	23.7	Very low	132 Å²	132	134.6 Å²	134.6	68%	0.677	75%	0.75	S	S	*	*			trans	-69.1	92.8	171.3	-60.1	178.1	0	0	0	106.5	I50 D54	I50-I52 VanDerWaalsContact C-N 3.27Å; I50-I52 HydrophobicContact CG2-CG1 3.96Å; I50-I52 PolarHBondContact O-N 3.49Å; I52-D54 VanDerWaalsContact C-N 3.31Å; I52-D54 PolarHBondContact O-N 3.14Å; I52-D54 VanDerWaalsContact O-N 3.08Å
53	N	22.8	Very low	23.7	Very low	117 Å²	117	134.2 Å²	134.2	63%	0.626	75%	0.748	S	S	*	*			trans	-78.1	86.3	175.1	-143.3	-2.7	0	0	0	106.5	L51 R55	L51-N53 PolarHBondContact O-N 3.29Å; N53-R55 PolarHBondContact O-N 3.35Å
54	D	23	Very low	23.4	Very low	138 Å²	138	132.8 Å²	132.8	74%	0.738	75%	0.746	S	S	*	*			trans	-66	77.9	170	-91.3	-17.3	0	0	0	109.1	I52 V56	I52-D54 VanDerWaalsContact C-N 3.31Å; I52-D54 PolarHBondContact O-N 3.14Å; I52-D54 VanDerWaalsContact O-N 3.08Å; D54-V56 PolarHBondContact O-N 2.73Å
55	R	22.6	Very low	23.2	Very low	221 Å²	221	136.8 Å²	136.8	83%	0.834	76%	0.756	S	S	*	*			trans	-70.5	89.4	159.9	-86.5	-177.4	173.4	160.4	-1.5	107	N53 S57	N53-R55 PolarHBondContact O-N 3.35Å; R55-S57 VanDerWaalsContact C-N 3.34Å; R55-S57 PolarHBondContact O-N 3.08Å
56	V	25.3	Very low	23.3	Very low	133 Å²	133	136.5 Å²	136.5	81%	0.806	75%	0.754	S	S	*	*			trans	-54.9	103.6	159.4	177	0	0	0	0	106.9	D54 G58	D54-V56 PolarHBondContact O-N 2.73Å; V56-G58 PolarHBondContact O-N 3.27Å
57	S	23.3	Very low	23.1	Very low	94 Å²	94	135.9 Å²	135.9	66%	0.657	76%	0.764	S	S	*	*			trans	-58.1	108.3	174.4	53.5	0	0	0	0	108.6	R55 N59	R55-S57 VanDerWaalsContact C-N 3.34Å; R55-S57 PolarHBondContact O-N 3.08Å; S57-N59 PolarHBondContact O-N 3.47Å
58	G	24.1	Very low	23.1	Very low	67 Å²	67	131.3 Å²	131.3	69%	0.691	76%	0.755	S	S	*	*			trans	-61.8	100.6	168.6	0	0	0	0	0	109.2	V56 V60	V56-G58 PolarHBondContact O-N 3.27Å; G58-V60 PolarHBondContact O-N 2.9Å
59	N	24.2	Very low	22.8	Very low	144 Å²	144	131.5 Å²	131.5	77%	0.77	77%	0.77	S	S	*	*			trans	-66	102.5	165.5	-86.9	-16.9	0	0	0	107.9	S57 V61	S57-N59 PolarHBondContact O-N 3.47Å; N59-V61 VanDerWaalsContact C-N 3.3Å; N59-V61 PolarHBondContact O-N 2.93Å
60	V	23.3	Very low	23	Very low	132 Å²	132	130.3 Å²	130.3	80%	0.8	77%	0.768	S	S	*	*			trans	-64	90.4	169.3	-179.3	0	0	0	0	107.6	G58 K62	G58-V60 PolarHBondContact O-N 2.9Å; V60-K62 PolarHBondContact O-N 3.02Å; V60-K62 VanDerWaalsContact O-N 3.07Å
61	V	22.6	Very low	23	Very low	119 Å²	119	131.2 Å²	131.2	72%	0.721	78%	0.775	S	S	*	*			trans	-73.6	98.9	168.7	178.7	0	0	0	0	107.2	N59 V63	N59-V61 VanDerWaalsContact C-N 3.3Å; N59-V61 PolarHBondContact O-N 2.93Å; V61-V63 HydrophobicContact CG1-CG2 4.35Å; V61-V63 PolarHBondContact O-N 2.81Å
62	K	20	Very low	23.1	Very low	185 Å²	185	127.9 Å²	127.9	80%	0.804	78%	0.776	S	S	*	*			trans	-60.1	102.1	165.9	-87.7	176.3	170.4	174.7	0	108.5	V60 T64	V60-K62 PolarHBondContact O-N 3.02Å; V60-K62 VanDerWaalsContact O-N 3.07Å; K62-T64 PolarHBondContact O-N 3.38Å
63	V	22.9	Very low	23.1	Very low	127 Å²	127	129.6 Å²	129.6	77%	0.77	79%	0.786	S	S	*	*			trans	-82.5	105.7	167.3	179.1	0	0	0	0	106.9	V61 E65	V61-V63 HydrophobicContact CG1-CG2 4.35Å; V61-V63 PolarHBondContact O-N 2.81Å; V63-E65 PolarHBondContact O-N 3.21Å
64	T	22	Very low	23	Very low	119 Å²	119	135.7 Å²	135.7	73%	0.73	80%	0.8	S	S	*	*			trans	-65.8	124.3	170.6	44.5	0	0	0	0	109.8	K62 N66	K62-T64 PolarHBondContact O-N 3.38Å; T64-N66 PolarHBondContact O-N 2.83Å
65	E	20.8	Very low	22.9	Very low	188 Å²	188	138.6 Å²	138.6	88%	0.879	81%	0.806	S	S	*	*			trans	-59.7	113	168.5	-66.5	175	148.8	0	0	109.7	V63	V63-E65 PolarHBondContact O-N 3.21Å
66	N	24.8	Very low	22.9	Very low	159 Å²	159	133.8 Å²	133.8	85%	0.85	80%	0.803	S	S	*	*			trans	-134.1	106.5	157.7	-96.6	-20.1	0	0	0	107.7	T64 G68	T64-N66 PolarHBondContact O-N 2.83Å; N66-G68 PolarHBondContact O-N 2.97Å
67	G	21.8	Very low	22.7	Very low	90 Å²	90	139.1 Å²	139.1	93%	0.928	81%	0.809	S	S	*	*			trans	-66	124.3	178.5	0	0	0	0	0	111.4
68	G	23.3	Very low	22.8	Very low	65 Å²	65	145.5 Å²	145.5	67%	0.67	82%	0.818	S	S	*	*			trans	-142.8	99.9	165.9	0	0	0	0	0	107.9	N66 V70	N66-G68 PolarHBondContact O-N 2.97Å; G68-V70 PolarHBondContact O-N 2.82Å
69	G	21.6	Very low	22.8	Very low	85 Å²	85	151.9 Å²	151.9	88%	0.876	83%	0.827	S	S	*	*			trans	-61.3	123.7	-177.7	0	0	0	0	0	111.9
70	V	26.8	Very low	22.9	Very low	142 Å²	142	150 Å²	150	86%	0.861	82%	0.822	S	S	*	*			trans	-118.4	121.3	163.7	-175.5	0	0	0	0	108.3	G68 G72	G68-V70 PolarHBondContact O-N 2.82Å; V70-G72 PolarHBondContact O-N 2.93Å
71	N	24.1	Very low	23.3	Very low	150 Å²	150	149.6 Å²	149.6	80%	0.802	82%	0.819	S	S	*	*			trans	-47.9	112.5	-175.3	-68.3	-39.4	0	0	0	114.3	L73	N71-L73 PolarHBondContact O-N 3.36Å
72	G	22.8	Very low	23.6	Very low	78 Å²	78	150.6 Å²	150.6	80%	0.804	82%	0.816	S	S	*	*				31.5	58.3	126	0	0	0	0	0	120.2	V70 R74	V70-G72 PolarHBondContact O-N 2.93Å; G72-R74 PolarHBondContact O-N 3.17Å
73	L	23.4	Very low	24.1	Very low	169 Å²	169	145.2 Å²	145.2	89%	0.885	80%	0.802	S	S	*	*			trans	-81.2	99.1	158.2	-97.9	115.3	0	0	0	110	N71 K75	N71-L73 PolarHBondContact O-N 3.36Å; L73-K75 PolarHBondContact O-N 3.47Å; L73-K75 VanDerWaalsContact O-N 3.1Å
74	R	20.8	Very low	24.5	Very low	245 Å²	245	146.3 Å²	146.3	93%	0.925	80%	0.798	S	S	*	*			trans	-49.1	110.7	170.4	-84.3	175.5	168.9	169.8	-2.5	110.6	G72	G72-R74 PolarHBondContact O-N 3.17Å
75	K	21.2	Very low	25	Very low	199 Å²	199	146.2 Å²	146.2	87%	0.865	79%	0.792	S	S	*	*			trans	-62.4	130.5	165.2	-77.6	-179.2	177.9	174.5	0	109.2	L73 R77	L73-K75 PolarHBondContact O-N 3.47Å; L73-K75 VanDerWaalsContact O-N 3.1Å; K75-R77 PolarHBondContact O-N 2.88Å
76	P	21.9	Very low	25.8	Very low	119 Å²	119	141.7 Å²	141.7	77%	0.773	77%	0.774	S	S	*	*			trans	-67.4	126	-178.7	25.3	-30.2	0	0	0	110	R78	P76-R78 PolarHBondContact O-N 3.22Å
77	R	22.1	Very low	26.3	Very low	246 Å²	246	141.4 Å²	141.4	93%	0.928	77%	0.765	S	S	*	*			trans	-51.8	110.3	170	-110	175.3	167.7	155.4	-4.2	108.5	K75 K79	K75-R77 PolarHBondContact O-N 2.88Å; R77-K79 PolarHBondContact O-N 3.05Å
78	R	24.4	Very low	27	Very low	227 Å²	227	141.9 Å²	141.9	86%	0.857	75%	0.745	S	S	*	*			trans	-58.8	107.8	170.1	-81.5	-179.6	172.3	171.2	-2.7	108.1	P76 T80	P76-R78 PolarHBondContact O-N 3.22Å; R78-T80 HydrophobicContact CB-CG2 4.28Å; R78-T80 PolarHBondContact O-N 3.4Å
79	K	23.6	Very low	27.6	Very low	201 Å²	201	147.4 Å²	147.4	87%	0.874	75%	0.746	S	S	*	*			trans	-71.6	78.9	167.9	-75.1	-175.3	176.8	-180	0	108.8	R77	R77-K79 PolarHBondContact O-N 3.05Å
80	T	27.5	Very low	28.5	Very low	106 Å²	106	147.4 Å²	147.4	65%	0.65	73%	0.729	S	S	*	*			trans	-93.5	84.6	172.1	42.5	0	0	0	0	109.5	R78	R78-T80 HydrophobicContact CB-CG2 4.28Å; R78-T80 PolarHBondContact O-N 3.4Å
81	T	31.2	Very low	29.3	Very low	122 Å²	122	144.2 Å²	144.2	75%	0.748	70%	0.704	S	S	*	*	S	Bend	trans	-154.1	-11.2	169.2	23.9	0	0	0	0	118.3
82	H	29.3	Very low	30	Very low	140 Å²	140	139.5 Å²	139.5	65%	0.648	68%	0.682	S	S	*	*	S	Bend	trans	-127.1	-31.9	-177.3	-146.9	-105.4	0	0	0	116	L86	H82-L86 WeakPolarHBondContact ND1-CD1 3.42Å; H82-L86 PolarHBondContact O-N 3.24Å
83	S	30.2	Very low	30.8	Very low	73 Å²	73	142.9 Å²	142.9	51%	0.51	68%	0.675	S	S	.	*	H	α-helix	trans	-72.1	-35.3	-176.5	64.1	0	0	0	0	113.7	L86 K87	S83-L86 PolarHBondContact O-N 2.85Å; S83-K87 WeakPolarHBondContact O-CG 3.21Å; S83-K87 PolarHBondContact O-N 3.18Å
84	H	32	Very low	31.4	Very low	150 Å²	150	138.7 Å²	138.7	69%	0.694	66%	0.656	S	S	*	*	H	α-helix	trans	-68.4	-38.8	178.7	-96.2	-95.9	0	0	0	112.7	K87 L88	H84-K87 PolarHBondContact O-N 3.12Å; H84-L88 WeakPolarHBondContact O-CB 3.45Å; H84-L88 PolarHBondContact O-N 3.44Å
85	L	31.8	Very low	32.2	Very low	116 Å²	116	129.8 Å²	129.8	61%	0.607	63%	0.627	S	S	*	*	H	α-helix	trans	-67.3	-39.2	176.7	-87.7	162.4	0	0	0	111.9	L88 R89	L85-L88 PolarHBondContact O-N 3.14Å; L85-R89 WeakPolarHBondContact O-CB 3.07Å; L85-R89 PolarHBondContact O-N 3.17Å
86	L	36.6	Very low	33	Very low	94 Å²	94	122.9 Å²	122.9	49%	0.492	60%	0.599	S	S	.	*	H	α-helix	trans	-63.2	-46.5	173.1	-90.9	149.5	0	0	0	111.4	H82 S83 L88 R89 T90	H82-L86 WeakPolarHBondContact ND1-CD1 3.42Å; H82-L86 PolarHBondContact O-N 3.24Å; S83-L86 PolarHBondContact O-N 2.85Å; L86-L88 VanDerWaalsContact C-N 3.32Å; L86-L88 PolarHBondContact O-N 3.19Å; L86-R89 PolarHBondContact O-N 3.41Å; L86-T90 PolarHBondContact O-N 2.97Å; L86-T90 PolarHBondContact O-OG1 2.96Å
87	K	36	Very low	33.7	Very low	153 Å²	153	128.2 Å²	128.2	67%	0.665	60%	0.604	S	S	*	*	H	α-helix	trans	-58.3	-43.5	175.3	-76.9	-176.7	177	-175	0	111.8	S83 H84 R89 F91	S83-K87 WeakPolarHBondContact O-CG 3.21Å; S83-K87 PolarHBondContact O-N 3.18Å; H84-K87 PolarHBondContact O-N 3.12Å; K87-R89 VanDerWaalsContact C-N 3.35Å; K87-R89 PolarHBondContact O-N 3.37Å; K87-F91 WeakPolarHBondContact O-CB 3.46Å; K87-F91 PolarHBondContact O-N 3.47Å
88	L	36.3	Very low	34.4	Very low	99 Å²	99	125.5 Å²	125.5	52%	0.518	60%	0.599	S	S	.	*	H	α-helix	trans	-65.9	-35.7	178	-164.9	71.4	0	0	0	112.5	H84 L85 L86 F91 C92	H84-L88 WeakPolarHBondContact O-CB 3.45Å; H84-L88 PolarHBondContact O-N 3.44Å; L85-L88 PolarHBondContact O-N 3.14Å; L86-L88 VanDerWaalsContact C-N 3.32Å; L86-L88 PolarHBondContact O-N 3.19Å; L88-F91 HydrophobicContact CD1-CD1 4.11Å; L88-F91 WeakPolarHBondContact O-CB 3.26Å; L88-F91 PolarHBondContact O-N 2.84Å; L88-C92 PolarHBondContact O-N 3.12Å; L88-C92 PolarHBondContact O-SG 3.16Å
89	R	37	Very low	35	Very low	181 Å²	181	119.9 Å²	119.9	68%	0.683	59%	0.585	S	S	*	*	H	α-helix	trans	-73.7	-41.9	179.7	-159.1	173.8	-172.9	154.7	-0.1	112.1	L85 L86 K87 F91 K93	L85-R89 WeakPolarHBondContact O-CB 3.07Å; L85-R89 PolarHBondContact O-N 3.17Å; L86-R89 PolarHBondContact O-N 3.41Å; K87-R89 VanDerWaalsContact C-N 3.35Å; K87-R89 PolarHBondContact O-N 3.37Å; R89-F91 VanDerWaalsContact C-N 3.27Å; R89-K93 WeakPolarHBondContact O-CG 3.49Å; R89-K93 PolarHBondContact O-N 2.81Å; R89-K93 VanDerWaalsContact O-N 3.1Å
90	T	38.8	Very low	35.5	Very low	86 Å²	86	113.8 Å²	113.8	53%	0.528	58%	0.58	S	S	.	*	H	α-helix	trans	-64.9	-36.7	171.6	-41	0	0	0	0	110.4	L86 K93 T94	L86-T90 PolarHBondContact O-N 2.97Å; L86-T90 PolarHBondContact O-OG1 2.96Å; T90-K93 PolarHBondContact O-N 3.02Å; T90-T94 PolarHBondContact O-N 3.39Å; T90-T94 PolarHBondContact O-OG1 3.11Å
91	F	44.7	Very low	35.9	Very low	75 Å²	75	115.3 Å²	115.3	33%	0.329	58%	0.579	S	S	.	*	H	α-helix	trans	-62.7	-49.9	174.7	174.9	-105.3	0	0	0	112.5	K87 L88 R89 K93 T94 L95 I136	K87-F91 WeakPolarHBondContact O-CB 3.46Å; K87-F91 PolarHBondContact O-N 3.47Å; L88-F91 HydrophobicContact CD1-CD1 4.11Å; L88-F91 WeakPolarHBondContact O-CB 3.26Å; L88-F91 PolarHBondContact O-N 2.84Å; R89-F91 VanDerWaalsContact C-N 3.27Å; F91-K93 VanDerWaalsContact C-N 3.3Å; F91-K93 PolarHBondContact O-N 2.95Å; F91-T94 PolarHBondContact O-N 3.4Å; F91-T94 VanDerWaalsContact O-N 3.08Å; F91-L95 HydrophobicContact CE2-CD1 4.33Å; F91-L95 HydrophobicContact CZ-CD1 3.99Å; F91-L95 WeakPolarHBondContact O-CB 3.35Å; F91-L95 PolarHBondContact O-N 3.21Å; F91-I136 HydrophobicContact CD2-CD1 4.11Å; F91-I136 HydrophobicContact CE2-CD1 3.28Å; F91-I136 HydrophobicContact CE2-CG1 4.16Å; F91-I136 HydrophobicContact CE2-CG2 4.22Å; F91-I136 HydrophobicContact CZ-CD1 3.68Å; F91-I136 HydrophobicContact CZ-CG1 4.19Å; F91-I136 HydrophobicContact CZ-CG2 4.27Å
92	C	38.8	Very low	36.2	Very low	50 Å²	50	117.5 Å²	117.5	34%	0.338	59%	0.587	S	S	.	*	H	α-helix	trans	-62	-37.6	176.3	-67	0	0	0	0	112.1	L88 T94 L95 N96	L88-C92 PolarHBondContact O-N 3.12Å; L88-C92 PolarHBondContact O-SG 3.16Å; C92-T94 VanDerWaalsContact C-N 3.33Å; C92-L95 PolarHBondContact O-N 2.57Å; C92-N96 WeakPolarHBondContact O-CB 3.32Å; C92-N96 PolarHBondContact O-N 2.77Å
93	K	38.9	Very low	36.4	Very low	150 Å²	150	114.6 Å²	114.6	65%	0.652	58%	0.576	S	S	*	*	H	α-helix	trans	-63.9	-38	173.9	-79.7	-175	174.6	-174.5	0	112.3	R89 T90 F91 R97	R89-K93 WeakPolarHBondContact O-CG 3.49Å; R89-K93 PolarHBondContact O-N 2.81Å; R89-K93 VanDerWaalsContact O-N 3.1Å; T90-K93 PolarHBondContact O-N 3.02Å; F91-K93 VanDerWaalsContact C-N 3.3Å; F91-K93 PolarHBondContact O-N 2.95Å; K93-R97 PolarHBondContact O-N 2.97Å; K93-R97 VanDerWaalsContact O-N 3.14Å
94	T	37.2	Very low	36.7	Very low	80 Å²	80	115 Å²	115	49%	0.491	58%	0.576	S	S	.	*	H	α-helix	trans	-71.2	-42	178.2	-51.2	0	0	0	0	110.8	T90 F91 C92 R97 F98	T90-T94 PolarHBondContact O-N 3.39Å; T90-T94 PolarHBondContact O-OG1 3.11Å; F91-T94 PolarHBondContact O-N 3.4Å; F91-T94 VanDerWaalsContact O-N 3.08Å; C92-T94 VanDerWaalsContact C-N 3.33Å; T94-R97 WeakPolarHBondContact O-CB 3.5Å; T94-R97 PolarHBondContact O-N 3.47Å; T94-F98 PolarHBondContact O-N 2.76Å; T94-F98 VanDerWaalsContact O-N 3.12Å
95	L	36.8	Very low	36.9	Very low	59 Å²	59	112.9 Å²	112.9	31%	0.309	57%	0.569	S	S	.	*	H	α-helix	trans	-61.2	-44.6	176.2	-153.2	95.1	0	0	0	111.7	F91 C92 R97 F98 L99	F91-L95 HydrophobicContact CE2-CD1 4.33Å; F91-L95 HydrophobicContact CZ-CD1 3.99Å; F91-L95 WeakPolarHBondContact O-CB 3.35Å; F91-L95 PolarHBondContact O-N 3.21Å; C92-L95 PolarHBondContact O-N 2.57Å; L95-R97 VanDerWaalsContact C-N 3.32Å; L95-R97 PolarHBondContact O-N 2.66Å; L95-F98 PolarHBondContact O-N 3.42Å; L95-L99 HydrophobicContact CD2-CD1 3.9Å; L95-L99 HydrophobicContact CG-CD1 3.92Å; L95-L99 PolarHBondContact O-N 2.84Å
96	N	37.8	Very low	37	Very low	54 Å²	54	116.1 Å²	116.1	29%	0.289	58%	0.579	S	S	.	*	H	α-helix	trans	-64.9	-34.3	175.4	-94.1	2.9	0	0	0	112.8	C92 F98	C92-N96 WeakPolarHBondContact O-CB 3.32Å; C92-N96 PolarHBondContact O-N 2.77Å; N96-F98 VanDerWaalsContact C-N 3.27Å; N96-F98 PolarHBondContact O-N 3.44Å
97	R	37.3	Very low	36.8	Very low	231 Å²	231	117.7 Å²	117.7	87%	0.872	58%	0.584	S	S	*	*	H	α-helix	trans	-65.6	-33	174.6	-112.9	-178.8	180	172.1	-1	112.2	K93 T94 L95	K93-R97 PolarHBondContact O-N 2.97Å; K93-R97 VanDerWaalsContact O-N 3.14Å; T94-R97 WeakPolarHBondContact O-CB 3.5Å; T94-R97 PolarHBondContact O-N 3.47Å; L95-R97 VanDerWaalsContact C-N 3.32Å; L95-R97 PolarHBondContact O-N 2.66Å
98	F	36.6	Very low	36.7	Very low	188 Å²	188	114.6 Å²	114.6	83%	0.825	57%	0.574	S	S	*	*	H	α-helix	trans	-87	-35.8	-175.6	-127.5	-84.7	0	0	0	113.4	T94 L95 N96 G100	T94-F98 PolarHBondContact O-N 2.76Å; T94-F98 VanDerWaalsContact O-N 3.12Å; L95-F98 PolarHBondContact O-N 3.42Å; N96-F98 VanDerWaalsContact C-N 3.27Å; N96-F98 PolarHBondContact O-N 3.44Å; F98-G100 VanDerWaalsContact C-N 3.29Å; F98-G100 PolarHBondContact O-N 2.81Å
99	L	36.6	Very low	36.4	Very low	109 Å²	109	113.4 Å²	113.4	57%	0.571	57%	0.571	S	S	*	*	S	Bend	trans	-82.4	-0.2	-175	-72.5	172.3	0	0	0	114.4	L95 Q101	L95-L99 HydrophobicContact CD2-CD1 3.9Å; L95-L99 HydrophobicContact CG-CD1 3.92Å; L95-L99 PolarHBondContact O-N 2.84Å; L99-Q101 WeakPolarHBondContact O-CG 3.1Å; L99-Q101 PolarHBondContact O-N 2.69Å
100	G	33.8	Very low	36.1	Very low	73 Å²	73	111.4 Å²	111.4	75%	0.753	57%	0.569	S	S	*	*			trans	60.5	-0.8	170.8	0	0	0	0	0	116	F98	F98-G100 VanDerWaalsContact C-N 3.29Å; F98-G100 PolarHBondContact O-N 2.81Å
101	Q	36.2	Very low	35.7	Very low	138 Å²	138	109.5 Å²	109.5	65%	0.645	56%	0.562	S	S	*	*			trans	-105.2	117.1	-177.1	-70	-172.7	2.4	0	0	108.9	L99 L103	L99-Q101 WeakPolarHBondContact O-CG 3.1Å; L99-Q101 PolarHBondContact O-N 2.69Å; Q101-L103 PolarHBondContact O-N 3.32Å
102	N	37.3	Very low	35	Very low	169 Å²	169	114.7 Å²	114.7	90%	0.904	58%	0.58	S	S	*	*			trans	-65.9	56.6	171.2	-82.6	-33.3	0	0	0	111.2	P104	N102-P104 VanDerWaalsContact O-CD 3.26Å; N102-P104 WeakPolarHBondContact O-CD 3.25Å
103	L	33.4	Very low	34.6	Very low	79 Å²	79	119.1 Å²	119.1	41%	0.414	59%	0.594	S	S	.	*			trans	-72.5	118	174	-134.8	82.2	0	0	0	108.2	Q101 L105	Q101-L103 PolarHBondContact O-N 3.32Å; L103-L105 PolarHBondContact O-N 2.88Å
104	P	36.8	Very low	34.1	Very low	81 Å²	81	114.8 Å²	114.8	53%	0.526	58%	0.582	S	S	.	*			trans	-61.7	124.6	-176.6	-19.6	31	0	0	0	110.3	N102 K106 Q107	N102-P104 VanDerWaalsContact O-CD 3.26Å; N102-P104 WeakPolarHBondContact O-CD 3.25Å; P104-K106 PolarHBondContact O-N 3.37Å; P104-Q107 PolarHBondContact O-N 3.17Å
105	L	35.8	Very low	33.6	Very low	105 Å²	105	117.9 Å²	117.9	55%	0.55	59%	0.591	S	S	.	*	H	α-helix	trans	-49.3	-22.5	-177.9	-158.7	78.2	0	0	0	114	L103 T109	L103-L105 PolarHBondContact O-N 2.88Å; L105-T109 PolarHBondContact O-N 3.21Å; L105-T109 PolarHBondContact O-OG1 3.25Å
106	K	33.7	Very low	33.2	Very low	185 Å²	185	119 Å²	119	80%	0.804	60%	0.604	S	S	*	*	H	α-helix	trans	-63.6	-36.2	175	-81.3	-175.5	174.2	179.8	0	113	P104 H110	P104-K106 PolarHBondContact O-N 3.37Å; K106-H110 WeakPolarHBondContact O-CB 3.42Å; K106-H110 PolarHBondContact O-N 2.86Å
107	Q	33.9	Very low	32.7	Very low	127 Å²	127	120.5 Å²	120.5	59%	0.593	62%	0.624	S	S	*	*	H	α-helix	trans	-73.7	-37.5	-179.5	-86.8	-177.2	-17.5	0	0	112.9	P104 T109 H110 A111	P104-Q107 PolarHBondContact O-N 3.17Å; Q107-T109 VanDerWaalsContact C-N 3.34Å; Q107-T109 PolarHBondContact O-N 3.3Å; Q107-H110 PolarHBondContact O-N 3.1Å; Q107-A111 VanDerWaalsContact O-CB 3.27Å; Q107-A111 WeakPolarHBondContact O-CB 3.5Å; Q107-A111 PolarHBondContact O-N 3.43Å
108	L	32.9	Very low	32.1	Very low	88 Å²	88	113.3 Å²	113.3	46%	0.461	61%	0.609	S	S	.	*	H	α-helix	trans	-65.1	-39.1	175	-87.6	158.3	0	0	0	112.1	H110 A111 Y112	L108-H110 VanDerWaalsContact C-N 3.33Å; L108-A111 PolarHBondContact O-N 3.35Å; L108-Y112 WeakPolarHBondContact O-CB 3.37Å; L108-Y112 PolarHBondContact O-N 3.39Å
109	T	30.4	Very low	31.5	Very low	74 Å²	74	111 Å²	111	45%	0.454	61%	0.605	S	S	.	*	H	α-helix	trans	-68.8	-35.6	176.9	-38.6	0	0	0	0	111.1	L105 Q107 K113	L105-T109 PolarHBondContact O-N 3.21Å; L105-T109 PolarHBondContact O-OG1 3.25Å; Q107-T109 VanDerWaalsContact C-N 3.34Å; Q107-T109 PolarHBondContact O-N 3.3Å; T109-K113 WeakPolarHBondContact O-CB 3.27Å; T109-K113 WeakPolarHBondContact O-CG 3.4Å; T109-K113 PolarHBondContact O-N 3.22Å
110	H	30.4	Very low	31.1	Very low	138 Å²	138	113.2 Å²	113.2	64%	0.639	62%	0.617	S	S	*	*	H	α-helix	trans	-74.8	-36.4	176.2	-140.9	-83.8	0	0	0	112.4	K106 Q107 L108 Y112 K113 S114	K106-H110 WeakPolarHBondContact O-CB 3.42Å; K106-H110 PolarHBondContact O-N 2.86Å; Q107-H110 PolarHBondContact O-N 3.1Å; L108-H110 VanDerWaalsContact C-N 3.33Å; H110-Y112 VanDerWaalsContact C-N 3.34Å; H110-K113 PolarHBondContact O-N 2.95Å; H110-S114 WeakPolarHBondContact O-CB 3.43Å; H110-S114 PolarHBondContact O-N 3.49Å; H110-S114 PolarHBondContact O-OG 2.97Å
111	A	30	Very low	30.7	Very low	46 Å²	46	118.2 Å²	118.2	38%	0.38	62%	0.621	S	S	.	*	H	α-helix	trans	-62.5	-42.4	173.2	0	0	0	0	0	110.5	Q107 L108 S114 H115	Q107-A111 VanDerWaalsContact O-CB 3.27Å; Q107-A111 WeakPolarHBondContact O-CB 3.5Å; Q107-A111 PolarHBondContact O-N 3.43Å; L108-A111 PolarHBondContact O-N 3.35Å; A111-S114 WeakPolarHBondContact CA-OG 3.28Å; A111-S114 PolarHBondContact O-OG 3.29Å; A111-S114 VanDerWaalsContact O-OG 3.11Å; A111-H115 WeakPolarHBondContact O-CB 3.39Å; A111-H115 PolarHBondContact O-N 3.44Å
112	Y	31.1	Very low	30.1	Very low	184 Å²	184	120.3 Å²	120.3	72%	0.722	64%	0.636	S	S	*	*	H	α-helix	trans	-70.9	-41.3	175.7	-165.4	-91.9	0	0	0	112.8	L108 H110 H115 S116	L108-Y112 WeakPolarHBondContact O-CB 3.37Å; L108-Y112 PolarHBondContact O-N 3.39Å; H110-Y112 VanDerWaalsContact C-N 3.34Å; Y112-H115 PolarHBondContact O-N 2.99Å; Y112-S116 WeakPolarHBondContact O-CB 3.42Å; Y112-S116 PolarHBondContact O-N 3.16Å
113	K	29	Very low	29.4	Very low	144 Å²	144	116 Å²	116	63%	0.626	62%	0.624	S	S	*	*	H	α-helix	trans	-68.4	-37	176.9	-80.4	-173.4	174.1	-172.9	0	112.8	T109 H110 S116 A117	T109-K113 WeakPolarHBondContact O-CB 3.27Å; T109-K113 WeakPolarHBondContact O-CG 3.4Å; T109-K113 PolarHBondContact O-N 3.22Å; H110-K113 PolarHBondContact O-N 2.95Å; K113-S116 PolarHBondContact O-N 3.33Å; K113-A117 WeakPolarHBondContact O-CB 3.37Å; K113-A117 PolarHBondContact O-N 2.84Å
114	S	29.1	Very low	28.9	Very low	58 Å²	58	117.7 Å²	117.7	41%	0.406	64%	0.642	S	S	.	*	H	α-helix	trans	-70.6	-34.5	173.9	56.1	0	0	0	0	111.9	H110 A111 A117 S118	H110-S114 WeakPolarHBondContact O-CB 3.43Å; H110-S114 PolarHBondContact O-N 3.49Å; H110-S114 PolarHBondContact O-OG 2.97Å; A111-S114 WeakPolarHBondContact CA-OG 3.28Å; A111-S114 PolarHBondContact O-OG 3.29Å; A111-S114 VanDerWaalsContact O-OG 3.11Å; S114-A117 PolarHBondContact O-N 2.89Å; S114-S118 PolarHBondContact O-N 3.41Å; S114-S118 PolarHBondContact O-OG 3.33Å
115	H	27.2	Very low	28.2	Very low	145 Å²	145	120.5 Å²	120.5	67%	0.671	66%	0.658	S	S	*	*	H	α-helix	trans	-69	-33.9	170.9	-104.1	-67.4	0	0	0	113.6	A111 Y112 A117	A111-H115 WeakPolarHBondContact O-CB 3.39Å; A111-H115 PolarHBondContact O-N 3.44Å; Y112-H115 PolarHBondContact O-N 2.99Å; H115-A117 VanDerWaalsContact C-N 3.34Å
116	S	27.2	Very low	27.7	Very low	84 Å²	84	120.4 Å²	120.4	59%	0.587	67%	0.666	S	S	*	*	H	α-helix	trans	-75.7	-22.2	175.5	-177.4	0	0	0	0	113.3	Y112 K113	Y112-S116 WeakPolarHBondContact O-CB 3.42Å; Y112-S116 PolarHBondContact O-N 3.16Å; K113-S116 PolarHBondContact O-N 3.33Å
117	A	27.1	Very low	27.4	Very low	85 Å²	85	120 Å²	120	70%	0.702	67%	0.667	S	S	*	*	H	α-helix	trans	-91.8	-21.1	-178.4	0	0	0	0	0	113.4	K113 S114 H115 N119	K113-A117 WeakPolarHBondContact O-CB 3.37Å; K113-A117 PolarHBondContact O-N 2.84Å; S114-A117 PolarHBondContact O-N 2.89Å; H115-A117 VanDerWaalsContact C-N 3.34Å; A117-N119 PolarHBondContact O-N 3Å; A117-N119 VanDerWaalsContact O-N 3.11Å
118	S	25.6	Very low	27.2	Very low	79 Å²	79	120.8 Å²	120.8	55%	0.552	67%	0.673	S	S	*	*			trans	-87.8	49.3	178	49.7	0	0	0	0	112	S114 N120	S114-S118 PolarHBondContact O-N 3.41Å; S114-S118 PolarHBondContact O-OG 3.33Å; S118-N120 VanDerWaalsContact C-N 3.33Å; S118-N120 PolarHBondContact O-N 3.08Å
119	N	25	Very low	27.1	Very low	139 Å²	139	120.7 Å²	120.7	74%	0.743	68%	0.68	S	S	*	*			trans	-90.6	14.9	-173.6	-135	21.2	0	0	0	114.4	A117	A117-N119 PolarHBondContact O-N 3Å; A117-N119 VanDerWaalsContact O-N 3.11Å
120	N	27.1	Very low	27.3	Very low	156 Å²	156	123 Å²	123	83%	0.834	69%	0.688	S	S	*	*	S	Bend	trans	-116.6	-17.8	-172.4	-91.7	3.2	0	0	0	117.7	S118	S118-N120 VanDerWaalsContact C-N 3.33Å; S118-N120 PolarHBondContact O-N 3.08Å
121	Q	26.4	Very low	27.6	Very low	179 Å²	179	125.5 Å²	125.5	84%	0.836	69%	0.692	S	S	*	*	S	Bend	trans	-156.3	85.7	179.8	-65.4	-174.4	1.8	0	0	111.4
122	L	22.4	Very low	28.3	Very low	181 Å²	181	129 Å²	129	95%	0.948	71%	0.714	S	S	*	*			trans	-159.8	139.6	148.2	-133.6	79.7	0	0	0	111.5
123	A	22.5	Very low	28.9	Very low	80 Å²	80	128.4 Å²	128.4	66%	0.661	72%	0.717	S	S	*	*			trans	-60.3	132.7	-168.5	0	0	0	0	0	114.4	V125	A123-V125 PolarHBondContact O-N 3.27Å; A123-V125 VanDerWaalsContact O-N 3.09Å
124	S	22.4	Very low	29.6	Very low	113 Å²	113	124.5 Å²	124.5	79%	0.79	70%	0.703	S	S	*	*			trans	14.8	78.9	151.5	64.1	0	0	0	0	117.4	S126	S124-S126 PolarHBondContact O-N 3.24Å
125	V	24.1	Very low	30.8	Very low	140 Å²	140	124.5 Å²	124.5	85%	0.848	70%	0.703	S	S	*	*			trans	-86.2	95.6	159	-179	0	0	0	0	107.1	A123 H127	A123-V125 PolarHBondContact O-N 3.27Å; A123-V125 VanDerWaalsContact O-N 3.09Å; V125-H127 PolarHBondContact O-N 2.99Å
126	S	24.7	Very low	32.1	Very low	103 Å²	103	121.7 Å²	121.7	72%	0.72	69%	0.692	S	S	*	*			trans	-63	111.3	176.7	52.2	0	0	0	0	111.2	S124	S124-S126 PolarHBondContact O-N 3.24Å
127	H	26.7	Very low	33.5	Very low	178 Å²	178	121.8 Å²	121.8	82%	0.824	69%	0.689	S	S	*	*			trans	31.8	94.8	149.7	-67.3	-90.1	0	0	0	118.1	V125 S129	V125-H127 PolarHBondContact O-N 2.99Å; H127-S129 PolarHBondContact O-N 3.33Å; H127-S129 VanDerWaalsContact O-N 3.15Å
128	I	29.9	Very low	35	Very low	142 Å²	142	119.7 Å²	119.7	73%	0.728	67%	0.666	S	S	*	*			trans	-70.1	100.5	143.9	-63.2	169.3	0	0	0	105.7	I130	I128-I130 VanDerWaalsContact C-N 3.29Å; I128-I130 HydrophobicContact CG2-CG1 3.9Å; I128-I130 PolarHBondContact O-N 2.75Å
129	S	30.8	Very low	36.7	Very low	86 Å²	86	120 Å²	120	60%	0.601	66%	0.661	S	S	*	*			trans	-71.7	87.4	171.7	166.7	0	0	0	0	108.8	H127 R131	H127-S129 PolarHBondContact O-N 3.33Å; H127-S129 VanDerWaalsContact O-N 3.15Å; S129-R131 PolarHBondContact O-N 2.66Å; S129-R131 VanDerWaalsContact O-N 3.13Å
130	I	33.6	Very low	38.5	Very low	123 Å²	123	117.4 Å²	117.4	63%	0.631	65%	0.647	S	S	*	*			trans	-66	107.8	171.3	-57.6	171.6	0	0	0	107.1	I128	I128-I130 VanDerWaalsContact C-N 3.29Å; I128-I130 HydrophobicContact CG2-CG1 3.9Å; I128-I130 PolarHBondContact O-N 2.75Å
131	R	37.7	Very low	40.3	Very low	191 Å²	191	115.7 Å²	115.7	72%	0.721	63%	0.634	S	S	*	*			trans	-65.4	138.9	167.3	-82.2	-176.7	175.3	-171.8	-0.5	107.2	S129 H133 D134	S129-R131 PolarHBondContact O-N 2.66Å; S129-R131 VanDerWaalsContact O-N 3.13Å; R131-H133 PolarHBondContact O-N 2.87Å; R131-D134 PolarHBondContact O-N 2.9Å
132	S	45.4	Very low	42.2	Very low	119 Å²	119	109.4 Å²	109.4	83%	0.832	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	3.5	-174.1	57.1	0	0	0	0	115.4
133	H	42.5	Very low	44.5	Very low	172 Å²	172	104.1 Å²	104.1	80%	0.796	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	-2.2	-176.6	-90.2	-83	0	0	0	114.8	R131 S135	R131-H133 PolarHBondContact O-N 2.87Å; H133-S135 PolarHBondContact O-N 3.43Å; H133-S135 VanDerWaalsContact O-N 3.1Å
134	D	43.6	Very low	47	Very low	61 Å²	61	105.4 Å²	105.4	33%	0.326	58%	0.581	S	S	.	*			trans	-71.5	112.4	179	-62.9	-14.1	0	0	0	108.7	R131 I139	R131-D134 PolarHBondContact O-N 2.9Å; D134-I139 HydrophobicContact CB-CG1 4.33Å
135	S	55.3	Low	49.8	Very low	59 Å²	59	101.1 Å²	101.1	41%	0.413	55%	0.548	S	S	.	.			trans	-66.5	152.4	174.4	59.7	0	0	0	0	109.6	H133 T137 D138 I139	H133-S135 PolarHBondContact O-N 3.43Å; H133-S135 VanDerWaalsContact O-N 3.1Å; S135-T137 PolarHBondContact O-N 2.82Å; S135-T137 VanDerWaalsContact O-N 3.14Å; S135-T137 PolarHBondContact OG-OG1 3.3Å; S135-D138 WeakPolarHBondContact O-CB 3.49Å; S135-D138 PolarHBondContact O-N 2.92Å; S135-D138 PolarHBondContact OG-N 2.96Å; S135-I139 PolarHBondContact O-N 3.1Å; S135-I139 VanDerWaalsContact O-N 3.11Å
136	I	53	Low	52.8	Low	85 Å²	85	95 Å²	95	44%	0.436	51%	0.51	S	S	.	.	H	α-helix	trans	-55.8	-32	173.7	-71.9	144.9	0	0	0	111.2	F91 I139 L140	F91-I136 HydrophobicContact CD2-CD1 4.11Å; F91-I136 HydrophobicContact CE2-CD1 3.28Å; F91-I136 HydrophobicContact CE2-CG1 4.16Å; F91-I136 HydrophobicContact CE2-CG2 4.22Å; F91-I136 HydrophobicContact CZ-CD1 3.68Å; F91-I136 HydrophobicContact CZ-CG1 4.19Å; F91-I136 HydrophobicContact CZ-CG2 4.27Å; I136-I139 PolarHBondContact O-N 3.41Å; I136-L140 HydrophobicContact CG2-CD1 3.81Å; I136-L140 HydrophobicContact CG2-CG 4.19Å; I136-L140 WeakPolarHBondContact O-CB 3.45Å; I136-L140 VanDerWaalsContact O-CG 3.27Å; I136-L140 WeakPolarHBondContact O-CG 3.45Å; I136-L140 PolarHBondContact O-N 3.46Å
137	T	56.6	Low	55.8	Low	87 Å²	87	92.8 Å²	92.8	53%	0.534	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-44.1	174.5	56.8	0	0	0	0	111.5	S135 I139 L140 E141	S135-T137 PolarHBondContact O-N 2.82Å; S135-T137 VanDerWaalsContact O-N 3.14Å; S135-T137 PolarHBondContact OG-OG1 3.3Å; T137-I139 PolarHBondContact O-N 3.36Å; T137-L140 PolarHBondContact O-N 3.43Å; T137-E141 WeakPolarHBondContact O-CB 3.35Å; T137-E141 VanDerWaalsContact O-CG 3.31Å; T137-E141 WeakPolarHBondContact O-CG 3.41Å; T137-E141 PolarHBondContact O-N 2.79Å
138	D	59	Low	58.7	Low	41 Å²	41	84.6 Å²	84.6	22%	0.219	46%	0.457	C	S	.	.	H	α-helix	trans	-67.2	-38.7	-179.9	-168.8	35.7	0	0	0	111.4	S135 K142	S135-D138 WeakPolarHBondContact O-CB 3.49Å; S135-D138 PolarHBondContact O-N 2.92Å; S135-D138 PolarHBondContact OG-N 2.96Å; D138-K142 VanDerWaalsContact O-CB 3.25Å; D138-K142 WeakPolarHBondContact O-CB 3.47Å; D138-K142 WeakPolarHBondContact O-CD 3.45Å; D138-K142 WeakPolarHBondContact O-CG 3.33Å; D138-K142 PolarHBondContact O-N 2.89Å; D138-K142 IonicContact OD1-NZ 3.93Å; D138-K142 IonicContact OD2-NZ 2.97Å; D138-K142 PolarHBondContact OD2-NZ 3.36Å
139	I	61.4	Low	61.6	Low	84 Å²	84	77.9 Å²	77.9	43%	0.431	42%	0.422	S	S	.	.	H	α-helix	trans	-64.3	-46	173.8	-60.8	172.2	0	0	0	111.2	D134 S135 I136 T137 K142 S143	D134-I139 HydrophobicContact CB-CG1 4.33Å; S135-I139 PolarHBondContact O-N 3.1Å; S135-I139 VanDerWaalsContact O-N 3.11Å; I136-I139 PolarHBondContact O-N 3.41Å; T137-I139 PolarHBondContact O-N 3.36Å; I139-K142 PolarHBondContact O-N 3.02Å; I139-S143 PolarHBondContact O-N 3.34Å
140	L	63	Low	64.5	Low	86 Å²	86	75.3 Å²	75.3	45%	0.45	40%	0.401	S	S	.	.	H	α-helix	trans	-65	-42.6	178.9	-73.3	173.2	0	0	0	110.9	I136 T137 S143 V144	I136-L140 HydrophobicContact CG2-CD1 3.81Å; I136-L140 HydrophobicContact CG2-CG 4.19Å; I136-L140 WeakPolarHBondContact O-CB 3.45Å; I136-L140 VanDerWaalsContact O-CG 3.27Å; I136-L140 WeakPolarHBondContact O-CG 3.45Å; I136-L140 PolarHBondContact O-N 3.46Å; T137-L140 PolarHBondContact O-N 3.43Å; L140-S143 PolarHBondContact O-N 3.09Å; L140-S143 PolarHBondContact O-OG 3.11Å; L140-V144 WeakPolarHBondContact O-CG2 3.22Å; L140-V144 PolarHBondContact O-N 3.05Å
141	E	65.5	Low	67.2	Low	120 Å²	120	76.6 Å²	76.6	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-60.5	-48.4	174.9	-77.4	175.3	-171.7	0	0	111.3	T137 S143 V144 Y145	T137-E141 WeakPolarHBondContact O-CB 3.35Å; T137-E141 VanDerWaalsContact O-CG 3.31Å; T137-E141 WeakPolarHBondContact O-CG 3.41Å; T137-E141 PolarHBondContact O-N 2.79Å; E141-S143 VanDerWaalsContact C-N 3.26Å; E141-S143 PolarHBondContact O-N 3.42Å; E141-V144 PolarHBondContact O-N 3.28Å; E141-Y145 WeakPolarHBondContact O-CD1 3.42Å; E141-Y145 PolarHBondContact O-N 3.07Å
142	K	66.7	Low	69.6	Low	47 Å²	47	68 Å²	68	20%	0.204	37%	0.368	C	S	.	.	H	α-helix	trans	-53.5	-40.2	173.4	-84.3	161.3	-178.9	166.9	0	113.1	D138 I139 V144 Y145 I146	D138-K142 VanDerWaalsContact O-CB 3.25Å; D138-K142 WeakPolarHBondContact O-CB 3.47Å; D138-K142 WeakPolarHBondContact O-CD 3.45Å; D138-K142 WeakPolarHBondContact O-CG 3.33Å; D138-K142 PolarHBondContact O-N 2.89Å; D138-K142 IonicContact OD1-NZ 3.93Å; D138-K142 IonicContact OD2-NZ 2.97Å; D138-K142 PolarHBondContact OD2-NZ 3.36Å; I139-K142 PolarHBondContact O-N 3.02Å; K142-V144 VanDerWaalsContact C-N 3.26Å; K142-V144 PolarHBondContact O-N 2.97Å; K142-Y145 HydrophobicContact CB-CE1 4.2Å; K142-Y145 HydrophobicContact CG-CE1 3.76Å; K142-Y145 WeakPolarHBondContact CG-OH 3.29Å; K142-I146 WeakPolarHBondContact O-CD1 3.46Å; K142-I146 VanDerWaalsContact O-CG1 3.29Å; K142-I146 WeakPolarHBondContact O-CG1 3.31Å
143	S	70.1	Confident	71.9	Confident	70 Å²	70	63.7 Å²	63.7	49%	0.49	33%	0.333	S	S	.	.	H	α-helix	trans	-66.6	-26.4	-179.8	77.7	0	0	0	0	113.6	I139 L140 E141 P147	I139-S143 PolarHBondContact O-N 3.34Å; L140-S143 PolarHBondContact O-N 3.09Å; L140-S143 PolarHBondContact O-OG 3.11Å; E141-S143 VanDerWaalsContact C-N 3.26Å; E141-S143 PolarHBondContact O-N 3.42Å; S143-P147 VanDerWaalsContact O-CD 3.28Å; S143-P147 WeakPolarHBondContact O-CD 3.32Å
144	V	75	Confident	74.1	Confident	106 Å²	106	63.5 Å²	63.5	64%	0.642	33%	0.33	S	S	*	.	H	α-helix	trans	-88.4	-43.4	-176.7	176.9	0	0	0	0	111.9	L140 E141 K142	L140-V144 WeakPolarHBondContact O-CG2 3.22Å; L140-V144 PolarHBondContact O-N 3.05Å; E141-V144 PolarHBondContact O-N 3.28Å; K142-V144 VanDerWaalsContact C-N 3.26Å; K142-V144 PolarHBondContact O-N 2.97Å
145	Y	81.4	Confident	76.4	Confident	24 Å²	24	68 Å²	68	9%	0.094	35%	0.349	C	S	.	.	H	α-helix	trans	-80.5	-28.7	-171.8	68.7	-117	0	0	0	114	E141 K142 A148 F149 F199	E141-Y145 WeakPolarHBondContact O-CD1 3.42Å; E141-Y145 PolarHBondContact O-N 3.07Å; K142-Y145 HydrophobicContact CB-CE1 4.2Å; K142-Y145 HydrophobicContact CG-CE1 3.76Å; K142-Y145 WeakPolarHBondContact CG-OH 3.29Å; Y145-A148 WeakPolarHBondContact O-CB 3.24Å; Y145-A148 PolarHBondContact O-N 2.83Å; Y145-F149 WeakPolarHBondContact O-CB 3.41Å; Y145-F149 PolarHBondContact O-N 3.41Å; Y145-F199 AromaticContact CD2-CE2 3.57Å; Y145-F199 HydrophobicContact CD2-CE2 3.57Å; Y145-F199 AromaticContact CD2-CZ 3.72Å; Y145-F199 HydrophobicContact CD2-CZ 3.72Å; Y145-F199 HydrophobicContact CE2-CD2 4.26Å; Y145-F199 AromaticContact CE2-CE2 3.18Å; Y145-F199 HydrophobicContact CE2-CE2 3.18Å; Y145-F199 AromaticContact CE2-CZ 3.39Å; Y145-F199 HydrophobicContact CE2-CZ 3.39Å; Y145-F199 AromaticContact CZ-CE2 3.98Å
146	I	86.8	Confident	78.1	Confident	10 Å²	10	69.8 Å²	69.8	5%	0.051	35%	0.351	C	S	.	.	H	α-helix	trans	-64	-46.5	-177.7	-62.2	173.2	0	0	0	111.9	K142 A148 F149 L150 P192 L195 A196	K142-I146 WeakPolarHBondContact O-CD1 3.46Å; K142-I146 VanDerWaalsContact O-CG1 3.29Å; K142-I146 WeakPolarHBondContact O-CG1 3.31Å; I146-A148 VanDerWaalsContact C-N 3.28Å; I146-A148 PolarHBondContact O-N 2.77Å; I146-F149 PolarHBondContact O-N 2.71Å; I146-L150 HydrophobicContact CG2-CD1 4.21Å; I146-L150 WeakPolarHBondContact O-CG 3.42Å; I146-L150 PolarHBondContact O-N 2.89Å; I146-P192 HydrophobicContact CD1-CB 4.38Å; I146-P192 WeakPolarHBondContact CD1-O 3.47Å; I146-P192 HydrophobicContact CG2-CB 4.05Å; I146-L195 HydrophobicContact CG2-CB 4.32Å; I146-L195 HydrophobicContact CG2-CD1 3.97Å; I146-A196 HydrophobicContact CD1-CB 3.76Å
147	P	86.9	Confident	80.1	Confident	58 Å²	58	70.6 Å²	70.6	38%	0.377	36%	0.362	S	S	.	.	H	α-helix	trans	-60.9	-37.2	172.7	-23.7	34.4	0	0	0	112.9	S143 L150 R151	S143-P147 VanDerWaalsContact O-CD 3.28Å; S143-P147 WeakPolarHBondContact O-CD 3.32Å; P147-L150 PolarHBondContact O-N 3.1Å; P147-R151 WeakPolarHBondContact O-CG 3.28Å; P147-R151 PolarHBondContact O-N 2.91Å
148	A	87.6	Confident	81.9	Confident	6 Å²	6	71.1 Å²	71.1	5%	0.05	36%	0.355	C	S	.	.	H	α-helix	trans	-65	-46.4	177.7	0	0	0	0	0	111.6	Y145 I146 R151 A152 Y202 N204	Y145-A148 WeakPolarHBondContact O-CB 3.24Å; Y145-A148 PolarHBondContact O-N 2.83Å; I146-A148 VanDerWaalsContact C-N 3.28Å; I146-A148 PolarHBondContact O-N 2.77Å; A148-R151 PolarHBondContact O-N 2.65Å; A148-A152 PolarHBondContact O-N 3.11Å; A148-Y202 HydrophobicContact CB-CE1 4.14Å; A148-N204 HydrophobicContact CB-CB 4.41Å
149	F	91.4	Very high	83.6	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-57.7	-47.6	172.7	165.7	-105.4	0	0	0	112.1	Y145 I146 R151 A152 R153 W172 L195 F199 Y202 L209	Y145-F149 WeakPolarHBondContact O-CB 3.41Å; Y145-F149 PolarHBondContact O-N 3.41Å; I146-F149 PolarHBondContact O-N 2.71Å; F149-R151 VanDerWaalsContact C-N 3.29Å; F149-R151 PolarHBondContact O-N 3.4Å; F149-A152 PolarHBondContact O-N 3.11Å; F149-A152 VanDerWaalsContact O-N 3.16Å; F149-R153 HydrophobicContact CE2-CB 4.48Å; F149-R153 HydrophobicContact CZ-CB 4.44Å; F149-R153 WeakPolarHBondContact O-CB 3.39Å; F149-R153 PolarHBondContact O-N 3.37Å; F149-W172 AromaticContact CE2-CH2 3.63Å; F149-W172 HydrophobicContact CE2-CH2 3.63Å; F149-W172 AromaticContact CE2-CZ2 3.83Å; F149-W172 HydrophobicContact CE2-CZ2 3.83Å; F149-W172 AromaticContact CZ-CH2 3.71Å; F149-W172 HydrophobicContact CZ-CH2 3.71Å; F149-W172 HydrophobicContact CZ-CZ2 4.2Å; F149-L195 HydrophobicContact CD1-CD1 4.39Å; F149-L195 HydrophobicContact CE1-CD1 4.3Å; F149-L195 HydrophobicContact CE1-CD2 3.87Å; F149-F199 HydrophobicContact CD1-CE1 4.5Å; F149-Y202 HydrophobicContact CB-CD1 3.98Å; F149-Y202 HydrophobicContact CB-CD2 4.36Å; F149-Y202 HydrophobicContact CB-CE1 4.01Å; F149-Y202 HydrophobicContact CB-CE2 4.37Å; F149-Y202 HydrophobicContact CB-CG 4.16Å; F149-Y202 HydrophobicContact CD2-CD2 4.15Å; F149-Y202 HydrophobicContact CD2-CE2 4.04Å; F149-L209 HydrophobicContact CD2-CD1 4.48Å; F149-L209 HydrophobicContact CD2-CD2 3.96Å; F149-L209 HydrophobicContact CD2-CG 4.49Å; F149-L209 HydrophobicContact CE2-CD1 3.85Å; F149-L209 HydrophobicContact CE2-CD2 4.09Å; F149-L209 HydrophobicContact CE2-CG 4.33Å
150	L	91.3	Very high	85.3	Confident	33 Å²	33	66.2 Å²	66.2	17%	0.173	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-37.1	179.2	-76.8	173.8	0	0	0	112.4	I146 P147 K154 L195	I146-L150 HydrophobicContact CG2-CD1 4.21Å; I146-L150 WeakPolarHBondContact O-CG 3.42Å; I146-L150 PolarHBondContact O-N 2.89Å; P147-L150 PolarHBondContact O-N 3.1Å; L150-K154 WeakPolarHBondContact O-CG 3.38Å; L150-K154 PolarHBondContact O-N 2.89Å; L150-L195 HydrophobicContact CD1-CD1 4.31Å; L150-L195 HydrophobicContact CD2-CD1 3.75Å; L150-L195 HydrophobicContact CG-CD1 4.08Å
151	R	90.4	Very high	86.9	Confident	150 Å²	150	62.1 Å²	62.1	57%	0.566	31%	0.308	S	S	*	.	H	α-helix	trans	-65.2	-51.3	171.5	-73.8	-173.1	-67.4	-112.2	1.3	110.8	P147 A148 F149 R153 K154 H155	P147-R151 WeakPolarHBondContact O-CG 3.28Å; P147-R151 PolarHBondContact O-N 2.91Å; A148-R151 PolarHBondContact O-N 2.65Å; F149-R151 VanDerWaalsContact C-N 3.29Å; F149-R151 PolarHBondContact O-N 3.4Å; R151-R153 VanDerWaalsContact C-N 3.33Å; R151-R153 PolarHBondContact O-N 3.06Å; R151-K154 WeakPolarHBondContact O-CB 3.38Å; R151-K154 PolarHBondContact O-N 2.96Å; R151-H155 PolarHBondContact O-CD2 3.33Å; R151-H155 PolarHBondContact O-N 3.41Å
152	A	89.8	Confident	88.3	Confident	9 Å²	9	57.1 Å²	57.1	7%	0.074	29%	0.286	C	S	.	.	H	α-helix	trans	-58.6	-42.6	-179.4	0	0	0	0	0	112.5	A148 F149 K154 H155 H156 Y202 N207	A148-A152 PolarHBondContact O-N 3.11Å; F149-A152 PolarHBondContact O-N 3.11Å; F149-A152 VanDerWaalsContact O-N 3.16Å; A152-K154 PolarHBondContact O-N 3.29Å; A152-H155 PolarHBondContact O-N 3.2Å; A152-H155 VanDerWaalsContact O-N 3.11Å; A152-H156 WeakPolarHBondContact O-CB 3.46Å; A152-H156 PolarHBondContact O-CD2 2.6Å; A152-H156 VanDerWaalsContact O-CD2 3.27Å; A152-H156 PolarHBondContact O-N 3.14Å; A152-Y202 WeakPolarHBondContact CB-OH 3.33Å; A152-N207 WeakPolarHBondContact CB-OD1 3.44Å
153	R	92.4	Very high	89.7	Confident	30 Å²	30	54.9 Å²	54.9	11%	0.113	28%	0.276	C	S	.	.	H	α-helix	trans	-59.5	-31.8	176	-174.5	177.8	74.1	175.4	1.5	113.3	F149 R151 W172 L186 S189 N190	F149-R153 HydrophobicContact CE2-CB 4.48Å; F149-R153 HydrophobicContact CZ-CB 4.44Å; F149-R153 WeakPolarHBondContact O-CB 3.39Å; F149-R153 PolarHBondContact O-N 3.37Å; R151-R153 VanDerWaalsContact C-N 3.33Å; R151-R153 PolarHBondContact O-N 3.06Å; R153-W172 HydrophobicContact CB-CZ2 4.08Å; R153-W172 HydrophobicContact CG-CD2 4.07Å; R153-W172 HydrophobicContact CG-CH2 4.32Å; R153-W172 HydrophobicContact CG-CZ2 3.73Å; R153-L186 PolarHBondContact NH1-O 3.06Å; R153-S189 PolarHBondContact NH1-O 2.84Å; R153-S189 PolarHBondContact NH2-O 2.91Å; R153-N190 PolarHBondContact NH2-OD1 3.46Å
154	K	89.8	Confident	90.7	Very high	168 Å²	168	53.9 Å²	53.9	73%	0.73	28%	0.277	S	S	*	.	H	α-helix	trans	-75.7	-34.4	176	-72.2	-179.7	-179.9	-175.4	0	112.5	L150 R151 A152	L150-K154 WeakPolarHBondContact O-CG 3.38Å; L150-K154 PolarHBondContact O-N 2.89Å; R151-K154 WeakPolarHBondContact O-CB 3.38Å; R151-K154 PolarHBondContact O-N 2.96Å; A152-K154 PolarHBondContact O-N 3.29Å
155	H	90.8	Very high	91.5	Very high	154 Å²	154	51.4 Å²	51.4	71%	0.713	27%	0.273	S	S	*	.	H	α-helix	trans	-91.9	-24	-175.3	-68.5	-67.2	0	0	0	114.1	R151 A152	R151-H155 PolarHBondContact O-CD2 3.33Å; R151-H155 PolarHBondContact O-N 3.41Å; A152-H155 PolarHBondContact O-N 3.2Å; A152-H155 VanDerWaalsContact O-N 3.11Å
156	H	91.8	Very high	92.1	Very high	98 Å²	98	55 Å²	55	45%	0.454	29%	0.29	S	S	.	.			trans	-110.2	128.3	-179.1	-61.9	-74.8	0	0	0	111.4	A152 R158 W172	A152-H156 WeakPolarHBondContact O-CB 3.46Å; A152-H156 PolarHBondContact O-CD2 2.6Å; A152-H156 VanDerWaalsContact O-CD2 3.27Å; A152-H156 PolarHBondContact O-N 3.14Å; H156-R158 VanDerWaalsContact C-N 3.26Å; H156-R158 WeakPolarHBondContact CB-O 3.35Å; H156-R158 PolarHBondContact O-N 2.91Å; H156-W172 PolarHBondContact O-NE1 3.43Å
157	C	94.3	Very high	92.5	Very high	101 Å²	101	61.9 Å²	61.9	68%	0.682	32%	0.316	S	S	*	.	S	Bend	trans	-73.3	-19.6	174.2	61.4	0	0	0	0	113.2	W172	C157-W172 PolarHBondContact O-N 3.49Å; C157-W172 VanDerWaalsContact O-N 3.08Å
158	R	94.7	Very high	92.9	Very high	99 Å²	99	60.9 Å²	60.9	37%	0.374	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	158.7	-179.7	-59.7	179.2	88.4	-166.4	1.3	111.2	H156 E169 V170 M171	H156-R158 VanDerWaalsContact C-N 3.26Å; H156-R158 WeakPolarHBondContact CB-O 3.35Å; H156-R158 PolarHBondContact O-N 2.91Å; R158-E169 HydrophobicContact CB-CG 4.38Å; R158-E169 WeakPolarHBondContact CD-OE1 3.25Å; R158-E169 IonicContact CZ-OE1 3.15Å; R158-E169 IonicContact CZ-OE2 2.7Å; R158-E169 IonicContact NE-OE1 3.07Å; R158-E169 PolarHBondContact NE-OE1 3.42Å; R158-E169 IonicContact NH1-OE1 2.92Å; R158-E169 PolarHBondContact NH1-OE1 2.8Å; R158-E169 IonicContact NH1-OE2 3.63Å; R158-E169 PolarHBondContact NH1-OE2 3.06Å; R158-E169 VanDerWaalsContact NH2-CD 3.35Å; R158-E169 IonicContact NH2-OE1 3.12Å; R158-E169 IonicContact NH2-OE2 3.56Å; R158-E169 PolarHBondContact NH2-OE2 2.8Å; R158-E169 VanDerWaalsContact NH2-OE2 3.12Å; R158-V170 CarbonylContact C-O 3.59Å; R158-V170 WeakPolarHBondContact CA-O 3.44Å; R158-V170 WeakPolarHBondContact CB-O 3.23Å; R158-M171 HydrophobicContact CG-CG 4.1Å
159	V	94.3	Very high	93.3	Very high	1 Å²	1	65 Å²	65	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.3	174.9	61	0	0	0	0	109.6	L161 V170 W172 L175 L209	V159-L161 HydrophobicContact CG1-CD2 4.09Å; V159-L161 HydrophobicContact CG2-CD2 4.24Å; V159-V170 HydrophobicContact CG1-CG2 3.66Å; V159-V170 PolarHBondContact N-O 3.31Å; V159-V170 PolarHBondContact O-N 2.72Å; V159-W172 HydrophobicContact CB-CD2 4.37Å; V159-W172 HydrophobicContact CB-CH2 3.92Å; V159-W172 HydrophobicContact CB-CZ2 3.39Å; V159-W172 HydrophobicContact CG1-CD2 4.01Å; V159-W172 HydrophobicContact CG1-CE3 4.1Å; V159-W172 HydrophobicContact CG1-CH2 3.78Å; V159-W172 HydrophobicContact CG1-CZ2 3.69Å; V159-W172 HydrophobicContact CG1-CZ3 3.99Å; V159-W172 HydrophobicContact CG2-CH2 3.86Å; V159-W172 HydrophobicContact CG2-CZ2 3.57Å; V159-L175 HydrophobicContact CG1-CD1 4.29Å; V159-L209 HydrophobicContact CG2-CD1 3.9Å; V159-L209 HydrophobicContact CG2-CG 4.33Å
160	V	96.6	Very high	93.5	Very high	20 Å²	20	65.2 Å²	65.2	12%	0.121	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124	172.3	-175.6	0	0	0	0	108.8	R167 E169 N207 E208 L209	V160-R167 HydrophobicContact CG1-CB 4.18Å; V160-E169 HydrophobicContact CG2-CG 4.29Å; V160-N207 PolarHBondContact N-O 3.39Å; V160-E208 HydrophobicContact CB-CB 4.23Å; V160-E208 HydrophobicContact CB-CG 4.21Å; V160-E208 HydrophobicContact CG1-CB 4.41Å; V160-E208 HydrophobicContact CG1-CG 3.91Å; V160-E208 WeakPolarHBondContact O-CA 3.43Å; V160-L209 PolarHBondContact O-N 3Å
161	L	96.5	Very high	93.7	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	116	174.7	-50.6	177.6	0	0	0	108	V159 H168 V170 L183 L209 F211 F218	V159-L161 HydrophobicContact CG1-CD2 4.09Å; V159-L161 HydrophobicContact CG2-CD2 4.24Å; L161-H168 HydrophobicContact CB-CB 4.48Å; L161-H168 PolarHBondContact N-O 2.91Å; L161-H168 PolarHBondContact O-N 3.24Å; L161-V170 HydrophobicContact CD1-CG2 3.74Å; L161-V170 HydrophobicContact CG-CG2 4.01Å; L161-L183 HydrophobicContact CD1-CD1 3.94Å; L161-L183 HydrophobicContact CD1-CD2 4.04Å; L161-L183 HydrophobicContact CD2-CD2 4.43Å; L161-L209 HydrophobicContact CD2-CB 4.37Å; L161-L209 HydrophobicContact CD2-CD1 4.02Å; L161-F211 HydrophobicContact CB-CE2 4.2Å; L161-F211 HydrophobicContact CD2-CE2 3.96Å; L161-F211 HydrophobicContact CD2-CZ 4.37Å; L161-F218 HydrophobicContact CD1-CE1 4.38Å; L161-F218 HydrophobicContact CD1-CZ 3.87Å
162	N	96.4	Very high	93.9	Very high	16 Å²	16	61.8 Å²	61.8	9%	0.086	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	106.1	175.2	-167.5	-47.3	0	0	0	109.1	G165 E166 E208 L209 Y210 F211	N162-G165 WeakPolarHBondContact OD1-CA 3.47Å; N162-G165 PolarHBondContact OD1-N 3.17Å; N162-E166 CarbonylContact C-O 3.55Å; N162-E166 WeakPolarHBondContact CA-O 3.25Å; N162-E208 HydrophobicContact CB-CG 3.8Å; N162-E208 WeakPolarHBondContact CB-OE1 3.44Å; N162-E208 PolarHBondContact ND2-OE1 3.49Å; N162-L209 WeakPolarHBondContact CB-O 3.42Å; N162-L209 PolarHBondContact N-O 3.34Å; N162-Y210 HydrophobicContact CB-CD1 3.68Å; N162-Y210 HydrophobicContact CB-CE1 3.9Å; N162-Y210 HydrophobicContact CB-CG 4.27Å; N162-Y210 WeakPolarHBondContact ND2-CE1 3.25Å; N162-Y210 CarbonylContact O-C 3.59Å; N162-Y210 WeakPolarHBondContact O-CA 3.48Å; N162-F211 PolarHBondContact O-N 3.41Å
163	V	95.8	Very high	94.2	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	110	-177.6	-174.9	0	0	0	0	107.9	G165 E166 F211 Q213 A215 F218 W248	V163-G165 PolarHBondContact O-N 3.03Å; V163-G165 VanDerWaalsContact O-N 3.08Å; V163-E166 PolarHBondContact N-O 3.33Å; V163-E166 PolarHBondContact O-N 2.81Å; V163-F211 HydrophobicContact CG2-CB 4.34Å; V163-F211 HydrophobicContact CG2-CD2 4.03Å; V163-F211 HydrophobicContact CG2-CG 4.48Å; V163-Q213 HydrophobicContact CG1-CB 4.03Å; V163-A215 WeakPolarHBondContact O-CB 3.32Å; V163-F218 HydrophobicContact CB-CB 4.45Å; V163-F218 HydrophobicContact CB-CD1 4.36Å; V163-F218 HydrophobicContact CB-CD2 4.47Å; V163-F218 HydrophobicContact CB-CG 4.18Å; V163-F218 HydrophobicContact CG1-CB 4.15Å; V163-F218 HydrophobicContact CG1-CD2 4.22Å; V163-F218 HydrophobicContact CG1-CG 4.15Å; V163-F218 HydrophobicContact CG2-CD1 3.85Å; V163-F218 HydrophobicContact CG2-CD2 3.86Å; V163-F218 HydrophobicContact CG2-CE1 3.84Å; V163-F218 HydrophobicContact CG2-CE2 3.86Å; V163-F218 HydrophobicContact CG2-CG 3.84Å; V163-F218 HydrophobicContact CG2-CZ 3.85Å; V163-W248 HydrophobicContact CG1-CH2 4.36Å; V163-W248 HydrophobicContact CG1-CZ2 3.85Å; V163-W248 HydrophobicContact CG2-CH2 4Å; V163-W248 HydrophobicContact CG2-CZ2 4.21Å
164	G	91.1	Very high	94.4	Very high	49 Å²	49	69 Å²	69	51%	0.505	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	25.5	-179.7	0	0	0	0	0	114.4	F211 Q213	G164-F211 PolarHBondContact N-O 2.91Å; G164-Q213 WeakPolarHBondContact CA-O 3.29Å; G164-Q213 PolarHBondContact N-O 3.07Å
165	G	90.8	Very high	94.7	Very high	54 Å²	54	61 Å²	61	56%	0.557	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.7	-16.8	-176.5	0	0	0	0	0	115.1	N162 V163	N162-G165 WeakPolarHBondContact OD1-CA 3.47Å; N162-G165 PolarHBondContact OD1-N 3.17Å; V163-G165 PolarHBondContact O-N 3.03Å; V163-G165 VanDerWaalsContact O-N 3.08Å
166	E	95.2	Very high	94.9	Very high	99 Å²	99	59.5 Å²	59.5	46%	0.463	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	130.6	177.2	-69.1	-172.8	-169.5	0	0	111.5	N162 V163 H168 A215	N162-E166 CarbonylContact C-O 3.55Å; N162-E166 WeakPolarHBondContact CA-O 3.25Å; V163-E166 PolarHBondContact N-O 3.33Å; V163-E166 PolarHBondContact O-N 2.81Å; E166-H168 PolarHBondContact O-CD2 2.82Å; E166-H168 IonicContact OE2-NE2 3.78Å; E166-A215 HydrophobicContact CB-CB 3.97Å; E166-A215 HydrophobicContact CG-CB 3.73Å
167	R	94.9	Very high	95.1	Very high	155 Å²	155	61.2 Å²	61.2	59%	0.585	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.2	-174.2	-57.1	179.7	71.1	-145.6	-1	110.6	V160 E208	V160-R167 HydrophobicContact CG1-CB 4.18Å; R167-E208 WeakPolarHBondContact CD-OE1 3.43Å; R167-E208 WeakPolarHBondContact CG-OE1 3.44Å; R167-E208 IonicContact NE-OE1 3.56Å; R167-E208 PolarHBondContact NE-OE1 3.42Å; R167-E208 IonicContact NE-OE2 3.59Å; R167-E208 IonicContact NH2-OE2 2.84Å
168	H	95.3	Very high	95.1	Very high	36 Å²	36	58 Å²	58	17%	0.167	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	114.9	177.9	-58.4	-84.1	0	0	0	110.8	L161 E166 F218 L222	L161-H168 HydrophobicContact CB-CB 4.48Å; L161-H168 PolarHBondContact N-O 2.91Å; L161-H168 PolarHBondContact O-N 3.24Å; E166-H168 PolarHBondContact O-CD2 2.82Å; E166-H168 IonicContact OE2-NE2 3.78Å; H168-F218 HydrophobicContact CB-CD1 4.48Å; H168-F218 HydrophobicContact CB-CE1 3.98Å; H168-F218 AromaticContact CD2-CD1 3.39Å; H168-F218 WeakPolarHBondContact CD2-CD1 3.39Å; H168-F218 AromaticContact CD2-CE1 3.66Å; H168-F218 AromaticContact CG-CD1 3.78Å; H168-F218 AromaticContact CG-CE1 3.78Å; H168-F218 AromaticContact NE2-CD1 3.56Å; H168-L222 HydrophobicContact CB-CD2 4.11Å
169	E	95.1	Very high	95.1	Very high	92 Å²	92	56.2 Å²	56.2	43%	0.43	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	126.8	176.9	-164.9	-172.4	-179.4	0	0	111.4	R158 V160	R158-E169 HydrophobicContact CB-CG 4.38Å; R158-E169 WeakPolarHBondContact CD-OE1 3.25Å; R158-E169 IonicContact CZ-OE1 3.15Å; R158-E169 IonicContact CZ-OE2 2.7Å; R158-E169 IonicContact NE-OE1 3.07Å; R158-E169 PolarHBondContact NE-OE1 3.42Å; R158-E169 IonicContact NH1-OE1 2.92Å; R158-E169 PolarHBondContact NH1-OE1 2.8Å; R158-E169 IonicContact NH1-OE2 3.63Å; R158-E169 PolarHBondContact NH1-OE2 3.06Å; R158-E169 VanDerWaalsContact NH2-CD 3.35Å; R158-E169 IonicContact NH2-OE1 3.12Å; R158-E169 IonicContact NH2-OE2 3.56Å; R158-E169 PolarHBondContact NH2-OE2 2.8Å; R158-E169 VanDerWaalsContact NH2-OE2 3.12Å; V160-E169 HydrophobicContact CG2-CG 4.29Å
170	V	95.6	Very high	95.1	Very high	6 Å²	6	63.7 Å²	63.7	4%	0.036	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154	-173.2	-60	0	0	0	0	111.8	R158 V159 L161 L175 L222	R158-V170 CarbonylContact C-O 3.59Å; R158-V170 WeakPolarHBondContact CA-O 3.44Å; R158-V170 WeakPolarHBondContact CB-O 3.23Å; V159-V170 HydrophobicContact CG1-CG2 3.66Å; V159-V170 PolarHBondContact N-O 3.31Å; V159-V170 PolarHBondContact O-N 2.72Å; L161-V170 HydrophobicContact CD1-CG2 3.74Å; L161-V170 HydrophobicContact CG-CG2 4.01Å; V170-L175 HydrophobicContact CG2-CD1 3.97Å; V170-L175 HydrophobicContact CG2-CD2 4.2Å; V170-L175 HydrophobicContact CG2-CG 4.14Å; V170-L222 HydrophobicContact CG1-CD1 3.59Å; V170-L222 HydrophobicContact CG1-CD2 3.63Å; V170-L222 HydrophobicContact CG1-CG 4.21Å
171	M	95.9	Very high	95	Very high	103 Å²	103	62.8 Å²	62.8	51%	0.507	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	140.6	171.8	-67.4	-177.6	177.4	0	0	110.5	R158 K173 T174 L175	R158-M171 HydrophobicContact CG-CG 4.1Å; M171-K173 PolarHBondContact O-N 3.11Å; M171-K173 VanDerWaalsContact O-N 3.14Å; M171-T174 WeakPolarHBondContact O-CB 3.49Å; M171-T174 PolarHBondContact O-N 3.33Å; M171-L175 PolarHBondContact O-N 2.85Å
172	W	95.3	Very high	95	Very high	8 Å²	8	65.2 Å²	65.2	3%	0.03	33%	0.325	C	S	.	.	H	α-helix	trans	-57.2	-31.3	173.2	-72.9	118.1	0	0	0	112.7	F149 R153 H156 C157 V159 T174 L175 R176 L186 L209	F149-W172 AromaticContact CE2-CH2 3.63Å; F149-W172 HydrophobicContact CE2-CH2 3.63Å; F149-W172 AromaticContact CE2-CZ2 3.83Å; F149-W172 HydrophobicContact CE2-CZ2 3.83Å; F149-W172 AromaticContact CZ-CH2 3.71Å; F149-W172 HydrophobicContact CZ-CH2 3.71Å; F149-W172 HydrophobicContact CZ-CZ2 4.2Å; R153-W172 HydrophobicContact CB-CZ2 4.08Å; R153-W172 HydrophobicContact CG-CD2 4.07Å; R153-W172 HydrophobicContact CG-CH2 4.32Å; R153-W172 HydrophobicContact CG-CZ2 3.73Å; H156-W172 PolarHBondContact O-NE1 3.43Å; C157-W172 PolarHBondContact O-N 3.49Å; C157-W172 VanDerWaalsContact O-N 3.08Å; V159-W172 HydrophobicContact CB-CD2 4.37Å; V159-W172 HydrophobicContact CB-CH2 3.92Å; V159-W172 HydrophobicContact CB-CZ2 3.39Å; V159-W172 HydrophobicContact CG1-CD2 4.01Å; V159-W172 HydrophobicContact CG1-CE3 4.1Å; V159-W172 HydrophobicContact CG1-CH2 3.78Å; V159-W172 HydrophobicContact CG1-CZ2 3.69Å; V159-W172 HydrophobicContact CG1-CZ3 3.99Å; V159-W172 HydrophobicContact CG2-CH2 3.86Å; V159-W172 HydrophobicContact CG2-CZ2 3.57Å; W172-T174 VanDerWaalsContact C-N 3.31Å; W172-T174 PolarHBondContact O-N 3.14Å; W172-L175 HydrophobicContact CE3-CD1 3.95Å; W172-L175 HydrophobicContact CZ3-CD1 3.96Å; W172-L175 PolarHBondContact O-N 3.08Å; W172-R176 PolarHBondContact O-N 3.17Å; W172-L186 HydrophobicContact CZ3-CB 4.21Å; W172-L209 HydrophobicContact CH2-CD1 4.31Å
173	K	95.5	Very high	95	Very high	157 Å²	157	64.5 Å²	64.5	68%	0.683	32%	0.321	S	S	*	.	H	α-helix	trans	-62.5	-35.6	175.7	-171.9	178.3	177.8	-178.3	0	112.7	M171 R176	M171-K173 PolarHBondContact O-N 3.11Å; M171-K173 VanDerWaalsContact O-N 3.14Å; K173-R176 PolarHBondContact O-N 2.96Å
174	T	96.3	Very high	95.1	Very high	34 Å²	34	64.5 Å²	64.5	21%	0.209	32%	0.321	C	S	.	.	H	α-helix	trans	-67.3	-43.2	178.7	-53	0	0	0	0	110.8	M171 W172 R176 R177 Y225 R226	M171-T174 WeakPolarHBondContact O-CB 3.49Å; M171-T174 PolarHBondContact O-N 3.33Å; W172-T174 VanDerWaalsContact C-N 3.31Å; W172-T174 PolarHBondContact O-N 3.14Å; T174-R176 VanDerWaalsContact C-N 3.28Å; T174-R176 PolarHBondContact O-N 2.85Å; T174-R177 WeakPolarHBondContact O-CB 3.04Å; T174-R177 PolarHBondContact O-N 3.47Å; T174-Y225 WeakPolarHBondContact CG2-O 3.45Å; T174-R226 HydrophobicContact CG2-CG 4.1Å
175	L	96.4	Very high	95.3	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.8	-30.7	-179.8	-58.9	-176	0	0	0	112.8	V159 V170 M171 W172 R177 L178 L183 G184 L222 Y225	V159-L175 HydrophobicContact CG1-CD1 4.29Å; V170-L175 HydrophobicContact CG2-CD1 3.97Å; V170-L175 HydrophobicContact CG2-CD2 4.2Å; V170-L175 HydrophobicContact CG2-CG 4.14Å; M171-L175 PolarHBondContact O-N 2.85Å; W172-L175 HydrophobicContact CE3-CD1 3.95Å; W172-L175 HydrophobicContact CZ3-CD1 3.96Å; W172-L175 PolarHBondContact O-N 3.08Å; L175-R177 PolarHBondContact O-N 3.17Å; L175-R177 VanDerWaalsContact O-N 3.12Å; L175-L178 PolarHBondContact O-N 2.95Å; L175-L183 HydrophobicContact CD1-CB 4.19Å; L175-L183 HydrophobicContact CD2-CB 3.9Å; L175-L183 HydrophobicContact CD2-CD1 4.03Å; L175-L183 HydrophobicContact CG-CB 4.43Å; L175-G184 WeakPolarHBondContact O-CA 3.09Å; L175-L222 HydrophobicContact CD2-CD1 4.43Å; L175-Y225 HydrophobicContact CD2-CD1 4.09Å; L175-Y225 HydrophobicContact CD2-CE1 4.29Å; L175-Y225 HydrophobicContact CD2-CG 4.3Å
176	R	95.6	Very high	95.5	Very high	122 Å²	122	63.8 Å²	63.8	46%	0.46	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-12	175.7	-77.4	-171.1	-71	-94.8	6.7	115	W172 K173 T174 L178 S187 I188	W172-R176 PolarHBondContact O-N 3.17Å; K173-R176 PolarHBondContact O-N 2.96Å; T174-R176 VanDerWaalsContact C-N 3.28Å; T174-R176 PolarHBondContact O-N 2.85Å; R176-L178 VanDerWaalsContact C-N 3.25Å; R176-L178 PolarHBondContact O-N 3.43Å; R176-S187 WeakPolarHBondContact CG-OG 3.09Å; R176-I188 HydrophobicContact CG-CG1 4.41Å
177	R	94.7	Very high	95.4	Very high	134 Å²	134	59.6 Å²	59.6	51%	0.506	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-25.8	177.4	-72.9	-179.1	63.7	-174.5	10.1	113.3	T174 L175 Y225 R226	T174-R177 WeakPolarHBondContact O-CB 3.04Å; T174-R177 PolarHBondContact O-N 3.47Å; L175-R177 PolarHBondContact O-N 3.17Å; L175-R177 VanDerWaalsContact O-N 3.12Å; R177-Y225 VanDerWaalsContact CD-O 3.24Å; R177-Y225 WeakPolarHBondContact CD-O 3.35Å; R177-Y225 PolarHBondContact NH1-O 2.86Å; R177-R226 PolarHBondContact NH1-O 3.42Å
178	L	95.2	Very high	95.3	Very high	33 Å²	33	56.4 Å²	56.4	17%	0.173	26%	0.261	C	S	.	.	S	Bend	trans	-122.5	73.1	175.2	-61.1	174.1	0	0	0	108.8	L175 R176 L180 S181 G184 V224 Y225	L175-L178 PolarHBondContact O-N 2.95Å; R176-L178 VanDerWaalsContact C-N 3.25Å; R176-L178 PolarHBondContact O-N 3.43Å; L178-L180 PolarHBondContact O-N 3.08Å; L178-L180 VanDerWaalsContact O-N 3.1Å; L178-S181 WeakPolarHBondContact O-CB 3.27Å; L178-S181 PolarHBondContact O-N 2.95Å; L178-S181 PolarHBondContact O-OG 3.17Å; L178-G184 WeakPolarHBondContact O-CA 3.39Å; L178-V224 HydrophobicContact CD1-CB 4.26Å; L178-V224 HydrophobicContact CD1-CG1 3.81Å; L178-Y225 HydrophobicContact CB-CD1 4.02Å; L178-Y225 HydrophobicContact CB-CE1 3.71Å; L178-Y225 HydrophobicContact CD1-CD1 3.92Å; L178-Y225 HydrophobicContact CD1-CD2 4.29Å; L178-Y225 HydrophobicContact CD1-CE1 3.92Å; L178-Y225 HydrophobicContact CD1-CE2 4.25Å; L178-Y225 HydrophobicContact CD1-CG 4.13Å; L178-Y225 HydrophobicContact CG-CD1 4.11Å; L178-Y225 HydrophobicContact CG-CE1 4.2Å
179	P	94.8	Very high	95.1	Very high	61 Å²	61	55.2 Å²	55.2	40%	0.396	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-24.1	-169.2	27.3	-37.1	0	0	0	113.9	R185 I188	P179-R185 WeakPolarHBondContact O-CG 3.39Å; P179-R185 PolarHBondContact O-N 2.99Å; P179-I188 HydrophobicContact CB-CD1 3.41Å; P179-I188 VanDerWaalsContact CB-CD1 3.41Å
180	L	93.8	Very high	94.9	Very high	158 Å²	158	55.7 Å²	55.7	83%	0.827	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-16.6	179.6	-61.1	-179.4	0	0	0	113.7	L178	L178-L180 PolarHBondContact O-N 3.08Å; L178-L180 VanDerWaalsContact O-N 3.1Å
181	S	96	Very high	94.6	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.014	28%	0.283	C	S	.	.	S	Bend	trans	-73.8	166.2	178.9	77.2	0	0	0	0	111.3	L178 L183 G184 R185 Y225 W248	L178-S181 WeakPolarHBondContact O-CB 3.27Å; L178-S181 PolarHBondContact O-N 2.95Å; L178-S181 PolarHBondContact O-OG 3.17Å; S181-L183 PolarHBondContact O-N 3.31Å; S181-G184 PolarHBondContact O-N 2.73Å; S181-G184 PolarHBondContact OG-N 2.75Å; S181-G184 VanDerWaalsContact OG-N 3.1Å; S181-R185 WeakPolarHBondContact O-CB 3.39Å; S181-R185 VanDerWaalsContact O-CG 3.27Å; S181-R185 WeakPolarHBondContact O-CG 3.36Å; S181-R185 PolarHBondContact O-N 3.19Å; S181-Y225 WeakPolarHBondContact CB-OH 3.37Å; S181-Y225 VanDerWaalsContact OG-CE1 3.28Å; S181-Y225 WeakPolarHBondContact OG-CE1 3.18Å; S181-Y225 VanDerWaalsContact OG-CZ 3.3Å; S181-Y225 PolarHBondContact OG-OH 2.87Å; S181-W248 WeakPolarHBondContact CB-O 3.48Å
182	R	96	Very high	94.1	Very high	51 Å²	51	58 Å²	58	19%	0.192	28%	0.281	C	S	.	.	H	α-helix	trans	-55	-48.7	178.8	177.2	170.5	-67.8	-91.5	-2.2	112.1	R185 L186 Q197 L198 Y247 W248	R182-R185 PolarHBondContact O-N 3.4Å; R182-L186 PolarHBondContact O-N 2.98Å; R182-Q197 PolarHBondContact NH1-O 3.1Å; R182-L198 WeakPolarHBondContact CD-O 3.43Å; R182-L198 HydrophobicContact CG-CD2 4.25Å; R182-L198 VanDerWaalsContact NH1-CA 3.34Å; R182-L198 PolarHBondContact NH1-O 3.39Å; R182-Y247 PolarHBondContact NE-O 3.41Å; R182-W248 HydrophobicContact CB-CE3 4.43Å; R182-W248 WeakPolarHBondContact CB-O 3.33Å; R182-W248 HydrophobicContact CG-CE3 4.41Å; R182-W248 PolarHBondContact N-O 2.89Å
183	L	96.4	Very high	93.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-73.7	-31.3	179.8	-58.7	178	0	0	0	112.7	L161 L175 S181 L186 S187 F211 F218 Y225 W248	L161-L183 HydrophobicContact CD1-CD1 3.94Å; L161-L183 HydrophobicContact CD1-CD2 4.04Å; L161-L183 HydrophobicContact CD2-CD2 4.43Å; L175-L183 HydrophobicContact CD1-CB 4.19Å; L175-L183 HydrophobicContact CD2-CB 3.9Å; L175-L183 HydrophobicContact CD2-CD1 4.03Å; L175-L183 HydrophobicContact CG-CB 4.43Å; S181-L183 PolarHBondContact O-N 3.31Å; L183-L186 HydrophobicContact CD2-CD1 3.85Å; L183-L186 WeakPolarHBondContact O-CB 3.35Å; L183-L186 PolarHBondContact O-N 3.37Å; L183-S187 PolarHBondContact O-N 3.13Å; L183-F211 HydrophobicContact CD2-CE1 4.28Å; L183-F211 HydrophobicContact CD2-CE2 4.45Å; L183-F211 HydrophobicContact CD2-CZ 3.83Å; L183-F218 HydrophobicContact CD1-CE2 3.92Å; L183-F218 HydrophobicContact CD1-CZ 3.81Å; L183-Y225 HydrophobicContact CB-CE1 4.11Å; L183-Y225 WeakPolarHBondContact CB-OH 3.46Å; L183-Y225 HydrophobicContact CD1-CE2 4.01Å; L183-W248 HydrophobicContact CD1-CE3 4.39Å; L183-W248 HydrophobicContact CD1-CZ3 4.44Å; L183-W248 HydrophobicContact CD2-CE3 4.18Å; L183-W248 HydrophobicContact CD2-CZ3 3.72Å; L183-W248 HydrophobicContact CG-CE3 4.01Å; L183-W248 HydrophobicContact CG-CZ3 4.05Å
184	G	96.3	Very high	93.2	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-45.1	172.8	0	0	0	0	0	111.9	L175 L178 S181 L186 S187 I188	L175-G184 WeakPolarHBondContact O-CA 3.09Å; L178-G184 WeakPolarHBondContact O-CA 3.39Å; S181-G184 PolarHBondContact O-N 2.73Å; S181-G184 PolarHBondContact OG-N 2.75Å; S181-G184 VanDerWaalsContact OG-N 3.1Å; G184-L186 VanDerWaalsContact C-N 3.29Å; G184-L186 PolarHBondContact O-N 3.19Å; G184-S187 WeakPolarHBondContact O-CB 3.47Å; G184-S187 PolarHBondContact O-N 3.39Å; G184-S187 PolarHBondContact O-OG 3.11Å; G184-I188 PolarHBondContact O-N 2.99Å
185	R	96.3	Very high	92.9	Very high	88 Å²	88	53 Å²	53	33%	0.332	27%	0.266	S	S	.	.	H	α-helix	trans	-61.3	-35.4	176.1	-69.8	169.6	63.3	-163.3	1.6	112.5	P179 S181 R182 S187 I188 S189 E194 L198	P179-R185 WeakPolarHBondContact O-CG 3.39Å; P179-R185 PolarHBondContact O-N 2.99Å; S181-R185 WeakPolarHBondContact O-CB 3.39Å; S181-R185 VanDerWaalsContact O-CG 3.27Å; S181-R185 WeakPolarHBondContact O-CG 3.36Å; S181-R185 PolarHBondContact O-N 3.19Å; R182-R185 PolarHBondContact O-N 3.4Å; R185-S187 PolarHBondContact O-N 3.15Å; R185-I188 PolarHBondContact O-N 3.32Å; R185-I188 VanDerWaalsContact O-N 3.16Å; R185-S189 VanDerWaalsContact O-CB 3.31Å; R185-S189 WeakPolarHBondContact O-CB 3.33Å; R185-S189 PolarHBondContact O-N 3.01Å; R185-E194 IonicContact CZ-OE1 3.16Å; R185-E194 IonicContact NE-OE1 3.26Å; R185-E194 PolarHBondContact NE-OE1 3.4Å; R185-E194 VanDerWaalsContact NH2-CD 3.34Å; R185-E194 IonicContact NH2-OE1 2.83Å; R185-E194 PolarHBondContact NH2-OE1 3.1Å; R185-L198 HydrophobicContact CB-CD1 3.71Å; R185-L198 HydrophobicContact CB-CD2 4.4Å
186	L	94.2	Very high	92.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-30.2	172.2	-72.7	173.8	0	0	0	113.2	R153 W172 R182 L183 G184 L195 L198 F199 L209 F211	R153-L186 PolarHBondContact NH1-O 3.06Å; W172-L186 HydrophobicContact CZ3-CB 4.21Å; R182-L186 PolarHBondContact O-N 2.98Å; L183-L186 HydrophobicContact CD2-CD1 3.85Å; L183-L186 WeakPolarHBondContact O-CB 3.35Å; L183-L186 PolarHBondContact O-N 3.37Å; G184-L186 VanDerWaalsContact C-N 3.29Å; G184-L186 PolarHBondContact O-N 3.19Å; L186-L195 HydrophobicContact CD2-CD2 4.15Å; L186-L198 HydrophobicContact CD2-CB 3.44Å; L186-L198 VanDerWaalsContact CD2-CB 3.44Å; L186-L198 HydrophobicContact CD2-CD1 3.81Å; L186-L198 HydrophobicContact CD2-CG 4.28Å; L186-L198 HydrophobicContact CG-CB 3.99Å; L186-L198 HydrophobicContact CG-CD1 4.06Å; L186-F199 HydrophobicContact CD2-CD1 3.63Å; L186-F199 HydrophobicContact CD2-CE1 4.2Å; L186-L209 HydrophobicContact CD1-CD1 4.16Å; L186-F211 HydrophobicContact CD1-CE1 4.2Å; L186-F211 HydrophobicContact CD1-CZ 3.76Å
187	S	93.2	Very high	92	Very high	11 Å²	11	54.6 Å²	54.6	8%	0.077	28%	0.283	C	S	.	.	H	α-helix	trans	-82.5	-14.9	-179.6	77.1	0	0	0	0	113.9	R176 L183 G184 R185	R176-S187 WeakPolarHBondContact CG-OG 3.09Å; L183-S187 PolarHBondContact O-N 3.13Å; G184-S187 WeakPolarHBondContact O-CB 3.47Å; G184-S187 PolarHBondContact O-N 3.39Å; G184-S187 PolarHBondContact O-OG 3.11Å; R185-S187 PolarHBondContact O-N 3.15Å
188	I	93	Very high	91.9	Very high	88 Å²	88	48.3 Å²	48.3	45%	0.451	26%	0.259	S	S	.	.	H	α-helix	trans	-118.3	-44.1	-170.8	-59.9	164.4	0	0	0	111.7	R176 P179 G184 R185 N190	R176-I188 HydrophobicContact CG-CG1 4.41Å; P179-I188 HydrophobicContact CB-CD1 3.41Å; P179-I188 VanDerWaalsContact CB-CD1 3.41Å; G184-I188 PolarHBondContact O-N 2.99Å; R185-I188 PolarHBondContact O-N 3.32Å; R185-I188 VanDerWaalsContact O-N 3.16Å; I188-N190 PolarHBondContact O-N 3.42Å
189	S	92.4	Very high	91.7	Very high	11 Å²	11	46.9 Å²	46.9	8%	0.077	25%	0.252	C	S	.	.			trans	-65	137.1	-171.4	-176.2	0	0	0	0	112	R153 R185 N191 E194	R153-S189 PolarHBondContact NH1-O 2.84Å; R153-S189 PolarHBondContact NH2-O 2.91Å; R185-S189 VanDerWaalsContact O-CB 3.31Å; R185-S189 WeakPolarHBondContact O-CB 3.33Å; R185-S189 PolarHBondContact O-N 3.01Å; S189-N191 PolarHBondContact OG-N 2.98Å; S189-N191 VanDerWaalsContact OG-N 3.16Å; S189-E194 VanDerWaalsContact CB-OE2 3.29Å; S189-E194 WeakPolarHBondContact CB-OE2 3.41Å; S189-E194 VanDerWaalsContact OG-CD 3.3Å; S189-E194 PolarHBondContact OG-OE2 3.2Å
190	N	90.2	Very high	91.4	Very high	103 Å²	103	47.4 Å²	47.4	55%	0.551	25%	0.251	S	S	*	.			trans	-110.8	-0.3	168.8	-70	-48.5	0	0	0	111.7	R153 I188 P192	R153-N190 PolarHBondContact NH2-OD1 3.46Å; I188-N190 PolarHBondContact O-N 3.42Å; N190-P192 VanDerWaalsContact O-CD 3.25Å; N190-P192 WeakPolarHBondContact O-CD 3.27Å
191	N	89.1	Confident	91.1	Very high	86 Å²	86	42.4 Å²	42.4	46%	0.46	23%	0.229	S	C	.	.			trans	-78.7	115.3	-177.3	-178.8	-11.6	0	0	0	109.2	S189 A193 E194 L195	S189-N191 PolarHBondContact OG-N 2.98Å; S189-N191 VanDerWaalsContact OG-N 3.16Å; N191-A193 VanDerWaalsContact C-N 3.28Å; N191-A193 PolarHBondContact O-N 3.48Å; N191-A193 PolarHBondContact OD1-N 2.96Å; N191-E194 HydrophobicContact CB-CB 3.89Å; N191-E194 PolarHBondContact O-N 3.13Å; N191-E194 VanDerWaalsContact O-N 3.16Å; N191-L195 WeakPolarHBondContact O-CG 3.33Å; N191-L195 PolarHBondContact O-N 3.31Å
192	P	85.4	Confident	90.9	Very high	72 Å²	72	43.3 Å²	43.3	47%	0.468	23%	0.232	S	C	.	.	H	α-helix	trans	-59.5	-37.5	-178.7	-24.3	35.6	0	0	0	113.2	I146 N190 E194 L195 A196	I146-P192 HydrophobicContact CD1-CB 4.38Å; I146-P192 WeakPolarHBondContact CD1-O 3.47Å; I146-P192 HydrophobicContact CG2-CB 4.05Å; N190-P192 VanDerWaalsContact O-CD 3.25Å; N190-P192 WeakPolarHBondContact O-CD 3.27Å; P192-E194 VanDerWaalsContact C-N 3.31Å; P192-E194 PolarHBondContact O-N 3.22Å; P192-L195 PolarHBondContact O-N 2.8Å; P192-A196 WeakPolarHBondContact O-CB 3.41Å; P192-A196 PolarHBondContact O-N 3.46Å
193	A	84.8	Confident	90.6	Very high	47 Å²	47	42 Å²	42	39%	0.388	23%	0.232	S	C	.	.	H	α-helix	trans	-67.4	-34.4	-179.8	0	0	0	0	0	112.1	N191	N191-A193 VanDerWaalsContact C-N 3.28Å; N191-A193 PolarHBondContact O-N 3.48Å; N191-A193 PolarHBondContact OD1-N 2.96Å
194	E	88	Confident	90.1	Very high	46 Å²	46	46.9 Å²	46.9	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-71.1	-49.5	174.9	-170.2	-175.3	178	0	0	110.8	R185 S189 N191 P192 A196 Q197 L198	R185-E194 IonicContact CZ-OE1 3.16Å; R185-E194 IonicContact NE-OE1 3.26Å; R185-E194 PolarHBondContact NE-OE1 3.4Å; R185-E194 VanDerWaalsContact NH2-CD 3.34Å; R185-E194 IonicContact NH2-OE1 2.83Å; R185-E194 PolarHBondContact NH2-OE1 3.1Å; S189-E194 VanDerWaalsContact CB-OE2 3.29Å; S189-E194 WeakPolarHBondContact CB-OE2 3.41Å; S189-E194 VanDerWaalsContact OG-CD 3.3Å; S189-E194 PolarHBondContact OG-OE2 3.2Å; N191-E194 HydrophobicContact CB-CB 3.89Å; N191-E194 PolarHBondContact O-N 3.13Å; N191-E194 VanDerWaalsContact O-N 3.16Å; P192-E194 VanDerWaalsContact C-N 3.31Å; P192-E194 PolarHBondContact O-N 3.22Å; E194-A196 VanDerWaalsContact C-N 3.26Å; E194-A196 PolarHBondContact O-N 3.33Å; E194-Q197 WeakPolarHBondContact O-CB 3.17Å; E194-Q197 PolarHBondContact O-N 2.68Å; E194-L198 HydrophobicContact CG-CD1 4.4Å; E194-L198 WeakPolarHBondContact O-CG 3.39Å; E194-L198 PolarHBondContact O-N 2.87Å
195	L	89.4	Confident	89.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.6	-40.7	179.9	-72.4	172	0	0	0	112.1	I146 F149 L150 L186 N191 P192 Q197 L198 F199	I146-L195 HydrophobicContact CG2-CB 4.32Å; I146-L195 HydrophobicContact CG2-CD1 3.97Å; F149-L195 HydrophobicContact CD1-CD1 4.39Å; F149-L195 HydrophobicContact CE1-CD1 4.3Å; F149-L195 HydrophobicContact CE1-CD2 3.87Å; L150-L195 HydrophobicContact CD1-CD1 4.31Å; L150-L195 HydrophobicContact CD2-CD1 3.75Å; L150-L195 HydrophobicContact CG-CD1 4.08Å; L186-L195 HydrophobicContact CD2-CD2 4.15Å; N191-L195 WeakPolarHBondContact O-CG 3.33Å; N191-L195 PolarHBondContact O-N 3.31Å; P192-L195 PolarHBondContact O-N 2.8Å; L195-Q197 PolarHBondContact O-N 2.55Å; L195-Q197 VanDerWaalsContact O-N 3.08Å; L195-L198 HydrophobicContact CD2-CD1 4.33Å; L195-L198 PolarHBondContact O-N 3.22Å; L195-F199 HydrophobicContact CB-CE1 4.27Å; L195-F199 VanDerWaalsContact O-CD1 3.25Å; L195-F199 WeakPolarHBondContact O-CD1 3.2Å; L195-F199 VanDerWaalsContact O-CE1 3.25Å; L195-F199 WeakPolarHBondContact O-CE1 3.49Å
196	A	85.2	Confident	89.3	Confident	23 Å²	23	57.3 Å²	57.3	19%	0.19	31%	0.308	C	S	.	.	H	α-helix	trans	-59.7	-18.1	176.6	0	0	0	0	0	114.3	I146 P192 E194	I146-A196 HydrophobicContact CD1-CB 3.76Å; P192-A196 WeakPolarHBondContact O-CB 3.41Å; P192-A196 PolarHBondContact O-N 3.46Å; E194-A196 VanDerWaalsContact C-N 3.26Å; E194-A196 PolarHBondContact O-N 3.33Å
197	Q	88.4	Confident	89.1	Confident	133 Å²	133	58.2 Å²	58.2	62%	0.621	31%	0.313	S	S	*	.	H	α-helix	trans	-100.1	-10.3	177.4	-62.3	178.5	12.6	0	0	113	R182 E194 L195	R182-Q197 PolarHBondContact NH1-O 3.1Å; E194-Q197 WeakPolarHBondContact O-CB 3.17Å; E194-Q197 PolarHBondContact O-N 2.68Å; L195-Q197 PolarHBondContact O-N 2.55Å; L195-Q197 VanDerWaalsContact O-N 3.08Å
198	L	91.8	Very high	89.1	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-87.2	-28.2	-172.7	-68.8	-178.5	0	0	0	112.8	R182 R185 L186 E194 L195 F211	R182-L198 WeakPolarHBondContact CD-O 3.43Å; R182-L198 HydrophobicContact CG-CD2 4.25Å; R182-L198 VanDerWaalsContact NH1-CA 3.34Å; R182-L198 PolarHBondContact NH1-O 3.39Å; R185-L198 HydrophobicContact CB-CD1 3.71Å; R185-L198 HydrophobicContact CB-CD2 4.4Å; L186-L198 HydrophobicContact CD2-CB 3.44Å; L186-L198 VanDerWaalsContact CD2-CB 3.44Å; L186-L198 HydrophobicContact CD2-CD1 3.81Å; L186-L198 HydrophobicContact CD2-CG 4.28Å; L186-L198 HydrophobicContact CG-CB 3.99Å; L186-L198 HydrophobicContact CG-CD1 4.06Å; E194-L198 HydrophobicContact CG-CD1 4.4Å; E194-L198 WeakPolarHBondContact O-CG 3.39Å; E194-L198 PolarHBondContact O-N 2.87Å; L195-L198 HydrophobicContact CD2-CD1 4.33Å; L195-L198 PolarHBondContact O-N 3.22Å; L198-F211 WeakPolarHBondContact O-CE1 3.33Å
199	F	90.6	Very high	89.2	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.018	29%	0.288	C	S	.	.			trans	-141.2	158.7	-179.8	62.7	-86.3	0	0	0	111.1	Y145 F149 L186 L195 S201 L209 F211	Y145-F199 AromaticContact CD2-CE2 3.57Å; Y145-F199 HydrophobicContact CD2-CE2 3.57Å; Y145-F199 AromaticContact CD2-CZ 3.72Å; Y145-F199 HydrophobicContact CD2-CZ 3.72Å; Y145-F199 HydrophobicContact CE2-CD2 4.26Å; Y145-F199 AromaticContact CE2-CE2 3.18Å; Y145-F199 HydrophobicContact CE2-CE2 3.18Å; Y145-F199 AromaticContact CE2-CZ 3.39Å; Y145-F199 HydrophobicContact CE2-CZ 3.39Å; Y145-F199 AromaticContact CZ-CE2 3.98Å; F149-F199 HydrophobicContact CD1-CE1 4.5Å; L186-F199 HydrophobicContact CD2-CD1 3.63Å; L186-F199 HydrophobicContact CD2-CE1 4.2Å; L195-F199 HydrophobicContact CB-CE1 4.27Å; L195-F199 VanDerWaalsContact O-CD1 3.25Å; L195-F199 WeakPolarHBondContact O-CD1 3.2Å; L195-F199 VanDerWaalsContact O-CE1 3.25Å; L195-F199 WeakPolarHBondContact O-CE1 3.49Å; F199-S201 WeakPolarHBondContact CD2-O 3.45Å; F199-L209 HydrophobicContact CB-CD2 4.24Å; F199-L209 HydrophobicContact CD1-CD2 4.01Å; F199-L209 HydrophobicContact CD2-CD2 3.6Å; F199-L209 HydrophobicContact CE1-CD2 4.17Å; F199-L209 HydrophobicContact CE2-CD2 3.79Å; F199-L209 HydrophobicContact CG-CD2 3.69Å; F199-L209 HydrophobicContact CZ-CD2 4.05Å; F199-F211 HydrophobicContact CB-CD1 4.41Å; F199-F211 HydrophobicContact CB-CE1 3.83Å; F199-F211 HydrophobicContact CB-CZ 4.09Å
200	D	89.2	Confident	89.3	Confident	72 Å²	72	55.8 Å²	55.8	39%	0.385	30%	0.295	S	S	.	.	S	Bend	trans	-87.3	-43.6	-172.5	-59.5	-51	0	0	0	112	Y210 F211 D212	D200-Y210 PolarHBondContact N-O 2.91Å; D200-F211 WeakPolarHBondContact OD2-CA 3.14Å; D200-D212 PolarHBondContact OD2-N 2.94Å
201	S	88.1	Confident	89.5	Confident	53 Å²	53	51 Å²	51	37%	0.371	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	165.5	173.6	68.5	0	0	0	0	112.8	F199 Y210	F199-S201 WeakPolarHBondContact CD2-O 3.45Å; S201-Y210 PolarHBondContact O-N 3.35Å; S201-Y210 WeakPolarHBondContact OG-CB 3.45Å; S201-Y210 WeakPolarHBondContact OG-CD2 3.39Å
202	Y	90.4	Very high	89.5	Confident	20 Å²	20	53.3 Å²	53.3	8%	0.078	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	127.2	-179.9	171.8	-106	0	0	0	111.2	A148 F149 A152 N204 N207 E208 L209	A148-Y202 HydrophobicContact CB-CE1 4.14Å; F149-Y202 HydrophobicContact CB-CD1 3.98Å; F149-Y202 HydrophobicContact CB-CD2 4.36Å; F149-Y202 HydrophobicContact CB-CE1 4.01Å; F149-Y202 HydrophobicContact CB-CE2 4.37Å; F149-Y202 HydrophobicContact CB-CG 4.16Å; F149-Y202 HydrophobicContact CD2-CD2 4.15Å; F149-Y202 HydrophobicContact CD2-CE2 4.04Å; A152-Y202 WeakPolarHBondContact CB-OH 3.33Å; Y202-N204 HydrophobicContact CE1-CB 3.9Å; Y202-N207 PolarHBondContact OH-OD1 3.01Å; Y202-E208 WeakPolarHBondContact CA-O 3.43Å; Y202-E208 WeakPolarHBondContact CD2-O 3.49Å; Y202-L209 HydrophobicContact CD2-CD2 3.61Å; Y202-L209 HydrophobicContact CD2-CG 4.08Å; Y202-L209 HydrophobicContact CG-CD2 4.21Å
203	S	90.2	Very high	89.7	Confident	25 Å²	25	52.5 Å²	52.5	18%	0.175	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	113.5	170.3	177.7	0	0	0	0	110.1	K206 N207 E208	S203-K206 PolarHBondContact OG-N 3.4Å; S203-N207 VanDerWaalsContact O-CA 3.32Å; S203-N207 WeakPolarHBondContact O-CA 3.48Å; S203-N207 PolarHBondContact O-N 2.86Å; S203-E208 PolarHBondContact N-O 3.3Å; S203-E208 PolarHBondContact O-N 2.89Å
204	N	85.6	Confident	89.7	Confident	101 Å²	101	55.1 Å²	55.1	54%	0.54	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-34.5	177.2	-170.1	52.6	0	0	0	112.8	A148 Y202	A148-N204 HydrophobicContact CB-CB 4.41Å; Y202-N204 HydrophobicContact CE1-CB 3.9Å
205	E	87	Confident	89.7	Confident	185 Å²	185	53.5 Å²	53.5	86%	0.864	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-39.1	179.2	-63.9	178.4	179.5	0	0	112
206	K	88.8	Confident	89.7	Confident	122 Å²	122	60.7 Å²	60.7	53%	0.53	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-6.3	-177.3	-62	-178.3	-177.7	175.2	0	113.6	S203 E208	S203-K206 PolarHBondContact OG-N 3.4Å; K206-E208 HydrophobicContact CB-CB 3.86Å; K206-E208 WeakPolarHBondContact CD-OE2 3.45Å; K206-E208 PolarHBondContact O-N 2.94Å
207	N	90	Very high	89.9	Confident	20 Å²	20	59.6 Å²	59.6	11%	0.107	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	50.6	-169.1	-175.6	31.3	0	0	0	111.7	A152 V160 Y202 S203	A152-N207 WeakPolarHBondContact CB-OD1 3.44Å; V160-N207 PolarHBondContact N-O 3.39Å; Y202-N207 PolarHBondContact OH-OD1 3.01Å; S203-N207 VanDerWaalsContact O-CA 3.32Å; S203-N207 WeakPolarHBondContact O-CA 3.48Å; S203-N207 PolarHBondContact O-N 2.86Å
208	E	94.1	Very high	90.2	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.009	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.3	-168.7	-177.4	166.8	-152.6	0	0	110.5	V160 N162 R167 Y202 S203 K206 Y210	V160-E208 HydrophobicContact CB-CB 4.23Å; V160-E208 HydrophobicContact CB-CG 4.21Å; V160-E208 HydrophobicContact CG1-CB 4.41Å; V160-E208 HydrophobicContact CG1-CG 3.91Å; V160-E208 WeakPolarHBondContact O-CA 3.43Å; N162-E208 HydrophobicContact CB-CG 3.8Å; N162-E208 WeakPolarHBondContact CB-OE1 3.44Å; N162-E208 PolarHBondContact ND2-OE1 3.49Å; R167-E208 WeakPolarHBondContact CD-OE1 3.43Å; R167-E208 WeakPolarHBondContact CG-OE1 3.44Å; R167-E208 IonicContact NE-OE1 3.56Å; R167-E208 PolarHBondContact NE-OE1 3.42Å; R167-E208 IonicContact NE-OE2 3.59Å; R167-E208 IonicContact NH2-OE2 2.84Å; Y202-E208 WeakPolarHBondContact CA-O 3.43Å; Y202-E208 WeakPolarHBondContact CD2-O 3.49Å; S203-E208 PolarHBondContact N-O 3.3Å; S203-E208 PolarHBondContact O-N 2.89Å; K206-E208 HydrophobicContact CB-CB 3.86Å; K206-E208 WeakPolarHBondContact CD-OE2 3.45Å; K206-E208 PolarHBondContact O-N 2.94Å; E208-Y210 HydrophobicContact CB-CE2 4.41Å; E208-Y210 HydrophobicContact CG-CE2 4.13Å; E208-Y210 PolarHBondContact OE2-OH 3.18Å
209	L	94.3	Very high	90.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.8	176.1	-70.6	168.9	0	0	0	109.9	F149 V159 V160 L161 N162 W172 L186 F199 Y202 F211	F149-L209 HydrophobicContact CD2-CD1 4.48Å; F149-L209 HydrophobicContact CD2-CD2 3.96Å; F149-L209 HydrophobicContact CD2-CG 4.49Å; F149-L209 HydrophobicContact CE2-CD1 3.85Å; F149-L209 HydrophobicContact CE2-CD2 4.09Å; F149-L209 HydrophobicContact CE2-CG 4.33Å; V159-L209 HydrophobicContact CG2-CD1 3.9Å; V159-L209 HydrophobicContact CG2-CG 4.33Å; V160-L209 PolarHBondContact O-N 3Å; L161-L209 HydrophobicContact CD2-CB 4.37Å; L161-L209 HydrophobicContact CD2-CD1 4.02Å; N162-L209 WeakPolarHBondContact CB-O 3.42Å; N162-L209 PolarHBondContact N-O 3.34Å; W172-L209 HydrophobicContact CH2-CD1 4.31Å; L186-L209 HydrophobicContact CD1-CD1 4.16Å; F199-L209 HydrophobicContact CB-CD2 4.24Å; F199-L209 HydrophobicContact CD1-CD2 4.01Å; F199-L209 HydrophobicContact CD2-CD2 3.6Å; F199-L209 HydrophobicContact CE1-CD2 4.17Å; F199-L209 HydrophobicContact CE2-CD2 3.79Å; F199-L209 HydrophobicContact CG-CD2 3.69Å; F199-L209 HydrophobicContact CZ-CD2 4.05Å; Y202-L209 HydrophobicContact CD2-CD2 3.61Å; Y202-L209 HydrophobicContact CD2-CG 4.08Å; Y202-L209 HydrophobicContact CG-CD2 4.21Å; L209-F211 HydrophobicContact CB-CE2 3.82Å; L209-F211 HydrophobicContact CB-CZ 4.2Å
210	Y	94.1	Very high	90.4	Very high	57 Å²	57	55.8 Å²	55.8	22%	0.224	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	138.7	179.8	-64.2	-92.9	0	0	0	111.8	N162 D200 S201 E208	N162-Y210 HydrophobicContact CB-CD1 3.68Å; N162-Y210 HydrophobicContact CB-CE1 3.9Å; N162-Y210 HydrophobicContact CB-CG 4.27Å; N162-Y210 WeakPolarHBondContact ND2-CE1 3.25Å; N162-Y210 CarbonylContact O-C 3.59Å; N162-Y210 WeakPolarHBondContact O-CA 3.48Å; D200-Y210 PolarHBondContact N-O 2.91Å; S201-Y210 PolarHBondContact O-N 3.35Å; S201-Y210 WeakPolarHBondContact OG-CB 3.45Å; S201-Y210 WeakPolarHBondContact OG-CD2 3.39Å; E208-Y210 HydrophobicContact CB-CE2 4.41Å; E208-Y210 HydrophobicContact CG-CE2 4.13Å; E208-Y210 PolarHBondContact OE2-OH 3.18Å
211	F	94.9	Very high	90.7	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.009	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119.6	174.8	-55.3	-92.4	0	0	0	109.1	L161 N162 V163 G164 L183 L186 L198 F199 D200 L209 Q213 W248	L161-F211 HydrophobicContact CB-CE2 4.2Å; L161-F211 HydrophobicContact CD2-CE2 3.96Å; L161-F211 HydrophobicContact CD2-CZ 4.37Å; N162-F211 PolarHBondContact O-N 3.41Å; V163-F211 HydrophobicContact CG2-CB 4.34Å; V163-F211 HydrophobicContact CG2-CD2 4.03Å; V163-F211 HydrophobicContact CG2-CG 4.48Å; G164-F211 PolarHBondContact N-O 2.91Å; L183-F211 HydrophobicContact CD2-CE1 4.28Å; L183-F211 HydrophobicContact CD2-CE2 4.45Å; L183-F211 HydrophobicContact CD2-CZ 3.83Å; L186-F211 HydrophobicContact CD1-CE1 4.2Å; L186-F211 HydrophobicContact CD1-CZ 3.76Å; L198-F211 WeakPolarHBondContact O-CE1 3.33Å; F199-F211 HydrophobicContact CB-CD1 4.41Å; F199-F211 HydrophobicContact CB-CE1 3.83Å; F199-F211 HydrophobicContact CB-CZ 4.09Å; D200-F211 WeakPolarHBondContact OD2-CA 3.14Å; L209-F211 HydrophobicContact CB-CE2 3.82Å; L209-F211 HydrophobicContact CB-CZ 4.2Å; F211-Q213 PolarHBondContact O-N 2.71Å; F211-W248 HydrophobicContact CB-CH2 3.9Å; F211-W248 AromaticContact CD1-CH2 3.69Å; F211-W248 HydrophobicContact CD1-CH2 3.69Å; F211-W248 AromaticContact CD1-CZ3 3.79Å; F211-W248 HydrophobicContact CD1-CZ3 3.79Å; F211-W248 HydrophobicContact CD2-CH2 4.18Å; F211-W248 HydrophobicContact CE1-CH2 4.24Å; F211-W248 AromaticContact CE1-CZ3 3.91Å; F211-W248 HydrophobicContact CE1-CZ3 3.91Å; F211-W248 AromaticContact CG-CH2 3.65Å; F211-W248 HydrophobicContact CG-CH2 3.65Å; F211-W248 HydrophobicContact CG-CZ3 4.18Å; F211-W248 HydrophobicContact CZ-CZ3 4.42Å
212	D	90	Very high	91	Very high	134 Å²	134	49.9 Å²	49.9	72%	0.717	25%	0.245	S	C	*	.			trans	-79.1	65.7	175.8	-76.2	-12.6	0	0	0	110	D200	D200-D212 PolarHBondContact OD2-N 2.94Å
213	Q	89.2	Confident	91.2	Very high	56 Å²	56	49.8 Å²	49.8	26%	0.262	25%	0.25	S	C	.	.	S	Bend	trans	-133	165.5	-177.5	-68.2	-61.4	-1	0	0	113	V163 G164 F211 A215 Y247 W248	V163-Q213 HydrophobicContact CG1-CB 4.03Å; G164-Q213 WeakPolarHBondContact CA-O 3.29Å; G164-Q213 PolarHBondContact N-O 3.07Å; F211-Q213 PolarHBondContact O-N 2.71Å; Q213-A215 PolarHBondContact O-N 2.98Å; Q213-Y247 HydrophobicContact CG-CD1 3.79Å; Q213-Y247 HydrophobicContact CG-CE1 3.46Å; Q213-Y247 VanDerWaalsContact CG-CE1 3.46Å; Q213-Y247 HydrophobicContact CG-CE2 4.3Å; Q213-Y247 HydrophobicContact CG-CG 4.35Å; Q213-Y247 VanDerWaalsContact NE2-CG 3.33Å; Q213-W248 HydrophobicContact CB-CZ2 4.15Å; Q213-W248 HydrophobicContact CG-CZ2 4.32Å
214	Y	83.8	Confident	91.5	Very high	102 Å²	102	48.6 Å²	48.6	40%	0.4	24%	0.242	S	C	.	.			trans	-68.8	111.5	179.9	-173.3	-121.1	0	0	0	111.5	R216 S217 I236	Y214-R216 HydrophobicContact CD1-CB 4.28Å; Y214-R216 HydrophobicContact CE1-CB 3.59Å; Y214-R216 HydrophobicContact CE2-CB 4.29Å; Y214-R216 PolarHBondContact O-N 3.45Å; Y214-R216 WeakPolarHBondContact OH-CD 3.43Å; Y214-S217 PolarHBondContact O-OG 3.38Å; Y214-I236 HydrophobicContact CE1-CG2 4.17Å
215	A	89.5	Confident	92	Very high	12 Å²	12	43.8 Å²	43.8	10%	0.099	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-40.8	-173.7	0	0	0	0	0	114	V163 E166 Q213 S217 F218	V163-A215 WeakPolarHBondContact O-CB 3.32Å; E166-A215 HydrophobicContact CB-CB 3.97Å; E166-A215 HydrophobicContact CG-CB 3.73Å; Q213-A215 PolarHBondContact O-N 2.98Å; A215-S217 VanDerWaalsContact C-N 3.3Å; A215-S217 PolarHBondContact O-N 3.38Å; A215-F218 WeakPolarHBondContact O-CB 3.03Å; A215-F218 PolarHBondContact O-N 3.16Å
216	R	88.4	Confident	92.4	Very high	150 Å²	150	41.5 Å²	41.5	57%	0.566	20%	0.199	S	C	*	.	H	α-helix	trans	-63.2	-31.2	-166.6	-170.3	176.3	-69.8	-177.5	-5.6	113.9	Y214 F218 I236	Y214-R216 HydrophobicContact CD1-CB 4.28Å; Y214-R216 HydrophobicContact CE1-CB 3.59Å; Y214-R216 HydrophobicContact CE2-CB 4.29Å; Y214-R216 PolarHBondContact O-N 3.45Å; Y214-R216 WeakPolarHBondContact OH-CD 3.43Å; R216-F218 VanDerWaalsContact C-N 3.33Å; R216-I236 HydrophobicContact CG-CG2 4.35Å
217	S	89.2	Confident	92.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-78.4	-19.5	176.3	58.2	0	0	0	0	112.9	Y214 A215 G219 S220 I221 D244	Y214-S217 PolarHBondContact O-OG 3.38Å; A215-S217 VanDerWaalsContact C-N 3.3Å; A215-S217 PolarHBondContact O-N 3.38Å; S217-G219 VanDerWaalsContact C-N 3.26Å; S217-G219 PolarHBondContact O-N 3.11Å; S217-S220 WeakPolarHBondContact O-CB 3.5Å; S217-S220 PolarHBondContact O-N 3.47Å; S217-S220 VanDerWaalsContact O-N 3.07Å; S217-I221 PolarHBondContact O-N 3.21Å; S217-D244 VanDerWaalsContact CB-OD2 3.28Å; S217-D244 WeakPolarHBondContact CB-OD2 3.31Å; S217-D244 PolarHBondContact OG-OD2 3.06Å
218	F	94.9	Very high	92.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-27.8	-170.9	-170.3	-105.8	0	0	0	113.1	L161 V163 H168 L183 A215 R216 S220 I221 L222 W248	L161-F218 HydrophobicContact CD1-CE1 4.38Å; L161-F218 HydrophobicContact CD1-CZ 3.87Å; V163-F218 HydrophobicContact CB-CB 4.45Å; V163-F218 HydrophobicContact CB-CD1 4.36Å; V163-F218 HydrophobicContact CB-CD2 4.47Å; V163-F218 HydrophobicContact CB-CG 4.18Å; V163-F218 HydrophobicContact CG1-CB 4.15Å; V163-F218 HydrophobicContact CG1-CD2 4.22Å; V163-F218 HydrophobicContact CG1-CG 4.15Å; V163-F218 HydrophobicContact CG2-CD1 3.85Å; V163-F218 HydrophobicContact CG2-CD2 3.86Å; V163-F218 HydrophobicContact CG2-CE1 3.84Å; V163-F218 HydrophobicContact CG2-CE2 3.86Å; V163-F218 HydrophobicContact CG2-CG 3.84Å; V163-F218 HydrophobicContact CG2-CZ 3.85Å; H168-F218 HydrophobicContact CB-CD1 4.48Å; H168-F218 HydrophobicContact CB-CE1 3.98Å; H168-F218 AromaticContact CD2-CD1 3.39Å; H168-F218 WeakPolarHBondContact CD2-CD1 3.39Å; H168-F218 AromaticContact CD2-CE1 3.66Å; H168-F218 AromaticContact CG-CD1 3.78Å; H168-F218 AromaticContact CG-CE1 3.78Å; H168-F218 AromaticContact NE2-CD1 3.56Å; L183-F218 HydrophobicContact CD1-CE2 3.92Å; L183-F218 HydrophobicContact CD1-CZ 3.81Å; A215-F218 WeakPolarHBondContact O-CB 3.03Å; A215-F218 PolarHBondContact O-N 3.16Å; R216-F218 VanDerWaalsContact C-N 3.33Å; F218-S220 VanDerWaalsContact C-N 3.27Å; F218-S220 PolarHBondContact O-N 3.44Å; F218-I221 HydrophobicContact CD2-CB 4.02Å; F218-I221 HydrophobicContact CD2-CG2 3.95Å; F218-I221 HydrophobicContact CE2-CB 4.48Å; F218-I221 HydrophobicContact CE2-CG2 3.98Å; F218-I221 WeakPolarHBondContact O-CB 3.38Å; F218-I221 PolarHBondContact O-N 2.77Å; F218-I221 VanDerWaalsContact O-N 3.17Å; F218-L222 HydrophobicContact CD1-CB 4.4Å; F218-L222 HydrophobicContact CE1-CB 4.11Å; F218-L222 HydrophobicContact CE1-CD2 4.13Å; F218-L222 HydrophobicContact CZ-CB 4.46Å; F218-L222 WeakPolarHBondContact O-CB 3.16Å; F218-L222 PolarHBondContact O-N 3.48Å; F218-W248 HydrophobicContact CD2-CD2 4.35Å; F218-W248 AromaticContact CD2-CE2 3.67Å; F218-W248 HydrophobicContact CD2-CH2 4Å; F218-W248 AromaticContact CD2-CZ2 3.49Å; F218-W248 HydrophobicContact CD2-CZ2 3.49Å; F218-W248 VanDerWaalsContact CD2-CZ2 3.49Å; F218-W248 HydrophobicContact CE2-CD2 4.18Å; F218-W248 AromaticContact CE2-CE2 3.87Å; F218-W248 HydrophobicContact CE2-CE3 4.19Å; F218-W248 AromaticContact CE2-CH2 3.63Å; F218-W248 HydrophobicContact CE2-CH2 3.63Å; F218-W248 AromaticContact CE2-CZ2 3.61Å; F218-W248 HydrophobicContact CE2-CZ2 3.61Å; F218-W248 AromaticContact CE2-CZ3 3.94Å; F218-W248 HydrophobicContact CE2-CZ3 3.94Å
219	G	93.4	Very high	92.9	Very high	45 Å²	45	43.7 Å²	43.7	46%	0.464	22%	0.224	S	C	.	.	H	α-helix	trans	-53.6	-44.3	171.8	0	0	0	0	0	112.5	S217 G223	S217-G219 VanDerWaalsContact C-N 3.26Å; S217-G219 PolarHBondContact O-N 3.11Å; G219-G223 PolarHBondContact O-N 3.1Å
220	S	93	Very high	92.9	Very high	14 Å²	14	43.7 Å²	43.7	10%	0.098	22%	0.224	C	C	.	.	H	α-helix	trans	-69.7	-42.2	174.7	-84.7	0	0	0	0	113.2	S217 F218 L222 G223 V224 H231 L233	S217-S220 WeakPolarHBondContact O-CB 3.5Å; S217-S220 PolarHBondContact O-N 3.47Å; S217-S220 VanDerWaalsContact O-N 3.07Å; F218-S220 VanDerWaalsContact C-N 3.27Å; F218-S220 PolarHBondContact O-N 3.44Å; S220-L222 VanDerWaalsContact C-N 3.3Å; S220-L222 PolarHBondContact O-N 3.14Å; S220-G223 WeakPolarHBondContact O-CA 3.2Å; S220-G223 PolarHBondContact O-N 3.03Å; S220-G223 VanDerWaalsContact O-N 3.14Å; S220-V224 WeakPolarHBondContact O-CG2 3.38Å; S220-V224 PolarHBondContact O-N 3.1Å; S220-H231 VanDerWaalsContact CB-O 3.23Å; S220-H231 WeakPolarHBondContact CB-O 3.49Å; S220-H231 PolarHBondContact OG-O 3.35Å; S220-L233 WeakPolarHBondContact OG-CD1 3.28Å
221	I	95.8	Very high	93	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-55.9	-48.9	176.3	-59.8	-59.7	0	0	0	109.9	S217 F218 G223 V224 Y225 F241 L245 W248 I250	S217-I221 PolarHBondContact O-N 3.21Å; F218-I221 HydrophobicContact CD2-CB 4.02Å; F218-I221 HydrophobicContact CD2-CG2 3.95Å; F218-I221 HydrophobicContact CE2-CB 4.48Å; F218-I221 HydrophobicContact CE2-CG2 3.98Å; F218-I221 WeakPolarHBondContact O-CB 3.38Å; F218-I221 PolarHBondContact O-N 2.77Å; F218-I221 VanDerWaalsContact O-N 3.17Å; I221-G223 VanDerWaalsContact C-N 3.33Å; I221-V224 PolarHBondContact O-N 3.19Å; I221-Y225 HydrophobicContact CG2-CE2 4.4Å; I221-Y225 VanDerWaalsContact O-CD2 3.23Å; I221-Y225 WeakPolarHBondContact O-CD2 3.44Å; I221-Y225 WeakPolarHBondContact O-CE2 3.41Å; I221-F241 HydrophobicContact CD1-CE2 4.49Å; I221-L245 HydrophobicContact CD1-CD2 3.51Å; I221-L245 HydrophobicContact CD1-CG 4.35Å; I221-W248 HydrophobicContact CD1-CG 4.43Å; I221-W248 HydrophobicContact CG1-CG 4.32Å; I221-W248 HydrophobicContact CG2-CB 3.83Å; I221-W248 HydrophobicContact CG2-CD2 3.98Å; I221-W248 HydrophobicContact CG2-CG 3.52Å; I221-I250 HydrophobicContact CB-CD1 4.09Å; I221-I250 HydrophobicContact CD1-CD1 4.01Å; I221-I250 HydrophobicContact CG2-CD1 3.49Å; I221-I250 VanDerWaalsContact CG2-CD1 3.49Å; I221-I250 WeakPolarHBondContact O-CD1 3.09Å
222	L	95.3	Very high	93	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-69.9	-32.6	178.9	-174.8	57.6	0	0	0	112.2	H168 V170 L175 F218 S220 V224 Y225 R226	H168-L222 HydrophobicContact CB-CD2 4.11Å; V170-L222 HydrophobicContact CG1-CD1 3.59Å; V170-L222 HydrophobicContact CG1-CD2 3.63Å; V170-L222 HydrophobicContact CG1-CG 4.21Å; L175-L222 HydrophobicContact CD2-CD1 4.43Å; F218-L222 HydrophobicContact CD1-CB 4.4Å; F218-L222 HydrophobicContact CE1-CB 4.11Å; F218-L222 HydrophobicContact CE1-CD2 4.13Å; F218-L222 HydrophobicContact CZ-CB 4.46Å; F218-L222 WeakPolarHBondContact O-CB 3.16Å; F218-L222 PolarHBondContact O-N 3.48Å; S220-L222 VanDerWaalsContact C-N 3.3Å; S220-L222 PolarHBondContact O-N 3.14Å; L222-V224 PolarHBondContact O-N 3.31Å; L222-Y225 HydrophobicContact CD1-CD2 4.49Å; L222-Y225 PolarHBondContact O-N 3.03Å; L222-Y225 VanDerWaalsContact O-N 3.17Å; L222-R226 VanDerWaalsContact CD2-NH2 3.34Å; L222-R226 PolarHBondContact O-N 3.46Å
223	G	94.3	Very high	93	Very high	17 Å²	17	41.7 Å²	41.7	18%	0.175	21%	0.213	C	C	.	.	H	α-helix	trans	-50.8	-42.9	171.1	0	0	0	0	0	112.5	G219 S220 I221 Y225 R226 T227	G219-G223 PolarHBondContact O-N 3.1Å; S220-G223 WeakPolarHBondContact O-CA 3.2Å; S220-G223 PolarHBondContact O-N 3.03Å; S220-G223 VanDerWaalsContact O-N 3.14Å; I221-G223 VanDerWaalsContact C-N 3.33Å; G223-Y225 VanDerWaalsContact C-N 3.31Å; G223-Y225 PolarHBondContact O-N 3.27Å; G223-R226 CarbonylContact O-C 3.59Å; G223-R226 WeakPolarHBondContact O-CA 3.23Å; G223-R226 WeakPolarHBondContact O-CB 3.47Å; G223-R226 PolarHBondContact O-N 2.96Å; G223-T227 PolarHBondContact O-N 2.98Å; G223-T227 PolarHBondContact O-OG1 2.91Å; G223-T227 VanDerWaalsContact O-OG1 3.06Å
224	V	96.1	Very high	92.8	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-39.1	179.6	-165	0	0	0	0	112.3	L178 S220 I221 L222 R226 G228 L230 I250 Q254	L178-V224 HydrophobicContact CD1-CB 4.26Å; L178-V224 HydrophobicContact CD1-CG1 3.81Å; S220-V224 WeakPolarHBondContact O-CG2 3.38Å; S220-V224 PolarHBondContact O-N 3.1Å; I221-V224 PolarHBondContact O-N 3.19Å; L222-V224 PolarHBondContact O-N 3.31Å; V224-R226 PolarHBondContact O-N 3.36Å; V224-G228 WeakPolarHBondContact O-CA 2.86Å; V224-G228 PolarHBondContact O-N 2.86Å; V224-L230 HydrophobicContact CG2-CB 3.71Å; V224-L230 HydrophobicContact CG2-CD1 3.48Å; V224-L230 VanDerWaalsContact CG2-CD1 3.48Å; V224-L230 HydrophobicContact CG2-CG 4.17Å; V224-I250 HydrophobicContact CB-CD1 4.21Å; V224-I250 HydrophobicContact CG2-CD1 3.97Å; V224-I250 HydrophobicContact CG2-CG2 4.19Å; V224-Q254 HydrophobicContact CG1-CB 4.43Å
225	Y	96.3	Very high	93	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.5	-22.3	176.1	-60.2	-100.1	0	0	0	112.2	T174 L175 R177 L178 S181 L183 I221 L222 G223 I250	T174-Y225 WeakPolarHBondContact CG2-O 3.45Å; L175-Y225 HydrophobicContact CD2-CD1 4.09Å; L175-Y225 HydrophobicContact CD2-CE1 4.29Å; L175-Y225 HydrophobicContact CD2-CG 4.3Å; R177-Y225 VanDerWaalsContact CD-O 3.24Å; R177-Y225 WeakPolarHBondContact CD-O 3.35Å; R177-Y225 PolarHBondContact NH1-O 2.86Å; L178-Y225 HydrophobicContact CB-CD1 4.02Å; L178-Y225 HydrophobicContact CB-CE1 3.71Å; L178-Y225 HydrophobicContact CD1-CD1 3.92Å; L178-Y225 HydrophobicContact CD1-CD2 4.29Å; L178-Y225 HydrophobicContact CD1-CE1 3.92Å; L178-Y225 HydrophobicContact CD1-CE2 4.25Å; L178-Y225 HydrophobicContact CD1-CG 4.13Å; L178-Y225 HydrophobicContact CG-CD1 4.11Å; L178-Y225 HydrophobicContact CG-CE1 4.2Å; S181-Y225 WeakPolarHBondContact CB-OH 3.37Å; S181-Y225 VanDerWaalsContact OG-CE1 3.28Å; S181-Y225 WeakPolarHBondContact OG-CE1 3.18Å; S181-Y225 VanDerWaalsContact OG-CZ 3.3Å; S181-Y225 PolarHBondContact OG-OH 2.87Å; L183-Y225 HydrophobicContact CB-CE1 4.11Å; L183-Y225 WeakPolarHBondContact CB-OH 3.46Å; L183-Y225 HydrophobicContact CD1-CE2 4.01Å; I221-Y225 HydrophobicContact CG2-CE2 4.4Å; I221-Y225 VanDerWaalsContact O-CD2 3.23Å; I221-Y225 WeakPolarHBondContact O-CD2 3.44Å; I221-Y225 WeakPolarHBondContact O-CE2 3.41Å; L222-Y225 HydrophobicContact CD1-CD2 4.49Å; L222-Y225 PolarHBondContact O-N 3.03Å; L222-Y225 VanDerWaalsContact O-N 3.17Å; G223-Y225 VanDerWaalsContact C-N 3.31Å; G223-Y225 PolarHBondContact O-N 3.27Å; Y225-I250 HydrophobicContact CE2-CD1 4Å
226	R	95.4	Very high	93	Very high	136 Å²	136	46.1 Å²	46.1	51%	0.513	24%	0.241	S	C	.	.	H	α-helix	trans	-92	-41.4	-177.9	-66.7	173.3	175.9	168.4	-3.6	112.6	T174 R177 L222 G223 V224	T174-R226 HydrophobicContact CG2-CG 4.1Å; R177-R226 PolarHBondContact NH1-O 3.42Å; L222-R226 VanDerWaalsContact CD2-NH2 3.34Å; L222-R226 PolarHBondContact O-N 3.46Å; G223-R226 CarbonylContact O-C 3.59Å; G223-R226 WeakPolarHBondContact O-CA 3.23Å; G223-R226 WeakPolarHBondContact O-CB 3.47Å; G223-R226 PolarHBondContact O-N 2.96Å; V224-R226 PolarHBondContact O-N 3.36Å
227	T	94.5	Very high	93.1	Very high	73 Å²	73	42.5 Å²	42.5	45%	0.448	24%	0.237	S	C	.	.	H	α-helix	trans	-104.3	-30.1	-175.9	62.3	0	0	0	0	112.2	G223 H229	G223-T227 PolarHBondContact O-N 2.98Å; G223-T227 PolarHBondContact O-OG1 2.91Å; G223-T227 VanDerWaalsContact O-OG1 3.06Å; T227-H229 VanDerWaalsContact C-N 3.33Å; T227-H229 PolarHBondContact O-CD2 3.35Å; T227-H229 PolarHBondContact OG1-N 3.23Å; T227-H229 VanDerWaalsContact OG1-N 3.11Å; T227-H229 PolarHBondContact OG1-O 3.46Å; T227-H229 VanDerWaalsContact OG1-O 3.11Å
228	G	93.4	Very high	93.3	Very high	30 Å²	30	42.5 Å²	42.5	31%	0.309	24%	0.237	S	C	.	.	S	Bend	trans	91.2	-5.6	-167.9	0	0	0	0	0	113.5	V224	V224-G228 WeakPolarHBondContact O-CA 2.86Å; V224-G228 PolarHBondContact O-N 2.86Å
229	H	94.4	Very high	93.2	Very high	88 Å²	88	44.7 Å²	44.7	41%	0.407	25%	0.25	S	S	.	.			trans	-121.7	136.1	-173	-58.9	-81.8	0	0	0	110.6	T227 E256	T227-H229 VanDerWaalsContact C-N 3.33Å; T227-H229 PolarHBondContact O-CD2 3.35Å; T227-H229 PolarHBondContact OG1-N 3.23Å; T227-H229 VanDerWaalsContact OG1-N 3.11Å; T227-H229 PolarHBondContact OG1-O 3.46Å; T227-H229 VanDerWaalsContact OG1-O 3.11Å; H229-E256 HydrophobicContact CB-CB 4.33Å; H229-E256 IonicContact CE1-OE2 2.85Å; H229-E256 PolarHBondContact CE1-OE2 3.03Å; H229-E256 VanDerWaalsContact CE1-OE2 3.28Å; H229-E256 IonicContact CG-OE2 3.71Å; H229-E256 VanDerWaalsContact CG-OE2 3.31Å; H229-E256 IonicContact ND1-OE2 3.95Å; H229-E256 PolarHBondContact ND1-OE2 3.37Å
230	L	95.8	Very high	93	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-95	126.5	178.8	177.3	65	0	0	0	110.3	V224 F241 L245 I250 Q254 L255 E256	V224-L230 HydrophobicContact CG2-CB 3.71Å; V224-L230 HydrophobicContact CG2-CD1 3.48Å; V224-L230 VanDerWaalsContact CG2-CD1 3.48Å; V224-L230 HydrophobicContact CG2-CG 4.17Å; L230-F241 HydrophobicContact CD1-CZ 3.96Å; L230-L245 HydrophobicContact CD1-CD2 3.9Å; L230-L245 HydrophobicContact CD2-CD1 3.92Å; L230-L245 HydrophobicContact CD2-CD2 3.48Å; L230-L245 VanDerWaalsContact CD2-CD2 3.48Å; L230-L245 HydrophobicContact CD2-CG 4.38Å; L230-L245 HydrophobicContact CG-CD2 4.35Å; L230-I250 HydrophobicContact CD2-CG2 4.1Å; L230-Q254 HydrophobicContact CB-CB 4.09Å; L230-Q254 WeakPolarHBondContact CB-O 3.45Å; L230-Q254 PolarHBondContact N-O 2.78Å; L230-L255 HydrophobicContact CD2-CD2 4.1Å; L230-L255 HydrophobicContact CD2-CG 3.91Å; L230-L255 HydrophobicContact CG-CD2 3.98Å; L230-L255 HydrophobicContact CG-CG 4.25Å; L230-L255 WeakPolarHBondContact O-CA 3.5Å; L230-E256 PolarHBondContact O-N 2.93Å
231	H	95.1	Very high	93.1	Very high	77 Å²	77	43.7 Å²	43.7	36%	0.356	24%	0.238	S	C	.	.			trans	-110.3	137.1	174.6	-66.4	-79.9	0	0	0	110.7	S220 C258	S220-H231 VanDerWaalsContact CB-O 3.23Å; S220-H231 WeakPolarHBondContact CB-O 3.49Å; S220-H231 PolarHBondContact OG-O 3.35Å; H231-C258 PolarHBondContact ND1-SG 3.09Å
232	F	94.6	Very high	93	Very high	17 Å²	17	47.1 Å²	47.1	8%	0.075	25%	0.254	C	S	.	.			trans	-90.9	134.1	176.9	176.3	-122.7	0	0	0	110.8	I236 V238 F241 L255 C259 Y263 K266	F232-I236 HydrophobicContact CE2-CD1 4.25Å; F232-I236 HydrophobicContact CE2-CG1 3.96Å; F232-V238 HydrophobicContact CE2-CG2 4.33Å; F232-V238 HydrophobicContact CZ-CB 4.25Å; F232-V238 HydrophobicContact CZ-CG2 4.2Å; F232-F241 HydrophobicContact CB-CE1 4.49Å; F232-F241 AromaticContact CD2-CD1 3.57Å; F232-F241 HydrophobicContact CD2-CD1 3.57Å; F232-F241 AromaticContact CD2-CE1 3.72Å; F232-F241 HydrophobicContact CD2-CE1 3.72Å; F232-F241 HydrophobicContact CD2-CG 4.21Å; F232-F241 HydrophobicContact CD2-CZ 4.47Å; F232-F241 HydrophobicContact CE2-CB 4.39Å; F232-F241 AromaticContact CE2-CD1 3.96Å; F232-F241 HydrophobicContact CE2-CD1 3.96Å; F232-F241 HydrophobicContact CE2-CG 4.3Å; F232-L255 HydrophobicContact CB-CD2 4.21Å; F232-C259 HydrophobicContact CB-CB 3.97Å; F232-C259 PolarHBondContact N-SG 3.21Å; F232-Y263 HydrophobicContact CD1-CD2 4.48Å; F232-Y263 AromaticContact CD2-CD2 3.73Å; F232-Y263 HydrophobicContact CD2-CD2 3.73Å; F232-Y263 AromaticContact CE2-CD2 3.96Å; F232-Y263 HydrophobicContact CE2-CD2 3.96Å; F232-Y263 HydrophobicContact CG-CD2 4.01Å; F232-Y263 HydrophobicContact CZ-CD2 4.44Å; F232-K266 HydrophobicContact CE1-CD 4.14Å; F232-K266 HydrophobicContact CZ-CD 4.06Å
233	L	90.5	Very high	92.9	Very high	57 Å²	57	51.8 Å²	51.8	30%	0.298	28%	0.278	S	S	.	.			trans	-88.5	134.6	172.6	-78.5	74.5	0	0	0	109.7	S220 D235 I236	S220-L233 WeakPolarHBondContact OG-CD1 3.28Å; L233-D235 PolarHBondContact O-N 3.5Å; L233-I236 HydrophobicContact CB-CD1 3.96Å; L233-I236 HydrophobicContact CB-CG1 3.97Å; L233-I236 HydrophobicContact CB-CG2 4.4Å; L233-I236 VanDerWaalsContact O-CG1 3.26Å; L233-I236 WeakPolarHBondContact O-CG1 3.45Å
234	E	85	Confident	92.8	Very high	108 Å²	108	51.4 Å²	51.4	51%	0.505	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-29.6	-176.7	-64.6	-176.9	178	0	0	112.6	I236 K262 K266	E234-I236 VanDerWaalsContact C-N 3.29Å; E234-I236 PolarHBondContact O-N 2.88Å; E234-K262 WeakPolarHBondContact OE1-CD 3.43Å; E234-K262 WeakPolarHBondContact OE1-CE 3.35Å; E234-K262 IonicContact OE1-NZ 3.28Å; E234-K262 PolarHBondContact OE1-NZ 3.47Å; E234-K266 PolarHBondContact O-NZ 3.06Å
235	D	88.2	Confident	92.8	Very high	148 Å²	148	51.4 Å²	51.4	79%	0.791	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	4.4	-172.8	-61.2	-26.2	0	0	0	115	L233	L233-D235 PolarHBondContact O-N 3.5Å
236	I	89.7	Confident	92.7	Very high	7 Å²	7	60.2 Å²	60.2	4%	0.036	31%	0.311	C	S	.	.	S	Bend	trans	-106.4	154.3	-180	62.1	175.7	0	0	0	111.9	Y214 R216 F232 L233 E234 V238 F241 K266	Y214-I236 HydrophobicContact CE1-CG2 4.17Å; R216-I236 HydrophobicContact CG-CG2 4.35Å; F232-I236 HydrophobicContact CE2-CD1 4.25Å; F232-I236 HydrophobicContact CE2-CG1 3.96Å; L233-I236 HydrophobicContact CB-CD1 3.96Å; L233-I236 HydrophobicContact CB-CG1 3.97Å; L233-I236 HydrophobicContact CB-CG2 4.4Å; L233-I236 VanDerWaalsContact O-CG1 3.26Å; L233-I236 WeakPolarHBondContact O-CG1 3.45Å; E234-I236 VanDerWaalsContact C-N 3.29Å; E234-I236 PolarHBondContact O-N 2.88Å; I236-V238 PolarHBondContact O-N 3.1Å; I236-F241 HydrophobicContact CD1-CB 3.67Å; I236-F241 HydrophobicContact CD1-CD1 4.47Å; I236-F241 HydrophobicContact CD1-CD2 3.26Å; I236-F241 HydrophobicContact CD1-CE2 3.93Å; I236-F241 HydrophobicContact CD1-CG 3.56Å; I236-F241 HydrophobicContact CG1-CB 4.35Å; I236-K266 PolarHBondContact O-NZ 2.86Å
237	C	91	Very high	92.6	Very high	73 Å²	73	55.6 Å²	55.6	49%	0.493	29%	0.294	S	S	.	.			trans	-66.3	121	171	176.5	0	0	0	0	109.3	V239 A240 F241	C237-V239 PolarHBondContact O-N 2.78Å; C237-A240 HydrophobicContact CB-CB 3.93Å; C237-A240 PolarHBondContact O-N 3.15Å; C237-A240 VanDerWaalsContact O-N 3.12Å; C237-F241 PolarHBondContact O-N 3.06Å
238	V	93.7	Very high	92.7	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-32.4	-178.2	69.2	0	0	0	0	112.7	F232 I236 K242 Y263 K266 K267 V270	F232-V238 HydrophobicContact CE2-CG2 4.33Å; F232-V238 HydrophobicContact CZ-CB 4.25Å; F232-V238 HydrophobicContact CZ-CG2 4.2Å; I236-V238 PolarHBondContact O-N 3.1Å; V238-K242 WeakPolarHBondContact O-CB 3.34Å; V238-K242 PolarHBondContact O-N 3.21Å; V238-Y263 HydrophobicContact CG2-CD2 3.65Å; V238-Y263 HydrophobicContact CG2-CE2 3.49Å; V238-Y263 VanDerWaalsContact CG2-CE2 3.49Å; V238-K266 HydrophobicContact CB-CG 4.2Å; V238-K266 HydrophobicContact CG1-CG 4.2Å; V238-K267 HydrophobicContact CG1-CB 4.44Å; V238-K267 HydrophobicContact CG2-CB 3.71Å; V238-K267 HydrophobicContact CG2-CG 4.49Å; V238-V270 HydrophobicContact CG1-CB 4Å; V238-V270 HydrophobicContact CG1-CG1 4.42Å; V238-V270 HydrophobicContact CG1-CG2 3.97Å
239	V	91	Very high	92.8	Very high	45 Å²	45	52.8 Å²	52.8	27%	0.273	28%	0.279	S	S	.	.	H	α-helix	trans	-70	-42.5	176.2	-179.7	0	0	0	0	110.8	C237 K242 N243 V270 L274	C237-V239 PolarHBondContact O-N 2.78Å; V239-K242 PolarHBondContact O-N 3.42Å; V239-N243 VanDerWaalsContact O-CG 3.31Å; V239-N243 PolarHBondContact O-N 3.3Å; V239-N243 VanDerWaalsContact O-N 3.1Å; V239-N243 PolarHBondContact O-ND2 3.2Å; V239-V270 HydrophobicContact CG2-CG1 3.68Å; V239-L274 HydrophobicContact CG2-CD1 4.09Å
240	A	90.8	Very high	92.8	Very high	37 Å²	37	49 Å²	49	31%	0.306	26%	0.262	S	S	.	.	H	α-helix	trans	-64.1	-45.4	175.2	0	0	0	0	0	110.8	C237 K242 N243 D244	C237-A240 HydrophobicContact CB-CB 3.93Å; C237-A240 PolarHBondContact O-N 3.15Å; C237-A240 VanDerWaalsContact O-N 3.12Å; A240-K242 VanDerWaalsContact C-N 3.32Å; A240-K242 PolarHBondContact O-N 2.66Å; A240-N243 WeakPolarHBondContact O-CB 3.39Å; A240-N243 PolarHBondContact O-N 2.95Å; A240-D244 PolarHBondContact O-N 3.49Å
241	F	94.4	Very high	92.7	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-41.6	176.8	-170.7	-119.1	0	0	0	112.6	I221 L230 F232 I236 C237 N243 D244 L245 Y263	I221-F241 HydrophobicContact CD1-CE2 4.49Å; L230-F241 HydrophobicContact CD1-CZ 3.96Å; F232-F241 HydrophobicContact CB-CE1 4.49Å; F232-F241 AromaticContact CD2-CD1 3.57Å; F232-F241 HydrophobicContact CD2-CD1 3.57Å; F232-F241 AromaticContact CD2-CE1 3.72Å; F232-F241 HydrophobicContact CD2-CE1 3.72Å; F232-F241 HydrophobicContact CD2-CG 4.21Å; F232-F241 HydrophobicContact CD2-CZ 4.47Å; F232-F241 HydrophobicContact CE2-CB 4.39Å; F232-F241 AromaticContact CE2-CD1 3.96Å; F232-F241 HydrophobicContact CE2-CD1 3.96Å; F232-F241 HydrophobicContact CE2-CG 4.3Å; I236-F241 HydrophobicContact CD1-CB 3.67Å; I236-F241 HydrophobicContact CD1-CD1 4.47Å; I236-F241 HydrophobicContact CD1-CD2 3.26Å; I236-F241 HydrophobicContact CD1-CE2 3.93Å; I236-F241 HydrophobicContact CD1-CG 3.56Å; I236-F241 HydrophobicContact CG1-CB 4.35Å; C237-F241 PolarHBondContact O-N 3.06Å; F241-N243 VanDerWaalsContact C-N 3.33Å; F241-N243 PolarHBondContact O-N 2.69Å; F241-D244 WeakPolarHBondContact O-CB 3.41Å; F241-D244 PolarHBondContact O-N 3.5Å; F241-L245 HydrophobicContact CD1-CD1 3.98Å; F241-L245 HydrophobicContact CD1-CG 4.38Å; F241-L245 HydrophobicContact CE1-CD1 3.82Å; F241-L245 HydrophobicContact CE1-CD2 4.4Å; F241-L245 HydrophobicContact CE1-CG 4.21Å; F241-L245 HydrophobicContact CZ-CD1 4.47Å; F241-L245 HydrophobicContact CZ-CD2 4.25Å; F241-L245 HydrophobicContact CZ-CG 4.43Å; F241-L245 WeakPolarHBondContact O-CG 3.24Å; F241-L245 PolarHBondContact O-N 2.91Å; F241-Y263 HydrophobicContact CD1-CD2 4.13Å; F241-Y263 AromaticContact CD1-CE2 3.8Å; F241-Y263 HydrophobicContact CD1-CE2 3.8Å; F241-Y263 HydrophobicContact CE1-CE2 4.44Å
242	K	93.7	Very high	92.5	Very high	73 Å²	73	50.6 Å²	50.6	32%	0.317	27%	0.272	S	S	.	.	H	α-helix	trans	-59	-44.3	173.7	-176.7	-179.6	179.4	-171.4	0	111.9	V238 V239 A240 D244 L245 F246 E252	V238-K242 WeakPolarHBondContact O-CB 3.34Å; V238-K242 PolarHBondContact O-N 3.21Å; V239-K242 PolarHBondContact O-N 3.42Å; A240-K242 VanDerWaalsContact C-N 3.32Å; A240-K242 PolarHBondContact O-N 2.66Å; K242-D244 VanDerWaalsContact C-N 3.3Å; K242-D244 PolarHBondContact O-N 2.98Å; K242-L245 PolarHBondContact O-N 3.02Å; K242-F246 PolarHBondContact O-N 3.32Å; K242-E252 VanDerWaalsContact CE-OE1 3.23Å; K242-E252 WeakPolarHBondContact CE-OE1 3.27Å; K242-E252 WeakPolarHBondContact CG-OE1 3.2Å
243	N	92.8	Very high	92.3	Very high	98 Å²	98	57.8 Å²	57.8	52%	0.524	30%	0.3	S	S	.	.	H	α-helix	trans	-65	-37.4	177.6	-66.9	-18.2	0	0	0	111.4	V239 A240 F241 F246 Y247	V239-N243 VanDerWaalsContact O-CG 3.31Å; V239-N243 PolarHBondContact O-N 3.3Å; V239-N243 VanDerWaalsContact O-N 3.1Å; V239-N243 PolarHBondContact O-ND2 3.2Å; A240-N243 WeakPolarHBondContact O-CB 3.39Å; A240-N243 PolarHBondContact O-N 2.95Å; F241-N243 VanDerWaalsContact C-N 3.33Å; F241-N243 PolarHBondContact O-N 2.69Å; N243-F246 PolarHBondContact O-N 3.47Å; N243-Y247 WeakPolarHBondContact O-CB 3.47Å; N243-Y247 PolarHBondContact O-N 2.85Å
244	D	93.3	Very high	92.3	Very high	9 Å²	9	56.5 Å²	56.5	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-62.8	-48.3	174	-66.5	-20.5	0	0	0	110.8	S217 A240 F241 K242 F246 Y247 W248	S217-D244 VanDerWaalsContact CB-OD2 3.28Å; S217-D244 WeakPolarHBondContact CB-OD2 3.31Å; S217-D244 PolarHBondContact OG-OD2 3.06Å; A240-D244 PolarHBondContact O-N 3.49Å; F241-D244 WeakPolarHBondContact O-CB 3.41Å; F241-D244 PolarHBondContact O-N 3.5Å; K242-D244 VanDerWaalsContact C-N 3.3Å; K242-D244 PolarHBondContact O-N 2.98Å; D244-F246 VanDerWaalsContact C-N 3.27Å; D244-F246 PolarHBondContact O-N 3.41Å; D244-Y247 PolarHBondContact O-N 3.12Å; D244-Y247 VanDerWaalsContact O-N 3.1Å; D244-W248 PolarHBondContact O-N 3.44Å
245	L	94.7	Very high	92.8	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-54.5	-45.6	175.9	-69.4	174.5	0	0	0	111.5	I221 L230 F241 K242 W248 G249 I250 E252	I221-L245 HydrophobicContact CD1-CD2 3.51Å; I221-L245 HydrophobicContact CD1-CG 4.35Å; L230-L245 HydrophobicContact CD1-CD2 3.9Å; L230-L245 HydrophobicContact CD2-CD1 3.92Å; L230-L245 HydrophobicContact CD2-CD2 3.48Å; L230-L245 VanDerWaalsContact CD2-CD2 3.48Å; L230-L245 HydrophobicContact CD2-CG 4.38Å; L230-L245 HydrophobicContact CG-CD2 4.35Å; F241-L245 HydrophobicContact CD1-CD1 3.98Å; F241-L245 HydrophobicContact CD1-CG 4.38Å; F241-L245 HydrophobicContact CE1-CD1 3.82Å; F241-L245 HydrophobicContact CE1-CD2 4.4Å; F241-L245 HydrophobicContact CE1-CG 4.21Å; F241-L245 HydrophobicContact CZ-CD1 4.47Å; F241-L245 HydrophobicContact CZ-CD2 4.25Å; F241-L245 HydrophobicContact CZ-CG 4.43Å; F241-L245 WeakPolarHBondContact O-CG 3.24Å; F241-L245 PolarHBondContact O-N 2.91Å; K242-L245 PolarHBondContact O-N 3.02Å; L245-W248 PolarHBondContact O-N 3.17Å; L245-G249 PolarHBondContact O-N 3.45Å; L245-I250 CarbonylContact C-O 3.55Å; L245-I250 HydrophobicContact CD2-CB 3.88Å; L245-I250 HydrophobicContact CD2-CG2 3.69Å; L245-I250 PolarHBondContact O-N 3.02Å; L245-E252 HydrophobicContact CD1-CG 4.06Å
246	F	94.4	Very high	93	Very high	184 Å²	184	47.4 Å²	47.4	81%	0.807	25%	0.245	S	C	*	.	H	α-helix	trans	-62.2	-46	175.5	-178.9	-98.2	0	0	0	112.4	K242 N243 D244 W248 G249	K242-F246 PolarHBondContact O-N 3.32Å; N243-F246 PolarHBondContact O-N 3.47Å; D244-F246 VanDerWaalsContact C-N 3.27Å; D244-F246 PolarHBondContact O-N 3.41Å; F246-W248 PolarHBondContact O-N 3.29Å; F246-G249 PolarHBondContact O-N 3.26Å
247	Y	94.7	Very high	93.2	Very high	40 Å²	40	52.7 Å²	52.7	16%	0.157	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-44.8	178.2	174.4	-94	0	0	0	112	R182 Q213 N243 D244 G249	R182-Y247 PolarHBondContact NE-O 3.41Å; Q213-Y247 HydrophobicContact CG-CD1 3.79Å; Q213-Y247 HydrophobicContact CG-CE1 3.46Å; Q213-Y247 VanDerWaalsContact CG-CE1 3.46Å; Q213-Y247 HydrophobicContact CG-CE2 4.3Å; Q213-Y247 HydrophobicContact CG-CG 4.35Å; Q213-Y247 VanDerWaalsContact NE2-CG 3.33Å; N243-Y247 WeakPolarHBondContact O-CB 3.47Å; N243-Y247 PolarHBondContact O-N 2.85Å; D244-Y247 PolarHBondContact O-N 3.12Å; D244-Y247 VanDerWaalsContact O-N 3.1Å; Y247-G249 VanDerWaalsContact C-N 3.26Å; Y247-G249 PolarHBondContact O-N 2.92Å
248	W	95.8	Very high	93.4	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-75.8	-12.9	179.7	-65	116.4	0	0	0	113.4	V163 S181 R182 L183 F211 Q213 F218 I221 D244 L245 F246 I250	V163-W248 HydrophobicContact CG1-CH2 4.36Å; V163-W248 HydrophobicContact CG1-CZ2 3.85Å; V163-W248 HydrophobicContact CG2-CH2 4Å; V163-W248 HydrophobicContact CG2-CZ2 4.21Å; S181-W248 WeakPolarHBondContact CB-O 3.48Å; R182-W248 HydrophobicContact CB-CE3 4.43Å; R182-W248 WeakPolarHBondContact CB-O 3.33Å; R182-W248 HydrophobicContact CG-CE3 4.41Å; R182-W248 PolarHBondContact N-O 2.89Å; L183-W248 HydrophobicContact CD1-CE3 4.39Å; L183-W248 HydrophobicContact CD1-CZ3 4.44Å; L183-W248 HydrophobicContact CD2-CE3 4.18Å; L183-W248 HydrophobicContact CD2-CZ3 3.72Å; L183-W248 HydrophobicContact CG-CE3 4.01Å; L183-W248 HydrophobicContact CG-CZ3 4.05Å; F211-W248 HydrophobicContact CB-CH2 3.9Å; F211-W248 AromaticContact CD1-CH2 3.69Å; F211-W248 HydrophobicContact CD1-CH2 3.69Å; F211-W248 AromaticContact CD1-CZ3 3.79Å; F211-W248 HydrophobicContact CD1-CZ3 3.79Å; F211-W248 HydrophobicContact CD2-CH2 4.18Å; F211-W248 HydrophobicContact CE1-CH2 4.24Å; F211-W248 AromaticContact CE1-CZ3 3.91Å; F211-W248 HydrophobicContact CE1-CZ3 3.91Å; F211-W248 AromaticContact CG-CH2 3.65Å; F211-W248 HydrophobicContact CG-CH2 3.65Å; F211-W248 HydrophobicContact CG-CZ3 4.18Å; F211-W248 HydrophobicContact CZ-CZ3 4.42Å; Q213-W248 HydrophobicContact CB-CZ2 4.15Å; Q213-W248 HydrophobicContact CG-CZ2 4.32Å; F218-W248 HydrophobicContact CD2-CD2 4.35Å; F218-W248 AromaticContact CD2-CE2 3.67Å; F218-W248 HydrophobicContact CD2-CH2 4Å; F218-W248 AromaticContact CD2-CZ2 3.49Å; F218-W248 HydrophobicContact CD2-CZ2 3.49Å; F218-W248 VanDerWaalsContact CD2-CZ2 3.49Å; F218-W248 HydrophobicContact CE2-CD2 4.18Å; F218-W248 AromaticContact CE2-CE2 3.87Å; F218-W248 HydrophobicContact CE2-CE3 4.19Å; F218-W248 AromaticContact CE2-CH2 3.63Å; F218-W248 HydrophobicContact CE2-CH2 3.63Å; F218-W248 AromaticContact CE2-CZ2 3.61Å; F218-W248 HydrophobicContact CE2-CZ2 3.61Å; F218-W248 AromaticContact CE2-CZ3 3.94Å; F218-W248 HydrophobicContact CE2-CZ3 3.94Å; I221-W248 HydrophobicContact CD1-CG 4.43Å; I221-W248 HydrophobicContact CG1-CG 4.32Å; I221-W248 HydrophobicContact CG2-CB 3.83Å; I221-W248 HydrophobicContact CG2-CD2 3.98Å; I221-W248 HydrophobicContact CG2-CG 3.52Å; D244-W248 PolarHBondContact O-N 3.44Å; L245-W248 PolarHBondContact O-N 3.17Å; F246-W248 PolarHBondContact O-N 3.29Å; W248-I250 HydrophobicContact CB-CD1 4.5Å; W248-I250 HydrophobicContact CB-CG1 4.17Å
249	G	94.9	Very high	93.4	Very high	43 Å²	43	53.6 Å²	53.6	44%	0.443	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	35.3	-175.7	0	0	0	0	0	112.6	L245 F246 Y247	L245-G249 PolarHBondContact O-N 3.45Å; F246-G249 PolarHBondContact O-N 3.26Å; Y247-G249 VanDerWaalsContact C-N 3.26Å; Y247-G249 PolarHBondContact O-N 2.92Å
250	I	95.4	Very high	93.6	Very high	8 Å²	8	57 Å²	57	4%	0.041	29%	0.293	C	S	.	.			trans	-99.7	133.4	173	-62.6	-169.8	0	0	0	107.9	I221 V224 Y225 L230 L245 W248	I221-I250 HydrophobicContact CB-CD1 4.09Å; I221-I250 HydrophobicContact CD1-CD1 4.01Å; I221-I250 HydrophobicContact CG2-CD1 3.49Å; I221-I250 VanDerWaalsContact CG2-CD1 3.49Å; I221-I250 WeakPolarHBondContact O-CD1 3.09Å; V224-I250 HydrophobicContact CB-CD1 4.21Å; V224-I250 HydrophobicContact CG2-CD1 3.97Å; V224-I250 HydrophobicContact CG2-CG2 4.19Å; Y225-I250 HydrophobicContact CE2-CD1 4Å; L230-I250 HydrophobicContact CD2-CG2 4.1Å; L245-I250 CarbonylContact C-O 3.55Å; L245-I250 HydrophobicContact CD2-CB 3.88Å; L245-I250 HydrophobicContact CD2-CG2 3.69Å; L245-I250 PolarHBondContact O-N 3.02Å; W248-I250 HydrophobicContact CB-CD1 4.5Å; W248-I250 HydrophobicContact CB-CG1 4.17Å
251	N	92.1	Very high	93.7	Very high	81 Å²	81	63 Å²	63	43%	0.433	31%	0.309	S	S	.	.			trans	-89.5	140.2	-178.8	-161.4	-48.3	0	0	0	111	Y253 Q254	N251-Y253 HydrophobicContact CB-CD1 3.38Å; N251-Y253 HydrophobicContact CB-CE1 3.18Å; N251-Y253 HydrophobicContact CB-CE2 4.5Å; N251-Y253 HydrophobicContact CB-CG 4.08Å; N251-Y253 WeakPolarHBondContact ND2-CD1 3.44Å; N251-Y253 WeakPolarHBondContact ND2-CE1 3.41Å; N251-Y253 PolarHBondContact O-N 3.02Å; N251-Y253 WeakPolarHBondContact OD1-CD1 3.36Å; N251-Y253 PolarHBondContact OD1-N 2.93Å; N251-Q254 WeakPolarHBondContact O-CB 3.35Å; N251-Q254 PolarHBondContact O-N 3.16Å; N251-Q254 VanDerWaalsContact O-N 3.13Å
252	E	92.7	Very high	93.7	Very high	31 Å²	31	68 Å²	68	15%	0.145	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-57.1	-26.9	174.4	-61.2	-179.2	-160.9	0	0	112.4	K242 L245 Q254 L255 Y263 Y264 K267	K242-E252 VanDerWaalsContact CE-OE1 3.23Å; K242-E252 WeakPolarHBondContact CE-OE1 3.27Å; K242-E252 WeakPolarHBondContact CG-OE1 3.2Å; L245-E252 HydrophobicContact CD1-CG 4.06Å; E252-Q254 PolarHBondContact O-N 3.35Å; E252-L255 HydrophobicContact CB-CD1 4.49Å; E252-L255 VanDerWaalsContact O-CB 3.27Å; E252-L255 WeakPolarHBondContact O-CB 3.39Å; E252-L255 WeakPolarHBondContact O-CD1 3.44Å; E252-L255 WeakPolarHBondContact O-CG 3.26Å; E252-L255 PolarHBondContact O-N 3.19Å; E252-Y263 HydrophobicContact CG-CE1 4.35Å; E252-Y263 PolarHBondContact OE1-OH 2.96Å; E252-Y264 PolarHBondContact OE2-OH 3.39Å; E252-K267 IonicContact OE1-NZ 3.15Å; E252-K267 PolarHBondContact OE1-NZ 3.31Å; E252-K267 IonicContact OE2-NZ 2.77Å; E252-K267 PolarHBondContact OE2-NZ 2.89Å
253	Y	89.4	Confident	93.7	Very high	168 Å²	168	64.5 Å²	64.5	66%	0.659	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-61.1	-18.1	177.1	72.3	-115.9	0	0	0	113.8	N251 L255	N251-Y253 HydrophobicContact CB-CD1 3.38Å; N251-Y253 HydrophobicContact CB-CE1 3.18Å; N251-Y253 HydrophobicContact CB-CE2 4.5Å; N251-Y253 HydrophobicContact CB-CG 4.08Å; N251-Y253 WeakPolarHBondContact ND2-CD1 3.44Å; N251-Y253 WeakPolarHBondContact ND2-CE1 3.41Å; N251-Y253 PolarHBondContact O-N 3.02Å; N251-Y253 WeakPolarHBondContact OD1-CD1 3.36Å; N251-Y253 PolarHBondContact OD1-N 2.93Å; Y253-L255 PolarHBondContact O-N 3.45Å
254	Q	91.4	Very high	93.8	Very high	29 Å²	29	62.8 Å²	62.8	14%	0.136	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-78.3	-4.1	178.1	-58.8	-174.5	-76.6	0	0	112.3	V224 L230 N251 E252 E256	V224-Q254 HydrophobicContact CG1-CB 4.43Å; L230-Q254 HydrophobicContact CB-CB 4.09Å; L230-Q254 WeakPolarHBondContact CB-O 3.45Å; L230-Q254 PolarHBondContact N-O 2.78Å; N251-Q254 WeakPolarHBondContact O-CB 3.35Å; N251-Q254 PolarHBondContact O-N 3.16Å; N251-Q254 VanDerWaalsContact O-N 3.13Å; E252-Q254 PolarHBondContact O-N 3.35Å; Q254-E256 PolarHBondContact O-N 3.3Å
255	L	94.1	Very high	93.8	Very high	12 Å²	12	66.3 Å²	66.3	6%	0.063	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-57.8	126.2	175.5	-84.7	162.7	0	0	0	110.6	L230 F232 E252 Y253 C259 Y260 Y263 Y264	L230-L255 HydrophobicContact CD2-CD2 4.1Å; L230-L255 HydrophobicContact CD2-CG 3.91Å; L230-L255 HydrophobicContact CG-CD2 3.98Å; L230-L255 HydrophobicContact CG-CG 4.25Å; L230-L255 WeakPolarHBondContact O-CA 3.5Å; F232-L255 HydrophobicContact CB-CD2 4.21Å; E252-L255 HydrophobicContact CB-CD1 4.49Å; E252-L255 VanDerWaalsContact O-CB 3.27Å; E252-L255 WeakPolarHBondContact O-CB 3.39Å; E252-L255 WeakPolarHBondContact O-CD1 3.44Å; E252-L255 WeakPolarHBondContact O-CG 3.26Å; E252-L255 PolarHBondContact O-N 3.19Å; Y253-L255 PolarHBondContact O-N 3.45Å; L255-C259 HydrophobicContact CD2-CB 4.09Å; L255-Y260 HydrophobicContact CB-CD2 4.19Å; L255-Y263 HydrophobicContact CD1-CD1 3.3Å; L255-Y263 HydrophobicContact CD1-CD2 4.48Å; L255-Y263 HydrophobicContact CD1-CE1 3.82Å; L255-Y263 HydrophobicContact CD1-CG 3.67Å; L255-Y264 HydrophobicContact CD1-CE2 4.29Å
256	E	93.9	Very high	93.8	Very high	53 Å²	53	69.6 Å²	69.6	25%	0.248	34%	0.335	C	S	.	.			trans	-70.5	152.2	174.4	-170.6	50.4	-101.6	0	0	111.2	H229 L230 Q254 C258 C259 Y260	H229-E256 HydrophobicContact CB-CB 4.33Å; H229-E256 IonicContact CE1-OE2 2.85Å; H229-E256 PolarHBondContact CE1-OE2 3.03Å; H229-E256 VanDerWaalsContact CE1-OE2 3.28Å; H229-E256 IonicContact CG-OE2 3.71Å; H229-E256 VanDerWaalsContact CG-OE2 3.31Å; H229-E256 IonicContact ND1-OE2 3.95Å; H229-E256 PolarHBondContact ND1-OE2 3.37Å; L230-E256 PolarHBondContact O-N 2.93Å; Q254-E256 PolarHBondContact O-N 3.3Å; E256-C258 PolarHBondContact O-N 3.44Å; E256-C258 VanDerWaalsContact O-N 3.11Å; E256-C259 CarbonylContact O-C 3.57Å; E256-C259 PolarHBondContact O-N 2.64Å; E256-Y260 PolarHBondContact O-N 2.9Å
257	T	93.8	Very high	93.8	Very high	119 Å²	119	61.8 Å²	61.8	73%	0.73	30%	0.3	S	S	*	.	H	α-helix	trans	-49	-39.6	179.8	-48.1	0	0	0	0	112.7	C259	T257-C259 PolarHBondContact O-N 3.31Å
258	C	93.6	Very high	93.7	Very high	79 Å²	79	65.6 Å²	65.6	53%	0.534	32%	0.32	S	S	.	.	H	α-helix	trans	-66.7	-21.9	179.6	67.6	0	0	0	0	114.2	H231 E256	H231-C258 PolarHBondContact ND1-SG 3.09Å; E256-C258 PolarHBondContact O-N 3.44Å; E256-C258 VanDerWaalsContact O-N 3.11Å
259	C	95	Very high	93.4	Very high	13 Å²	13	70.8 Å²	70.8	9%	0.088	34%	0.344	C	S	.	.	H	α-helix	trans	-111.5	-21.5	-177	-70.2	0	0	0	0	112.9	F232 L255 E256 T257 K262 Y263	F232-C259 HydrophobicContact CB-CB 3.97Å; F232-C259 PolarHBondContact N-SG 3.21Å; L255-C259 HydrophobicContact CD2-CB 4.09Å; E256-C259 CarbonylContact O-C 3.57Å; E256-C259 PolarHBondContact O-N 2.64Å; T257-C259 PolarHBondContact O-N 3.31Å; C259-K262 PolarHBondContact O-N 3.44Å; C259-Y263 WeakPolarHBondContact O-CB 3.47Å; C259-Y263 PolarHBondContact O-N 3.29Å
260	Y	93.9	Very high	93.2	Very high	116 Å²	116	70.5 Å²	70.5	46%	0.455	33%	0.333	S	S	.	.	H	α-helix	trans	-54	-59.1	-174	-174.6	-88	0	0	0	112.2	L255 E256 K262 Y263 Y264	L255-Y260 HydrophobicContact CB-CD2 4.19Å; E256-Y260 PolarHBondContact O-N 2.9Å; Y260-K262 VanDerWaalsContact C-N 3.35Å; Y260-K262 PolarHBondContact O-N 2.95Å; Y260-Y263 PolarHBondContact O-N 2.93Å; Y260-Y264 HydrophobicContact CD1-CD2 4.06Å; Y260-Y264 HydrophobicContact CD1-CE2 4.5Å; Y260-Y264 HydrophobicContact CD2-CD2 4.09Å; Y260-Y264 AromaticContact CD2-CE2 3.79Å; Y260-Y264 HydrophobicContact CD2-CE2 3.79Å; Y260-Y264 AromaticContact CE1-CD2 3.82Å; Y260-Y264 HydrophobicContact CE1-CD2 3.82Å; Y260-Y264 HydrophobicContact CE1-CE2 4.1Å; Y260-Y264 AromaticContact CE2-CD2 3.86Å; Y260-Y264 HydrophobicContact CE2-CD2 3.86Å; Y260-Y264 AromaticContact CE2-CE2 3.32Å; Y260-Y264 HydrophobicContact CE2-CE2 3.32Å; Y260-Y264 HydrophobicContact CG-CD2 4.18Å; Y260-Y264 HydrophobicContact CG-CE2 4.35Å; Y260-Y264 AromaticContact CZ-CD2 3.71Å; Y260-Y264 AromaticContact CZ-CE2 3.49Å; Y260-Y264 VanDerWaalsContact CZ-CE2 3.49Å; Y260-Y264 WeakPolarHBondContact O-CD2 3.38Å; Y260-Y264 PolarHBondContact O-N 3.27Å; Y260-Y264 VanDerWaalsContact O-N 3.09Å
261	Y	93.7	Very high	92.9	Very high	165 Å²	165	74.2 Å²	74.2	65%	0.647	35%	0.35	S	S	*	.	H	α-helix	trans	-60	-44.2	-178	179.4	-102.7	0	0	0	112.2	Y263 Y264 L265	Y261-Y263 PolarHBondContact O-N 3.28Å; Y261-Y264 PolarHBondContact O-N 3.46Å; Y261-L265 HydrophobicContact CE1-CD2 3.93Å; Y261-L265 VanDerWaalsContact O-CB 3.27Å; Y261-L265 WeakPolarHBondContact O-CB 3.43Å; Y261-L265 PolarHBondContact O-N 3.37Å
262	K	93.5	Very high	92.7	Very high	105 Å²	105	75.3 Å²	75.3	46%	0.457	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-42.9	-179.6	-65	-176.8	175.5	-172.9	0	112.2	E234 C259 Y260 K266	E234-K262 WeakPolarHBondContact OE1-CD 3.43Å; E234-K262 WeakPolarHBondContact OE1-CE 3.35Å; E234-K262 IonicContact OE1-NZ 3.28Å; E234-K262 PolarHBondContact OE1-NZ 3.47Å; C259-K262 PolarHBondContact O-N 3.44Å; Y260-K262 VanDerWaalsContact C-N 3.35Å; Y260-K262 PolarHBondContact O-N 2.95Å; K262-K266 WeakPolarHBondContact O-CB 3.39Å; K262-K266 PolarHBondContact O-N 2.91Å
263	Y	94.9	Very high	92.3	Very high	0 Å²	0	76.9 Å²	76.9	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-64.2	-51.1	178.4	172.1	-99.8	0	0	0	111.5	F232 V238 F241 E252 L255 C259 Y260 Y261 K266 K267	F232-Y263 HydrophobicContact CD1-CD2 4.48Å; F232-Y263 AromaticContact CD2-CD2 3.73Å; F232-Y263 HydrophobicContact CD2-CD2 3.73Å; F232-Y263 AromaticContact CE2-CD2 3.96Å; F232-Y263 HydrophobicContact CE2-CD2 3.96Å; F232-Y263 HydrophobicContact CG-CD2 4.01Å; F232-Y263 HydrophobicContact CZ-CD2 4.44Å; V238-Y263 HydrophobicContact CG2-CD2 3.65Å; V238-Y263 HydrophobicContact CG2-CE2 3.49Å; V238-Y263 VanDerWaalsContact CG2-CE2 3.49Å; F241-Y263 HydrophobicContact CD1-CD2 4.13Å; F241-Y263 AromaticContact CD1-CE2 3.8Å; F241-Y263 HydrophobicContact CD1-CE2 3.8Å; F241-Y263 HydrophobicContact CE1-CE2 4.44Å; E252-Y263 HydrophobicContact CG-CE1 4.35Å; E252-Y263 PolarHBondContact OE1-OH 2.96Å; L255-Y263 HydrophobicContact CD1-CD1 3.3Å; L255-Y263 HydrophobicContact CD1-CD2 4.48Å; L255-Y263 HydrophobicContact CD1-CE1 3.82Å; L255-Y263 HydrophobicContact CD1-CG 3.67Å; C259-Y263 WeakPolarHBondContact O-CB 3.47Å; C259-Y263 PolarHBondContact O-N 3.29Å; Y260-Y263 PolarHBondContact O-N 2.93Å; Y261-Y263 PolarHBondContact O-N 3.28Å; Y263-K266 PolarHBondContact O-N 3.12Å; Y263-K267 HydrophobicContact CE1-CD 3.73Å; Y263-K267 WeakPolarHBondContact O-CB 3.48Å; Y263-K267 PolarHBondContact O-N 3.46Å
264	Y	94.6	Very high	92.1	Very high	61 Å²	61	73.1 Å²	73.1	24%	0.239	35%	0.351	C	S	.	.	H	α-helix	trans	-66.7	-42.4	-177.3	-82.7	-79	0	0	0	112.5	E252 L255 Y260 Y261 K266 K267 E268	E252-Y264 PolarHBondContact OE2-OH 3.39Å; L255-Y264 HydrophobicContact CD1-CE2 4.29Å; Y260-Y264 HydrophobicContact CD1-CD2 4.06Å; Y260-Y264 HydrophobicContact CD1-CE2 4.5Å; Y260-Y264 HydrophobicContact CD2-CD2 4.09Å; Y260-Y264 AromaticContact CD2-CE2 3.79Å; Y260-Y264 HydrophobicContact CD2-CE2 3.79Å; Y260-Y264 AromaticContact CE1-CD2 3.82Å; Y260-Y264 HydrophobicContact CE1-CD2 3.82Å; Y260-Y264 HydrophobicContact CE1-CE2 4.1Å; Y260-Y264 AromaticContact CE2-CD2 3.86Å; Y260-Y264 HydrophobicContact CE2-CD2 3.86Å; Y260-Y264 AromaticContact CE2-CE2 3.32Å; Y260-Y264 HydrophobicContact CE2-CE2 3.32Å; Y260-Y264 HydrophobicContact CG-CD2 4.18Å; Y260-Y264 HydrophobicContact CG-CE2 4.35Å; Y260-Y264 AromaticContact CZ-CD2 3.71Å; Y260-Y264 AromaticContact CZ-CE2 3.49Å; Y260-Y264 VanDerWaalsContact CZ-CE2 3.49Å; Y260-Y264 WeakPolarHBondContact O-CD2 3.38Å; Y260-Y264 PolarHBondContact O-N 3.27Å; Y260-Y264 VanDerWaalsContact O-N 3.09Å; Y261-Y264 PolarHBondContact O-N 3.46Å; Y264-K266 PolarHBondContact O-N 3.15Å; Y264-K267 WeakPolarHBondContact O-CB 3.36Å; Y264-K267 PolarHBondContact O-N 3.49Å; Y264-E268 WeakPolarHBondContact O-CB 3.39Å; Y264-E268 WeakPolarHBondContact O-CG 3.3Å; Y264-E268 PolarHBondContact O-N 3.21Å
265	L	94.1	Very high	91.9	Very high	84 Å²	84	77.8 Å²	77.8	44%	0.44	37%	0.371	S	S	.	.	H	α-helix	trans	-58.5	-48.9	176.4	-178.2	66	0	0	0	111.8	Y261 K267 E268 Q269	Y261-L265 HydrophobicContact CE1-CD2 3.93Å; Y261-L265 VanDerWaalsContact O-CB 3.27Å; Y261-L265 WeakPolarHBondContact O-CB 3.43Å; Y261-L265 PolarHBondContact O-N 3.37Å; L265-K267 VanDerWaalsContact C-N 3.32Å; L265-K267 PolarHBondContact O-N 2.8Å; L265-E268 PolarHBondContact O-N 3.11Å; L265-Q269 WeakPolarHBondContact O-CB 3.23Å; L265-Q269 PolarHBondContact O-N 3.42Å
266	K	93.9	Very high	91.4	Very high	71 Å²	71	81.1 Å²	81.1	31%	0.309	39%	0.385	S	S	.	.	H	α-helix	trans	-65.7	-37	178.6	-169.9	168.7	-179	175	0	111.6	F232 E234 I236 V238 K262 Y263 Y264 V270	F232-K266 HydrophobicContact CE1-CD 4.14Å; F232-K266 HydrophobicContact CZ-CD 4.06Å; E234-K266 PolarHBondContact O-NZ 3.06Å; I236-K266 PolarHBondContact O-NZ 2.86Å; V238-K266 HydrophobicContact CB-CG 4.2Å; V238-K266 HydrophobicContact CG1-CG 4.2Å; K262-K266 WeakPolarHBondContact O-CB 3.39Å; K262-K266 PolarHBondContact O-N 2.91Å; Y263-K266 PolarHBondContact O-N 3.12Å; Y264-K266 PolarHBondContact O-N 3.15Å; K266-V270 WeakPolarHBondContact O-CB 3.19Å; K266-V270 VanDerWaalsContact O-CG2 3.3Å; K266-V270 WeakPolarHBondContact O-CG2 3.45Å; K266-V270 PolarHBondContact O-N 2.94Å
267	K	93.6	Very high	90.9	Very high	20 Å²	20	81.9 Å²	81.9	9%	0.087	39%	0.393	C	S	.	.	H	α-helix	trans	-63.3	-50	176.8	178.3	172.9	166.9	178.7	0	111.2	V238 E252 Y263 Y264 L265 V270 Q271	V238-K267 HydrophobicContact CG1-CB 4.44Å; V238-K267 HydrophobicContact CG2-CB 3.71Å; V238-K267 HydrophobicContact CG2-CG 4.49Å; E252-K267 IonicContact OE1-NZ 3.15Å; E252-K267 PolarHBondContact OE1-NZ 3.31Å; E252-K267 IonicContact OE2-NZ 2.77Å; E252-K267 PolarHBondContact OE2-NZ 2.89Å; Y263-K267 HydrophobicContact CE1-CD 3.73Å; Y263-K267 WeakPolarHBondContact O-CB 3.48Å; Y263-K267 PolarHBondContact O-N 3.46Å; Y264-K267 WeakPolarHBondContact O-CB 3.36Å; Y264-K267 PolarHBondContact O-N 3.49Å; L265-K267 VanDerWaalsContact C-N 3.32Å; L265-K267 PolarHBondContact O-N 2.8Å; K267-V270 PolarHBondContact O-N 3.48Å; K267-Q271 HydrophobicContact CG-CG 4.42Å; K267-Q271 VanDerWaalsContact O-CB 3.27Å; K267-Q271 WeakPolarHBondContact O-CB 3.42Å; K267-Q271 WeakPolarHBondContact O-CG 3.38Å; K267-Q271 PolarHBondContact O-N 2.88Å
268	E	93.2	Very high	90.4	Very high	120 Å²	120	84.5 Å²	84.5	56%	0.561	39%	0.39	S	S	*	.	H	α-helix	trans	-60.5	-47.8	178.6	-73.9	177	177.3	0	0	111.3	Y264 L265 V270 Q271 E272	Y264-E268 WeakPolarHBondContact O-CB 3.39Å; Y264-E268 WeakPolarHBondContact O-CG 3.3Å; Y264-E268 PolarHBondContact O-N 3.21Å; L265-E268 PolarHBondContact O-N 3.11Å; E268-V270 PolarHBondContact O-N 3.43Å; E268-Q271 PolarHBondContact O-N 2.93Å; E268-E272 WeakPolarHBondContact O-CB 3.28Å; E268-E272 PolarHBondContact O-N 3.47Å
269	Q	90.5	Very high	90	Very high	108 Å²	108	85.6 Å²	85.6	51%	0.505	39%	0.387	S	S	.	.	H	α-helix	trans	-56.9	-51.4	177.8	-175.5	-177.4	-4.7	0	0	112.1	L265 Q271 E272 E273	L265-Q269 WeakPolarHBondContact O-CB 3.23Å; L265-Q269 PolarHBondContact O-N 3.42Å; Q269-Q271 PolarHBondContact O-N 3.28Å; Q269-E272 PolarHBondContact O-N 3.45Å; Q269-E273 WeakPolarHBondContact O-CG 3.27Å; Q269-E273 PolarHBondContact O-N 3.25Å
270	V	90.3	Very high	89.4	Confident	37 Å²	37	88.8 Å²	88.8	22%	0.224	40%	0.403	C	S	.	.	H	α-helix	trans	-67	-38	-179.1	174	0	0	0	0	111.1	V238 V239 K266 K267 E268 E273 L274	V238-V270 HydrophobicContact CG1-CB 4Å; V238-V270 HydrophobicContact CG1-CG1 4.42Å; V238-V270 HydrophobicContact CG1-CG2 3.97Å; V239-V270 HydrophobicContact CG2-CG1 3.68Å; K266-V270 WeakPolarHBondContact O-CB 3.19Å; K266-V270 VanDerWaalsContact O-CG2 3.3Å; K266-V270 WeakPolarHBondContact O-CG2 3.45Å; K266-V270 PolarHBondContact O-N 2.94Å; K267-V270 PolarHBondContact O-N 3.48Å; E268-V270 PolarHBondContact O-N 3.43Å; V270-E273 PolarHBondContact O-N 2.88Å; V270-L274 HydrophobicContact CG1-CD1 3.91Å; V270-L274 HydrophobicContact CG1-CG 4.3Å; V270-L274 WeakPolarHBondContact O-CB 3.45Å; V270-L274 WeakPolarHBondContact O-CG 3.45Å; V270-L274 PolarHBondContact O-N 3.46Å
271	Q	89.4	Confident	88.7	Confident	86 Å²	86	86.6 Å²	86.6	40%	0.402	40%	0.404	S	S	.	.	H	α-helix	trans	-67	-37.7	177.3	-75.6	-175.7	-52.7	0	0	112.2	K267 E268 Q269 L274 K275	K267-Q271 HydrophobicContact CG-CG 4.42Å; K267-Q271 VanDerWaalsContact O-CB 3.27Å; K267-Q271 WeakPolarHBondContact O-CB 3.42Å; K267-Q271 WeakPolarHBondContact O-CG 3.38Å; K267-Q271 PolarHBondContact O-N 2.88Å; E268-Q271 PolarHBondContact O-N 2.93Å; Q269-Q271 PolarHBondContact O-N 3.28Å; Q271-L274 PolarHBondContact O-N 2.91Å; Q271-K275 VanDerWaalsContact O-CB 3.23Å; Q271-K275 WeakPolarHBondContact O-CB 3.36Å; Q271-K275 PolarHBondContact O-N 3.26Å
272	E	87.7	Confident	88.2	Confident	104 Å²	104	83 Å²	83	49%	0.486	40%	0.396	S	S	.	.	H	α-helix	trans	-67.3	-43.7	175.6	-164.9	-174.1	164.2	0	0	111.3	E268 Q269 L274 K275 K276	E268-E272 WeakPolarHBondContact O-CB 3.28Å; E268-E272 PolarHBondContact O-N 3.47Å; Q269-E272 PolarHBondContact O-N 3.45Å; E272-L274 PolarHBondContact O-N 2.9Å; E272-K275 PolarHBondContact O-N 3.17Å; E272-K276 HydrophobicContact CG-CD 4.36Å; E272-K276 WeakPolarHBondContact O-CB 3.27Å; E272-K276 WeakPolarHBondContact O-CG 3.49Å; E272-K276 PolarHBondContact O-N 3.04Å; E272-K276 WeakPolarHBondContact OE1-CE 3.33Å; E272-K276 IonicContact OE1-NZ 3.16Å; E272-K276 PolarHBondContact OE1-NZ 3.47Å
273	E	84.1	Confident	87.7	Confident	64 Å²	64	80.5 Å²	80.5	30%	0.299	39%	0.391	S	S	.	.	H	α-helix	trans	-59.8	-44.5	173.7	-73.5	-172.4	178.8	0	0	111.6	Q269 V270 T277 R562	Q269-E273 WeakPolarHBondContact O-CG 3.27Å; Q269-E273 PolarHBondContact O-N 3.25Å; V270-E273 PolarHBondContact O-N 2.88Å; E273-T277 WeakPolarHBondContact O-CB 3.32Å; E273-T277 PolarHBondContact O-N 2.85Å; E273-T277 PolarHBondContact O-OG1 3.33Å; E273-R562 IonicContact OE1-NH1 2.65Å; E273-R562 PolarHBondContact OE1-NH1 3.06Å; E273-R562 IonicContact OE2-NH1 2.71Å
274	L	86	Confident	87	Confident	90 Å²	90	84.8 Å²	84.8	47%	0.471	41%	0.412	S	S	.	.	H	α-helix	trans	-65.1	-39.4	176	-73.5	172.5	0	0	0	112.4	V239 V270 Q271 E272 R278	V239-L274 HydrophobicContact CG2-CD1 4.09Å; V270-L274 HydrophobicContact CG1-CD1 3.91Å; V270-L274 HydrophobicContact CG1-CG 4.3Å; V270-L274 WeakPolarHBondContact O-CB 3.45Å; V270-L274 WeakPolarHBondContact O-CG 3.45Å; V270-L274 PolarHBondContact O-N 3.46Å; Q271-L274 PolarHBondContact O-N 2.91Å; E272-L274 PolarHBondContact O-N 2.9Å; L274-R278 WeakPolarHBondContact O-CB 3.43Å; L274-R278 PolarHBondContact O-N 2.91Å
275	K	86.7	Confident	86.4	Confident	127 Å²	127	84.9 Å²	84.9	55%	0.552	43%	0.425	S	S	*	.	H	α-helix	trans	-64.6	-50	177.3	-178.3	-179.4	171.9	-177.2	0	110.5	Q271 E272 T277 R278 E279	Q271-K275 VanDerWaalsContact O-CB 3.23Å; Q271-K275 WeakPolarHBondContact O-CB 3.36Å; Q271-K275 PolarHBondContact O-N 3.26Å; E272-K275 PolarHBondContact O-N 3.17Å; K275-T277 VanDerWaalsContact C-N 3.31Å; K275-T277 PolarHBondContact O-N 3.21Å; K275-R278 PolarHBondContact O-N 2.87Å; K275-E279 WeakPolarHBondContact CE-OE1 3.46Å; K275-E279 HydrophobicContact CG-CG 4.45Å; K275-E279 WeakPolarHBondContact CG-OE1 3.47Å; K275-E279 IonicContact NZ-OE1 3.31Å; K275-E279 WeakPolarHBondContact O-CG 3.21Å; K275-E279 PolarHBondContact O-N 3.08Å
276	K	84	Confident	85.8	Confident	82 Å²	82	87 Å²	87	36%	0.357	43%	0.433	S	S	.	.	H	α-helix	trans	-57.8	-44.5	176.6	-73.5	172.5	-179.4	165.9	0	111.5	E272 R278 E279 I280	E272-K276 HydrophobicContact CG-CD 4.36Å; E272-K276 WeakPolarHBondContact O-CB 3.27Å; E272-K276 WeakPolarHBondContact O-CG 3.49Å; E272-K276 PolarHBondContact O-N 3.04Å; E272-K276 WeakPolarHBondContact OE1-CE 3.33Å; E272-K276 IonicContact OE1-NZ 3.16Å; E272-K276 PolarHBondContact OE1-NZ 3.47Å; K276-R278 PolarHBondContact O-N 3.45Å; K276-E279 PolarHBondContact O-N 3.45Å; K276-I280 WeakPolarHBondContact O-CD1 3.3Å; K276-I280 VanDerWaalsContact O-CG1 3.25Å; K276-I280 WeakPolarHBondContact O-CG1 3.2Å; K276-I280 PolarHBondContact O-N 3.44Å; K276-I280 VanDerWaalsContact O-N 3.09Å
277	T	82.3	Confident	85.1	Confident	68 Å²	68	88.4 Å²	88.4	42%	0.417	44%	0.44	S	S	.	.	H	α-helix	trans	-61.8	-45.4	177.8	-56.4	0	0	0	0	110.9	E273 K275 I280 S281	E273-T277 WeakPolarHBondContact O-CB 3.32Å; E273-T277 PolarHBondContact O-N 2.85Å; E273-T277 PolarHBondContact O-OG1 3.33Å; K275-T277 VanDerWaalsContact C-N 3.31Å; K275-T277 PolarHBondContact O-N 3.21Å; T277-I280 PolarHBondContact O-N 3.35Å; T277-S281 PolarHBondContact O-N 3.44Å; T277-S281 PolarHBondContact O-OG 3.44Å; T277-S281 VanDerWaalsContact O-OG 3.07Å
278	R	83.3	Confident	84.6	Confident	174 Å²	174	89.3 Å²	89.3	66%	0.657	45%	0.445	S	S	*	.	H	α-helix	trans	-63.7	-45.7	178	-174.7	-173.7	-61.5	178.5	0.2	112.3	L274 K275 K276 I280 S281 L282	L274-R278 WeakPolarHBondContact O-CB 3.43Å; L274-R278 PolarHBondContact O-N 2.91Å; K275-R278 PolarHBondContact O-N 2.87Å; K276-R278 PolarHBondContact O-N 3.45Å; R278-I280 VanDerWaalsContact C-N 3.28Å; R278-I280 PolarHBondContact O-N 2.89Å; R278-S281 PolarHBondContact O-N 3.02Å; R278-L282 HydrophobicContact CG-CD1 3.87Å; R278-L282 HydrophobicContact CG-CG 4.25Å; R278-L282 WeakPolarHBondContact O-CB 3.36Å; R278-L282 VanDerWaalsContact O-CG 3.26Å; R278-L282 WeakPolarHBondContact O-CG 3.24Å; R278-L282 PolarHBondContact O-N 3.07Å
279	E	85.1	Confident	84.1	Confident	102 Å²	102	90.7 Å²	90.7	48%	0.477	45%	0.451	S	S	.	.	H	α-helix	trans	-60	-40.4	179.4	-75.3	172.9	176.3	0	0	111.5	K275 K276 L282 S283	K275-E279 WeakPolarHBondContact CE-OE1 3.46Å; K275-E279 HydrophobicContact CG-CG 4.45Å; K275-E279 WeakPolarHBondContact CG-OE1 3.47Å; K275-E279 IonicContact NZ-OE1 3.31Å; K275-E279 WeakPolarHBondContact O-CG 3.21Å; K275-E279 PolarHBondContact O-N 3.08Å; K276-E279 PolarHBondContact O-N 3.45Å; E279-L282 PolarHBondContact O-N 3.35Å; E279-S283 VanDerWaalsContact O-CB 3.28Å; E279-S283 WeakPolarHBondContact O-CB 3.33Å; E279-S283 PolarHBondContact O-N 3.47Å
280	I	81.9	Confident	83.9	Confident	81 Å²	81	87 Å²	87	42%	0.415	43%	0.433	S	S	.	.	H	α-helix	trans	-67.3	-47.3	176.5	-67.8	163.4	0	0	0	111	K276 T277 R278 L282 S283 Q284	K276-I280 WeakPolarHBondContact O-CD1 3.3Å; K276-I280 VanDerWaalsContact O-CG1 3.25Å; K276-I280 WeakPolarHBondContact O-CG1 3.2Å; K276-I280 PolarHBondContact O-N 3.44Å; K276-I280 VanDerWaalsContact O-N 3.09Å; T277-I280 PolarHBondContact O-N 3.35Å; R278-I280 VanDerWaalsContact C-N 3.28Å; R278-I280 PolarHBondContact O-N 2.89Å; I280-L282 VanDerWaalsContact C-N 3.27Å; I280-L282 PolarHBondContact O-N 2.85Å; I280-S283 PolarHBondContact O-N 3.43Å; I280-Q284 WeakPolarHBondContact O-CB 3.32Å; I280-Q284 PolarHBondContact O-N 2.82Å
281	S	79.5	Confident	83.5	Confident	69 Å²	69	88 Å²	88	48%	0.483	45%	0.451	S	S	.	.	H	α-helix	trans	-61	-37.9	177.4	-60.2	0	0	0	0	112.2	T277 R278 A285	T277-S281 PolarHBondContact O-N 3.44Å; T277-S281 PolarHBondContact O-OG 3.44Å; T277-S281 VanDerWaalsContact O-OG 3.07Å; R278-S281 PolarHBondContact O-N 3.02Å; S281-A285 WeakPolarHBondContact O-CB 3.34Å; S281-A285 PolarHBondContact O-N 3.37Å
282	L	83.6	Confident	83.2	Confident	90 Å²	90	91 Å²	91	47%	0.471	48%	0.475	S	S	.	.	H	α-helix	trans	-69.4	-48.1	175.8	-72.4	174.4	0	0	0	111.5	R278 E279 I280 Q284 A285 E286	R278-L282 HydrophobicContact CG-CD1 3.87Å; R278-L282 HydrophobicContact CG-CG 4.25Å; R278-L282 WeakPolarHBondContact O-CB 3.36Å; R278-L282 VanDerWaalsContact O-CG 3.26Å; R278-L282 WeakPolarHBondContact O-CG 3.24Å; R278-L282 PolarHBondContact O-N 3.07Å; E279-L282 PolarHBondContact O-N 3.35Å; I280-L282 VanDerWaalsContact C-N 3.27Å; I280-L282 PolarHBondContact O-N 2.85Å; L282-Q284 PolarHBondContact O-N 2.89Å; L282-A285 PolarHBondContact O-N 2.86Å; L282-E286 WeakPolarHBondContact O-CB 3.38Å; L282-E286 WeakPolarHBondContact O-CG 3.27Å; L282-E286 PolarHBondContact O-N 3.43Å
283	S	83.3	Confident	83.3	Confident	53 Å²	53	88.2 Å²	88.2	37%	0.371	48%	0.475	S	S	.	.	H	α-helix	trans	-56.6	-42.4	176.5	-169.9	0	0	0	0	111	E279 I280 E286 E287	E279-S283 VanDerWaalsContact O-CB 3.28Å; E279-S283 WeakPolarHBondContact O-CB 3.33Å; E279-S283 PolarHBondContact O-N 3.47Å; I280-S283 PolarHBondContact O-N 3.43Å; S283-E286 PolarHBondContact O-N 3.43Å; S283-E287 VanDerWaalsContact O-CB 3.3Å; S283-E287 WeakPolarHBondContact O-CB 3.28Å; S283-E287 VanDerWaalsContact O-CG 3.28Å; S283-E287 WeakPolarHBondContact O-CG 3.38Å; S283-E287 PolarHBondContact O-N 3.11Å
284	Q	80.7	Confident	83.6	Confident	90 Å²	90	96.3 Å²	96.3	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-67.1	-40.5	176.4	-171.6	176.6	4.4	0	0	111.9	I280 L282 E288	I280-Q284 WeakPolarHBondContact O-CB 3.32Å; I280-Q284 PolarHBondContact O-N 2.82Å; L282-Q284 PolarHBondContact O-N 2.89Å; Q284-E288 HydrophobicContact CG-CG 4.33Å; Q284-E288 WeakPolarHBondContact CG-OE1 3.36Å; Q284-E288 PolarHBondContact NE2-OE1 3.23Å; Q284-E288 WeakPolarHBondContact O-CB 3.46Å; Q284-E288 WeakPolarHBondContact O-CG 3.21Å; Q284-E288 PolarHBondContact O-N 2.84Å
285	A	81.3	Confident	83.7	Confident	63 Å²	63	100.8 Å²	100.8	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-67.8	-35.9	177.6	0	0	0	0	0	112.9	S281 L282 E288 Q289	S281-A285 WeakPolarHBondContact O-CB 3.34Å; S281-A285 PolarHBondContact O-N 3.37Å; L282-A285 PolarHBondContact O-N 2.86Å; A285-E288 CarbonylContact O-C 3.58Å; A285-Q289 PolarHBondContact O-N 3.36Å
286	E	81.9	Confident	83.9	Confident	129 Å²	129	95.2 Å²	95.2	60%	0.603	49%	0.491	S	S	*	.	H	α-helix	trans	-70.4	-43.7	174.9	-73	177.3	-175.7	0	0	111.5	L282 S283 E288	L282-E286 WeakPolarHBondContact O-CB 3.38Å; L282-E286 WeakPolarHBondContact O-CG 3.27Å; L282-E286 PolarHBondContact O-N 3.43Å; S283-E286 PolarHBondContact O-N 3.43Å; E286-E288 VanDerWaalsContact C-N 3.33Å
287	E	79.1	Confident	84.1	Confident	99 Å²	99	96 Å²	96	46%	0.463	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-37.5	175.1	-76	-179.5	-170.2	0	0	111.6	S283 Q289 P388 T392	S283-E287 VanDerWaalsContact O-CB 3.3Å; S283-E287 WeakPolarHBondContact O-CB 3.28Å; S283-E287 VanDerWaalsContact O-CG 3.28Å; S283-E287 WeakPolarHBondContact O-CG 3.38Å; S283-E287 PolarHBondContact O-N 3.11Å; E287-Q289 PolarHBondContact O-N 2.9Å; E287-P388 WeakPolarHBondContact O-CG 3.4Å; E287-T392 HydrophobicContact CG-CG2 4.39Å
288	E	83.6	Confident	84.6	Confident	39 Å²	39	97 Å²	97	18%	0.182	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	30.1	-178.2	-62.2	-174.9	-163.5	0	0	113.8	Q284 A285 E286 F290 K308	Q284-E288 HydrophobicContact CG-CG 4.33Å; Q284-E288 WeakPolarHBondContact CG-OE1 3.36Å; Q284-E288 PolarHBondContact NE2-OE1 3.23Å; Q284-E288 WeakPolarHBondContact O-CB 3.46Å; Q284-E288 WeakPolarHBondContact O-CG 3.21Å; Q284-E288 PolarHBondContact O-N 2.84Å; A285-E288 CarbonylContact O-C 3.58Å; E286-E288 VanDerWaalsContact C-N 3.33Å; E288-F290 VanDerWaalsContact C-N 3.33Å; E288-F290 HydrophobicContact CB-CD2 4.49Å; E288-F290 HydrophobicContact CB-CE2 4Å; E288-F290 WeakPolarHBondContact O-CD2 3.34Å; E288-F290 PolarHBondContact O-N 2.81Å; E288-K308 WeakPolarHBondContact OE1-CE 3.23Å; E288-K308 IonicContact OE1-NZ 2.9Å; E288-K308 PolarHBondContact OE1-NZ 3.48Å; E288-K308 IonicContact OE2-NZ 2.64Å; E288-K308 PolarHBondContact OE2-NZ 2.82Å
289	Q	81.6	Confident	85.1	Confident	149 Å²	149	89.9 Å²	89.9	70%	0.696	48%	0.479	S	S	*	.			trans	-77.2	84.4	176.4	-163.9	173.6	5	0	0	111.1	A285 E287	A285-Q289 PolarHBondContact O-N 3.36Å; E287-Q289 PolarHBondContact O-N 2.9Å
290	F	85.8	Confident	85.5	Confident	31 Å²	31	89.5 Å²	89.5	14%	0.136	48%	0.476	C	S	.	.			trans	-76.8	145.7	170.5	-61.4	-82	0	0	0	110.8	E288 A296 Q299 K300 W303 P388	E288-F290 VanDerWaalsContact C-N 3.33Å; E288-F290 HydrophobicContact CB-CD2 4.49Å; E288-F290 HydrophobicContact CB-CE2 4Å; E288-F290 WeakPolarHBondContact O-CD2 3.34Å; E288-F290 PolarHBondContact O-N 2.81Å; F290-A296 HydrophobicContact CB-CB 4.44Å; F290-Q299 HydrophobicContact CD1-CB 4.43Å; F290-Q299 HydrophobicContact CD1-CG 4.06Å; F290-Q299 HydrophobicContact CE1-CG 3.92Å; F290-K300 HydrophobicContact CD1-CB 4.28Å; F290-K300 HydrophobicContact CD2-CB 3.92Å; F290-K300 HydrophobicContact CD2-CD 4.01Å; F290-K300 HydrophobicContact CD2-CG 3.98Å; F290-K300 HydrophobicContact CE1-CB 4.42Å; F290-K300 HydrophobicContact CE2-CB 4.07Å; F290-K300 HydrophobicContact CE2-CD 4.35Å; F290-K300 HydrophobicContact CE2-CG 3.95Å; F290-K300 HydrophobicContact CG-CB 4.04Å; F290-K300 HydrophobicContact CZ-CB 4.33Å; F290-W303 HydrophobicContact CE1-CB 4.3Å; F290-W303 HydrophobicContact CE1-CG 4.46Å; F290-W303 HydrophobicContact CZ-CB 3.82Å; F290-W303 AromaticContact CZ-CD1 3.71Å; F290-W303 HydrophobicContact CZ-CD2 4.25Å; F290-W303 AromaticContact CZ-CG 3.64Å; F290-W303 HydrophobicContact CZ-CG 3.64Å; F290-P388 HydrophobicContact CD1-CB 4.25Å; F290-P388 HydrophobicContact CE1-CB 4.11Å; F290-P388 HydrophobicContact CE1-CG 4.15Å; F290-P388 HydrophobicContact CZ-CG 4.17Å
291	G	82.9	Confident	86	Confident	57 Å²	57	91.8 Å²	91.8	59%	0.588	48%	0.481	S	S	*	.			trans	-64.4	-177.9	172.8	0	0	0	0	0	112.9	A296	G291-A296 VanDerWaalsContact C-CB 3.48Å; G291-A296 WeakPolarHBondContact O-CB 3.39Å
292	T	83.4	Confident	86.7	Confident	150 Å²	150	91.2 Å²	91.2	92%	0.92	47%	0.471	S	S	*	.	S	Bend	trans	-96.2	140.7	173.4	55.7	0	0	0	0	111.2
293	G	89.6	Confident	87.2	Confident	46 Å²	46	88 Å²	88	47%	0.474	45%	0.452	S	S	.	.	S	Bend	trans	132.2	177.8	172.9	0	0	0	0	0	113.9	W295 A296 T297	G293-W295 PolarHBondContact O-N 3.39Å; G293-A296 PolarHBondContact O-N 2.92Å; G293-T297 PolarHBondContact O-N 2.76Å; G293-T297 PolarHBondContact O-OG1 2.99Å
294	R	89.6	Confident	87.6	Confident	234 Å²	234	86.9 Å²	86.9	88%	0.883	44%	0.443	S	S	*	.	H	α-helix	trans	-64.4	-41.1	-178.9	-59.6	-176.3	89.3	177	6	111.8	T297 L298	R294-T297 PolarHBondContact O-N 3Å; R294-L298 PolarHBondContact O-N 2.84Å
295	W	89.4	Confident	88.3	Confident	183 Å²	183	83.7 Å²	83.7	69%	0.693	43%	0.428	S	S	*	.	H	α-helix	trans	-61.9	-48.7	176.8	176.6	-110.7	0	0	0	112	G293 T297 L298 Q299	G293-W295 PolarHBondContact O-N 3.39Å; W295-T297 VanDerWaalsContact C-N 3.26Å; W295-T297 PolarHBondContact O-N 2.92Å; W295-L298 HydrophobicContact CE3-CD2 4.22Å; W295-L298 HydrophobicContact CZ3-CD2 4.06Å; W295-L298 PolarHBondContact O-N 2.86Å; W295-L298 VanDerWaalsContact O-N 3.15Å; W295-Q299 WeakPolarHBondContact O-CB 3.48Å; W295-Q299 PolarHBondContact O-N 3.48Å
296	A	89.4	Confident	88.8	Confident	11 Å²	11	81 Å²	81	9%	0.091	41%	0.405	C	S	.	.	H	α-helix	trans	-63.4	-34	178.7	0	0	0	0	0	112.5	F290 G291 G293 Q299 K300	F290-A296 HydrophobicContact CB-CB 4.44Å; G291-A296 VanDerWaalsContact C-CB 3.48Å; G291-A296 WeakPolarHBondContact O-CB 3.39Å; G293-A296 PolarHBondContact O-N 2.92Å; A296-Q299 PolarHBondContact O-N 2.76Å; A296-K300 WeakPolarHBondContact O-CB 3.48Å; A296-K300 PolarHBondContact O-N 3.44Å
297	T	89.7	Confident	89.3	Confident	98 Å²	98	77 Å²	77	60%	0.601	39%	0.387	S	S	*	.	H	α-helix	trans	-65.3	-44	173.6	-51.7	0	0	0	0	111.3	G293 R294 W295 K300 Y301	G293-T297 PolarHBondContact O-N 2.76Å; G293-T297 PolarHBondContact O-OG1 2.99Å; R294-T297 PolarHBondContact O-N 3Å; W295-T297 VanDerWaalsContact C-N 3.26Å; W295-T297 PolarHBondContact O-N 2.92Å; T297-K300 PolarHBondContact O-N 3.27Å; T297-Y301 WeakPolarHBondContact O-CB 3.42Å; T297-Y301 PolarHBondContact O-N 3.31Å
298	L	92.1	Very high	89.8	Confident	88 Å²	88	73.7 Å²	73.7	46%	0.461	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-42.7	175	-179.9	63.1	0	0	0	111.6	R294 W295 K300 Y301 M302	R294-L298 PolarHBondContact O-N 2.84Å; W295-L298 HydrophobicContact CE3-CD2 4.22Å; W295-L298 HydrophobicContact CZ3-CD2 4.06Å; W295-L298 PolarHBondContact O-N 2.86Å; W295-L298 VanDerWaalsContact O-N 3.15Å; L298-K300 VanDerWaalsContact C-N 3.35Å; L298-K300 PolarHBondContact O-N 3.04Å; L298-Y301 WeakPolarHBondContact O-CB 3.38Å; L298-Y301 PolarHBondContact O-N 3Å; L298-M302 HydrophobicContact CD1-CG 4.33Å; L298-M302 WeakPolarHBondContact O-CG 3.25Å; L298-M302 PolarHBondContact O-N 3.46Å
299	Q	94.3	Very high	90.1	Very high	25 Å²	25	74 Å²	74	12%	0.117	38%	0.376	C	S	.	.	H	α-helix	trans	-58.8	-46.9	176.5	-174.8	-172.3	-2.4	0	0	110.8	F290 W295 A296 M302 W303 V386	F290-Q299 HydrophobicContact CD1-CB 4.43Å; F290-Q299 HydrophobicContact CD1-CG 4.06Å; F290-Q299 HydrophobicContact CE1-CG 3.92Å; W295-Q299 WeakPolarHBondContact O-CB 3.48Å; W295-Q299 PolarHBondContact O-N 3.48Å; A296-Q299 PolarHBondContact O-N 2.76Å; Q299-M302 PolarHBondContact O-N 3.36Å; Q299-W303 VanDerWaalsContact O-CB 3.31Å; Q299-W303 WeakPolarHBondContact O-CB 3.26Å; Q299-W303 PolarHBondContact O-N 2.83Å; Q299-V386 HydrophobicContact CG-CB 4.34Å; Q299-V386 HydrophobicContact CG-CG1 4.49Å; Q299-V386 VanDerWaalsContact CG-O 3.28Å; Q299-V386 WeakPolarHBondContact CG-O 3.45Å; Q299-V386 PolarHBondContact NE2-O 3.31Å
300	K	92	Very high	90.3	Very high	95 Å²	95	73.5 Å²	73.5	41%	0.413	37%	0.374	S	S	.	.	H	α-helix	trans	-61	-45.8	175.1	179.5	171	-179.2	165.3	0	111.9	F290 A296 T297 L298 M302 W303 D304	F290-K300 HydrophobicContact CD1-CB 4.28Å; F290-K300 HydrophobicContact CD2-CB 3.92Å; F290-K300 HydrophobicContact CD2-CD 4.01Å; F290-K300 HydrophobicContact CD2-CG 3.98Å; F290-K300 HydrophobicContact CE1-CB 4.42Å; F290-K300 HydrophobicContact CE2-CB 4.07Å; F290-K300 HydrophobicContact CE2-CD 4.35Å; F290-K300 HydrophobicContact CE2-CG 3.95Å; F290-K300 HydrophobicContact CG-CB 4.04Å; F290-K300 HydrophobicContact CZ-CB 4.33Å; A296-K300 WeakPolarHBondContact O-CB 3.48Å; A296-K300 PolarHBondContact O-N 3.44Å; T297-K300 PolarHBondContact O-N 3.27Å; L298-K300 VanDerWaalsContact C-N 3.35Å; L298-K300 PolarHBondContact O-N 3.04Å; K300-M302 VanDerWaalsContact C-N 3.32Å; K300-M302 PolarHBondContact O-N 3.48Å; K300-W303 WeakPolarHBondContact O-CB 3.41Å; K300-W303 PolarHBondContact O-N 3.27Å; K300-D304 WeakPolarHBondContact O-CB 3.32Å; K300-D304 PolarHBondContact O-N 2.92Å
301	Y	92.7	Very high	90.4	Very high	129 Å²	129	75.1 Å²	75.1	51%	0.506	39%	0.386	S	S	.	.	H	α-helix	trans	-57.4	-45.9	176.1	174.2	-94.3	0	0	0	111.9	T297 L298 D304 L305	T297-Y301 WeakPolarHBondContact O-CB 3.42Å; T297-Y301 PolarHBondContact O-N 3.31Å; L298-Y301 WeakPolarHBondContact O-CB 3.38Å; L298-Y301 PolarHBondContact O-N 3Å; Y301-D304 PolarHBondContact O-N 3.48Å; Y301-L305 HydrophobicContact CE1-CD1 4.3Å; Y301-L305 WeakPolarHBondContact O-CB 3.46Å; Y301-L305 PolarHBondContact O-N 2.95Å
302	M	94.4	Very high	90.8	Very high	56 Å²	56	74.2 Å²	74.2	28%	0.276	37%	0.371	S	S	.	.	H	α-helix	trans	-68	-39.5	178.2	-68.6	-61.5	-65.3	0	0	112.1	L298 Q299 K300 L305 V306 L382 V386	L298-M302 HydrophobicContact CD1-CG 4.33Å; L298-M302 WeakPolarHBondContact O-CG 3.25Å; L298-M302 PolarHBondContact O-N 3.46Å; Q299-M302 PolarHBondContact O-N 3.36Å; K300-M302 VanDerWaalsContact C-N 3.32Å; K300-M302 PolarHBondContact O-N 3.48Å; M302-L305 WeakPolarHBondContact O-CB 3.34Å; M302-L305 PolarHBondContact O-N 2.86Å; M302-V306 WeakPolarHBondContact O-CG2 3.4Å; M302-V306 PolarHBondContact O-N 2.94Å; M302-L382 HydrophobicContact CE-CD1 4.45Å; M302-V386 HydrophobicContact CB-CB 4.45Å; M302-V386 HydrophobicContact CB-CG1 3.63Å
303	W	94.5	Very high	91.3	Very high	22 Å²	22	74.3 Å²	74.3	8%	0.083	36%	0.362	C	S	.	.	H	α-helix	trans	-57.6	-50.1	173.1	174	-98.2	0	0	0	111.7	F290 Q299 K300 L305 V306 E307 V386 A387 F393	F290-W303 HydrophobicContact CE1-CB 4.3Å; F290-W303 HydrophobicContact CE1-CG 4.46Å; F290-W303 HydrophobicContact CZ-CB 3.82Å; F290-W303 AromaticContact CZ-CD1 3.71Å; F290-W303 HydrophobicContact CZ-CD2 4.25Å; F290-W303 AromaticContact CZ-CG 3.64Å; F290-W303 HydrophobicContact CZ-CG 3.64Å; Q299-W303 VanDerWaalsContact O-CB 3.31Å; Q299-W303 WeakPolarHBondContact O-CB 3.26Å; Q299-W303 PolarHBondContact O-N 2.83Å; K300-W303 WeakPolarHBondContact O-CB 3.41Å; K300-W303 PolarHBondContact O-N 3.27Å; W303-L305 PolarHBondContact O-N 3.09Å; W303-V306 PolarHBondContact O-N 3.47Å; W303-E307 HydrophobicContact CD2-CB 4.27Å; W303-E307 HydrophobicContact CH2-CG 4.16Å; W303-E307 HydrophobicContact CZ2-CB 4.36Å; W303-E307 HydrophobicContact CZ2-CG 3.87Å; W303-E307 VanDerWaalsContact O-CB 3.26Å; W303-E307 WeakPolarHBondContact O-CB 3.35Å; W303-E307 PolarHBondContact O-N 3.15Å; W303-V386 HydrophobicContact CE3-CG2 4.25Å; W303-A387 HydrophobicContact CE3-CB 4.25Å; W303-A387 HydrophobicContact CH2-CB 4.28Å; W303-A387 VanDerWaalsContact CZ3-CA 3.44Å; W303-A387 HydrophobicContact CZ3-CB 3.58Å; W303-F393 AromaticContact CH2-CD2 3.79Å; W303-F393 HydrophobicContact CH2-CD2 3.79Å; W303-F393 HydrophobicContact CH2-CE2 4.03Å; W303-F393 AromaticContact CZ3-CD2 3.83Å; W303-F393 HydrophobicContact CZ3-CD2 3.83Å; W303-F393 AromaticContact CZ3-CE2 3.89Å; W303-F393 HydrophobicContact CZ3-CE2 3.89Å
304	D	92.5	Very high	91.6	Very high	31 Å²	31	75.7 Å²	75.7	17%	0.166	36%	0.362	C	S	.	.	H	α-helix	trans	-61.3	-34.5	177.8	-73.4	-26.6	0	0	0	111.4	K300 Y301 K308 T311	K300-D304 WeakPolarHBondContact O-CB 3.32Å; K300-D304 PolarHBondContact O-N 2.92Å; Y301-D304 PolarHBondContact O-N 3.48Å; D304-K308 CarbonylContact O-C 3.28Å; D304-K308 WeakPolarHBondContact O-CB 2.87Å; D304-K308 PolarHBondContact O-N 3.14Å; D304-K308 WeakPolarHBondContact OD1-CD 3.49Å; D304-K308 IonicContact OD1-NZ 3.55Å; D304-K308 PolarHBondContact OD1-NZ 3.27Å; D304-T311 HydrophobicContact CB-CG2 3.97Å; D304-T311 PolarHBondContact O-OG1 2.95Å
305	L	94	Very high	91.8	Very high	23 Å²	23	64.6 Å²	64.6	12%	0.12	32%	0.32	C	S	.	.	H	α-helix	trans	-66.7	-44.3	175.9	-173.1	155.4	0	0	0	113.2	Y301 M302 W303 V314 A315 F318	Y301-L305 HydrophobicContact CE1-CD1 4.3Å; Y301-L305 WeakPolarHBondContact O-CB 3.46Å; Y301-L305 PolarHBondContact O-N 2.95Å; M302-L305 WeakPolarHBondContact O-CB 3.34Å; M302-L305 PolarHBondContact O-N 2.86Å; W303-L305 PolarHBondContact O-N 3.09Å; L305-V314 HydrophobicContact CD1-CB 4.33Å; L305-V314 HydrophobicContact CD1-CG1 3.72Å; L305-V314 HydrophobicContact CG-CG1 4.26Å; L305-A315 WeakPolarHBondContact O-CA 3.45Å; L305-A315 WeakPolarHBondContact O-CB 3.39Å; L305-F318 HydrophobicContact CD2-CB 4.37Å; L305-F318 HydrophobicContact CD2-CG 4.35Å
306	V	93.5	Very high	92.1	Very high	6 Å²	6	64 Å²	64	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-92.3	-24.8	-171.4	-59.1	0	0	0	0	114.4	M302 W303 F318 L382 R383 V386	M302-V306 WeakPolarHBondContact O-CG2 3.4Å; M302-V306 PolarHBondContact O-N 2.94Å; W303-V306 PolarHBondContact O-N 3.47Å; V306-F318 HydrophobicContact CB-CE1 4.05Å; V306-F318 HydrophobicContact CB-CZ 4.41Å; V306-F318 HydrophobicContact CG1-CE1 4.23Å; V306-F318 HydrophobicContact CG1-CZ 4.2Å; V306-L382 HydrophobicContact CG1-CD2 3.59Å; V306-L382 HydrophobicContact CG1-CG 4.03Å; V306-R383 HydrophobicContact CB-CG 4.09Å; V306-R383 HydrophobicContact CG2-CG 3.77Å; V306-R383 PolarHBondContact O-NE 2.79Å; V306-R383 PolarHBondContact O-NH2 3Å; V306-V386 HydrophobicContact CG2-CG2 3.8Å
307	E	91.2	Very high	92.4	Very high	46 Å²	46	67.9 Å²	67.9	22%	0.215	34%	0.336	C	S	.	.	H	α-helix	trans	-103.9	-32.3	-176.1	-168.9	62.6	-166.4	0	0	112.4	W303 P309 R383 R449	W303-E307 HydrophobicContact CD2-CB 4.27Å; W303-E307 HydrophobicContact CH2-CG 4.16Å; W303-E307 HydrophobicContact CZ2-CB 4.36Å; W303-E307 HydrophobicContact CZ2-CG 3.87Å; W303-E307 VanDerWaalsContact O-CB 3.26Å; W303-E307 WeakPolarHBondContact O-CB 3.35Å; W303-E307 PolarHBondContact O-N 3.15Å; E307-P309 WeakPolarHBondContact O-CD 3.34Å; E307-R383 VanDerWaalsContact OE2-CD 3.28Å; E307-R383 WeakPolarHBondContact OE2-CD 3.08Å; E307-R383 IonicContact OE2-NE 3.68Å; E307-R449 IonicContact OE1-CZ 2.67Å; E307-R449 IonicContact OE1-NH1 3.62Å; E307-R449 PolarHBondContact OE1-NH1 3.28Å; E307-R449 IonicContact OE2-NH1 2.67Å
308	K	90	Very high	92.7	Very high	29 Å²	29	64.8 Å²	64.8	13%	0.126	31%	0.314	C	S	.	.			trans	-120.4	89.6	-171.5	-60.1	-179.4	-168.3	158.5	0	112.1	E288 D304 Q310 T311 A315	E288-K308 WeakPolarHBondContact OE1-CE 3.23Å; E288-K308 IonicContact OE1-NZ 2.9Å; E288-K308 PolarHBondContact OE1-NZ 3.48Å; E288-K308 IonicContact OE2-NZ 2.64Å; E288-K308 PolarHBondContact OE2-NZ 2.82Å; D304-K308 CarbonylContact O-C 3.28Å; D304-K308 WeakPolarHBondContact O-CB 2.87Å; D304-K308 PolarHBondContact O-N 3.14Å; D304-K308 WeakPolarHBondContact OD1-CD 3.49Å; D304-K308 IonicContact OD1-NZ 3.55Å; D304-K308 PolarHBondContact OD1-NZ 3.27Å; K308-Q310 PolarHBondContact O-N 3.2Å; K308-T311 HydrophobicContact CB-CG2 3.46Å; K308-T311 VanDerWaalsContact CB-CG2 3.46Å; K308-T311 HydrophobicContact CD-CG2 3.91Å; K308-T311 HydrophobicContact CG-CG2 4.38Å; K308-T311 PolarHBondContact O-N 3.38Å; K308-T311 VanDerWaalsContact O-N 3.11Å; K308-T311 PolarHBondContact O-OG1 3.06Å; K308-A315 WeakPolarHBondContact O-CB 3.26Å
309	P	89.6	Confident	92.8	Very high	46 Å²	46	61.1 Å²	61.1	30%	0.299	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-58.6	-26.8	-176.6	23.2	-33.4	0	0	0	113.5	E307 T311 R316 A319	E307-P309 WeakPolarHBondContact O-CD 3.34Å; P309-T311 VanDerWaalsContact C-N 3.28Å; P309-T311 PolarHBondContact O-N 3.17Å; P309-R316 WeakPolarHBondContact O-CG 3.33Å; P309-R316 PolarHBondContact O-N 3.45Å; P309-A319 HydrophobicContact CB-CB 3.76Å
310	Q	84.9	Confident	92.9	Very high	138 Å²	138	64.6 Å²	64.6	65%	0.645	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-72.8	-13.2	-178.9	66.6	-82.2	8.2	0	0	114.9	K308	K308-Q310 PolarHBondContact O-N 3.2Å
311	T	87.8	Confident	93.1	Very high	65 Å²	65	63.3 Å²	63.3	40%	0.399	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-76.5	-31.6	-171.1	58.9	0	0	0	0	114	D304 K308 P309	D304-T311 HydrophobicContact CB-CG2 3.97Å; D304-T311 PolarHBondContact O-OG1 2.95Å; K308-T311 HydrophobicContact CB-CG2 3.46Å; K308-T311 VanDerWaalsContact CB-CG2 3.46Å; K308-T311 HydrophobicContact CD-CG2 3.91Å; K308-T311 HydrophobicContact CG-CG2 4.38Å; K308-T311 PolarHBondContact O-N 3.38Å; K308-T311 VanDerWaalsContact O-N 3.11Å; K308-T311 PolarHBondContact O-OG1 3.06Å; P309-T311 VanDerWaalsContact C-N 3.28Å; P309-T311 PolarHBondContact O-N 3.17Å
312	S	92.3	Very high	93.3	Very high	37 Å²	37	57.2 Å²	57.2	26%	0.259	29%	0.292	S	S	.	.			trans	-154.4	159.2	-178	69.4	0	0	0	0	112	V314 A315 R316	S312-V314 PolarHBondContact O-N 3.08Å; S312-A315 WeakPolarHBondContact O-CB 3.38Å; S312-A315 PolarHBondContact O-N 2.9Å; S312-A315 VanDerWaalsContact O-N 3.15Å; S312-A315 WeakPolarHBondContact OG-CB 3.39Å; S312-A315 PolarHBondContact OG-N 2.87Å; S312-A315 VanDerWaalsContact OG-N 3.07Å; S312-R316 WeakPolarHBondContact O-CG 3.29Å; S312-R316 PolarHBondContact O-N 3.4Å
313	M	93.9	Very high	93.3	Very high	152 Å²	152	57 Å²	57	75%	0.749	29%	0.292	S	S	*	.	H	α-helix	trans	-58.8	-37.3	174.7	-170.4	-177	-69.5	0	0	111.8	R316 I317	M313-R316 WeakPolarHBondContact O-CB 3.38Å; M313-R316 PolarHBondContact O-N 3.28Å; M313-I317 HydrophobicContact CG-CD1 4.42Å; M313-I317 WeakPolarHBondContact O-CG1 3.25Å; M313-I317 PolarHBondContact O-N 3.29Å
314	V	95.4	Very high	93.5	Very high	76 Å²	76	58.5 Å²	58.5	46%	0.461	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-41.5	176.8	-175.7	0	0	0	0	111	L305 S312 R316 I317 F318	L305-V314 HydrophobicContact CD1-CB 4.33Å; L305-V314 HydrophobicContact CD1-CG1 3.72Å; L305-V314 HydrophobicContact CG-CG1 4.26Å; S312-V314 PolarHBondContact O-N 3.08Å; V314-R316 VanDerWaalsContact C-N 3.31Å; V314-R316 PolarHBondContact O-N 2.91Å; V314-I317 PolarHBondContact O-N 3.04Å; V314-F318 PolarHBondContact O-N 3.49Å
315	A	94.7	Very high	93.7	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-40.3	175	0	0	0	0	0	112	L305 K308 S312 F318 A319	L305-A315 WeakPolarHBondContact O-CA 3.45Å; L305-A315 WeakPolarHBondContact O-CB 3.39Å; K308-A315 WeakPolarHBondContact O-CB 3.26Å; S312-A315 WeakPolarHBondContact O-CB 3.38Å; S312-A315 PolarHBondContact O-N 2.9Å; S312-A315 VanDerWaalsContact O-N 3.15Å; S312-A315 WeakPolarHBondContact OG-CB 3.39Å; S312-A315 PolarHBondContact OG-N 2.87Å; S312-A315 VanDerWaalsContact OG-N 3.07Å; A315-F318 PolarHBondContact O-N 2.92Å; A315-A319 PolarHBondContact O-N 2.8Å
316	R	94.6	Very high	93.8	Very high	171 Å²	171	57.9 Å²	57.9	65%	0.645	30%	0.304	S	S	*	.	H	α-helix	trans	-62	-44.4	174.2	-63.1	177.2	63.6	172.1	-2.2	111.9	P309 S312 M313 V314 A319 V320	P309-R316 WeakPolarHBondContact O-CG 3.33Å; P309-R316 PolarHBondContact O-N 3.45Å; S312-R316 WeakPolarHBondContact O-CG 3.29Å; S312-R316 PolarHBondContact O-N 3.4Å; M313-R316 WeakPolarHBondContact O-CB 3.38Å; M313-R316 PolarHBondContact O-N 3.28Å; V314-R316 VanDerWaalsContact C-N 3.31Å; V314-R316 PolarHBondContact O-N 2.91Å; R316-A319 PolarHBondContact O-N 2.97Å; R316-V320 WeakPolarHBondContact O-CG2 3.25Å; R316-V320 PolarHBondContact O-N 2.91Å
317	I	96.6	Very high	93.9	Very high	93 Å²	93	61.9 Å²	61.9	48%	0.477	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-46.7	177.8	-68.4	165.6	0	0	0	110.3	M313 V314 A319 V320 I321	M313-I317 HydrophobicContact CG-CD1 4.42Å; M313-I317 WeakPolarHBondContact O-CG1 3.25Å; M313-I317 PolarHBondContact O-N 3.29Å; V314-I317 PolarHBondContact O-N 3.04Å; I317-A319 VanDerWaalsContact C-N 3.32Å; I317-A319 PolarHBondContact O-N 3.09Å; I317-V320 PolarHBondContact O-N 3.49Å; I317-I321 HydrophobicContact CG2-CD1 3.84Å; I317-I321 HydrophobicContact CG2-CG1 4.42Å; I317-I321 WeakPolarHBondContact O-CG1 3.36Å; I317-I321 PolarHBondContact O-N 2.86Å
318	F	95.5	Very high	94.1	Very high	32 Å²	32	62.9 Å²	62.9	14%	0.14	33%	0.331	C	S	.	.	H	α-helix	trans	-55.8	-47.2	176.7	-178.4	-97.6	0	0	0	111.6	L305 V306 V314 A315 V320 I321 S322 W375 E379	L305-F318 HydrophobicContact CD2-CB 4.37Å; L305-F318 HydrophobicContact CD2-CG 4.35Å; V306-F318 HydrophobicContact CB-CE1 4.05Å; V306-F318 HydrophobicContact CB-CZ 4.41Å; V306-F318 HydrophobicContact CG1-CE1 4.23Å; V306-F318 HydrophobicContact CG1-CZ 4.2Å; V314-F318 PolarHBondContact O-N 3.49Å; A315-F318 PolarHBondContact O-N 2.92Å; F318-V320 PolarHBondContact O-N 2.96Å; F318-I321 PolarHBondContact O-N 2.66Å; F318-S322 PolarHBondContact O-N 3.1Å; F318-S322 PolarHBondContact O-OG 3.39Å; F318-W375 HydrophobicContact CE2-CH2 4.37Å; F318-W375 HydrophobicContact CE2-CZ2 4.25Å; F318-E379 HydrophobicContact CE1-CG 4.13Å; F318-E379 HydrophobicContact CZ-CG 3.65Å
319	A	94.9	Very high	94.3	Very high	12 Å²	12	61.5 Å²	61.5	10%	0.099	33%	0.325	C	S	.	.	H	α-helix	trans	-63.6	-39.1	177.2	0	0	0	0	0	113.5	P309 A315 R316 I317 I321 S322 I323	P309-A319 HydrophobicContact CB-CB 3.76Å; A315-A319 PolarHBondContact O-N 2.8Å; R316-A319 PolarHBondContact O-N 2.97Å; I317-A319 VanDerWaalsContact C-N 3.32Å; I317-A319 PolarHBondContact O-N 3.09Å; A319-I321 VanDerWaalsContact C-N 3.35Å; A319-S322 PolarHBondContact O-N 3.43Å; A319-I323 VanDerWaalsContact O-CG1 3.28Å; A319-I323 WeakPolarHBondContact O-CG1 3.37Å; A319-I323 PolarHBondContact O-N 2.76Å
320	V	96.2	Very high	94.5	Very high	97 Å²	97	61.5 Å²	61.5	59%	0.588	32%	0.322	S	S	*	.	H	α-helix	trans	-62.9	-42.8	175.2	169.6	0	0	0	0	111	R316 I317 F318 I323 A324	R316-V320 WeakPolarHBondContact O-CG2 3.25Å; R316-V320 PolarHBondContact O-N 2.91Å; I317-V320 PolarHBondContact O-N 3.49Å; F318-V320 PolarHBondContact O-N 2.96Å; V320-I323 PolarHBondContact O-N 3.41Å; V320-A324 PolarHBondContact O-N 2.88Å
321	I	96.7	Very high	94.8	Very high	69 Å²	69	59 Å²	59	35%	0.354	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-48.1	176.1	-65.9	169	0	0	0	110	I317 F318 A319 I323 A324 F325 W375	I317-I321 HydrophobicContact CG2-CD1 3.84Å; I317-I321 HydrophobicContact CG2-CG1 4.42Å; I317-I321 WeakPolarHBondContact O-CG1 3.36Å; I317-I321 PolarHBondContact O-N 2.86Å; F318-I321 PolarHBondContact O-N 2.66Å; A319-I321 VanDerWaalsContact C-N 3.35Å; I321-I323 VanDerWaalsContact C-N 3.3Å; I321-I323 PolarHBondContact O-N 3.29Å; I321-A324 WeakPolarHBondContact O-CB 3.3Å; I321-A324 PolarHBondContact O-N 3.02Å; I321-F325 HydrophobicContact CG2-CD2 3.77Å; I321-F325 HydrophobicContact CG2-CE2 3.65Å; I321-F325 WeakPolarHBondContact O-CD2 3.5Å; I321-F325 PolarHBondContact O-N 3.18Å; I321-W375 HydrophobicContact CB-CH2 4.46Å; I321-W375 HydrophobicContact CB-CZ2 4.28Å; I321-W375 HydrophobicContact CG2-CH2 3.51Å; I321-W375 HydrophobicContact CG2-CZ2 3.47Å; I321-W375 VanDerWaalsContact CG2-CZ2 3.47Å; I321-W375 HydrophobicContact CG2-CZ3 4.24Å
322	S	95.5	Very high	94.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-55.4	-43	175.9	-67.9	0	0	0	0	112.8	F318 A319 F325 I326 E379	F318-S322 PolarHBondContact O-N 3.1Å; F318-S322 PolarHBondContact O-OG 3.39Å; A319-S322 PolarHBondContact O-N 3.43Å; S322-F325 PolarHBondContact O-N 3.17Å; S322-I326 WeakPolarHBondContact O-CG1 3.36Å; S322-I326 PolarHBondContact O-N 3.07Å; S322-I326 VanDerWaalsContact O-N 3.14Å; S322-E379 VanDerWaalsContact CB-OE2 3.23Å; S322-E379 WeakPolarHBondContact CB-OE2 3.45Å; S322-E379 PolarHBondContact OG-OE2 2.87Å
323	I	95.9	Very high	94.7	Very high	52 Å²	52	56.1 Å²	56.1	27%	0.267	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-41.9	175.6	-67.7	164.6	0	0	0	111.1	A319 V320 I321 F325 I326 I327 H450	A319-I323 VanDerWaalsContact O-CG1 3.28Å; A319-I323 WeakPolarHBondContact O-CG1 3.37Å; A319-I323 PolarHBondContact O-N 2.76Å; V320-I323 PolarHBondContact O-N 3.41Å; I321-I323 VanDerWaalsContact C-N 3.3Å; I321-I323 PolarHBondContact O-N 3.29Å; I323-F325 VanDerWaalsContact C-N 3.33Å; I323-F325 PolarHBondContact O-N 2.86Å; I323-I326 WeakPolarHBondContact O-CB 3.39Å; I323-I326 PolarHBondContact O-N 3.02Å; I323-I326 VanDerWaalsContact O-N 3.13Å; I323-I327 HydrophobicContact CG2-CD1 4.08Å; I323-I327 WeakPolarHBondContact O-CG1 3.34Å; I323-I327 PolarHBondContact O-N 3.34Å; I323-H450 HydrophobicContact CD1-CB 3.89Å; I323-H450 HydrophobicContact CG1-CB 4.13Å
324	A	97.3	Very high	94.5	Very high	54 Å²	54	53.3 Å²	53.3	45%	0.446	28%	0.28	S	S	.	.	H	α-helix	trans	-60.7	-41.2	177.5	0	0	0	0	0	111.9	V320 I321 I326 I327 L328	V320-A324 PolarHBondContact O-N 2.88Å; I321-A324 WeakPolarHBondContact O-CB 3.3Å; I321-A324 PolarHBondContact O-N 3.02Å; A324-I326 VanDerWaalsContact C-N 3.34Å; A324-I326 PolarHBondContact O-N 3.03Å; A324-I327 PolarHBondContact O-N 3.49Å; A324-L328 WeakPolarHBondContact O-CB 3.26Å; A324-L328 PolarHBondContact O-N 2.67Å
325	F	97.5	Very high	94.1	Very high	40 Å²	40	52.4 Å²	52.4	18%	0.175	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-36.6	173.7	-86	-83.3	0	0	0	112.7	I321 S322 I323 L328 S329 I371 W375 F376	I321-F325 HydrophobicContact CG2-CD2 3.77Å; I321-F325 HydrophobicContact CG2-CE2 3.65Å; I321-F325 WeakPolarHBondContact O-CD2 3.5Å; I321-F325 PolarHBondContact O-N 3.18Å; S322-F325 PolarHBondContact O-N 3.17Å; I323-F325 VanDerWaalsContact C-N 3.33Å; I323-F325 PolarHBondContact O-N 2.86Å; F325-L328 PolarHBondContact O-N 3.01Å; F325-S329 VanDerWaalsContact O-CB 3.24Å; F325-S329 WeakPolarHBondContact O-CB 3.38Å; F325-S329 PolarHBondContact O-N 2.9Å; F325-S329 PolarHBondContact O-OG 3.4Å; F325-I371 HydrophobicContact CE1-CG2 4.06Å; F325-W375 HydrophobicContact CB-CG 4.33Å; F325-W375 HydrophobicContact CD1-CB 3.82Å; F325-W375 AromaticContact CD1-CG 3.82Å; F325-W375 HydrophobicContact CD1-CG 3.82Å; F325-W375 AromaticContact CD2-CD1 3.62Å; F325-W375 AromaticContact CD2-CD2 3.63Å; F325-W375 HydrophobicContact CD2-CD2 3.63Å; F325-W375 AromaticContact CD2-CE2 3.64Å; F325-W375 HydrophobicContact CD2-CE3 4.3Å; F325-W375 AromaticContact CD2-CG 3.67Å; F325-W375 HydrophobicContact CD2-CG 3.67Å; F325-W375 HydrophobicContact CD2-CZ2 4.33Å; F325-W375 AromaticContact CD2-NE1 3.66Å; F325-W375 HydrophobicContact CE1-CB 3.79Å; F325-W375 HydrophobicContact CE1-CD2 4.4Å; F325-W375 AromaticContact CE1-CG 3.96Å; F325-W375 HydrophobicContact CE1-CG 3.96Å; F325-W375 HydrophobicContact CE2-CB 4.49Å; F325-W375 AromaticContact CE2-CD2 3.51Å; F325-W375 HydrophobicContact CE2-CD2 3.51Å; F325-W375 AromaticContact CE2-CE2 3.87Å; F325-W375 AromaticContact CE2-CE3 3.71Å; F325-W375 HydrophobicContact CE2-CE3 3.71Å; F325-W375 AromaticContact CE2-CG 3.83Å; F325-W375 HydrophobicContact CE2-CG 3.83Å; F325-W375 HydrophobicContact CE2-CZ2 4.38Å; F325-W375 HydrophobicContact CE2-CZ3 4.21Å; F325-W375 HydrophobicContact CG-CB 4.19Å; F325-W375 AromaticContact CG-CD1 3.49Å; F325-W375 VanDerWaalsContact CG-CD1 3.49Å; F325-W375 HydrophobicContact CG-CD2 4.16Å; F325-W375 AromaticContact CG-CG 3.67Å; F325-W375 HydrophobicContact CG-CG 3.67Å; F325-W375 AromaticContact CG-NE1 3.95Å; F325-W375 HydrophobicContact CZ-CB 4.15Å; F325-W375 AromaticContact CZ-CD2 3.92Å; F325-W375 HydrophobicContact CZ-CD2 3.92Å; F325-W375 AromaticContact CZ-CE3 3.96Å; F325-W375 HydrophobicContact CZ-CE3 3.96Å; F325-W375 AromaticContact CZ-CG 3.98Å; F325-W375 HydrophobicContact CZ-CG 3.98Å; F325-F376 HydrophobicContact CB-CE1 3.78Å; F325-F376 HydrophobicContact CB-CZ 4.11Å
326	I	95.7	Very high	93.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-47.3	173.1	-61.9	164.1	0	0	0	110.2	S322 I323 A324 S329 I330 F376 K446 L447	S322-I326 WeakPolarHBondContact O-CG1 3.36Å; S322-I326 PolarHBondContact O-N 3.07Å; S322-I326 VanDerWaalsContact O-N 3.14Å; I323-I326 WeakPolarHBondContact O-CB 3.39Å; I323-I326 PolarHBondContact O-N 3.02Å; I323-I326 VanDerWaalsContact O-N 3.13Å; A324-I326 VanDerWaalsContact C-N 3.34Å; A324-I326 PolarHBondContact O-N 3.03Å; I326-S329 PolarHBondContact O-N 3.23Å; I326-S329 PolarHBondContact O-OG 3.46Å; I326-I330 HydrophobicContact CG2-CD1 4.12Å; I326-I330 WeakPolarHBondContact O-CG1 3.37Å; I326-I330 PolarHBondContact O-N 3.12Å; I326-I330 VanDerWaalsContact O-N 3.13Å; I326-F376 HydrophobicContact CG1-CE1 3.99Å; I326-F376 HydrophobicContact CG1-CZ 3.96Å; I326-K446 HydrophobicContact CD1-CB 3.84Å; I326-K446 HydrophobicContact CD1-CD 3.9Å; I326-K446 HydrophobicContact CD1-CG 3.72Å; I326-K446 HydrophobicContact CG1-CB 4.36Å; I326-K446 HydrophobicContact CG1-CD 4.12Å; I326-K446 HydrophobicContact CG1-CG 4.41Å; I326-L447 HydrophobicContact CB-CD2 4.24Å; I326-L447 HydrophobicContact CD1-CD2 4.03Å; I326-L447 HydrophobicContact CG2-CD1 4.34Å; I326-L447 HydrophobicContact CG2-CD2 3.8Å; I326-L447 HydrophobicContact CG2-CG 3.8Å
327	I	95.9	Very high	93	Very high	90 Å²	90	49.4 Å²	49.4	46%	0.462	28%	0.275	S	S	.	.	H	α-helix	trans	-62.4	-46.9	178.5	-64.9	169.1	0	0	0	111.1	I323 A324 S329 I330 I331	I323-I327 HydrophobicContact CG2-CD1 4.08Å; I323-I327 WeakPolarHBondContact O-CG1 3.34Å; I323-I327 PolarHBondContact O-N 3.34Å; A324-I327 PolarHBondContact O-N 3.49Å; I327-S329 PolarHBondContact O-N 3.24Å; I327-I330 WeakPolarHBondContact O-CB 3.45Å; I327-I330 PolarHBondContact O-N 3.38Å; I327-I330 VanDerWaalsContact O-N 3.09Å; I327-I331 HydrophobicContact CG2-CD1 3.88Å; I327-I331 HydrophobicContact CG2-CG1 4.46Å; I327-I331 WeakPolarHBondContact O-CG1 3.47Å; I327-I331 PolarHBondContact O-N 3.16Å
328	L	95.6	Very high	92.3	Very high	67 Å²	67	49.2 Å²	49.2	35%	0.351	27%	0.273	S	S	.	.	H	α-helix	trans	-56.6	-40.6	177.9	-177.6	61.9	0	0	0	111.6	A324 F325 I330 I331 G332 L368	A324-L328 WeakPolarHBondContact O-CB 3.26Å; A324-L328 PolarHBondContact O-N 2.67Å; F325-L328 PolarHBondContact O-N 3.01Å; L328-I330 PolarHBondContact O-N 2.87Å; L328-I331 PolarHBondContact O-N 3.46Å; L328-G332 PolarHBondContact O-N 2.88Å; L328-L368 HydrophobicContact CD1-CD1 3.82Å; L328-L368 HydrophobicContact CD1-CG 4.37Å; L328-L368 HydrophobicContact CD2-CG 4.45Å; L328-L368 HydrophobicContact CG-CD1 4.19Å; L328-L368 HydrophobicContact CG-CD2 4.17Å; L328-L368 HydrophobicContact CG-CG 4.21Å
329	S	93.8	Very high	91.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68.2	-32.3	179	79.7	0	0	0	0	113.5	F325 I326 I327 L333 R443	F325-S329 VanDerWaalsContact O-CB 3.24Å; F325-S329 WeakPolarHBondContact O-CB 3.38Å; F325-S329 PolarHBondContact O-N 2.9Å; F325-S329 PolarHBondContact O-OG 3.4Å; I326-S329 PolarHBondContact O-N 3.23Å; I326-S329 PolarHBondContact O-OG 3.46Å; I327-S329 PolarHBondContact O-N 3.24Å; S329-L333 PolarHBondContact O-N 3.4Å; S329-R443 WeakPolarHBondContact OG-CD 3.49Å
330	I	93	Very high	89.9	Confident	46 Å²	46	59 Å²	59	24%	0.236	33%	0.325	C	S	.	.	H	α-helix	trans	-71.6	-43.1	174.1	-64.9	166.7	0	0	0	109.7	I326 I327 L328 G332 L333 N334 V444	I326-I330 HydrophobicContact CG2-CD1 4.12Å; I326-I330 WeakPolarHBondContact O-CG1 3.37Å; I326-I330 PolarHBondContact O-N 3.12Å; I326-I330 VanDerWaalsContact O-N 3.13Å; I327-I330 WeakPolarHBondContact O-CB 3.45Å; I327-I330 PolarHBondContact O-N 3.38Å; I327-I330 VanDerWaalsContact O-N 3.09Å; L328-I330 PolarHBondContact O-N 2.87Å; I330-G332 VanDerWaalsContact C-N 3.35Å; I330-L333 WeakPolarHBondContact O-CB 3.28Å; I330-L333 PolarHBondContact O-N 2.94Å; I330-N334 PolarHBondContact O-N 3.27Å; I330-N334 PolarHBondContact O-ND2 3Å; I330-V444 HydrophobicContact CD1-CB 4.48Å; I330-V444 HydrophobicContact CD1-CG1 4.41Å; I330-V444 HydrophobicContact CD1-CG2 3.74Å; I330-V444 HydrophobicContact CG1-CG2 3.71Å
331	I	92.3	Very high	88.3	Confident	85 Å²	85	57.1 Å²	57.1	44%	0.436	31%	0.312	S	S	.	.	H	α-helix	trans	-60	-48.5	175.2	-66.4	168.9	0	0	0	109.5	I327 L328 L333 N334 L335	I327-I331 HydrophobicContact CG2-CD1 3.88Å; I327-I331 HydrophobicContact CG2-CG1 4.46Å; I327-I331 WeakPolarHBondContact O-CG1 3.47Å; I327-I331 PolarHBondContact O-N 3.16Å; L328-I331 PolarHBondContact O-N 3.46Å; I331-L333 VanDerWaalsContact C-N 3.3Å; I331-L333 PolarHBondContact O-N 2.85Å; I331-N334 PolarHBondContact O-N 3.07Å; I331-N334 VanDerWaalsContact O-N 3.11Å; I331-L335 HydrophobicContact CG2-CD1 3.82Å; I331-L335 HydrophobicContact CG2-CG 4.14Å; I331-L335 VanDerWaalsContact O-CG 3.32Å; I331-L335 WeakPolarHBondContact O-CG 3.27Å; I331-L335 PolarHBondContact O-N 2.94Å
332	G	89.9	Confident	86.6	Confident	6 Å²	6	58.4 Å²	58.4	6%	0.062	31%	0.312	C	S	.	.	H	α-helix	trans	-55.9	-42.1	176.1	0	0	0	0	0	113.1	L328 I330 L335 S336	L328-G332 PolarHBondContact O-N 2.88Å; I330-G332 VanDerWaalsContact C-N 3.35Å; G332-L335 PolarHBondContact O-N 3.28Å; G332-S336 WeakPolarHBondContact O-CB 3.46Å; G332-S336 PolarHBondContact O-N 3Å
333	L	88.1	Confident	84.6	Confident	36 Å²	36	60.8 Å²	60.8	19%	0.188	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-49.2	174.3	179.7	65.3	0	0	0	111.7	S329 I330 I331 L335 S336 T337 I441	S329-L333 PolarHBondContact O-N 3.4Å; I330-L333 WeakPolarHBondContact O-CB 3.28Å; I330-L333 PolarHBondContact O-N 2.94Å; I331-L333 VanDerWaalsContact C-N 3.3Å; I331-L333 PolarHBondContact O-N 2.85Å; L333-L335 PolarHBondContact O-N 3.47Å; L333-S336 PolarHBondContact O-N 3.41Å; L333-S336 PolarHBondContact O-OG 3.09Å; L333-T337 PolarHBondContact O-N 2.92Å; L333-I441 HydrophobicContact CD2-CB 3.89Å; L333-I441 HydrophobicContact CD2-CD1 4.44Å; L333-I441 HydrophobicContact CD2-CG1 4Å
334	N	89.5	Confident	81.9	Confident	93 Å²	93	64.3 Å²	64.3	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-44.8	179.3	-75.6	-81.4	0	0	0	111.5	I330 I331 S336 T337	I330-N334 PolarHBondContact O-N 3.27Å; I330-N334 PolarHBondContact O-ND2 3Å; I331-N334 PolarHBondContact O-N 3.07Å; I331-N334 VanDerWaalsContact O-N 3.11Å; N334-S336 VanDerWaalsContact C-N 3.26Å; N334-S336 PolarHBondContact O-N 2.87Å; N334-T337 WeakPolarHBondContact O-CB 3.43Å; N334-T337 PolarHBondContact O-N 3.37Å; N334-T337 PolarHBondContact O-OG1 3.15Å
335	L	87.5	Confident	79.4	Confident	57 Å²	57	67.6 Å²	67.6	30%	0.298	38%	0.376	S	S	.	.	H	α-helix	trans	-60.9	-35.4	177.1	-66.1	178.9	0	0	0	112	I331 G332 L333 T337 M338 L341 L365	I331-L335 HydrophobicContact CG2-CD1 3.82Å; I331-L335 HydrophobicContact CG2-CG 4.14Å; I331-L335 VanDerWaalsContact O-CG 3.32Å; I331-L335 WeakPolarHBondContact O-CG 3.27Å; I331-L335 PolarHBondContact O-N 2.94Å; G332-L335 PolarHBondContact O-N 3.28Å; L333-L335 PolarHBondContact O-N 3.47Å; L335-T337 PolarHBondContact O-N 2.99Å; L335-M338 HydrophobicContact CD2-SD 4.06Å; L335-M338 PolarHBondContact O-N 3.29Å; L335-M338 VanDerWaalsContact O-N 3.13Å; L335-L341 HydrophobicContact CB-CD1 3.77Å; L335-L341 HydrophobicContact CD2-CD1 3.76Å; L335-L341 HydrophobicContact CG-CD1 4.27Å; L335-L365 HydrophobicContact CB-CD1 4.2Å; L335-L365 HydrophobicContact CB-CD2 3.81Å; L335-L365 HydrophobicContact CD1-CD2 4.13Å
336	S	82	Confident	76.7	Confident	25 Å²	25	70.3 Å²	70.3	18%	0.175	40%	0.4	C	S	.	.	H	α-helix	trans	-66.7	-16	175.6	79.7	0	0	0	0	114.2	G332 L333 N334 R342	G332-S336 WeakPolarHBondContact O-CB 3.46Å; G332-S336 PolarHBondContact O-N 3Å; L333-S336 PolarHBondContact O-N 3.41Å; L333-S336 PolarHBondContact O-OG 3.09Å; N334-S336 VanDerWaalsContact C-N 3.26Å; N334-S336 PolarHBondContact O-N 2.87Å; S336-R342 PolarHBondContact O-NE 3Å; S336-R342 PolarHBondContact O-NH2 3.49Å
337	T	82.5	Confident	74	Confident	84 Å²	84	73.6 Å²	73.6	52%	0.515	43%	0.434	S	S	.	.	H	α-helix	trans	-87.9	-16.7	174.8	68.3	0	0	0	0	113.3	L333 N334 L335	L333-T337 PolarHBondContact O-N 2.92Å; N334-T337 WeakPolarHBondContact O-CB 3.43Å; N334-T337 PolarHBondContact O-N 3.37Å; N334-T337 PolarHBondContact O-OG1 3.15Å; L335-T337 PolarHBondContact O-N 2.99Å
338	M	81.9	Confident	71.5	Confident	88 Å²	88	76.8 Å²	76.8	43%	0.433	45%	0.451	S	S	.	.			trans	-77.8	121.8	-177.6	-63	-174.9	112.2	0	0	110.7	L335 E340 L341 R342	L335-M338 HydrophobicContact CD2-SD 4.06Å; L335-M338 PolarHBondContact O-N 3.29Å; L335-M338 VanDerWaalsContact O-N 3.13Å; M338-E340 VanDerWaalsContact C-N 3.27Å; M338-E340 PolarHBondContact O-N 2.84Å; M338-L341 HydrophobicContact CB-CD1 4.2Å; M338-L341 HydrophobicContact CB-CG 4.37Å; M338-L341 PolarHBondContact O-N 3.12Å; M338-L341 VanDerWaalsContact O-N 3.1Å; M338-L341 HydrophobicContact SD-CD1 4.39Å; M338-R342 PolarHBondContact O-N 3.33Å
339	P	70.5	Confident	68.5	Low	103 Å²	103	81.8 Å²	81.8	67%	0.669	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-64.7	-31.7	-177.2	25.8	-33.8	0	0	0	112.4	L341 R342	P339-L341 PolarHBondContact O-N 3.43Å; P339-L341 VanDerWaalsContact O-N 3.15Å; P339-R342 PolarHBondContact O-N 2.83Å
340	E	70.5	Confident	65.9	Low	146 Å²	146	92.2 Å²	92.2	68%	0.682	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-57.2	-28.6	175.3	-63.2	170.2	-172.5	0	0	112.5	M338	M338-E340 VanDerWaalsContact C-N 3.27Å; M338-E340 PolarHBondContact O-N 2.84Å
341	L	62.8	Low	63.4	Low	58 Å²	58	97.4 Å²	97.4	30%	0.304	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-93.9	-8.3	178.3	-64.4	174.7	0	0	0	113.1	L335 M338 P339 G343 N362 L365	L335-L341 HydrophobicContact CB-CD1 3.77Å; L335-L341 HydrophobicContact CD2-CD1 3.76Å; L335-L341 HydrophobicContact CG-CD1 4.27Å; M338-L341 HydrophobicContact CB-CD1 4.2Å; M338-L341 HydrophobicContact CB-CG 4.37Å; M338-L341 PolarHBondContact O-N 3.12Å; M338-L341 VanDerWaalsContact O-N 3.1Å; M338-L341 HydrophobicContact SD-CD1 4.39Å; P339-L341 PolarHBondContact O-N 3.43Å; P339-L341 VanDerWaalsContact O-N 3.15Å; L341-G343 PolarHBondContact O-N 3.46Å; L341-N362 WeakPolarHBondContact O-CB 3.46Å; L341-L365 HydrophobicContact CB-CD1 4.44Å
342	R	60.5	Low	61.1	Low	96 Å²	96	99.9 Å²	99.9	36%	0.362	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	19.4	177.3	-68.7	-174.6	179.6	-172.1	3.7	113.9	S336 M338 P339 D359 Y360	S336-R342 PolarHBondContact O-NE 3Å; S336-R342 PolarHBondContact O-NH2 3.49Å; M338-R342 PolarHBondContact O-N 3.33Å; P339-R342 PolarHBondContact O-N 2.83Å; R342-D359 WeakPolarHBondContact CD-OD1 3.37Å; R342-D359 IonicContact NH1-OD2 3.51Å; R342-Y360 CarbonylContact C-O 3.57Å; R342-Y360 VanDerWaalsContact C-O 3.28Å
343	G	53.1	Low	58.7	Low	50 Å²	50	108.5 Å²	108.5	52%	0.515	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	113.5	78.2	176.3	0	0	0	0	0	111.9	L341	L341-G343 PolarHBondContact O-N 3.46Å
344	N	40.6	Very low	56.6	Low	127 Å²	127	113.5 Å²	113.5	68%	0.679	62%	0.62	S	S	*	*			trans	-92.9	39.8	158.8	-145.6	38.3	0	0	0	111	S346	N344-S346 PolarHBondContact O-N 3.31Å
345	S	43.3	Very low	54.4	Low	122 Å²	122	113.4 Å²	113.4	85%	0.853	63%	0.633	S	S	*	*			trans	-73.1	80.2	157.7	-71	0	0	0	0	107.3	G347	S345-G347 PolarHBondContact O-N 3.06Å
346	S	41.4	Very low	52.4	Low	97 Å²	97	116.8 Å²	116.8	68%	0.678	65%	0.651	S	S	*	*			trans	-51	122.4	167.2	-61.6	0	0	0	0	109.7	N344	N344-S346 PolarHBondContact O-N 3.31Å
347	G	39.2	Very low	50.6	Low	70 Å²	70	122.9 Å²	122.9	72%	0.722	68%	0.681	S	S	*	*			trans	69.3	78.5	139.4	0	0	0	0	0	118.4	S345	S345-G347 PolarHBondContact O-N 3.06Å
348	I	42.8	Very low	49	Very low	157 Å²	157	122.4 Å²	122.4	81%	0.805	68%	0.678	S	S	*	*			trans	-139.2	109.8	142.1	-59.7	-173.7	0	0	0	108.2
349	H	34.2	Very low	47.7	Very low	172 Å²	172	121.3 Å²	121.3	80%	0.796	68%	0.675	S	S	*	*			trans	71.9	110	157.7	-77.2	-111.6	0	0	0	119.5	D351	H349-D351 PolarHBondContact O-N 3.37Å
350	Y	38.1	Very low	47	Very low	219 Å²	219	124.8 Å²	124.8	86%	0.859	68%	0.676	S	S	*	*			trans	-38.8	122.8	142.2	-69.7	-96.2	0	0	0	109.9
351	D	41	Very low	46.7	Very low	154 Å²	154	120.3 Å²	120.3	82%	0.824	66%	0.658	S	S	*	*				-175.7	136.5	126.3	-88	-25.4	0	0	0	110.7	H349	H349-D351 PolarHBondContact O-N 3.37Å
352	N	43	Very low	47.4	Very low	138 Å²	138	119.8 Å²	119.8	74%	0.738	66%	0.655	S	S	*	*			trans	78.3	78.4	154.1	-140.1	2.3	0	0	0	118.1	N354	N352-N354 PolarHBondContact O-N 2.84Å
353	H	40.3	Very low	48.6	Very low	186 Å²	186	122.4 Å²	122.4	86%	0.861	67%	0.672	S	S	*	*	S	Bend		32.1	1.1	126.8	-101.8	-67.8	0	0	0	124.8
354	N	44.9	Very low	50.2	Low	141 Å²	141	126.9 Å²	126.9	75%	0.754	68%	0.679	S	S	*	*			trans	-136.5	14.5	177.3	-85.8	-18.8	0	0	0	113.5	N352 N356	N352-N354 PolarHBondContact O-N 2.84Å; N354-N356 PolarHBondContact O-N 2.85Å
355	A	43.3	Very low	52.5	Low	92 Å²	92	121.9 Å²	121.9	76%	0.76	65%	0.652	S	S	*	*			trans	-69.4	84.5	164.9	0	0	0	0	0	107.9	N357	A355-N357 PolarHBondContact O-N 3.27Å
356	N	44.5	Very low	54.4	Low	128 Å²	128	118.8 Å²	118.8	68%	0.684	62%	0.624	S	S	*	*			trans	-28.7	125.6	154.6	-63.6	-32.9	0	0	0	107.4	N354 T358	N354-N356 PolarHBondContact O-N 2.85Å; N356-T358 HydrophobicContact CB-CG2 4.46Å; N356-T358 PolarHBondContact O-N 3.43Å; N356-T358 PolarHBondContact O-OG1 3.47Å
357	N	44.7	Very low	56.8	Low	152 Å²	152	117.2 Å²	117.2	81%	0.813	61%	0.61	S	S	*	*			trans	-55.8	72.2	171.5	-85.4	-41.6	0	0	0	110	A355 D359 R430	A355-N357 PolarHBondContact O-N 3.27Å; N357-D359 PolarHBondContact O-N 3.45Å; N357-R430 PolarHBondContact O-NH1 3.25Å; N357-R430 VanDerWaalsContact O-NH1 3.13Å; N357-R430 PolarHBondContact O-NH2 2.92Å
358	T	48.9	Very low	59.3	Low	74 Å²	74	115.5 Å²	115.5	45%	0.454	59%	0.585	S	S	.	*			trans	-71.8	89.3	164.4	49.6	0	0	0	0	102.3	N356 Y360	N356-T358 HydrophobicContact CB-CG2 4.46Å; N356-T358 PolarHBondContact O-N 3.43Å; N356-T358 PolarHBondContact O-OG1 3.47Å; T358-Y360 VanDerWaalsContact O-CD2 3.22Å; T358-Y360 WeakPolarHBondContact O-CD2 3.32Å; T358-Y360 PolarHBondContact O-N 2.88Å; T358-Y360 WeakPolarHBondContact OG1-CE2 3.18Å
359	D	54.9	Low	61.5	Low	66 Å²	66	108.4 Å²	108.4	35%	0.353	55%	0.548	S	S	.	.			trans	-46.2	93.3	162.9	-160.1	21.8	0	0	0	105.2	R342 N357 V361	R342-D359 WeakPolarHBondContact CD-OD1 3.37Å; R342-D359 IonicContact NH1-OD2 3.51Å; N357-D359 PolarHBondContact O-N 3.45Å; D359-V361 VanDerWaalsContact C-N 3.29Å; D359-V361 WeakPolarHBondContact O-CG2 3.41Å; D359-V361 PolarHBondContact O-N 3Å
360	Y	55.3	Low	64.3	Low	176 Å²	176	103.3 Å²	103.3	69%	0.69	53%	0.527	S	S	*	.			trans	-69.9	95.2	-173.6	-98.2	-86.8	0	0	0	105.7	R342 T358 N362	R342-Y360 CarbonylContact C-O 3.57Å; R342-Y360 VanDerWaalsContact C-O 3.28Å; T358-Y360 VanDerWaalsContact O-CD2 3.22Å; T358-Y360 WeakPolarHBondContact O-CD2 3.32Å; T358-Y360 PolarHBondContact O-N 2.88Å; T358-Y360 WeakPolarHBondContact OG1-CE2 3.18Å; Y360-N362 PolarHBondContact O-N 3.39Å
361	V	63.8	Low	67.1	Low	52 Å²	52	97 Å²	97	32%	0.315	51%	0.507	S	S	.	.			trans	-70.2	130.8	177	-168.8	0	0	0	0	107.6	D359 E363 E366	D359-V361 VanDerWaalsContact C-N 3.29Å; D359-V361 WeakPolarHBondContact O-CG2 3.41Å; D359-V361 PolarHBondContact O-N 3Å; V361-E363 PolarHBondContact O-N 3.32Å; V361-E363 VanDerWaalsContact O-N 3.16Å; V361-E366 HydrophobicContact CB-CG 4.25Å; V361-E366 HydrophobicContact CG1-CG 3.69Å; V361-E366 WeakPolarHBondContact CG1-OE1 3.32Å
362	N	78	Confident	69.7	Low	46 Å²	46	89.7 Å²	89.7	25%	0.246	47%	0.468	C	S	.	.			trans	-57.1	119.1	177.8	-172.8	-31.7	0	0	0	110.6	L341 Y360 H364 L365 E366	L341-N362 WeakPolarHBondContact O-CB 3.46Å; Y360-N362 PolarHBondContact O-N 3.39Å; N362-H364 PolarHBondContact O-N 3.28Å; N362-H364 VanDerWaalsContact O-N 3.14Å; N362-H364 VanDerWaalsContact OD1-CB 3.28Å; N362-H364 WeakPolarHBondContact OD1-CB 3.33Å; N362-H364 PolarHBondContact OD1-CD2 2.98Å; N362-H364 PolarHBondContact OD1-N 2.88Å; N362-L365 HydrophobicContact CB-CB 4.27Å; N362-L365 HydrophobicContact CB-CD1 3.97Å; N362-L365 HydrophobicContact CB-CG 3.96Å; N362-L365 WeakPolarHBondContact O-CB 3.19Å; N362-L365 PolarHBondContact O-N 2.91Å; N362-E366 PolarHBondContact O-N 2.94Å
363	E	84.9	Confident	72.2	Confident	152 Å²	152	83.2 Å²	83.2	71%	0.71	43%	0.433	S	S	*	.	H	α-helix	trans	-53	-35.9	179.8	-174	-178.2	169.3	0	0	112.1	V361 L365 E366 T367	V361-E363 PolarHBondContact O-N 3.32Å; V361-E363 VanDerWaalsContact O-N 3.16Å; E363-L365 PolarHBondContact O-N 3.44Å; E363-E366 PolarHBondContact O-N 3.39Å; E363-T367 WeakPolarHBondContact O-CB 3.41Å; E363-T367 PolarHBondContact O-N 2.92Å; E363-T367 PolarHBondContact O-OG1 2.94Å
364	H	88.1	Confident	74.9	Confident	144 Å²	144	78.5 Å²	78.5	67%	0.667	41%	0.413	S	S	*	.	H	α-helix	trans	-66.6	-35.7	177.5	-57.2	-50.4	0	0	0	112.6	N362 L368	N362-H364 PolarHBondContact O-N 3.28Å; N362-H364 VanDerWaalsContact O-N 3.14Å; N362-H364 VanDerWaalsContact OD1-CB 3.28Å; N362-H364 WeakPolarHBondContact OD1-CB 3.33Å; N362-H364 PolarHBondContact OD1-CD2 2.98Å; N362-H364 PolarHBondContact OD1-N 2.88Å; H364-L368 WeakPolarHBondContact O-CB 3.2Å; H364-L368 PolarHBondContact O-N 3.22Å
365	L	87.3	Confident	77.4	Confident	21 Å²	21	75 Å²	75	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-73.2	-39.3	178.4	-65.9	179.9	0	0	0	111.5	L335 L341 N362 E363 T367 L368 E369	L335-L365 HydrophobicContact CB-CD1 4.2Å; L335-L365 HydrophobicContact CB-CD2 3.81Å; L335-L365 HydrophobicContact CD1-CD2 4.13Å; L341-L365 HydrophobicContact CB-CD1 4.44Å; N362-L365 HydrophobicContact CB-CB 4.27Å; N362-L365 HydrophobicContact CB-CD1 3.97Å; N362-L365 HydrophobicContact CB-CG 3.96Å; N362-L365 WeakPolarHBondContact O-CB 3.19Å; N362-L365 PolarHBondContact O-N 2.91Å; E363-L365 PolarHBondContact O-N 3.44Å; L365-T367 VanDerWaalsContact C-N 3.34Å; L365-L368 PolarHBondContact O-N 2.79Å; L365-E369 WeakPolarHBondContact O-CB 2.95Å; L365-E369 PolarHBondContact O-N 2.79Å
366	E	84.6	Confident	80	Confident	58 Å²	58	70.8 Å²	70.8	27%	0.271	35%	0.354	S	S	.	.	H	α-helix	trans	-67.3	-37.1	173.6	-71.7	-65	162.6	0	0	111.4	V361 N362 E363 E369 L370	V361-E366 HydrophobicContact CB-CG 4.25Å; V361-E366 HydrophobicContact CG1-CG 3.69Å; V361-E366 WeakPolarHBondContact CG1-OE1 3.32Å; N362-E366 PolarHBondContact O-N 2.94Å; E363-E366 PolarHBondContact O-N 3.39Å; E366-E369 WeakPolarHBondContact O-CB 3.48Å; E366-E369 PolarHBondContact O-N 2.64Å; E366-L370 WeakPolarHBondContact O-CB 3.46Å; E366-L370 PolarHBondContact O-N 3.49Å
367	T	90.9	Very high	82.5	Confident	63 Å²	63	66.2 Å²	66.2	39%	0.387	33%	0.331	S	S	.	.	H	α-helix	trans	-62.7	-44.4	173	-58.4	0	0	0	0	111.5	E363 L365 E369 L370 I371	E363-T367 WeakPolarHBondContact O-CB 3.41Å; E363-T367 PolarHBondContact O-N 2.92Å; E363-T367 PolarHBondContact O-OG1 2.94Å; L365-T367 VanDerWaalsContact C-N 3.34Å; T367-E369 VanDerWaalsContact C-N 3.34Å; T367-E369 PolarHBondContact O-N 3.32Å; T367-L370 PolarHBondContact O-N 3.4Å; T367-I371 HydrophobicContact CG2-CD1 3.95Å; T367-I371 VanDerWaalsContact O-CG1 3.27Å; T367-I371 WeakPolarHBondContact O-CG1 3.46Å; T367-I371 PolarHBondContact O-N 2.86Å
368	L	91.3	Very high	85	Confident	35 Å²	35	63.1 Å²	63.1	18%	0.183	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-44.3	175.9	-178.8	161.3	0	0	0	111.3	L328 H364 L365 I371 C372	L328-L368 HydrophobicContact CD1-CD1 3.82Å; L328-L368 HydrophobicContact CD1-CG 4.37Å; L328-L368 HydrophobicContact CD2-CG 4.45Å; L328-L368 HydrophobicContact CG-CD1 4.19Å; L328-L368 HydrophobicContact CG-CD2 4.17Å; L328-L368 HydrophobicContact CG-CG 4.21Å; H364-L368 WeakPolarHBondContact O-CB 3.2Å; H364-L368 PolarHBondContact O-N 3.22Å; L365-L368 PolarHBondContact O-N 2.79Å; L368-I371 PolarHBondContact O-N 3.01Å; L368-C372 PolarHBondContact O-N 2.98Å; L368-C372 PolarHBondContact O-SG 3.07Å
369	E	90.5	Very high	87.3	Confident	8 Å²	8	59.8 Å²	59.8	4%	0.037	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-45.3	176.9	178.1	68.6	-179.4	0	0	111.7	L365 E366 T367 C372 T373 Y409 R440 R443	L365-E369 WeakPolarHBondContact O-CB 2.95Å; L365-E369 PolarHBondContact O-N 2.79Å; E366-E369 WeakPolarHBondContact O-CB 3.48Å; E366-E369 PolarHBondContact O-N 2.64Å; T367-E369 VanDerWaalsContact C-N 3.34Å; T367-E369 PolarHBondContact O-N 3.32Å; E369-C372 PolarHBondContact O-N 3.05Å; E369-T373 WeakPolarHBondContact O-CB 3.23Å; E369-T373 PolarHBondContact O-N 3.06Å; E369-T373 PolarHBondContact O-OG1 3.13Å; E369-Y409 HydrophobicContact CG-CD2 4.25Å; E369-R440 WeakPolarHBondContact OE1-CD 3.02Å; E369-R440 IonicContact OE1-CZ 3.79Å; E369-R440 IonicContact OE1-NE 3.3Å; E369-R440 PolarHBondContact OE1-NE 3.06Å; E369-R440 IonicContact OE1-NH1 3.39Å; E369-R443 IonicContact OE1-CZ 2.64Å; E369-R443 IonicContact OE1-NH1 2.7Å; E369-R443 PolarHBondContact OE1-NH1 3.08Å; E369-R443 IonicContact OE1-NH2 2.79Å; E369-R443 PolarHBondContact OE1-NH2 3.3Å; E369-R443 IonicContact OE2-CZ 2.75Å; E369-R443 IonicContact OE2-NH1 3.82Å; E369-R443 PolarHBondContact OE2-NH1 2.79Å; E369-R443 IonicContact OE2-NH2 2.89Å
370	L	92.7	Very high	89.3	Confident	65 Å²	65	57.9 Å²	57.9	34%	0.34	28%	0.284	S	S	.	.	H	α-helix	trans	-60.3	-47.7	175.7	172.8	58.5	0	0	0	111.2	E366 T367 C372 T373 I374 Y409	E366-L370 WeakPolarHBondContact O-CB 3.46Å; E366-L370 PolarHBondContact O-N 3.49Å; T367-L370 PolarHBondContact O-N 3.4Å; L370-C372 PolarHBondContact O-N 3.47Å; L370-T373 PolarHBondContact O-N 3.38Å; L370-I374 HydrophobicContact CD1-CD1 3.67Å; L370-I374 HydrophobicContact CD1-CG1 3.91Å; L370-I374 HydrophobicContact CG-CD1 3.8Å; L370-I374 HydrophobicContact CG-CG1 4.44Å; L370-I374 WeakPolarHBondContact O-CB 3.42Å; L370-I374 VanDerWaalsContact O-CG1 3.27Å; L370-I374 WeakPolarHBondContact O-CG1 3.3Å; L370-I374 PolarHBondContact O-N 3.1Å; L370-Y409 HydrophobicContact CD1-CE1 4.18Å; L370-Y409 HydrophobicContact CD1-CE2 4.42Å; L370-Y409 WeakPolarHBondContact CD1-OH 3.4Å
371	I	95.7	Very high	91.3	Very high	87 Å²	87	51.9 Å²	51.9	45%	0.446	27%	0.271	S	S	.	.	H	α-helix	trans	-59.5	-46.1	178.7	-70	166.5	0	0	0	110.9	F325 T367 L368 T373 I374 W375	F325-I371 HydrophobicContact CE1-CG2 4.06Å; T367-I371 HydrophobicContact CG2-CD1 3.95Å; T367-I371 VanDerWaalsContact O-CG1 3.27Å; T367-I371 WeakPolarHBondContact O-CG1 3.46Å; T367-I371 PolarHBondContact O-N 2.86Å; L368-I371 PolarHBondContact O-N 3.01Å; I371-T373 PolarHBondContact O-N 3.48Å; I371-I374 PolarHBondContact O-N 3.46Å; I371-W375 PolarHBondContact O-N 3.07Å
372	C	96.1	Very high	92.8	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-41.6	177.6	-66.8	0	0	0	0	111.8	L368 E369 L370 W375 F376	L368-C372 PolarHBondContact O-N 2.98Å; L368-C372 PolarHBondContact O-SG 3.07Å; E369-C372 PolarHBondContact O-N 3.05Å; L370-C372 PolarHBondContact O-N 3.47Å; C372-W375 PolarHBondContact O-N 3.07Å; C372-F376 HydrophobicContact CB-CE2 4.41Å; C372-F376 VanDerWaalsContact O-CD2 3.31Å; C372-F376 WeakPolarHBondContact O-CD2 3.48Å; C372-F376 WeakPolarHBondContact O-CG 3.28Å; C372-F376 PolarHBondContact O-N 3.22Å
373	T	95.1	Very high	93.7	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.012	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-42.9	178.3	-57.9	0	0	0	0	111.4	E369 L370 I371 W375 F376 T377 Y409 Y410	E369-T373 WeakPolarHBondContact O-CB 3.23Å; E369-T373 PolarHBondContact O-N 3.06Å; E369-T373 PolarHBondContact O-OG1 3.13Å; L370-T373 PolarHBondContact O-N 3.38Å; I371-T373 PolarHBondContact O-N 3.48Å; T373-W375 VanDerWaalsContact C-N 3.35Å; T373-F376 PolarHBondContact O-N 3.23Å; T373-T377 VanDerWaalsContact O-CB 3.32Å; T373-T377 WeakPolarHBondContact O-CB 3.46Å; T373-T377 PolarHBondContact O-N 2.81Å; T373-T377 PolarHBondContact O-OG1 2.88Å; T373-Y409 HydrophobicContact CG2-CD1 3.72Å; T373-Y409 HydrophobicContact CG2-CG 3.79Å; T373-Y410 HydrophobicContact CG2-CE2 4.07Å
374	I	96.8	Very high	94.2	Very high	87 Å²	87	44.8 Å²	44.8	45%	0.446	24%	0.236	S	C	.	.	H	α-helix	trans	-58.8	-49	174.4	-71.4	167.1	0	0	0	109.7	L370 I371 F376 T377 V378	L370-I374 HydrophobicContact CD1-CD1 3.67Å; L370-I374 HydrophobicContact CD1-CG1 3.91Å; L370-I374 HydrophobicContact CG-CD1 3.8Å; L370-I374 HydrophobicContact CG-CG1 4.44Å; L370-I374 WeakPolarHBondContact O-CB 3.42Å; L370-I374 VanDerWaalsContact O-CG1 3.27Å; L370-I374 WeakPolarHBondContact O-CG1 3.3Å; L370-I374 PolarHBondContact O-N 3.1Å; I371-I374 PolarHBondContact O-N 3.46Å; I374-F376 PolarHBondContact O-N 3.19Å; I374-T377 PolarHBondContact O-N 3.26Å; I374-V378 HydrophobicContact CG2-CG2 4.32Å; I374-V378 WeakPolarHBondContact O-CG2 3.28Å; I374-V378 PolarHBondContact O-N 3.43Å
375	W	97.8	Very high	94.5	Very high	67 Å²	67	41.2 Å²	41.2	25%	0.254	23%	0.227	S	C	.	.	H	α-helix	trans	-55.6	-52.6	177.9	175.8	-93	0	0	0	111.2	F318 I321 F325 I371 C372 T373 T377 V378 E379	F318-W375 HydrophobicContact CE2-CH2 4.37Å; F318-W375 HydrophobicContact CE2-CZ2 4.25Å; I321-W375 HydrophobicContact CB-CH2 4.46Å; I321-W375 HydrophobicContact CB-CZ2 4.28Å; I321-W375 HydrophobicContact CG2-CH2 3.51Å; I321-W375 HydrophobicContact CG2-CZ2 3.47Å; I321-W375 VanDerWaalsContact CG2-CZ2 3.47Å; I321-W375 HydrophobicContact CG2-CZ3 4.24Å; F325-W375 HydrophobicContact CB-CG 4.33Å; F325-W375 HydrophobicContact CD1-CB 3.82Å; F325-W375 AromaticContact CD1-CG 3.82Å; F325-W375 HydrophobicContact CD1-CG 3.82Å; F325-W375 AromaticContact CD2-CD1 3.62Å; F325-W375 AromaticContact CD2-CD2 3.63Å; F325-W375 HydrophobicContact CD2-CD2 3.63Å; F325-W375 AromaticContact CD2-CE2 3.64Å; F325-W375 HydrophobicContact CD2-CE3 4.3Å; F325-W375 AromaticContact CD2-CG 3.67Å; F325-W375 HydrophobicContact CD2-CG 3.67Å; F325-W375 HydrophobicContact CD2-CZ2 4.33Å; F325-W375 AromaticContact CD2-NE1 3.66Å; F325-W375 HydrophobicContact CE1-CB 3.79Å; F325-W375 HydrophobicContact CE1-CD2 4.4Å; F325-W375 AromaticContact CE1-CG 3.96Å; F325-W375 HydrophobicContact CE1-CG 3.96Å; F325-W375 HydrophobicContact CE2-CB 4.49Å; F325-W375 AromaticContact CE2-CD2 3.51Å; F325-W375 HydrophobicContact CE2-CD2 3.51Å; F325-W375 AromaticContact CE2-CE2 3.87Å; F325-W375 AromaticContact CE2-CE3 3.71Å; F325-W375 HydrophobicContact CE2-CE3 3.71Å; F325-W375 AromaticContact CE2-CG 3.83Å; F325-W375 HydrophobicContact CE2-CG 3.83Å; F325-W375 HydrophobicContact CE2-CZ2 4.38Å; F325-W375 HydrophobicContact CE2-CZ3 4.21Å; F325-W375 HydrophobicContact CG-CB 4.19Å; F325-W375 AromaticContact CG-CD1 3.49Å; F325-W375 VanDerWaalsContact CG-CD1 3.49Å; F325-W375 HydrophobicContact CG-CD2 4.16Å; F325-W375 AromaticContact CG-CG 3.67Å; F325-W375 HydrophobicContact CG-CG 3.67Å; F325-W375 AromaticContact CG-NE1 3.95Å; F325-W375 HydrophobicContact CZ-CB 4.15Å; F325-W375 AromaticContact CZ-CD2 3.92Å; F325-W375 HydrophobicContact CZ-CD2 3.92Å; F325-W375 AromaticContact CZ-CE3 3.96Å; F325-W375 HydrophobicContact CZ-CE3 3.96Å; F325-W375 AromaticContact CZ-CG 3.98Å; F325-W375 HydrophobicContact CZ-CG 3.98Å; I371-W375 PolarHBondContact O-N 3.07Å; C372-W375 PolarHBondContact O-N 3.07Å; T373-W375 VanDerWaalsContact C-N 3.35Å; W375-T377 VanDerWaalsContact C-N 3.31Å; W375-T377 PolarHBondContact O-N 3.25Å; W375-V378 PolarHBondContact O-N 3.35Å; W375-E379 PolarHBondContact NE1-OE2 2.7Å; W375-E379 VanDerWaalsContact O-CB 3.3Å; W375-E379 WeakPolarHBondContact O-CB 3.32Å; W375-E379 PolarHBondContact O-N 2.9Å
376	F	97.4	Very high	94.8	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-63.4	-35.5	179.7	-64.2	-29.7	0	0	0	113.6	F325 I326 C372 T373 I374 E379 Y380 I406 K446	F325-F376 HydrophobicContact CB-CE1 3.78Å; F325-F376 HydrophobicContact CB-CZ 4.11Å; I326-F376 HydrophobicContact CG1-CE1 3.99Å; I326-F376 HydrophobicContact CG1-CZ 3.96Å; C372-F376 HydrophobicContact CB-CE2 4.41Å; C372-F376 VanDerWaalsContact O-CD2 3.31Å; C372-F376 WeakPolarHBondContact O-CD2 3.48Å; C372-F376 WeakPolarHBondContact O-CG 3.28Å; C372-F376 PolarHBondContact O-N 3.22Å; T373-F376 PolarHBondContact O-N 3.23Å; I374-F376 PolarHBondContact O-N 3.19Å; F376-E379 WeakPolarHBondContact O-CB 3.05Å; F376-E379 PolarHBondContact O-N 2.85Å; F376-Y380 WeakPolarHBondContact O-CB 3.32Å; F376-Y380 PolarHBondContact O-N 2.89Å; F376-I406 HydrophobicContact CB-CG2 3.41Å; F376-I406 VanDerWaalsContact CB-CG2 3.41Å; F376-I406 HydrophobicContact CG-CG2 4.47Å; F376-K446 HydrophobicContact CD1-CD 4.44Å; F376-K446 HydrophobicContact CE1-CD 4.41Å
377	T	97.8	Very high	95.2	Very high	32 Å²	32	38 Å²	38	20%	0.196	21%	0.213	C	C	.	.	H	α-helix	trans	-66.3	-47.3	176.8	-57.1	0	0	0	0	110.9	T373 I374 W375 E379 Y380 A381 I406 Y410	T373-T377 VanDerWaalsContact O-CB 3.32Å; T373-T377 WeakPolarHBondContact O-CB 3.46Å; T373-T377 PolarHBondContact O-N 2.81Å; T373-T377 PolarHBondContact O-OG1 2.88Å; I374-T377 PolarHBondContact O-N 3.26Å; W375-T377 VanDerWaalsContact C-N 3.31Å; W375-T377 PolarHBondContact O-N 3.25Å; T377-E379 VanDerWaalsContact C-N 3.31Å; T377-E379 PolarHBondContact O-N 3.5Å; T377-Y380 PolarHBondContact O-N 3.5Å; T377-A381 VanDerWaalsContact O-CB 3.23Å; T377-A381 WeakPolarHBondContact O-CB 3.13Å; T377-A381 PolarHBondContact O-N 3.31Å; T377-I406 HydrophobicContact CG2-CD1 4.46Å; T377-Y410 HydrophobicContact CG2-CE2 4.43Å; T377-Y410 WeakPolarHBondContact CG2-OH 3.47Å; T377-Y410 WeakPolarHBondContact OG1-CE2 3.35Å; T377-Y410 PolarHBondContact OG1-OH 3.03Å
378	V	97.7	Very high	95.2	Very high	87 Å²	87	36.4 Å²	36.4	53%	0.527	20%	0.203	S	C	.	.	H	α-helix	trans	-62.2	-41.9	175.2	171.7	0	0	0	0	110.4	I374 W375 Y380 A381 L382	I374-V378 HydrophobicContact CG2-CG2 4.32Å; I374-V378 WeakPolarHBondContact O-CG2 3.28Å; I374-V378 PolarHBondContact O-N 3.43Å; W375-V378 PolarHBondContact O-N 3.35Å; V378-Y380 PolarHBondContact O-N 3.15Å; V378-A381 PolarHBondContact O-N 3.49Å; V378-L382 WeakPolarHBondContact O-CB 2.96Å; V378-L382 PolarHBondContact O-N 2.92Å
379	E	96.6	Very high	95.2	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-58.7	-48.9	177.7	-148.1	-167.2	93.8	0	0	111.5	F318 S322 W375 F376 T377 R383 K446	F318-E379 HydrophobicContact CE1-CG 4.13Å; F318-E379 HydrophobicContact CZ-CG 3.65Å; S322-E379 VanDerWaalsContact CB-OE2 3.23Å; S322-E379 WeakPolarHBondContact CB-OE2 3.45Å; S322-E379 PolarHBondContact OG-OE2 2.87Å; W375-E379 PolarHBondContact NE1-OE2 2.7Å; W375-E379 VanDerWaalsContact O-CB 3.3Å; W375-E379 WeakPolarHBondContact O-CB 3.32Å; W375-E379 PolarHBondContact O-N 2.9Å; F376-E379 WeakPolarHBondContact O-CB 3.05Å; F376-E379 PolarHBondContact O-N 2.85Å; T377-E379 VanDerWaalsContact C-N 3.31Å; T377-E379 PolarHBondContact O-N 3.5Å; E379-R383 VanDerWaalsContact CG-NH1 3.3Å; E379-R383 WeakPolarHBondContact O-CG 2.94Å; E379-R383 PolarHBondContact O-N 3.34Å; E379-R383 VanDerWaalsContact O-N 3.12Å; E379-R383 IonicContact OE1-CZ 3.58Å; E379-R383 IonicContact OE1-NH1 3.61Å; E379-R383 PolarHBondContact OE1-NH1 2.89Å; E379-R383 IonicContact OE1-NH2 2.95Å; E379-R383 PolarHBondContact OE1-NH2 3.32Å; E379-K446 WeakPolarHBondContact OE1-CE 3.33Å; E379-K446 IonicContact OE1-NZ 3.18Å; E379-K446 PolarHBondContact OE1-NZ 3.37Å; E379-K446 IonicContact OE2-NZ 3.68Å; E379-K446 PolarHBondContact OE2-NZ 2.98Å; E379-K446 VanDerWaalsContact OE2-NZ 3.16Å
380	Y	97.3	Very high	95.3	Very high	26 Å²	26	42.3 Å²	42.3	10%	0.102	23%	0.231	C	C	.	.	H	α-helix	trans	-67.4	-45.3	178	-179.3	-100.3	0	0	0	112.1	F376 T377 V378 L382 R383 L384 F393 N399 D402 V403	F376-Y380 WeakPolarHBondContact O-CB 3.32Å; F376-Y380 PolarHBondContact O-N 2.89Å; T377-Y380 PolarHBondContact O-N 3.5Å; V378-Y380 PolarHBondContact O-N 3.15Å; Y380-L382 VanDerWaalsContact C-N 3.33Å; Y380-L382 PolarHBondContact O-N 3.47Å; Y380-R383 PolarHBondContact O-N 2.86Å; Y380-L384 HydrophobicContact CE1-CD2 4.21Å; Y380-L384 WeakPolarHBondContact O-CB 3.46Å; Y380-L384 PolarHBondContact O-N 3.04Å; Y380-F393 HydrophobicContact CD2-CE1 4.31Å; Y380-F393 AromaticContact CE2-CE1 3.71Å; Y380-F393 HydrophobicContact CE2-CE1 3.71Å; Y380-F393 HydrophobicContact CE2-CZ 4.44Å; Y380-N399 HydrophobicContact CE2-CB 4.32Å; Y380-D402 HydrophobicContact CD2-CB 3.7Å; Y380-D402 HydrophobicContact CE2-CB 4.33Å; Y380-V403 HydrophobicContact CD1-CG2 4.34Å; Y380-V403 HydrophobicContact CD2-CG2 4.17Å; Y380-V403 HydrophobicContact CE1-CG2 3.68Å; Y380-V403 HydrophobicContact CE2-CG2 3.47Å; Y380-V403 VanDerWaalsContact CE2-CG2 3.47Å; Y380-V403 VanDerWaalsContact OH-CG2 3.26Å; Y380-V403 WeakPolarHBondContact OH-CG2 3.2Å
381	A	97.3	Very high	95.3	Very high	50 Å²	50	43.6 Å²	43.6	41%	0.413	24%	0.244	S	C	.	.	H	α-helix	trans	-61.5	-41.7	178.8	0	0	0	0	0	111.7	T377 V378 L384 S385	T377-A381 VanDerWaalsContact O-CB 3.23Å; T377-A381 WeakPolarHBondContact O-CB 3.13Å; T377-A381 PolarHBondContact O-N 3.31Å; V378-A381 PolarHBondContact O-N 3.49Å; A381-L384 PolarHBondContact O-N 3.38Å; A381-S385 WeakPolarHBondContact O-CB 3.46Å; A381-S385 PolarHBondContact O-N 2.87Å
382	L	95.9	Very high	95	Very high	54 Å²	54	42.8 Å²	42.8	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-60.1	-53.5	175.4	-179.2	60.7	0	0	0	110	M302 V306 V378 Y380 L384 S385 V386	M302-L382 HydrophobicContact CE-CD1 4.45Å; V306-L382 HydrophobicContact CG1-CD2 3.59Å; V306-L382 HydrophobicContact CG1-CG 4.03Å; V378-L382 WeakPolarHBondContact O-CB 2.96Å; V378-L382 PolarHBondContact O-N 2.92Å; Y380-L382 VanDerWaalsContact C-N 3.33Å; Y380-L382 PolarHBondContact O-N 3.47Å; L382-L384 VanDerWaalsContact C-N 3.34Å; L382-L384 PolarHBondContact O-N 3.36Å; L382-S385 PolarHBondContact O-N 3.11Å; L382-S385 VanDerWaalsContact O-N 3.08Å; L382-S385 PolarHBondContact O-OG 3.15Å; L382-V386 VanDerWaalsContact O-CG2 3.22Å; L382-V386 WeakPolarHBondContact O-CG2 3.24Å; L382-V386 PolarHBondContact O-N 3.31Å; L382-V386 VanDerWaalsContact O-N 3.13Å
383	R	95.2	Very high	94.9	Very high	3 Å²	3	43.2 Å²	43.2	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-57.8	-45.1	178.2	-70.2	-167.4	-174	94.2	4.1	113	V306 E307 E379 Y380 S385 V386 A387 F393	V306-R383 HydrophobicContact CB-CG 4.09Å; V306-R383 HydrophobicContact CG2-CG 3.77Å; V306-R383 PolarHBondContact O-NE 2.79Å; V306-R383 PolarHBondContact O-NH2 3Å; E307-R383 VanDerWaalsContact OE2-CD 3.28Å; E307-R383 WeakPolarHBondContact OE2-CD 3.08Å; E307-R383 IonicContact OE2-NE 3.68Å; E379-R383 VanDerWaalsContact CG-NH1 3.3Å; E379-R383 WeakPolarHBondContact O-CG 2.94Å; E379-R383 PolarHBondContact O-N 3.34Å; E379-R383 VanDerWaalsContact O-N 3.12Å; E379-R383 IonicContact OE1-CZ 3.58Å; E379-R383 IonicContact OE1-NH1 3.61Å; E379-R383 PolarHBondContact OE1-NH1 2.89Å; E379-R383 IonicContact OE1-NH2 2.95Å; E379-R383 PolarHBondContact OE1-NH2 3.32Å; Y380-R383 PolarHBondContact O-N 2.86Å; R383-S385 VanDerWaalsContact C-N 3.3Å; R383-S385 PolarHBondContact O-N 2.83Å; R383-V386 PolarHBondContact O-N 3.39Å; R383-A387 WeakPolarHBondContact O-CB 2.94Å; R383-A387 PolarHBondContact O-N 2.75Å; R383-F393 HydrophobicContact CB-CE1 4.41Å; R383-F393 HydrophobicContact CB-CE2 3.9Å; R383-F393 HydrophobicContact CB-CZ 3.47Å; R383-F393 VanDerWaalsContact CB-CZ 3.47Å
384	L	96.3	Very high	94.9	Very high	44 Å²	44	46.5 Å²	46.5	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-59.8	-42.7	176.4	178.7	61.8	0	0	0	110.9	Y380 A381 L382 V386 A387 K390 F393 I394	Y380-L384 HydrophobicContact CE1-CD2 4.21Å; Y380-L384 WeakPolarHBondContact O-CB 3.46Å; Y380-L384 PolarHBondContact O-N 3.04Å; A381-L384 PolarHBondContact O-N 3.38Å; L382-L384 VanDerWaalsContact C-N 3.34Å; L382-L384 PolarHBondContact O-N 3.36Å; L384-V386 PolarHBondContact O-N 3.07Å; L384-A387 WeakPolarHBondContact O-CB 3.45Å; L384-A387 PolarHBondContact O-N 3.18Å; L384-K390 HydrophobicContact CD1-CB 4.2Å; L384-K390 HydrophobicContact CD1-CD 4.02Å; L384-K390 WeakPolarHBondContact O-CD 3.41Å; L384-K390 WeakPolarHBondContact O-CE 3.27Å; L384-F393 HydrophobicContact CB-CD1 4.25Å; L384-F393 HydrophobicContact CB-CE1 4Å; L384-F393 HydrophobicContact CD1-CD1 3.64Å; L384-F393 HydrophobicContact CD1-CE1 4.23Å; L384-F393 HydrophobicContact CD1-CG 4.43Å; L384-I394 HydrophobicContact CD1-CD1 3.99Å; L384-I394 HydrophobicContact CD1-CG1 3.77Å
385	S	94.3	Very high	94.8	Very high	69 Å²	69	50.2 Å²	50.2	48%	0.483	28%	0.275	S	S	.	.	H	α-helix	trans	-62.8	-42.2	-178.8	77	0	0	0	0	112.8	A381 L382 R383 K390	A381-S385 WeakPolarHBondContact O-CB 3.46Å; A381-S385 PolarHBondContact O-N 2.87Å; L382-S385 PolarHBondContact O-N 3.11Å; L382-S385 VanDerWaalsContact O-N 3.08Å; L382-S385 PolarHBondContact O-OG 3.15Å; R383-S385 VanDerWaalsContact C-N 3.3Å; R383-S385 PolarHBondContact O-N 2.83Å; S385-K390 WeakPolarHBondContact O-CE 3.22Å; S385-K390 PolarHBondContact O-NZ 3.27Å; S385-K390 VanDerWaalsContact O-NZ 3.08Å
386	V	94.1	Very high	94.5	Very high	12 Å²	12	49 Å²	49	7%	0.073	28%	0.276	C	S	.	.	H	α-helix	trans	-84.8	-14.2	-179.6	-74.7	0	0	0	0	114	Q299 M302 W303 V306 L382 R383 L384	Q299-V386 HydrophobicContact CG-CB 4.34Å; Q299-V386 HydrophobicContact CG-CG1 4.49Å; Q299-V386 VanDerWaalsContact CG-O 3.28Å; Q299-V386 WeakPolarHBondContact CG-O 3.45Å; Q299-V386 PolarHBondContact NE2-O 3.31Å; M302-V386 HydrophobicContact CB-CB 4.45Å; M302-V386 HydrophobicContact CB-CG1 3.63Å; W303-V386 HydrophobicContact CE3-CG2 4.25Å; V306-V386 HydrophobicContact CG2-CG2 3.8Å; L382-V386 VanDerWaalsContact O-CG2 3.22Å; L382-V386 WeakPolarHBondContact O-CG2 3.24Å; L382-V386 PolarHBondContact O-N 3.31Å; L382-V386 VanDerWaalsContact O-N 3.13Å; R383-V386 PolarHBondContact O-N 3.39Å; L384-V386 PolarHBondContact O-N 3.07Å
387	A	93.4	Very high	94.3	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.008	30%	0.301	C	S	.	.			trans	-57.2	132.9	175.7	0	0	0	0	0	111.4	W303 R383 L384 K390 F393	W303-A387 HydrophobicContact CE3-CB 4.25Å; W303-A387 HydrophobicContact CH2-CB 4.28Å; W303-A387 VanDerWaalsContact CZ3-CA 3.44Å; W303-A387 HydrophobicContact CZ3-CB 3.58Å; R383-A387 WeakPolarHBondContact O-CB 2.94Å; R383-A387 PolarHBondContact O-N 2.75Å; L384-A387 WeakPolarHBondContact O-CB 3.45Å; L384-A387 PolarHBondContact O-N 3.18Å; A387-K390 HydrophobicContact CB-CD 4.31Å; A387-K390 PolarHBondContact O-NZ 3.37Å; A387-F393 HydrophobicContact CB-CB 3.8Å; A387-F393 HydrophobicContact CB-CD2 3.67Å; A387-F393 HydrophobicContact CB-CE2 4.45Å; A387-F393 HydrophobicContact CB-CG 3.76Å
388	P	90.8	Very high	94	Very high	29 Å²	29	52.3 Å²	52.3	19%	0.188	30%	0.297	C	S	.	.	S	Bend	trans	-64	-49.6	177.5	24.4	-33.3	0	0	0	111.4	E287 F290	E287-P388 WeakPolarHBondContact O-CG 3.4Å; F290-P388 HydrophobicContact CD1-CB 4.25Å; F290-P388 HydrophobicContact CE1-CB 4.11Å; F290-P388 HydrophobicContact CE1-CG 4.15Å; F290-P388 HydrophobicContact CZ-CG 4.17Å
389	N	90.1	Very high	93.9	Very high	80 Å²	80	48.4 Å²	48.4	43%	0.428	27%	0.273	S	S	.	.	S	Bend	trans	-111.2	99.6	-179.9	-72.1	-43.6	0	0	0	111.6	C391 T392 F393	N389-C391 PolarHBondContact O-N 3.28Å; N389-T392 PolarHBondContact O-N 3.44Å; N389-F393 WeakPolarHBondContact O-CB 3.49Å; N389-F393 PolarHBondContact O-N 2.85Å
390	K	92.4	Very high	93.9	Very high	87 Å²	87	52 Å²	52	38%	0.378	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-42.8	-173.9	-52.3	-58	-165.3	-91.3	0	113.4	L384 S385 A387 F393 I394	L384-K390 HydrophobicContact CD1-CB 4.2Å; L384-K390 HydrophobicContact CD1-CD 4.02Å; L384-K390 WeakPolarHBondContact O-CD 3.41Å; L384-K390 WeakPolarHBondContact O-CE 3.27Å; S385-K390 WeakPolarHBondContact O-CE 3.22Å; S385-K390 PolarHBondContact O-NZ 3.27Å; S385-K390 VanDerWaalsContact O-NZ 3.08Å; A387-K390 HydrophobicContact CB-CD 4.31Å; A387-K390 PolarHBondContact O-NZ 3.37Å; K390-F393 WeakPolarHBondContact O-CB 3.36Å; K390-F393 PolarHBondContact O-N 3.41Å; K390-I394 VanDerWaalsContact O-CG1 3.27Å; K390-I394 WeakPolarHBondContact O-CG1 3.24Å; K390-I394 PolarHBondContact O-N 3.27Å
391	C	92.5	Very high	93.8	Very high	92 Å²	92	52.9 Å²	52.9	62%	0.622	30%	0.298	S	S	*	.	H	α-helix	trans	-66.5	-41.5	-179.2	-70.9	0	0	0	0	112.2	N389 K395	N389-C391 PolarHBondContact O-N 3.28Å; C391-K395 WeakPolarHBondContact O-CB 3.42Å; C391-K395 VanDerWaalsContact O-CG 3.3Å; C391-K395 WeakPolarHBondContact O-CG 3.43Å; C391-K395 PolarHBondContact O-N 2.93Å; C391-K395 VanDerWaalsContact O-N 3.15Å
392	T	90.8	Very high	93.7	Very high	69 Å²	69	50.8 Å²	50.8	42%	0.423	28%	0.28	S	S	.	.	H	α-helix	trans	-65.7	-43	176.1	-50.2	0	0	0	0	110.4	E287 N389 I394 K395 S396	E287-T392 HydrophobicContact CG-CG2 4.39Å; N389-T392 PolarHBondContact O-N 3.44Å; T392-I394 PolarHBondContact O-N 3.03Å; T392-K395 PolarHBondContact O-N 3.33Å; T392-S396 PolarHBondContact O-N 3.25Å
393	F	93.7	Very high	93.7	Very high	9 Å²	9	49.9 Å²	49.9	4%	0.039	28%	0.277	C	S	.	.	H	α-helix	trans	-56.3	-52.4	174.9	-178.9	-87.8	0	0	0	111.7	W303 Y380 R383 L384 A387 N389 K390 K395 S396 N399	W303-F393 AromaticContact CH2-CD2 3.79Å; W303-F393 HydrophobicContact CH2-CD2 3.79Å; W303-F393 HydrophobicContact CH2-CE2 4.03Å; W303-F393 AromaticContact CZ3-CD2 3.83Å; W303-F393 HydrophobicContact CZ3-CD2 3.83Å; W303-F393 AromaticContact CZ3-CE2 3.89Å; W303-F393 HydrophobicContact CZ3-CE2 3.89Å; Y380-F393 HydrophobicContact CD2-CE1 4.31Å; Y380-F393 AromaticContact CE2-CE1 3.71Å; Y380-F393 HydrophobicContact CE2-CE1 3.71Å; Y380-F393 HydrophobicContact CE2-CZ 4.44Å; R383-F393 HydrophobicContact CB-CE1 4.41Å; R383-F393 HydrophobicContact CB-CE2 3.9Å; R383-F393 HydrophobicContact CB-CZ 3.47Å; R383-F393 VanDerWaalsContact CB-CZ 3.47Å; L384-F393 HydrophobicContact CB-CD1 4.25Å; L384-F393 HydrophobicContact CB-CE1 4Å; L384-F393 HydrophobicContact CD1-CD1 3.64Å; L384-F393 HydrophobicContact CD1-CE1 4.23Å; L384-F393 HydrophobicContact CD1-CG 4.43Å; A387-F393 HydrophobicContact CB-CB 3.8Å; A387-F393 HydrophobicContact CB-CD2 3.67Å; A387-F393 HydrophobicContact CB-CE2 4.45Å; A387-F393 HydrophobicContact CB-CG 3.76Å; N389-F393 WeakPolarHBondContact O-CB 3.49Å; N389-F393 PolarHBondContact O-N 2.85Å; K390-F393 WeakPolarHBondContact O-CB 3.36Å; K390-F393 PolarHBondContact O-N 3.41Å; F393-K395 VanDerWaalsContact C-N 3.26Å; F393-K395 PolarHBondContact O-N 3.19Å; F393-S396 WeakPolarHBondContact O-CB 3.42Å; F393-S396 PolarHBondContact O-N 3.46Å; F393-S396 VanDerWaalsContact O-N 3.12Å; F393-N399 HydrophobicContact CD1-CB 4.36Å; F393-N399 WeakPolarHBondContact CD2-ND2 3.32Å; F393-N399 HydrophobicContact CE1-CB 4.04Å; F393-N399 WeakPolarHBondContact CE2-ND2 2.87Å; F393-N399 WeakPolarHBondContact CG-ND2 3.23Å; F393-N399 HydrophobicContact CZ-CB 4.17Å; F393-N399 VanDerWaalsContact CZ-CG 3.41Å; F393-N399 WeakPolarHBondContact CZ-ND2 3.39Å; F393-N399 WeakPolarHBondContact CZ-OD1 3.44Å; F393-N399 VanDerWaalsContact O-CB 3.22Å; F393-N399 WeakPolarHBondContact O-CB 3.33Å; F393-N399 PolarHBondContact O-ND2 2.94Å
394	I	95	Very high	93.6	Very high	71 Å²	71	53.4 Å²	53.4	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-61	-35.8	-178.8	-67.5	164.6	0	0	0	111.7	L384 K390 T392 S396 L400	L384-I394 HydrophobicContact CD1-CD1 3.99Å; L384-I394 HydrophobicContact CD1-CG1 3.77Å; K390-I394 VanDerWaalsContact O-CG1 3.27Å; K390-I394 WeakPolarHBondContact O-CG1 3.24Å; K390-I394 PolarHBondContact O-N 3.27Å; T392-I394 PolarHBondContact O-N 3.03Å; I394-S396 VanDerWaalsContact C-N 3.3Å; I394-S396 PolarHBondContact O-N 3.34Å; I394-L400 VanDerWaalsContact O-CD2 3.27Å; I394-L400 WeakPolarHBondContact O-CD2 3.35Å; I394-L400 WeakPolarHBondContact O-CG 3.39Å
395	K	94	Very high	93.6	Very high	165 Å²	165	51.4 Å²	51.4	72%	0.717	29%	0.285	S	S	*	.	H	α-helix	trans	-77.4	-11.5	-179.6	-71.6	176.6	-179.6	-178.1	0	114	C391 T392 F393	C391-K395 WeakPolarHBondContact O-CB 3.42Å; C391-K395 VanDerWaalsContact O-CG 3.3Å; C391-K395 WeakPolarHBondContact O-CG 3.43Å; C391-K395 PolarHBondContact O-N 2.93Å; C391-K395 VanDerWaalsContact O-N 3.15Å; T392-K395 PolarHBondContact O-N 3.33Å; F393-K395 VanDerWaalsContact C-N 3.26Å; F393-K395 PolarHBondContact O-N 3.19Å
396	S	92.7	Very high	93.6	Very high	41 Å²	41	48.8 Å²	48.8	29%	0.287	27%	0.266	S	S	.	.	S	Bend	trans	-68.1	133.3	-179.8	176.2	0	0	0	0	110.9	T392 F393 I394 M398 N399 L400	T392-S396 PolarHBondContact O-N 3.25Å; F393-S396 WeakPolarHBondContact O-CB 3.42Å; F393-S396 PolarHBondContact O-N 3.46Å; F393-S396 VanDerWaalsContact O-N 3.12Å; I394-S396 VanDerWaalsContact C-N 3.3Å; I394-S396 PolarHBondContact O-N 3.34Å; S396-M398 VanDerWaalsContact C-N 3.25Å; S396-M398 PolarHBondContact O-N 3.27Å; S396-N399 WeakPolarHBondContact CB-ND2 3.28Å; S396-N399 PolarHBondContact O-N 2.97Å; S396-L400 PolarHBondContact O-N 3.36Å
397	P	92.7	Very high	93.6	Very high	81 Å²	81	51.1 Å²	51.1	53%	0.526	28%	0.277	S	S	.	.	H	α-helix	trans	-58.3	-36.7	-175.1	22.8	-33.9	0	0	0	112.9	N399 L400 I401	P397-N399 VanDerWaalsContact C-N 3.33Å; P397-N399 PolarHBondContact O-N 3.3Å; P397-L400 PolarHBondContact O-N 3.3Å; P397-I401 WeakPolarHBondContact O-CG1 3.44Å; P397-I401 PolarHBondContact O-N 2.94Å
398	M	92.1	Very high	93.5	Very high	26 Å²	26	51.2 Å²	51.2	13%	0.128	28%	0.278	C	S	.	.	H	α-helix	trans	-68.5	-34.8	178.6	-62.9	-52.2	-53.1	0	0	112.3	S396 I401 D402 A448 R449 Q455	S396-M398 VanDerWaalsContact C-N 3.25Å; S396-M398 PolarHBondContact O-N 3.27Å; M398-I401 HydrophobicContact CE-CD1 4.41Å; M398-I401 HydrophobicContact SD-CD1 4.33Å; M398-D402 PolarHBondContact O-N 3.48Å; M398-A448 HydrophobicContact CE-CB 3.96Å; M398-R449 VanDerWaalsContact CE-CA 3.43Å; M398-R449 HydrophobicContact CE-CB 3.65Å; M398-R449 PolarHBondContact O-NH2 3.34Å; M398-Q455 HydrophobicContact SD-CG 4.41Å
399	N	95.6	Very high	93.5	Very high	4 Å²	4	52 Å²	52	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-77.7	-28.7	177.6	-63.1	-26.7	0	0	0	111.6	Y380 F393 S396 P397 D402 V403 R449	Y380-N399 HydrophobicContact CE2-CB 4.32Å; F393-N399 HydrophobicContact CD1-CB 4.36Å; F393-N399 WeakPolarHBondContact CD2-ND2 3.32Å; F393-N399 HydrophobicContact CE1-CB 4.04Å; F393-N399 WeakPolarHBondContact CE2-ND2 2.87Å; F393-N399 WeakPolarHBondContact CG-ND2 3.23Å; F393-N399 HydrophobicContact CZ-CB 4.17Å; F393-N399 VanDerWaalsContact CZ-CG 3.41Å; F393-N399 WeakPolarHBondContact CZ-ND2 3.39Å; F393-N399 WeakPolarHBondContact CZ-OD1 3.44Å; F393-N399 VanDerWaalsContact O-CB 3.22Å; F393-N399 WeakPolarHBondContact O-CB 3.33Å; F393-N399 PolarHBondContact O-ND2 2.94Å; S396-N399 WeakPolarHBondContact CB-ND2 3.28Å; S396-N399 PolarHBondContact O-N 2.97Å; P397-N399 VanDerWaalsContact C-N 3.33Å; P397-N399 PolarHBondContact O-N 3.3Å; N399-D402 WeakPolarHBondContact O-CB 3.21Å; N399-D402 PolarHBondContact O-N 2.83Å; N399-V403 PolarHBondContact O-N 2.89Å; N399-V403 VanDerWaalsContact O-N 3.16Å; N399-R449 PolarHBondContact OD1-NH2 3Å
400	L	95.7	Very high	93.6	Very high	78 Å²	78	52.4 Å²	52.4	41%	0.408	27%	0.273	S	S	.	.	H	α-helix	trans	-65.3	-39.2	171.2	-71.5	174.4	0	0	0	111.9	I394 S396 P397 D402 V403 I404	I394-L400 VanDerWaalsContact O-CD2 3.27Å; I394-L400 WeakPolarHBondContact O-CD2 3.35Å; I394-L400 WeakPolarHBondContact O-CG 3.39Å; S396-L400 PolarHBondContact O-N 3.36Å; P397-L400 PolarHBondContact O-N 3.3Å; L400-D402 VanDerWaalsContact C-N 3.27Å; L400-D402 PolarHBondContact O-N 3.21Å; L400-V403 PolarHBondContact O-N 3.03Å; L400-I404 WeakPolarHBondContact O-CG1 3.31Å; L400-I404 PolarHBondContact O-N 3.3Å
401	I	94.9	Very high	93.4	Very high	46 Å²	46	51.7 Å²	51.7	24%	0.236	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-41.5	173.2	-67.7	167.7	0	0	0	110.4	P397 M398 V403 I404 A405 F445	P397-I401 WeakPolarHBondContact O-CG1 3.44Å; P397-I401 PolarHBondContact O-N 2.94Å; M398-I401 HydrophobicContact CE-CD1 4.41Å; M398-I401 HydrophobicContact SD-CD1 4.33Å; I401-V403 VanDerWaalsContact C-N 3.34Å; I401-V403 PolarHBondContact O-N 3.22Å; I401-I404 PolarHBondContact O-N 3.42Å; I401-A405 WeakPolarHBondContact O-CB 3.36Å; I401-A405 PolarHBondContact O-N 3.34Å; I401-F445 HydrophobicContact CG2-CB 3.8Å
402	D	95.5	Very high	93.1	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.027	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-39.9	177.3	-68.6	-32.7	0	0	0	112.2	Y380 M398 N399 L400 K446 R449	Y380-D402 HydrophobicContact CD2-CB 3.7Å; Y380-D402 HydrophobicContact CE2-CB 4.33Å; M398-D402 PolarHBondContact O-N 3.48Å; N399-D402 WeakPolarHBondContact O-CB 3.21Å; N399-D402 PolarHBondContact O-N 2.83Å; L400-D402 VanDerWaalsContact C-N 3.27Å; L400-D402 PolarHBondContact O-N 3.21Å; D402-K446 WeakPolarHBondContact OD1-CD 3.26Å; D402-K446 VanDerWaalsContact OD1-CE 3.28Å; D402-K446 WeakPolarHBondContact OD1-CE 3.49Å; D402-K446 WeakPolarHBondContact OD1-CG 3.44Å; D402-R449 IonicContact OD2-CZ 3.94Å; D402-R449 IonicContact OD2-NE 2.95Å; D402-R449 IonicContact OD2-NH2 2.66Å; D402-R449 PolarHBondContact OD2-NH2 3.43Å
403	V	95.7	Very high	92.8	Very high	36 Å²	36	47 Å²	47	22%	0.218	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-51	175	176.1	0	0	0	0	111	Y380 N399 L400 I401 A405 I406 L407	Y380-V403 HydrophobicContact CD1-CG2 4.34Å; Y380-V403 HydrophobicContact CD2-CG2 4.17Å; Y380-V403 HydrophobicContact CE1-CG2 3.68Å; Y380-V403 HydrophobicContact CE2-CG2 3.47Å; Y380-V403 VanDerWaalsContact CE2-CG2 3.47Å; Y380-V403 VanDerWaalsContact OH-CG2 3.26Å; Y380-V403 WeakPolarHBondContact OH-CG2 3.2Å; N399-V403 PolarHBondContact O-N 2.89Å; N399-V403 VanDerWaalsContact O-N 3.16Å; L400-V403 PolarHBondContact O-N 3.03Å; I401-V403 VanDerWaalsContact C-N 3.34Å; I401-V403 PolarHBondContact O-N 3.22Å; V403-A405 PolarHBondContact O-N 3.03Å; V403-I406 WeakPolarHBondContact O-CG1 3.47Å; V403-I406 PolarHBondContact O-N 3.43Å; V403-I406 VanDerWaalsContact O-N 3.08Å; V403-L407 HydrophobicContact CG1-CD1 4.09Å; V403-L407 HydrophobicContact CG1-CD2 4.46Å; V403-L407 HydrophobicContact CG1-CG 4.1Å; V403-L407 WeakPolarHBondContact O-CG 3.34Å; V403-L407 PolarHBondContact O-N 3.11Å
404	I	94.4	Very high	92.4	Very high	76 Å²	76	51 Å²	51	39%	0.39	26%	0.26	S	S	.	.	H	α-helix	trans	-59.9	-30.9	-178.1	-68.4	168.5	0	0	0	111.2	L400 I401 I406 P408 L442	L400-I404 WeakPolarHBondContact O-CG1 3.31Å; L400-I404 PolarHBondContact O-N 3.3Å; I401-I404 PolarHBondContact O-N 3.42Å; I404-I406 VanDerWaalsContact C-N 3.34Å; I404-I406 PolarHBondContact O-N 3.39Å; I404-P408 WeakPolarHBondContact O-CD 3.45Å; I404-L442 HydrophobicContact CG2-CB 4.17Å; I404-L442 HydrophobicContact CG2-CD1 3.44Å; I404-L442 VanDerWaalsContact CG2-CD1 3.44Å; I404-L442 HydrophobicContact CG2-CG 4.44Å
405	A	94.5	Very high	91.8	Very high	2 Å²	2	50.3 Å²	50.3	2%	0.017	25%	0.254	C	S	.	.	H	α-helix	trans	-65.2	-30.8	177.5	0	0	0	0	0	114.3	I401 V403 R443	I401-A405 WeakPolarHBondContact O-CB 3.36Å; I401-A405 PolarHBondContact O-N 3.34Å; V403-A405 PolarHBondContact O-N 3.03Å; A405-R443 HydrophobicContact CB-CB 3.8Å
406	I	94.7	Very high	90.9	Very high	15 Å²	15	49.5 Å²	49.5	8%	0.077	25%	0.253	C	S	.	.	H	α-helix	trans	-95.1	-24.4	-179.1	61.4	170.3	0	0	0	113.4	F376 T377 V403 I404 P408 Y409 Y410	F376-I406 HydrophobicContact CB-CG2 3.41Å; F376-I406 VanDerWaalsContact CB-CG2 3.41Å; F376-I406 HydrophobicContact CG-CG2 4.47Å; T377-I406 HydrophobicContact CG2-CD1 4.46Å; V403-I406 WeakPolarHBondContact O-CG1 3.47Å; V403-I406 PolarHBondContact O-N 3.43Å; V403-I406 VanDerWaalsContact O-N 3.08Å; I404-I406 VanDerWaalsContact C-N 3.34Å; I404-I406 PolarHBondContact O-N 3.39Å; I406-P408 VanDerWaalsContact C-CD 3.43Å; I406-Y409 PolarHBondContact O-N 3.3Å; I406-Y410 HydrophobicContact CB-CD2 4.47Å; I406-Y410 HydrophobicContact CB-CE2 4.33Å; I406-Y410 HydrophobicContact CD1-CE2 4.33Å; I406-Y410 WeakPolarHBondContact O-CD2 3.34Å
407	L	93.6	Very high	90.3	Very high	60 Å²	60	51.7 Å²	51.7	31%	0.314	26%	0.264	S	S	.	.	H	α-helix	trans	-53.6	-40.5	-178.2	-76.5	-179.8	0	0	0	115.2	V403 Y409 Y410 F411	V403-L407 HydrophobicContact CG1-CD1 4.09Å; V403-L407 HydrophobicContact CG1-CD2 4.46Å; V403-L407 HydrophobicContact CG1-CG 4.1Å; V403-L407 WeakPolarHBondContact O-CG 3.34Å; V403-L407 PolarHBondContact O-N 3.11Å; L407-Y409 VanDerWaalsContact C-N 3.3Å; L407-Y409 PolarHBondContact O-N 2.82Å; L407-Y410 PolarHBondContact O-N 2.92Å; L407-F411 HydrophobicContact CB-CD2 3.9Å; L407-F411 HydrophobicContact CB-CE2 3.72Å; L407-F411 HydrophobicContact CD1-CE2 3.97Å; L407-F411 HydrophobicContact CD1-CZ 4.43Å; L407-F411 HydrophobicContact CD2-CE2 4Å; L407-F411 HydrophobicContact CD2-CZ 4.1Å; L407-F411 HydrophobicContact CG-CE2 4.1Å; L407-F411 WeakPolarHBondContact O-CB 3.37Å; L407-F411 VanDerWaalsContact O-CD2 3.31Å; L407-F411 WeakPolarHBondContact O-CD2 3.27Å; L407-F411 PolarHBondContact O-N 3.44Å
408	P	91.7	Very high	89.3	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.019	28%	0.277	C	S	.	.	H	α-helix	trans	-50.8	-42.8	179.3	-35.5	39.8	0	0	0	115.3	I404 I406 S412 F436 L439 R440	I404-P408 WeakPolarHBondContact O-CD 3.45Å; I406-P408 VanDerWaalsContact C-CD 3.43Å; P408-S412 WeakPolarHBondContact O-CB 3.32Å; P408-S412 PolarHBondContact O-N 2.88Å; P408-S412 VanDerWaalsContact O-N 3.08Å; P408-S412 PolarHBondContact O-OG 2.91Å; P408-F436 WeakPolarHBondContact CB-O 3.5Å; P408-L439 HydrophobicContact CB-CB 4.5Å; P408-L439 HydrophobicContact CG-CB 3.86Å; P408-R440 HydrophobicContact CB-CG 3.7Å
409	Y	90.3	Very high	88.1	Confident	47 Å²	47	58.6 Å²	58.6	18%	0.184	28%	0.282	C	S	.	.	H	α-helix	trans	-69.9	-49.7	-179.3	176.9	-91.5	0	0	0	110.8	E369 L370 T373 I406 L407 F411 S412 V413	E369-Y409 HydrophobicContact CG-CD2 4.25Å; L370-Y409 HydrophobicContact CD1-CE1 4.18Å; L370-Y409 HydrophobicContact CD1-CE2 4.42Å; L370-Y409 WeakPolarHBondContact CD1-OH 3.4Å; T373-Y409 HydrophobicContact CG2-CD1 3.72Å; T373-Y409 HydrophobicContact CG2-CG 3.79Å; I406-Y409 PolarHBondContact O-N 3.3Å; L407-Y409 VanDerWaalsContact C-N 3.3Å; L407-Y409 PolarHBondContact O-N 2.82Å; Y409-F411 VanDerWaalsContact C-N 3.35Å; Y409-F411 PolarHBondContact O-N 3.44Å; Y409-S412 WeakPolarHBondContact O-CB 3.41Å; Y409-S412 PolarHBondContact O-N 2.91Å; Y409-S412 VanDerWaalsContact O-N 3.12Å; Y409-V413 HydrophobicContact CD1-CG2 4.32Å; Y409-V413 HydrophobicContact CE1-CG2 3.81Å; Y409-V413 HydrophobicContact CE2-CG2 4.38Å; Y409-V413 PolarHBondContact O-N 2.83Å
410	Y	92.6	Very high	86.5	Confident	88 Å²	88	66.1 Å²	66.1	35%	0.345	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-40.8	179.3	-72.5	-70.5	0	0	0	112.5	T373 T377 I406 L407 V413 I414	T373-Y410 HydrophobicContact CG2-CE2 4.07Å; T377-Y410 HydrophobicContact CG2-CE2 4.43Å; T377-Y410 WeakPolarHBondContact CG2-OH 3.47Å; T377-Y410 WeakPolarHBondContact OG1-CE2 3.35Å; T377-Y410 PolarHBondContact OG1-OH 3.03Å; I406-Y410 HydrophobicContact CB-CD2 4.47Å; I406-Y410 HydrophobicContact CB-CE2 4.33Å; I406-Y410 HydrophobicContact CD1-CE2 4.33Å; I406-Y410 WeakPolarHBondContact O-CD2 3.34Å; L407-Y410 PolarHBondContact O-N 2.92Å; Y410-V413 PolarHBondContact O-N 2.94Å; Y410-I414 WeakPolarHBondContact O-CB 3.42Å; Y410-I414 WeakPolarHBondContact O-CD1 3.36Å; Y410-I414 WeakPolarHBondContact O-CG1 3.23Å; Y410-I414 PolarHBondContact O-N 3.33Å
411	F	89.7	Confident	84.7	Confident	72 Å²	72	65.4 Å²	65.4	32%	0.316	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-40.5	173.9	-73.5	-46.3	0	0	0	111.7	L407 Y409 V413 I414 F415 F436	L407-F411 HydrophobicContact CB-CD2 3.9Å; L407-F411 HydrophobicContact CB-CE2 3.72Å; L407-F411 HydrophobicContact CD1-CE2 3.97Å; L407-F411 HydrophobicContact CD1-CZ 4.43Å; L407-F411 HydrophobicContact CD2-CE2 4Å; L407-F411 HydrophobicContact CD2-CZ 4.1Å; L407-F411 HydrophobicContact CG-CE2 4.1Å; L407-F411 WeakPolarHBondContact O-CB 3.37Å; L407-F411 VanDerWaalsContact O-CD2 3.31Å; L407-F411 WeakPolarHBondContact O-CD2 3.27Å; L407-F411 PolarHBondContact O-N 3.44Å; Y409-F411 VanDerWaalsContact C-N 3.35Å; Y409-F411 PolarHBondContact O-N 3.44Å; F411-V413 PolarHBondContact O-N 3.09Å; F411-I414 PolarHBondContact O-N 3.37Å; F411-F415 HydrophobicContact CB-CD2 4.4Å; F411-F415 HydrophobicContact CD1-CE2 4.45Å; F411-F415 VanDerWaalsContact O-CB 3.32Å; F411-F415 WeakPolarHBondContact O-CB 3.43Å; F411-F415 VanDerWaalsContact O-CD2 3.25Å; F411-F415 WeakPolarHBondContact O-CD2 3.12Å; F411-F415 PolarHBondContact O-N 3.07Å; F411-F436 HydrophobicContact CB-CD1 3.74Å; F411-F436 HydrophobicContact CB-CD2 4.03Å; F411-F436 HydrophobicContact CB-CE1 3.81Å; F411-F436 HydrophobicContact CB-CE2 4.05Å; F411-F436 HydrophobicContact CB-CG 3.88Å; F411-F436 HydrophobicContact CB-CZ 3.96Å; F411-F436 AromaticContact CD2-CD1 3.82Å; F411-F436 HydrophobicContact CD2-CD1 3.82Å; F411-F436 AromaticContact CD2-CE1 3.5Å; F411-F436 HydrophobicContact CD2-CE1 3.5Å; F411-F436 HydrophobicContact CD2-CZ 4.2Å; F411-F436 HydrophobicContact CE2-CE1 4.21Å; F411-F436 HydrophobicContact CG-CD1 4.13Å; F411-F436 AromaticContact CG-CE1 3.79Å; F411-F436 HydrophobicContact CG-CE1 3.79Å; F411-F436 HydrophobicContact CG-CZ 4.06Å
412	S	85	Confident	82.7	Confident	9 Å²	9	68.7 Å²	68.7	6%	0.063	34%	0.343	C	S	.	.	H	α-helix	trans	-57.7	-49	176.2	-57.1	0	0	0	0	111.3	P408 Y409 F415 E416	P408-S412 WeakPolarHBondContact O-CB 3.32Å; P408-S412 PolarHBondContact O-N 2.88Å; P408-S412 VanDerWaalsContact O-N 3.08Å; P408-S412 PolarHBondContact O-OG 2.91Å; Y409-S412 WeakPolarHBondContact O-CB 3.41Å; Y409-S412 PolarHBondContact O-N 2.91Å; Y409-S412 VanDerWaalsContact O-N 3.12Å; S412-F415 PolarHBondContact O-N 2.84Å; S412-E416 VanDerWaalsContact O-CB 3.31Å; S412-E416 WeakPolarHBondContact O-CB 3.49Å; S412-E416 PolarHBondContact O-N 3.41Å
413	V	85.7	Confident	80.8	Confident	53 Å²	53	75 Å²	75	32%	0.321	38%	0.375	S	S	.	.	H	α-helix	trans	-65.4	-46	179.1	176.2	0	0	0	0	111.8	Y409 Y410 F411 F415 E416 V417	Y409-V413 HydrophobicContact CD1-CG2 4.32Å; Y409-V413 HydrophobicContact CE1-CG2 3.81Å; Y409-V413 HydrophobicContact CE2-CG2 4.38Å; Y409-V413 PolarHBondContact O-N 2.83Å; Y410-V413 PolarHBondContact O-N 2.94Å; F411-V413 PolarHBondContact O-N 3.09Å; V413-F415 PolarHBondContact O-N 2.7Å; V413-E416 PolarHBondContact O-N 3.12Å; V413-V417 HydrophobicContact CG1-CG2 4.31Å; V413-V417 WeakPolarHBondContact O-CB 3.43Å; V413-V417 VanDerWaalsContact O-CG2 3.27Å; V413-V417 WeakPolarHBondContact O-CG2 3.48Å; V413-V417 PolarHBondContact O-N 3.4Å
414	I	85.1	Confident	78.7	Confident	94 Å²	94	80.6 Å²	80.6	48%	0.482	40%	0.404	S	S	.	.	H	α-helix	trans	-63.7	-42.4	-180	-69.9	166.1	0	0	0	110.6	Y410 F411 V417 W418	Y410-I414 WeakPolarHBondContact O-CB 3.42Å; Y410-I414 WeakPolarHBondContact O-CD1 3.36Å; Y410-I414 WeakPolarHBondContact O-CG1 3.23Å; Y410-I414 PolarHBondContact O-N 3.33Å; F411-I414 PolarHBondContact O-N 3.37Å; I414-V417 PolarHBondContact O-N 2.94Å; I414-W418 WeakPolarHBondContact O-CB 3.35Å; I414-W418 PolarHBondContact O-N 3.13Å
415	F	81.5	Confident	77	Confident	56 Å²	56	78.5 Å²	78.5	25%	0.246	40%	0.396	C	S	.	.	H	α-helix	trans	-68.3	-35.6	178.6	-89.8	-96.8	0	0	0	112.3	F411 S412 V413 L419 M429 I432 V433 F436	F411-F415 HydrophobicContact CB-CD2 4.4Å; F411-F415 HydrophobicContact CD1-CE2 4.45Å; F411-F415 VanDerWaalsContact O-CB 3.32Å; F411-F415 WeakPolarHBondContact O-CB 3.43Å; F411-F415 VanDerWaalsContact O-CD2 3.25Å; F411-F415 WeakPolarHBondContact O-CD2 3.12Å; F411-F415 PolarHBondContact O-N 3.07Å; S412-F415 PolarHBondContact O-N 2.84Å; V413-F415 PolarHBondContact O-N 2.7Å; F415-L419 HydrophobicContact CD1-CD1 4.44Å; F415-L419 PolarHBondContact O-N 3.46Å; F415-M429 HydrophobicContact CD1-CE 4.04Å; F415-I432 HydrophobicContact CD1-CG2 4.06Å; F415-I432 HydrophobicContact CE1-CG2 3.96Å; F415-I432 HydrophobicContact CZ-CG2 4.44Å; F415-V433 HydrophobicContact CB-CG2 4.41Å; F415-F436 HydrophobicContact CD2-CD2 4.48Å; F415-F436 AromaticContact CD2-CE2 3.77Å; F415-F436 HydrophobicContact CD2-CE2 3.77Å; F415-F436 HydrophobicContact CD2-CZ 4.41Å; F415-F436 AromaticContact CE2-CE2 3.59Å; F415-F436 HydrophobicContact CE2-CE2 3.59Å; F415-F436 AromaticContact CE2-CZ 3.87Å; F415-F436 HydrophobicContact CE2-CZ 3.87Å; F415-F436 HydrophobicContact CG-CE2 4.35Å; F415-F436 HydrophobicContact CZ-CE2 4.05Å; F415-F436 HydrophobicContact CZ-CZ 4.35Å
416	E	76.2	Confident	75.2	Confident	147 Å²	147	82.9 Å²	82.9	69%	0.687	42%	0.419	S	S	*	.	H	α-helix	trans	-67.6	-38.8	174.9	-173.7	171	-167.2	0	0	112	S412 V413	S412-E416 VanDerWaalsContact O-CB 3.31Å; S412-E416 WeakPolarHBondContact O-CB 3.49Å; S412-E416 PolarHBondContact O-N 3.41Å; V413-E416 PolarHBondContact O-N 3.12Å
417	V	78.7	Confident	73.6	Confident	87 Å²	87	87 Å²	87	53%	0.527	44%	0.444	S	S	.	.	H	α-helix	trans	-82.7	-38.1	179.5	175.3	0	0	0	0	112.9	V413 I414 H420	V413-V417 HydrophobicContact CG1-CG2 4.31Å; V413-V417 WeakPolarHBondContact O-CB 3.43Å; V413-V417 VanDerWaalsContact O-CG2 3.27Å; V413-V417 WeakPolarHBondContact O-CG2 3.48Å; V413-V417 PolarHBondContact O-N 3.4Å; I414-V417 PolarHBondContact O-N 2.94Å; V417-H420 PolarHBondContact O-CE1 3.48Å; V417-H420 PolarHBondContact O-ND1 2.89Å
418	W	72.4	Confident	72.4	Confident	207 Å²	207	87.6 Å²	87.6	78%	0.784	45%	0.454	S	S	*	.	H	α-helix	trans	-76.2	-30.9	-172	-168.9	71.1	0	0	0	112.3	I414 H420	I414-W418 WeakPolarHBondContact O-CB 3.35Å; I414-W418 PolarHBondContact O-N 3.13Å; W418-H420 PolarHBondContact O-N 3.49Å
419	L	66	Low	71.1	Confident	45 Å²	45	88.7 Å²	88.7	24%	0.236	46%	0.459	C	S	.	.			trans	-97.9	78.4	178.5	-93.5	107.5	0	0	0	112.1	F415 S421 M429	F415-L419 HydrophobicContact CD1-CD1 4.44Å; F415-L419 PolarHBondContact O-N 3.46Å; L419-S421 PolarHBondContact O-N 3.33Å; L419-S421 VanDerWaalsContact O-N 3.16Å; L419-M429 HydrophobicContact CB-CE 3.47Å; L419-M429 VanDerWaalsContact CB-CE 3.47Å; L419-M429 HydrophobicContact CD1-CE 3.44Å; L419-M429 VanDerWaalsContact CD1-CE 3.44Å; L419-M429 HydrophobicContact CD1-SD 4.02Å; L419-M429 HydrophobicContact CD2-CE 3.62Å; L419-M429 HydrophobicContact CD2-CG 4.14Å; L419-M429 HydrophobicContact CD2-SD 3.58Å; L419-M429 VanDerWaalsContact CD2-SD 3.58Å; L419-M429 HydrophobicContact CG-CE 3.65Å; L419-M429 HydrophobicContact CG-SD 4.24Å
420	H	63.4	Low	70.1	Confident	163 Å²	163	92.1 Å²	92.1	76%	0.755	47%	0.472	S	S	*	.			trans	-77	22.8	167.6	-74.9	87.2	0	0	0	113.4	V417 W418	V417-H420 PolarHBondContact O-CE1 3.48Å; V417-H420 PolarHBondContact O-ND1 2.89Å; W418-H420 PolarHBondContact O-N 3.49Å
421	S	56.2	Low	69.4	Low	63 Å²	63	93.7 Å²	93.7	44%	0.441	48%	0.48	S	S	.	.			trans	-87.2	145	-168.8	-60.8	0	0	0	0	114.1	L419 L423 S425	L419-S421 PolarHBondContact O-N 3.33Å; L419-S421 VanDerWaalsContact O-N 3.16Å; S421-L423 PolarHBondContact O-N 3.06Å; S421-S425 PolarHBondContact O-OG 2.77Å
422	P	53.9	Low	68.9	Low	115 Å²	115	93.4 Å²	93.4	75%	0.747	48%	0.481	S	S	*	.			trans	-74.2	127.1	-167.6	-9.6	26.9	0	0	0	113.2	D424	P422-D424 PolarHBondContact O-N 3.34Å
423	L	54.8	Low	68.5	Low	136 Å²	136	94.4 Å²	94.4	71%	0.712	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	-61.5	155.5	-68.6	159.3	0	0	0	120.1	S421 S425 L426	S421-L423 PolarHBondContact O-N 3.06Å; L423-S425 VanDerWaalsContact C-N 3.35Å; L423-S425 PolarHBondContact O-N 3.44Å; L423-L426 HydrophobicContact CD2-CD1 4.36Å; L423-L426 WeakPolarHBondContact O-CB 3.33Å; L423-L426 WeakPolarHBondContact O-CG 3.23Å; L423-L426 PolarHBondContact O-N 3.15Å
424	D	53	Low	68.2	Low	154 Å²	154	95.7 Å²	95.7	82%	0.824	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-23.7	-171.3	-77.7	-19.7	0	0	0	113.5	P422 L426	P422-D424 PolarHBondContact O-N 3.34Å; D424-L426 PolarHBondContact O-N 3.5Å
425	S	57.8	Low	68.1	Low	33 Å²	33	96.4 Å²	96.4	23%	0.231	49%	0.492	C	S	.	.	H	α-helix	trans	-69.2	-24.3	173.3	69	0	0	0	0	112.1	S421 L423 V427 S428 M429	S421-S425 PolarHBondContact O-OG 2.77Å; L423-S425 VanDerWaalsContact C-N 3.35Å; L423-S425 PolarHBondContact O-N 3.44Å; S425-V427 PolarHBondContact O-N 2.81Å; S425-S428 PolarHBondContact O-N 3.12Å; S425-M429 WeakPolarHBondContact O-CB 3.4Å; S425-M429 WeakPolarHBondContact O-CG 3.37Å; S425-M429 PolarHBondContact O-N 3.26Å
426	L	56.3	Low	68.3	Low	93 Å²	93	95.4 Å²	95.4	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-36.5	-166	-61.6	179.4	0	0	0	114	L423 D424 R430	L423-L426 HydrophobicContact CD2-CD1 4.36Å; L423-L426 WeakPolarHBondContact O-CB 3.33Å; L423-L426 WeakPolarHBondContact O-CG 3.23Å; L423-L426 PolarHBondContact O-N 3.15Å; D424-L426 PolarHBondContact O-N 3.5Å; L426-R430 WeakPolarHBondContact O-CB 3.49Å; L426-R430 PolarHBondContact O-N 3.31Å
427	V	62.5	Low	68.6	Low	101 Å²	101	91.5 Å²	91.5	61%	0.612	47%	0.467	S	S	*	.	H	α-helix	trans	-71.8	-48.3	179.9	179.6	0	0	0	0	111.3	S425 M429 R430 K431	S425-V427 PolarHBondContact O-N 2.81Å; V427-M429 PolarHBondContact O-N 3Å; V427-R430 PolarHBondContact O-N 3.29Å; V427-K431 PolarHBondContact O-N 3.26Å
428	S	66.9	Low	68.9	Low	74 Å²	74	92.5 Å²	92.5	52%	0.517	47%	0.468	S	S	.	.	H	α-helix	trans	-62.8	-35.9	175.7	-64.8	0	0	0	0	111.3	S425 K431 I432	S425-S428 PolarHBondContact O-N 3.12Å; S428-K431 WeakPolarHBondContact O-CB 3.43Å; S428-K431 PolarHBondContact O-N 3.11Å; S428-I432 WeakPolarHBondContact O-CG1 3.48Å; S428-I432 PolarHBondContact O-N 3.25Å
429	M	64.9	Low	69.8	Low	26 Å²	26	86 Å²	86	13%	0.128	45%	0.449	C	S	.	.	H	α-helix	trans	-68.4	-42	176.7	-72.1	-64	-67.8	0	0	112.7	F415 L419 S425 V427 K431 I432 V433	F415-M429 HydrophobicContact CD1-CE 4.04Å; L419-M429 HydrophobicContact CB-CE 3.47Å; L419-M429 VanDerWaalsContact CB-CE 3.47Å; L419-M429 HydrophobicContact CD1-CE 3.44Å; L419-M429 VanDerWaalsContact CD1-CE 3.44Å; L419-M429 HydrophobicContact CD1-SD 4.02Å; L419-M429 HydrophobicContact CD2-CE 3.62Å; L419-M429 HydrophobicContact CD2-CG 4.14Å; L419-M429 HydrophobicContact CD2-SD 3.58Å; L419-M429 VanDerWaalsContact CD2-SD 3.58Å; L419-M429 HydrophobicContact CG-CE 3.65Å; L419-M429 HydrophobicContact CG-SD 4.24Å; S425-M429 WeakPolarHBondContact O-CB 3.4Å; S425-M429 WeakPolarHBondContact O-CG 3.37Å; S425-M429 PolarHBondContact O-N 3.26Å; V427-M429 PolarHBondContact O-N 3Å; M429-K431 PolarHBondContact O-N 3.2Å; M429-I432 PolarHBondContact O-N 3.47Å; M429-I432 VanDerWaalsContact O-N 3.09Å; M429-I432 HydrophobicContact SD-CD1 4.24Å; M429-V433 WeakPolarHBondContact O-CG2 3.27Å; M429-V433 PolarHBondContact O-N 2.91Å
430	R	70.3	Confident	70.9	Confident	118 Å²	118	84.8 Å²	84.8	45%	0.445	44%	0.441	S	S	.	.	H	α-helix	trans	-57.2	-40.5	173.7	-179.2	179.6	-79.3	-142.6	3.4	110.7	N357 L426 V427 V433 Q434	N357-R430 PolarHBondContact O-NH1 3.25Å; N357-R430 VanDerWaalsContact O-NH1 3.13Å; N357-R430 PolarHBondContact O-NH2 2.92Å; L426-R430 WeakPolarHBondContact O-CB 3.49Å; L426-R430 PolarHBondContact O-N 3.31Å; V427-R430 PolarHBondContact O-N 3.29Å; R430-V433 PolarHBondContact O-N 3.41Å; R430-Q434 HydrophobicContact CG-CG 4.39Å; R430-Q434 WeakPolarHBondContact O-CB 3.22Å; R430-Q434 WeakPolarHBondContact O-CG 3.5Å; R430-Q434 PolarHBondContact O-N 3.33Å
431	K	77.6	Confident	72.2	Confident	122 Å²	122	81.4 Å²	81.4	53%	0.53	43%	0.427	S	S	.	.	H	α-helix	trans	-61.3	-45.8	175.6	-66	176.9	-177.1	176.9	0	111.3	V427 S428 M429 Q434 M435	V427-K431 PolarHBondContact O-N 3.26Å; S428-K431 WeakPolarHBondContact O-CB 3.43Å; S428-K431 PolarHBondContact O-N 3.11Å; M429-K431 PolarHBondContact O-N 3.2Å; K431-Q434 WeakPolarHBondContact O-CB 3.45Å; K431-Q434 PolarHBondContact O-N 3.05Å; K431-M435 VanDerWaalsContact O-CG 3.3Å; K431-M435 WeakPolarHBondContact O-CG 3.45Å; K431-M435 PolarHBondContact O-N 2.93Å
432	I	79.5	Confident	74	Confident	65 Å²	65	80.6 Å²	80.6	33%	0.333	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-46.3	179.3	-65.3	167	0	0	0	111.3	F415 S428 M429 Q434 M435 F436	F415-I432 HydrophobicContact CD1-CG2 4.06Å; F415-I432 HydrophobicContact CE1-CG2 3.96Å; F415-I432 HydrophobicContact CZ-CG2 4.44Å; S428-I432 WeakPolarHBondContact O-CG1 3.48Å; S428-I432 PolarHBondContact O-N 3.25Å; M429-I432 PolarHBondContact O-N 3.47Å; M429-I432 VanDerWaalsContact O-N 3.09Å; M429-I432 HydrophobicContact SD-CD1 4.24Å; I432-Q434 VanDerWaalsContact C-N 3.3Å; I432-Q434 PolarHBondContact O-N 2.87Å; I432-M435 WeakPolarHBondContact O-CB 3.3Å; I432-M435 PolarHBondContact O-N 3.26Å; I432-M435 VanDerWaalsContact O-N 3.11Å; I432-F436 HydrophobicContact CG2-CD2 3.98Å; I432-F436 HydrophobicContact CG2-CE2 3.57Å; I432-F436 VanDerWaalsContact O-CD2 3.28Å; I432-F436 WeakPolarHBondContact O-CD2 3.43Å; I432-F436 PolarHBondContact O-N 2.83Å; I432-F436 VanDerWaalsContact O-N 3.09Å
433	V	76.5	Confident	75.9	Confident	31 Å²	31	75.3 Å²	75.3	19%	0.188	38%	0.383	C	S	.	.	H	α-helix	trans	-61	-40.4	175.6	175.1	0	0	0	0	111	F415 M429 R430 M435 F436 R437	F415-V433 HydrophobicContact CB-CG2 4.41Å; M429-V433 WeakPolarHBondContact O-CG2 3.27Å; M429-V433 PolarHBondContact O-N 2.91Å; R430-V433 PolarHBondContact O-N 3.41Å; V433-M435 VanDerWaalsContact C-N 3.34Å; V433-M435 PolarHBondContact O-N 2.88Å; V433-F436 PolarHBondContact O-N 3.25Å; V433-R437 PolarHBondContact O-N 2.97Å
434	Q	78.9	Confident	77.8	Confident	79 Å²	79	71.3 Å²	71.3	37%	0.369	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-37	173.9	-74.7	173.2	0.4	0	0	112.6	R430 K431 I432 R437 I438	R430-Q434 HydrophobicContact CG-CG 4.39Å; R430-Q434 WeakPolarHBondContact O-CB 3.22Å; R430-Q434 WeakPolarHBondContact O-CG 3.5Å; R430-Q434 PolarHBondContact O-N 3.33Å; K431-Q434 WeakPolarHBondContact O-CB 3.45Å; K431-Q434 PolarHBondContact O-N 3.05Å; I432-Q434 VanDerWaalsContact C-N 3.3Å; I432-Q434 PolarHBondContact O-N 2.87Å; Q434-R437 WeakPolarHBondContact O-CB 3.3Å; Q434-R437 PolarHBondContact O-N 2.98Å; Q434-I438 PolarHBondContact O-N 3.41Å; Q434-I438 VanDerWaalsContact O-N 3.08Å
435	M	82.9	Confident	79.8	Confident	109 Å²	109	69.9 Å²	69.9	54%	0.537	35%	0.35	S	S	.	.	H	α-helix	trans	-61.5	-47.1	174.2	-64.1	-52.3	133.9	0	0	110.9	K431 I432 V433 R437 I438 L439	K431-M435 VanDerWaalsContact O-CG 3.3Å; K431-M435 WeakPolarHBondContact O-CG 3.45Å; K431-M435 PolarHBondContact O-N 2.93Å; I432-M435 WeakPolarHBondContact O-CB 3.3Å; I432-M435 PolarHBondContact O-N 3.26Å; I432-M435 VanDerWaalsContact O-N 3.11Å; V433-M435 VanDerWaalsContact C-N 3.34Å; V433-M435 PolarHBondContact O-N 2.88Å; M435-R437 VanDerWaalsContact C-N 3.28Å; M435-R437 PolarHBondContact O-N 3.03Å; M435-I438 PolarHBondContact O-N 3.07Å; M435-I438 VanDerWaalsContact O-N 3.15Å; M435-L439 PolarHBondContact O-N 3.41Å
436	F	86.1	Confident	81.5	Confident	35 Å²	35	68.5 Å²	68.5	15%	0.154	34%	0.34	C	S	.	.	H	α-helix	trans	-61.7	-37.3	174.9	-70.5	-62.3	0	0	0	111.9	P408 F411 F415 I432 V433 I438 L439 R440	P408-F436 WeakPolarHBondContact CB-O 3.5Å; F411-F436 HydrophobicContact CB-CD1 3.74Å; F411-F436 HydrophobicContact CB-CD2 4.03Å; F411-F436 HydrophobicContact CB-CE1 3.81Å; F411-F436 HydrophobicContact CB-CE2 4.05Å; F411-F436 HydrophobicContact CB-CG 3.88Å; F411-F436 HydrophobicContact CB-CZ 3.96Å; F411-F436 AromaticContact CD2-CD1 3.82Å; F411-F436 HydrophobicContact CD2-CD1 3.82Å; F411-F436 AromaticContact CD2-CE1 3.5Å; F411-F436 HydrophobicContact CD2-CE1 3.5Å; F411-F436 HydrophobicContact CD2-CZ 4.2Å; F411-F436 HydrophobicContact CE2-CE1 4.21Å; F411-F436 HydrophobicContact CG-CD1 4.13Å; F411-F436 AromaticContact CG-CE1 3.79Å; F411-F436 HydrophobicContact CG-CE1 3.79Å; F411-F436 HydrophobicContact CG-CZ 4.06Å; F415-F436 HydrophobicContact CD2-CD2 4.48Å; F415-F436 AromaticContact CD2-CE2 3.77Å; F415-F436 HydrophobicContact CD2-CE2 3.77Å; F415-F436 HydrophobicContact CD2-CZ 4.41Å; F415-F436 AromaticContact CE2-CE2 3.59Å; F415-F436 HydrophobicContact CE2-CE2 3.59Å; F415-F436 AromaticContact CE2-CZ 3.87Å; F415-F436 HydrophobicContact CE2-CZ 3.87Å; F415-F436 HydrophobicContact CG-CE2 4.35Å; F415-F436 HydrophobicContact CZ-CE2 4.05Å; F415-F436 HydrophobicContact CZ-CZ 4.35Å; I432-F436 HydrophobicContact CG2-CD2 3.98Å; I432-F436 HydrophobicContact CG2-CE2 3.57Å; I432-F436 VanDerWaalsContact O-CD2 3.28Å; I432-F436 WeakPolarHBondContact O-CD2 3.43Å; I432-F436 PolarHBondContact O-N 2.83Å; I432-F436 VanDerWaalsContact O-N 3.09Å; V433-F436 PolarHBondContact O-N 3.25Å; F436-I438 VanDerWaalsContact C-N 3.29Å; F436-I438 PolarHBondContact O-N 3.19Å; F436-L439 HydrophobicContact CD1-CD1 3.96Å; F436-L439 HydrophobicContact CE1-CD1 4.44Å; F436-L439 WeakPolarHBondContact O-CB 3.43Å; F436-L439 PolarHBondContact O-N 3.31Å; F436-L439 VanDerWaalsContact O-N 3.13Å; F436-R440 PolarHBondContact O-N 3.43Å
437	R	81.3	Confident	83.3	Confident	65 Å²	65	66.5 Å²	66.5	25%	0.245	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-38	174.8	-171	179.3	-71.7	173.9	-5.6	112.4	V433 Q434 M435 R440	V433-R437 PolarHBondContact O-N 2.97Å; Q434-R437 WeakPolarHBondContact O-CB 3.3Å; Q434-R437 PolarHBondContact O-N 2.98Å; M435-R437 VanDerWaalsContact C-N 3.28Å; M435-R437 PolarHBondContact O-N 3.03Å; R437-R440 WeakPolarHBondContact O-CB 3.47Å; R437-R440 WeakPolarHBondContact O-CD 3.44Å; R437-R440 WeakPolarHBondContact O-CG 3.16Å; R437-R440 PolarHBondContact O-N 3.35Å
438	I	85.5	Confident	84.8	Confident	109 Å²	109	62.4 Å²	62.4	56%	0.559	31%	0.306	S	S	*	.	H	α-helix	trans	-67.9	-39.2	175.9	-66.3	160.7	0	0	0	111.1	Q434 M435 F436 R440 I441	Q434-I438 PolarHBondContact O-N 3.41Å; Q434-I438 VanDerWaalsContact O-N 3.08Å; M435-I438 PolarHBondContact O-N 3.07Å; M435-I438 VanDerWaalsContact O-N 3.15Å; F436-I438 VanDerWaalsContact C-N 3.29Å; F436-I438 PolarHBondContact O-N 3.19Å; I438-R440 PolarHBondContact O-N 3.05Å; I438-I441 VanDerWaalsContact O-CG2 3.24Å; I438-I441 WeakPolarHBondContact O-CG2 3.12Å; I438-I441 PolarHBondContact O-N 2.99Å
439	L	90.6	Very high	86	Confident	71 Å²	71	60.7 Å²	60.7	37%	0.372	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-13.2	177.4	-62.2	177.9	0	0	0	113.3	P408 M435 F436 I441 L442	P408-L439 HydrophobicContact CB-CB 4.5Å; P408-L439 HydrophobicContact CG-CB 3.86Å; M435-L439 PolarHBondContact O-N 3.41Å; F436-L439 HydrophobicContact CD1-CD1 3.96Å; F436-L439 HydrophobicContact CE1-CD1 4.44Å; F436-L439 WeakPolarHBondContact O-CB 3.43Å; F436-L439 PolarHBondContact O-N 3.31Å; F436-L439 VanDerWaalsContact O-N 3.13Å; L439-I441 PolarHBondContact O-N 2.92Å; L439-I441 VanDerWaalsContact O-N 3.13Å; L439-L442 HydrophobicContact CB-CD1 4.13Å; L439-L442 HydrophobicContact CB-CG 4.47Å; L439-L442 HydrophobicContact CD2-CD1 3.96Å; L439-L442 HydrophobicContact CD2-CG 4.48Å; L439-L442 WeakPolarHBondContact O-CB 3.41Å; L439-L442 WeakPolarHBondContact O-CG 3.22Å; L439-L442 PolarHBondContact O-N 3.48Å
440	R	89.1	Confident	87.2	Confident	18 Å²	18	62.2 Å²	62.2	7%	0.068	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-54.8	-28.7	170.5	-64.7	173.8	-178.4	-168.9	-0.4	112	E369 P408 F436 R437 I438 L442 R443	E369-R440 WeakPolarHBondContact OE1-CD 3.02Å; E369-R440 IonicContact OE1-CZ 3.79Å; E369-R440 IonicContact OE1-NE 3.3Å; E369-R440 PolarHBondContact OE1-NE 3.06Å; E369-R440 IonicContact OE1-NH1 3.39Å; P408-R440 HydrophobicContact CB-CG 3.7Å; F436-R440 PolarHBondContact O-N 3.43Å; R437-R440 WeakPolarHBondContact O-CB 3.47Å; R437-R440 WeakPolarHBondContact O-CD 3.44Å; R437-R440 WeakPolarHBondContact O-CG 3.16Å; R437-R440 PolarHBondContact O-N 3.35Å; I438-R440 PolarHBondContact O-N 3.05Å; R440-L442 PolarHBondContact O-N 3.38Å; R440-R443 WeakPolarHBondContact O-CD 3.14Å; R440-R443 WeakPolarHBondContact O-CG 3.45Å; R440-R443 PolarHBondContact O-N 2.99Å; R440-R443 PolarHBondContact O-NE 3.38Å
441	I	91.6	Very high	88.1	Confident	92 Å²	92	58.5 Å²	58.5	47%	0.472	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-60.6	-24	175.2	-159.8	168.3	0	0	0	112.9	L333 I438 L439 R443 V444	L333-I441 HydrophobicContact CD2-CB 3.89Å; L333-I441 HydrophobicContact CD2-CD1 4.44Å; L333-I441 HydrophobicContact CD2-CG1 4Å; I438-I441 VanDerWaalsContact O-CG2 3.24Å; I438-I441 WeakPolarHBondContact O-CG2 3.12Å; I438-I441 PolarHBondContact O-N 2.99Å; L439-I441 PolarHBondContact O-N 2.92Å; L439-I441 VanDerWaalsContact O-N 3.13Å; I441-R443 PolarHBondContact O-N 2.95Å; I441-R443 VanDerWaalsContact O-N 3.07Å; I441-V444 HydrophobicContact CG1-CG2 4.13Å; I441-V444 VanDerWaalsContact O-CB 3.3Å; I441-V444 WeakPolarHBondContact O-CB 3.41Å; I441-V444 WeakPolarHBondContact O-CG2 3.28Å; I441-V444 PolarHBondContact O-N 3.44Å
442	L	93.2	Very high	88.4	Confident	46 Å²	46	57.9 Å²	57.9	24%	0.241	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-60.4	-22.4	179.8	-62.1	-178.8	0	0	0	112.8	I404 L439 R440 V444 F445	I404-L442 HydrophobicContact CG2-CB 4.17Å; I404-L442 HydrophobicContact CG2-CD1 3.44Å; I404-L442 VanDerWaalsContact CG2-CD1 3.44Å; I404-L442 HydrophobicContact CG2-CG 4.44Å; L439-L442 HydrophobicContact CB-CD1 4.13Å; L439-L442 HydrophobicContact CB-CG 4.47Å; L439-L442 HydrophobicContact CD2-CD1 3.96Å; L439-L442 HydrophobicContact CD2-CG 4.48Å; L439-L442 WeakPolarHBondContact O-CB 3.41Å; L439-L442 WeakPolarHBondContact O-CG 3.22Å; L439-L442 PolarHBondContact O-N 3.48Å; R440-L442 PolarHBondContact O-N 3.38Å; L442-V444 PolarHBondContact O-N 2.97Å; L442-V444 VanDerWaalsContact O-N 3.17Å; L442-F445 HydrophobicContact CB-CD2 4.35Å; L442-F445 HydrophobicContact CD2-CD2 4Å; L442-F445 HydrophobicContact CD2-CE2 3.64Å; L442-F445 WeakPolarHBondContact O-CB 3.29Å; L442-F445 VanDerWaalsContact O-CD2 3.31Å; L442-F445 WeakPolarHBondContact O-CD2 3.37Å; L442-F445 PolarHBondContact O-N 3.18Å
443	R	94.2	Very high	88.7	Confident	5 Å²	5	55.9 Å²	55.9	2%	0.019	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-61.1	-22.1	174.3	75.7	-169.6	56.5	-180	-9.2	113.6	S329 E369 A405 R440 I441 F445 K446	S329-R443 WeakPolarHBondContact OG-CD 3.49Å; E369-R443 IonicContact OE1-CZ 2.64Å; E369-R443 IonicContact OE1-NH1 2.7Å; E369-R443 PolarHBondContact OE1-NH1 3.08Å; E369-R443 IonicContact OE1-NH2 2.79Å; E369-R443 PolarHBondContact OE1-NH2 3.3Å; E369-R443 IonicContact OE2-CZ 2.75Å; E369-R443 IonicContact OE2-NH1 3.82Å; E369-R443 PolarHBondContact OE2-NH1 2.79Å; E369-R443 IonicContact OE2-NH2 2.89Å; A405-R443 HydrophobicContact CB-CB 3.8Å; R440-R443 WeakPolarHBondContact O-CD 3.14Å; R440-R443 WeakPolarHBondContact O-CG 3.45Å; R440-R443 PolarHBondContact O-N 2.99Å; R440-R443 PolarHBondContact O-NE 3.38Å; I441-R443 PolarHBondContact O-N 2.95Å; I441-R443 VanDerWaalsContact O-N 3.07Å; R443-F445 PolarHBondContact O-N 2.88Å; R443-K446 WeakPolarHBondContact O-CB 3.36Å; R443-K446 PolarHBondContact O-N 3.43Å
444	V	95	Very high	89.3	Confident	51 Å²	51	58.5 Å²	58.5	31%	0.309	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-56.9	-35.7	173.5	177.7	0	0	0	0	110.6	I330 I441 L442 K446 L447	I330-V444 HydrophobicContact CD1-CB 4.48Å; I330-V444 HydrophobicContact CD1-CG1 4.41Å; I330-V444 HydrophobicContact CD1-CG2 3.74Å; I330-V444 HydrophobicContact CG1-CG2 3.71Å; I441-V444 HydrophobicContact CG1-CG2 4.13Å; I441-V444 VanDerWaalsContact O-CB 3.3Å; I441-V444 WeakPolarHBondContact O-CB 3.41Å; I441-V444 WeakPolarHBondContact O-CG2 3.28Å; I441-V444 PolarHBondContact O-N 3.44Å; L442-V444 PolarHBondContact O-N 2.97Å; L442-V444 VanDerWaalsContact O-N 3.17Å; V444-K446 PolarHBondContact O-N 2.87Å; V444-K446 VanDerWaalsContact O-N 3.12Å; V444-L447 HydrophobicContact CG1-CD1 4.23Å; V444-L447 VanDerWaalsContact O-CB 3.29Å; V444-L447 WeakPolarHBondContact O-CB 3.45Å; V444-L447 WeakPolarHBondContact O-CG 3.28Å; V444-L447 PolarHBondContact O-N 3.43Å
445	F	94.8	Very high	89.7	Confident	124 Å²	124	57.4 Å²	57.4	54%	0.544	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-63.3	-19.1	179.1	-66.8	-61.9	0	0	0	113.4	I401 L442 R443 L447 A448	I401-F445 HydrophobicContact CG2-CB 3.8Å; L442-F445 HydrophobicContact CB-CD2 4.35Å; L442-F445 HydrophobicContact CD2-CD2 4Å; L442-F445 HydrophobicContact CD2-CE2 3.64Å; L442-F445 WeakPolarHBondContact O-CB 3.29Å; L442-F445 VanDerWaalsContact O-CD2 3.31Å; L442-F445 WeakPolarHBondContact O-CD2 3.37Å; L442-F445 PolarHBondContact O-N 3.18Å; R443-F445 PolarHBondContact O-N 2.88Å; F445-L447 PolarHBondContact O-N 3.49Å; F445-A448 WeakPolarHBondContact O-CB 3.28Å; F445-A448 PolarHBondContact O-N 2.92Å
446	K	94.3	Very high	89.9	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.017	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-59.7	-25.4	173.3	-168.8	173	177.3	-172.5	0	112.7	I326 F376 E379 D402 R443 V444 A448 R449	I326-K446 HydrophobicContact CD1-CB 3.84Å; I326-K446 HydrophobicContact CD1-CD 3.9Å; I326-K446 HydrophobicContact CD1-CG 3.72Å; I326-K446 HydrophobicContact CG1-CB 4.36Å; I326-K446 HydrophobicContact CG1-CD 4.12Å; I326-K446 HydrophobicContact CG1-CG 4.41Å; F376-K446 HydrophobicContact CD1-CD 4.44Å; F376-K446 HydrophobicContact CE1-CD 4.41Å; E379-K446 WeakPolarHBondContact OE1-CE 3.33Å; E379-K446 IonicContact OE1-NZ 3.18Å; E379-K446 PolarHBondContact OE1-NZ 3.37Å; E379-K446 IonicContact OE2-NZ 3.68Å; E379-K446 PolarHBondContact OE2-NZ 2.98Å; E379-K446 VanDerWaalsContact OE2-NZ 3.16Å; D402-K446 WeakPolarHBondContact OD1-CD 3.26Å; D402-K446 VanDerWaalsContact OD1-CE 3.28Å; D402-K446 WeakPolarHBondContact OD1-CE 3.49Å; D402-K446 WeakPolarHBondContact OD1-CG 3.44Å; R443-K446 WeakPolarHBondContact O-CB 3.36Å; R443-K446 PolarHBondContact O-N 3.43Å; V444-K446 PolarHBondContact O-N 2.87Å; V444-K446 VanDerWaalsContact O-N 3.12Å; K446-A448 PolarHBondContact O-N 2.75Å; K446-A448 VanDerWaalsContact O-N 3.12Å; K446-R449 PolarHBondContact O-N 2.92Å; K446-R449 VanDerWaalsContact O-N 3.09Å
447	L	93.8	Very high	90	Very high	52 Å²	52	54.6 Å²	54.6	27%	0.272	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-57.2	-24.7	171.5	-67.4	173.1	0	0	0	112.8	I326 V444 F445 R449 H450 S451	I326-L447 HydrophobicContact CB-CD2 4.24Å; I326-L447 HydrophobicContact CD1-CD2 4.03Å; I326-L447 HydrophobicContact CG2-CD1 4.34Å; I326-L447 HydrophobicContact CG2-CD2 3.8Å; I326-L447 HydrophobicContact CG2-CG 3.8Å; V444-L447 HydrophobicContact CG1-CD1 4.23Å; V444-L447 VanDerWaalsContact O-CB 3.29Å; V444-L447 WeakPolarHBondContact O-CB 3.45Å; V444-L447 WeakPolarHBondContact O-CG 3.28Å; V444-L447 PolarHBondContact O-N 3.43Å; F445-L447 PolarHBondContact O-N 3.49Å; L447-R449 PolarHBondContact O-N 3.43Å; L447-H450 CarbonylContact O-C 3.44Å; L447-H450 PolarHBondContact O-N 3.44Å; L447-S451 PolarHBondContact O-N 2.95Å; L447-S451 VanDerWaalsContact O-N 3.11Å
448	A	93.1	Very high	90.4	Very high	14 Å²	14	53.5 Å²	53.5	12%	0.116	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-58.3	-33.5	176.4	0	0	0	0	0	112	M398 F445 K446 H450 S451 L454 Q455	M398-A448 HydrophobicContact CE-CB 3.96Å; F445-A448 WeakPolarHBondContact O-CB 3.28Å; F445-A448 PolarHBondContact O-N 2.92Å; K446-A448 PolarHBondContact O-N 2.75Å; K446-A448 VanDerWaalsContact O-N 3.12Å; A448-H450 PolarHBondContact O-N 3.22Å; A448-S451 CarbonylContact O-C 3.53Å; A448-S451 PolarHBondContact O-N 3.37Å; A448-S451 VanDerWaalsContact O-N 3.12Å; A448-L454 HydrophobicContact CB-CB 4.01Å; A448-Q455 VanDerWaalsContact O-CG 3.28Å; A448-Q455 WeakPolarHBondContact O-CG 3.36Å; A448-Q455 PolarHBondContact O-NE2 3.49Å
449	R	92.1	Very high	90.4	Very high	38 Å²	38	53.4 Å²	53.4	14%	0.143	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-62.3	-32.2	176.2	-175.4	179.1	-66.4	-83.3	8.1	112.4	E307 M398 N399 D402 K446 L447 Q455	E307-R449 IonicContact OE1-CZ 2.67Å; E307-R449 IonicContact OE1-NH1 3.62Å; E307-R449 PolarHBondContact OE1-NH1 3.28Å; E307-R449 IonicContact OE2-NH1 2.67Å; M398-R449 VanDerWaalsContact CE-CA 3.43Å; M398-R449 HydrophobicContact CE-CB 3.65Å; M398-R449 PolarHBondContact O-NH2 3.34Å; N399-R449 PolarHBondContact OD1-NH2 3Å; D402-R449 IonicContact OD2-CZ 3.94Å; D402-R449 IonicContact OD2-NE 2.95Å; D402-R449 IonicContact OD2-NH2 2.66Å; D402-R449 PolarHBondContact OD2-NH2 3.43Å; K446-R449 PolarHBondContact O-N 2.92Å; K446-R449 VanDerWaalsContact O-N 3.09Å; L447-R449 PolarHBondContact O-N 3.43Å; R449-Q455 PolarHBondContact O-NE2 2.96Å; R449-Q455 VanDerWaalsContact O-NE2 3.07Å
450	H	90.9	Very high	90.3	Very high	59 Å²	59	50.2 Å²	50.2	27%	0.273	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-93.8	0.3	-179.6	-57.3	-68.7	0	0	0	113.1	I323 L447 A448	I323-H450 HydrophobicContact CD1-CB 3.89Å; I323-H450 HydrophobicContact CG1-CB 4.13Å; L447-H450 CarbonylContact O-C 3.44Å; L447-H450 PolarHBondContact O-N 3.44Å; A448-H450 PolarHBondContact O-N 3.22Å
451	S	89.6	Confident	90.3	Very high	40 Å²	40	53.5 Å²	53.5	28%	0.28	28%	0.282	S	S	.	.			trans	-127.9	107.5	-179.7	175.9	0	0	0	0	111.3	L447 A448 G453 L454 Q455	L447-S451 PolarHBondContact O-N 2.95Å; L447-S451 VanDerWaalsContact O-N 3.11Å; A448-S451 CarbonylContact O-C 3.53Å; A448-S451 PolarHBondContact O-N 3.37Å; A448-S451 VanDerWaalsContact O-N 3.12Å; S451-G453 PolarHBondContact O-N 3.31Å; S451-L454 PolarHBondContact O-N 3.18Å; S451-L454 PolarHBondContact OG-N 3.46Å; S451-Q455 PolarHBondContact O-N 3.12Å; S451-Q455 VanDerWaalsContact O-N 3.13Å
452	Q	83.5	Confident	90.2	Very high	108 Å²	108	56.8 Å²	56.8	51%	0.505	29%	0.293	S	S	.	.	H	α-helix	trans	-60.3	-33.6	173.5	-66.3	173.9	-20.1	0	0	112.1	Q455 A456 E564	Q452-Q455 PolarHBondContact O-N 2.84Å; Q452-A456 VanDerWaalsContact O-CB 3.24Å; Q452-A456 WeakPolarHBondContact O-CB 3.36Å; Q452-A456 PolarHBondContact O-N 3.38Å; Q452-E564 PolarHBondContact NE2-OE2 2.67Å; Q452-E564 PolarHBondContact OE1-OE2 3.39Å
453	G	86.2	Confident	89.9	Confident	24 Å²	24	61.9 Å²	61.9	25%	0.247	32%	0.316	C	S	.	.	H	α-helix	trans	-63	-43.7	177	0	0	0	0	0	112.4	S451 A456 L457	S451-G453 PolarHBondContact O-N 3.31Å; G453-A456 PolarHBondContact O-N 3.33Å; G453-L457 WeakPolarHBondContact O-CG 3.3Å; G453-L457 PolarHBondContact O-N 3.38Å
454	L	88.6	Confident	89.6	Confident	85 Å²	85	61.7 Å²	61.7	45%	0.445	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-40.6	176.2	-84.2	152	0	0	0	112	A448 S451 L457 G458	A448-L454 HydrophobicContact CB-CB 4.01Å; S451-L454 PolarHBondContact O-N 3.18Å; S451-L454 PolarHBondContact OG-N 3.46Å; L454-L457 PolarHBondContact O-N 3.4Å; L454-G458 PolarHBondContact O-N 3.04Å; L454-G458 VanDerWaalsContact O-N 3.09Å
455	Q	88.3	Confident	89.5	Confident	56 Å²	56	66.3 Å²	66.3	26%	0.262	33%	0.328	S	S	.	.	H	α-helix	trans	-63.5	-44.1	173.7	-67.6	174.2	31.2	0	0	111.2	M398 A448 R449 S451 Q452 L457 G458 Y459	M398-Q455 HydrophobicContact SD-CG 4.41Å; A448-Q455 VanDerWaalsContact O-CG 3.28Å; A448-Q455 WeakPolarHBondContact O-CG 3.36Å; A448-Q455 PolarHBondContact O-NE2 3.49Å; R449-Q455 PolarHBondContact O-NE2 2.96Å; R449-Q455 VanDerWaalsContact O-NE2 3.07Å; S451-Q455 PolarHBondContact O-N 3.12Å; S451-Q455 VanDerWaalsContact O-N 3.13Å; Q452-Q455 PolarHBondContact O-N 2.84Å; Q455-L457 VanDerWaalsContact C-N 3.31Å; Q455-L457 PolarHBondContact O-N 3.26Å; Q455-G458 PolarHBondContact O-N 3.33Å; Q455-G458 VanDerWaalsContact O-N 3.12Å; Q455-Y459 HydrophobicContact CB-CD2 4.38Å; Q455-Y459 HydrophobicContact CB-CE2 4.18Å; Q455-Y459 WeakPolarHBondContact O-CD2 3.31Å; Q455-Y459 PolarHBondContact O-N 3.46Å
456	A	85.3	Confident	89.4	Confident	3 Å²	3	67 Å²	67	3%	0.025	33%	0.331	C	S	.	.	H	α-helix	trans	-59.6	-40.2	176.8	0	0	0	0	0	112.3	Q452 G453 Y459 T460 F553 F556 Y557	Q452-A456 VanDerWaalsContact O-CB 3.24Å; Q452-A456 WeakPolarHBondContact O-CB 3.36Å; Q452-A456 PolarHBondContact O-N 3.38Å; G453-A456 PolarHBondContact O-N 3.33Å; A456-Y459 PolarHBondContact O-N 3.15Å; A456-T460 VanDerWaalsContact O-CB 3.32Å; A456-T460 WeakPolarHBondContact O-CB 3.23Å; A456-T460 PolarHBondContact O-N 3.49Å; A456-T460 PolarHBondContact O-OG1 3.36Å; A456-F553 HydrophobicContact CB-CE2 3.82Å; A456-F556 HydrophobicContact CB-CD1 3.73Å; A456-F556 HydrophobicContact CB-CE1 3.88Å; A456-Y557 HydrophobicContact CB-CD2 4.44Å
457	L	88.6	Confident	89.2	Confident	83 Å²	83	70.5 Å²	70.5	44%	0.435	35%	0.347	S	S	.	.	H	α-helix	trans	-59.7	-49.5	172.1	-72.9	169.9	0	0	0	110.9	G453 L454 Q455 Y459 T460 L461 F553	G453-L457 WeakPolarHBondContact O-CG 3.3Å; G453-L457 PolarHBondContact O-N 3.38Å; L454-L457 PolarHBondContact O-N 3.4Å; Q455-L457 VanDerWaalsContact C-N 3.31Å; Q455-L457 PolarHBondContact O-N 3.26Å; L457-Y459 PolarHBondContact O-N 3.11Å; L457-T460 PolarHBondContact O-N 3.01Å; L457-T460 VanDerWaalsContact O-N 3.15Å; L457-L461 VanDerWaalsContact O-CG 3.32Å; L457-L461 WeakPolarHBondContact O-CG 3.4Å; L457-L461 PolarHBondContact O-N 2.95Å; L457-F553 HydrophobicContact CB-CE2 4.43Å; L457-F553 HydrophobicContact CD2-CD2 3.64Å; L457-F553 HydrophobicContact CD2-CE2 3.5Å; L457-F553 HydrophobicContact CD2-CG 4.31Å; L457-F553 HydrophobicContact CD2-CZ 4.08Å; L457-F553 HydrophobicContact CG-CD2 4.2Å; L457-F553 HydrophobicContact CG-CE2 3.64Å; L457-F553 HydrophobicContact CG-CZ 4.25Å
458	G	89.7	Confident	89	Confident	41 Å²	41	70.3 Å²	70.3	42%	0.423	35%	0.346	S	S	.	.	H	α-helix	trans	-57.6	-46.1	177.9	0	0	0	0	0	113.4	L454 Q455 T460 L461 K462	L454-G458 PolarHBondContact O-N 3.04Å; L454-G458 VanDerWaalsContact O-N 3.09Å; Q455-G458 PolarHBondContact O-N 3.33Å; Q455-G458 VanDerWaalsContact O-N 3.12Å; G458-T460 VanDerWaalsContact C-N 3.35Å; G458-T460 PolarHBondContact O-N 3.2Å; G458-L461 PolarHBondContact O-N 2.78Å; G458-K462 PolarHBondContact O-N 2.63Å
459	Y	86.4	Confident	89	Confident	108 Å²	108	71.6 Å²	71.6	42%	0.424	36%	0.361	S	S	.	.	H	α-helix	trans	-65	-37.9	175.7	-72	-63.6	0	0	0	112.5	Q455 A456 L457 K462 Q463 F556	Q455-Y459 HydrophobicContact CB-CD2 4.38Å; Q455-Y459 HydrophobicContact CB-CE2 4.18Å; Q455-Y459 WeakPolarHBondContact O-CD2 3.31Å; Q455-Y459 PolarHBondContact O-N 3.46Å; A456-Y459 PolarHBondContact O-N 3.15Å; L457-Y459 PolarHBondContact O-N 3.11Å; Y459-K462 PolarHBondContact O-N 2.97Å; Y459-Q463 WeakPolarHBondContact O-CB 3.45Å; Y459-Q463 PolarHBondContact O-N 3.08Å; Y459-F556 AromaticContact CD2-CE1 3.89Å; Y459-F556 HydrophobicContact CD2-CE1 3.89Å; Y459-F556 AromaticContact CD2-CZ 3.6Å; Y459-F556 HydrophobicContact CD2-CZ 3.6Å; Y459-F556 HydrophobicContact CG-CE1 4.14Å; Y459-F556 HydrophobicContact CG-CE2 4.31Å; Y459-F556 AromaticContact CG-CZ 3.59Å; Y459-F556 HydrophobicContact CG-CZ 3.59Å
460	T	87.3	Confident	89	Confident	4 Å²	4	73.5 Å²	73.5	3%	0.025	37%	0.374	C	S	.	.	H	α-helix	trans	-65.9	-42.1	177.8	-57.7	0	0	0	0	111.6	A456 L457 G458 K462 Q463 S464 N552 F553	A456-T460 VanDerWaalsContact O-CB 3.32Å; A456-T460 WeakPolarHBondContact O-CB 3.23Å; A456-T460 PolarHBondContact O-N 3.49Å; A456-T460 PolarHBondContact O-OG1 3.36Å; L457-T460 PolarHBondContact O-N 3.01Å; L457-T460 VanDerWaalsContact O-N 3.15Å; G458-T460 VanDerWaalsContact C-N 3.35Å; G458-T460 PolarHBondContact O-N 3.2Å; T460-K462 VanDerWaalsContact C-N 3.35Å; T460-Q463 PolarHBondContact O-N 3.17Å; T460-S464 VanDerWaalsContact O-CB 3.23Å; T460-S464 WeakPolarHBondContact O-CB 3.38Å; T460-S464 PolarHBondContact O-N 3.17Å; T460-S464 PolarHBondContact O-OG 3.33Å; T460-N552 HydrophobicContact CG2-CB 4.01Å; T460-F553 HydrophobicContact CG2-CB 3.88Å
461	L	89.8	Confident	89	Confident	86 Å²	86	71.7 Å²	71.7	45%	0.45	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-43	175.3	-66.5	174.2	0	0	0	110.9	L457 G458 Q463 S464 Y465 L468	L457-L461 VanDerWaalsContact O-CG 3.32Å; L457-L461 WeakPolarHBondContact O-CG 3.4Å; L457-L461 PolarHBondContact O-N 2.95Å; G458-L461 PolarHBondContact O-N 2.78Å; L461-Q463 VanDerWaalsContact C-N 3.31Å; L461-Q463 PolarHBondContact O-N 2.92Å; L461-S464 CarbonylContact O-C 3.56Å; L461-S464 PolarHBondContact O-N 3.37Å; L461-Y465 PolarHBondContact O-N 2.67Å; L461-L468 HydrophobicContact CB-CD1 4.26Å; L461-L468 HydrophobicContact CD2-CD1 3.6Å
462	K	89.7	Confident	89.2	Confident	162 Å²	162	75.6 Å²	75.6	70%	0.704	38%	0.381	S	S	*	.	H	α-helix	trans	-61.4	-39.7	174.5	-177.7	178.2	177.6	-176.7	0	111.9	G458 Y459 T460 Y465	G458-K462 PolarHBondContact O-N 2.63Å; Y459-K462 PolarHBondContact O-N 2.97Å; T460-K462 VanDerWaalsContact C-N 3.35Å; K462-Y465 VanDerWaalsContact O-CD1 3.22Å; K462-Y465 WeakPolarHBondContact O-CD1 3.2Å
463	Q	86.4	Confident	89.7	Confident	153 Å²	153	74.9 Å²	74.9	72%	0.715	38%	0.38	S	S	*	.	H	α-helix	trans	-72.5	-33.2	178.1	-174.7	63.4	12.5	0	0	112.1	Y459 T460 L461	Y459-Q463 WeakPolarHBondContact O-CB 3.45Å; Y459-Q463 PolarHBondContact O-N 3.08Å; T460-Q463 PolarHBondContact O-N 3.17Å; L461-Q463 VanDerWaalsContact C-N 3.31Å; L461-Q463 PolarHBondContact O-N 2.92Å
464	S	88.8	Confident	90.1	Very high	1 Å²	1	78 Å²	78	1%	0.007	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	17.5	-175.7	-47.6	0	0	0	0	112.9	T460 L461 K466 E467 L468 N552	T460-S464 VanDerWaalsContact O-CB 3.23Å; T460-S464 WeakPolarHBondContact O-CB 3.38Å; T460-S464 PolarHBondContact O-N 3.17Å; T460-S464 PolarHBondContact O-OG 3.33Å; L461-S464 CarbonylContact O-C 3.56Å; L461-S464 PolarHBondContact O-N 3.37Å; S464-K466 PolarHBondContact O-N 2.84Å; S464-E467 PolarHBondContact O-N 3.41Å; S464-E467 VanDerWaalsContact O-N 3.13Å; S464-L468 PolarHBondContact O-N 2.95Å; S464-N552 PolarHBondContact OG-ND2 3.49Å; S464-N552 VanDerWaalsContact OG-ND2 3.12Å
465	Y	92.2	Very high	90.4	Very high	148 Å²	148	75.8 Å²	75.8	58%	0.58	38%	0.377	S	S	*	.	H	α-helix	trans	-61.3	-31.1	-174.3	81	-84.6	0	0	0	113.2	L461 K462 G469	L461-Y465 PolarHBondContact O-N 2.67Å; K462-Y465 VanDerWaalsContact O-CD1 3.22Å; K462-Y465 WeakPolarHBondContact O-CD1 3.2Å; Y465-G469 PolarHBondContact O-N 3.4Å
466	K	92.2	Very high	90.8	Very high	139 Å²	139	76.9 Å²	76.9	60%	0.604	39%	0.387	S	S	*	.	H	α-helix	trans	-68.1	-44.1	176.6	-65.7	-176	179	179.6	0	111.3	S464 G469 L470	S464-K466 PolarHBondContact O-N 2.84Å; K466-G469 PolarHBondContact O-N 2.84Å; K466-L470 PolarHBondContact O-N 3.48Å
467	E	89.9	Confident	91.4	Very high	77 Å²	77	81.1 Å²	81.1	36%	0.36	41%	0.409	S	S	.	.	H	α-helix	trans	-64.4	-43.6	176.4	-52.3	-54.8	153.6	0	0	111	S464 L470 L471 I548	S464-E467 PolarHBondContact O-N 3.41Å; S464-E467 VanDerWaalsContact O-N 3.13Å; E467-L470 PolarHBondContact O-N 3.13Å; E467-L471 PolarHBondContact O-N 3.12Å; E467-I548 HydrophobicContact CG-CG2 4.25Å
468	L	90.5	Very high	91.8	Very high	47 Å²	47	78.2 Å²	78.2	25%	0.246	40%	0.395	C	S	.	.	H	α-helix	trans	-62.8	-41.7	174	-73.6	166.3	0	0	0	111.9	L461 S464 L470 L471 M472 I549	L461-L468 HydrophobicContact CB-CD1 4.26Å; L461-L468 HydrophobicContact CD2-CD1 3.6Å; S464-L468 PolarHBondContact O-N 2.95Å; L468-L470 VanDerWaalsContact C-N 3.33Å; L468-L470 PolarHBondContact O-N 3.25Å; L468-L471 PolarHBondContact O-N 3.05Å; L468-M472 VanDerWaalsContact O-CG 3.27Å; L468-M472 WeakPolarHBondContact O-CG 3.14Å; L468-M472 PolarHBondContact O-N 3.39Å; L468-I549 HydrophobicContact CD2-CD1 3.54Å; L468-I549 HydrophobicContact CG-CD1 4.17Å
469	G	92.4	Very high	92.2	Very high	42 Å²	42	76.8 Å²	76.8	43%	0.433	38%	0.378	S	S	.	.	H	α-helix	trans	-61.2	-42.1	176.3	0	0	0	0	0	112.2	Y465 K466 M472 L473	Y465-G469 PolarHBondContact O-N 3.4Å; K466-G469 PolarHBondContact O-N 2.84Å; G469-M472 PolarHBondContact O-N 3.47Å; G469-L473 WeakPolarHBondContact O-CB 3.22Å; G469-L473 PolarHBondContact O-N 2.83Å
470	L	91.8	Very high	92.7	Very high	77 Å²	77	75.2 Å²	75.2	40%	0.403	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-43.3	174.7	-176.8	63.4	0	0	0	111.9	K466 E467 L468 L473 F474	K466-L470 PolarHBondContact O-N 3.48Å; E467-L470 PolarHBondContact O-N 3.13Å; L468-L470 VanDerWaalsContact C-N 3.33Å; L468-L470 PolarHBondContact O-N 3.25Å; L470-L473 HydrophobicContact CD1-CD2 4.46Å; L470-L473 WeakPolarHBondContact O-CB 3.34Å; L470-L473 PolarHBondContact O-N 3.09Å; L470-F474 HydrophobicContact CD1-CE1 3.95Å; L470-F474 HydrophobicContact CD1-CE2 3.89Å; L470-F474 HydrophobicContact CD1-CZ 3.57Å; L470-F474 HydrophobicContact CD2-CE2 4.08Å; L470-F474 HydrophobicContact CD2-CZ 4.32Å; L470-F474 HydrophobicContact CG-CD2 4.22Å; L470-F474 HydrophobicContact CG-CE2 3.69Å; L470-F474 HydrophobicContact CG-CZ 3.93Å; L470-F474 PolarHBondContact O-N 2.98Å
471	L	92.1	Very high	93.3	Very high	22 Å²	22	79.6 Å²	79.6	12%	0.115	40%	0.399	C	S	.	.	H	α-helix	trans	-58	-49.5	174.1	169.4	63.6	0	0	0	111.1	E467 L468 L473 F474 V475 V541 P545	E467-L471 PolarHBondContact O-N 3.12Å; L468-L471 PolarHBondContact O-N 3.05Å; L471-L473 VanDerWaalsContact C-N 3.28Å; L471-L473 PolarHBondContact O-N 3.05Å; L471-F474 PolarHBondContact O-N 3.32Å; L471-V475 HydrophobicContact CD1-CG2 3.96Å; L471-V475 HydrophobicContact CG-CG2 4.44Å; L471-V475 WeakPolarHBondContact O-CG2 3.34Å; L471-V475 PolarHBondContact O-N 3.37Å; L471-V541 HydrophobicContact CD1-CG1 4.4Å; L471-V541 WeakPolarHBondContact CD1-O 3.36Å; L471-P545 HydrophobicContact CB-CB 4.26Å; L471-P545 HydrophobicContact CB-CG 4.11Å; L471-P545 HydrophobicContact CD1-CB 4.47Å; L471-P545 HydrophobicContact CD1-CG 3.89Å; L471-P545 HydrophobicContact CD2-CB 4.37Å; L471-P545 HydrophobicContact CG-CG 4.41Å
472	M	92.9	Very high	93.7	Very high	121 Å²	121	76.2 Å²	76.2	60%	0.596	38%	0.381	S	S	*	.	H	α-helix	trans	-62.7	-36.5	179.7	-66.7	-62.1	-84	0	0	111.6	L468 G469 V475 V476	L468-M472 VanDerWaalsContact O-CG 3.27Å; L468-M472 WeakPolarHBondContact O-CG 3.14Å; L468-M472 PolarHBondContact O-N 3.39Å; G469-M472 PolarHBondContact O-N 3.47Å; M472-V475 PolarHBondContact O-N 3.39Å; M472-V476 WeakPolarHBondContact O-CB 3.27Å; M472-V476 VanDerWaalsContact O-CG2 3.27Å; M472-V476 WeakPolarHBondContact O-CG2 3.49Å; M472-V476 PolarHBondContact O-N 3.26Å
473	L	95.2	Very high	94.1	Very high	93 Å²	93	68.5 Å²	68.5	49%	0.487	35%	0.347	S	S	.	.	H	α-helix	trans	-61	-48.6	173.2	179.3	68.1	0	0	0	111.3	G469 L470 L471 V476 L477	G469-L473 WeakPolarHBondContact O-CB 3.22Å; G469-L473 PolarHBondContact O-N 2.83Å; L470-L473 HydrophobicContact CD1-CD2 4.46Å; L470-L473 WeakPolarHBondContact O-CB 3.34Å; L470-L473 PolarHBondContact O-N 3.09Å; L471-L473 VanDerWaalsContact C-N 3.28Å; L471-L473 PolarHBondContact O-N 3.05Å; L473-V476 PolarHBondContact O-N 3.06Å; L473-L477 HydrophobicContact CD1-CD1 4.31Å; L473-L477 HydrophobicContact CD1-CG 4.43Å; L473-L477 HydrophobicContact CG-CD1 4.09Å; L473-L477 WeakPolarHBondContact O-CB 3.49Å; L473-L477 VanDerWaalsContact O-CG 3.27Å; L473-L477 WeakPolarHBondContact O-CG 3.27Å; L473-L477 PolarHBondContact O-N 3.27Å
474	F	94.8	Very high	94.6	Very high	91 Å²	91	63 Å²	63	40%	0.399	33%	0.326	S	S	.	.	H	α-helix	trans	-63.7	-41.8	177.4	-66.7	-28.2	0	0	0	112.2	L470 L471 V476 L477 V478 V541	L470-F474 HydrophobicContact CD1-CE1 3.95Å; L470-F474 HydrophobicContact CD1-CE2 3.89Å; L470-F474 HydrophobicContact CD1-CZ 3.57Å; L470-F474 HydrophobicContact CD2-CE2 4.08Å; L470-F474 HydrophobicContact CD2-CZ 4.32Å; L470-F474 HydrophobicContact CG-CD2 4.22Å; L470-F474 HydrophobicContact CG-CE2 3.69Å; L470-F474 HydrophobicContact CG-CZ 3.93Å; L470-F474 PolarHBondContact O-N 2.98Å; L471-F474 PolarHBondContact O-N 3.32Å; F474-V476 PolarHBondContact O-N 3.32Å; F474-L477 PolarHBondContact O-N 3.46Å; F474-V478 WeakPolarHBondContact O-CB 3.48Å; F474-V478 WeakPolarHBondContact O-CG2 3.39Å; F474-V478 PolarHBondContact O-N 2.96Å; F474-V541 HydrophobicContact CB-CG1 3.63Å
475	V	95.1	Very high	95	Very high	38 Å²	38	66.6 Å²	66.6	23%	0.23	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-47.7	175.8	171.2	0	0	0	0	110.9	L471 M472 L477 V478 V479 M512 V541 V542	L471-V475 HydrophobicContact CD1-CG2 3.96Å; L471-V475 HydrophobicContact CG-CG2 4.44Å; L471-V475 WeakPolarHBondContact O-CG2 3.34Å; L471-V475 PolarHBondContact O-N 3.37Å; M472-V475 PolarHBondContact O-N 3.39Å; V475-L477 PolarHBondContact O-N 2.95Å; V475-V478 PolarHBondContact O-N 3.18Å; V475-V479 HydrophobicContact CG1-CG2 4.23Å; V475-V479 WeakPolarHBondContact O-CB 3.21Å; V475-V479 VanDerWaalsContact O-CG2 3.23Å; V475-V479 WeakPolarHBondContact O-CG2 3.42Å; V475-V479 PolarHBondContact O-N 3.36Å; V475-M512 HydrophobicContact CG1-CE 4.34Å; V475-M512 HydrophobicContact CG2-CE 4.44Å; V475-V541 HydrophobicContact CG2-CG1 4.19Å; V475-V542 HydrophobicContact CG2-CG2 4.45Å
476	V	96.7	Very high	95.3	Very high	78 Å²	78	59.6 Å²	59.6	47%	0.473	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-46	178.4	169.3	0	0	0	0	111.5	M472 L473 F474 V478 V479 L480	M472-V476 WeakPolarHBondContact O-CB 3.27Å; M472-V476 VanDerWaalsContact O-CG2 3.27Å; M472-V476 WeakPolarHBondContact O-CG2 3.49Å; M472-V476 PolarHBondContact O-N 3.26Å; L473-V476 PolarHBondContact O-N 3.06Å; F474-V476 PolarHBondContact O-N 3.32Å; V476-V478 VanDerWaalsContact C-N 3.33Å; V476-V478 PolarHBondContact O-N 3.33Å; V476-V479 PolarHBondContact O-N 2.94Å; V476-L480 HydrophobicContact CG1-CD1 3.84Å; V476-L480 HydrophobicContact CG1-CG 4.35Å; V476-L480 WeakPolarHBondContact O-CB 3.45Å; V476-L480 VanDerWaalsContact O-CG 3.23Å; V476-L480 WeakPolarHBondContact O-CG 3.44Å; V476-L480 PolarHBondContact O-N 3.38Å
477	L	97.1	Very high	95.5	Very high	92 Å²	92	55.6 Å²	55.6	48%	0.482	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-42.2	178.9	-71.5	173.7	0	0	0	112.2	L473 F474 V475 L480 L481	L473-L477 HydrophobicContact CD1-CD1 4.31Å; L473-L477 HydrophobicContact CD1-CG 4.43Å; L473-L477 HydrophobicContact CG-CD1 4.09Å; L473-L477 WeakPolarHBondContact O-CB 3.49Å; L473-L477 VanDerWaalsContact O-CG 3.27Å; L473-L477 WeakPolarHBondContact O-CG 3.27Å; L473-L477 PolarHBondContact O-N 3.27Å; F474-L477 PolarHBondContact O-N 3.46Å; V475-L477 PolarHBondContact O-N 2.95Å; L477-L480 PolarHBondContact O-N 3.35Å; L477-L481 VanDerWaalsContact O-CB 3.3Å; L477-L481 WeakPolarHBondContact O-CB 2.97Å; L477-L481 PolarHBondContact O-N 3.17Å
478	V	97	Very high	95.8	Very high	22 Å²	22	57.7 Å²	57.7	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-71.4	-41.6	-178.9	175.3	0	0	0	0	111.1	F474 V475 V476 L481 F482 M512 V541	F474-V478 WeakPolarHBondContact O-CB 3.48Å; F474-V478 WeakPolarHBondContact O-CG2 3.39Å; F474-V478 PolarHBondContact O-N 2.96Å; V475-V478 PolarHBondContact O-N 3.18Å; V476-V478 VanDerWaalsContact C-N 3.33Å; V476-V478 PolarHBondContact O-N 3.33Å; V478-L481 PolarHBondContact O-N 3.5Å; V478-F482 HydrophobicContact CG1-CD2 3.48Å; V478-F482 VanDerWaalsContact CG1-CD2 3.48Å; V478-F482 HydrophobicContact CG1-CE2 3.68Å; V478-F482 WeakPolarHBondContact O-CD2 3.31Å; V478-F482 PolarHBondContact O-N 2.91Å; V478-M512 HydrophobicContact CB-CE 3.75Å; V478-M512 HydrophobicContact CB-SD 4.02Å; V478-M512 HydrophobicContact CG1-CE 3.44Å; V478-M512 VanDerWaalsContact CG1-CE 3.44Å; V478-M512 HydrophobicContact CG1-CG 4.26Å; V478-M512 HydrophobicContact CG1-SD 3.43Å; V478-M512 WeakPolarHBondContact CG1-SD 3.47Å; V478-V541 HydrophobicContact CG2-CG2 4.18Å
479	V	97.7	Very high	96.1	Very high	11 Å²	11	56.3 Å²	56.3	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-58.9	-49.7	172.4	169.2	0	0	0	0	110.3	V475 V476 L481 S483 F505 A508 I509 M512	V475-V479 HydrophobicContact CG1-CG2 4.23Å; V475-V479 WeakPolarHBondContact O-CB 3.21Å; V475-V479 VanDerWaalsContact O-CG2 3.23Å; V475-V479 WeakPolarHBondContact O-CG2 3.42Å; V475-V479 PolarHBondContact O-N 3.36Å; V476-V479 PolarHBondContact O-N 2.94Å; V479-L481 VanDerWaalsContact C-N 3.33Å; V479-L481 PolarHBondContact O-N 2.92Å; V479-S483 WeakPolarHBondContact O-CB 3.33Å; V479-S483 PolarHBondContact O-N 2.88Å; V479-S483 PolarHBondContact O-OG 3.02Å; V479-F505 HydrophobicContact CG1-CB 3.92Å; V479-F505 HydrophobicContact CG1-CD1 3.66Å; V479-F505 HydrophobicContact CG1-CE1 4.42Å; V479-F505 HydrophobicContact CG1-CG 3.91Å; V479-A508 HydrophobicContact CG1-CB 4.32Å; V479-I509 HydrophobicContact CG1-CG1 4.21Å; V479-I509 HydrophobicContact CG2-CG1 3.69Å; V479-M512 HydrophobicContact CG2-SD 3.59Å; V479-M512 VanDerWaalsContact CG2-SD 3.59Å
480	L	97.9	Very high	96.2	Very high	76 Å²	76	54.3 Å²	54.3	40%	0.398	28%	0.281	S	S	.	.	H	α-helix	trans	-58.9	-44	178.6	-72.5	172	0	0	0	112.1	V476 L477 S484 F505	V476-L480 HydrophobicContact CG1-CD1 3.84Å; V476-L480 HydrophobicContact CG1-CG 4.35Å; V476-L480 WeakPolarHBondContact O-CB 3.45Å; V476-L480 VanDerWaalsContact O-CG 3.23Å; V476-L480 WeakPolarHBondContact O-CG 3.44Å; V476-L480 PolarHBondContact O-N 3.38Å; L477-L480 PolarHBondContact O-N 3.35Å; L480-S484 VanDerWaalsContact O-CB 3.31Å; L480-S484 WeakPolarHBondContact O-CB 3.26Å; L480-S484 PolarHBondContact O-N 2.96Å; L480-S484 PolarHBondContact O-OG 2.69Å; L480-F505 HydrophobicContact CD2-CE1 3.72Å; L480-F505 HydrophobicContact CD2-CE2 4.41Å; L480-F505 HydrophobicContact CD2-CZ 3.46Å; L480-F505 VanDerWaalsContact CD2-CZ 3.46Å
481	L	98.2	Very high	96.3	Very high	96 Å²	96	54 Å²	54	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-64.7	-56.3	-179.7	178.9	64.4	0	0	0	111.6	L477 V478 V479 S484 L485	L477-L481 VanDerWaalsContact O-CB 3.3Å; L477-L481 WeakPolarHBondContact O-CB 2.97Å; L477-L481 PolarHBondContact O-N 3.17Å; V478-L481 PolarHBondContact O-N 3.5Å; V479-L481 VanDerWaalsContact C-N 3.33Å; V479-L481 PolarHBondContact O-N 2.92Å; L481-S484 PolarHBondContact O-N 3.44Å; L481-L485 HydrophobicContact CD1-CD1 4.15Å; L481-L485 HydrophobicContact CD1-CG 4.49Å; L481-L485 HydrophobicContact CG-CD1 4.18Å; L481-L485 WeakPolarHBondContact O-CG 3.36Å; L481-L485 PolarHBondContact O-N 3.42Å
482	F	98.2	Very high	96.2	Very high	14 Å²	14	57.9 Å²	57.9	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-73.7	-31.4	-174.2	-75.1	-67.7	0	0	0	113.1	V478 S484 L485 A486 I530 I533 C534 C537	V478-F482 HydrophobicContact CG1-CD2 3.48Å; V478-F482 VanDerWaalsContact CG1-CD2 3.48Å; V478-F482 HydrophobicContact CG1-CE2 3.68Å; V478-F482 WeakPolarHBondContact O-CD2 3.31Å; V478-F482 PolarHBondContact O-N 2.91Å; F482-S484 VanDerWaalsContact C-N 3.35Å; F482-L485 HydrophobicContact CD1-CD1 4.35Å; F482-L485 PolarHBondContact O-N 3.37Å; F482-A486 WeakPolarHBondContact O-CB 2.97Å; F482-A486 PolarHBondContact O-N 3.37Å; F482-I530 HydrophobicContact CD1-CG2 3.83Å; F482-I533 HydrophobicContact CE1-CB 4.22Å; F482-I533 HydrophobicContact CE1-CG2 3.86Å; F482-I533 HydrophobicContact CZ-CG2 3.77Å; F482-C534 HydrophobicContact CB-CB 4.05Å; F482-C534 HydrophobicContact CD1-CB 3.65Å; F482-C534 HydrophobicContact CD2-CB 4.02Å; F482-C534 HydrophobicContact CE1-CB 4.08Å; F482-C534 HydrophobicContact CE2-CB 4.42Å; F482-C534 HydrophobicContact CG-CB 3.63Å; F482-C534 HydrophobicContact CZ-CB 4.45Å; F482-C537 HydrophobicContact CE2-CB 3.82Å; F482-C537 HydrophobicContact CZ-CB 4.14Å
483	S	98.1	Very high	96	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.1	-36.9	172.1	-65.8	0	0	0	0	112.4	V479 Y487 T504 F505 A508	V479-S483 WeakPolarHBondContact O-CB 3.33Å; V479-S483 PolarHBondContact O-N 2.88Å; V479-S483 PolarHBondContact O-OG 3.02Å; S483-Y487 WeakPolarHBondContact O-CB 3.36Å; S483-Y487 PolarHBondContact O-N 2.86Å; S483-T504 VanDerWaalsContact OG-C 3.25Å; S483-T504 PolarHBondContact OG-O 3.39Å; S483-F505 WeakPolarHBondContact OG-CA 3.36Å; S483-F505 WeakPolarHBondContact OG-CD1 3.28Å; S483-F505 PolarHBondContact OG-N 3.38Å; S483-A508 WeakPolarHBondContact OG-CB 3.44Å
484	S	98.1	Very high	95.5	Very high	38 Å²	38	53.9 Å²	53.9	27%	0.266	28%	0.279	S	S	.	.	H	α-helix	trans	-66.3	-47.7	174.8	-58.9	0	0	0	0	111	L480 L481 F482 Y487 F488	L480-S484 VanDerWaalsContact O-CB 3.31Å; L480-S484 WeakPolarHBondContact O-CB 3.26Å; L480-S484 PolarHBondContact O-N 2.96Å; L480-S484 PolarHBondContact O-OG 2.69Å; L481-S484 PolarHBondContact O-N 3.44Å; F482-S484 VanDerWaalsContact C-N 3.35Å; S484-Y487 PolarHBondContact O-N 3.18Å; S484-F488 WeakPolarHBondContact O-CD2 3.3Å; S484-F488 PolarHBondContact O-N 2.9Å
485	L	97.9	Very high	94.8	Very high	77 Å²	77	55.9 Å²	55.9	40%	0.403	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-46	178	-69.9	174.3	0	0	0	111.9	L481 F482 F488 A489 I530	L481-L485 HydrophobicContact CD1-CD1 4.15Å; L481-L485 HydrophobicContact CD1-CG 4.49Å; L481-L485 HydrophobicContact CG-CD1 4.18Å; L481-L485 WeakPolarHBondContact O-CG 3.36Å; L481-L485 PolarHBondContact O-N 3.42Å; F482-L485 HydrophobicContact CD1-CD1 4.35Å; F482-L485 PolarHBondContact O-N 3.37Å; L485-F488 PolarHBondContact O-N 2.92Å; L485-A489 VanDerWaalsContact O-CB 3.3Å; L485-A489 WeakPolarHBondContact O-CB 3.34Å; L485-A489 PolarHBondContact O-N 3.07Å; L485-I530 HydrophobicContact CB-CD1 3.9Å; L485-I530 HydrophobicContact CB-CG1 4.44Å; L485-I530 HydrophobicContact CB-CG2 4Å
486	A	97.1	Very high	94.4	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.2	-40.7	179.5	0	0	0	0	0	112.2	F482 F488 A489 E490 F498 T504 W507 I530	F482-A486 WeakPolarHBondContact O-CB 2.97Å; F482-A486 PolarHBondContact O-N 3.37Å; A486-F488 PolarHBondContact O-N 3.01Å; A486-A489 PolarHBondContact O-N 3.35Å; A486-E490 VanDerWaalsContact O-CB 3.31Å; A486-E490 WeakPolarHBondContact O-CB 3.36Å; A486-E490 WeakPolarHBondContact O-CG 3.13Å; A486-E490 PolarHBondContact O-N 2.79Å; A486-F498 HydrophobicContact CB-CD1 4.47Å; A486-F498 HydrophobicContact CB-CE1 3.91Å; A486-T504 HydrophobicContact CB-CG2 4.11Å; A486-W507 HydrophobicContact CB-CE3 3.82Å; A486-W507 HydrophobicContact CB-CH2 3.73Å; A486-W507 HydrophobicContact CB-CZ3 3.25Å; A486-I530 HydrophobicContact CB-CG2 4.38Å
487	Y	97.3	Very high	94.1	Very high	55 Å²	55	59.3 Å²	59.3	22%	0.216	30%	0.301	C	S	.	.	H	α-helix	trans	-57.1	-50.4	172.4	171.9	-102.1	0	0	0	111.1	S483 S484 A489 E490 K491 F498 I501	S483-Y487 WeakPolarHBondContact O-CB 3.36Å; S483-Y487 PolarHBondContact O-N 2.86Å; S484-Y487 PolarHBondContact O-N 3.18Å; Y487-A489 VanDerWaalsContact C-N 3.28Å; Y487-A489 PolarHBondContact O-N 3.45Å; Y487-E490 PolarHBondContact O-N 3Å; Y487-K491 HydrophobicContact CD2-CB 4.33Å; Y487-K491 HydrophobicContact CE1-CB 4.45Å; Y487-K491 HydrophobicContact CE1-CD 4.23Å; Y487-K491 HydrophobicContact CE2-CB 3.99Å; Y487-K491 WeakPolarHBondContact O-CA 3.07Å; Y487-K491 WeakPolarHBondContact O-CB 3.48Å; Y487-K491 WeakPolarHBondContact O-CG 3.3Å; Y487-K491 PolarHBondContact O-N 2.71Å; Y487-F498 WeakPolarHBondContact CD2-O 3.4Å; Y487-F498 VanDerWaalsContact CE2-O 3.3Å; Y487-F498 WeakPolarHBondContact CE2-O 3.22Å; Y487-I501 HydrophobicContact CD1-CD1 4.28Å; Y487-I501 HydrophobicContact CD1-CG1 3.65Å; Y487-I501 HydrophobicContact CE1-CG1 4.26Å; Y487-I501 HydrophobicContact CG-CG1 3.85Å
488	F	96.5	Very high	93.9	Very high	121 Å²	121	55 Å²	55	53%	0.531	28%	0.278	S	S	.	.	H	α-helix	trans	-68.3	-26.3	-179.9	-76.5	-62.9	0	0	0	113.8	S484 L485 A486 K491 I501	S484-F488 WeakPolarHBondContact O-CD2 3.3Å; S484-F488 PolarHBondContact O-N 2.9Å; L485-F488 PolarHBondContact O-N 2.92Å; A486-F488 PolarHBondContact O-N 3.01Å; F488-K491 HydrophobicContact CD1-CD 4.07Å; F488-I501 HydrophobicContact CE2-CD1 4.47Å
489	A	96	Very high	93.7	Very high	18 Å²	18	60.7 Å²	60.7	15%	0.149	30%	0.303	C	S	.	.	H	α-helix	trans	-75.9	-31.9	174.8	0	0	0	0	0	113.2	L485 A486 Y487 L526 I530	L485-A489 VanDerWaalsContact O-CB 3.3Å; L485-A489 WeakPolarHBondContact O-CB 3.34Å; L485-A489 PolarHBondContact O-N 3.07Å; A486-A489 PolarHBondContact O-N 3.35Å; Y487-A489 VanDerWaalsContact C-N 3.28Å; Y487-A489 PolarHBondContact O-N 3.45Å; A489-L526 HydrophobicContact CB-CD2 3.86Å; A489-I530 HydrophobicContact CB-CD1 3.67Å
490	E	95.6	Very high	93.5	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-111.3	-14.1	-169.8	-66	-71.6	146.7	0	0	114	A486 Y487 D492 D493 N494 F498 P522 K523 T524	A486-E490 VanDerWaalsContact O-CB 3.31Å; A486-E490 WeakPolarHBondContact O-CB 3.36Å; A486-E490 WeakPolarHBondContact O-CG 3.13Å; A486-E490 PolarHBondContact O-N 2.79Å; Y487-E490 PolarHBondContact O-N 3Å; E490-D492 PolarHBondContact O-N 3.03Å; E490-D493 PolarHBondContact O-N 3.35Å; E490-N494 HydrophobicContact CB-CB 4.27Å; E490-N494 WeakPolarHBondContact O-CA 3.34Å; E490-N494 PolarHBondContact O-N 3.37Å; E490-N494 WeakPolarHBondContact OE2-CB 3.46Å; E490-F498 HydrophobicContact CB-CB 4.01Å; E490-F498 HydrophobicContact CB-CD1 4.07Å; E490-F498 HydrophobicContact CB-CD2 3.46Å; E490-F498 VanDerWaalsContact CB-CD2 3.46Å; E490-F498 HydrophobicContact CB-CE1 4.44Å; E490-F498 HydrophobicContact CB-CE2 3.89Å; E490-F498 HydrophobicContact CB-CG 3.57Å; E490-F498 HydrophobicContact CB-CZ 4.36Å; E490-F498 HydrophobicContact CG-CD1 4.41Å; E490-F498 HydrophobicContact CG-CD2 3.91Å; E490-F498 HydrophobicContact CG-CE1 4.27Å; E490-F498 HydrophobicContact CG-CE2 3.77Å; E490-F498 HydrophobicContact CG-CG 4.23Å; E490-F498 HydrophobicContact CG-CZ 3.96Å; E490-P522 VanDerWaalsContact CD-CA 3.49Å; E490-P522 HydrophobicContact CG-CB 4.15Å; E490-P522 WeakPolarHBondContact OE1-CA 3.37Å; E490-P522 VanDerWaalsContact OE1-CB 3.31Å; E490-P522 WeakPolarHBondContact OE1-CB 3.47Å; E490-K523 VanDerWaalsContact CD-N 3.31Å; E490-K523 PolarHBondContact OE1-N 2.93Å; E490-K523 VanDerWaalsContact OE1-N 3.12Å; E490-K523 PolarHBondContact OE2-N 3.37Å; E490-T524 VanDerWaalsContact OE1-CB 3.27Å; E490-T524 WeakPolarHBondContact OE1-CB 3.35Å; E490-T524 WeakPolarHBondContact OE1-CG2 3.19Å; E490-T524 PolarHBondContact OE1-N 3.49Å; E490-T524 PolarHBondContact OE1-OG1 3.44Å
491	K	92.4	Very high	93.4	Very high	71 Å²	71	61 Å²	61	31%	0.309	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.5	-174.1	60	166.5	-169.5	160.4	0	114.5	Y487 F488 K495	Y487-K491 HydrophobicContact CD2-CB 4.33Å; Y487-K491 HydrophobicContact CE1-CB 4.45Å; Y487-K491 HydrophobicContact CE1-CD 4.23Å; Y487-K491 HydrophobicContact CE2-CB 3.99Å; Y487-K491 WeakPolarHBondContact O-CA 3.07Å; Y487-K491 WeakPolarHBondContact O-CB 3.48Å; Y487-K491 WeakPolarHBondContact O-CG 3.3Å; Y487-K491 PolarHBondContact O-N 2.71Å; F488-K491 HydrophobicContact CD1-CD 4.07Å; K491-K495 VanDerWaalsContact O-CE 3.29Å; K491-K495 WeakPolarHBondContact O-CE 3.5Å; K491-K495 WeakPolarHBondContact O-CG 3.23Å
492	D	90.6	Very high	93.4	Very high	103 Å²	103	60.4 Å²	60.4	55%	0.551	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-36.3	-177.7	-65.2	-43.3	0	0	0	111.5	E490 K495	E490-D492 PolarHBondContact O-N 3.03Å; D492-K495 WeakPolarHBondContact O-CE 3.17Å
493	D	88.4	Confident	93.2	Very high	123 Å²	123	61.6 Å²	61.6	66%	0.658	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-25.3	-176.4	-65.7	-48.5	0	0	0	114.4	E490 T524	E490-D493 PolarHBondContact O-N 3.35Å; D493-T524 HydrophobicContact CB-CG2 3.72Å; D493-T524 WeakPolarHBondContact OD2-CG2 3.24Å
494	N	85	Confident	93.2	Very high	7 Å²	7	61.6 Å²	61.6	4%	0.037	32%	0.322	C	S	.	.			trans	-136.7	50.4	-170.9	-161.1	14.9	0	0	0	113.3	E490 N496 E497 F498 T521 K523	E490-N494 HydrophobicContact CB-CB 4.27Å; E490-N494 WeakPolarHBondContact O-CA 3.34Å; E490-N494 PolarHBondContact O-N 3.37Å; E490-N494 WeakPolarHBondContact OE2-CB 3.46Å; N494-N496 VanDerWaalsContact C-N 3.28Å; N494-N496 PolarHBondContact O-N 2.89Å; N494-E497 VanDerWaalsContact ND2-CD 3.33Å; N494-E497 PolarHBondContact ND2-OE2 2.95Å; N494-E497 PolarHBondContact O-N 3.28Å; N494-E497 PolarHBondContact OD1-OE1 3.07Å; N494-F498 HydrophobicContact CB-CD2 4.1Å; N494-F498 PolarHBondContact O-N 3.03Å; N494-T521 PolarHBondContact ND2-O 3.32Å; N494-T521 VanDerWaalsContact ND2-O 3.1Å; N494-K523 HydrophobicContact CB-CD 4.34Å; N494-K523 PolarHBondContact OD1-NZ 2.84Å
495	K	80.6	Confident	93.1	Very high	134 Å²	134	62.5 Å²	62.5	58%	0.583	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-34.1	-174.5	-72.4	174	-174.7	178.4	0	115.5	K491 D492 Q499	K491-K495 VanDerWaalsContact O-CE 3.29Å; K491-K495 WeakPolarHBondContact O-CE 3.5Å; K491-K495 WeakPolarHBondContact O-CG 3.23Å; D492-K495 WeakPolarHBondContact O-CE 3.17Å; K495-Q499 WeakPolarHBondContact O-CG 3.38Å
496	N	86.9	Confident	93.1	Very high	140 Å²	140	64.4 Å²	64.4	75%	0.749	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-31.9	-175.2	-65.1	-18	0	0	0	112.1	N494 Q499	N494-N496 VanDerWaalsContact C-N 3.28Å; N494-N496 PolarHBondContact O-N 2.89Å; N496-Q499 WeakPolarHBondContact O-CG 3.41Å; N496-Q499 PolarHBondContact O-NE2 3.29Å
497	E	90.2	Very high	93.1	Very high	47 Å²	47	64.8 Å²	64.8	22%	0.22	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-41.2	-178.5	-68.8	175.2	-148.3	0	0	111.3	N494 Q499 I520 T521 K523	N494-E497 VanDerWaalsContact ND2-CD 3.33Å; N494-E497 PolarHBondContact ND2-OE2 2.95Å; N494-E497 PolarHBondContact O-N 3.28Å; N494-E497 PolarHBondContact OD1-OE1 3.07Å; E497-Q499 PolarHBondContact O-N 2.93Å; E497-I520 HydrophobicContact CB-CG2 4.22Å; E497-T521 PolarHBondContact OE2-N 3.26Å; E497-T521 VanDerWaalsContact OE2-N 3.09Å; E497-K523 WeakPolarHBondContact OE1-CE 3.38Å; E497-K523 IonicContact OE1-NZ 3.01Å; E497-K523 PolarHBondContact OE1-NZ 3.48Å
498	F	92.3	Very high	93.1	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.009	32%	0.315	C	S	.	.			trans	-102.7	60.4	-178.7	-67.3	-93.9	0	0	0	111.9	A486 Y487 E490 N494 T504 W507 I520	A486-F498 HydrophobicContact CB-CD1 4.47Å; A486-F498 HydrophobicContact CB-CE1 3.91Å; Y487-F498 WeakPolarHBondContact CD2-O 3.4Å; Y487-F498 VanDerWaalsContact CE2-O 3.3Å; Y487-F498 WeakPolarHBondContact CE2-O 3.22Å; E490-F498 HydrophobicContact CB-CB 4.01Å; E490-F498 HydrophobicContact CB-CD1 4.07Å; E490-F498 HydrophobicContact CB-CD2 3.46Å; E490-F498 VanDerWaalsContact CB-CD2 3.46Å; E490-F498 HydrophobicContact CB-CE1 4.44Å; E490-F498 HydrophobicContact CB-CE2 3.89Å; E490-F498 HydrophobicContact CB-CG 3.57Å; E490-F498 HydrophobicContact CB-CZ 4.36Å; E490-F498 HydrophobicContact CG-CD1 4.41Å; E490-F498 HydrophobicContact CG-CD2 3.91Å; E490-F498 HydrophobicContact CG-CE1 4.27Å; E490-F498 HydrophobicContact CG-CE2 3.77Å; E490-F498 HydrophobicContact CG-CG 4.23Å; E490-F498 HydrophobicContact CG-CZ 3.96Å; N494-F498 HydrophobicContact CB-CD2 4.1Å; N494-F498 PolarHBondContact O-N 3.03Å; F498-T504 HydrophobicContact CD1-CG2 3.55Å; F498-T504 HydrophobicContact CE1-CG2 3.61Å; F498-W507 HydrophobicContact CE1-CD2 4.26Å; F498-W507 HydrophobicContact CE1-CE3 4.39Å; F498-W507 HydrophobicContact CE1-CG 4.44Å; F498-W507 HydrophobicContact CZ-CD2 4.44Å; F498-W507 HydrophobicContact CZ-CG 4.47Å; F498-I520 HydrophobicContact CD2-CG2 4.39Å; F498-I520 HydrophobicContact CE1-CG2 4.12Å; F498-I520 HydrophobicContact CE2-CG2 3.79Å; F498-I520 HydrophobicContact CZ-CG2 3.64Å
499	Q	91.9	Very high	93.1	Very high	141 Å²	141	60.2 Å²	60.2	66%	0.659	31%	0.309	S	S	*	.			trans	-68.7	-37.7	-172.9	-63.1	178.5	18.3	0	0	113.6	K495 N496 E497	K495-Q499 WeakPolarHBondContact O-CG 3.38Å; N496-Q499 WeakPolarHBondContact O-CG 3.41Å; N496-Q499 PolarHBondContact O-NE2 3.29Å; E497-Q499 PolarHBondContact O-N 2.93Å
500	S	95.1	Very high	93.1	Very high	47 Å²	47	59.7 Å²	59.7	33%	0.329	30%	0.304	S	S	.	.			trans	-155.7	163.5	-178.8	66.3	0	0	0	0	110.7	A503 T504	S500-A503 PolarHBondContact O-N 3.23Å; S500-A503 WeakPolarHBondContact OG-CB 3.34Å; S500-A503 PolarHBondContact OG-N 3.16Å; S500-T504 PolarHBondContact O-N 3.28Å; S500-T504 PolarHBondContact O-OG1 2.86Å
501	I	96.2	Very high	93.2	Very high	48 Å²	48	60.7 Å²	60.7	25%	0.246	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-47.7	177	-59.4	170.5	0	0	0	111.1	Y487 F488 A503 T504 F505	Y487-I501 HydrophobicContact CD1-CD1 4.28Å; Y487-I501 HydrophobicContact CD1-CG1 3.65Å; Y487-I501 HydrophobicContact CE1-CG1 4.26Å; Y487-I501 HydrophobicContact CG-CG1 3.85Å; F488-I501 HydrophobicContact CE2-CD1 4.47Å; I501-A503 PolarHBondContact O-N 3.43Å; I501-T504 WeakPolarHBondContact O-CA 3.14Å; I501-T504 WeakPolarHBondContact O-CB 3.3Å; I501-T504 PolarHBondContact O-N 3.05Å; I501-F505 HydrophobicContact CG2-CE1 3.76Å; I501-F505 HydrophobicContact CG2-CZ 4.23Å; I501-F505 WeakPolarHBondContact O-CD1 3.27Å; I501-F505 PolarHBondContact O-N 3.45Å
502	P	97.2	Very high	93.3	Very high	83 Å²	83	57.6 Å²	57.6	54%	0.539	30%	0.296	S	S	.	.	H	α-helix	trans	-63.8	-35.3	177.3	-24.2	36.1	0	0	0	114.3	T504 F505	P502-T504 PolarHBondContact O-N 2.97Å; P502-F505 HydrophobicContact CB-CD2 4.18Å; P502-F505 HydrophobicContact CB-CE2 4.03Å; P502-F505 HydrophobicContact CG-CE2 4.43Å; P502-F505 VanDerWaalsContact O-CB 3.28Å; P502-F505 WeakPolarHBondContact O-CB 3.03Å; P502-F505 WeakPolarHBondContact O-CG 3.41Å; P502-F505 PolarHBondContact O-N 3.3Å; P502-F505 VanDerWaalsContact O-N 3.14Å
503	A	94.6	Very high	93.4	Very high	38 Å²	38	55.8 Å²	55.8	31%	0.314	29%	0.289	S	S	.	.	H	α-helix	trans	-63.2	-34.3	173.3	0	0	0	0	0	111.4	S500 I501 F505 W506	S500-A503 PolarHBondContact O-N 3.23Å; S500-A503 WeakPolarHBondContact OG-CB 3.34Å; S500-A503 PolarHBondContact OG-N 3.16Å; I501-A503 PolarHBondContact O-N 3.43Å; A503-F505 PolarHBondContact O-N 3.43Å; A503-W506 PolarHBondContact O-N 2.67Å
504	T	96.8	Very high	93.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-73.5	-12.3	177.2	-47.3	0	0	0	0	112.8	S483 A486 F498 S500 I501 P502 W506 W507 A508	S483-T504 VanDerWaalsContact OG-C 3.25Å; S483-T504 PolarHBondContact OG-O 3.39Å; A486-T504 HydrophobicContact CB-CG2 4.11Å; F498-T504 HydrophobicContact CD1-CG2 3.55Å; F498-T504 HydrophobicContact CE1-CG2 3.61Å; S500-T504 PolarHBondContact O-N 3.28Å; S500-T504 PolarHBondContact O-OG1 2.86Å; I501-T504 WeakPolarHBondContact O-CA 3.14Å; I501-T504 WeakPolarHBondContact O-CB 3.3Å; I501-T504 PolarHBondContact O-N 3.05Å; P502-T504 PolarHBondContact O-N 2.97Å; T504-W506 VanDerWaalsContact C-N 3.25Å; T504-W506 PolarHBondContact O-N 3.45Å; T504-W507 HydrophobicContact CG2-CE3 3.97Å; T504-W507 PolarHBondContact O-N 2.88Å; T504-A508 PolarHBondContact O-N 3.16Å; T504-A508 VanDerWaalsContact O-N 3.1Å
505	F	97.7	Very high	94.2	Very high	58 Å²	58	57.8 Å²	57.8	25%	0.254	31%	0.306	S	S	.	.	H	α-helix	trans	-60.2	-38	172.7	-64.4	-19.1	0	0	0	111.6	V479 L480 S483 I501 P502 A503 W507 A508 I509	V479-F505 HydrophobicContact CG1-CB 3.92Å; V479-F505 HydrophobicContact CG1-CD1 3.66Å; V479-F505 HydrophobicContact CG1-CE1 4.42Å; V479-F505 HydrophobicContact CG1-CG 3.91Å; L480-F505 HydrophobicContact CD2-CE1 3.72Å; L480-F505 HydrophobicContact CD2-CE2 4.41Å; L480-F505 HydrophobicContact CD2-CZ 3.46Å; L480-F505 VanDerWaalsContact CD2-CZ 3.46Å; S483-F505 WeakPolarHBondContact OG-CA 3.36Å; S483-F505 WeakPolarHBondContact OG-CD1 3.28Å; S483-F505 PolarHBondContact OG-N 3.38Å; I501-F505 HydrophobicContact CG2-CE1 3.76Å; I501-F505 HydrophobicContact CG2-CZ 4.23Å; I501-F505 WeakPolarHBondContact O-CD1 3.27Å; I501-F505 PolarHBondContact O-N 3.45Å; P502-F505 HydrophobicContact CB-CD2 4.18Å; P502-F505 HydrophobicContact CB-CE2 4.03Å; P502-F505 HydrophobicContact CG-CE2 4.43Å; P502-F505 VanDerWaalsContact O-CB 3.28Å; P502-F505 WeakPolarHBondContact O-CB 3.03Å; P502-F505 WeakPolarHBondContact O-CG 3.41Å; P502-F505 PolarHBondContact O-N 3.3Å; P502-F505 VanDerWaalsContact O-N 3.14Å; A503-F505 PolarHBondContact O-N 3.43Å; F505-W507 PolarHBondContact O-N 3.12Å; F505-A508 PolarHBondContact O-N 2.66Å; F505-I509 HydrophobicContact CB-CD1 4.49Å; F505-I509 WeakPolarHBondContact O-CB 3.37Å; F505-I509 WeakPolarHBondContact O-CD1 3.08Å; F505-I509 WeakPolarHBondContact O-CG1 3.46Å; F505-I509 PolarHBondContact O-N 3.49Å
506	W	97.3	Very high	94.8	Very high	117 Å²	117	53.4 Å²	53.4	44%	0.443	30%	0.299	S	S	.	.	H	α-helix	trans	-55.3	-51.7	175.8	171.6	-111.9	0	0	0	111.4	A503 T504 A508 I509 I510 Y517 D519	A503-W506 PolarHBondContact O-N 2.67Å; T504-W506 VanDerWaalsContact C-N 3.25Å; T504-W506 PolarHBondContact O-N 3.45Å; W506-A508 PolarHBondContact O-N 2.63Å; W506-I509 PolarHBondContact O-N 3.39Å; W506-I510 HydrophobicContact CD2-CG2 4.14Å; W506-I510 HydrophobicContact CE3-CG2 4.15Å; W506-I510 HydrophobicContact CH2-CG2 4.02Å; W506-I510 HydrophobicContact CZ2-CG2 3.99Å; W506-I510 HydrophobicContact CZ3-CG2 4.09Å; W506-I510 WeakPolarHBondContact O-CG1 3.41Å; W506-I510 PolarHBondContact O-N 3.08Å; W506-I510 VanDerWaalsContact O-N 3.07Å; W506-Y517 HydrophobicContact CH2-CD2 4.09Å; W506-Y517 AromaticContact CH2-CE2 3.69Å; W506-Y517 HydrophobicContact CH2-CE2 3.69Å; W506-Y517 AromaticContact CZ2-CD2 3.56Å; W506-Y517 HydrophobicContact CZ2-CD2 3.56Å; W506-Y517 AromaticContact CZ2-CE2 3.66Å; W506-Y517 HydrophobicContact CZ2-CE2 3.66Å; W506-D519 PolarHBondContact NE1-OD2 3.35Å
507	W	96.9	Very high	95.1	Very high	7 Å²	7	54.4 Å²	54.4	3%	0.027	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-45	177.6	172	76.3	0	0	0	112.8	A486 F498 T504 F505 I510 T511 I520 P522 I530	A486-W507 HydrophobicContact CB-CE3 3.82Å; A486-W507 HydrophobicContact CB-CH2 3.73Å; A486-W507 HydrophobicContact CB-CZ3 3.25Å; F498-W507 HydrophobicContact CE1-CD2 4.26Å; F498-W507 HydrophobicContact CE1-CE3 4.39Å; F498-W507 HydrophobicContact CE1-CG 4.44Å; F498-W507 HydrophobicContact CZ-CD2 4.44Å; F498-W507 HydrophobicContact CZ-CG 4.47Å; T504-W507 HydrophobicContact CG2-CE3 3.97Å; T504-W507 PolarHBondContact O-N 2.88Å; F505-W507 PolarHBondContact O-N 3.12Å; W507-I510 WeakPolarHBondContact O-CG1 3.31Å; W507-T511 PolarHBondContact NE1-OG1 3Å; W507-T511 WeakPolarHBondContact O-CB 3.45Å; W507-T511 PolarHBondContact O-N 3.04Å; W507-T511 PolarHBondContact O-OG1 3.27Å; W507-I520 HydrophobicContact CB-CB 4.15Å; W507-I520 HydrophobicContact CB-CG2 3.75Å; W507-I520 HydrophobicContact CG-CB 4.47Å; W507-I520 HydrophobicContact CG-CG2 3.92Å; W507-P522 HydrophobicContact CZ2-CG 4.05Å; W507-I530 HydrophobicContact CH2-CG2 4.49Å
508	A	97.6	Very high	95.2	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.9	-42.8	179.7	0	0	0	0	0	111.8	V479 S483 T504 F505 W506 T511 M512	V479-A508 HydrophobicContact CG1-CB 4.32Å; S483-A508 WeakPolarHBondContact OG-CB 3.44Å; T504-A508 PolarHBondContact O-N 3.16Å; T504-A508 VanDerWaalsContact O-N 3.1Å; F505-A508 PolarHBondContact O-N 2.66Å; W506-A508 PolarHBondContact O-N 2.63Å; A508-T511 PolarHBondContact O-N 2.93Å; A508-M512 VanDerWaalsContact O-CB 3.3Å; A508-M512 WeakPolarHBondContact O-CB 3.34Å; A508-M512 WeakPolarHBondContact O-CG 3.43Å; A508-M512 PolarHBondContact O-N 3.47Å
509	I	96.3	Very high	95.2	Very high	80 Å²	80	58.4 Å²	58.4	41%	0.41	33%	0.327	S	S	.	.	H	α-helix	trans	-60.1	-53.7	178.7	-69.7	165.2	0	0	0	110.4	V479 F505 W506 T511 M512 T513	V479-I509 HydrophobicContact CG1-CG1 4.21Å; V479-I509 HydrophobicContact CG2-CG1 3.69Å; F505-I509 HydrophobicContact CB-CD1 4.49Å; F505-I509 WeakPolarHBondContact O-CB 3.37Å; F505-I509 WeakPolarHBondContact O-CD1 3.08Å; F505-I509 WeakPolarHBondContact O-CG1 3.46Å; F505-I509 PolarHBondContact O-N 3.49Å; W506-I509 PolarHBondContact O-N 3.39Å; I509-T511 VanDerWaalsContact C-N 3.27Å; I509-T511 PolarHBondContact O-N 3.24Å; I509-M512 PolarHBondContact O-N 3.13Å; I509-T513 WeakPolarHBondContact O-CG2 3.44Å; I509-T513 PolarHBondContact O-N 3.38Å; I509-T513 PolarHBondContact O-OG1 2.63Å
510	I	96.6	Very high	95.3	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-66.1	-29.8	-177.8	67	-177.7	0	0	0	112.6	W506 W507 T513 T514 V515 G516 Y517	W506-I510 HydrophobicContact CD2-CG2 4.14Å; W506-I510 HydrophobicContact CE3-CG2 4.15Å; W506-I510 HydrophobicContact CH2-CG2 4.02Å; W506-I510 HydrophobicContact CZ2-CG2 3.99Å; W506-I510 HydrophobicContact CZ3-CG2 4.09Å; W506-I510 WeakPolarHBondContact O-CG1 3.41Å; W506-I510 PolarHBondContact O-N 3.08Å; W506-I510 VanDerWaalsContact O-N 3.07Å; W507-I510 WeakPolarHBondContact O-CG1 3.31Å; I510-T513 WeakPolarHBondContact CA-OG1 3.28Å; I510-T513 PolarHBondContact O-OG1 3.12Å; I510-T514 PolarHBondContact O-N 3.43Å; I510-V515 HydrophobicContact CB-CB 4.43Å; I510-V515 PolarHBondContact O-N 2.82Å; I510-G516 PolarHBondContact O-N 3.01Å; I510-G516 VanDerWaalsContact O-N 3.07Å; I510-Y517 HydrophobicContact CD1-CD2 4.21Å; I510-Y517 HydrophobicContact CG2-CD2 4.05Å; I510-Y517 HydrophobicContact CG2-CE2 4.09Å
511	T	96.2	Very high	95.3	Very high	21 Å²	21	53.5 Å²	53.5	13%	0.129	30%	0.304	C	S	.	.	H	α-helix	trans	-74.3	-43.8	176.6	-59.3	0	0	0	0	111.1	W507 A508 I509 T513 T514 C534 C535	W507-T511 PolarHBondContact NE1-OG1 3Å; W507-T511 WeakPolarHBondContact O-CB 3.45Å; W507-T511 PolarHBondContact O-N 3.04Å; W507-T511 PolarHBondContact O-OG1 3.27Å; A508-T511 PolarHBondContact O-N 2.93Å; I509-T511 VanDerWaalsContact C-N 3.27Å; I509-T511 PolarHBondContact O-N 3.24Å; T511-T513 VanDerWaalsContact C-N 3.31Å; T511-T513 PolarHBondContact O-N 3.14Å; T511-T514 PolarHBondContact O-N 3Å; T511-C534 HydrophobicContact CG2-CB 4.47Å; T511-C535 HydrophobicContact CG2-CB 4.1Å
512	M	94.4	Very high	95.2	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.025	30%	0.299	C	S	.	.	H	α-helix	trans	-63.8	-36.8	176.4	-77	178	63.3	0	0	112.4	V475 V478 V479 A508 I509 T514 G538	V475-M512 HydrophobicContact CG1-CE 4.34Å; V475-M512 HydrophobicContact CG2-CE 4.44Å; V478-M512 HydrophobicContact CB-CE 3.75Å; V478-M512 HydrophobicContact CB-SD 4.02Å; V478-M512 HydrophobicContact CG1-CE 3.44Å; V478-M512 VanDerWaalsContact CG1-CE 3.44Å; V478-M512 HydrophobicContact CG1-CG 4.26Å; V478-M512 HydrophobicContact CG1-SD 3.43Å; V478-M512 WeakPolarHBondContact CG1-SD 3.47Å; V479-M512 HydrophobicContact CG2-SD 3.59Å; V479-M512 VanDerWaalsContact CG2-SD 3.59Å; A508-M512 VanDerWaalsContact O-CB 3.3Å; A508-M512 WeakPolarHBondContact O-CB 3.34Å; A508-M512 WeakPolarHBondContact O-CG 3.43Å; A508-M512 PolarHBondContact O-N 3.47Å; I509-M512 PolarHBondContact O-N 3.13Å; M512-T514 PolarHBondContact O-N 2.86Å; M512-G538 CarbonylContact O-C 3.54Å
513	T	93.5	Very high	95	Very high	66 Å²	66	53.4 Å²	53.4	41%	0.405	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	5.2	174.8	60	0	0	0	0	112.9	I509 I510 T511 V515	I509-T513 WeakPolarHBondContact O-CG2 3.44Å; I509-T513 PolarHBondContact O-N 3.38Å; I509-T513 PolarHBondContact O-OG1 2.63Å; I510-T513 WeakPolarHBondContact CA-OG1 3.28Å; I510-T513 PolarHBondContact O-OG1 3.12Å; T511-T513 VanDerWaalsContact C-N 3.31Å; T511-T513 PolarHBondContact O-N 3.14Å; T513-V515 PolarHBondContact O-N 2.88Å; T513-V515 VanDerWaalsContact O-N 3.11Å; T513-V515 WeakPolarHBondContact OG1-CG2 3.31Å
514	T	94.1	Very high	95.1	Very high	93 Å²	93	52.6 Å²	52.6	57%	0.571	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	19.9	-179.8	65.9	0	0	0	0	114.8	I510 T511 M512 V539	I510-T514 PolarHBondContact O-N 3.43Å; T511-T514 PolarHBondContact O-N 3Å; M512-T514 PolarHBondContact O-N 2.86Å; T514-V539 HydrophobicContact CG2-CG2 3.4Å; T514-V539 VanDerWaalsContact CG2-CG2 3.4Å
515	V	95.3	Very high	95	Very high	78 Å²	78	56.4 Å²	56.4	47%	0.473	32%	0.318	S	S	.	.			trans	-79.1	-54.8	179	175.2	0	0	0	0	110.1	I510 T513 Y517	I510-V515 HydrophobicContact CB-CB 4.43Å; I510-V515 PolarHBondContact O-N 2.82Å; T513-V515 PolarHBondContact O-N 2.88Å; T513-V515 VanDerWaalsContact O-N 3.11Å; T513-V515 WeakPolarHBondContact OG1-CG2 3.31Å; V515-Y517 HydrophobicContact CG1-CD1 4.24Å; V515-Y517 HydrophobicContact CG1-CD2 4.26Å; V515-Y517 HydrophobicContact CG1-CE1 3.89Å; V515-Y517 HydrophobicContact CG1-CE2 3.91Å; V515-Y517 HydrophobicContact CG1-CG 4.42Å
516	G	92.9	Very high	94.9	Very high	43 Å²	43	58.9 Å²	58.9	44%	0.443	33%	0.333	S	S	.	.			trans	51.3	66.2	172.4	0	0	0	0	0	115.8	I510 G518	I510-G516 PolarHBondContact O-N 3.01Å; I510-G516 VanDerWaalsContact O-N 3.07Å; G516-G518 PolarHBondContact O-N 3.06Å
517	Y	94.1	Very high	94.9	Very high	161 Å²	161	53.3 Å²	53.3	63%	0.631	31%	0.312	S	S	*	.			trans	-55.3	-26	178.9	-67.2	-63.7	0	0	0	114.6	W506 I510 V515	W506-Y517 HydrophobicContact CH2-CD2 4.09Å; W506-Y517 AromaticContact CH2-CE2 3.69Å; W506-Y517 HydrophobicContact CH2-CE2 3.69Å; W506-Y517 AromaticContact CZ2-CD2 3.56Å; W506-Y517 HydrophobicContact CZ2-CD2 3.56Å; W506-Y517 AromaticContact CZ2-CE2 3.66Å; W506-Y517 HydrophobicContact CZ2-CE2 3.66Å; I510-Y517 HydrophobicContact CD1-CD2 4.21Å; I510-Y517 HydrophobicContact CG2-CD2 4.05Å; I510-Y517 HydrophobicContact CG2-CE2 4.09Å; V515-Y517 HydrophobicContact CG1-CD1 4.24Å; V515-Y517 HydrophobicContact CG1-CD2 4.26Å; V515-Y517 HydrophobicContact CG1-CE1 3.89Å; V515-Y517 HydrophobicContact CG1-CE2 3.91Å; V515-Y517 HydrophobicContact CG1-CG 4.42Å
518	G	92.1	Very high	94.8	Very high	47 Å²	47	58.7 Å²	58.7	49%	0.485	34%	0.336	S	S	.	.	S	Bend	trans	82.8	11.3	179.3	0	0	0	0	0	114.3	G516	G516-G518 PolarHBondContact O-N 3.06Å
519	D	92.6	Very high	94.9	Very high	85 Å²	85	62.9 Å²	62.9	46%	0.455	36%	0.362	S	S	.	.	S	Bend	trans	-74.3	-29	174	61.1	-36.8	0	0	0	112.9	W506	W506-D519 PolarHBondContact NE1-OD2 3.35Å
520	I	93.8	Very high	94.9	Very high	25 Å²	25	59.8 Å²	59.8	13%	0.128	35%	0.346	C	S	.	.	S	Bend	trans	-126.6	126.2	170	-59.8	-175.8	0	0	0	107.5	E497 F498 W507	E497-I520 HydrophobicContact CB-CG2 4.22Å; F498-I520 HydrophobicContact CD2-CG2 4.39Å; F498-I520 HydrophobicContact CE1-CG2 4.12Å; F498-I520 HydrophobicContact CE2-CG2 3.79Å; F498-I520 HydrophobicContact CZ-CG2 3.64Å; W507-I520 HydrophobicContact CB-CB 4.15Å; W507-I520 HydrophobicContact CB-CG2 3.75Å; W507-I520 HydrophobicContact CG-CB 4.47Å; W507-I520 HydrophobicContact CG-CG2 3.92Å
521	T	94.3	Very high	94.9	Very high	61 Å²	61	59.9 Å²	59.9	37%	0.374	35%	0.349	S	S	.	.			trans	-144.6	140.2	178.7	58.5	0	0	0	0	112.3	N494 E497 K523	N494-T521 PolarHBondContact ND2-O 3.32Å; N494-T521 VanDerWaalsContact ND2-O 3.1Å; E497-T521 PolarHBondContact OE2-N 3.26Å; E497-T521 VanDerWaalsContact OE2-N 3.09Å; T521-K523 PolarHBondContact O-N 3Å
522	P	95	Very high	94.9	Very high	19 Å²	19	62.3 Å²	62.3	12%	0.123	37%	0.366	C	S	.	.			trans	-69.2	128	175.9	28.1	-33.4	0	0	0	110.7	E490 W507 K528	E490-P522 VanDerWaalsContact CD-CA 3.49Å; E490-P522 HydrophobicContact CG-CB 4.15Å; E490-P522 WeakPolarHBondContact OE1-CA 3.37Å; E490-P522 VanDerWaalsContact OE1-CB 3.31Å; E490-P522 WeakPolarHBondContact OE1-CB 3.47Å; W507-P522 HydrophobicContact CZ2-CG 4.05Å; P522-K528 HydrophobicContact CG-CG 4.3Å; P522-K528 WeakPolarHBondContact O-CE 3.14Å; P522-K528 WeakPolarHBondContact O-CG 3.2Å
523	K	93.7	Very high	95	Very high	109 Å²	109	66 Å²	66	47%	0.474	39%	0.385	S	S	.	.			trans	-94.6	-32.8	179.6	-68.6	175.4	-174	154.8	0	111.1	E490 N494 E497 T521	E490-K523 VanDerWaalsContact CD-N 3.31Å; E490-K523 PolarHBondContact OE1-N 2.93Å; E490-K523 VanDerWaalsContact OE1-N 3.12Å; E490-K523 PolarHBondContact OE2-N 3.37Å; N494-K523 HydrophobicContact CB-CD 4.34Å; N494-K523 PolarHBondContact OD1-NZ 2.84Å; E497-K523 WeakPolarHBondContact OE1-CE 3.38Å; E497-K523 IonicContact OE1-NZ 3.01Å; E497-K523 PolarHBondContact OE1-NZ 3.48Å; T521-K523 PolarHBondContact O-N 3Å
524	T	95.9	Very high	95.2	Very high	21 Å²	21	62.9 Å²	62.9	13%	0.129	37%	0.366	C	S	.	.	S	Bend	trans	-71.2	153.3	-179.4	73.4	0	0	0	0	111.5	E490 D493 L526 G527 K528	E490-T524 VanDerWaalsContact OE1-CB 3.27Å; E490-T524 WeakPolarHBondContact OE1-CB 3.35Å; E490-T524 WeakPolarHBondContact OE1-CG2 3.19Å; E490-T524 PolarHBondContact OE1-N 3.49Å; E490-T524 PolarHBondContact OE1-OG1 3.44Å; D493-T524 HydrophobicContact CB-CG2 3.72Å; D493-T524 WeakPolarHBondContact OD2-CG2 3.24Å; T524-L526 VanDerWaalsContact C-N 3.28Å; T524-L526 PolarHBondContact O-N 2.93Å; T524-G527 PolarHBondContact O-N 3.26Å; T524-G527 PolarHBondContact OG1-N 3.35Å; T524-K528 WeakPolarHBondContact O-CG 3.11Å; T524-K528 PolarHBondContact O-N 3.14Å
525	A	95.1	Very high	95.3	Very high	80 Å²	80	60.6 Å²	60.6	66%	0.661	35%	0.353	S	S	*	.	H	α-helix	trans	-60.8	-40.8	175.2	0	0	0	0	0	111.4	K528 V529	A525-K528 PolarHBondContact O-N 2.58Å; A525-V529 WeakPolarHBondContact O-CG2 3.46Å; A525-V529 PolarHBondContact O-N 3.28Å
526	L	95.6	Very high	95.3	Very high	110 Å²	110	62.1 Å²	62.1	58%	0.576	36%	0.358	S	S	*	.	H	α-helix	trans	-64.2	-47.3	178.5	-157.5	171.9	0	0	0	110.7	A489 T524 K528 V529 I530	A489-L526 HydrophobicContact CB-CD2 3.86Å; T524-L526 VanDerWaalsContact C-N 3.28Å; T524-L526 PolarHBondContact O-N 2.93Å; L526-K528 VanDerWaalsContact C-N 3.32Å; L526-K528 PolarHBondContact O-N 2.93Å; L526-V529 PolarHBondContact O-N 3.4Å; L526-I530 HydrophobicContact CD2-CD1 3.14Å; L526-I530 HydrophobicContact CD2-CG1 3.75Å; L526-I530 WeakPolarHBondContact O-CG1 3.14Å; L526-I530 PolarHBondContact O-N 3.12Å
527	G	96.1	Very high	95.5	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-59.8	-38.4	175.6	0	0	0	0	0	113.1	T524 I530 G531	T524-G527 PolarHBondContact O-N 3.26Å; T524-G527 PolarHBondContact OG1-N 3.35Å; G527-I530 PolarHBondContact O-N 2.89Å; G527-G531 PolarHBondContact O-N 3.46Å
528	K	96.6	Very high	95.6	Very high	121 Å²	121	54.3 Å²	54.3	53%	0.526	32%	0.32	S	S	.	.	H	α-helix	trans	-66.1	-38.8	175	-72.2	173.9	-177.6	175.3	0	112.8	P522 T524 A525 L526 G531 S532	P522-K528 HydrophobicContact CG-CG 4.3Å; P522-K528 WeakPolarHBondContact O-CE 3.14Å; P522-K528 WeakPolarHBondContact O-CG 3.2Å; T524-K528 WeakPolarHBondContact O-CG 3.11Å; T524-K528 PolarHBondContact O-N 3.14Å; A525-K528 PolarHBondContact O-N 2.58Å; L526-K528 VanDerWaalsContact C-N 3.32Å; L526-K528 PolarHBondContact O-N 2.93Å; K528-G531 PolarHBondContact O-N 3.29Å; K528-S532 WeakPolarHBondContact O-CB 2.9Å; K528-S532 PolarHBondContact O-N 3.3Å; K528-S532 PolarHBondContact O-OG 3.4Å
529	V	97.8	Very high	95.7	Very high	88 Å²	88	55.8 Å²	55.8	53%	0.533	32%	0.319	S	S	.	.	H	α-helix	trans	-64.1	-47.1	173	172.5	0	0	0	0	110.3	A525 L526 G531 S532 I533	A525-V529 WeakPolarHBondContact O-CG2 3.46Å; A525-V529 PolarHBondContact O-N 3.28Å; L526-V529 PolarHBondContact O-N 3.4Å; V529-G531 VanDerWaalsContact C-N 3.34Å; V529-G531 PolarHBondContact O-N 2.88Å; V529-S532 WeakPolarHBondContact O-CB 3.18Å; V529-S532 PolarHBondContact O-N 3.45Å; V529-I533 HydrophobicContact CG1-CD1 3.95Å; V529-I533 WeakPolarHBondContact O-CG1 3.31Å; V529-I533 PolarHBondContact O-N 2.88Å
530	I	97.7	Very high	95.7	Very high	15 Å²	15	56.5 Å²	56.5	8%	0.077	32%	0.322	C	S	.	.	H	α-helix	trans	-57.7	-47	175.1	-68.9	166.3	0	0	0	110.7	F482 L485 A486 A489 W507 L526 G527 S532 I533 C534	F482-I530 HydrophobicContact CD1-CG2 3.83Å; L485-I530 HydrophobicContact CB-CD1 3.9Å; L485-I530 HydrophobicContact CB-CG1 4.44Å; L485-I530 HydrophobicContact CB-CG2 4Å; A486-I530 HydrophobicContact CB-CG2 4.38Å; A489-I530 HydrophobicContact CB-CD1 3.67Å; W507-I530 HydrophobicContact CH2-CG2 4.49Å; L526-I530 HydrophobicContact CD2-CD1 3.14Å; L526-I530 HydrophobicContact CD2-CG1 3.75Å; L526-I530 WeakPolarHBondContact O-CG1 3.14Å; L526-I530 PolarHBondContact O-N 3.12Å; G527-I530 PolarHBondContact O-N 2.89Å; I530-S532 VanDerWaalsContact C-N 3.32Å; I530-S532 PolarHBondContact O-N 3.38Å; I530-I533 PolarHBondContact O-N 3.47Å; I530-C534 VanDerWaalsContact O-CB 3.23Å; I530-C534 WeakPolarHBondContact O-CB 3.23Å; I530-C534 PolarHBondContact O-N 3.1Å
531	G	96.5	Very high	95.6	Very high	10 Å²	10	56.7 Å²	56.7	10%	0.103	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-39.7	178.2	0	0	0	0	0	112.7	G527 K528 V529 C534 C535	G527-G531 PolarHBondContact O-N 3.46Å; K528-G531 PolarHBondContact O-N 3.29Å; V529-G531 VanDerWaalsContact C-N 3.34Å; V529-G531 PolarHBondContact O-N 2.88Å; G531-C534 WeakPolarHBondContact O-CB 3.32Å; G531-C534 PolarHBondContact O-N 3.07Å; G531-C535 WeakPolarHBondContact O-CB 3.43Å; G531-C535 PolarHBondContact O-N 3.44Å
532	S	95.7	Very high	95.3	Very high	72 Å²	72	55.9 Å²	55.9	50%	0.503	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-45.8	176.1	-56.9	0	0	0	0	111.5	K528 V529 I530 C535 I536	K528-S532 WeakPolarHBondContact O-CB 2.9Å; K528-S532 PolarHBondContact O-N 3.3Å; K528-S532 PolarHBondContact O-OG 3.4Å; V529-S532 WeakPolarHBondContact O-CB 3.18Å; V529-S532 PolarHBondContact O-N 3.45Å; I530-S532 VanDerWaalsContact C-N 3.32Å; I530-S532 PolarHBondContact O-N 3.38Å; S532-C535 PolarHBondContact O-N 3.09Å; S532-I536 WeakPolarHBondContact O-CG1 3.49Å; S532-I536 PolarHBondContact O-N 2.93Å
533	I	97.3	Very high	95.1	Very high	82 Å²	82	56.7 Å²	56.7	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-65.4	-42.2	176.3	-62.1	168.7	0	0	0	110.5	F482 V529 I530 C535 I536 C537	F482-I533 HydrophobicContact CE1-CB 4.22Å; F482-I533 HydrophobicContact CE1-CG2 3.86Å; F482-I533 HydrophobicContact CZ-CG2 3.77Å; V529-I533 HydrophobicContact CG1-CD1 3.95Å; V529-I533 WeakPolarHBondContact O-CG1 3.31Å; V529-I533 PolarHBondContact O-N 2.88Å; I530-I533 PolarHBondContact O-N 3.47Å; I533-C535 VanDerWaalsContact C-N 3.34Å; I533-C535 PolarHBondContact O-N 3.38Å; I533-I536 PolarHBondContact O-N 3.18Å; I533-C537 WeakPolarHBondContact O-CB 3.5Å; I533-C537 PolarHBondContact O-N 3.05Å; I533-C537 PolarHBondContact O-SG 3.08Å; I533-C537 VanDerWaalsContact O-SG 3.36Å
534	C	97.3	Very high	94.9	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-56.5	-46.7	176.7	-179.9	0	0	0	0	111.6	F482 T511 I530 G531 C537 G538	F482-C534 HydrophobicContact CB-CB 4.05Å; F482-C534 HydrophobicContact CD1-CB 3.65Å; F482-C534 HydrophobicContact CD2-CB 4.02Å; F482-C534 HydrophobicContact CE1-CB 4.08Å; F482-C534 HydrophobicContact CE2-CB 4.42Å; F482-C534 HydrophobicContact CG-CB 3.63Å; F482-C534 HydrophobicContact CZ-CB 4.45Å; T511-C534 HydrophobicContact CG2-CB 4.47Å; I530-C534 VanDerWaalsContact O-CB 3.23Å; I530-C534 WeakPolarHBondContact O-CB 3.23Å; I530-C534 PolarHBondContact O-N 3.1Å; G531-C534 WeakPolarHBondContact O-CB 3.32Å; G531-C534 PolarHBondContact O-N 3.07Å; C534-C537 PolarHBondContact O-N 3.17Å; C534-G538 PolarHBondContact O-N 3.17Å
535	C	96.3	Very high	94.3	Very high	45 Å²	45	57.2 Å²	57.2	30%	0.304	34%	0.338	S	S	.	.	H	α-helix	trans	-60.4	-48.6	177.9	-173.6	0	0	0	0	111.7	T511 G531 S532 I533 G538 V539	T511-C535 HydrophobicContact CG2-CB 4.1Å; G531-C535 WeakPolarHBondContact O-CB 3.43Å; G531-C535 PolarHBondContact O-N 3.44Å; S532-C535 PolarHBondContact O-N 3.09Å; I533-C535 VanDerWaalsContact C-N 3.34Å; I533-C535 PolarHBondContact O-N 3.38Å; C535-G538 PolarHBondContact O-N 3.18Å; C535-V539 WeakPolarHBondContact O-CG2 3.35Å; C535-V539 PolarHBondContact O-N 2.86Å
536	I	95.8	Very high	94	Very high	110 Å²	110	57.3 Å²	57.3	56%	0.564	33%	0.327	S	S	*	.	H	α-helix	trans	-61.8	-48.2	178.4	-65	168	0	0	0	110.9	S532 I533 G538 V539 L540	S532-I536 WeakPolarHBondContact O-CG1 3.49Å; S532-I536 PolarHBondContact O-N 2.93Å; I533-I536 PolarHBondContact O-N 3.18Å; I536-G538 VanDerWaalsContact C-N 3.32Å; I536-G538 PolarHBondContact O-N 3.42Å; I536-V539 PolarHBondContact O-N 3.07Å; I536-L540 HydrophobicContact CG2-CD1 4.23Å; I536-L540 WeakPolarHBondContact O-CG 3.35Å; I536-L540 PolarHBondContact O-N 2.92Å; I536-L540 VanDerWaalsContact O-N 3.11Å
537	C	95.8	Very high	93.8	Very high	41 Å²	41	55.8 Å²	55.8	28%	0.277	32%	0.324	S	S	.	.	H	α-helix	trans	-60.5	-41.5	177.4	-73.7	0	0	0	0	111.9	F482 I533 C534 L540 V541	F482-C537 HydrophobicContact CE2-CB 3.82Å; F482-C537 HydrophobicContact CZ-CB 4.14Å; I533-C537 WeakPolarHBondContact O-CB 3.5Å; I533-C537 PolarHBondContact O-N 3.05Å; I533-C537 PolarHBondContact O-SG 3.08Å; I533-C537 VanDerWaalsContact O-SG 3.36Å; C534-C537 PolarHBondContact O-N 3.17Å; C537-L540 PolarHBondContact O-N 3.26Å; C537-V541 WeakPolarHBondContact O-CB 3.43Å; C537-V541 VanDerWaalsContact O-CG2 3.24Å; C537-V541 WeakPolarHBondContact O-CG2 3.13Å; C537-V541 PolarHBondContact O-N 3.43Å
538	G	95.8	Very high	93.4	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.6	-47.6	177.6	0	0	0	0	0	112.7	M512 C534 C535 I536 L540 V541 V542	M512-G538 CarbonylContact O-C 3.54Å; C534-G538 PolarHBondContact O-N 3.17Å; C535-G538 PolarHBondContact O-N 3.18Å; I536-G538 VanDerWaalsContact C-N 3.32Å; I536-G538 PolarHBondContact O-N 3.42Å; G538-L540 VanDerWaalsContact C-N 3.33Å; G538-L540 PolarHBondContact O-N 2.87Å; G538-V541 PolarHBondContact O-N 3.23Å; G538-V542 WeakPolarHBondContact O-CB 3.3Å; G538-V542 WeakPolarHBondContact O-CG2 3.46Å; G538-V542 PolarHBondContact O-N 3.42Å
539	V	94.2	Very high	93	Very high	78 Å²	78	55 Å²	55	47%	0.473	33%	0.325	S	S	.	.	H	α-helix	trans	-59.3	-43.1	176.2	172.5	0	0	0	0	111.5	T514 C535 I536 G543	T514-V539 HydrophobicContact CG2-CG2 3.4Å; T514-V539 VanDerWaalsContact CG2-CG2 3.4Å; C535-V539 WeakPolarHBondContact O-CG2 3.35Å; C535-V539 PolarHBondContact O-N 2.86Å; I536-V539 PolarHBondContact O-N 3.07Å; V539-G543 WeakPolarHBondContact O-CA 3.24Å; V539-G543 PolarHBondContact O-N 3.48Å
540	L	93	Very high	92.7	Very high	100 Å²	100	54.9 Å²	54.9	52%	0.524	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-45.8	178.1	-68.5	173.6	0	0	0	112	I536 C537 G538 G543 L544	I536-L540 HydrophobicContact CG2-CD1 4.23Å; I536-L540 WeakPolarHBondContact O-CG 3.35Å; I536-L540 PolarHBondContact O-N 2.92Å; I536-L540 VanDerWaalsContact O-N 3.11Å; C537-L540 PolarHBondContact O-N 3.26Å; G538-L540 VanDerWaalsContact C-N 3.33Å; G538-L540 PolarHBondContact O-N 2.87Å; L540-G543 PolarHBondContact O-N 3.36Å; L540-L544 WeakPolarHBondContact O-CG 3.37Å; L540-L544 PolarHBondContact O-N 2.83Å; L540-L544 VanDerWaalsContact O-N 3.1Å
541	V	92.2	Very high	92.3	Very high	28 Å²	28	59.5 Å²	59.5	17%	0.17	35%	0.348	C	S	.	.	H	α-helix	trans	-66.4	-42.2	-177.4	167.6	0	0	0	0	111.9	L471 F474 V475 V478 C537 G538 P545	L471-V541 HydrophobicContact CD1-CG1 4.4Å; L471-V541 WeakPolarHBondContact CD1-O 3.36Å; F474-V541 HydrophobicContact CB-CG1 3.63Å; V475-V541 HydrophobicContact CG2-CG1 4.19Å; V478-V541 HydrophobicContact CG2-CG2 4.18Å; C537-V541 WeakPolarHBondContact O-CB 3.43Å; C537-V541 VanDerWaalsContact O-CG2 3.24Å; C537-V541 WeakPolarHBondContact O-CG2 3.13Å; C537-V541 PolarHBondContact O-N 3.43Å; G538-V541 PolarHBondContact O-N 3.23Å; V541-P545 WeakPolarHBondContact O-CD 3.45Å
542	V	88.3	Confident	91.8	Very high	44 Å²	44	61.8 Å²	61.8	27%	0.267	36%	0.358	S	S	.	.	H	α-helix	trans	-77	-36.9	178.2	175.2	0	0	0	0	110.9	V475 G538 P545 I546	V475-V542 HydrophobicContact CG2-CG2 4.45Å; G538-V542 WeakPolarHBondContact O-CB 3.3Å; G538-V542 WeakPolarHBondContact O-CG2 3.46Å; G538-V542 PolarHBondContact O-N 3.42Å; V542-P545 WeakPolarHBondContact O-CD 3.38Å; V542-I546 HydrophobicContact CG1-CD1 3.7Å; V542-I546 WeakPolarHBondContact O-CD1 3.47Å; V542-I546 VanDerWaalsContact O-CG1 3.23Å; V542-I546 WeakPolarHBondContact O-CG1 3.21Å
543	G	90.6	Very high	91.4	Very high	36 Å²	36	61 Å²	61	37%	0.371	35%	0.346	S	S	.	.	H	α-helix	trans	-70.5	-31.8	-176.5	0	0	0	0	0	114.8	V539 L540 P547	V539-G543 WeakPolarHBondContact O-CA 3.24Å; V539-G543 PolarHBondContact O-N 3.48Å; L540-G543 PolarHBondContact O-N 3.36Å; G543-P547 WeakPolarHBondContact O-CD 3.33Å
544	L	88.7	Confident	91.1	Very high	125 Å²	125	58.7 Å²	58.7	65%	0.654	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-41.9	-176.7	-71.2	169.5	0	0	0	114.1	L540	L540-L544 WeakPolarHBondContact O-CG 3.37Å; L540-L544 PolarHBondContact O-N 2.83Å; L540-L544 VanDerWaalsContact O-N 3.1Å
545	P	85	Confident	90.5	Very high	16 Å²	16	61.6 Å²	61.6	10%	0.104	36%	0.363	C	S	.	.	H	α-helix	trans	-81.2	-22.1	-179.3	-22.5	39.2	0	0	0	114.6	L471 V541 V542 I548 I549	L471-P545 HydrophobicContact CB-CB 4.26Å; L471-P545 HydrophobicContact CB-CG 4.11Å; L471-P545 HydrophobicContact CD1-CB 4.47Å; L471-P545 HydrophobicContact CD1-CG 3.89Å; L471-P545 HydrophobicContact CD2-CB 4.37Å; L471-P545 HydrophobicContact CG-CG 4.41Å; V541-P545 WeakPolarHBondContact O-CD 3.45Å; V542-P545 WeakPolarHBondContact O-CD 3.38Å; P545-I548 WeakPolarHBondContact O-CB 3.38Å; P545-I548 PolarHBondContact O-N 2.88Å; P545-I548 VanDerWaalsContact O-N 3.15Å; P545-I549 WeakPolarHBondContact O-CG1 3.46Å; P545-I549 PolarHBondContact O-N 3.49Å; P545-I549 VanDerWaalsContact O-N 3.07Å
546	I	88.5	Confident	89.9	Confident	83 Å²	83	61.8 Å²	61.8	43%	0.426	36%	0.359	S	S	.	.	H	α-helix	trans	-56.8	-50	-178.7	-72.4	167.6	0	0	0	111.7	V542 I548 I549 V550	V542-I546 HydrophobicContact CG1-CD1 3.7Å; V542-I546 WeakPolarHBondContact O-CD1 3.47Å; V542-I546 VanDerWaalsContact O-CG1 3.23Å; V542-I546 WeakPolarHBondContact O-CG1 3.21Å; I546-I548 VanDerWaalsContact C-N 3.27Å; I546-I548 PolarHBondContact O-N 2.78Å; I546-I549 PolarHBondContact O-N 3.09Å; I546-V550 HydrophobicContact CG2-CG2 4.11Å; I546-V550 WeakPolarHBondContact O-CB 3.39Å; I546-V550 VanDerWaalsContact O-CG2 3.28Å; I546-V550 WeakPolarHBondContact O-CG2 3.16Å; I546-V550 PolarHBondContact O-N 2.61Å
547	P	90.7	Very high	89.5	Confident	78 Å²	78	61 Å²	61	51%	0.506	35%	0.349	S	S	.	.	H	α-helix	trans	-58.3	-35.4	176.4	-27.4	34.9	0	0	0	114	G543 V550 N551	G543-P547 WeakPolarHBondContact O-CD 3.33Å; P547-V550 PolarHBondContact O-N 3.3Å; P547-N551 VanDerWaalsContact O-CB 3.27Å; P547-N551 WeakPolarHBondContact O-CB 3.21Å; P547-N551 PolarHBondContact O-N 3.28Å
548	I	88.4	Confident	89.1	Confident	75 Å²	75	64.7 Å²	64.7	39%	0.385	36%	0.362	S	S	.	.	H	α-helix	trans	-64.3	-48.5	177.5	-59.2	175.2	0	0	0	109.6	E467 P545 I546 V550 N551 N552	E467-I548 HydrophobicContact CG-CG2 4.25Å; P545-I548 WeakPolarHBondContact O-CB 3.38Å; P545-I548 PolarHBondContact O-N 2.88Å; P545-I548 VanDerWaalsContact O-N 3.15Å; I546-I548 VanDerWaalsContact C-N 3.27Å; I546-I548 PolarHBondContact O-N 2.78Å; I548-V550 PolarHBondContact O-N 3.02Å; I548-N551 PolarHBondContact O-N 3.28Å; I548-N552 VanDerWaalsContact O-CG 3.29Å; I548-N552 PolarHBondContact O-N 3.13Å
549	I	87.7	Confident	88.5	Confident	30 Å²	30	66.3 Å²	66.3	15%	0.154	37%	0.371	C	S	.	.	H	α-helix	trans	-63.9	-42	178.5	-62.9	163.7	0	0	0	110.7	L468 P545 I546 N552 F553	L468-I549 HydrophobicContact CD2-CD1 3.54Å; L468-I549 HydrophobicContact CG-CD1 4.17Å; P545-I549 WeakPolarHBondContact O-CG1 3.46Å; P545-I549 PolarHBondContact O-N 3.49Å; P545-I549 VanDerWaalsContact O-N 3.07Å; I546-I549 PolarHBondContact O-N 3.09Å; I549-N552 PolarHBondContact O-N 2.96Å; I549-F553 WeakPolarHBondContact O-CB 3.37Å; I549-F553 PolarHBondContact O-N 3.44Å
550	V	90.3	Very high	87.9	Confident	84 Å²	84	66 Å²	66	51%	0.509	36%	0.364	S	S	.	.	H	α-helix	trans	-65.1	-41.6	178	171.5	0	0	0	0	111.4	I546 P547 I548 F553 A554	I546-V550 HydrophobicContact CG2-CG2 4.11Å; I546-V550 WeakPolarHBondContact O-CB 3.39Å; I546-V550 VanDerWaalsContact O-CG2 3.28Å; I546-V550 WeakPolarHBondContact O-CG2 3.16Å; I546-V550 PolarHBondContact O-N 2.61Å; P547-V550 PolarHBondContact O-N 3.3Å; I548-V550 PolarHBondContact O-N 3.02Å; V550-F553 WeakPolarHBondContact O-CB 3.39Å; V550-F553 PolarHBondContact O-N 3.37Å; V550-A554 WeakPolarHBondContact O-CB 3.5Å; V550-A554 PolarHBondContact O-N 3.28Å
551	N	89.7	Confident	87.6	Confident	113 Å²	113	64.6 Å²	64.6	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-65.8	-41.2	177	-171.1	41.1	0	0	0	111.4	P547 I548 F553 A554 A555	P547-N551 VanDerWaalsContact O-CB 3.27Å; P547-N551 WeakPolarHBondContact O-CB 3.21Å; P547-N551 PolarHBondContact O-N 3.28Å; I548-N551 PolarHBondContact O-N 3.28Å; N551-F553 VanDerWaalsContact C-N 3.33Å; N551-F553 PolarHBondContact O-N 2.97Å; N551-A554 PolarHBondContact O-N 2.97Å; N551-A555 WeakPolarHBondContact O-CB 3.32Å; N551-A555 PolarHBondContact O-N 3.2Å
552	N	86.7	Confident	87.2	Confident	57 Å²	57	69.1 Å²	69.1	31%	0.305	37%	0.37	S	S	.	.	H	α-helix	trans	-62.5	-40.7	173.5	-71.3	-15.6	0	0	0	111.7	T460 S464 I548 I549 F556	T460-N552 HydrophobicContact CG2-CB 4.01Å; S464-N552 PolarHBondContact OG-ND2 3.49Å; S464-N552 VanDerWaalsContact OG-ND2 3.12Å; I548-N552 VanDerWaalsContact O-CG 3.29Å; I548-N552 PolarHBondContact O-N 3.13Å; I549-N552 PolarHBondContact O-N 2.96Å; N552-F556 WeakPolarHBondContact O-CB 3.19Å; N552-F556 PolarHBondContact O-N 3.35Å
553	F	88.2	Confident	86.9	Confident	56 Å²	56	69 Å²	69	25%	0.246	37%	0.365	C	S	.	.	H	α-helix	trans	-62.4	-48.4	174.8	178.1	-106.3	0	0	0	111.2	A456 L457 T460 I549 V550 N551 A555 F556 Y557	A456-F553 HydrophobicContact CB-CE2 3.82Å; L457-F553 HydrophobicContact CB-CE2 4.43Å; L457-F553 HydrophobicContact CD2-CD2 3.64Å; L457-F553 HydrophobicContact CD2-CE2 3.5Å; L457-F553 HydrophobicContact CD2-CG 4.31Å; L457-F553 HydrophobicContact CD2-CZ 4.08Å; L457-F553 HydrophobicContact CG-CD2 4.2Å; L457-F553 HydrophobicContact CG-CE2 3.64Å; L457-F553 HydrophobicContact CG-CZ 4.25Å; T460-F553 HydrophobicContact CG2-CB 3.88Å; I549-F553 WeakPolarHBondContact O-CB 3.37Å; I549-F553 PolarHBondContact O-N 3.44Å; V550-F553 WeakPolarHBondContact O-CB 3.39Å; V550-F553 PolarHBondContact O-N 3.37Å; N551-F553 VanDerWaalsContact C-N 3.33Å; N551-F553 PolarHBondContact O-N 2.97Å; F553-A555 VanDerWaalsContact C-N 3.33Å; F553-A555 PolarHBondContact O-N 3.01Å; F553-F556 PolarHBondContact O-N 2.78Å; F553-Y557 HydrophobicContact CZ-CD2 4.23Å; F553-Y557 HydrophobicContact CZ-CG 4.44Å; F553-Y557 WeakPolarHBondContact O-CB 3.37Å; F553-Y557 PolarHBondContact O-N 3.34Å
554	A	89.1	Confident	86.5	Confident	34 Å²	34	69.7 Å²	69.7	28%	0.281	36%	0.358	S	S	.	.	H	α-helix	trans	-60.2	-44.8	-179.9	0	0	0	0	0	111.1	V550 N551 Y557 H558	V550-A554 WeakPolarHBondContact O-CB 3.5Å; V550-A554 PolarHBondContact O-N 3.28Å; N551-A554 PolarHBondContact O-N 2.97Å; A554-Y557 PolarHBondContact O-N 2.97Å; A554-H558 WeakPolarHBondContact O-CB 3.38Å; A554-H558 PolarHBondContact O-CD2 3.28Å; A554-H558 PolarHBondContact O-N 2.85Å
555	A	85.6	Confident	86.3	Confident	60 Å²	60	69.1 Å²	69.1	50%	0.496	35%	0.35	S	S	.	.	H	α-helix	trans	-59.5	-49.2	175.9	0	0	0	0	0	111.9	N551 F553 D559	N551-A555 WeakPolarHBondContact O-CB 3.32Å; N551-A555 PolarHBondContact O-N 3.2Å; F553-A555 VanDerWaalsContact C-N 3.33Å; F553-A555 PolarHBondContact O-N 3.01Å; A555-D559 WeakPolarHBondContact O-CB 3.27Å; A555-D559 PolarHBondContact O-N 2.81Å
556	F	84.1	Confident	86.2	Confident	50 Å²	50	71.3 Å²	71.3	22%	0.219	36%	0.363	C	S	.	.	H	α-helix	trans	-65.5	-43.3	179	-173.5	-89.5	0	0	0	112.1	A456 Y459 N552 F553 D559 Q560	A456-F556 HydrophobicContact CB-CD1 3.73Å; A456-F556 HydrophobicContact CB-CE1 3.88Å; Y459-F556 AromaticContact CD2-CE1 3.89Å; Y459-F556 HydrophobicContact CD2-CE1 3.89Å; Y459-F556 AromaticContact CD2-CZ 3.6Å; Y459-F556 HydrophobicContact CD2-CZ 3.6Å; Y459-F556 HydrophobicContact CG-CE1 4.14Å; Y459-F556 HydrophobicContact CG-CE2 4.31Å; Y459-F556 AromaticContact CG-CZ 3.59Å; Y459-F556 HydrophobicContact CG-CZ 3.59Å; N552-F556 WeakPolarHBondContact O-CB 3.19Å; N552-F556 PolarHBondContact O-N 3.35Å; F553-F556 PolarHBondContact O-N 2.78Å; F556-D559 PolarHBondContact O-N 3.29Å; F556-Q560 HydrophobicContact CD1-CG 3.84Å; F556-Q560 HydrophobicContact CE1-CG 3.44Å; F556-Q560 VanDerWaalsContact CE1-CG 3.44Å; F556-Q560 HydrophobicContact CZ-CG 3.95Å; F556-Q560 WeakPolarHBondContact O-CG 3.48Å; F556-Q560 PolarHBondContact O-N 2.8Å
557	Y	87.2	Confident	85.8	Confident	94 Å²	94	71.9 Å²	71.9	37%	0.369	37%	0.367	S	S	.	.	H	α-helix	trans	-62.6	-44.9	179.3	-178.1	-101.2	0	0	0	111.7	A456 F553 A554 Q560 M561	A456-Y557 HydrophobicContact CB-CD2 4.44Å; F553-Y557 HydrophobicContact CZ-CD2 4.23Å; F553-Y557 HydrophobicContact CZ-CG 4.44Å; F553-Y557 WeakPolarHBondContact O-CB 3.37Å; F553-Y557 PolarHBondContact O-N 3.34Å; A554-Y557 PolarHBondContact O-N 2.97Å; Y557-Q560 PolarHBondContact O-N 3.04Å; Y557-M561 WeakPolarHBondContact O-CB 3.32Å; Y557-M561 PolarHBondContact O-N 3.02Å
558	H	87.1	Confident	85.4	Confident	118 Å²	118	73.7 Å²	73.7	55%	0.546	37%	0.367	S	S	.	.	H	α-helix	trans	-67.1	-36.1	176.5	-73.6	-50.5	0	0	0	113	A554 M561 R562	A554-H558 WeakPolarHBondContact O-CB 3.38Å; A554-H558 PolarHBondContact O-CD2 3.28Å; A554-H558 PolarHBondContact O-N 2.85Å; H558-M561 PolarHBondContact O-N 3.39Å; H558-R562 VanDerWaalsContact O-CB 3.29Å; H558-R562 WeakPolarHBondContact O-CB 3.27Å; H558-R562 PolarHBondContact O-N 3.4Å
559	D	82.8	Confident	85.2	Confident	33 Å²	33	79.2 Å²	79.2	18%	0.176	38%	0.383	C	S	.	.	H	α-helix	trans	-64.3	-45.4	173.7	-177.3	35	0	0	0	111.1	A555 F556 M561 R562 R563	A555-D559 WeakPolarHBondContact O-CB 3.27Å; A555-D559 PolarHBondContact O-N 2.81Å; F556-D559 PolarHBondContact O-N 3.29Å; D559-M561 PolarHBondContact O-N 2.87Å; D559-R562 PolarHBondContact O-N 2.71Å; D559-R563 VanDerWaalsContact CG-NE 3.35Å; D559-R563 WeakPolarHBondContact O-CB 3.49Å; D559-R563 VanDerWaalsContact O-CG 3.25Å; D559-R563 WeakPolarHBondContact O-CG 3.29Å; D559-R563 PolarHBondContact O-N 2.99Å; D559-R563 IonicContact OD1-CZ 3.41Å; D559-R563 IonicContact OD1-NE 3.58Å; D559-R563 PolarHBondContact OD1-NE 3.47Å; D559-R563 IonicContact OD1-NH2 3.6Å; D559-R563 IonicContact OD2-CZ 2.66Å; D559-R563 IonicContact OD2-NE 2.71Å; D559-R563 PolarHBondContact OD2-NE 3.1Å; D559-R563 IonicContact OD2-NH1 2.63Å; D559-R563 IonicContact OD2-NH2 2.72Å; D559-R563 PolarHBondContact OD2-NH2 3.26Å
560	Q	83.1	Confident	84.8	Confident	71 Å²	71	82.8 Å²	82.8	33%	0.332	40%	0.399	S	S	.	.	H	α-helix	trans	-59.3	-47.1	174.1	-71.6	-66.6	-10.1	0	0	112.2	F556 Y557 R562 R563 E564	F556-Q560 HydrophobicContact CD1-CG 3.84Å; F556-Q560 HydrophobicContact CE1-CG 3.44Å; F556-Q560 VanDerWaalsContact CE1-CG 3.44Å; F556-Q560 HydrophobicContact CZ-CG 3.95Å; F556-Q560 WeakPolarHBondContact O-CG 3.48Å; F556-Q560 PolarHBondContact O-N 2.8Å; Y557-Q560 PolarHBondContact O-N 3.04Å; Q560-R562 VanDerWaalsContact C-N 3.32Å; Q560-R562 PolarHBondContact O-N 2.73Å; Q560-R563 PolarHBondContact O-N 3.46Å; Q560-E564 PolarHBondContact O-N 2.84Å
561	M	85.4	Confident	84.3	Confident	72 Å²	72	84 Å²	84	36%	0.355	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-37.1	177.8	-175.2	59.3	146.8	0	0	112.2	Y557 H558 D559 K565	Y557-M561 WeakPolarHBondContact O-CB 3.32Å; Y557-M561 PolarHBondContact O-N 3.02Å; H558-M561 PolarHBondContact O-N 3.39Å; D559-M561 PolarHBondContact O-N 2.87Å; M561-K565 VanDerWaalsContact O-CG 3.3Å; M561-K565 WeakPolarHBondContact O-CG 3.3Å; M561-K565 PolarHBondContact O-N 3.04Å; M561-K565 VanDerWaalsContact O-N 3.16Å
562	R	84.6	Confident	83.9	Confident	123 Å²	123	81.5 Å²	81.5	46%	0.464	39%	0.394	S	S	.	.	H	α-helix	trans	-65.3	-45.4	174.9	-170.9	-171	-55.1	178.4	6.5	110.7	E273 H558 D559 Q560 K565 V566	E273-R562 IonicContact OE1-NH1 2.65Å; E273-R562 PolarHBondContact OE1-NH1 3.06Å; E273-R562 IonicContact OE2-NH1 2.71Å; H558-R562 VanDerWaalsContact O-CB 3.29Å; H558-R562 WeakPolarHBondContact O-CB 3.27Å; H558-R562 PolarHBondContact O-N 3.4Å; D559-R562 PolarHBondContact O-N 2.71Å; Q560-R562 VanDerWaalsContact C-N 3.32Å; Q560-R562 PolarHBondContact O-N 2.73Å; R562-K565 PolarHBondContact O-N 3.2Å; R562-V566 WeakPolarHBondContact O-CG2 3.4Å; R562-V566 PolarHBondContact O-N 3.13Å
563	R	81.5	Confident	83.5	Confident	42 Å²	42	84.4 Å²	84.4	16%	0.158	41%	0.405	C	S	.	.	H	α-helix	trans	-61.5	-45.4	178.3	-71.6	169.5	-173.1	-170.2	-4.6	111.8	D559 Q560 K565 V566 L567	D559-R563 VanDerWaalsContact CG-NE 3.35Å; D559-R563 WeakPolarHBondContact O-CB 3.49Å; D559-R563 VanDerWaalsContact O-CG 3.25Å; D559-R563 WeakPolarHBondContact O-CG 3.29Å; D559-R563 PolarHBondContact O-N 2.99Å; D559-R563 IonicContact OD1-CZ 3.41Å; D559-R563 IonicContact OD1-NE 3.58Å; D559-R563 PolarHBondContact OD1-NE 3.47Å; D559-R563 IonicContact OD1-NH2 3.6Å; D559-R563 IonicContact OD2-CZ 2.66Å; D559-R563 IonicContact OD2-NE 2.71Å; D559-R563 PolarHBondContact OD2-NE 3.1Å; D559-R563 IonicContact OD2-NH1 2.63Å; D559-R563 IonicContact OD2-NH2 2.72Å; D559-R563 PolarHBondContact OD2-NH2 3.26Å; Q560-R563 PolarHBondContact O-N 3.46Å; R563-K565 VanDerWaalsContact C-N 3.31Å; R563-K565 PolarHBondContact O-N 3.31Å; R563-V566 PolarHBondContact O-N 3.13Å; R563-V566 VanDerWaalsContact O-N 3.12Å; R563-L567 WeakPolarHBondContact O-CG 2.98Å; R563-L567 PolarHBondContact O-N 2.86Å
564	E	82.2	Confident	83	Confident	50 Å²	50	85.9 Å²	85.9	23%	0.234	42%	0.416	C	S	.	.	H	α-helix	trans	-60	-42.5	176.3	-173.6	-179	163.7	0	0	111.8	Q452 Q560 V566 L567 K568	Q452-E564 PolarHBondContact NE2-OE2 2.67Å; Q452-E564 PolarHBondContact OE1-OE2 3.39Å; Q560-E564 PolarHBondContact O-N 2.84Å; E564-V566 VanDerWaalsContact C-N 3.33Å; E564-V566 PolarHBondContact O-N 3.3Å; E564-L567 PolarHBondContact O-N 3.22Å; E564-K568 HydrophobicContact CG-CD 4.41Å; E564-K568 WeakPolarHBondContact O-CG 3.43Å; E564-K568 PolarHBondContact O-N 3.36Å; E564-K568 WeakPolarHBondContact OE1-CE 3.31Å; E564-K568 IonicContact OE1-NZ 2.69Å; E564-K568 PolarHBondContact OE1-NZ 2.71Å
565	K	85.5	Confident	82.4	Confident	112 Å²	112	91 Å²	91	49%	0.487	43%	0.433	S	S	.	.	H	α-helix	trans	-63.9	-37.1	175.3	-72	174	-177.3	-179.6	0	112.4	M561 R562 R563 R569	M561-K565 VanDerWaalsContact O-CG 3.3Å; M561-K565 WeakPolarHBondContact O-CG 3.3Å; M561-K565 PolarHBondContact O-N 3.04Å; M561-K565 VanDerWaalsContact O-N 3.16Å; R562-K565 PolarHBondContact O-N 3.2Å; R563-K565 VanDerWaalsContact C-N 3.31Å; R563-K565 PolarHBondContact O-N 3.31Å; K565-R569 VanDerWaalsContact O-CG 3.26Å; K565-R569 WeakPolarHBondContact O-CG 3.42Å; K565-R569 PolarHBondContact O-N 3.37Å; K565-R569 VanDerWaalsContact O-N 3.14Å
566	V	82.8	Confident	82.1	Confident	63 Å²	63	90 Å²	90	38%	0.382	43%	0.43	S	S	.	.	H	α-helix	trans	-67.7	-45.7	176.4	170.2	0	0	0	0	110.7	R562 R563 E564 K568 R569 Q570	R562-V566 WeakPolarHBondContact O-CG2 3.4Å; R562-V566 PolarHBondContact O-N 3.13Å; R563-V566 PolarHBondContact O-N 3.13Å; R563-V566 VanDerWaalsContact O-N 3.12Å; E564-V566 VanDerWaalsContact C-N 3.33Å; E564-V566 PolarHBondContact O-N 3.3Å; V566-K568 PolarHBondContact O-N 2.81Å; V566-R569 WeakPolarHBondContact O-CB 3.48Å; V566-R569 PolarHBondContact O-N 2.64Å; V566-R569 VanDerWaalsContact O-N 3.15Å; V566-Q570 HydrophobicContact CG1-CG 4.34Å; V566-Q570 WeakPolarHBondContact O-CG 3.49Å; V566-Q570 PolarHBondContact O-N 3.23Å
567	L	79.1	Confident	81.8	Confident	95 Å²	95	90.4 Å²	90.4	50%	0.497	44%	0.438	S	S	.	.	H	α-helix	trans	-59.8	-46.9	177.5	-69.2	173.8	0	0	0	111.4	R563 E564 R569 Q570 E571	R563-L567 WeakPolarHBondContact O-CG 2.98Å; R563-L567 PolarHBondContact O-N 2.86Å; E564-L567 PolarHBondContact O-N 3.22Å; L567-R569 VanDerWaalsContact C-N 3.27Å; L567-R569 PolarHBondContact O-N 3.11Å; L567-Q570 WeakPolarHBondContact O-CB 3.4Å; L567-Q570 PolarHBondContact O-N 3.5Å; L567-Q570 VanDerWaalsContact O-N 3.09Å; L567-E571 WeakPolarHBondContact O-CG 3.28Å; L567-E571 PolarHBondContact O-N 3.17Å
568	K	82.3	Confident	81.1	Confident	115 Å²	115	92.3 Å²	92.3	50%	0.5	45%	0.45	S	S	.	.	H	α-helix	trans	-60	-35.9	175.5	-72.2	177.7	-176.4	171.3	0	113.1	E564 V566 A572	E564-K568 HydrophobicContact CG-CD 4.41Å; E564-K568 WeakPolarHBondContact O-CG 3.43Å; E564-K568 PolarHBondContact O-N 3.36Å; E564-K568 WeakPolarHBondContact OE1-CE 3.31Å; E564-K568 IonicContact OE1-NZ 2.69Å; E564-K568 PolarHBondContact OE1-NZ 2.71Å; V566-K568 PolarHBondContact O-N 2.81Å; K568-A572 WeakPolarHBondContact O-CB 3.41Å; K568-A572 PolarHBondContact O-N 3.05Å; K568-A572 VanDerWaalsContact O-N 3.08Å
569	R	83.6	Confident	80.3	Confident	192 Å²	192	91.9 Å²	91.9	73%	0.725	45%	0.451	S	S	*	.	H	α-helix	trans	-71.3	-37.5	175.4	-75.3	173.7	178.6	-173.4	-0.6	112.1	K565 V566 L567 H573	K565-R569 VanDerWaalsContact O-CG 3.26Å; K565-R569 WeakPolarHBondContact O-CG 3.42Å; K565-R569 PolarHBondContact O-N 3.37Å; K565-R569 VanDerWaalsContact O-N 3.14Å; V566-R569 WeakPolarHBondContact O-CB 3.48Å; V566-R569 PolarHBondContact O-N 2.64Å; V566-R569 VanDerWaalsContact O-N 3.15Å; L567-R569 VanDerWaalsContact C-N 3.27Å; L567-R569 PolarHBondContact O-N 3.11Å; R569-H573 VanDerWaalsContact O-CB 3.25Å; R569-H573 WeakPolarHBondContact O-CB 3.49Å; R569-H573 PolarHBondContact O-N 2.65Å
570	Q	79.9	Confident	79.7	Confident	104 Å²	104	92 Å²	92	49%	0.486	46%	0.461	S	S	.	.	H	α-helix	trans	-66.1	-46.5	175.3	-74.5	175.5	-14.8	0	0	110.8	V566 L567 A572 H573 D574	V566-Q570 HydrophobicContact CG1-CG 4.34Å; V566-Q570 WeakPolarHBondContact O-CG 3.49Å; V566-Q570 PolarHBondContact O-N 3.23Å; L567-Q570 WeakPolarHBondContact O-CB 3.4Å; L567-Q570 PolarHBondContact O-N 3.5Å; L567-Q570 VanDerWaalsContact O-N 3.09Å; Q570-A572 PolarHBondContact O-N 3.43Å; Q570-H573 PolarHBondContact O-N 3.33Å; Q570-D574 WeakPolarHBondContact O-CB 3.32Å; Q570-D574 VanDerWaalsContact O-CG 3.29Å; Q570-D574 PolarHBondContact O-N 3.26Å
571	E	79.3	Confident	79.1	Confident	111 Å²	111	93.9 Å²	93.9	52%	0.519	47%	0.473	S	S	.	.	H	α-helix	trans	-56.9	-49.3	174.8	-70.7	170.3	171.7	0	0	111.2	L567 H573 D574 E575	L567-E571 WeakPolarHBondContact O-CG 3.28Å; L567-E571 PolarHBondContact O-N 3.17Å; E571-H573 VanDerWaalsContact C-N 3.32Å; E571-H573 PolarHBondContact O-N 2.9Å; E571-D574 PolarHBondContact O-N 3.41Å; E571-E575 WeakPolarHBondContact O-CB 3.47Å; E571-E575 WeakPolarHBondContact O-CG 3.44Å; E571-E575 PolarHBondContact O-N 2.97Å
572	A	81.7	Confident	78.2	Confident	59 Å²	59	93.5 Å²	93.5	49%	0.488	48%	0.475	S	S	.	.	H	α-helix	trans	-63	-36.9	177.3	0	0	0	0	0	113.1	K568 Q570 G576	K568-A572 WeakPolarHBondContact O-CB 3.41Å; K568-A572 PolarHBondContact O-N 3.05Å; K568-A572 VanDerWaalsContact O-N 3.08Å; Q570-A572 PolarHBondContact O-N 3.43Å; A572-G576 PolarHBondContact O-N 2.7Å
573	H	78.4	Confident	77.5	Confident	119 Å²	119	91.6 Å²	91.6	55%	0.551	47%	0.474	S	S	*	.	H	α-helix	trans	-67.6	-44	175.9	177.4	-87.7	0	0	0	111.5	R569 Q570 E571 G576 C577	R569-H573 VanDerWaalsContact O-CB 3.25Å; R569-H573 WeakPolarHBondContact O-CB 3.49Å; R569-H573 PolarHBondContact O-N 2.65Å; Q570-H573 PolarHBondContact O-N 3.33Å; E571-H573 VanDerWaalsContact C-N 3.32Å; E571-H573 PolarHBondContact O-N 2.9Å; H573-G576 CarbonylContact O-C 3.46Å; H573-G576 PolarHBondContact O-N 3.49Å; H573-C577 PolarHBondContact CE1-SG 3.22Å; H573-C577 PolarHBondContact O-N 2.94Å; H573-C577 PolarHBondContact O-SG 3.45Å
574	D	78	Confident	77	Confident	87 Å²	87	96.3 Å²	96.3	47%	0.465	50%	0.496	S	S	.	.	H	α-helix	trans	-68.1	-39.6	-179.6	-71.2	-12.9	0	0	0	111.7	Q570 E571 G576 C577 Q578	Q570-D574 WeakPolarHBondContact O-CB 3.32Å; Q570-D574 VanDerWaalsContact O-CG 3.29Å; Q570-D574 PolarHBondContact O-N 3.26Å; E571-D574 PolarHBondContact O-N 3.41Å; D574-G576 VanDerWaalsContact C-N 3.32Å; D574-G576 PolarHBondContact O-N 3.43Å; D574-C577 PolarHBondContact O-N 3.32Å; D574-Q578 WeakPolarHBondContact O-CB 3.46Å; D574-Q578 VanDerWaalsContact O-CG 3.26Å; D574-Q578 WeakPolarHBondContact O-CG 3.5Å; D574-Q578 PolarHBondContact O-N 2.88Å
575	E	77.1	Confident	76.2	Confident	140 Å²	140	98.9 Å²	98.9	65%	0.654	51%	0.511	S	S	*	.	H	α-helix	trans	-59.1	-44.3	169.9	-74.1	-178.6	173	0	0	111.3	E571 Q578 L579	E571-E575 WeakPolarHBondContact O-CB 3.47Å; E571-E575 WeakPolarHBondContact O-CG 3.44Å; E571-E575 PolarHBondContact O-N 2.97Å; E575-Q578 PolarHBondContact O-N 2.97Å; E575-L579 WeakPolarHBondContact O-CB 3.5Å; E575-L579 PolarHBondContact O-N 3.23Å
576	G	77.7	Confident	75.6	Confident	41 Å²	41	99.9 Å²	99.9	42%	0.423	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-45	175.2	0	0	0	0	0	113	A572 H573 D574 L579 G580	A572-G576 PolarHBondContact O-N 2.7Å; H573-G576 CarbonylContact O-C 3.46Å; H573-G576 PolarHBondContact O-N 3.49Å; D574-G576 VanDerWaalsContact C-N 3.32Å; D574-G576 PolarHBondContact O-N 3.43Å; G576-L579 PolarHBondContact O-N 3.41Å; G576-G580 PolarHBondContact O-N 2.83Å
577	C	77.9	Confident	74.8	Confident	57 Å²	57	103.8 Å²	103.8	39%	0.385	53%	0.527	S	S	.	.	H	α-helix	trans	-65.2	-40.2	176.5	-76.3	0	0	0	0	112.3	H573 D574 G580 N581	H573-C577 PolarHBondContact CE1-SG 3.22Å; H573-C577 PolarHBondContact O-N 2.94Å; H573-C577 PolarHBondContact O-SG 3.45Å; D574-C577 PolarHBondContact O-N 3.32Å; C577-G580 PolarHBondContact O-N 3.31Å; C577-N581 WeakPolarHBondContact O-CB 3.5Å; C577-N581 PolarHBondContact O-N 2.95Å
578	Q	73.1	Confident	74.4	Confident	134 Å²	134	101.4 Å²	101.4	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-67.1	-42.4	176.3	-72.9	-179.2	30.2	0	0	111.7	D574 E575 G580 N581 T582	D574-Q578 WeakPolarHBondContact O-CB 3.46Å; D574-Q578 VanDerWaalsContact O-CG 3.26Å; D574-Q578 WeakPolarHBondContact O-CG 3.5Å; D574-Q578 PolarHBondContact O-N 2.88Å; E575-Q578 PolarHBondContact O-N 2.97Å; Q578-G580 VanDerWaalsContact C-N 3.34Å; Q578-N581 PolarHBondContact O-N 3.15Å; Q578-T582 WeakPolarHBondContact O-CB 3.43Å; Q578-T582 VanDerWaalsContact O-CG2 3.32Å; Q578-T582 WeakPolarHBondContact O-CG2 3.35Å; Q578-T582 PolarHBondContact O-N 3.38Å; Q578-T582 PolarHBondContact O-OG1 3.45Å
579	L	70.8	Confident	73.9	Confident	109 Å²	109	100.2 Å²	100.2	57%	0.571	52%	0.516	S	S	*	.	H	α-helix	trans	-64.5	-40.5	175.2	-163.7	73.8	0	0	0	111.1	E575 G576 T582 N583	E575-L579 WeakPolarHBondContact O-CB 3.5Å; E575-L579 PolarHBondContact O-N 3.23Å; G576-L579 PolarHBondContact O-N 3.41Å; L579-T582 WeakPolarHBondContact CA-OG1 3.28Å; L579-T582 PolarHBondContact O-OG1 3.18Å; L579-N583 WeakPolarHBondContact O-CB 3.46Å; L579-N583 PolarHBondContact O-N 3.21Å; L579-N583 PolarHBondContact O-ND2 3.31Å
580	G	69.9	Low	73.4	Confident	37 Å²	37	96.3 Å²	96.3	38%	0.381	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-50	173.9	0	0	0	0	0	112.5	G576 C577 Q578 N583 F584	G576-G580 PolarHBondContact O-N 2.83Å; C577-G580 PolarHBondContact O-N 3.31Å; Q578-G580 VanDerWaalsContact C-N 3.34Å; G580-N583 PolarHBondContact O-N 2.93Å; G580-F584 VanDerWaalsContact O-CB 3.28Å; G580-F584 WeakPolarHBondContact O-CB 3.49Å; G580-F584 PolarHBondContact O-N 3.48Å
581	N	69.9	Low	72.9	Confident	109 Å²	109	96 Å²	96	58%	0.583	51%	0.511	S	S	*	.	H	α-helix	trans	-63.8	-42.8	178.3	-80.2	-12.4	0	0	0	112.2	C577 Q578 F584 L585	C577-N581 WeakPolarHBondContact O-CB 3.5Å; C577-N581 PolarHBondContact O-N 2.95Å; Q578-N581 PolarHBondContact O-N 3.15Å; N581-F584 PolarHBondContact O-N 3.08Å; N581-L585 WeakPolarHBondContact O-CB 3.25Å; N581-L585 VanDerWaalsContact O-CG 3.24Å; N581-L585 WeakPolarHBondContact O-CG 3.32Å; N581-L585 PolarHBondContact O-N 3.34Å
582	T	68	Low	72.4	Confident	64 Å²	64	97.8 Å²	97.8	39%	0.393	52%	0.519	S	S	.	.	H	α-helix	trans	-67	-39.1	177.3	50.7	0	0	0	0	111.9	Q578 L579 L585 K586	Q578-T582 WeakPolarHBondContact O-CB 3.43Å; Q578-T582 VanDerWaalsContact O-CG2 3.32Å; Q578-T582 WeakPolarHBondContact O-CG2 3.35Å; Q578-T582 PolarHBondContact O-N 3.38Å; Q578-T582 PolarHBondContact O-OG1 3.45Å; L579-T582 WeakPolarHBondContact CA-OG1 3.28Å; L579-T582 PolarHBondContact O-OG1 3.18Å; T582-L585 PolarHBondContact O-N 3.08Å; T582-K586 WeakPolarHBondContact O-CB 3.09Å; T582-K586 WeakPolarHBondContact O-CG 3.35Å; T582-K586 PolarHBondContact O-N 3.12Å
583	N	70.1	Confident	71.7	Confident	83 Å²	83	101.7 Å²	101.7	44%	0.444	53%	0.525	S	S	.	.	H	α-helix	trans	-67	-40.5	173.8	-73.9	-20.7	0	0	0	111.9	L579 G580 K586 K587	L579-N583 WeakPolarHBondContact O-CB 3.46Å; L579-N583 PolarHBondContact O-N 3.21Å; L579-N583 PolarHBondContact O-ND2 3.31Å; G580-N583 PolarHBondContact O-N 2.93Å; N583-K586 PolarHBondContact O-N 3.41Å; N583-K587 WeakPolarHBondContact O-CB 3.18Å; N583-K587 PolarHBondContact O-N 3.42Å
584	F	70.1	Confident	71.1	Confident	141 Å²	141	98.7 Å²	98.7	62%	0.618	52%	0.52	S	S	*	.	H	α-helix	trans	-63.1	-44	175.1	-174.7	-94.1	0	0	0	111.6	G580 N581 K587 S588	G580-F584 VanDerWaalsContact O-CB 3.28Å; G580-F584 WeakPolarHBondContact O-CB 3.49Å; G580-F584 PolarHBondContact O-N 3.48Å; N581-F584 PolarHBondContact O-N 3.08Å; F584-K587 PolarHBondContact O-N 3.05Å; F584-S588 VanDerWaalsContact O-CB 3.32Å; F584-S588 WeakPolarHBondContact O-CB 3.42Å; F584-S588 PolarHBondContact O-N 2.74Å; F584-S588 PolarHBondContact O-OG 3.48Å
585	L	65.7	Low	70.4	Confident	104 Å²	104	99.7 Å²	99.7	55%	0.545	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-45.5	174.5	-75.2	166.2	0	0	0	111.5	N581 T582 K587 S588 I589	N581-L585 WeakPolarHBondContact O-CB 3.25Å; N581-L585 VanDerWaalsContact O-CG 3.24Å; N581-L585 WeakPolarHBondContact O-CG 3.32Å; N581-L585 PolarHBondContact O-N 3.34Å; T582-L585 PolarHBondContact O-N 3.08Å; L585-K587 PolarHBondContact O-N 2.99Å; L585-S588 PolarHBondContact O-N 2.91Å; L585-I589 VanDerWaalsContact O-CG1 3.27Å; L585-I589 WeakPolarHBondContact O-CG1 3.35Å; L585-I589 PolarHBondContact O-N 2.96Å
586	K	71.5	Confident	69.7	Low	134 Å²	134	100.6 Å²	100.6	58%	0.583	52%	0.524	S	S	*	.	H	α-helix	trans	-59.5	-46.1	175.2	-79.1	178.3	-178.5	176.3	0	111.8	T582 N583 S588 I589 I590	T582-K586 WeakPolarHBondContact O-CB 3.09Å; T582-K586 WeakPolarHBondContact O-CG 3.35Å; T582-K586 PolarHBondContact O-N 3.12Å; N583-K586 PolarHBondContact O-N 3.41Å; K586-S588 VanDerWaalsContact C-N 3.33Å; K586-S588 PolarHBondContact O-N 2.92Å; K586-I589 PolarHBondContact O-N 3.13Å; K586-I590 VanDerWaalsContact O-CG1 3.28Å; K586-I590 WeakPolarHBondContact O-CG1 3.2Å; K586-I590 PolarHBondContact O-N 2.87Å
587	K	67.8	Low	68.9	Low	144 Å²	144	103.6 Å²	103.6	63%	0.626	53%	0.53	S	S	*	.	H	α-helix	trans	-64.3	-38.6	178.2	-162.9	172	-174.2	176.5	0	111.5	N583 F584 L585 I590 N591	N583-K587 WeakPolarHBondContact O-CB 3.18Å; N583-K587 PolarHBondContact O-N 3.42Å; F584-K587 PolarHBondContact O-N 3.05Å; L585-K587 PolarHBondContact O-N 2.99Å; K587-I590 PolarHBondContact O-N 3.2Å; K587-N591 WeakPolarHBondContact O-CB 3.27Å; K587-N591 VanDerWaalsContact O-CG 3.27Å; K587-N591 PolarHBondContact O-N 2.96Å
588	S	70.4	Confident	68.3	Low	46 Å²	46	108.2 Å²	108.2	32%	0.322	54%	0.544	S	S	.	.	H	α-helix	trans	-64.6	-42.8	175	-61.5	0	0	0	0	112.3	F584 L585 K586 N591 Q592	F584-S588 VanDerWaalsContact O-CB 3.32Å; F584-S588 WeakPolarHBondContact O-CB 3.42Å; F584-S588 PolarHBondContact O-N 2.74Å; F584-S588 PolarHBondContact O-OG 3.48Å; L585-S588 PolarHBondContact O-N 2.91Å; K586-S588 VanDerWaalsContact C-N 3.33Å; K586-S588 PolarHBondContact O-N 2.92Å; S588-N591 PolarHBondContact O-N 3.32Å; S588-Q592 PolarHBondContact O-N 3.34Å
589	I	71.5	Confident	67.7	Low	89 Å²	89	110 Å²	110	46%	0.456	55%	0.545	S	S	.	.	H	α-helix	trans	-65.7	-42.4	176	-67.8	165.5	0	0	0	111.2	L585 K586 Q592 K593	L585-I589 VanDerWaalsContact O-CG1 3.27Å; L585-I589 WeakPolarHBondContact O-CG1 3.35Å; L585-I589 PolarHBondContact O-N 2.96Å; K586-I589 PolarHBondContact O-N 3.13Å; I589-Q592 PolarHBondContact O-N 3.37Å; I589-K593 PolarHBondContact O-N 3.19Å
590	I	72.3	Confident	66.8	Low	111 Å²	111	106.5 Å²	106.5	57%	0.569	53%	0.529	S	S	*	.	H	α-helix	trans	-62	-45.6	176.4	-69.3	165.8	0	0	0	110.4	K586 K587 Q592 K593 A594	K586-I590 VanDerWaalsContact O-CG1 3.28Å; K586-I590 WeakPolarHBondContact O-CG1 3.2Å; K586-I590 PolarHBondContact O-N 2.87Å; K587-I590 PolarHBondContact O-N 3.2Å; I590-Q592 VanDerWaalsContact C-N 3.35Å; I590-Q592 PolarHBondContact O-N 2.92Å; I590-K593 PolarHBondContact O-N 3.41Å; I590-A594 WeakPolarHBondContact O-CB 3.5Å; I590-A594 PolarHBondContact O-N 3.11Å
591	N	69.2	Low	66	Low	98 Å²	98	111.5 Å²	111.5	52%	0.524	54%	0.541	S	S	.	.	H	α-helix	trans	-62.6	-40.4	176.9	-75.3	-13.7	0	0	0	111.9	K587 S588 A594 L595	K587-N591 WeakPolarHBondContact O-CB 3.27Å; K587-N591 VanDerWaalsContact O-CG 3.27Å; K587-N591 PolarHBondContact O-N 2.96Å; S588-N591 PolarHBondContact O-N 3.32Å; N591-A594 PolarHBondContact O-N 3.47Å; N591-L595 WeakPolarHBondContact O-CB 3.44Å; N591-L595 PolarHBondContact O-N 3.22Å
592	Q	69.6	Low	65.2	Low	147 Å²	147	109.7 Å²	109.7	69%	0.687	53%	0.531	S	S	*	.	H	α-helix	trans	-62.8	-44.9	173.5	-95.5	-176.3	2.8	0	0	112.3	S588 I589 I590 A594 L595 Y596	S588-Q592 PolarHBondContact O-N 3.34Å; I589-Q592 PolarHBondContact O-N 3.37Å; I590-Q592 VanDerWaalsContact C-N 3.35Å; I590-Q592 PolarHBondContact O-N 2.92Å; Q592-A594 VanDerWaalsContact C-N 3.34Å; Q592-A594 PolarHBondContact O-N 3.48Å; Q592-L595 PolarHBondContact O-N 2.95Å; Q592-Y596 WeakPolarHBondContact O-CB 3.43Å; Q592-Y596 PolarHBondContact O-N 2.9Å
593	K	68	Low	64.6	Low	142 Å²	142	111 Å²	111	62%	0.617	54%	0.535	S	S	*	.	H	α-helix	trans	-61.7	-41.3	176.1	-79.9	-173.1	176.1	-175.4	0	111.9	I589 I590 Y596 N597	I589-K593 PolarHBondContact O-N 3.19Å; I590-K593 PolarHBondContact O-N 3.41Å; K593-Y596 PolarHBondContact O-N 2.88Å; K593-N597 WeakPolarHBondContact O-CB 3.31Å; K593-N597 PolarHBondContact O-N 3.09Å
594	A	65.1	Low	63.7	Low	55 Å²	55	111.2 Å²	111.2	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-41.9	175.5	0	0	0	0	0	111.7	I590 N591 Q592 N597 K598	I590-A594 WeakPolarHBondContact O-CB 3.5Å; I590-A594 PolarHBondContact O-N 3.11Å; N591-A594 PolarHBondContact O-N 3.47Å; Q592-A594 VanDerWaalsContact C-N 3.34Å; Q592-A594 PolarHBondContact O-N 3.48Å; A594-N597 PolarHBondContact O-N 3.09Å; A594-K598 WeakPolarHBondContact O-CB 3.49Å; A594-K598 PolarHBondContact O-N 3.22Å
595	L	63.5	Low	62.6	Low	109 Å²	109	111.1 Å²	111.1	57%	0.571	53%	0.53	S	S	*	.	H	α-helix	trans	-66.1	-40	177.6	-142.9	108.2	0	0	0	112	N591 Q592 K598 R599	N591-L595 WeakPolarHBondContact O-CB 3.44Å; N591-L595 PolarHBondContact O-N 3.22Å; Q592-L595 PolarHBondContact O-N 2.95Å; L595-K598 PolarHBondContact O-N 3.41Å; L595-R599 PolarHBondContact O-N 3.47Å
596	Y	61.1	Low	62.1	Low	158 Å²	158	109.9 Å²	109.9	62%	0.62	52%	0.524	S	S	*	.	H	α-helix	trans	-64.6	-48.7	175.2	-177.1	-97.8	0	0	0	111.5	Q592 K593 K598 R599 S600	Q592-Y596 WeakPolarHBondContact O-CB 3.43Å; Q592-Y596 PolarHBondContact O-N 2.9Å; K593-Y596 PolarHBondContact O-N 2.88Å; Y596-K598 VanDerWaalsContact C-N 3.28Å; Y596-K598 PolarHBondContact O-N 2.76Å; Y596-R599 PolarHBondContact O-N 3.4Å; Y596-R599 VanDerWaalsContact O-N 3.12Å; Y596-S600 PolarHBondContact O-N 3.48Å; Y596-S600 PolarHBondContact O-OG 3.49Å
597	N	62.3	Low	61	Low	104 Å²	104	112.3 Å²	112.3	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-60.6	-37.8	177.1	-74	-12.7	0	0	0	112.1	K593 A594 S600 F601	K593-N597 WeakPolarHBondContact O-CB 3.31Å; K593-N597 PolarHBondContact O-N 3.09Å; A594-N597 PolarHBondContact O-N 3.09Å; N597-S600 PolarHBondContact O-N 3.43Å; N597-F601 WeakPolarHBondContact O-CB 3.46Å; N597-F601 PolarHBondContact O-N 2.87Å
598	K	65.1	Low	59.9	Low	155 Å²	155	114.1 Å²	114.1	67%	0.674	53%	0.534	S	S	*	.	H	α-helix	trans	-66.5	-39	175.9	-155.6	172.9	-172.3	177.7	0	112	A594 L595 Y596 N602	A594-K598 WeakPolarHBondContact O-CB 3.49Å; A594-K598 PolarHBondContact O-N 3.22Å; L595-K598 PolarHBondContact O-N 3.41Å; Y596-K598 VanDerWaalsContact C-N 3.28Å; Y596-K598 PolarHBondContact O-N 2.76Å; K598-N602 PolarHBondContact O-N 2.9Å
599	R	59.7	Low	58.8	Low	172 Å²	172	114.9 Å²	114.9	65%	0.649	54%	0.539	S	S	*	.	H	α-helix	trans	-66.4	-46	172.6	-82.1	-175.7	174.5	178.2	-1.4	112.1	L595 Y596 F601 N602 I603	L595-R599 PolarHBondContact O-N 3.47Å; Y596-R599 PolarHBondContact O-N 3.4Å; Y596-R599 VanDerWaalsContact O-N 3.12Å; R599-F601 VanDerWaalsContact C-N 3.35Å; R599-F601 PolarHBondContact O-N 2.92Å; R599-N602 PolarHBondContact O-N 3.34Å; R599-I603 WeakPolarHBondContact O-CG1 3.48Å; R599-I603 PolarHBondContact O-N 3.15Å
600	S	52.1	Low	57.2	Low	34 Å²	34	117.6 Å²	117.6	24%	0.238	55%	0.554	C	S	.	*	H	α-helix	trans	-62	-40.2	177.8	-65.6	0	0	0	0	112.3	Y596 N597 I603 I604	Y596-S600 PolarHBondContact O-N 3.48Å; Y596-S600 PolarHBondContact O-OG 3.49Å; N597-S600 PolarHBondContact O-N 3.43Å; S600-I603 PolarHBondContact O-N 3.1Å; S600-I604 VanDerWaalsContact O-CG1 3.3Å; S600-I604 WeakPolarHBondContact O-CG1 2.93Å; S600-I604 PolarHBondContact O-N 3.01Å
601	F	52.3	Low	55.4	Low	143 Å²	143	115.6 Å²	115.6	63%	0.627	56%	0.561	S	S	*	*	H	α-helix	trans	-64.8	-40.7	176.1	-162	-90.5	0	0	0	112.2	N597 R599 I604 R605	N597-F601 WeakPolarHBondContact O-CB 3.46Å; N597-F601 PolarHBondContact O-N 2.87Å; R599-F601 VanDerWaalsContact C-N 3.35Å; R599-F601 PolarHBondContact O-N 2.92Å; F601-I604 PolarHBondContact O-N 2.95Å; F601-R605 WeakPolarHBondContact O-CB 3.11Å; F601-R605 PolarHBondContact O-N 3.46Å
602	N	54.2	Low	53.8	Low	70 Å²	70	115.5 Å²	115.5	37%	0.374	57%	0.568	S	S	.	*	H	α-helix	trans	-64.1	-41.1	175.2	-73.8	-13.9	0	0	0	111.9	K598 R599 I604 R605 D606	K598-N602 PolarHBondContact O-N 2.9Å; R599-N602 PolarHBondContact O-N 3.34Å; N602-I604 VanDerWaalsContact C-N 3.35Å; N602-I604 PolarHBondContact O-N 3.33Å; N602-R605 PolarHBondContact O-N 3.16Å; N602-D606 WeakPolarHBondContact O-CB 3.22Å; N602-D606 PolarHBondContact O-N 2.95Å
603	I	54.6	Low	52	Low	92 Å²	92	115 Å²	115	47%	0.472	57%	0.569	S	S	.	*	H	α-helix	trans	-63.4	-41	176.5	-67.3	166.7	0	0	0	111.3	R599 S600 R607	R599-I603 WeakPolarHBondContact O-CG1 3.48Å; R599-I603 PolarHBondContact O-N 3.15Å; S600-I603 PolarHBondContact O-N 3.1Å; I603-R607 WeakPolarHBondContact O-CB 3.34Å; I603-R607 PolarHBondContact O-N 3.27Å; I603-R607 VanDerWaalsContact O-N 3.11Å
604	I	51.7	Low	50.2	Low	87 Å²	87	117.9 Å²	117.9	45%	0.446	58%	0.581	S	S	.	*	H	α-helix	trans	-66.6	-47.3	177.6	-67.7	166.6	0	0	0	110.2	S600 F601 N602 D606 R607 Y608	S600-I604 VanDerWaalsContact O-CG1 3.3Å; S600-I604 WeakPolarHBondContact O-CG1 2.93Å; S600-I604 PolarHBondContact O-N 3.01Å; F601-I604 PolarHBondContact O-N 2.95Å; N602-I604 VanDerWaalsContact C-N 3.35Å; N602-I604 PolarHBondContact O-N 3.33Å; I604-D606 VanDerWaalsContact C-N 3.33Å; I604-D606 PolarHBondContact O-N 3.41Å; I604-R607 PolarHBondContact O-N 3.14Å; I604-R607 VanDerWaalsContact O-N 3.16Å; I604-Y608 HydrophobicContact CG2-CD2 3.69Å; I604-Y608 HydrophobicContact CG2-CE2 3.53Å; I604-Y608 VanDerWaalsContact O-CD2 3.24Å; I604-Y608 WeakPolarHBondContact O-CD2 3.4Å; I604-Y608 PolarHBondContact O-N 2.96Å
605	R	48	Very low	48.5	Very low	140 Å²	140	121 Å²	121	53%	0.528	60%	0.599	S	S	.	*	H	α-helix	trans	-58.6	-44.5	178.4	-173.2	-166.6	67.6	155.1	4	111.9	F601 N602 R607 Y608 S609	F601-R605 WeakPolarHBondContact O-CB 3.11Å; F601-R605 PolarHBondContact O-N 3.46Å; N602-R605 PolarHBondContact O-N 3.16Å; R605-R607 VanDerWaalsContact C-N 3.3Å; R605-R607 PolarHBondContact O-N 3.43Å; R605-Y608 PolarHBondContact O-N 2.77Å; R605-S609 WeakPolarHBondContact O-CB 3.41Å; R605-S609 PolarHBondContact O-N 3.34Å; R605-S609 PolarHBondContact O-OG 3.31Å
606	D	53.4	Low	46.9	Very low	77 Å²	77	124.5 Å²	124.5	41%	0.412	61%	0.613	S	S	.	*	H	α-helix	trans	-68.8	-32.3	-179.7	-65.2	-7.6	0	0	0	110.8	N602 I604 S609 L610	N602-D606 WeakPolarHBondContact O-CB 3.22Å; N602-D606 PolarHBondContact O-N 2.95Å; I604-D606 VanDerWaalsContact C-N 3.33Å; I604-D606 PolarHBondContact O-N 3.41Å; D606-S609 PolarHBondContact O-N 2.83Å; D606-L610 WeakPolarHBondContact O-CD1 3.4Å; D606-L610 PolarHBondContact O-N 3.3Å
607	R	49.5	Very low	45.2	Very low	186 Å²	186	124.3 Å²	124.3	70%	0.702	62%	0.622	S	S	*	*	H	α-helix	trans	-68.5	-37.9	175	-133.7	-177.1	-68.1	-165.3	-1.3	113.3	I603 I604 R605	I603-R607 WeakPolarHBondContact O-CB 3.34Å; I603-R607 PolarHBondContact O-N 3.27Å; I603-R607 VanDerWaalsContact O-N 3.11Å; I604-R607 PolarHBondContact O-N 3.14Å; I604-R607 VanDerWaalsContact O-N 3.16Å; R605-R607 VanDerWaalsContact C-N 3.3Å; R605-R607 PolarHBondContact O-N 3.43Å
608	Y	44.7	Very low	43.5	Very low	181 Å²	181	125.5 Å²	125.5	71%	0.71	63%	0.634	S	S	*	*	H	α-helix	trans	-74.5	-32	174.7	-76.7	-73.8	0	0	0	112.7	I604 R605 L610 G611 S612	I604-Y608 HydrophobicContact CG2-CD2 3.69Å; I604-Y608 HydrophobicContact CG2-CE2 3.53Å; I604-Y608 VanDerWaalsContact O-CD2 3.24Å; I604-Y608 WeakPolarHBondContact O-CD2 3.4Å; I604-Y608 PolarHBondContact O-N 2.96Å; R605-Y608 PolarHBondContact O-N 2.77Å; Y608-L610 VanDerWaalsContact C-N 3.26Å; Y608-L610 PolarHBondContact O-N 3.24Å; Y608-G611 PolarHBondContact O-N 3.35Å; Y608-G611 VanDerWaalsContact O-N 3.14Å; Y608-S612 PolarHBondContact O-OG 3.34Å
609	S	46	Very low	41.6	Very low	62 Å²	62	125.4 Å²	125.4	43%	0.434	64%	0.639	S	S	.	*	H	α-helix	trans	-69.1	-25.4	176.9	-52.1	0	0	0	0	112.5	R605 D606 G611	R605-S609 WeakPolarHBondContact O-CB 3.41Å; R605-S609 PolarHBondContact O-N 3.34Å; R605-S609 PolarHBondContact O-OG 3.31Å; D606-S609 PolarHBondContact O-N 2.83Å; S609-G611 VanDerWaalsContact C-N 3.33Å
610	L	38.6	Very low	39.9	Very low	146 Å²	146	126.1 Å²	126.1	76%	0.764	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-11.7	172.8	-98.7	117.5	0	0	0	114.1	D606 Y608	D606-L610 WeakPolarHBondContact O-CD1 3.4Å; D606-L610 PolarHBondContact O-N 3.3Å; Y608-L610 VanDerWaalsContact C-N 3.26Å; Y608-L610 PolarHBondContact O-N 3.24Å
611	G	35.2	Very low	38.5	Very low	69 Å²	69	136 Å²	136	71%	0.711	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-10.1	179.3	0	0	0	0	0	115.1	Y608 S609	Y608-G611 PolarHBondContact O-N 3.35Å; Y608-G611 VanDerWaalsContact O-N 3.14Å; S609-G611 VanDerWaalsContact C-N 3.33Å
612	S	34	Very low	37.2	Very low	97 Å²	97	132.4 Å²	132.4	68%	0.678	69%	0.685	S	S	*	*	S	Bend	trans	-108.4	6.9	-170.3	9.1	0	0	0	0	114.6	Y608	Y608-S612 PolarHBondContact O-OG 3.34Å
613	I	32.6	Very low	35.8	Very low	137 Å²	137	139.8 Å²	139.8	70%	0.703	71%	0.71	S	S	*	*			trans	-127.5	86.3	-176.3	-51.2	173.7	0	0	0	108.8
614	K	31.3	Very low	34.3	Very low	202 Å²	202	144.9 Å²	144.9	88%	0.878	73%	0.731	S	S	*	*	S	Bend	trans	176.8	89.8	152.9	-99.5	166.9	-169.4	-169.8	0	110.4
615	S	29.3	Very low	33.2	Very low	119 Å²	119	145.5 Å²	145.5	83%	0.832	74%	0.743	S	S	*	*				165.8	65.9	129.3	64.7	0	0	0	0	110
616	E	28.2	Very low	32.3	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	76%	0.757	S	S	*	*			trans	-77	140	151.2	-79.6	174.3	156.3	0	0	106.7
617	N	26.8	Very low	31	Very low	154 Å²	154	147.8 Å²	147.8	82%	0.824	77%	0.773	S	S	*	*			trans	93.4	67.5	176.1	-49.8	-25.2	0	0	0	117.1
618	T	26.9	Very low	30.1	Very low	130 Å²	130	146 Å²	146	80%	0.798	78%	0.777	S	S	*	*			trans	-155	102.7	132.8	-29.5	0	0	0	0	111.3
619	I	25.3	Very low	29.3	Very low	153 Å²	153	142.3 Å²	142.3	79%	0.785	78%	0.778	S	S	*	*			trans	41.6	106.9	139.9	-55.8	167.2	0	0	0	117	R621	I619-R621 PolarHBondContact O-N 3.49Å
620	E	22.6	Very low	28.3	Very low	186 Å²	186	145.1 Å²	145.1	87%	0.869	80%	0.797	S	S	*	*			trans	-43.4	120.4	155.9	-61.3	170.9	146	0	0	111.9
621	R	23.5	Very low	27.7	Very low	241 Å²	241	145.1 Å²	145.1	91%	0.909	80%	0.797	S	S	*	*			trans	-175.9	110.3	144.6	-103.3	170.2	-152.9	-169.3	6.7	110.4	I619	I619-R621 PolarHBondContact O-N 3.49Å
622	G	24.2	Very low	27.3	Very low	69 Å²	69	151.4 Å²	151.4	71%	0.711	81%	0.805	S	S	*	*			trans	66.6	112.7	150	0	0	0	0	0	117.1
623	Y	24.6	Very low	26.8	Very low	224 Å²	224	154.8 Å²	154.8	88%	0.878	82%	0.815	S	S	*	*				171.8	95.5	118.4	-94.6	-75.4	0	0	0	107.7	S625	Y623-S625 PolarHBondContact O-N 3.41Å
624	H	24.8	Very low	26.4	Very low	200 Å²	200	154.6 Å²	154.6	93%	0.926	82%	0.82	S	S	*	*			trans	-69.2	108.6	160.7	-84.8	-100.3	0	0	0	108.1
625	S	28.7	Very low	26.2	Very low	99 Å²	99	150 Å²	150	69%	0.692	81%	0.814	S	S	*	*			trans	-149.5	103.6	160.4	51.4	0	0	0	0	111.7	Y623	Y623-S625 PolarHBondContact O-N 3.41Å
626	N	27.6	Very low	26	Very low	153 Å²	153	152.9 Å²	152.9	82%	0.818	81%	0.814	S	S	*	*			trans	23.3	104.2	145	-75.3	-10.6	0	0	0	118.8
627	C	26.2	Very low	25.8	Very low	113 Å²	113	154.5 Å²	154.5	76%	0.764	82%	0.818	S	S	*	*			trans	-132.6	103.7	147.7	-168.6	0	0	0	0	110	S629	C627-S629 VanDerWaalsContact C-N 3.27Å; C627-S629 PolarHBondContact O-N 2.73Å; C627-S629 VanDerWaalsContact O-N 3.16Å
628	N	30	Very low	25.7	Very low	147 Å²	147	150.6 Å²	150.6	79%	0.786	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	24.5	-168.4	-100	-21.5	0	0	0	115.1
629	S	29.7	Very low	25.6	Very low	104 Å²	104	152.5 Å²	152.5	73%	0.727	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	-4.7	-169.1	-52.1	0	0	0	0	115.5	C627	C627-S629 VanDerWaalsContact C-N 3.27Å; C627-S629 PolarHBondContact O-N 2.73Å; C627-S629 VanDerWaalsContact O-N 3.16Å
630	C	25	Very low	25.4	Very low	122 Å²	122	153.8 Å²	153.8	82%	0.824	82%	0.82	S	S	*	*	S	Bend	trans	-103.2	2.2	-178.1	-76.7	0	0	0	0	115.9	K632	C630-K632 PolarHBondContact O-N 2.87Å
631	N	25.7	Very low	25.4	Very low	145 Å²	145	154.8 Å²	154.8	78%	0.775	82%	0.822	S	S	*	*			trans	-95.1	23.8	-172.5	-97.6	-0.3	0	0	0	116.3
632	K	26.2	Very low	25.4	Very low	202 Å²	202	150.7 Å²	150.7	88%	0.878	82%	0.817	S	S	*	*	S	Bend	trans	-114.6	6.5	-173.1	-103.1	-174.2	-179.7	-178.8	0	119.2	C630	C630-K632 PolarHBondContact O-N 2.87Å
633	L	23.7	Very low	25.3	Very low	168 Å²	168	155 Å²	155	88%	0.88	82%	0.823	S	S	*	*	S	Bend	trans	-135.3	7.1	-179.8	-96.7	142.4	0	0	0	117.1	S635	L633-S635 VanDerWaalsContact C-N 3.28Å; L633-S635 PolarHBondContact O-N 2.85Å; L633-S635 VanDerWaalsContact O-N 3.17Å
634	T	24.7	Very low	25.3	Very low	133 Å²	133	153.9 Å²	153.9	82%	0.816	82%	0.823	S	S	*	*			trans	-89.3	64.2	168.1	40.8	0	0	0	0	110.8
635	S	25.8	Very low	25.3	Very low	106 Å²	106	153.1 Å²	153.1	74%	0.741	82%	0.82	S	S	*	*			trans	-106.9	104.6	167.3	176.6	0	0	0	0	109.1	L633 K637	L633-S635 VanDerWaalsContact C-N 3.28Å; L633-S635 PolarHBondContact O-N 2.85Å; L633-S635 VanDerWaalsContact O-N 3.17Å; S635-K637 PolarHBondContact O-N 3.13Å
636	Q	26.1	Very low	25	Very low	178 Å²	178	156.5 Å²	156.5	83%	0.832	83%	0.828	S	S	*	*	S	Bend	trans	9	99.7	151.5	-67.9	173.3	-13.5	0	0	116.6
637	K	24.5	Very low	24.8	Very low	217 Å²	217	151.9 Å²	151.9	94%	0.943	82%	0.817	S	S	*	*			trans	169.3	90.9	145.9	-95.6	165	-169.3	-173.8	0	108.5	S635	S635-K637 PolarHBondContact O-N 3.13Å
638	G	24	Very low	24.8	Very low	73 Å²	73	154.2 Å²	154.2	75%	0.753	82%	0.82	S	S	*	*			trans	-170.5	-6.9	177.6	0	0	0	0	0	119.3
639	I	23.9	Very low	24.5	Very low	170 Å²	170	154.6 Å²	154.6	87%	0.872	82%	0.821	S	S	*	*	S	Bend	trans	-110	25.2	-172.5	-51	177.4	0	0	0	112.2
640	H	22.4	Very low	24.3	Very low	180 Å²	180	155 Å²	155	83%	0.833	81%	0.814	S	S	*	*	S	Bend	trans	-124.9	44.3	179	-127.6	-70.8	0	0	0	113.6
641	F	22.3	Very low	24.5	Very low	206 Å²	206	155.1 Å²	155.1	90%	0.904	81%	0.814	S	S	*	*			trans	-147.4	66.6	169.6	-86.3	-80.1	0	0	0	110.9
642	I	24.1	Very low	24.6	Very low	155 Å²	155	152.9 Å²	152.9	80%	0.795	81%	0.81	S	S	*	*	S	Bend	trans	-125.8	-20.3	167.4	-62.5	-174.9	0	0	0	113.9	K644	I642-K644 PolarHBondContact O-N 2.85Å
643	N	22.2	Very low	24.8	Very low	160 Å²	160	149.5 Å²	149.5	86%	0.856	80%	0.801	S	S	*	*			trans	-105.8	59	-178.6	-75.8	-6.4	0	0	0	114.1
644	K	22.8	Very low	25.1	Very low	200 Å²	200	148 Å²	148	87%	0.87	79%	0.794	S	S	*	*			trans	-103.3	98.2	157.9	-129	179.1	-175.5	-179.4	0	108.3	I642	I642-K644 PolarHBondContact O-N 2.85Å
645	E	25	Very low	25.1	Very low	185 Å²	185	150.3 Å²	150.3	86%	0.864	80%	0.8	S	S	*	*			trans	-41.8	138.6	176.2	-68.3	171.4	145.8	0	0	111.4	G647	E645-G647 PolarHBondContact O-N 2.75Å
646	I	23.8	Very low	25.2	Very low	169 Å²	169	151.5 Å²	151.5	87%	0.867	80%	0.797	S	S	*	*			trans	-65.9	81.3	176.1	-60.9	168.1	0	0	0	106.8	I648	I646-I648 PolarHBondContact O-N 2.87Å
647	G	22.6	Very low	25.1	Very low	56 Å²	56	154.2 Å²	154.2	58%	0.577	80%	0.8	S	S	*	*			trans	-64.1	115.1	168.5	0	0	0	0	0	108.2	E645 I649	E645-G647 PolarHBondContact O-N 2.75Å; G647-I649 PolarHBondContact O-N 3.21Å
648	I	25.7	Very low	25.1	Very low	163 Å²	163	154.4 Å²	154.4	84%	0.836	80%	0.796	S	S	*	*			trans	-56.6	102.2	171.7	-62	166.7	0	0	0	106.8	I646 N650	I646-I648 PolarHBondContact O-N 2.87Å; I648-N650 PolarHBondContact O-N 3.41Å
649	I	24	Very low	25.1	Very low	155 Å²	155	160 Å²	160	80%	0.795	80%	0.8	S	S	*	*			trans	-67.7	106.2	176.9	-62.3	173	0	0	0	106.8	G647	G647-I649 PolarHBondContact O-N 3.21Å
650	N	25.4	Very low	25.1	Very low	111 Å²	111	160.9 Å²	160.9	59%	0.594	80%	0.8	S	S	*	*			trans	-66.6	128.2	174.3	-154.6	-12.6	0	0	0	108.4	I648 S652	I648-N650 PolarHBondContact O-N 3.41Å; N650-S652 PolarHBondContact O-N 3.23Å
651	P	28.6	Very low	25.2	Very low	126 Å²	126	157.8 Å²	157.8	82%	0.818	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	7.5	-167.4	-16.2	31	0	0	0	116
652	S	29.5	Very low	25.2	Very low	97 Å²	97	153.3 Å²	153.3	68%	0.678	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-16.8	-169.8	-42	0	0	0	0	114.6	N650	N650-S652 PolarHBondContact O-N 3.23Å
653	D	28.9	Very low	25.2	Very low	132 Å²	132	152.3 Å²	152.3	71%	0.706	78%	0.783	S	S	*	*	S	Bend	trans	-112.4	126.9	-170.5	-74.7	-35.3	0	0	0	113.8
654	N	30.3	Very low	25.2	Very low	136 Å²	136	148.3 Å²	148.3	73%	0.727	77%	0.768	S	S	*	*			trans	87.5	92.8	165.5	-60.1	-38.4	0	0	0	117.6	I656	N654-I656 HydrophobicContact CB-CG1 4.06Å; N654-I656 PolarHBondContact O-N 3.42Å
655	L	25.4	Very low	25.5	Very low	181 Å²	181	144.7 Å²	144.7	95%	0.948	76%	0.762	S	S	*	*			trans	-41.1	79.1	136.5	-94.6	76.9	0	0	0	110.7	R657	L655-R657 PolarHBondContact O-N 3.45Å
656	I	27.5	Very low	25.8	Very low	131 Å²	131	142 Å²	142	67%	0.672	75%	0.754	S	S	*	*			trans	-81.1	107	163	-61	179.7	0	0	0	105.9	N654 Y658	N654-I656 HydrophobicContact CB-CG1 4.06Å; N654-I656 PolarHBondContact O-N 3.42Å; I656-Y658 PolarHBondContact O-N 3.16Å
657	R	24.5	Very low	26.1	Very low	235 Å²	235	139 Å²	139	89%	0.887	74%	0.74	S	S	*	*			trans	-45	106.1	167.4	-75.5	-178.4	-171.9	-175.7	2.3	108.6	L655 K659	L655-R657 PolarHBondContact O-N 3.45Å; R657-K659 VanDerWaalsContact C-N 3.33Å; R657-K659 PolarHBondContact O-N 3.45Å
658	Y	24.7	Very low	26.4	Very low	221 Å²	221	141.6 Å²	141.6	87%	0.867	74%	0.744	S	S	*	*			trans	-67	99.7	165.9	-86.6	-87.5	0	0	0	107.4	I656 Q660	I656-Y658 PolarHBondContact O-N 3.16Å; Y658-Q660 PolarHBondContact O-N 3.47Å; Y658-Q660 VanDerWaalsContact O-N 3.07Å
659	K	23.6	Very low	26.5	Very low	191 Å²	191	140.7 Å²	140.7	83%	0.83	74%	0.741	S	S	*	*			trans	-55.2	114.1	159.2	-105.4	-179.2	174.5	179.8	0	106.3	R657 V661	R657-K659 VanDerWaalsContact C-N 3.33Å; R657-K659 PolarHBondContact O-N 3.45Å; K659-V661 VanDerWaalsContact C-N 3.31Å; K659-V661 PolarHBondContact O-N 2.95Å
660	Q	23.7	Very low	26.7	Very low	188 Å²	188	138.2 Å²	138.2	88%	0.879	74%	0.737	S	S	*	*			trans	-62.2	90.6	177.2	-158.1	171.7	5.7	0	0	107.8	Y658 S662	Y658-Q660 PolarHBondContact O-N 3.47Å; Y658-Q660 VanDerWaalsContact O-N 3.07Å; Q660-S662 VanDerWaalsContact C-N 3.32Å; Q660-S662 PolarHBondContact O-N 3.43Å; Q660-S662 VanDerWaalsContact O-N 3.07Å
661	V	24.1	Very low	26.7	Very low	116 Å²	116	141.3 Å²	141.3	70%	0.703	75%	0.75	S	S	*	*			trans	-76.5	95.6	169.2	-179.5	0	0	0	0	105.9	K659 L663	K659-V661 VanDerWaalsContact C-N 3.31Å; K659-V661 PolarHBondContact O-N 2.95Å; V661-L663 VanDerWaalsContact C-N 3.27Å; V661-L663 HydrophobicContact CG1-CG 4.4Å; V661-L663 PolarHBondContact O-N 3.2Å
662	S	23	Very low	26.7	Very low	112 Å²	112	139.5 Å²	139.5	78%	0.783	75%	0.746	S	S	*	*			trans	-64	86.7	170	45.3	0	0	0	0	109.1	Q660 S664	Q660-S662 VanDerWaalsContact C-N 3.32Å; Q660-S662 PolarHBondContact O-N 3.43Å; Q660-S662 VanDerWaalsContact O-N 3.07Å; S662-S664 PolarHBondContact O-N 2.56Å
663	L	22.8	Very low	26.4	Very low	133 Å²	133	141.6 Å²	141.6	70%	0.696	76%	0.759	S	S	*	*			trans	-69.4	110.5	166.3	-84.1	144.3	0	0	0	107.8	V661	V661-L663 VanDerWaalsContact C-N 3.27Å; V661-L663 HydrophobicContact CG1-CG 4.4Å; V661-L663 PolarHBondContact O-N 3.2Å
664	S	24.1	Very low	26.3	Very low	76 Å²	76	138.4 Å²	138.4	53%	0.531	76%	0.757	S	S	.	*			trans	-62	143.7	172.9	82.2	0	0	0	0	109.7	S662 N666	S662-S664 PolarHBondContact O-N 2.56Å; S664-N666 PolarHBondContact O-N 3.31Å
665	V	29.1	Very low	26.1	Very low	124 Å²	124	140.7 Å²	140.7	75%	0.752	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-59.9	-5.8	-172	175	0	0	0	0	114
666	N	29.9	Very low	26.1	Very low	129 Å²	129	143.6 Å²	143.6	69%	0.69	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-81.7	-14.5	-174.7	-68.8	-11.4	0	0	0	115.1	S664 V668	S664-N666 PolarHBondContact O-N 3.31Å; N666-V668 VanDerWaalsContact C-N 3.33Å; N666-V668 PolarHBondContact O-N 2.96Å
667	D	29.9	Very low	25.9	Very low	106 Å²	106	142.5 Å²	142.5	57%	0.567	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-83.6	-4.7	179.7	-73.1	-29.7	0	0	0	114.3	N669	D667-N669 VanDerWaalsContact C-N 3.33Å
668	V	28.9	Very low	26.2	Very low	111 Å²	111	140.9 Å²	140.9	67%	0.673	79%	0.791	S	S	*	*	G	3₁₀ helix	trans	-78.9	-18.6	-178.7	-175.1	0	0	0	0	112.3	N666 S670	N666-V668 VanDerWaalsContact C-N 3.33Å; N666-V668 PolarHBondContact O-N 2.96Å; V668-S670 PolarHBondContact O-N 2.77Å
669	N	28.3	Very low	26.3	Very low	144 Å²	144	136.9 Å²	136.9	77%	0.77	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-81.8	-6.5	-174.7	-75.7	-16.1	0	0	0	115.1	D667	D667-N669 VanDerWaalsContact C-N 3.33Å
670	S	28.4	Very low	26.4	Very low	102 Å²	102	134 Å²	134	71%	0.713	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-95.6	-4.7	-179.5	67.8	0	0	0	0	115	V668	V668-S670 PolarHBondContact O-N 2.77Å
671	M	26.2	Very low	26.5	Very low	176 Å²	176	131 Å²	131	87%	0.867	78%	0.78	S	S	*	*	S	Bend	trans	-106.5	6.5	-177.9	-82.2	-172.1	158.1	0	0	115.3
672	A	26.9	Very low	26.7	Very low	88 Å²	88	131.9 Å²	131.9	73%	0.727	78%	0.784	S	S	*	*			trans	-88.9	0.4	-170.5	0	0	0	0	0	116.5
673	C	24	Very low	26.9	Very low	142 Å²	142	133.1 Å²	133.1	96%	0.959	78%	0.784	S	S	*	*			trans	-103.1	76.3	177.1	-78.2	0	0	0	0	111.4
674	G	26.5	Very low	27.2	Very low	64 Å²	64	133.1 Å²	133.1	66%	0.66	79%	0.79	S	S	*	*	S	Bend	trans	-151	97.4	172.6	0	0	0	0	0	109.7	Y676	G674-Y676 PolarHBondContact O-N 2.69Å
675	E	26.7	Very low	27.4	Very low	184 Å²	184	137.2 Å²	137.2	86%	0.86	81%	0.809	S	S	*	*			trans	-35.7	121.8	-177.1	-67.7	170.7	144	0	0	115.2	C677	E675-C677 PolarHBondContact O-N 3.35Å; E675-C677 VanDerWaalsContact O-N 3.11Å
676	Y	25.9	Very low	27.3	Very low	242 Å²	242	138.2 Å²	138.2	95%	0.949	81%	0.813	S	S	*	*			trans	-65.2	98.7	162.4	-90.8	-100.6	0	0	0	109.4	G674	G674-Y676 PolarHBondContact O-N 2.69Å
677	C	23.2	Very low	27.1	Very low	108 Å²	108	139 Å²	139	73%	0.73	82%	0.823	S	S	*	*			trans	-128.3	130.7	169.1	-97.4	0	0	0	0	110.8	E675	E675-C677 PolarHBondContact O-N 3.35Å; E675-C677 VanDerWaalsContact O-N 3.11Å
678	S	29.8	Very low	26.8	Very low	201 Å²	201	142 Å²	142	100%	1.406	85%	0.847	S	S	*	*			trans	78.1	0	176	73.4	0	0	0	0	119.2

Retrieved 678 of 678 residues in 382.8 ms (Link to these results)

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