A0A060W8C5_ONCMY Loading...

Scavenger receptor class A member 5

Ferritin receptor that mediates non-transferrin-dependent delivery of iron. Mediates cellular uptake of ferritin-bound iron by stimulating ferritin endocytosis from the cell surface with consequent iron delivery within the cell. Delivery of iron to cells by ferritin is required for the development of specific cell types, suggesting the existence of cell type-specific mechanisms of iron traffic in organogenesis, which alternatively utilize transferrin or non-transferrin iron delivery pathways.

AlphaFold DB , UniProt , Accession A0A060W8C5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110529613, Length 498 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	35.5	Very low	30.1	Very low	230 Å²	230	160.2 Å²	160.2	100%	1.133	81%	0.808	S	S	*	*				0	133.2	0	-74.6	-156.5	-86.2	0	0	107.2
2	E	36	Very low	30.1	Very low	174 Å²	174	162.8 Å²	162.8	81%	0.813	82%	0.815	S	S	*	*			trans	63.9	148.8	165.7	-57.8	177.7	153.6	0	0	117.9
3	N	33.2	Very low	30.1	Very low	149 Å²	149	161.8 Å²	161.8	80%	0.797	81%	0.807	S	S	*	*			cis	-157.7	128.4	-24.4	-102.2	-23.2	0	0	0	106.1
4	K	34.2	Very low	30.2	Very low	208 Å²	208	166.5 Å²	166.5	90%	0.904	81%	0.81	S	S	*	*			trans	-89.8	159.8	172.4	-90.2	176.4	174.3	179.5	0	108.5
5	A	33.2	Very low	30.3	Very low	98 Å²	98	165.7 Å²	165.7	81%	0.81	80%	0.804	S	S	*	*			cis	-162.9	145.2	-3.3	0	0	0	0	0	106.2
6	M	27.8	Very low	30.4	Very low	173 Å²	173	165.3 Å²	165.3	85%	0.852	81%	0.807	S	S	*	*			trans	-136.6	121.9	173.7	-171.6	-175.5	-91.9	0	0	108.4
7	Y	26.4	Very low	30.3	Very low	205 Å²	205	160 Å²	160	80%	0.804	81%	0.806	S	S	*	*			trans	52.1	138.5	155.1	-80.9	-97.4	0	0	0	123
8	L	25.5	Very low	30.2	Very low	143 Å²	143	157.2 Å²	157.2	75%	0.749	80%	0.804	S	S	*	*			trans	83.5	104.6	146.8	-73.1	156.1	0	0	0	119.5
9	S	26.1	Very low	30.1	Very low	90 Å²	90	157.4 Å²	157.4	63%	0.629	80%	0.798	S	S	*	*				75.8	139.8	120.4	76.7	0	0	0	0	119.9
10	T	27	Very low	30.1	Very low	113 Å²	113	158.3 Å²	158.3	69%	0.693	79%	0.793	S	S	*	*			trans	84.4	117.1	144.5	47.1	0	0	0	0	119.9
11	Y	25.7	Very low	30.3	Very low	179 Å²	179	158.5 Å²	158.5	70%	0.702	79%	0.791	S	S	*	*			trans	81.9	112.8	139.6	-83.3	-104.1	0	0	0	120.8	E13	Y11-E13 HydrophobicContact CD1-CG 4.3Å; Y11-E13 HydrophobicContact CE1-CG 4.33Å
12	E	30.3	Very low	30	Very low	192 Å²	192	156.5 Å²	156.5	90%	0.897	78%	0.779	S	S	*	*				-172.4	94.6	124	-98	-179.1	180	0	0	105.2
13	E	30.7	Very low	30.1	Very low	150 Å²	150	151.6 Å²	151.6	70%	0.701	78%	0.775	S	S	*	*				40.3	96.7	76.9	-85.2	-173.1	-177.6	0	0	115.7	Y11	Y11-E13 HydrophobicContact CD1-CG 4.3Å; Y11-E13 HydrophobicContact CE1-CG 4.33Å
14	R	30.8	Very low	30	Very low	227 Å²	227	155 Å²	155	86%	0.857	78%	0.779	S	S	*	*			trans	-160.6	92.3	137.3	-141.2	172.2	-174.9	113.5	5.5	108.9
15	E	31.8	Very low	29.7	Very low	155 Å²	155	150.1 Å²	150.1	72%	0.724	76%	0.762	S	S	*	*				72.1	98.7	90.2	-75.8	-165.3	154.5	0	0	115.3
16	N	31.8	Very low	30.2	Very low	158 Å²	158	149.3 Å²	149.3	85%	0.845	76%	0.763	S	S	*	*				165.9	102.9	113.2	-92.9	-3.5	0	0	0	106.7
17	G	29.3	Very low	30.5	Very low	76 Å²	76	150.3 Å²	150.3	78%	0.784	76%	0.757	S	S	*	*				88.4	121.3	62	0	0	0	0	0	107.3
18	S	27.8	Very low	30.8	Very low	110 Å²	110	147 Å²	147	77%	0.769	75%	0.754	S	S	*	*			cis	-173.2	140.4	30.2	60	0	0	0	0	107.4
19	F	28.1	Very low	31.3	Very low	161 Å²	161	149.5 Å²	149.5	71%	0.706	77%	0.767	S	S	*	*				73.6	120.7	97.6	-153.1	-133.1	0	0	0	112.6
20	Y	31.6	Very low	31.8	Very low	174 Å²	174	148.8 Å²	148.8	68%	0.682	76%	0.762	S	S	*	*			cis	-149.1	163.7	37.4	-107.2	-75.3	0	0	0	111.8
21	E	33.5	Very low	32.3	Very low	164 Å²	164	151.4 Å²	151.4	77%	0.766	76%	0.764	S	S	*	*			trans	-40.7	145.4	157.5	-68	166.5	123.6	0	0	114.1
22	E	28.9	Very low	32.6	Very low	187 Å²	187	150.9 Å²	150.9	87%	0.874	77%	0.772	S	S	*	*				179.8	149.4	120.2	-103.6	176.3	165.6	0	0	111.2
23	G	38.5	Very low	33	Very low	71 Å²	71	146.5 Å²	146.5	73%	0.732	76%	0.755	S	S	*	*			trans	-61.9	153.8	-173.7	0	0	0	0	0	115.4
24	Y	30.2	Very low	33.3	Very low	222 Å²	222	146.8 Å²	146.8	87%	0.871	76%	0.76	S	S	*	*			trans	-136	94.6	162.7	-100.1	-94.7	0	0	0	105.7
25	D	29.1	Very low	33.5	Very low	105 Å²	105	141.9 Å²	141.9	56%	0.561	76%	0.76	S	S	*	*				57.9	100.4	78.7	-145.3	30.1	0	0	0	110.9	R27	D25-R27 PolarHBondContact O-N 2.84Å; D25-R27 IonicContact OD2-CZ 3.5Å; D25-R27 IonicContact OD2-NE 3.89Å; D25-R27 PolarHBondContact OD2-NE 3.31Å; D25-R27 IonicContact OD2-NH2 3.08Å; D25-R27 PolarHBondContact OD2-NH2 2.93Å; D25-R27 VanDerWaalsContact OD2-NH2 3.08Å
26	G	43.6	Very low	33.6	Very low	80 Å²	80	142.6 Å²	142.6	83%	0.825	76%	0.763	S	S	*	*			trans	-58.2	107.6	169.2	0	0	0	0	0	109.4
27	R	33.5	Very low	34	Very low	194 Å²	194	143.1 Å²	143.1	73%	0.732	77%	0.766	S	S	*	*			trans	-138	110.1	164.8	-69.4	-170.8	-164.6	-166.8	3.2	109.8	D25	D25-R27 PolarHBondContact O-N 2.84Å; D25-R27 IonicContact OD2-CZ 3.5Å; D25-R27 IonicContact OD2-NE 3.89Å; D25-R27 PolarHBondContact OD2-NE 3.31Å; D25-R27 IonicContact OD2-NH2 3.08Å; D25-R27 PolarHBondContact OD2-NH2 2.93Å; D25-R27 VanDerWaalsContact OD2-NH2 3.08Å
28	N	33	Very low	34.2	Very low	136 Å²	136	144.1 Å²	144.1	73%	0.727	77%	0.766	S	S	*	*			trans	41.2	94.8	131	-76.8	-14	0	0	0	116.1	S30	N28-S30 VanDerWaalsContact CB-OG 3.27Å; N28-S30 WeakPolarHBondContact CB-OG 3.3Å; N28-S30 PolarHBondContact O-N 3.48Å
29	L	35.4	Very low	34.8	Very low	195 Å²	195	146 Å²	146	100%	1.021	77%	0.773	S	S	*	*	S	Bend	trans	-72.1	35.1	152.7	-75.7	166.6	0	0	0	111.9
30	S	37.7	Very low	35	Very low	76 Å²	76	143.6 Å²	143.6	53%	0.531	78%	0.776	S	S	.	*			trans	-107.7	70.3	168	32.9	0	0	0	0	108.5	N28	N28-S30 VanDerWaalsContact CB-OG 3.27Å; N28-S30 WeakPolarHBondContact CB-OG 3.3Å; N28-S30 PolarHBondContact O-N 3.48Å
31	K	36.8	Very low	35.5	Very low	168 Å²	168	139.4 Å²	139.4	73%	0.73	78%	0.778	S	S	*	*			trans	-171.4	68.9	160.3	-107.4	167.3	-173	-175.5	0	111.7
32	L	32.7	Very low	35.9	Very low	167 Å²	167	140.9 Å²	140.9	87%	0.874	78%	0.781	S	S	*	*			trans	-99.3	79.9	134.9	-111.2	92.3	0	0	0	106.4	L34	L32-L34 PolarHBondContact O-N 3.36Å; L32-L34 VanDerWaalsContact O-N 3.17Å
33	N	37.2	Very low	36.3	Very low	100 Å²	100	142.5 Å²	142.5	54%	0.535	78%	0.779	S	S	.	*			trans	-72.9	100.3	166.7	-86.7	3.8	0	0	0	107.9
34	L	38.3	Very low	36.2	Very low	156 Å²	156	150.1 Å²	150.1	82%	0.817	79%	0.786	S	S	*	*			trans	-125.2	74.4	156.3	-93.4	156.9	0	0	0	106.7	L32	L32-L34 PolarHBondContact O-N 3.36Å; L32-L34 VanDerWaalsContact O-N 3.17Å
35	C	33.9	Very low	36.9	Very low	125 Å²	125	150.2 Å²	150.2	85%	0.845	79%	0.785	S	S	*	*			trans	171	87.4	155.5	-90.2	0	0	0	0	106.2
36	E	34	Very low	37.1	Very low	170 Å²	170	154.1 Å²	154.1	79%	0.794	80%	0.797	S	S	*	*			trans	-109.1	109.5	166.6	-154.2	164.1	-150.3	0	0	106.8	A38	E36-A38 PolarHBondContact O-N 2.87Å
37	D	40.4	Very low	36.9	Very low	168 Å²	168	156.1 Å²	156.1	90%	0.898	80%	0.796	S	S	*	*			trans	-68.1	117	176.5	-83.5	-38.8	0	0	0	109.9
38	A	34.3	Very low	37.1	Very low	97 Å²	97	154.4 Å²	154.4	80%	0.802	80%	0.801	S	S	*	*			trans	-112.6	112.6	161.8	0	0	0	0	0	109.5	E36 S40	E36-A38 PolarHBondContact O-N 2.87Å; A38-S40 PolarHBondContact O-N 3.09Å
39	V	40.2	Very low	37.7	Very low	150 Å²	150	154.7 Å²	154.7	91%	0.909	80%	0.802	S	S	*	*			trans	-55	115.3	172	175.8	0	0	0	0	110.7
40	S	32.5	Very low	38.2	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	79%	0.787	S	S	*	*			trans	-163.8	121.5	143.6	-163.3	0	0	0	0	113.2	A38	A38-S40 PolarHBondContact O-N 3.09Å
41	A	41.9	Very low	38.3	Very low	86 Å²	86	151.9 Å²	151.9	71%	0.711	80%	0.797	S	S	*	*			trans	-1.6	134.3	164.6	0	0	0	0	0	121.7
42	K	42.2	Very low	38.6	Very low	194 Å²	194	147 Å²	147	84%	0.843	78%	0.784	S	S	*	*			trans	87.4	112.8	147.5	-73.7	173.9	-179.7	171.2	0	119.5
43	R	37.1	Very low	39	Very low	221 Å²	221	145.8 Å²	145.8	83%	0.834	77%	0.774	S	S	*	*			trans	96.1	117.4	137.4	-75.1	-178.1	179.6	-175	1.3	119.6
44	R	35.5	Very low	39.4	Very low	231 Å²	231	147.4 Å²	147.4	87%	0.872	78%	0.781	S	S	*	*			trans	83.3	111.9	142.2	-72.4	-176.1	175.1	-179.9	-2.1	118.3
45	R	45.8	Very low	39.8	Very low	225 Å²	225	145.8 Å²	145.8	85%	0.849	77%	0.773	S	S	*	*			trans	-39.3	130.7	163.2	-71.8	174.8	170	161.6	-6	112.6	E169	R45-E169 IonicContact CZ-OE1 3.95Å; R45-E169 IonicContact NH2-OE1 2.8Å; R45-E169 PolarHBondContact NH2-OE1 3.01Å
46	K	33.2	Very low	40.7	Very low	186 Å²	186	142.1 Å²	142.1	81%	0.809	75%	0.75	S	S	*	*			trans	-136.9	136.2	156.4	-132.9	-177.1	-177.5	-174.9	0	106.7
47	P	39.1	Very low	41.7	Very low	123 Å²	123	138.7 Å²	138.7	80%	0.799	74%	0.736	S	S	*	*			trans	-76.2	131.4	-178.1	29.9	-31	0	0	0	110.2	N49	P47-N49 PolarHBondContact O-N 3.19Å
48	D	37	Very low	42.5	Very low	157 Å²	157	133.1 Å²	133.1	84%	0.84	71%	0.71	S	S	*	*			trans	-70.9	123.8	-177.8	-70.1	-45	0	0	0	111.9	C50	D48-C50 VanDerWaalsContact C-N 3.28Å; D48-C50 PolarHBondContact O-N 3.08Å
49	N	47.5	Very low	43.7	Very low	142 Å²	142	131 Å²	131	76%	0.759	69%	0.693	S	S	*	*			trans	-93	35.4	-178.6	-148.2	32.5	0	0	0	111.6	P47	P47-N49 PolarHBondContact O-N 3.19Å
50	C	44.6	Very low	45	Very low	102 Å²	102	128.6 Å²	128.6	69%	0.689	67%	0.674	S	S	*	*			trans	-87.8	-17.6	-170.9	-145.7	0	0	0	0	114	D48	D48-C50 VanDerWaalsContact C-N 3.28Å; D48-C50 PolarHBondContact O-N 3.08Å
51	C	39.9	Very low	46.8	Very low	111 Å²	111	129.9 Å²	129.9	75%	0.75	67%	0.666	S	S	*	*	S	Bend	trans	-91.5	0.3	-174.5	-68.8	0	0	0	0	115.9
52	S	42.8	Very low	48	Very low	66 Å²	66	133.8 Å²	133.8	46%	0.462	66%	0.663	S	S	.	*	S	Bend	trans	-90.4	-18	-180	57.2	0	0	0	0	114
53	H	42.3	Very low	49.3	Very low	141 Å²	141	127 Å²	127	65%	0.653	64%	0.643	S	S	*	*	S	Bend	trans	-88.3	-15.9	-174.6	-112.8	-83.9	0	0	0	114.9	S56	H53-S56 PolarHBondContact O-OG 2.92Å; H53-S56 VanDerWaalsContact O-OG 3.09Å
54	L	43.9	Very low	51.2	Low	133 Å²	133	121.6 Å²	121.6	70%	0.696	63%	0.63	S	S	*	*	H	α-helix	trans	-85.9	-26	178.4	-78.7	159.6	0	0	0	113.1	S56 S58	L54-S56 VanDerWaalsContact C-N 3.34Å; L54-S58 PolarHBondContact O-OG 3.46Å
55	N	48.3	Very low	53	Low	122 Å²	122	114.6 Å²	114.6	65%	0.652	61%	0.612	S	S	*	*	H	α-helix	trans	-75	-22.8	175.7	-73.9	-13	0	0	0	113	S58 A59	N55-S58 PolarHBondContact O-OG 3.05Å; N55-A59 VanDerWaalsContact O-CB 3.26Å; N55-A59 WeakPolarHBondContact O-CB 3.33Å; N55-A59 PolarHBondContact O-N 3.49Å
56	S	52.8	Low	54	Low	49 Å²	49	107 Å²	107	34%	0.343	59%	0.594	S	S	.	*	H	α-helix	trans	-80.5	-35.6	177.4	64.2	0	0	0	0	112.1	H53 L54 A59 I60	H53-S56 PolarHBondContact O-OG 2.92Å; H53-S56 VanDerWaalsContact O-OG 3.09Å; L54-S56 VanDerWaalsContact C-N 3.34Å; S56-A59 PolarHBondContact O-N 3.18Å; S56-I60 WeakPolarHBondContact O-CB 3.37Å; S56-I60 VanDerWaalsContact O-CD1 3.31Å; S56-I60 WeakPolarHBondContact O-CD1 3.36Å; S56-I60 WeakPolarHBondContact O-CG1 3.44Å; S56-I60 PolarHBondContact O-N 3.13Å
57	L	54.3	Low	56.3	Low	97 Å²	97	103.6 Å²	103.6	51%	0.508	58%	0.584	S	S	.	*	H	α-helix	trans	-75.7	-33.5	-174.3	-134.5	141.9	0	0	0	112.4	K61	L57-K61 WeakPolarHBondContact O-CG 3.43Å; L57-K61 PolarHBondContact O-N 3.31Å
58	S	57.7	Low	58.3	Low	51 Å²	51	105.3 Å²	105.3	36%	0.357	58%	0.575	S	S	.	*	H	α-helix	trans	-70.1	-45.1	169.4	57.5	0	0	0	0	111.2	L54 N55 I60 K61 Y62	L54-S58 PolarHBondContact O-OG 3.46Å; N55-S58 PolarHBondContact O-OG 3.05Å; S58-I60 VanDerWaalsContact C-N 3.32Å; S58-I60 PolarHBondContact O-N 2.85Å; S58-K61 WeakPolarHBondContact O-CB 3.38Å; S58-K61 PolarHBondContact O-N 3.46Å; S58-K61 VanDerWaalsContact O-N 3.13Å; S58-Y62 WeakPolarHBondContact O-CD2 3.4Å; S58-Y62 PolarHBondContact O-N 2.94Å
59	A	58.8	Low	60.2	Low	54 Å²	54	102 Å²	102	45%	0.446	56%	0.557	S	S	.	*	H	α-helix	trans	-60.1	-38.8	177.2	0	0	0	0	0	112.9	N55 S56 Y62 A63	N55-A59 VanDerWaalsContact O-CB 3.26Å; N55-A59 WeakPolarHBondContact O-CB 3.33Å; N55-A59 PolarHBondContact O-N 3.49Å; S56-A59 PolarHBondContact O-N 3.18Å; A59-Y62 PolarHBondContact O-N 3.01Å; A59-A63 WeakPolarHBondContact O-CB 3.44Å; A59-A63 PolarHBondContact O-N 3.45Å
60	I	68	Low	61.8	Low	98 Å²	98	100.6 Å²	100.6	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-64.9	-41.1	175.5	-70.7	162.2	0	0	0	111	S56 S58 A63 I64	S56-I60 WeakPolarHBondContact O-CB 3.37Å; S56-I60 VanDerWaalsContact O-CD1 3.31Å; S56-I60 WeakPolarHBondContact O-CD1 3.36Å; S56-I60 WeakPolarHBondContact O-CG1 3.44Å; S56-I60 PolarHBondContact O-N 3.13Å; S58-I60 VanDerWaalsContact C-N 3.32Å; S58-I60 PolarHBondContact O-N 2.85Å; I60-A63 PolarHBondContact O-N 2.99Å; I60-I64 HydrophobicContact CG2-CD1 3.88Å; I60-I64 VanDerWaalsContact O-CG1 3.29Å; I60-I64 WeakPolarHBondContact O-CG1 3.5Å; I60-I64 PolarHBondContact O-N 3.34Å
61	K	70.9	Confident	63.9	Low	139 Å²	139	99.4 Å²	99.4	60%	0.604	54%	0.538	S	S	*	.	H	α-helix	trans	-62.3	-44	175.6	-73.5	178.4	178.7	-174.9	0	111.8	L57 S58 A63 I64 V65	L57-K61 WeakPolarHBondContact O-CG 3.43Å; L57-K61 PolarHBondContact O-N 3.31Å; S58-K61 WeakPolarHBondContact O-CB 3.38Å; S58-K61 PolarHBondContact O-N 3.46Å; S58-K61 VanDerWaalsContact O-N 3.13Å; K61-A63 PolarHBondContact O-N 2.8Å; K61-I64 PolarHBondContact O-N 3.43Å; K61-V65 WeakPolarHBondContact O-CG2 3.46Å; K61-V65 PolarHBondContact O-N 3.34Å; K61-V65 VanDerWaalsContact O-N 3.12Å
62	Y	66.6	Low	65.7	Low	167 Å²	167	98.3 Å²	98.3	66%	0.655	52%	0.524	S	S	*	.	H	α-helix	trans	-66.6	-35.4	177.1	-71.6	-68.1	0	0	0	113.1	S58 A59 S66	S58-Y62 WeakPolarHBondContact O-CD2 3.4Å; S58-Y62 PolarHBondContact O-N 2.94Å; A59-Y62 PolarHBondContact O-N 3.01Å; Y62-S66 WeakPolarHBondContact O-CB 3.33Å; Y62-S66 PolarHBondContact O-N 3.38Å; Y62-S66 PolarHBondContact O-OG 3.01Å
63	A	70.3	Confident	67.2	Low	51 Å²	51	100.4 Å²	100.4	42%	0.421	53%	0.53	S	S	.	.	H	α-helix	trans	-65.4	-41	175.6	0	0	0	0	0	112.1	A59 I60 K61 S66 L67	A59-A63 WeakPolarHBondContact O-CB 3.44Å; A59-A63 PolarHBondContact O-N 3.45Å; I60-A63 PolarHBondContact O-N 2.99Å; K61-A63 PolarHBondContact O-N 2.8Å; A63-S66 PolarHBondContact O-N 3.04Å; A63-L67 PolarHBondContact O-N 3.33Å
64	I	76.2	Confident	69	Low	109 Å²	109	96.8 Å²	96.8	56%	0.559	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-44.7	177.5	-67.9	165.9	0	0	0	110.9	I60 K61 S66 L67 Y68	I60-I64 HydrophobicContact CG2-CD1 3.88Å; I60-I64 VanDerWaalsContact O-CG1 3.29Å; I60-I64 WeakPolarHBondContact O-CG1 3.5Å; I60-I64 PolarHBondContact O-N 3.34Å; K61-I64 PolarHBondContact O-N 3.43Å; I64-S66 VanDerWaalsContact C-N 3.35Å; I64-S66 PolarHBondContact O-N 2.88Å; I64-L67 PolarHBondContact O-N 3.31Å; I64-Y68 PolarHBondContact O-N 2.98Å
65	V	73.6	Confident	70.6	Confident	83 Å²	83	94.6 Å²	94.6	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-41.4	177.3	174.3	0	0	0	0	111.1	K61 L67 Y68 I69	K61-V65 WeakPolarHBondContact O-CG2 3.46Å; K61-V65 PolarHBondContact O-N 3.34Å; K61-V65 VanDerWaalsContact O-N 3.12Å; V65-L67 PolarHBondContact O-N 3.14Å; V65-Y68 PolarHBondContact O-N 2.91Å; V65-I69 HydrophobicContact CG1-CD1 4.08Å; V65-I69 WeakPolarHBondContact O-CG1 3.24Å; V65-I69 PolarHBondContact O-N 3.43Å; V65-I69 VanDerWaalsContact O-N 3.09Å
66	S	66.5	Low	72	Confident	66 Å²	66	95 Å²	95	46%	0.462	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-39.1	178.3	-58.8	0	0	0	0	112.4	Y62 A63 I64 I69 L70	Y62-S66 WeakPolarHBondContact O-CB 3.33Å; Y62-S66 PolarHBondContact O-N 3.38Å; Y62-S66 PolarHBondContact O-OG 3.01Å; A63-S66 PolarHBondContact O-N 3.04Å; I64-S66 VanDerWaalsContact C-N 3.35Å; I64-S66 PolarHBondContact O-N 2.88Å; S66-I69 PolarHBondContact O-N 2.98Å; S66-L70 WeakPolarHBondContact O-CG 3.49Å; S66-L70 PolarHBondContact O-N 3.08Å; S66-L70 VanDerWaalsContact O-N 3.16Å
67	L	80.3	Confident	73.3	Confident	115 Å²	115	94.4 Å²	94.4	60%	0.602	51%	0.507	S	S	*	.	H	α-helix	trans	-65	-39.7	174.3	-83.3	164.7	0	0	0	112.1	A63 I64 V65 L70 V71	A63-L67 PolarHBondContact O-N 3.33Å; I64-L67 PolarHBondContact O-N 3.31Å; V65-L67 PolarHBondContact O-N 3.14Å; L67-L70 PolarHBondContact O-N 3.39Å; L67-V71 WeakPolarHBondContact O-CG2 3.44Å; L67-V71 PolarHBondContact O-N 3Å; L67-V71 VanDerWaalsContact O-N 3.08Å
68	Y	82.4	Confident	74.3	Confident	158 Å²	158	95.3 Å²	95.3	62%	0.62	51%	0.511	S	S	*	.	H	α-helix	trans	-63.2	-42	177.6	-166.1	-102.3	0	0	0	112.1	I64 V65 V71 L72	I64-Y68 PolarHBondContact O-N 2.98Å; V65-Y68 PolarHBondContact O-N 2.91Å; Y68-V71 PolarHBondContact O-N 3.42Å; Y68-L72 HydrophobicContact CD1-CD1 3.85Å; Y68-L72 HydrophobicContact CD1-CG 4.43Å; Y68-L72 HydrophobicContact CE1-CD1 3.62Å; Y68-L72 HydrophobicContact CE1-CG 4.24Å; Y68-L72 WeakPolarHBondContact O-CG 3.36Å; Y68-L72 PolarHBondContact O-N 3.44Å
69	I	76.9	Confident	74.7	Confident	89 Å²	89	96.4 Å²	96.4	46%	0.456	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-43	176.5	-66.8	168.3	0	0	0	111.4	V65 S66 V71 L72 L73	V65-I69 HydrophobicContact CG1-CD1 4.08Å; V65-I69 WeakPolarHBondContact O-CG1 3.24Å; V65-I69 PolarHBondContact O-N 3.43Å; V65-I69 VanDerWaalsContact O-N 3.09Å; S66-I69 PolarHBondContact O-N 2.98Å; I69-V71 VanDerWaalsContact C-N 3.34Å; I69-V71 PolarHBondContact O-N 3.23Å; I69-L72 PolarHBondContact O-N 3.21Å; I69-L73 HydrophobicContact CG2-CD1 4.07Å; I69-L73 HydrophobicContact CG2-CG 4.48Å; I69-L73 WeakPolarHBondContact O-CG 3.37Å; I69-L73 PolarHBondContact O-N 3.25Å
70	L	80.4	Confident	75.1	Confident	111 Å²	111	97.7 Å²	97.7	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-64.3	-38.4	178.5	-71.8	172.1	0	0	0	112.4	S66 L67 L73 S74	S66-L70 WeakPolarHBondContact O-CG 3.49Å; S66-L70 PolarHBondContact O-N 3.08Å; S66-L70 VanDerWaalsContact O-N 3.16Å; L67-L70 PolarHBondContact O-N 3.39Å; L70-L73 PolarHBondContact O-N 3.41Å; L70-S74 WeakPolarHBondContact O-CB 3.38Å; L70-S74 PolarHBondContact O-N 3.4Å
71	V	88.1	Confident	75.1	Confident	78 Å²	78	95.6 Å²	95.6	47%	0.473	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-45.3	174.8	171.5	0	0	0	0	110.6	L67 Y68 I69 L73 S74 I75	L67-V71 WeakPolarHBondContact O-CG2 3.44Å; L67-V71 PolarHBondContact O-N 3Å; L67-V71 VanDerWaalsContact O-N 3.08Å; Y68-V71 PolarHBondContact O-N 3.42Å; I69-V71 VanDerWaalsContact C-N 3.34Å; I69-V71 PolarHBondContact O-N 3.23Å; V71-L73 PolarHBondContact O-N 2.7Å; V71-S74 PolarHBondContact O-N 3.44Å; V71-S74 PolarHBondContact O-OG 3.06Å; V71-I75 HydrophobicContact CG1-CD1 3.81Å; V71-I75 HydrophobicContact CG1-CG1 4.47Å; V71-I75 WeakPolarHBondContact O-CG1 3.35Å; V71-I75 PolarHBondContact O-N 3.39Å
72	L	78.4	Confident	74.8	Confident	87 Å²	87	92.7 Å²	92.7	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-61.5	-42.7	177.2	-73.4	175.8	0	0	0	112.9	Y68 I69 S74 I75 F76	Y68-L72 HydrophobicContact CD1-CD1 3.85Å; Y68-L72 HydrophobicContact CD1-CG 4.43Å; Y68-L72 HydrophobicContact CE1-CD1 3.62Å; Y68-L72 HydrophobicContact CE1-CG 4.24Å; Y68-L72 WeakPolarHBondContact O-CG 3.36Å; Y68-L72 PolarHBondContact O-N 3.44Å; I69-L72 PolarHBondContact O-N 3.21Å; L72-S74 VanDerWaalsContact C-N 3.3Å; L72-S74 PolarHBondContact O-N 3.28Å; L72-I75 PolarHBondContact O-N 3.01Å; L72-F76 WeakPolarHBondContact O-CB 3.4Å; L72-F76 PolarHBondContact O-N 2.89Å
73	L	75.4	Confident	74.3	Confident	111 Å²	111	88 Å²	88	58%	0.581	50%	0.5	S	S	*	.	H	α-helix	trans	-64.8	-35.2	176.2	-70.6	173.3	0	0	0	112.2	I69 L70 V71 G77	I69-L73 HydrophobicContact CG2-CD1 4.07Å; I69-L73 HydrophobicContact CG2-CG 4.48Å; I69-L73 WeakPolarHBondContact O-CG 3.37Å; I69-L73 PolarHBondContact O-N 3.25Å; L70-L73 PolarHBondContact O-N 3.41Å; V71-L73 PolarHBondContact O-N 2.7Å; L73-G77 PolarHBondContact O-N 3.04Å
74	S	79.1	Confident	73.6	Confident	65 Å²	65	95.6 Å²	95.6	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-68.7	-40.1	175.9	77.5	0	0	0	0	112.5	L70 V71 L72 G77 L78	L70-S74 WeakPolarHBondContact O-CB 3.38Å; L70-S74 PolarHBondContact O-N 3.4Å; V71-S74 PolarHBondContact O-N 3.44Å; V71-S74 PolarHBondContact O-OG 3.06Å; L72-S74 VanDerWaalsContact C-N 3.3Å; L72-S74 PolarHBondContact O-N 3.28Å; S74-G77 PolarHBondContact O-N 3.1Å; S74-L78 WeakPolarHBondContact O-CG 3.33Å; S74-L78 PolarHBondContact O-N 3.24Å
75	I	78.5	Confident	72.5	Confident	87 Å²	87	94.8 Å²	94.8	45%	0.446	52%	0.522	S	S	.	.	H	α-helix	trans	-65.5	-44.6	175.6	-67.5	167	0	0	0	109.7	V71 L72 G77 L78 C79	V71-I75 HydrophobicContact CG1-CD1 3.81Å; V71-I75 HydrophobicContact CG1-CG1 4.47Å; V71-I75 WeakPolarHBondContact O-CG1 3.35Å; V71-I75 PolarHBondContact O-N 3.39Å; L72-I75 PolarHBondContact O-N 3.01Å; I75-G77 PolarHBondContact O-N 2.9Å; I75-L78 PolarHBondContact O-N 3.04Å; I75-C79 PolarHBondContact O-N 3.41Å; I75-C79 PolarHBondContact O-SG 3.47Å
76	F	77.2	Confident	71.3	Confident	129 Å²	129	98.4 Å²	98.4	57%	0.566	53%	0.533	S	S	*	.	H	α-helix	trans	-62	-42.1	176.3	-172.8	-104.4	0	0	0	112.2	L72 L78 C79 L80	L72-F76 WeakPolarHBondContact O-CB 3.4Å; L72-F76 PolarHBondContact O-N 2.89Å; F76-L78 PolarHBondContact O-N 3.05Å; F76-C79 PolarHBondContact O-N 3.02Å; F76-L80 HydrophobicContact CD1-CD1 3.86Å; F76-L80 HydrophobicContact CD1-CG 4.44Å; F76-L80 HydrophobicContact CE1-CD1 3.44Å; F76-L80 VanDerWaalsContact CE1-CD1 3.44Å; F76-L80 HydrophobicContact CE1-CG 4.13Å; F76-L80 HydrophobicContact CZ-CD1 4.03Å; F76-L80 HydrophobicContact CZ-CG 4.34Å; F76-L80 WeakPolarHBondContact O-CG 3.49Å; F76-L80 PolarHBondContact O-N 3.3Å
77	G	80.2	Confident	70.2	Confident	38 Å²	38	100.2 Å²	100.2	39%	0.392	54%	0.535	S	S	.	.	H	α-helix	trans	-61.6	-40.9	174	0	0	0	0	0	113.2	L73 S74 I75 L80 A81	L73-G77 PolarHBondContact O-N 3.04Å; S74-G77 PolarHBondContact O-N 3.1Å; I75-G77 PolarHBondContact O-N 2.9Å; G77-L80 PolarHBondContact O-N 2.88Å; G77-A81 WeakPolarHBondContact O-CB 3.36Å; G77-A81 PolarHBondContact O-N 3.19Å
78	L	76	Confident	68.5	Low	115 Å²	115	98.8 Å²	98.8	60%	0.602	54%	0.535	S	S	*	.	H	α-helix	trans	-67	-40.1	174.4	-76.8	165.2	0	0	0	112	S74 I75 F76 L80 A81 V82	S74-L78 WeakPolarHBondContact O-CG 3.33Å; S74-L78 PolarHBondContact O-N 3.24Å; I75-L78 PolarHBondContact O-N 3.04Å; F76-L78 PolarHBondContact O-N 3.05Å; L78-L80 PolarHBondContact O-N 3.21Å; L78-A81 PolarHBondContact O-N 3.47Å; L78-V82 WeakPolarHBondContact O-CB 3.3Å; L78-V82 VanDerWaalsContact O-CG2 3.28Å; L78-V82 WeakPolarHBondContact O-CG2 3.38Å; L78-V82 PolarHBondContact O-N 3.5Å
79	C	66.1	Low	67	Low	74 Å²	74	96 Å²	96	50%	0.5	54%	0.538	S	S	.	.	H	α-helix	trans	-61.2	-41.9	174	-72	0	0	0	0	112.1	I75 F76 V82 S83	I75-C79 PolarHBondContact O-N 3.41Å; I75-C79 PolarHBondContact O-SG 3.47Å; F76-C79 PolarHBondContact O-N 3.02Å; C79-V82 PolarHBondContact O-N 3Å; C79-S83 WeakPolarHBondContact O-CB 3.38Å; C79-S83 PolarHBondContact O-N 3.29Å; C79-S83 PolarHBondContact O-OG 2.71Å
80	L	65.8	Low	65.5	Low	82 Å²	82	100 Å²	100	43%	0.429	56%	0.555	S	S	.	*	H	α-helix	trans	-68.1	-34.1	175.4	-74.2	176.1	0	0	0	113.1	F76 G77 L78 S83 R84	F76-L80 HydrophobicContact CD1-CD1 3.86Å; F76-L80 HydrophobicContact CD1-CG 4.44Å; F76-L80 HydrophobicContact CE1-CD1 3.44Å; F76-L80 VanDerWaalsContact CE1-CD1 3.44Å; F76-L80 HydrophobicContact CE1-CG 4.13Å; F76-L80 HydrophobicContact CZ-CD1 4.03Å; F76-L80 HydrophobicContact CZ-CG 4.34Å; F76-L80 WeakPolarHBondContact O-CG 3.49Å; F76-L80 PolarHBondContact O-N 3.3Å; G77-L80 PolarHBondContact O-N 2.88Å; L78-L80 PolarHBondContact O-N 3.21Å; L80-S83 WeakPolarHBondContact CA-OG 3.38Å; L80-S83 PolarHBondContact O-OG 3.1Å; L80-R84 WeakPolarHBondContact O-CB 3.37Å; L80-R84 WeakPolarHBondContact O-CG 3.27Å; L80-R84 PolarHBondContact O-N 3.49Å; L80-R84 VanDerWaalsContact O-N 3.11Å
81	A	67.8	Low	63.9	Low	54 Å²	54	102.9 Å²	102.9	45%	0.446	56%	0.563	S	S	.	*	H	α-helix	trans	-69.9	-39.9	175.4	0	0	0	0	0	111.6	G77 L78 R84 S85	G77-A81 WeakPolarHBondContact O-CB 3.36Å; G77-A81 PolarHBondContact O-N 3.19Å; L78-A81 PolarHBondContact O-N 3.47Å; A81-R84 PolarHBondContact O-N 2.95Å; A81-S85 WeakPolarHBondContact O-CB 3.45Å; A81-S85 PolarHBondContact O-N 3.38Å; A81-S85 PolarHBondContact O-OG 3.18Å
82	V	64.9	Low	61.8	Low	78 Å²	78	103.2 Å²	103.2	47%	0.473	56%	0.56	S	S	.	*	H	α-helix	trans	-69.2	-38.6	175.8	172.3	0	0	0	0	111.6	L78 C79 R84 S85 Q86	L78-V82 WeakPolarHBondContact O-CB 3.3Å; L78-V82 VanDerWaalsContact O-CG2 3.28Å; L78-V82 WeakPolarHBondContact O-CG2 3.38Å; L78-V82 PolarHBondContact O-N 3.5Å; C79-V82 PolarHBondContact O-N 3Å; V82-R84 VanDerWaalsContact C-N 3.27Å; V82-R84 PolarHBondContact O-N 3.24Å; V82-S85 WeakPolarHBondContact CA-OG 3.37Å; V82-S85 PolarHBondContact O-N 2.96Å; V82-S85 PolarHBondContact O-OG 3.25Å; V82-Q86 PolarHBondContact O-N 2.79Å
83	S	57.2	Low	60.4	Low	67 Å²	67	106.5 Å²	106.5	47%	0.469	57%	0.572	S	S	.	*	H	α-helix	trans	-66.8	-30.6	174.7	71.1	0	0	0	0	112.3	C79 L80	C79-S83 WeakPolarHBondContact O-CB 3.38Å; C79-S83 PolarHBondContact O-N 3.29Å; C79-S83 PolarHBondContact O-OG 2.71Å; L80-S83 WeakPolarHBondContact CA-OG 3.38Å; L80-S83 PolarHBondContact O-OG 3.1Å
84	R	55.6	Low	59.1	Low	212 Å²	212	104.2 Å²	104.2	80%	0.8	57%	0.57	S	S	*	*	H	α-helix	trans	-79.8	-28.1	174.6	-77	-177.3	174.4	-176.6	-0.5	113.4	L80 A81 V82	L80-R84 WeakPolarHBondContact O-CB 3.37Å; L80-R84 WeakPolarHBondContact O-CG 3.27Å; L80-R84 PolarHBondContact O-N 3.49Å; L80-R84 VanDerWaalsContact O-N 3.11Å; A81-R84 PolarHBondContact O-N 2.95Å; V82-R84 VanDerWaalsContact C-N 3.27Å; V82-R84 PolarHBondContact O-N 3.24Å
85	S	52.1	Low	57.2	Low	92 Å²	92	105.8 Å²	105.8	64%	0.643	57%	0.573	S	S	*	*	H	α-helix	trans	-84.7	-13	-179.9	65.7	0	0	0	0	114.4	A81 V82	A81-S85 WeakPolarHBondContact O-CB 3.45Å; A81-S85 PolarHBondContact O-N 3.38Å; A81-S85 PolarHBondContact O-OG 3.18Å; V82-S85 WeakPolarHBondContact CA-OG 3.37Å; V82-S85 PolarHBondContact O-N 2.96Å; V82-S85 PolarHBondContact O-OG 3.25Å
86	Q	47.8	Very low	55.6	Low	159 Å²	159	107 Å²	107	74%	0.743	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-4.7	176.1	-95.2	176.6	-10.8	0	0	115.3	V82	V82-Q86 PolarHBondContact O-N 2.79Å
87	M	44.8	Very low	54.4	Low	103 Å²	103	108 Å²	108	51%	0.507	58%	0.584	S	S	.	*			trans	-102.2	101.1	174.9	-69.5	-156.9	86.9	0	0	111.5	Q92	M87-Q92 HydrophobicContact CE-CG 4.22Å
88	S	43.3	Very low	52.9	Low	86 Å²	86	111.4 Å²	111.4	60%	0.601	59%	0.593	S	S	*	*			trans	-72.2	131.3	164.3	167	0	0	0	0	110.2	E90 K91	S88-E90 PolarHBondContact O-N 3.24Å; S88-K91 PolarHBondContact O-N 3.04Å
89	S	51.5	Low	51.1	Low	98 Å²	98	111.3 Å²	111.3	69%	0.685	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-5.1	-168.8	-170.5	0	0	0	0	116.2
90	E	45.6	Very low	50.3	Low	173 Å²	173	111 Å²	111	81%	0.808	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-20.9	176.6	-85.8	179.9	149.1	0	0	113.6	S88	S88-E90 PolarHBondContact O-N 3.24Å
91	K	47.5	Very low	49.5	Very low	173 Å²	173	115.9 Å²	115.9	75%	0.752	60%	0.6	S	S	*	*	H	α-helix	trans	-86.5	-6.9	177.4	-80.2	-175.9	176.8	-179.6	0	113.9	S88 L95	S88-K91 PolarHBondContact O-N 3.04Å; K91-L95 VanDerWaalsContact O-CB 3.31Å; K91-L95 WeakPolarHBondContact O-CB 3.4Å; K91-L95 PolarHBondContact O-N 3.3Å
92	Q	44	Very low	48.2	Very low	85 Å²	85	118.3 Å²	118.3	40%	0.397	60%	0.603	S	S	.	*	H	α-helix	trans	-83.4	-27.9	-173.7	-127.3	166.2	-54.1	0	0	113	M87 M96	M87-Q92 HydrophobicContact CE-CG 4.22Å; Q92-M96 WeakPolarHBondContact O-CB 3.49Å; Q92-M96 PolarHBondContact O-N 3.25Å; Q92-M96 VanDerWaalsContact O-N 3.12Å
93	E	47.8	Very low	47.1	Very low	155 Å²	155	120.5 Å²	120.5	72%	0.724	61%	0.608	S	S	*	*	H	α-helix	trans	-76.7	-44.7	177.8	-102.5	176	159.6	0	0	112.7	L95 M96 E97	E93-L95 PolarHBondContact O-N 2.95Å; E93-M96 PolarHBondContact O-N 3.05Å; E93-M96 VanDerWaalsContact O-N 3.12Å; E93-E97 PolarHBondContact O-N 2.73Å; E93-E97 VanDerWaalsContact O-N 3.15Å
94	A	48.1	Very low	46.8	Very low	63 Å²	63	122.3 Å²	122.3	52%	0.521	61%	0.613	S	S	.	*	H	α-helix	trans	-67.2	-25	175.3	0	0	0	0	0	113
95	L	40.3	Very low	46.6	Very low	99 Å²	99	120 Å²	120	52%	0.518	60%	0.604	S	S	.	*	H	α-helix	trans	-76	-36.7	172.6	-169.8	72.4	0	0	0	111	K91 E93 M99	K91-L95 VanDerWaalsContact O-CB 3.31Å; K91-L95 WeakPolarHBondContact O-CB 3.4Å; K91-L95 PolarHBondContact O-N 3.3Å; E93-L95 PolarHBondContact O-N 2.95Å; L95-M99 VanDerWaalsContact O-CB 3.25Å; L95-M99 WeakPolarHBondContact O-CB 3.48Å; L95-M99 PolarHBondContact O-N 3.13Å
96	M	43.6	Very low	46.1	Very low	112 Å²	112	118.1 Å²	118.1	55%	0.552	59%	0.591	S	S	*	*	H	α-helix	trans	-71.3	-36	-178.2	-152.8	174.8	-57.4	0	0	112.4	Q92 E93 M99 T100	Q92-M96 WeakPolarHBondContact O-CB 3.49Å; Q92-M96 PolarHBondContact O-N 3.25Å; Q92-M96 VanDerWaalsContact O-N 3.12Å; E93-M96 PolarHBondContact O-N 3.05Å; E93-M96 VanDerWaalsContact O-N 3.12Å; M96-M99 WeakPolarHBondContact O-CB 3.31Å; M96-M99 PolarHBondContact O-N 3.42Å; M96-T100 WeakPolarHBondContact O-CG2 3.4Å; M96-T100 PolarHBondContact O-N 2.83Å; M96-T100 PolarHBondContact O-OG1 2.99Å
97	E	51.5	Low	46.2	Very low	149 Å²	149	119 Å²	119	70%	0.696	59%	0.587	S	S	*	*	H	α-helix	trans	-72.7	-31.7	176.7	-159.9	175.5	-163.7	0	0	112.8	E93 T100 R101	E93-E97 PolarHBondContact O-N 2.73Å; E93-E97 VanDerWaalsContact O-N 3.15Å; E97-T100 PolarHBondContact O-OG1 3.5Å; E97-T100 VanDerWaalsContact O-OG1 3.11Å; E97-R101 PolarHBondContact O-N 3.04Å
98	N	49	Very low	46.5	Very low	110 Å²	110	120.9 Å²	120.9	59%	0.588	60%	0.595	S	S	*	*	H	α-helix	trans	-75.6	-28.2	168.2	-85	-30.4	0	0	0	112.5	M102	N98-M102 VanDerWaalsContact O-CB 3.29Å; N98-M102 WeakPolarHBondContact O-CB 3.4Å; N98-M102 PolarHBondContact O-N 3.39Å; N98-M102 VanDerWaalsContact O-N 3.11Å
99	M	39.5	Very low	46.5	Very low	114 Å²	114	121.7 Å²	121.7	56%	0.562	59%	0.592	S	S	*	*	H	α-helix	trans	-71.4	-41.7	176.7	-156.7	85.5	165.9	0	0	111.4	L95 M96 M102 E103	L95-M99 VanDerWaalsContact O-CB 3.25Å; L95-M99 WeakPolarHBondContact O-CB 3.48Å; L95-M99 PolarHBondContact O-N 3.13Å; M96-M99 WeakPolarHBondContact O-CB 3.31Å; M96-M99 PolarHBondContact O-N 3.42Å; M99-M102 CarbonylContact O-C 3.52Å; M99-M102 WeakPolarHBondContact O-CB 3.44Å; M99-M102 PolarHBondContact O-N 3.03Å; M99-E103 VanDerWaalsContact O-CB 3.3Å; M99-E103 WeakPolarHBondContact O-CB 3.39Å; M99-E103 PolarHBondContact O-N 3.12Å
100	T	47.7	Very low	46	Very low	67 Å²	67	122.8 Å²	122.8	41%	0.411	59%	0.586	S	S	.	*	H	α-helix	trans	-69.3	-36	178.5	51.5	0	0	0	0	112.4	M96 E97 M102 E103 D104	M96-T100 WeakPolarHBondContact O-CG2 3.4Å; M96-T100 PolarHBondContact O-N 2.83Å; M96-T100 PolarHBondContact O-OG1 2.99Å; E97-T100 PolarHBondContact O-OG1 3.5Å; E97-T100 VanDerWaalsContact O-OG1 3.11Å; T100-M102 VanDerWaalsContact C-N 3.31Å; T100-M102 PolarHBondContact O-N 2.94Å; T100-E103 WeakPolarHBondContact O-CB 3.3Å; T100-E103 PolarHBondContact O-N 3.41Å; T100-D104 PolarHBondContact O-N 2.8Å
101	R	50.3	Low	46.1	Very low	185 Å²	185	122.5 Å²	122.5	70%	0.698	59%	0.585	S	S	*	*	H	α-helix	trans	-69.8	-29.2	172.8	-163.7	174.5	-176.4	166	0.7	112.8	E97 R105	E97-R101 PolarHBondContact O-N 3.04Å; R101-R105 PolarHBondContact O-N 2.99Å
102	M	39.8	Very low	46	Very low	105 Å²	105	118.5 Å²	118.5	52%	0.517	58%	0.579	S	S	.	*	H	α-helix	trans	-75.7	-30.8	170.5	-161.3	-171	-48.3	0	0	111.4	N98 M99 T100 S106	N98-M102 VanDerWaalsContact O-CB 3.29Å; N98-M102 WeakPolarHBondContact O-CB 3.4Å; N98-M102 PolarHBondContact O-N 3.39Å; N98-M102 VanDerWaalsContact O-N 3.11Å; M99-M102 CarbonylContact O-C 3.52Å; M99-M102 WeakPolarHBondContact O-CB 3.44Å; M99-M102 PolarHBondContact O-N 3.03Å; T100-M102 VanDerWaalsContact C-N 3.31Å; T100-M102 PolarHBondContact O-N 2.94Å; M102-S106 WeakPolarHBondContact O-CA 3.25Å; M102-S106 WeakPolarHBondContact O-CB 3.22Å; M102-S106 PolarHBondContact O-N 2.76Å
103	E	42.9	Very low	45.9	Very low	124 Å²	124	118.7 Å²	118.7	58%	0.579	58%	0.582	S	S	*	*	H	α-helix	trans	-71.4	-37.1	177	-159.1	171.4	-168.7	0	0	112	M99 T100 S106 R107	M99-E103 VanDerWaalsContact O-CB 3.3Å; M99-E103 WeakPolarHBondContact O-CB 3.39Å; M99-E103 PolarHBondContact O-N 3.12Å; T100-E103 WeakPolarHBondContact O-CB 3.3Å; T100-E103 PolarHBondContact O-N 3.41Å; E103-S106 CarbonylContact O-C 3.57Å; E103-S106 WeakPolarHBondContact O-CB 3.33Å; E103-S106 PolarHBondContact O-N 3.23Å; E103-R107 WeakPolarHBondContact O-CB 3.33Å; E103-R107 PolarHBondContact O-N 2.76Å
104	D	50.1	Low	45.6	Very low	105 Å²	105	114.5 Å²	114.5	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-70.6	-40.3	173.2	-81.4	-22.4	0	0	0	112.4	T100 S106 R107 E108	T100-D104 PolarHBondContact O-N 2.8Å; D104-S106 VanDerWaalsContact C-N 3.33Å; D104-R107 WeakPolarHBondContact O-CB 3.38Å; D104-R107 PolarHBondContact O-N 3.44Å; D104-E108 PolarHBondContact O-N 2.72Å; D104-E108 VanDerWaalsContact O-N 3.08Å
105	R	51.3	Low	45.5	Very low	163 Å²	163	119 Å²	119	62%	0.615	60%	0.596	S	S	*	*	H	α-helix	trans	-66.2	-35.1	169.4	-89.5	-178.5	172.5	174.9	-3.1	112.4	R101 R107 L109	R101-R105 PolarHBondContact O-N 2.99Å; R105-R107 VanDerWaalsContact C-N 3.28Å; R105-L109 WeakPolarHBondContact O-CB 3.34Å; R105-L109 PolarHBondContact O-N 2.95Å
106	S	42	Very low	45.7	Very low	52 Å²	52	119.5 Å²	119.5	36%	0.364	60%	0.598	S	S	.	*	H	α-helix	trans	-64.3	-35	172.1	-176	0	0	0	0	110.7	M102 E103 D104 L109 Q110	M102-S106 WeakPolarHBondContact O-CA 3.25Å; M102-S106 WeakPolarHBondContact O-CB 3.22Å; M102-S106 PolarHBondContact O-N 2.76Å; E103-S106 CarbonylContact O-C 3.57Å; E103-S106 WeakPolarHBondContact O-CB 3.33Å; E103-S106 PolarHBondContact O-N 3.23Å; D104-S106 VanDerWaalsContact C-N 3.33Å; S106-L109 CarbonylContact O-C 3.55Å; S106-L109 PolarHBondContact O-N 3.1Å; S106-Q110 VanDerWaalsContact O-CB 3.25Å; S106-Q110 WeakPolarHBondContact O-CB 3.3Å; S106-Q110 PolarHBondContact O-N 3.13Å
107	R	48.8	Very low	45.7	Very low	177 Å²	177	118.6 Å²	118.6	67%	0.668	60%	0.603	S	S	*	*	H	α-helix	trans	-72.2	-38	178.5	-123.6	174.4	176.2	173	-0	113	E103 D104 R105 Q110 Q111	E103-R107 WeakPolarHBondContact O-CB 3.33Å; E103-R107 PolarHBondContact O-N 2.76Å; D104-R107 WeakPolarHBondContact O-CB 3.38Å; D104-R107 PolarHBondContact O-N 3.44Å; R105-R107 VanDerWaalsContact C-N 3.28Å; R107-Q110 WeakPolarHBondContact O-CB 3.46Å; R107-Q110 PolarHBondContact O-N 2.87Å; R107-Q111 PolarHBondContact O-N 3.23Å
108	E	51.3	Low	45.9	Very low	143 Å²	143	114.7 Å²	114.7	67%	0.668	59%	0.592	S	S	*	*	H	α-helix	trans	-67.7	-39.4	170.8	-74.7	-179.8	161	0	0	111.3	D104 Q111 S112	D104-E108 PolarHBondContact O-N 2.72Å; D104-E108 VanDerWaalsContact O-N 3.08Å; E108-Q111 PolarHBondContact O-N 3.49Å; E108-S112 PolarHBondContact O-N 3Å; E108-S112 VanDerWaalsContact O-N 3.1Å
109	L	43.4	Very low	45.6	Very low	104 Å²	104	117.3 Å²	117.3	55%	0.545	60%	0.601	S	S	.	*	H	α-helix	trans	-63.9	-39.4	168.9	-86.1	157.7	0	0	0	111.8	R105 S106 Q111 S112 L113	R105-L109 WeakPolarHBondContact O-CB 3.34Å; R105-L109 PolarHBondContact O-N 2.95Å; S106-L109 CarbonylContact O-C 3.55Å; S106-L109 PolarHBondContact O-N 3.1Å; L109-Q111 PolarHBondContact O-N 2.99Å; L109-S112 CarbonylContact O-C 3.47Å; L109-S112 WeakPolarHBondContact O-CA 3.43Å; L109-S112 PolarHBondContact O-N 3.22Å; L109-S112 VanDerWaalsContact O-N 3.12Å; L109-S112 PolarHBondContact O-OG 3.24Å; L109-L113 VanDerWaalsContact O-CB 3.28Å; L109-L113 WeakPolarHBondContact O-CB 3.44Å; L109-L113 WeakPolarHBondContact O-CD1 3.45Å; L109-L113 PolarHBondContact O-N 3.29Å
110	Q	42	Very low	46.2	Very low	121 Å²	121	115.4 Å²	115.4	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-65.7	-35.5	178	-145.5	108.8	-13.3	0	0	112.2	S106 R107 L113 G114	S106-Q110 VanDerWaalsContact O-CB 3.25Å; S106-Q110 WeakPolarHBondContact O-CB 3.3Å; S106-Q110 PolarHBondContact O-N 3.13Å; R107-Q110 WeakPolarHBondContact O-CB 3.46Å; R107-Q110 PolarHBondContact O-N 2.87Å; Q110-L113 CarbonylContact O-C 3.33Å; Q110-L113 PolarHBondContact O-N 3.15Å; Q110-G114 PolarHBondContact O-N 2.92Å
111	Q	47.3	Very low	46.6	Very low	166 Å²	166	115.7 Å²	115.7	78%	0.776	60%	0.602	S	S	*	*	H	α-helix	trans	-71.1	-31.8	172.2	-86.1	-179.3	-17.2	0	0	112	R107 E108 L109	R107-Q111 PolarHBondContact O-N 3.23Å; E108-Q111 PolarHBondContact O-N 3.49Å; L109-Q111 PolarHBondContact O-N 2.99Å
112	S	44.7	Very low	46.5	Very low	90 Å²	90	112.1 Å²	112.1	63%	0.629	60%	0.596	S	S	*	*	H	α-helix	trans	-75.9	-24.1	170	84.6	0	0	0	0	113.4	E108 L109 G114	E108-S112 PolarHBondContact O-N 3Å; E108-S112 VanDerWaalsContact O-N 3.1Å; L109-S112 CarbonylContact O-C 3.47Å; L109-S112 WeakPolarHBondContact O-CA 3.43Å; L109-S112 PolarHBondContact O-N 3.22Å; L109-S112 VanDerWaalsContact O-N 3.12Å; L109-S112 PolarHBondContact O-OG 3.24Å; S112-G114 VanDerWaalsContact C-N 3.26Å; S112-G114 PolarHBondContact O-N 3.32Å
113	L	41.5	Very low	47.1	Very low	88 Å²	88	113.3 Å²	113.3	46%	0.461	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	20.8	173.4	-83.5	150.7	0	0	0	112.3	L109 Q110 D115 I116	L109-L113 VanDerWaalsContact O-CB 3.28Å; L109-L113 WeakPolarHBondContact O-CB 3.44Å; L109-L113 WeakPolarHBondContact O-CD1 3.45Å; L109-L113 PolarHBondContact O-N 3.29Å; Q110-L113 CarbonylContact O-C 3.33Å; Q110-L113 PolarHBondContact O-N 3.15Å; L113-D115 PolarHBondContact O-N 3.27Å; L113-I116 HydrophobicContact CD2-CD1 3.32Å; L113-I116 HydrophobicContact CD2-CG1 3.89Å; L113-I116 PolarHBondContact O-N 3.43Å
114	G	43.5	Very low	48.1	Very low	68 Å²	68	111.9 Å²	111.9	70%	0.701	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	15.9	173.9	0	0	0	0	0	115.3	Q110 S112	Q110-G114 PolarHBondContact O-N 2.92Å; S112-G114 VanDerWaalsContact C-N 3.26Å; S112-G114 PolarHBondContact O-N 3.32Å
115	D	45.4	Very low	48.4	Very low	158 Å²	158	110.1 Å²	110.1	85%	0.845	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	7.4	178	-123.2	2.2	0	0	0	113.4	L113 S117	L113-D115 PolarHBondContact O-N 3.27Å; D115-S117 PolarHBondContact O-N 3.49Å
116	I	43.6	Very low	48.8	Very low	109 Å²	109	106.9 Å²	106.9	56%	0.559	58%	0.582	S	S	*	*			trans	-94.8	95	175.2	-53.2	-168.7	0	0	0	111.4	L113 S118	L113-I116 HydrophobicContact CD2-CD1 3.32Å; L113-I116 HydrophobicContact CD2-CG1 3.89Å; L113-I116 PolarHBondContact O-N 3.43Å; I116-S118 VanDerWaalsContact CG2-OG 3.29Å; I116-S118 WeakPolarHBondContact CG2-OG 3.44Å; I116-S118 PolarHBondContact O-N 3.12Å
117	S	43.8	Very low	49.9	Very low	93 Å²	93	112.6 Å²	112.6	65%	0.65	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-33.7	-1.5	161.6	-178	0	0	0	0	119.7	D115	D115-S117 PolarHBondContact O-N 3.49Å
118	S	55	Low	50.5	Low	67 Å²	67	108.8 Å²	108.8	47%	0.469	58%	0.584	S	S	.	*	H	α-helix	trans	-97.3	-9.1	-156.4	66.4	0	0	0	0	117.7	I116 L122	I116-S118 VanDerWaalsContact CG2-OG 3.29Å; I116-S118 WeakPolarHBondContact CG2-OG 3.44Å; I116-S118 PolarHBondContact O-N 3.12Å; S118-L122 PolarHBondContact O-N 3.31Å
119	Q	44.5	Very low	50.8	Low	165 Å²	165	105 Å²	105	77%	0.771	57%	0.567	S	S	*	*	H	α-helix	trans	-80.8	-27.5	-178.4	-162	171.9	-15.1	0	0	113.1
120	A	52	Low	51.4	Low	74 Å²	74	105.6 Å²	105.6	61%	0.612	57%	0.568	S	S	*	*	H	α-helix	trans	-71	-39.7	169.7	0	0	0	0	0	111.3	L122 L123 E124	A120-L122 VanDerWaalsContact C-N 3.35Å; A120-L122 PolarHBondContact O-N 2.82Å; A120-L123 PolarHBondContact O-N 2.95Å; A120-E124 WeakPolarHBondContact O-CB 3.44Å; A120-E124 PolarHBondContact O-N 3.23Å; A120-E124 VanDerWaalsContact O-N 3.11Å
121	D	55.3	Low	52.6	Low	72 Å²	72	102.7 Å²	102.7	39%	0.385	56%	0.561	S	S	.	*	H	α-helix	trans	-64.1	-36.7	179.2	-68	-24.9	0	0	0	112.6	E124 N125	D121-E124 PolarHBondContact O-N 3.01Å; D121-N125 VanDerWaalsContact O-CB 3.31Å; D121-N125 WeakPolarHBondContact O-CB 3.44Å; D121-N125 PolarHBondContact O-N 3.35Å; D121-N125 PolarHBondContact O-ND2 3.36Å
122	L	48	Very low	53.3	Low	111 Å²	111	96.9 Å²	96.9	58%	0.581	54%	0.535	S	S	*	.	H	α-helix	trans	-64.6	-45.6	178.6	-166.2	85.8	0	0	0	111.8	S118 A120 E124 N125 I126	S118-L122 PolarHBondContact O-N 3.31Å; A120-L122 VanDerWaalsContact C-N 3.35Å; A120-L122 PolarHBondContact O-N 2.82Å; L122-E124 VanDerWaalsContact C-N 3.34Å; L122-N125 PolarHBondContact O-N 3.15Å; L122-I126 HydrophobicContact CD2-CD1 4.45Å; L122-I126 HydrophobicContact CG-CD1 4.3Å; L122-I126 VanDerWaalsContact O-CG1 3.29Å; L122-I126 WeakPolarHBondContact O-CG1 3.13Å; L122-I126 PolarHBondContact O-N 2.97Å
123	L	52.8	Low	53.8	Low	130 Å²	130	99 Å²	99	68%	0.681	53%	0.533	S	S	*	.	H	α-helix	trans	-67.4	-38.1	-179.5	-137.9	96.3	0	0	0	111.2	A120 I126 W127	A120-L123 PolarHBondContact O-N 2.95Å; L123-I126 PolarHBondContact O-N 3.29Å; L123-W127 PolarHBondContact O-N 2.93Å
124	E	64.8	Low	54.8	Low	94 Å²	94	100.2 Å²	100.2	44%	0.439	54%	0.536	S	S	.	.	H	α-helix	trans	-64.7	-40.5	174.9	-172.5	176.9	159.4	0	0	111.9	A120 D121 L122 W127 K128	A120-E124 WeakPolarHBondContact O-CB 3.44Å; A120-E124 PolarHBondContact O-N 3.23Å; A120-E124 VanDerWaalsContact O-N 3.11Å; D121-E124 PolarHBondContact O-N 3.01Å; L122-E124 VanDerWaalsContact C-N 3.34Å; E124-W127 PolarHBondContact O-N 3.28Å; E124-K128 HydrophobicContact CG-CD 4.42Å; E124-K128 WeakPolarHBondContact O-CG 3.06Å; E124-K128 PolarHBondContact O-N 3.48Å; E124-K128 VanDerWaalsContact OE1-CE 3.25Å; E124-K128 WeakPolarHBondContact OE1-CE 3.41Å; E124-K128 IonicContact OE1-NZ 2.87Å; E124-K128 PolarHBondContact OE1-NZ 3.47Å
125	N	56.3	Low	55.9	Low	68 Å²	68	102.1 Å²	102.1	36%	0.364	53%	0.53	S	S	.	.	H	α-helix	trans	-66.4	-38.8	175.9	-75.1	-41.9	0	0	0	112.4	D121 L122 K128 L129	D121-N125 VanDerWaalsContact O-CB 3.31Å; D121-N125 WeakPolarHBondContact O-CB 3.44Å; D121-N125 PolarHBondContact O-N 3.35Å; D121-N125 PolarHBondContact O-ND2 3.36Å; L122-N125 PolarHBondContact O-N 3.15Å; N125-K128 PolarHBondContact O-N 3.4Å; N125-L129 PolarHBondContact O-N 2.91Å
126	I	58	Low	56.7	Low	94 Å²	94	95.5 Å²	95.5	48%	0.482	49%	0.494	S	S	.	.	H	α-helix	trans	-62.6	-45.5	175.2	-69.7	165.3	0	0	0	110.5	L122 L123 K128 L129 E130	L122-I126 HydrophobicContact CD2-CD1 4.45Å; L122-I126 HydrophobicContact CG-CD1 4.3Å; L122-I126 VanDerWaalsContact O-CG1 3.29Å; L122-I126 WeakPolarHBondContact O-CG1 3.13Å; L122-I126 PolarHBondContact O-N 2.97Å; L123-I126 PolarHBondContact O-N 3.29Å; I126-K128 PolarHBondContact O-N 2.7Å; I126-L129 WeakPolarHBondContact O-CB 3.19Å; I126-L129 PolarHBondContact O-N 3.47Å; I126-E130 PolarHBondContact O-N 3.23Å
127	W	66.2	Low	57.9	Low	173 Å²	173	92.6 Å²	92.6	66%	0.655	48%	0.483	S	S	*	.	H	α-helix	trans	-64.5	-40.4	178.7	-173.9	82.4	0	0	0	112.6	L123 E124 L129 E130 S131	L123-W127 PolarHBondContact O-N 2.93Å; E124-W127 PolarHBondContact O-N 3.28Å; W127-L129 VanDerWaalsContact C-N 3.33Å; W127-L129 PolarHBondContact O-N 3.36Å; W127-E130 PolarHBondContact O-N 3.12Å; W127-S131 WeakPolarHBondContact O-CB 3.5Å; W127-S131 PolarHBondContact O-N 2.76Å
128	K	61.7	Low	59.2	Low	97 Å²	97	91.8 Å²	91.8	42%	0.422	47%	0.469	S	S	.	.	H	α-helix	trans	-61.1	-40.9	174.4	-76.3	172.7	-176.1	165.3	0	112.1	E124 N125 I126 S131 L132	E124-K128 HydrophobicContact CG-CD 4.42Å; E124-K128 WeakPolarHBondContact O-CG 3.06Å; E124-K128 PolarHBondContact O-N 3.48Å; E124-K128 VanDerWaalsContact OE1-CE 3.25Å; E124-K128 WeakPolarHBondContact OE1-CE 3.41Å; E124-K128 IonicContact OE1-NZ 2.87Å; E124-K128 PolarHBondContact OE1-NZ 3.47Å; N125-K128 PolarHBondContact O-N 3.4Å; I126-K128 PolarHBondContact O-N 2.7Å; K128-S131 PolarHBondContact O-N 3.3Å; K128-L132 WeakPolarHBondContact O-CB 3.46Å; K128-L132 PolarHBondContact O-N 3.41Å
129	L	56.8	Low	59.7	Low	62 Å²	62	90.1 Å²	90.1	33%	0.325	46%	0.458	S	S	.	.	H	α-helix	trans	-63.7	-45.3	175.3	-106.4	134.8	0	0	0	111.9	N125 I126 W127 S131 L132 F133	N125-L129 PolarHBondContact O-N 2.91Å; I126-L129 WeakPolarHBondContact O-CB 3.19Å; I126-L129 PolarHBondContact O-N 3.47Å; W127-L129 VanDerWaalsContact C-N 3.33Å; W127-L129 PolarHBondContact O-N 3.36Å; L129-S131 VanDerWaalsContact C-N 3.34Å; L129-S131 PolarHBondContact O-N 2.91Å; L129-L132 WeakPolarHBondContact O-CB 3.37Å; L129-L132 PolarHBondContact O-N 3.07Å; L129-F133 HydrophobicContact CD2-CD2 4.25Å; L129-F133 HydrophobicContact CD2-CE2 3.55Å; L129-F133 HydrophobicContact CD2-CZ 4.38Å; L129-F133 WeakPolarHBondContact O-CD2 3.4Å; L129-F133 PolarHBondContact O-N 3.4Å
130	E	57.2	Low	60.5	Low	118 Å²	118	86.9 Å²	86.9	55%	0.551	45%	0.445	S	S	*	.	H	α-helix	trans	-63.2	-40.7	178.2	-170.1	166.7	-170.4	0	0	111.8	I126 W127 F133 Q134	I126-E130 PolarHBondContact O-N 3.23Å; W127-E130 PolarHBondContact O-N 3.12Å; E130-F133 PolarHBondContact O-N 3.38Å; E130-Q134 WeakPolarHBondContact O-CG 3.27Å; E130-Q134 PolarHBondContact O-N 2.92Å
131	S	66.8	Low	61.4	Low	60 Å²	60	88.3 Å²	88.3	42%	0.42	44%	0.437	S	S	.	.	H	α-helix	trans	-61.2	-43.3	173.5	-175.9	0	0	0	0	112.3	W127 K128 L129 Q134 N135	W127-S131 WeakPolarHBondContact O-CB 3.5Å; W127-S131 PolarHBondContact O-N 2.76Å; K128-S131 PolarHBondContact O-N 3.3Å; L129-S131 VanDerWaalsContact C-N 3.34Å; L129-S131 PolarHBondContact O-N 2.91Å; S131-Q134 PolarHBondContact O-N 3.4Å; S131-N135 WeakPolarHBondContact O-CB 3.34Å; S131-N135 PolarHBondContact O-N 3.08Å
132	L	60.8	Low	62.1	Low	43 Å²	43	90.2 Å²	90.2	23%	0.225	44%	0.444	C	S	.	.	H	α-helix	trans	-61.4	-45.8	176	-102.9	165.5	0	0	0	112.6	K128 L129 Q134 N135 H136 D238 H242	K128-L132 WeakPolarHBondContact O-CB 3.46Å; K128-L132 PolarHBondContact O-N 3.41Å; L129-L132 WeakPolarHBondContact O-CB 3.37Å; L129-L132 PolarHBondContact O-N 3.07Å; L132-Q134 VanDerWaalsContact C-N 3.33Å; L132-Q134 PolarHBondContact O-N 3.05Å; L132-N135 PolarHBondContact O-N 3.26Å; L132-H136 PolarHBondContact O-N 3.26Å; L132-H136 PolarHBondContact O-ND1 3.31Å; L132-D238 HydrophobicContact CD2-CB 4.17Å; L132-D238 WeakPolarHBondContact CD2-OD2 3.47Å; L132-H242 WeakPolarHBondContact CD1-NE2 3.45Å
133	F	55.4	Low	62.9	Low	135 Å²	135	86.6 Å²	86.6	59%	0.592	43%	0.425	S	S	*	.	H	α-helix	trans	-62.8	-39.4	176.9	-81.7	-64.6	0	0	0	112.5	L129 E130 N135 S137	L129-F133 HydrophobicContact CD2-CD2 4.25Å; L129-F133 HydrophobicContact CD2-CE2 3.55Å; L129-F133 HydrophobicContact CD2-CZ 4.38Å; L129-F133 WeakPolarHBondContact O-CD2 3.4Å; L129-F133 PolarHBondContact O-N 3.4Å; E130-F133 PolarHBondContact O-N 3.38Å; F133-N135 VanDerWaalsContact C-N 3.34Å; F133-S137 WeakPolarHBondContact O-CB 2.99Å; F133-S137 PolarHBondContact O-N 2.76Å
134	Q	63.6	Low	63.4	Low	113 Å²	113	82.1 Å²	82.1	53%	0.528	41%	0.41	S	S	.	.	H	α-helix	trans	-64.7	-39.6	175.2	-70.6	-65.9	-12	0	0	111.9	E130 S131 L132 S137 E138	E130-Q134 WeakPolarHBondContact O-CG 3.27Å; E130-Q134 PolarHBondContact O-N 2.92Å; S131-Q134 PolarHBondContact O-N 3.4Å; L132-Q134 VanDerWaalsContact C-N 3.33Å; L132-Q134 PolarHBondContact O-N 3.05Å; Q134-S137 WeakPolarHBondContact O-CB 3.33Å; Q134-S137 PolarHBondContact O-N 3.37Å; Q134-E138 PolarHBondContact O-N 2.8Å
135	N	64.9	Low	63.9	Low	108 Å²	108	85.1 Å²	85.1	58%	0.578	42%	0.418	S	S	*	.	H	α-helix	trans	-69.3	-40	179.8	-145.9	15.1	0	0	0	112.1	S131 L132 F133 S137 E138 S139	S131-N135 WeakPolarHBondContact O-CB 3.34Å; S131-N135 PolarHBondContact O-N 3.08Å; L132-N135 PolarHBondContact O-N 3.26Å; F133-N135 VanDerWaalsContact C-N 3.34Å; N135-S137 VanDerWaalsContact C-N 3.34Å; N135-E138 PolarHBondContact O-N 2.71Å; N135-S139 PolarHBondContact O-N 3.38Å; N135-S139 PolarHBondContact O-OG 2.96Å
136	H	62.8	Low	64.3	Low	20 Å²	20	83.5 Å²	83.5	9%	0.093	41%	0.414	C	S	.	.	H	α-helix	trans	-64.3	-38	171.4	-72.3	149.1	0	0	0	112.3	L132 S139 L140 F235 D238	L132-H136 PolarHBondContact O-N 3.26Å; L132-H136 PolarHBondContact O-ND1 3.31Å; H136-S139 PolarHBondContact O-N 3.07Å; H136-L140 WeakPolarHBondContact O-CB 3.5Å; H136-L140 WeakPolarHBondContact O-CG 3.03Å; H136-L140 PolarHBondContact O-N 3.42Å; H136-F235 HydrophobicContact CB-CD2 4.43Å; H136-F235 HydrophobicContact CB-CE2 4.41Å; H136-F235 AromaticContact CD2-CD2 3.96Å; H136-F235 AromaticContact CE1-CD2 3.61Å; H136-F235 AromaticContact CG-CD2 3.77Å; H136-F235 AromaticContact ND1-CD2 3.54Å; H136-F235 AromaticContact ND1-CE2 3.77Å; H136-F235 AromaticContact NE2-CD2 3.85Å; H136-D238 IonicContact CE1-OD2 2.94Å; H136-D238 PolarHBondContact CE1-OD2 3.23Å; H136-D238 IonicContact NE2-OD2 2.65Å; H136-D238 PolarHBondContact NE2-OD2 3.01Å
137	S	69.8	Low	64.7	Low	47 Å²	47	81.8 Å²	81.8	33%	0.329	41%	0.407	S	S	.	.	H	α-helix	trans	-61.6	-45.4	174.9	-177.3	0	0	0	0	112.2	F133 Q134 N135 L140 K141	F133-S137 WeakPolarHBondContact O-CB 2.99Å; F133-S137 PolarHBondContact O-N 2.76Å; Q134-S137 WeakPolarHBondContact O-CB 3.33Å; Q134-S137 PolarHBondContact O-N 3.37Å; N135-S137 VanDerWaalsContact C-N 3.34Å; S137-L140 PolarHBondContact O-N 2.86Å; S137-K141 WeakPolarHBondContact O-CG 3.45Å; S137-K141 PolarHBondContact O-N 2.9Å
138	E	70.8	Confident	64.9	Low	77 Å²	77	76.3 Å²	76.3	36%	0.36	40%	0.396	S	S	.	.	H	α-helix	trans	-63.4	-41.2	175.5	-82.1	-59.1	131.2	0	0	112.5	Q134 N135 L140 K141 Q142	Q134-E138 PolarHBondContact O-N 2.8Å; N135-E138 PolarHBondContact O-N 2.71Å; E138-L140 PolarHBondContact O-N 3.32Å; E138-K141 WeakPolarHBondContact O-CB 3.06Å; E138-K141 PolarHBondContact O-N 3.29Å; E138-K141 IonicContact OE1-NZ 3.19Å; E138-K141 PolarHBondContact OE1-NZ 2.02Å; E138-Q142 WeakPolarHBondContact O-CG 3.43Å; E138-Q142 PolarHBondContact O-N 3.07Å
139	S	65.4	Low	65.3	Low	31 Å²	31	72.7 Å²	72.7	22%	0.217	38%	0.382	C	S	.	.	H	α-helix	trans	-63.2	-41.3	177.6	-56.1	0	0	0	0	111.9	N135 H136 Q142 L143	N135-S139 PolarHBondContact O-N 3.38Å; N135-S139 PolarHBondContact O-OG 2.96Å; H136-S139 PolarHBondContact O-N 3.07Å; S139-Q142 PolarHBondContact O-N 3.46Å; S139-L143 PolarHBondContact O-N 3.26Å
140	L	61.1	Low	65.8	Low	98 Å²	98	70.9 Å²	70.9	51%	0.513	37%	0.373	S	S	.	.	H	α-helix	trans	-66.2	-36	174.5	-72.1	170.3	0	0	0	112.6	H136 S137 E138 L143 G144	H136-L140 WeakPolarHBondContact O-CB 3.5Å; H136-L140 WeakPolarHBondContact O-CG 3.03Å; H136-L140 PolarHBondContact O-N 3.42Å; S137-L140 PolarHBondContact O-N 2.86Å; E138-L140 PolarHBondContact O-N 3.32Å; L140-L143 PolarHBondContact O-N 3.5Å; L140-G144 PolarHBondContact O-N 2.87Å
141	K	70.3	Confident	66.4	Low	103 Å²	103	70.1 Å²	70.1	45%	0.448	37%	0.369	S	S	.	.	H	α-helix	trans	-66.6	-37.8	173.2	-70.5	174.6	-158.6	165.6	0	112.2	S137 E138 R145	S137-K141 WeakPolarHBondContact O-CG 3.45Å; S137-K141 PolarHBondContact O-N 2.9Å; E138-K141 WeakPolarHBondContact O-CB 3.06Å; E138-K141 PolarHBondContact O-N 3.29Å; E138-K141 IonicContact OE1-NZ 3.19Å; E138-K141 PolarHBondContact OE1-NZ 2.02Å; K141-R145 WeakPolarHBondContact O-CG 3.36Å; K141-R145 PolarHBondContact O-N 3.06Å; K141-R145 VanDerWaalsContact O-N 3.09Å
142	Q	69.9	Low	66.8	Low	113 Å²	113	73.6 Å²	73.6	53%	0.528	37%	0.373	S	S	.	.	H	α-helix	trans	-64.4	-45.6	174.4	-74.1	-178.6	1.7	0	0	111	E138 S139 G144 R145 A146	E138-Q142 WeakPolarHBondContact O-CG 3.43Å; E138-Q142 PolarHBondContact O-N 3.07Å; S139-Q142 PolarHBondContact O-N 3.46Å; Q142-G144 PolarHBondContact O-N 2.81Å; Q142-R145 PolarHBondContact O-N 3.12Å; Q142-A146 PolarHBondContact O-N 2.04Å
143	L	64.8	Low	67.3	Low	34 Å²	34	73.7 Å²	73.7	18%	0.178	37%	0.374	C	S	.	.	H	α-helix	trans	-58.6	-45.9	174.6	-179.8	61.2	0	0	0	111.9	S139 L140 R145 A146 V147 V224 V228	S139-L143 PolarHBondContact O-N 3.26Å; L140-L143 PolarHBondContact O-N 3.5Å; L143-R145 VanDerWaalsContact C-N 3.32Å; L143-R145 PolarHBondContact O-N 2.8Å; L143-A146 PolarHBondContact O-N 2.89Å; L143-A146 VanDerWaalsContact O-N 3.15Å; L143-V147 HydrophobicContact CD1-CG2 4.22Å; L143-V147 HydrophobicContact CG-CG2 4.47Å; L143-V147 WeakPolarHBondContact O-CG2 3.45Å; L143-V147 PolarHBondContact O-N 3.33Å; L143-V224 HydrophobicContact CD1-CG1 4.12Å; L143-V228 HydrophobicContact CD1-CG2 3.41Å; L143-V228 VanDerWaalsContact CD1-CG2 3.41Å; L143-V228 HydrophobicContact CD2-CG2 4.01Å; L143-V228 HydrophobicContact CG-CG2 4.37Å
144	G	64.9	Low	67.9	Low	36 Å²	36	71 Å²	71	37%	0.371	37%	0.365	S	S	.	.	H	α-helix	trans	-58.1	-42.2	176.5	0	0	0	0	0	112.9	L140 Q142 S148	L140-G144 PolarHBondContact O-N 2.87Å; Q142-G144 PolarHBondContact O-N 2.81Å; G144-S148 WeakPolarHBondContact O-CB 3.43Å; G144-S148 PolarHBondContact O-N 3.41Å; G144-S148 PolarHBondContact O-OG 3.02Å; G144-S148 VanDerWaalsContact O-OG 3.13Å
145	R	74.6	Confident	68.4	Low	158 Å²	158	72.9 Å²	72.9	60%	0.596	37%	0.367	S	S	*	.	H	α-helix	trans	-63.2	-41.4	175.2	-76.3	-176.1	-79.6	-175.2	-6.3	112.3	K141 Q142 L143 S149	K141-R145 WeakPolarHBondContact O-CG 3.36Å; K141-R145 PolarHBondContact O-N 3.06Å; K141-R145 VanDerWaalsContact O-N 3.09Å; Q142-R145 PolarHBondContact O-N 3.12Å; L143-R145 VanDerWaalsContact C-N 3.32Å; L143-R145 PolarHBondContact O-N 2.8Å; R145-S149 PolarHBondContact O-N 3.04Å
146	A	64.4	Low	68.8	Low	34 Å²	34	72.4 Å²	72.4	28%	0.281	37%	0.365	S	S	.	.	H	α-helix	trans	-66.2	-45.5	179	0	0	0	0	0	111.6	Q142 L143 S148 S149 L150 V224	Q142-A146 PolarHBondContact O-N 2.04Å; L143-A146 PolarHBondContact O-N 2.89Å; L143-A146 VanDerWaalsContact O-N 3.15Å; A146-S148 PolarHBondContact O-N 3.08Å; A146-S149 WeakPolarHBondContact O-CB 3.35Å; A146-S149 PolarHBondContact O-N 2.9Å; A146-S149 VanDerWaalsContact O-N 3.12Å; A146-L150 PolarHBondContact O-N 2.95Å; A146-V224 HydrophobicContact CB-CG2 3.75Å
147	V	66.7	Low	69.1	Low	57 Å²	57	72.6 Å²	72.6	35%	0.345	37%	0.366	S	S	.	.	H	α-helix	trans	-61.3	-45.1	175.8	173.5	0	0	0	0	111.5	L143 S149 L150 E151	L143-V147 HydrophobicContact CD1-CG2 4.22Å; L143-V147 HydrophobicContact CG-CG2 4.47Å; L143-V147 WeakPolarHBondContact O-CG2 3.45Å; L143-V147 PolarHBondContact O-N 3.33Å; V147-S149 PolarHBondContact O-N 3.39Å; V147-L150 WeakPolarHBondContact O-CB 3.46Å; V147-L150 PolarHBondContact O-N 3.14Å; V147-L150 VanDerWaalsContact O-N 3.17Å; V147-E151 WeakPolarHBondContact O-CG 3.38Å; V147-E151 PolarHBondContact O-N 3.28Å
148	S	70.2	Confident	69.2	Low	59 Å²	59	75.9 Å²	75.9	41%	0.413	38%	0.377	S	S	.	.	H	α-helix	trans	-65.7	-23.9	176.1	-65.4	0	0	0	0	113.9	G144 A146 R152	G144-S148 WeakPolarHBondContact O-CB 3.43Å; G144-S148 PolarHBondContact O-N 3.41Å; G144-S148 PolarHBondContact O-OG 3.02Å; G144-S148 VanDerWaalsContact O-OG 3.13Å; A146-S148 PolarHBondContact O-N 3.08Å; S148-R152 PolarHBondContact O-NE 3.2Å
149	S	69.9	Low	69.4	Low	20 Å²	20	74 Å²	74	14%	0.14	38%	0.377	C	S	.	.	H	α-helix	trans	-72.5	-48.3	170.5	-161.9	0	0	0	0	110.6	R145 A146 V147 E151 R152 D153	R145-S149 PolarHBondContact O-N 3.04Å; A146-S149 WeakPolarHBondContact O-CB 3.35Å; A146-S149 PolarHBondContact O-N 2.9Å; A146-S149 VanDerWaalsContact O-N 3.12Å; V147-S149 PolarHBondContact O-N 3.39Å; S149-E151 VanDerWaalsContact C-N 3.31Å; S149-E151 PolarHBondContact O-N 3.47Å; S149-R152 WeakPolarHBondContact O-CB 3.32Å; S149-R152 PolarHBondContact O-N 3.22Å; S149-D153 PolarHBondContact O-N 3.43Å
150	L	66.4	Low	69.6	Low	24 Å²	24	75.2 Å²	75.2	13%	0.126	38%	0.38	C	S	.	.	H	α-helix	trans	-59.3	-41.2	178.7	-171	71.6	0	0	0	112.1	A146 V147 R152 D153 I154 L217 L221	A146-L150 PolarHBondContact O-N 2.95Å; V147-L150 WeakPolarHBondContact O-CB 3.46Å; V147-L150 PolarHBondContact O-N 3.14Å; V147-L150 VanDerWaalsContact O-N 3.17Å; L150-R152 VanDerWaalsContact C-N 3.27Å; L150-R152 PolarHBondContact O-N 3.46Å; L150-D153 PolarHBondContact O-N 2.89Å; L150-I154 HydrophobicContact CG-CD1 4.05Å; L150-I154 VanDerWaalsContact O-CG1 3.3Å; L150-I154 WeakPolarHBondContact O-CG1 3.29Å; L150-I154 PolarHBondContact O-N 3.06Å; L150-L217 HydrophobicContact CD1-CD1 3.81Å; L150-L217 HydrophobicContact CD1-CD2 4.38Å; L150-L217 HydrophobicContact CD1-CG 3.75Å; L150-L221 HydrophobicContact CD2-CD1 3.85Å
151	E	69.8	Low	70	Confident	102 Å²	102	74.1 Å²	74.1	48%	0.477	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-28.1	175.5	-77.4	-175.4	168.6	0	0	114.1	V147 S149 R155	V147-E151 WeakPolarHBondContact O-CG 3.38Å; V147-E151 PolarHBondContact O-N 3.28Å; S149-E151 VanDerWaalsContact C-N 3.31Å; S149-E151 PolarHBondContact O-N 3.47Å; E151-R155 WeakPolarHBondContact O-CG 3.36Å; E151-R155 PolarHBondContact O-N 3.02Å; E151-R155 PolarHBondContact O-NE 2.92Å; E151-R155 VanDerWaalsContact O-NE 3.08Å
152	R	76	Confident	70.2	Confident	134 Å²	134	75.3 Å²	75.3	51%	0.506	39%	0.386	S	S	.	.	H	α-helix	trans	-75.8	-46.7	174	-85.8	-179.4	-75.2	123.9	-4.6	110.4	S148 S149 L150 I154 R155 D156	S148-R152 PolarHBondContact O-NE 3.2Å; S149-R152 WeakPolarHBondContact O-CB 3.32Å; S149-R152 PolarHBondContact O-N 3.22Å; L150-R152 VanDerWaalsContact C-N 3.27Å; L150-R152 PolarHBondContact O-N 3.46Å; R152-I154 VanDerWaalsContact C-N 3.31Å; R152-I154 PolarHBondContact O-N 3.48Å; R152-R155 WeakPolarHBondContact O-CB 3.37Å; R152-R155 PolarHBondContact O-N 3.39Å; R152-R155 VanDerWaalsContact O-N 3.08Å; R152-D156 PolarHBondContact O-N 3.29Å
153	D	70.8	Confident	70.4	Confident	44 Å²	44	72.7 Å²	72.7	24%	0.235	38%	0.381	C	S	.	.	H	α-helix	trans	-62.8	-38.7	-179.2	-60.9	-18	0	0	0	111.4	S149 L150 D156 L157 L217 R220	S149-D153 PolarHBondContact O-N 3.43Å; L150-D153 PolarHBondContact O-N 2.89Å; D153-D156 PolarHBondContact O-N 2.86Å; D153-L157 WeakPolarHBondContact O-CB 3.36Å; D153-L157 PolarHBondContact O-N 3.02Å; D153-L217 HydrophobicContact CB-CD1 3.22Å; D153-R220 WeakPolarHBondContact OD2-CD 3.3Å; D153-R220 IonicContact OD2-NE 3.65Å
154	I	68	Low	70.6	Confident	79 Å²	79	72.1 Å²	72.1	41%	0.405	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-41.8	173.2	-70.4	169.2	0	0	0	111.6	L150 R152 L157 Q158 L217	L150-I154 HydrophobicContact CG-CD1 4.05Å; L150-I154 VanDerWaalsContact O-CG1 3.3Å; L150-I154 WeakPolarHBondContact O-CG1 3.29Å; L150-I154 PolarHBondContact O-N 3.06Å; R152-I154 VanDerWaalsContact C-N 3.31Å; R152-I154 PolarHBondContact O-N 3.48Å; I154-L157 PolarHBondContact O-N 3.38Å; I154-Q158 WeakPolarHBondContact O-CB 3.45Å; I154-Q158 PolarHBondContact O-N 2.93Å; I154-L217 HydrophobicContact CG1-CD1 4.22Å; I154-L217 HydrophobicContact CG1-CD2 3.94Å
155	R	74.6	Confident	71	Confident	152 Å²	152	75.7 Å²	75.7	57%	0.574	39%	0.389	S	S	*	.	H	α-helix	trans	-65.2	-41.4	177.6	-87.2	-176.9	-83.5	-172.2	-11.2	111.9	E151 R152 Q158 G159	E151-R155 WeakPolarHBondContact O-CG 3.36Å; E151-R155 PolarHBondContact O-N 3.02Å; E151-R155 PolarHBondContact O-NE 2.92Å; E151-R155 VanDerWaalsContact O-NE 3.08Å; R152-R155 WeakPolarHBondContact O-CB 3.37Å; R152-R155 PolarHBondContact O-N 3.39Å; R152-R155 VanDerWaalsContact O-N 3.08Å; R155-Q158 PolarHBondContact O-N 2.89Å; R155-G159 PolarHBondContact O-N 3.41Å
156	D	73.5	Confident	71	Confident	99 Å²	99	70.8 Å²	70.8	53%	0.529	38%	0.379	S	S	.	.	H	α-helix	trans	-64.4	-42.5	176.6	-78.2	-5.5	0	0	0	111.1	R152 D153 Q158 G159 H160	R152-D156 PolarHBondContact O-N 3.29Å; D153-D156 PolarHBondContact O-N 2.86Å; D156-Q158 VanDerWaalsContact C-N 3.34Å; D156-Q158 PolarHBondContact O-N 3.43Å; D156-G159 PolarHBondContact O-N 3.39Å; D156-H160 PolarHBondContact O-N 2.95Å; D156-H160 PolarHBondContact O-ND1 3.08Å
157	L	69.9	Low	71.3	Confident	24 Å²	24	70.8 Å²	70.8	13%	0.126	38%	0.375	C	S	.	.	H	α-helix	trans	-59.6	-43.1	173	-106.1	155	0	0	0	112.2	D153 I154 G159 H160 C161 Q213 V214 L217	D153-L157 WeakPolarHBondContact O-CB 3.36Å; D153-L157 PolarHBondContact O-N 3.02Å; I154-L157 PolarHBondContact O-N 3.38Å; L157-G159 VanDerWaalsContact C-N 3.3Å; L157-G159 PolarHBondContact O-N 3.35Å; L157-H160 PolarHBondContact O-N 3.03Å; L157-C161 PolarHBondContact O-N 3.01Å; L157-Q213 HydrophobicContact CD1-CB 4.49Å; L157-Q213 HydrophobicContact CG-CB 4.48Å; L157-V214 HydrophobicContact CD1-CG2 4.05Å; L157-V214 HydrophobicContact CD2-CG2 3.66Å; L157-L217 HydrophobicContact CD1-CB 4.5Å; L157-L217 HydrophobicContact CD1-CD1 4.32Å; L157-L217 HydrophobicContact CD1-CD2 4.25Å
158	Q	72.1	Confident	71.6	Confident	116 Å²	116	71.7 Å²	71.7	54%	0.542	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-38	177.3	-163.6	174.1	-0.2	0	0	111.7	I154 R155 D156 C161 Q162	I154-Q158 WeakPolarHBondContact O-CB 3.45Å; I154-Q158 PolarHBondContact O-N 2.93Å; R155-Q158 PolarHBondContact O-N 2.89Å; D156-Q158 VanDerWaalsContact C-N 3.34Å; D156-Q158 PolarHBondContact O-N 3.43Å; Q158-C161 PolarHBondContact O-N 3.36Å; Q158-Q162 WeakPolarHBondContact O-CG 3.45Å; Q158-Q162 PolarHBondContact O-N 2.96Å
159	G	73.9	Confident	72	Confident	36 Å²	36	74 Å²	74	37%	0.371	39%	0.385	S	S	.	.	H	α-helix	trans	-64.1	-42	172.6	0	0	0	0	0	113	R155 D156 L157 Q162 S163	R155-G159 PolarHBondContact O-N 3.41Å; D156-G159 PolarHBondContact O-N 3.39Å; L157-G159 VanDerWaalsContact C-N 3.3Å; L157-G159 PolarHBondContact O-N 3.35Å; G159-Q162 PolarHBondContact O-N 3.33Å; G159-S163 PolarHBondContact O-N 2.74Å
160	H	70.3	Confident	72.3	Confident	58 Å²	58	78.9 Å²	78.9	27%	0.269	41%	0.406	S	S	.	.	H	α-helix	trans	-64.7	-42.1	175.2	-75.9	78.9	0	0	0	111.9	D156 L157 Q162 S163 T164 T210	D156-H160 PolarHBondContact O-N 2.95Å; D156-H160 PolarHBondContact O-ND1 3.08Å; L157-H160 PolarHBondContact O-N 3.03Å; H160-Q162 PolarHBondContact O-N 2.97Å; H160-S163 PolarHBondContact O-N 3.22Å; H160-T164 WeakPolarHBondContact O-CB 3.27Å; H160-T164 PolarHBondContact O-N 2.98Å; H160-T164 PolarHBondContact O-OG1 3.17Å; H160-T210 HydrophobicContact CB-CG2 3.58Å
161	C	68.4	Low	72.6	Confident	75 Å²	75	79.1 Å²	79.1	51%	0.507	41%	0.407	S	S	.	.	H	α-helix	trans	-60.1	-44.4	174.9	-77.5	0	0	0	0	111.9	L157 Q158 S163 T164 D165	L157-C161 PolarHBondContact O-N 3.01Å; Q158-C161 PolarHBondContact O-N 3.36Å; C161-S163 PolarHBondContact O-N 3.31Å; C161-T164 WeakPolarHBondContact O-CB 3.08Å; C161-T164 PolarHBondContact O-N 3.28Å; C161-D165 PolarHBondContact O-N 3.21Å
162	Q	75.9	Confident	72.8	Confident	128 Å²	128	76.2 Å²	76.2	60%	0.598	41%	0.405	S	S	*	.	H	α-helix	trans	-63.4	-40.4	176.6	-72.9	175.3	2.2	0	0	112.7	Q158 G159 H160 T164 D165 S166	Q158-Q162 WeakPolarHBondContact O-CG 3.45Å; Q158-Q162 PolarHBondContact O-N 2.96Å; G159-Q162 PolarHBondContact O-N 3.33Å; H160-Q162 PolarHBondContact O-N 2.97Å; Q162-T164 VanDerWaalsContact C-N 3.33Å; Q162-D165 PolarHBondContact O-N 2.82Å; Q162-S166 PolarHBondContact O-N 3.27Å; Q162-S166 VanDerWaalsContact O-N 3.08Å
163	S	73.4	Confident	72.9	Confident	58 Å²	58	75 Å²	75	41%	0.406	41%	0.408	S	S	.	.	H	α-helix	trans	-62.6	-42.3	174.3	-173.6	0	0	0	0	111.5	G159 H160 C161 D165 S166 T167	G159-S163 PolarHBondContact O-N 2.74Å; H160-S163 PolarHBondContact O-N 3.22Å; C161-S163 PolarHBondContact O-N 3.31Å; S163-D165 VanDerWaalsContact C-N 3.34Å; S163-D165 PolarHBondContact O-N 3.13Å; S163-S166 PolarHBondContact O-N 2.8Å; S163-S166 PolarHBondContact O-OG 3.38Å; S163-T167 WeakPolarHBondContact O-CG2 3.36Å; S163-T167 PolarHBondContact O-N 2.78Å; S163-T167 VanDerWaalsContact O-N 3.12Å; S163-T167 PolarHBondContact O-OG1 2.92Å
164	T	69.6	Low	72.9	Confident	21 Å²	21	78.9 Å²	78.9	13%	0.129	42%	0.419	C	S	.	.	H	α-helix	trans	-63.2	-40.4	177.1	-50.1	0	0	0	0	111.4	H160 C161 Q162 T167 V168 H203 L207	H160-T164 WeakPolarHBondContact O-CB 3.27Å; H160-T164 PolarHBondContact O-N 2.98Å; H160-T164 PolarHBondContact O-OG1 3.17Å; C161-T164 WeakPolarHBondContact O-CB 3.08Å; C161-T164 PolarHBondContact O-N 3.28Å; Q162-T164 VanDerWaalsContact C-N 3.33Å; T164-T167 WeakPolarHBondContact CA-OG1 3.41Å; T164-T167 PolarHBondContact O-N 3.22Å; T164-T167 PolarHBondContact O-OG1 3.11Å; T164-V168 VanDerWaalsContact O-CG2 3.3Å; T164-V168 WeakPolarHBondContact O-CG2 3.34Å; T164-V168 PolarHBondContact O-N 2.66Å; T164-H203 WeakPolarHBondContact CG2-NE2 3.5Å; T164-H203 PolarHBondContact O-NE2 3.32Å; T164-L207 HydrophobicContact CG2-CD2 4.5Å
165	D	71.4	Confident	73.1	Confident	111 Å²	111	78.9 Å²	78.9	59%	0.594	42%	0.423	S	S	*	.	H	α-helix	trans	-66.3	-43.6	178.9	-144	23.7	0	0	0	111.6	C161 Q162 S163 T167 V168 E169	C161-D165 PolarHBondContact O-N 3.21Å; Q162-D165 PolarHBondContact O-N 2.82Å; S163-D165 VanDerWaalsContact C-N 3.34Å; S163-D165 PolarHBondContact O-N 3.13Å; D165-T167 VanDerWaalsContact C-N 3.3Å; D165-T167 PolarHBondContact O-N 2.77Å; D165-V168 PolarHBondContact O-N 2.74Å; D165-E169 PolarHBondContact O-N 3.1Å
166	S	75.1	Confident	73	Confident	56 Å²	56	73.3 Å²	73.3	39%	0.392	41%	0.408	S	S	.	.	H	α-helix	trans	-62.8	-35.7	177.2	74.3	0	0	0	0	113.2	Q162 S163 Q170	Q162-S166 PolarHBondContact O-N 3.27Å; Q162-S166 VanDerWaalsContact O-N 3.08Å; S163-S166 PolarHBondContact O-N 2.8Å; S163-S166 PolarHBondContact O-OG 3.38Å; S166-Q170 PolarHBondContact O-N 3.16Å; S166-Q170 VanDerWaalsContact O-N 3.15Å
167	T	71.5	Confident	73	Confident	33 Å²	33	72.6 Å²	72.6	20%	0.202	41%	0.406	C	S	.	.	H	α-helix	trans	-76.2	-33.6	178.1	47.9	0	0	0	0	111.5	S163 T164 D165 Q170 L171 H203	S163-T167 WeakPolarHBondContact O-CG2 3.36Å; S163-T167 PolarHBondContact O-N 2.78Å; S163-T167 VanDerWaalsContact O-N 3.12Å; S163-T167 PolarHBondContact O-OG1 2.92Å; T164-T167 WeakPolarHBondContact CA-OG1 3.41Å; T164-T167 PolarHBondContact O-N 3.22Å; T164-T167 PolarHBondContact O-OG1 3.11Å; D165-T167 VanDerWaalsContact C-N 3.3Å; D165-T167 PolarHBondContact O-N 2.77Å; T167-Q170 PolarHBondContact O-N 3.27Å; T167-L171 PolarHBondContact O-N 3.31Å; T167-H203 PolarHBondContact OG1-CE1 2.94Å; T167-H203 PolarHBondContact OG1-NE2 2.79Å; T167-H203 VanDerWaalsContact OG1-NE2 3.13Å
168	V	72.6	Confident	72.9	Confident	77 Å²	77	73.2 Å²	73.2	47%	0.467	41%	0.409	S	S	.	.	H	α-helix	trans	-66	-42.4	172.1	171.1	0	0	0	0	111	T164 D165 Q170 L171 G172	T164-V168 VanDerWaalsContact O-CG2 3.3Å; T164-V168 WeakPolarHBondContact O-CG2 3.34Å; T164-V168 PolarHBondContact O-N 2.66Å; D165-V168 PolarHBondContact O-N 2.74Å; V168-Q170 VanDerWaalsContact C-N 3.35Å; V168-Q170 PolarHBondContact O-N 3Å; V168-L171 PolarHBondContact O-N 2.86Å; V168-G172 PolarHBondContact O-N 2.93Å
169	E	77.8	Confident	72.7	Confident	106 Å²	106	74.5 Å²	74.5	50%	0.495	42%	0.42	S	S	.	.	H	α-helix	trans	-58	-46.3	173	-81.9	-165.8	146.6	0	0	111.1	R45 D165 L171 G172 D173	R45-E169 IonicContact CZ-OE1 3.95Å; R45-E169 IonicContact NH2-OE1 2.8Å; R45-E169 PolarHBondContact NH2-OE1 3.01Å; D165-E169 PolarHBondContact O-N 3.1Å; E169-L171 VanDerWaalsContact C-N 3.32Å; E169-L171 PolarHBondContact O-N 3.14Å; E169-G172 PolarHBondContact O-N 2.94Å; E169-D173 PolarHBondContact O-N 2.77Å
170	Q	77.7	Confident	72.5	Confident	123 Å²	123	82 Å²	82	58%	0.575	44%	0.438	S	S	*	.	H	α-helix	trans	-61.2	-37.7	175.7	-78	-175.8	-4.9	0	0	113.2	S166 T167 V168 R174	S166-Q170 PolarHBondContact O-N 3.16Å; S166-Q170 VanDerWaalsContact O-N 3.15Å; T167-Q170 PolarHBondContact O-N 3.27Å; V168-Q170 VanDerWaalsContact C-N 3.35Å; V168-Q170 PolarHBondContact O-N 3Å; Q170-R174 WeakPolarHBondContact O-CG 3.47Å; Q170-R174 PolarHBondContact O-N 2.83Å; Q170-R174 VanDerWaalsContact O-N 3.1Å
171	L	71.8	Confident	72.2	Confident	29 Å²	29	82.1 Å²	82.1	15%	0.152	45%	0.445	C	S	.	.	H	α-helix	trans	-67.4	-43.2	177	-150.2	91.5	0	0	0	110.8	T167 V168 E169 D173 R174 V175 S199 L200	T167-L171 PolarHBondContact O-N 3.31Å; V168-L171 PolarHBondContact O-N 2.86Å; E169-L171 VanDerWaalsContact C-N 3.32Å; E169-L171 PolarHBondContact O-N 3.14Å; L171-D173 PolarHBondContact O-N 2.87Å; L171-R174 PolarHBondContact O-N 2.87Å; L171-V175 WeakPolarHBondContact O-CG2 3.49Å; L171-V175 PolarHBondContact O-N 2.68Å; L171-S199 VanDerWaalsContact CD1-CB 3.45Å; L171-S199 VanDerWaalsContact CD1-OG 3.24Å; L171-S199 WeakPolarHBondContact CD1-OG 3.44Å; L171-L200 HydrophobicContact CD2-CD2 3.86Å; L171-L200 HydrophobicContact CD2-CG 4.03Å
172	G	74.4	Confident	71.6	Confident	41 Å²	41	85.4 Å²	85.4	42%	0.423	46%	0.463	S	S	.	.	H	α-helix	trans	-60.2	-42.9	175.7	0	0	0	0	0	112.5	V168 E169 R174 V175 S176	V168-G172 PolarHBondContact O-N 2.93Å; E169-G172 PolarHBondContact O-N 2.94Å; G172-R174 PolarHBondContact O-N 2.96Å; G172-V175 PolarHBondContact O-N 2.92Å; G172-S176 WeakPolarHBondContact O-CB 3.31Å; G172-S176 PolarHBondContact O-N 3.5Å
173	D	78.1	Confident	70.8	Confident	108 Å²	108	87.2 Å²	87.2	58%	0.578	47%	0.471	S	S	*	.	H	α-helix	trans	-61.6	-44.8	174.9	-79.9	-15.7	0	0	0	111.5	E169 L171 S176 V177	E169-D173 PolarHBondContact O-N 2.77Å; L171-D173 PolarHBondContact O-N 2.87Å; D173-S176 WeakPolarHBondContact O-CB 3.48Å; D173-S176 PolarHBondContact O-N 2.86Å; D173-S176 PolarHBondContact O-OG 3.07Å; D173-V177 WeakPolarHBondContact O-CG2 3.45Å; D173-V177 PolarHBondContact O-N 2.91Å
174	R	70.9	Confident	70.1	Confident	126 Å²	126	95.1 Å²	95.1	48%	0.475	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-42.4	176.9	-76.6	178.7	166.5	-177	-1.9	113	Q170 L171 G172 S176 V177 L178	Q170-R174 WeakPolarHBondContact O-CG 3.47Å; Q170-R174 PolarHBondContact O-N 2.83Å; Q170-R174 VanDerWaalsContact O-N 3.1Å; L171-R174 PolarHBondContact O-N 2.87Å; G172-R174 PolarHBondContact O-N 2.96Å; R174-S176 VanDerWaalsContact C-N 3.29Å; R174-S176 PolarHBondContact O-N 3.4Å; R174-V177 PolarHBondContact O-N 2.97Å; R174-L178 PolarHBondContact O-N 3.37Å
175	V	72.3	Confident	69.7	Low	80 Å²	80	99.7 Å²	99.7	49%	0.485	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-37	174.7	171.7	0	0	0	0	110.8	L171 G172 L178 N179	L171-V175 WeakPolarHBondContact O-CG2 3.49Å; L171-V175 PolarHBondContact O-N 2.68Å; G172-V175 PolarHBondContact O-N 2.92Å; V175-L178 WeakPolarHBondContact O-CB 3.23Å; V175-L178 PolarHBondContact O-N 2.92Å; V175-N179 WeakPolarHBondContact O-CB 3.43Å; V175-N179 PolarHBondContact O-N 3.39Å
176	S	73.2	Confident	69.3	Low	35 Å²	35	99.9 Å²	99.9	25%	0.245	52%	0.521	C	S	.	.	H	α-helix	trans	-66.9	-36.2	176.5	87.1	0	0	0	0	112.8	G172 D173 R174 N179 R180	G172-S176 WeakPolarHBondContact O-CB 3.31Å; G172-S176 PolarHBondContact O-N 3.5Å; D173-S176 WeakPolarHBondContact O-CB 3.48Å; D173-S176 PolarHBondContact O-N 2.86Å; D173-S176 PolarHBondContact O-OG 3.07Å; R174-S176 VanDerWaalsContact C-N 3.29Å; R174-S176 PolarHBondContact O-N 3.4Å; S176-N179 PolarHBondContact O-N 3.47Å; S176-R180 WeakPolarHBondContact O-CG 3.43Å; S176-R180 PolarHBondContact O-N 3.36Å; S176-R180 VanDerWaalsContact O-N 3.14Å
177	V	73	Confident	68.8	Low	83 Å²	83	101.1 Å²	101.1	50%	0.503	53%	0.529	S	S	.	.	H	α-helix	trans	-67.9	-43.6	174.9	170.4	0	0	0	0	110.8	D173 R174 N179 R180 S181	D173-V177 WeakPolarHBondContact O-CG2 3.45Å; D173-V177 PolarHBondContact O-N 2.91Å; R174-V177 PolarHBondContact O-N 2.97Å; V177-N179 VanDerWaalsContact C-N 3.31Å; V177-N179 PolarHBondContact O-N 2.91Å; V177-R180 PolarHBondContact O-N 2.91Å; V177-S181 PolarHBondContact O-N 3.35Å
178	L	67.1	Low	68.7	Low	37 Å²	37	101.2 Å²	101.2	19%	0.194	54%	0.536	C	S	.	.	H	α-helix	trans	-56.2	-44.2	172.9	-88.3	159.9	0	0	0	111.9	R174 V175 L189 Q192	R174-L178 PolarHBondContact O-N 3.37Å; V175-L178 WeakPolarHBondContact O-CB 3.23Å; V175-L178 PolarHBondContact O-N 2.92Å; L178-L189 HydrophobicContact CD2-CD2 3.58Å; L178-Q192 HydrophobicContact CD1-CB 4.26Å; L178-Q192 HydrophobicContact CD2-CB 3.7Å; L178-Q192 HydrophobicContact CG-CB 4.1Å
179	N	68	Low	68.4	Low	144 Å²	144	100.6 Å²	100.6	77%	0.77	53%	0.53	S	S	*	.	H	α-helix	trans	-71.7	-29.2	-177.9	-166.3	26.1	0	0	0	113.6	V175 S176 V177	V175-N179 WeakPolarHBondContact O-CB 3.43Å; V175-N179 PolarHBondContact O-N 3.39Å; S176-N179 PolarHBondContact O-N 3.47Å; V177-N179 VanDerWaalsContact C-N 3.31Å; V177-N179 PolarHBondContact O-N 2.91Å
180	R	69	Low	68.1	Low	194 Å²	194	99 Å²	99	73%	0.732	53%	0.531	S	S	*	.	H	α-helix	trans	-86.8	-11.8	179.6	-68.1	178.6	-157.5	172.7	10.4	113.8	S176 V177 T182	S176-R180 WeakPolarHBondContact O-CG 3.43Å; S176-R180 PolarHBondContact O-N 3.36Å; S176-R180 VanDerWaalsContact O-N 3.14Å; V177-R180 PolarHBondContact O-N 2.91Å; R180-T182 PolarHBondContact O-N 3.3Å; R180-T182 VanDerWaalsContact O-N 3.13Å
181	S	65.4	Low	68	Low	60 Å²	60	98.1 Å²	98.1	42%	0.42	53%	0.53	S	S	.	.			trans	-69.1	104.6	178.5	175.9	0	0	0	0	111.1	V177	V177-S181 PolarHBondContact O-N 3.35Å
182	T	56.1	Low	68	Low	144 Å²	144	100.5 Å²	100.5	88%	0.883	54%	0.54	S	S	*	.			trans	-85.7	-6.7	178.5	39.4	0	0	0	0	113.8	R180	R180-T182 PolarHBondContact O-N 3.3Å; R180-T182 VanDerWaalsContact O-N 3.13Å
183	Q	57.6	Low	68	Low	166 Å²	166	104.1 Å²	104.1	78%	0.776	55%	0.55	S	S	*	.	S	Bend	trans	-109.5	102.3	-177.3	-146.6	162.6	-0.4	0	0	110.4	N185	Q183-N185 VanDerWaalsContact C-N 3.26Å; Q183-N185 PolarHBondContact O-N 2.93Å
184	R	59.5	Low	68	Low	223 Å²	223	101.4 Å²	101.4	84%	0.842	54%	0.542	S	S	*	.			trans	-71.8	68.1	-175.4	-60.8	179.1	-172.3	135.1	0.6	112.3	V186	R184-V186 PolarHBondContact O-N 3.33Å
185	N	60.4	Low	68.2	Low	117 Å²	117	101 Å²	101	63%	0.626	55%	0.545	S	S	*	.			trans	-78.9	102.1	158.4	-102	-12.4	0	0	0	107.9	Q183 S187 G188 L189	Q183-N185 VanDerWaalsContact C-N 3.26Å; Q183-N185 PolarHBondContact O-N 2.93Å; N185-S187 PolarHBondContact O-N 3.42Å; N185-G188 PolarHBondContact O-N 3.08Å; N185-L189 PolarHBondContact O-N 3.48Å; N185-L189 VanDerWaalsContact O-N 3.09Å
186	V	63.6	Low	68.3	Low	116 Å²	116	97.7 Å²	97.7	70%	0.703	53%	0.526	S	S	*	.	H	α-helix	trans	-55.8	-33.9	-177.7	-179.8	0	0	0	0	111.6	R184 S190	R184-V186 PolarHBondContact O-N 3.33Å; V186-S190 WeakPolarHBondContact O-CB 3.46Å; V186-S190 PolarHBondContact O-N 3.07Å
187	S	65.9	Low	68.5	Low	82 Å²	82	99.6 Å²	99.6	57%	0.573	54%	0.54	S	S	*	.	H	α-helix	trans	-67.3	-39.1	175.2	52.6	0	0	0	0	113.6	N185 S190 N191	N185-S187 PolarHBondContact O-N 3.42Å; S187-S190 PolarHBondContact O-N 3.05Å; S187-N191 PolarHBondContact O-N 3.22Å; S187-N191 VanDerWaalsContact O-N 3.08Å
188	G	67.9	Low	68.9	Low	34 Å²	34	99.9 Å²	99.9	35%	0.351	54%	0.542	S	S	.	.	H	α-helix	trans	-69.6	-40.5	176.7	0	0	0	0	0	112.4	N185 N191 Q192	N185-G188 PolarHBondContact O-N 3.08Å; G188-N191 PolarHBondContact O-N 3.38Å; G188-Q192 WeakPolarHBondContact O-CG 3.37Å; G188-Q192 PolarHBondContact O-N 3.08Å
189	L	67.8	Low	69.4	Low	65 Å²	65	99.5 Å²	99.5	34%	0.34	54%	0.542	S	S	.	.	H	α-helix	trans	-63.3	-42.8	172.6	-87.8	153.8	0	0	0	111.9	L178 N185 Q192 L193	L178-L189 HydrophobicContact CD2-CD2 3.58Å; N185-L189 PolarHBondContact O-N 3.48Å; N185-L189 VanDerWaalsContact O-N 3.09Å; L189-Q192 PolarHBondContact O-N 3Å; L189-L193 VanDerWaalsContact O-CB 3.3Å; L189-L193 WeakPolarHBondContact O-CB 3.37Å; L189-L193 PolarHBondContact O-N 3.12Å
190	S	71.4	Confident	69.8	Low	73 Å²	73	97.4 Å²	97.4	51%	0.51	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-43.1	177.4	-171.8	0	0	0	0	112.3	V186 S187 L193 A194	V186-S190 WeakPolarHBondContact O-CB 3.46Å; V186-S190 PolarHBondContact O-N 3.07Å; S187-S190 PolarHBondContact O-N 3.05Å; S190-L193 PolarHBondContact O-N 2.98Å; S190-A194 WeakPolarHBondContact O-CB 3.23Å; S190-A194 PolarHBondContact O-N 3.04Å
191	N	75.2	Confident	70.3	Confident	104 Å²	104	93.5 Å²	93.5	56%	0.556	52%	0.52	S	S	*	.	H	α-helix	trans	-66	-42	176.3	-85	-4.4	0	0	0	112	S187 G188 A194 H195	S187-N191 PolarHBondContact O-N 3.22Å; S187-N191 VanDerWaalsContact O-N 3.08Å; G188-N191 PolarHBondContact O-N 3.38Å; N191-A194 PolarHBondContact O-N 2.99Å; N191-H195 PolarHBondContact O-CD2 3.17Å; N191-H195 PolarHBondContact O-N 3.26Å
192	Q	71.8	Confident	70.9	Confident	78 Å²	78	94.7 Å²	94.7	36%	0.364	52%	0.522	S	S	.	.	H	α-helix	trans	-66.3	-37.3	177	-74.7	-176	-12.4	0	0	112.4	L178 G188 L189 H195 A196	L178-Q192 HydrophobicContact CD1-CB 4.26Å; L178-Q192 HydrophobicContact CD2-CB 3.7Å; L178-Q192 HydrophobicContact CG-CB 4.1Å; G188-Q192 WeakPolarHBondContact O-CG 3.37Å; G188-Q192 PolarHBondContact O-N 3.08Å; L189-Q192 PolarHBondContact O-N 3Å; Q192-H195 PolarHBondContact O-N 3.02Å; Q192-A196 WeakPolarHBondContact O-CB 3.41Å; Q192-A196 PolarHBondContact O-N 2.96Å
193	L	74.2	Confident	71.8	Confident	118 Å²	118	88.6 Å²	88.6	62%	0.618	48%	0.484	S	S	*	.	H	α-helix	trans	-67.9	-40.4	174.7	-171.1	68.1	0	0	0	111.8	L189 S190 A196 S197	L189-L193 VanDerWaalsContact O-CB 3.3Å; L189-L193 WeakPolarHBondContact O-CB 3.37Å; L189-L193 PolarHBondContact O-N 3.12Å; S190-L193 PolarHBondContact O-N 2.98Å; L193-A196 PolarHBondContact O-N 2.77Å; L193-S197 WeakPolarHBondContact O-CB 3.39Å; L193-S197 PolarHBondContact O-N 2.91Å
194	A	77.9	Confident	72.7	Confident	51 Å²	51	83.7 Å²	83.7	42%	0.421	46%	0.463	S	S	.	.	H	α-helix	trans	-61.9	-43.4	174.2	0	0	0	0	0	111.6	S190 N191 S197 V198	S190-A194 WeakPolarHBondContact O-CB 3.23Å; S190-A194 PolarHBondContact O-N 3.04Å; N191-A194 PolarHBondContact O-N 2.99Å; A194-S197 PolarHBondContact O-N 2.86Å; A194-V198 WeakPolarHBondContact O-CG2 3.4Å; A194-V198 PolarHBondContact O-N 3.23Å
195	H	75.4	Confident	73.6	Confident	116 Å²	116	77.3 Å²	77.3	54%	0.537	45%	0.445	S	S	.	.	H	α-helix	trans	-65.3	-39	174.8	-74.3	-55.6	0	0	0	113.1	N191 Q192 S199	N191-H195 PolarHBondContact O-CD2 3.17Å; N191-H195 PolarHBondContact O-N 3.26Å; Q192-H195 PolarHBondContact O-N 3.02Å; H195-S199 WeakPolarHBondContact O-CB 3.49Å; H195-S199 PolarHBondContact O-N 2.76Å
196	A	74.6	Confident	74.4	Confident	11 Å²	11	74.5 Å²	74.5	9%	0.091	43%	0.429	C	S	.	.	H	α-helix	trans	-65.9	-39.7	174.6	0	0	0	0	0	111.8	Q192 L193 S199 L200	Q192-A196 WeakPolarHBondContact O-CB 3.41Å; Q192-A196 PolarHBondContact O-N 2.96Å; L193-A196 PolarHBondContact O-N 2.77Å; A196-S199 PolarHBondContact O-N 3.5Å; A196-L200 WeakPolarHBondContact O-CB 3.35Å; A196-L200 WeakPolarHBondContact O-CG 3.38Å; A196-L200 PolarHBondContact O-N 2.85Å
197	S	77.1	Confident	75	Confident	76 Å²	76	73.4 Å²	73.4	53%	0.531	42%	0.419	S	S	.	.	H	α-helix	trans	-63.6	-43.8	176.7	-173.8	0	0	0	0	112.4	L193 A194 S199 L200 H201	L193-S197 WeakPolarHBondContact O-CB 3.39Å; L193-S197 PolarHBondContact O-N 2.91Å; A194-S197 PolarHBondContact O-N 2.86Å; S197-S199 VanDerWaalsContact C-N 3.33Å; S197-L200 PolarHBondContact O-N 2.85Å; S197-H201 WeakPolarHBondContact O-CB 3.25Å; S197-H201 PolarHBondContact O-N 2.61Å
198	V	81.9	Confident	75.5	Confident	88 Å²	88	76.7 Å²	76.7	53%	0.533	42%	0.419	S	S	.	.	H	α-helix	trans	-65.2	-39.9	175.8	172.2	0	0	0	0	110.8	A194 H201 N202	A194-V198 WeakPolarHBondContact O-CG2 3.4Å; A194-V198 PolarHBondContact O-N 3.23Å; V198-H201 PolarHBondContact O-N 3.31Å; V198-N202 PolarHBondContact O-N 3.38Å
199	S	77.1	Confident	76	Confident	30 Å²	30	77.7 Å²	77.7	21%	0.21	42%	0.42	C	S	.	.	H	α-helix	trans	-64.9	-41.7	177.2	-161.2	0	0	0	0	112.3	L171 H195 A196 S197 N202 H203	L171-S199 VanDerWaalsContact CD1-CB 3.45Å; L171-S199 VanDerWaalsContact CD1-OG 3.24Å; L171-S199 WeakPolarHBondContact CD1-OG 3.44Å; H195-S199 WeakPolarHBondContact O-CB 3.49Å; H195-S199 PolarHBondContact O-N 2.76Å; A196-S199 PolarHBondContact O-N 3.5Å; S197-S199 VanDerWaalsContact C-N 3.33Å; S199-N202 PolarHBondContact O-N 3.36Å; S199-H203 PolarHBondContact O-N 3.41Å
200	L	75.7	Confident	76.3	Confident	99 Å²	99	75.3 Å²	75.3	52%	0.518	41%	0.408	S	S	.	.	H	α-helix	trans	-64.1	-39.3	174.5	-83.4	164.1	0	0	0	112.2	L171 A196 S197 H203 D204	L171-L200 HydrophobicContact CD2-CD2 3.86Å; L171-L200 HydrophobicContact CD2-CG 4.03Å; A196-L200 WeakPolarHBondContact O-CB 3.35Å; A196-L200 WeakPolarHBondContact O-CG 3.38Å; A196-L200 PolarHBondContact O-N 2.85Å; S197-L200 PolarHBondContact O-N 2.85Å; L200-H203 WeakPolarHBondContact O-CB 3.43Å; L200-H203 PolarHBondContact O-N 3.47Å; L200-D204 PolarHBondContact O-N 2.01Å
201	H	79.8	Confident	76.4	Confident	112 Å²	112	74.1 Å²	74.1	52%	0.519	40%	0.403	S	S	.	.	H	α-helix	trans	-65	-42.1	176.6	-172	62.8	0	0	0	112.1	S197 V198 H203 D204 L205	S197-H201 WeakPolarHBondContact O-CB 3.25Å; S197-H201 PolarHBondContact O-N 2.61Å; V198-H201 PolarHBondContact O-N 3.31Å; H201-H203 VanDerWaalsContact C-N 3.27Å; H201-H203 PolarHBondContact O-N 3.05Å; H201-D204 PolarHBondContact O-N 3.3Å; H201-L205 PolarHBondContact O-N 2.95Å
202	N	78.6	Confident	76.6	Confident	86 Å²	86	74.1 Å²	74.1	46%	0.46	40%	0.403	S	S	.	.	H	α-helix	trans	-63.9	-33.9	173.9	-72.5	-14.6	0	0	0	112.1	V198 S199 L205 L206	V198-N202 PolarHBondContact O-N 3.38Å; S199-N202 PolarHBondContact O-N 3.36Å; N202-L205 PolarHBondContact O-N 2.66Å; N202-L206 PolarHBondContact O-N 3.14Å; N202-L206 VanDerWaalsContact O-N 3.1Å
203	H	73.8	Confident	76.8	Confident	16 Å²	16	73 Å²	73	7%	0.074	40%	0.398	C	S	.	.	H	α-helix	trans	-64.6	-43.2	173.6	-114.8	121	0	0	0	112.7	T164 T167 S199 L200 H201 L205 L206 L207	T164-H203 WeakPolarHBondContact CG2-NE2 3.5Å; T164-H203 PolarHBondContact O-NE2 3.32Å; T167-H203 PolarHBondContact OG1-CE1 2.94Å; T167-H203 PolarHBondContact OG1-NE2 2.79Å; T167-H203 VanDerWaalsContact OG1-NE2 3.13Å; S199-H203 PolarHBondContact O-N 3.41Å; L200-H203 WeakPolarHBondContact O-CB 3.43Å; L200-H203 PolarHBondContact O-N 3.47Å; H201-H203 VanDerWaalsContact C-N 3.27Å; H201-H203 PolarHBondContact O-N 3.05Å; H203-L205 VanDerWaalsContact C-N 3.27Å; H203-L205 PolarHBondContact O-N 2.89Å; H203-L206 PolarHBondContact O-N 3.35Å; H203-L207 WeakPolarHBondContact O-CB 3.5Å; H203-L207 WeakPolarHBondContact O-CG 3.3Å; H203-L207 PolarHBondContact O-N 2.99Å
204	D	76.6	Confident	76.7	Confident	63 Å²	63	71 Å²	71	34%	0.337	39%	0.39	S	S	.	.	H	α-helix	trans	-61.1	-37.9	177.3	-170.4	50.9	0	0	0	111.4	L200 H201 R208	L200-D204 PolarHBondContact O-N 2.01Å; H201-D204 PolarHBondContact O-N 3.3Å; D204-R208 WeakPolarHBondContact O-CG 3.45Å; D204-R208 PolarHBondContact O-N 2.84Å; D204-R208 IonicContact OD1-NE 3.87Å; D204-R208 IonicContact OD1-NH2 3.92Å; D204-R208 IonicContact OD2-CZ 3.27Å; D204-R208 VanDerWaalsContact OD2-CZ 3.27Å; D204-R208 IonicContact OD2-NE 3.43Å; D204-R208 PolarHBondContact OD2-NE 2.63Å; D204-R208 IonicContact OD2-NH2 2.8Å; D204-R208 PolarHBondContact OD2-NH2 3.08Å
205	L	79.8	Confident	76.5	Confident	89 Å²	89	72.9 Å²	72.9	47%	0.466	39%	0.394	S	S	.	.	H	α-helix	trans	-67.2	-43.2	175.1	-67.4	173.4	0	0	0	112.6	H201 N202 H203 R208 S209	H201-L205 PolarHBondContact O-N 2.95Å; N202-L205 PolarHBondContact O-N 2.66Å; H203-L205 VanDerWaalsContact C-N 3.27Å; H203-L205 PolarHBondContact O-N 2.89Å; L205-R208 PolarHBondContact O-N 3.23Å; L205-S209 PolarHBondContact O-N 3.32Å
206	L	77.5	Confident	76.7	Confident	58 Å²	58	73.4 Å²	73.4	30%	0.304	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-39.7	175.6	-90.6	154.6	0	0	0	112.3	N202 H203 S209 T210	N202-L206 PolarHBondContact O-N 3.14Å; N202-L206 VanDerWaalsContact O-N 3.1Å; H203-L206 PolarHBondContact O-N 3.35Å; L206-S209 PolarHBondContact O-N 3.34Å; L206-T210 PolarHBondContact O-N 2.8Å; L206-T210 PolarHBondContact O-OG1 3.45Å
207	L	74.3	Confident	76.6	Confident	92 Å²	92	74.5 Å²	74.5	48%	0.482	40%	0.4	S	S	.	.	H	α-helix	trans	-66.4	-38.9	177.3	-75.8	170.7	0	0	0	112.3	T164 H203 T210 A211	T164-L207 HydrophobicContact CG2-CD2 4.5Å; H203-L207 WeakPolarHBondContact O-CB 3.5Å; H203-L207 WeakPolarHBondContact O-CG 3.3Å; H203-L207 PolarHBondContact O-N 2.99Å; L207-T210 VanDerWaalsContact CA-OG1 3.27Å; L207-T210 WeakPolarHBondContact CA-OG1 3.45Å; L207-T210 PolarHBondContact O-N 3.33Å; L207-T210 PolarHBondContact O-OG1 2.98Å; L207-T210 VanDerWaalsContact O-OG1 3.05Å; L207-A211 WeakPolarHBondContact O-CB 3.02Å; L207-A211 PolarHBondContact O-N 3.38Å
208	R	77.9	Confident	76.4	Confident	152 Å²	152	76.5 Å²	76.5	57%	0.574	40%	0.399	S	S	*	.	H	α-helix	trans	-66	-44.6	173.6	-72.8	179.5	-166.1	-179.4	7.4	111.8	D204 L205 T210 A211 D212	D204-R208 WeakPolarHBondContact O-CG 3.45Å; D204-R208 PolarHBondContact O-N 2.84Å; D204-R208 IonicContact OD1-NE 3.87Å; D204-R208 IonicContact OD1-NH2 3.92Å; D204-R208 IonicContact OD2-CZ 3.27Å; D204-R208 VanDerWaalsContact OD2-CZ 3.27Å; D204-R208 IonicContact OD2-NE 3.43Å; D204-R208 PolarHBondContact OD2-NE 2.63Å; D204-R208 IonicContact OD2-NH2 2.8Å; D204-R208 PolarHBondContact OD2-NH2 3.08Å; L205-R208 PolarHBondContact O-N 3.23Å; R208-T210 VanDerWaalsContact C-N 3.31Å; R208-T210 PolarHBondContact O-N 3.27Å; R208-A211 PolarHBondContact O-N 2.99Å; R208-D212 PolarHBondContact O-N 3.34Å
209	S	78.1	Confident	76.1	Confident	55 Å²	55	77 Å²	77	39%	0.385	40%	0.399	S	S	.	.	H	α-helix	trans	-61.1	-39.4	176.8	-174.4	0	0	0	0	112.5	L205 L206 Q213	L205-S209 PolarHBondContact O-N 3.32Å; L206-S209 PolarHBondContact O-N 3.34Å; S209-Q213 WeakPolarHBondContact O-CG 3.36Å; S209-Q213 PolarHBondContact O-N 3.3Å; S209-Q213 VanDerWaalsContact O-N 3.12Å
210	T	73	Confident	76	Confident	14 Å²	14	80.7 Å²	80.7	9%	0.086	41%	0.408	C	S	.	.	H	α-helix	trans	-72.2	-36.6	177	35.7	0	0	0	0	112	H160 L206 L207 R208 D212 Q213 V214	H160-T210 HydrophobicContact CB-CG2 3.58Å; L206-T210 PolarHBondContact O-N 2.8Å; L206-T210 PolarHBondContact O-OG1 3.45Å; L207-T210 VanDerWaalsContact CA-OG1 3.27Å; L207-T210 WeakPolarHBondContact CA-OG1 3.45Å; L207-T210 PolarHBondContact O-N 3.33Å; L207-T210 PolarHBondContact O-OG1 2.98Å; L207-T210 VanDerWaalsContact O-OG1 3.05Å; R208-T210 VanDerWaalsContact C-N 3.31Å; R208-T210 PolarHBondContact O-N 3.27Å; T210-D212 VanDerWaalsContact C-N 3.33Å; T210-D212 PolarHBondContact O-N 3.28Å; T210-Q213 PolarHBondContact O-N 3.45Å; T210-V214 WeakPolarHBondContact O-CG2 3.16Å; T210-V214 PolarHBondContact O-N 3.23Å
211	A	73.6	Confident	75.6	Confident	49 Å²	49	80.8 Å²	80.8	41%	0.405	41%	0.409	S	S	.	.	H	α-helix	trans	-61.1	-41.6	172.6	0	0	0	0	0	112.1	L207 R208 V214 N215	L207-A211 WeakPolarHBondContact O-CB 3.02Å; L207-A211 PolarHBondContact O-N 3.38Å; R208-A211 PolarHBondContact O-N 2.99Å; A211-V214 PolarHBondContact O-N 3.46Å; A211-N215 PolarHBondContact O-N 2.87Å; A211-N215 PolarHBondContact O-ND2 3.29Å
212	D	79.7	Confident	75.2	Confident	103 Å²	103	80 Å²	80	55%	0.551	41%	0.406	S	S	*	.	H	α-helix	trans	-64.2	-39.9	175.7	-71.4	-22.6	0	0	0	111.9	R208 T210 N215 Q216	R208-D212 PolarHBondContact O-N 3.34Å; T210-D212 VanDerWaalsContact C-N 3.33Å; T210-D212 PolarHBondContact O-N 3.28Å; D212-N215 PolarHBondContact O-N 3.17Å; D212-Q216 PolarHBondContact O-N 2.93Å
213	Q	75.8	Confident	74.9	Confident	56 Å²	56	81.6 Å²	81.6	26%	0.262	41%	0.41	S	S	.	.	H	α-helix	trans	-64.3	-39.9	174	-74.9	174.7	-34.9	0	0	112.6	L157 S209 T210 N215 Q216 L217	L157-Q213 HydrophobicContact CD1-CB 4.49Å; L157-Q213 HydrophobicContact CG-CB 4.48Å; S209-Q213 WeakPolarHBondContact O-CG 3.36Å; S209-Q213 PolarHBondContact O-N 3.3Å; S209-Q213 VanDerWaalsContact O-N 3.12Å; T210-Q213 PolarHBondContact O-N 3.45Å; Q213-N215 VanDerWaalsContact C-N 3.33Å; Q213-Q216 PolarHBondContact O-N 2.9Å; Q213-L217 WeakPolarHBondContact O-CB 3.48Å; Q213-L217 PolarHBondContact O-N 2.97Å
214	V	72.8	Confident	74.7	Confident	74 Å²	74	81.7 Å²	81.7	45%	0.448	41%	0.412	S	S	.	.	H	α-helix	trans	-64.3	-39.2	175.9	170.6	0	0	0	0	111.3	L157 T210 A211 L217 K218	L157-V214 HydrophobicContact CD1-CG2 4.05Å; L157-V214 HydrophobicContact CD2-CG2 3.66Å; T210-V214 WeakPolarHBondContact O-CG2 3.16Å; T210-V214 PolarHBondContact O-N 3.23Å; A211-V214 PolarHBondContact O-N 3.46Å; V214-L217 WeakPolarHBondContact O-CB 3.47Å; V214-L217 PolarHBondContact O-N 3.47Å; V214-K218 PolarHBondContact O-N 3.34Å
215	N	74.2	Confident	74.3	Confident	92 Å²	92	80.8 Å²	80.8	49%	0.492	42%	0.417	S	S	.	.	H	α-helix	trans	-65	-44.3	175.7	-71.5	-34.7	0	0	0	111.6	A211 D212 Q213 L217 K218 D219	A211-N215 PolarHBondContact O-N 2.87Å; A211-N215 PolarHBondContact O-ND2 3.29Å; D212-N215 PolarHBondContact O-N 3.17Å; Q213-N215 VanDerWaalsContact C-N 3.33Å; N215-L217 VanDerWaalsContact C-N 3.29Å; N215-L217 PolarHBondContact O-N 3.44Å; N215-K218 WeakPolarHBondContact O-CB 3.06Å; N215-K218 PolarHBondContact O-N 2.9Å; N215-D219 PolarHBondContact O-N 3.37Å; N215-D219 VanDerWaalsContact O-N 3.07Å
216	Q	79.4	Confident	73.9	Confident	126 Å²	126	85.4 Å²	85.4	59%	0.589	43%	0.428	S	S	*	.	H	α-helix	trans	-61.4	-37.5	173.2	-79.9	-176.3	-2.2	0	0	112.8	D212 Q213 K218 D219 R220	D212-Q216 PolarHBondContact O-N 2.93Å; Q213-Q216 PolarHBondContact O-N 2.9Å; Q216-K218 VanDerWaalsContact C-N 3.32Å; Q216-D219 PolarHBondContact O-N 3.44Å; Q216-R220 WeakPolarHBondContact O-CG 3.17Å; Q216-R220 PolarHBondContact O-N 3.29Å
217	L	71.2	Confident	73.4	Confident	35 Å²	35	85 Å²	85	18%	0.183	43%	0.428	C	S	.	.	H	α-helix	trans	-64.1	-40.2	176.8	-157.6	91.4	0	0	0	111.4	L150 D153 I154 L157 Q213 V214 N215 R220 L221	L150-L217 HydrophobicContact CD1-CD1 3.81Å; L150-L217 HydrophobicContact CD1-CD2 4.38Å; L150-L217 HydrophobicContact CD1-CG 3.75Å; D153-L217 HydrophobicContact CB-CD1 3.22Å; I154-L217 HydrophobicContact CG1-CD1 4.22Å; I154-L217 HydrophobicContact CG1-CD2 3.94Å; L157-L217 HydrophobicContact CD1-CB 4.5Å; L157-L217 HydrophobicContact CD1-CD1 4.32Å; L157-L217 HydrophobicContact CD1-CD2 4.25Å; Q213-L217 WeakPolarHBondContact O-CB 3.48Å; Q213-L217 PolarHBondContact O-N 2.97Å; V214-L217 WeakPolarHBondContact O-CB 3.47Å; V214-L217 PolarHBondContact O-N 3.47Å; N215-L217 VanDerWaalsContact C-N 3.29Å; N215-L217 PolarHBondContact O-N 3.44Å; L217-R220 PolarHBondContact O-N 3.02Å; L217-L221 WeakPolarHBondContact O-CB 3.25Å; L217-L221 PolarHBondContact O-N 3Å
218	K	73.8	Confident	73.1	Confident	117 Å²	117	83.8 Å²	83.8	51%	0.509	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-47.8	175.9	-174.6	-168.1	171.2	-159.9	0	111	V214 N215 Q216 R220 L221 E222	V214-K218 PolarHBondContact O-N 3.34Å; N215-K218 WeakPolarHBondContact O-CB 3.06Å; N215-K218 PolarHBondContact O-N 2.9Å; Q216-K218 VanDerWaalsContact C-N 3.32Å; K218-R220 VanDerWaalsContact C-N 3.32Å; K218-R220 PolarHBondContact O-N 2.93Å; K218-L221 PolarHBondContact O-N 3.15Å; K218-L221 VanDerWaalsContact O-N 3.14Å; K218-E222 WeakPolarHBondContact CE-OE1 3.45Å; K218-E222 IonicContact NZ-OE1 3.93Å; K218-E222 PolarHBondContact O-N 3.21Å
219	D	76.4	Confident	72.6	Confident	98 Å²	98	78 Å²	78	52%	0.524	41%	0.412	S	S	.	.	H	α-helix	trans	-61.8	-41.1	179.3	-64.2	-17.7	0	0	0	111.5	N215 Q216 E222 E223	N215-D219 PolarHBondContact O-N 3.37Å; N215-D219 VanDerWaalsContact O-N 3.07Å; Q216-D219 PolarHBondContact O-N 3.44Å; D219-E222 PolarHBondContact O-N 2.93Å; D219-E223 PolarHBondContact O-N 3.09Å
220	R	73.4	Confident	72	Confident	109 Å²	109	78.9 Å²	78.9	41%	0.411	42%	0.418	S	S	.	.	H	α-helix	trans	-66.9	-36	174.6	-72.6	-174.7	-178.9	-79.8	1.1	113	D153 Q216 L217 K218 E222 E223 V224	D153-R220 WeakPolarHBondContact OD2-CD 3.3Å; D153-R220 IonicContact OD2-NE 3.65Å; Q216-R220 WeakPolarHBondContact O-CG 3.17Å; Q216-R220 PolarHBondContact O-N 3.29Å; L217-R220 PolarHBondContact O-N 3.02Å; K218-R220 VanDerWaalsContact C-N 3.32Å; K218-R220 PolarHBondContact O-N 2.93Å; R220-E222 VanDerWaalsContact C-N 3.34Å; R220-E223 PolarHBondContact O-N 3.27Å; R220-V224 WeakPolarHBondContact O-CG2 3.4Å; R220-V224 PolarHBondContact O-N 3.21Å
221	L	67.6	Low	71.6	Confident	100 Å²	100	79.3 Å²	79.3	52%	0.524	42%	0.421	S	S	.	.	H	α-helix	trans	-67.7	-37.7	176.5	-176.2	66.9	0	0	0	111.2	L150 L217 K218 V224 G225	L150-L221 HydrophobicContact CD2-CD1 3.85Å; L217-L221 WeakPolarHBondContact O-CB 3.25Å; L217-L221 PolarHBondContact O-N 3Å; K218-L221 PolarHBondContact O-N 3.15Å; K218-L221 VanDerWaalsContact O-N 3.14Å; L221-V224 PolarHBondContact O-N 3.09Å; L221-G225 PolarHBondContact O-N 3.13Å
222	E	71.3	Confident	71.2	Confident	97 Å²	97	81.8 Å²	81.8	45%	0.453	43%	0.427	S	S	.	.	H	α-helix	trans	-62	-46.4	171.3	-72.5	-178.7	-169.6	0	0	110.5	K218 D219 R220 V224 G225 W226	K218-E222 WeakPolarHBondContact CE-OE1 3.45Å; K218-E222 IonicContact NZ-OE1 3.93Å; K218-E222 PolarHBondContact O-N 3.21Å; D219-E222 PolarHBondContact O-N 2.93Å; R220-E222 VanDerWaalsContact C-N 3.34Å; E222-V224 VanDerWaalsContact C-N 3.34Å; E222-V224 PolarHBondContact O-N 2.69Å; E222-G225 CarbonylContact O-C 3.49Å; E222-G225 WeakPolarHBondContact O-CA 3.07Å; E222-G225 PolarHBondContact O-N 2.99Å; E222-W226 PolarHBondContact O-N 3.34Å
223	E	72.9	Confident	70.6	Confident	118 Å²	118	82.2 Å²	82.2	55%	0.551	43%	0.426	S	S	*	.	H	α-helix	trans	-58	-41.9	174.9	-169.9	-178.3	-176.7	0	0	112.8	D219 R220 W226 T227	D219-E223 PolarHBondContact O-N 3.09Å; R220-E223 PolarHBondContact O-N 3.27Å; E223-W226 PolarHBondContact O-N 3.26Å; E223-T227 WeakPolarHBondContact O-CG2 3.44Å; E223-T227 PolarHBondContact O-N 3.47Å; E223-T227 PolarHBondContact O-OG1 2.78Å; E223-T227 VanDerWaalsContact O-OG1 3.07Å
224	V	69.9	Low	70.2	Confident	19 Å²	19	82.1 Å²	82.1	12%	0.115	43%	0.429	C	S	.	.	H	α-helix	trans	-63.2	-42.2	172.4	172.6	0	0	0	0	110.9	L143 A146 R220 L221 E222 W226 T227 V228	L143-V224 HydrophobicContact CD1-CG1 4.12Å; A146-V224 HydrophobicContact CB-CG2 3.75Å; R220-V224 WeakPolarHBondContact O-CG2 3.4Å; R220-V224 PolarHBondContact O-N 3.21Å; L221-V224 PolarHBondContact O-N 3.09Å; E222-V224 VanDerWaalsContact C-N 3.34Å; E222-V224 PolarHBondContact O-N 2.69Å; V224-W226 PolarHBondContact O-N 3.05Å; V224-T227 WeakPolarHBondContact CA-OG1 3.47Å; V224-T227 PolarHBondContact O-N 2.81Å; V224-T227 PolarHBondContact O-OG1 3.18Å; V224-V228 HydrophobicContact CG1-CG2 4.22Å; V224-V228 WeakPolarHBondContact O-CB 3.4Å; V224-V228 VanDerWaalsContact O-CG2 3.25Å; V224-V228 WeakPolarHBondContact O-CG2 2.92Å; V224-V228 PolarHBondContact O-N 3.09Å
225	G	67.2	Low	69.9	Low	43 Å²	43	82.7 Å²	82.7	44%	0.443	43%	0.426	S	S	.	.	H	α-helix	trans	-58.6	-45.9	175.2	0	0	0	0	0	112.5	L221 E222 V228 G229	L221-G225 PolarHBondContact O-N 3.13Å; E222-G225 CarbonylContact O-C 3.49Å; E222-G225 WeakPolarHBondContact O-CA 3.07Å; E222-G225 PolarHBondContact O-N 2.99Å; G225-V228 PolarHBondContact O-N 3.26Å; G225-G229 PolarHBondContact O-N 2.85Å
226	W	71.7	Confident	69.5	Low	187 Å²	187	81.8 Å²	81.8	71%	0.708	42%	0.424	S	S	*	.	H	α-helix	trans	-61.9	-45.5	176.4	-72.1	112.9	0	0	0	112.3	E222 E223 V224 G229 S230	E222-W226 PolarHBondContact O-N 3.34Å; E223-W226 PolarHBondContact O-N 3.26Å; V224-W226 PolarHBondContact O-N 3.05Å; W226-G229 PolarHBondContact O-N 2.88Å; W226-S230 WeakPolarHBondContact O-CB 3.24Å; W226-S230 PolarHBondContact O-N 3.35Å
227	T	66.6	Low	69	Low	49 Å²	49	78.5 Å²	78.5	30%	0.301	41%	0.414	S	S	.	.	H	α-helix	trans	-67.2	-41.5	179.5	52	0	0	0	0	112.2	E223 V224 S230 V231	E223-T227 WeakPolarHBondContact O-CG2 3.44Å; E223-T227 PolarHBondContact O-N 3.47Å; E223-T227 PolarHBondContact O-OG1 2.78Å; E223-T227 VanDerWaalsContact O-OG1 3.07Å; V224-T227 WeakPolarHBondContact CA-OG1 3.47Å; V224-T227 PolarHBondContact O-N 2.81Å; V224-T227 PolarHBondContact O-OG1 3.18Å; T227-S230 PolarHBondContact O-N 3.08Å; T227-V231 WeakPolarHBondContact O-CG2 3.45Å; T227-V231 PolarHBondContact O-N 2.7Å
228	V	68.3	Low	68.7	Low	66 Å²	66	78.9 Å²	78.9	40%	0.4	42%	0.417	S	S	.	.	H	α-helix	trans	-61.7	-44.4	173.3	171.9	0	0	0	0	111	L143 V224 G225 S230 V231 N232	L143-V228 HydrophobicContact CD1-CG2 3.41Å; L143-V228 VanDerWaalsContact CD1-CG2 3.41Å; L143-V228 HydrophobicContact CD2-CG2 4.01Å; L143-V228 HydrophobicContact CG-CG2 4.37Å; V224-V228 HydrophobicContact CG1-CG2 4.22Å; V224-V228 WeakPolarHBondContact O-CB 3.4Å; V224-V228 VanDerWaalsContact O-CG2 3.25Å; V224-V228 WeakPolarHBondContact O-CG2 2.92Å; V224-V228 PolarHBondContact O-N 3.09Å; G225-V228 PolarHBondContact O-N 3.26Å; V228-S230 VanDerWaalsContact C-N 3.34Å; V228-S230 PolarHBondContact O-N 2.81Å; V228-V231 PolarHBondContact O-N 2.7Å; V228-N232 VanDerWaalsContact O-CB 3.28Å; V228-N232 WeakPolarHBondContact O-CB 3.44Å; V228-N232 PolarHBondContact O-N 2.87Å
229	G	66.9	Low	68.4	Low	30 Å²	30	77.6 Å²	77.6	31%	0.309	41%	0.414	S	S	.	.	H	α-helix	trans	-59.9	-44.3	176.6	0	0	0	0	0	112.2	G225 W226 N232 H233	G225-G229 PolarHBondContact O-N 2.85Å; W226-G229 PolarHBondContact O-N 2.88Å; G229-N232 PolarHBondContact O-N 3.34Å; G229-H233 WeakPolarHBondContact O-CB 3.35Å; G229-H233 PolarHBondContact O-CD2 3.02Å; G229-H233 PolarHBondContact O-N 3.41Å
230	S	66.7	Low	67.7	Low	74 Å²	74	75.7 Å²	75.7	52%	0.517	41%	0.409	S	S	.	.	H	α-helix	trans	-61.7	-47.8	175.7	-175.1	0	0	0	0	112.1	W226 T227 V228 H233 T234	W226-S230 WeakPolarHBondContact O-CB 3.24Å; W226-S230 PolarHBondContact O-N 3.35Å; T227-S230 PolarHBondContact O-N 3.08Å; V228-S230 VanDerWaalsContact C-N 3.34Å; V228-S230 PolarHBondContact O-N 2.81Å; S230-H233 PolarHBondContact O-N 2.92Å; S230-T234 WeakPolarHBondContact O-CG2 3.01Å; S230-T234 PolarHBondContact O-N 3.4Å; S230-T234 PolarHBondContact O-OG1 3Å
231	V	64.5	Low	67.5	Low	24 Å²	24	73.6 Å²	73.6	15%	0.145	41%	0.408	C	S	.	.	H	α-helix	trans	-64.1	-41.8	179.7	171.3	0	0	0	0	111.2	T227 V228 T234 F235	T227-V231 WeakPolarHBondContact O-CG2 3.45Å; T227-V231 PolarHBondContact O-N 2.7Å; V228-V231 PolarHBondContact O-N 2.7Å; V231-T234 PolarHBondContact O-N 3.33Å; V231-T234 PolarHBondContact O-OG1 2.92Å; V231-F235 WeakPolarHBondContact O-CB 3.14Å; V231-F235 PolarHBondContact O-N 2.96Å
232	N	64.3	Low	67.3	Low	101 Å²	101	71 Å²	71	54%	0.54	39%	0.393	S	S	.	.	H	α-helix	trans	-64	-42.7	178.5	-168.9	40.5	0	0	0	111.5	V228 G229 T236	V228-N232 VanDerWaalsContact O-CB 3.28Å; V228-N232 WeakPolarHBondContact O-CB 3.44Å; V228-N232 PolarHBondContact O-N 2.87Å; G229-N232 PolarHBondContact O-N 3.34Å; N232-T236 WeakPolarHBondContact O-CB 3.42Å; N232-T236 PolarHBondContact O-N 2.99Å; N232-T236 PolarHBondContact O-OG1 3.36Å
233	H	68.2	Low	67	Low	111 Å²	111	71.1 Å²	71.1	51%	0.514	39%	0.394	S	S	.	.	H	α-helix	trans	-64	-45.3	175.6	-94.5	-67.4	0	0	0	113.1	G229 S230 S237 L458	G229-H233 WeakPolarHBondContact O-CB 3.35Å; G229-H233 PolarHBondContact O-CD2 3.02Å; G229-H233 PolarHBondContact O-N 3.41Å; S230-H233 PolarHBondContact O-N 2.92Å; H233-S237 WeakPolarHBondContact O-CB 3.49Å; H233-S237 PolarHBondContact O-N 3.34Å; H233-L458 VanDerWaalsContact CE1-CD2 3.47Å; H233-L458 WeakPolarHBondContact CE1-CD2 3.39Å
234	T	67.6	Low	66.4	Low	54 Å²	54	70.4 Å²	70.4	33%	0.331	39%	0.393	S	S	.	.	H	α-helix	trans	-64.5	-46.6	178	54.1	0	0	0	0	110.6	S230 V231 T236 S237 D238	S230-T234 WeakPolarHBondContact O-CG2 3.01Å; S230-T234 PolarHBondContact O-N 3.4Å; S230-T234 PolarHBondContact O-OG1 3Å; V231-T234 PolarHBondContact O-N 3.33Å; V231-T234 PolarHBondContact O-OG1 2.92Å; T234-T236 PolarHBondContact O-N 3.4Å; T234-S237 PolarHBondContact O-N 3Å; T234-D238 WeakPolarHBondContact O-CB 3.5Å; T234-D238 PolarHBondContact O-N 3.06Å; T234-D238 VanDerWaalsContact O-OD2 3.11Å
235	F	65.9	Low	66.3	Low	87 Å²	87	74.6 Å²	74.6	38%	0.382	41%	0.41	S	S	.	.	H	α-helix	trans	-64.7	-41.4	-177.9	-153.3	-108.1	0	0	0	112.2	H136 V231 I239	H136-F235 HydrophobicContact CB-CD2 4.43Å; H136-F235 HydrophobicContact CB-CE2 4.41Å; H136-F235 AromaticContact CD2-CD2 3.96Å; H136-F235 AromaticContact CE1-CD2 3.61Å; H136-F235 AromaticContact CG-CD2 3.77Å; H136-F235 AromaticContact ND1-CD2 3.54Å; H136-F235 AromaticContact ND1-CE2 3.77Å; H136-F235 AromaticContact NE2-CD2 3.85Å; V231-F235 WeakPolarHBondContact O-CB 3.14Å; V231-F235 PolarHBondContact O-N 2.96Å; F235-I239 HydrophobicContact CD1-CD1 3.31Å; F235-I239 HydrophobicContact CD1-CG1 4.32Å; F235-I239 HydrophobicContact CE1-CD1 3.25Å; F235-I239 HydrophobicContact CE1-CG1 4.36Å; F235-I239 HydrophobicContact CG-CD1 4.14Å; F235-I239 HydrophobicContact CZ-CD1 4Å; F235-I239 VanDerWaalsContact O-CB 3.24Å; F235-I239 WeakPolarHBondContact O-CB 3.47Å; F235-I239 WeakPolarHBondContact O-CG1 3.46Å; F235-I239 PolarHBondContact O-N 3.29Å
236	T	64.9	Low	66.2	Low	73 Å²	73	76.9 Å²	76.9	45%	0.448	41%	0.411	S	S	.	.	H	α-helix	trans	-68.3	-44	178.4	-55.3	0	0	0	0	111.1	N232 T234 S240	N232-T236 WeakPolarHBondContact O-CB 3.42Å; N232-T236 PolarHBondContact O-N 2.99Å; N232-T236 PolarHBondContact O-OG1 3.36Å; T234-T236 PolarHBondContact O-N 3.4Å; T236-S240 VanDerWaalsContact O-CB 3.31Å; T236-S240 WeakPolarHBondContact O-CB 3.33Å; T236-S240 PolarHBondContact O-N 3.46Å; T236-S240 PolarHBondContact O-OG 3.38Å
237	S	68.9	Low	65.7	Low	56 Å²	56	72.2 Å²	72.2	39%	0.392	40%	0.397	S	S	.	.	H	α-helix	trans	-60.8	-50.1	176.5	-180	0	0	0	0	111.5	H233 T234 S240 V241	H233-S237 WeakPolarHBondContact O-CB 3.49Å; H233-S237 PolarHBondContact O-N 3.34Å; T234-S237 PolarHBondContact O-N 3Å; S237-S240 PolarHBondContact O-N 2.95Å; S237-V241 WeakPolarHBondContact O-CG2 3.46Å; S237-V241 PolarHBondContact O-N 3.34Å
238	D	65.7	Low	65.7	Low	43 Å²	43	74 Å²	74	23%	0.23	41%	0.405	C	S	.	.	H	α-helix	trans	-68.2	-40.5	-176.5	-66	-30.1	0	0	0	111.7	L132 H136 T234 S240 V241 H242	L132-D238 HydrophobicContact CD2-CB 4.17Å; L132-D238 WeakPolarHBondContact CD2-OD2 3.47Å; H136-D238 IonicContact CE1-OD2 2.94Å; H136-D238 PolarHBondContact CE1-OD2 3.23Å; H136-D238 IonicContact NE2-OD2 2.65Å; H136-D238 PolarHBondContact NE2-OD2 3.01Å; T234-D238 WeakPolarHBondContact O-CB 3.5Å; T234-D238 PolarHBondContact O-N 3.06Å; T234-D238 VanDerWaalsContact O-OD2 3.11Å; D238-S240 VanDerWaalsContact C-N 3.31Å; D238-S240 PolarHBondContact O-N 3.01Å; D238-V241 PolarHBondContact O-N 3.05Å; D238-H242 WeakPolarHBondContact O-CB 2.98Å; D238-H242 PolarHBondContact O-CD2 3.43Å; D238-H242 PolarHBondContact O-N 3.29Å
239	I	67.7	Low	65.6	Low	90 Å²	90	75.4 Å²	75.4	46%	0.462	41%	0.409	S	S	.	.	H	α-helix	trans	-60.3	-43.2	173.3	-75	174.3	0	0	0	110.9	F235 H242 H243	F235-I239 HydrophobicContact CD1-CD1 3.31Å; F235-I239 HydrophobicContact CD1-CG1 4.32Å; F235-I239 HydrophobicContact CE1-CD1 3.25Å; F235-I239 HydrophobicContact CE1-CG1 4.36Å; F235-I239 HydrophobicContact CG-CD1 4.14Å; F235-I239 HydrophobicContact CZ-CD1 4Å; F235-I239 VanDerWaalsContact O-CB 3.24Å; F235-I239 WeakPolarHBondContact O-CB 3.47Å; F235-I239 WeakPolarHBondContact O-CG1 3.46Å; F235-I239 PolarHBondContact O-N 3.29Å; I239-H242 PolarHBondContact O-N 3.48Å; I239-H243 VanDerWaalsContact O-CB 3.28Å; I239-H243 WeakPolarHBondContact O-CB 3.44Å; I239-H243 PolarHBondContact O-N 3Å
240	S	62.4	Low	65.5	Low	58 Å²	58	79.9 Å²	79.9	41%	0.406	42%	0.422	S	S	.	.	H	α-helix	trans	-66.1	-44.2	-177.3	-58.2	0	0	0	0	111	T236 S237 D238 H242 H243 L244	T236-S240 VanDerWaalsContact O-CB 3.31Å; T236-S240 WeakPolarHBondContact O-CB 3.33Å; T236-S240 PolarHBondContact O-N 3.46Å; T236-S240 PolarHBondContact O-OG 3.38Å; S237-S240 PolarHBondContact O-N 2.95Å; D238-S240 VanDerWaalsContact C-N 3.31Å; D238-S240 PolarHBondContact O-N 3.01Å; S240-H242 PolarHBondContact O-N 2.94Å; S240-H243 PolarHBondContact O-N 2.79Å; S240-L244 WeakPolarHBondContact O-CG 3.38Å; S240-L244 PolarHBondContact O-N 3.09Å
241	V	68.1	Low	65.6	Low	66 Å²	66	80.2 Å²	80.2	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-62.4	-42.8	175.2	172.1	0	0	0	0	111.2	S237 D238 K245	S237-V241 WeakPolarHBondContact O-CG2 3.46Å; S237-V241 PolarHBondContact O-N 3.34Å; D238-V241 PolarHBondContact O-N 3.05Å; V241-K245 HydrophobicContact CG1-CD 4.46Å; V241-K245 WeakPolarHBondContact O-CG 3.49Å; V241-K245 PolarHBondContact O-N 2.95Å; V241-K245 VanDerWaalsContact O-N 3.09Å
242	H	64.2	Low	65.6	Low	45 Å²	45	84.1 Å²	84.1	21%	0.208	44%	0.438	C	S	.	.	H	α-helix	trans	-68	-36.8	176.8	-79.8	-62.4	0	0	0	112.6	L132 D238 I239 S240 K245 I246	L132-H242 WeakPolarHBondContact CD1-NE2 3.45Å; D238-H242 WeakPolarHBondContact O-CB 2.98Å; D238-H242 PolarHBondContact O-CD2 3.43Å; D238-H242 PolarHBondContact O-N 3.29Å; I239-H242 PolarHBondContact O-N 3.48Å; S240-H242 PolarHBondContact O-N 2.94Å; H242-K245 PolarHBondContact O-N 3.08Å; H242-I246 WeakPolarHBondContact O-CB 3.48Å; H242-I246 WeakPolarHBondContact O-CG1 3.49Å; H242-I246 PolarHBondContact O-N 2.68Å
243	H	63.3	Low	65.7	Low	100 Å²	100	84.9 Å²	84.9	46%	0.463	44%	0.44	S	S	.	.	H	α-helix	trans	-61.8	-45.1	176.5	-169.2	74.9	0	0	0	111.3	I239 S240 I246 Q247	I239-H243 VanDerWaalsContact O-CB 3.28Å; I239-H243 WeakPolarHBondContact O-CB 3.44Å; I239-H243 PolarHBondContact O-N 3Å; S240-H243 PolarHBondContact O-N 2.79Å; H243-I246 PolarHBondContact O-N 3.34Å; H243-Q247 PolarHBondContact NE2-NE2 3Å; H243-Q247 WeakPolarHBondContact O-CG 3.39Å; H243-Q247 PolarHBondContact O-N 2.93Å
244	L	62.2	Low	65.6	Low	102 Å²	102	82.8 Å²	82.8	53%	0.534	44%	0.438	S	S	.	.	H	α-helix	trans	-62.9	-43	175.8	-69.7	171.9	0	0	0	112.1	S240 I246 Q247 D248	S240-L244 WeakPolarHBondContact O-CG 3.38Å; S240-L244 PolarHBondContact O-N 3.09Å; L244-I246 VanDerWaalsContact C-N 3.34Å; L244-I246 PolarHBondContact O-N 3.45Å; L244-Q247 PolarHBondContact O-N 3.24Å; L244-D248 WeakPolarHBondContact O-CB 3.27Å; L244-D248 PolarHBondContact O-N 3.44Å
245	K	66.7	Low	65.5	Low	108 Å²	108	84.8 Å²	84.8	47%	0.47	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-37.8	175.2	-75.9	178.7	177.3	-178.8	0	112.7	V241 H242 L249	V241-K245 HydrophobicContact CG1-CD 4.46Å; V241-K245 WeakPolarHBondContact O-CG 3.49Å; V241-K245 PolarHBondContact O-N 2.95Å; V241-K245 VanDerWaalsContact O-N 3.09Å; H242-K245 PolarHBondContact O-N 3.08Å; K245-L249 WeakPolarHBondContact O-CB 3.33Å; K245-L249 VanDerWaalsContact O-CG 3.3Å; K245-L249 WeakPolarHBondContact O-CG 3.39Å; K245-L249 PolarHBondContact O-N 3.47Å
246	I	64.6	Low	65.4	Low	91 Å²	91	83.5 Å²	83.5	47%	0.467	45%	0.453	S	S	.	.	H	α-helix	trans	-67.3	-41.5	176.4	-71.2	165.4	0	0	0	110.5	H242 H243 L244 L249 Q250	H242-I246 WeakPolarHBondContact O-CB 3.48Å; H242-I246 WeakPolarHBondContact O-CG1 3.49Å; H242-I246 PolarHBondContact O-N 2.68Å; H243-I246 PolarHBondContact O-N 3.34Å; L244-I246 VanDerWaalsContact C-N 3.34Å; L244-I246 PolarHBondContact O-N 3.45Å; I246-L249 PolarHBondContact O-N 2.97Å; I246-Q250 WeakPolarHBondContact O-CB 3.04Å; I246-Q250 WeakPolarHBondContact O-CG 3.42Å; I246-Q250 PolarHBondContact O-N 3.45Å
247	Q	62.9	Low	65.4	Low	88 Å²	88	82.7 Å²	82.7	41%	0.411	45%	0.449	S	S	.	.	H	α-helix	trans	-63.1	-44.1	175.2	-76.2	-177	-14.5	0	0	111.7	H243 L244 Q250 V251	H243-Q247 PolarHBondContact NE2-NE2 3Å; H243-Q247 WeakPolarHBondContact O-CG 3.39Å; H243-Q247 PolarHBondContact O-N 2.93Å; L244-Q247 PolarHBondContact O-N 3.24Å; Q247-Q250 WeakPolarHBondContact O-CB 3.45Å; Q247-Q250 PolarHBondContact O-N 2.65Å; Q247-V251 WeakPolarHBondContact O-CG2 3.24Å; Q247-V251 PolarHBondContact O-N 3.06Å
248	D	66.5	Low	65.4	Low	88 Å²	88	85.3 Å²	85.3	47%	0.471	46%	0.456	S	S	.	.	H	α-helix	trans	-60.6	-46.5	175.9	-176.5	66.5	0	0	0	111.4	L244 Q250 V251 Q252	L244-D248 WeakPolarHBondContact O-CB 3.27Å; L244-D248 PolarHBondContact O-N 3.44Å; D248-Q250 VanDerWaalsContact C-N 3.31Å; D248-Q250 PolarHBondContact O-N 3.27Å; D248-V251 PolarHBondContact O-N 3.46Å; D248-V251 VanDerWaalsContact O-N 3.15Å; D248-Q252 WeakPolarHBondContact O-CG 3.4Å; D248-Q252 PolarHBondContact O-N 3.24Å; D248-Q252 PolarHBondContact OD2-NE2 3.01Å
249	L	65	Low	65.4	Low	95 Å²	95	88 Å²	88	50%	0.497	47%	0.47	S	S	.	.	H	α-helix	trans	-61	-38	174.2	-74.2	171.5	0	0	0	112.5	K245 I246 V251 Q252 I253	K245-L249 WeakPolarHBondContact O-CB 3.33Å; K245-L249 VanDerWaalsContact O-CG 3.3Å; K245-L249 WeakPolarHBondContact O-CG 3.39Å; K245-L249 PolarHBondContact O-N 3.47Å; I246-L249 PolarHBondContact O-N 2.97Å; L249-V251 VanDerWaalsContact C-N 3.35Å; L249-Q252 PolarHBondContact O-N 3.39Å; L249-I253 WeakPolarHBondContact O-CB 3.22Å; L249-I253 WeakPolarHBondContact O-CD1 3.38Å; L249-I253 WeakPolarHBondContact O-CG1 3.31Å; L249-I253 PolarHBondContact O-N 3.42Å
250	Q	65.9	Low	65.2	Low	124 Å²	124	86.2 Å²	86.2	58%	0.579	47%	0.468	S	S	*	.	H	α-helix	trans	-63.2	-40.2	174.8	-81.1	176.5	-38.2	0	0	112	I246 Q247 D248 S254	I246-Q250 WeakPolarHBondContact O-CB 3.04Å; I246-Q250 WeakPolarHBondContact O-CG 3.42Å; I246-Q250 PolarHBondContact O-N 3.45Å; Q247-Q250 WeakPolarHBondContact O-CB 3.45Å; Q247-Q250 PolarHBondContact O-N 2.65Å; D248-Q250 VanDerWaalsContact C-N 3.31Å; D248-Q250 PolarHBondContact O-N 3.27Å; Q250-S254 WeakPolarHBondContact O-CB 3.19Å; Q250-S254 PolarHBondContact O-N 3.48Å
251	V	68.1	Low	65.6	Low	81 Å²	81	90.4 Å²	90.4	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-65.9	-46.2	175.4	173.4	0	0	0	0	110.6	Q247 D248 L249 I253 S254 N255	Q247-V251 WeakPolarHBondContact O-CG2 3.24Å; Q247-V251 PolarHBondContact O-N 3.06Å; D248-V251 PolarHBondContact O-N 3.46Å; D248-V251 VanDerWaalsContact O-N 3.15Å; L249-V251 VanDerWaalsContact C-N 3.35Å; V251-I253 PolarHBondContact O-N 3.44Å; V251-S254 WeakPolarHBondContact O-CB 3.35Å; V251-S254 PolarHBondContact O-N 3.45Å; V251-S254 VanDerWaalsContact O-N 3.14Å; V251-N255 PolarHBondContact O-N 3.04Å
252	Q	64.5	Low	65.6	Low	106 Å²	106	94 Å²	94	50%	0.495	48%	0.482	S	S	.	.	H	α-helix	trans	-59.8	-44.4	177	-68.8	-174.7	31.8	0	0	112.1	D248 L249 S254 N255 A256	D248-Q252 WeakPolarHBondContact O-CG 3.4Å; D248-Q252 PolarHBondContact O-N 3.24Å; D248-Q252 PolarHBondContact OD2-NE2 3.01Å; L249-Q252 PolarHBondContact O-N 3.39Å; Q252-S254 VanDerWaalsContact C-N 3.33Å; Q252-S254 PolarHBondContact O-N 3Å; Q252-N255 PolarHBondContact O-N 3.5Å; Q252-A256 WeakPolarHBondContact O-CB 3.36Å; Q252-A256 PolarHBondContact O-N 2.95Å
253	I	66.1	Low	65.6	Low	116 Å²	116	97.6 Å²	97.6	60%	0.595	50%	0.501	S	S	*	.	H	α-helix	trans	-63.4	-40.3	175.5	-69.9	166	0	0	0	110.7	L249 V251 S257	L249-I253 WeakPolarHBondContact O-CB 3.22Å; L249-I253 WeakPolarHBondContact O-CD1 3.38Å; L249-I253 WeakPolarHBondContact O-CG1 3.31Å; L249-I253 PolarHBondContact O-N 3.42Å; V251-I253 PolarHBondContact O-N 3.44Å; I253-S257 VanDerWaalsContact O-CB 3.24Å; I253-S257 WeakPolarHBondContact O-CB 3.28Å; I253-S257 PolarHBondContact O-N 2.9Å; I253-S257 PolarHBondContact O-OG 3.32Å
254	S	67.3	Low	65.9	Low	68 Å²	68	100.5 Å²	100.5	48%	0.476	51%	0.508	S	S	.	.	H	α-helix	trans	-62.3	-46.5	177.3	-170	0	0	0	0	111.5	Q250 V251 Q252 S257 H258	Q250-S254 WeakPolarHBondContact O-CB 3.19Å; Q250-S254 PolarHBondContact O-N 3.48Å; V251-S254 WeakPolarHBondContact O-CB 3.35Å; V251-S254 PolarHBondContact O-N 3.45Å; V251-S254 VanDerWaalsContact O-N 3.14Å; Q252-S254 VanDerWaalsContact C-N 3.33Å; Q252-S254 PolarHBondContact O-N 3Å; S254-S257 PolarHBondContact O-N 3.02Å; S254-S257 PolarHBondContact O-OG 3.09Å; S254-H258 PolarHBondContact O-N 3.05Å
255	N	63.8	Low	66.4	Low	96 Å²	96	101.4 Å²	101.4	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-49.1	177.1	-71	-8.7	0	0	0	111.5	V251 Q252 S257 H258 D259	V251-N255 PolarHBondContact O-N 3.04Å; Q252-N255 PolarHBondContact O-N 3.5Å; N255-S257 PolarHBondContact O-N 3.13Å; N255-H258 WeakPolarHBondContact O-CA 3.2Å; N255-H258 WeakPolarHBondContact O-CB 3.5Å; N255-H258 PolarHBondContact O-N 3.36Å; N255-D259 PolarHBondContact O-N 3.31Å
256	A	64	Low	66.6	Low	60 Å²	60	98.8 Å²	98.8	50%	0.496	50%	0.502	S	S	.	.	H	α-helix	trans	-59.5	-36.3	176.3	0	0	0	0	0	112.1	Q252 A260	Q252-A256 WeakPolarHBondContact O-CB 3.36Å; Q252-A256 PolarHBondContact O-N 2.95Å; A256-A260 VanDerWaalsContact O-CB 3.28Å; A256-A260 WeakPolarHBondContact O-CB 2.99Å; A256-A260 PolarHBondContact O-N 3.27Å
257	S	65.3	Low	66.7	Low	55 Å²	55	98.5 Å²	98.5	39%	0.385	50%	0.499	S	S	.	.	H	α-helix	trans	-69.4	-33.5	175.4	79.8	0	0	0	0	112.9	I253 S254 N255 R261	I253-S257 VanDerWaalsContact O-CB 3.24Å; I253-S257 WeakPolarHBondContact O-CB 3.28Å; I253-S257 PolarHBondContact O-N 2.9Å; I253-S257 PolarHBondContact O-OG 3.32Å; S254-S257 PolarHBondContact O-N 3.02Å; S254-S257 PolarHBondContact O-OG 3.09Å; N255-S257 PolarHBondContact O-N 3.13Å; S257-R261 WeakPolarHBondContact O-CB 3.32Å; S257-R261 PolarHBondContact O-N 2.78Å
258	H	68.3	Low	67.4	Low	112 Å²	112	98.2 Å²	98.2	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-70.2	-46.7	175.9	-168.1	81.4	0	0	0	110.7	S254 N255 A260 R261 Y262	S254-H258 PolarHBondContact O-N 3.05Å; N255-H258 WeakPolarHBondContact O-CA 3.2Å; N255-H258 WeakPolarHBondContact O-CB 3.5Å; N255-H258 PolarHBondContact O-N 3.36Å; H258-A260 VanDerWaalsContact C-N 3.32Å; H258-A260 PolarHBondContact O-N 2.92Å; H258-R261 WeakPolarHBondContact O-CB 3.5Å; H258-R261 PolarHBondContact O-N 2.87Å; H258-R261 VanDerWaalsContact O-N 3.07Å; H258-Y262 PolarHBondContact O-N 2.91Å
259	D	67.6	Low	67.7	Low	100 Å²	100	100 Å²	100	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-60	-43.5	175.5	-69.1	-14.8	0	0	0	111.1	N255 R261 Y262 M263	N255-D259 PolarHBondContact O-N 3.31Å; D259-R261 VanDerWaalsContact C-N 3.3Å; D259-R261 PolarHBondContact O-N 2.85Å; D259-Y262 PolarHBondContact O-N 3.3Å; D259-M263 WeakPolarHBondContact O-CB 3.39Å; D259-M263 VanDerWaalsContact O-CG 3.29Å; D259-M263 WeakPolarHBondContact O-CG 3.33Å; D259-M263 PolarHBondContact O-N 3.46Å
260	A	63.1	Low	68.1	Low	51 Å²	51	101.3 Å²	101.3	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-34.8	175.2	0	0	0	0	0	112.7	A256 H258 R264	A256-A260 VanDerWaalsContact O-CB 3.28Å; A256-A260 WeakPolarHBondContact O-CB 2.99Å; A256-A260 PolarHBondContact O-N 3.27Å; H258-A260 VanDerWaalsContact C-N 3.32Å; H258-A260 PolarHBondContact O-N 2.92Å; A260-R264 WeakPolarHBondContact O-CB 3.36Å; A260-R264 PolarHBondContact O-N 2.92Å
261	R	69.6	Low	68.5	Low	147 Å²	147	100.6 Å²	100.6	56%	0.555	51%	0.51	S	S	*	.	H	α-helix	trans	-68.8	-45.9	175.4	-172	-178.1	-65	144.3	2.9	111	S257 H258 D259 R264 E265	S257-R261 WeakPolarHBondContact O-CB 3.32Å; S257-R261 PolarHBondContact O-N 2.78Å; H258-R261 WeakPolarHBondContact O-CB 3.5Å; H258-R261 PolarHBondContact O-N 2.87Å; H258-R261 VanDerWaalsContact O-N 3.07Å; D259-R261 VanDerWaalsContact C-N 3.3Å; D259-R261 PolarHBondContact O-N 2.85Å; R261-R264 WeakPolarHBondContact O-CB 3.42Å; R261-R264 PolarHBondContact O-N 3.01Å; R261-R264 VanDerWaalsContact O-N 3.16Å; R261-E265 PolarHBondContact O-N 3.11Å
262	Y	68.1	Low	69	Low	140 Å²	140	102.3 Å²	102.3	55%	0.549	51%	0.513	S	S	.	.	H	α-helix	trans	-61.7	-44.5	176.9	-177.7	-98.6	0	0	0	112	H258 D259 R264 E265 T266	H258-Y262 PolarHBondContact O-N 2.91Å; D259-Y262 PolarHBondContact O-N 3.3Å; Y262-R264 VanDerWaalsContact C-N 3.29Å; Y262-R264 PolarHBondContact O-N 3.4Å; Y262-E265 PolarHBondContact O-N 3.45Å; Y262-T266 HydrophobicContact CD1-CG2 4.37Å; Y262-T266 HydrophobicContact CE1-CG2 3.96Å; Y262-T266 WeakPolarHBondContact O-CG2 3.24Å; Y262-T266 PolarHBondContact O-N 2.99Å; Y262-T266 PolarHBondContact O-OG1 3.06Å
263	M	64.4	Low	69.6	Low	122 Å²	122	100.2 Å²	100.2	60%	0.601	51%	0.507	S	S	*	.	H	α-helix	trans	-60.6	-37.5	173.6	-73.9	-60.5	-61.8	0	0	112.2	D259 T266 Q267	D259-M263 WeakPolarHBondContact O-CB 3.39Å; D259-M263 VanDerWaalsContact O-CG 3.29Å; D259-M263 WeakPolarHBondContact O-CG 3.33Å; D259-M263 PolarHBondContact O-N 3.46Å; M263-T266 WeakPolarHBondContact CA-OG1 3.39Å; M263-T266 PolarHBondContact O-OG1 3.12Å; M263-Q267 WeakPolarHBondContact O-CB 3.31Å; M263-Q267 PolarHBondContact O-N 3.31Å
264	R	69.6	Low	70	Confident	160 Å²	160	99.7 Å²	99.7	60%	0.604	51%	0.505	S	S	*	.	H	α-helix	trans	-68.8	-40.4	175.7	-171.2	179.1	-101.2	124.2	-7	112.1	A260 R261 Y262 Q267 V268	A260-R264 WeakPolarHBondContact O-CB 3.36Å; A260-R264 PolarHBondContact O-N 2.92Å; R261-R264 WeakPolarHBondContact O-CB 3.42Å; R261-R264 PolarHBondContact O-N 3.01Å; R261-R264 VanDerWaalsContact O-N 3.16Å; Y262-R264 VanDerWaalsContact C-N 3.29Å; Y262-R264 PolarHBondContact O-N 3.4Å; R264-Q267 PolarHBondContact O-N 3.33Å; R264-V268 WeakPolarHBondContact O-CG2 3.25Å; R264-V268 PolarHBondContact O-N 3.5Å
265	E	74.2	Confident	70.5	Confident	121 Å²	121	103.6 Å²	103.6	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-62.5	-45.5	175.8	-75.3	173.3	-170.4	0	0	111.8	R261 Y262 Q267 V268 H269	R261-E265 PolarHBondContact O-N 3.11Å; Y262-E265 PolarHBondContact O-N 3.45Å; E265-Q267 PolarHBondContact O-N 3.38Å; E265-V268 PolarHBondContact O-N 3.41Å; E265-H269 PolarHBondContact O-N 3.18Å
266	T	69.2	Low	71.6	Confident	53 Å²	53	103.2 Å²	103.2	33%	0.325	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-38.5	176	54.3	0	0	0	0	112.7	Y262 M263 H269 M270	Y262-T266 HydrophobicContact CD1-CG2 4.37Å; Y262-T266 HydrophobicContact CE1-CG2 3.96Å; Y262-T266 WeakPolarHBondContact O-CG2 3.24Å; Y262-T266 PolarHBondContact O-N 2.99Å; Y262-T266 PolarHBondContact O-OG1 3.06Å; M263-T266 WeakPolarHBondContact CA-OG1 3.39Å; M263-T266 PolarHBondContact O-OG1 3.12Å; T266-H269 PolarHBondContact O-N 2.96Å; T266-M270 WeakPolarHBondContact O-CB 3.16Å; T266-M270 PolarHBondContact O-N 3.42Å
267	Q	67.4	Low	72.4	Confident	86 Å²	86	105.7 Å²	105.7	40%	0.402	51%	0.513	S	S	.	.	H	α-helix	trans	-61.6	-46.3	174.2	-176.2	-176.9	-22.8	0	0	111.6	M263 R264 E265 H269 M270 E271	M263-Q267 WeakPolarHBondContact O-CB 3.31Å; M263-Q267 PolarHBondContact O-N 3.31Å; R264-Q267 PolarHBondContact O-N 3.33Å; E265-Q267 PolarHBondContact O-N 3.38Å; Q267-H269 VanDerWaalsContact C-N 3.32Å; Q267-H269 PolarHBondContact O-N 3.42Å; Q267-M270 PolarHBondContact O-N 3.49Å; Q267-E271 HydrophobicContact CG-CG 4.5Å; Q267-E271 PolarHBondContact NE2-OE1 3.06Å; Q267-E271 WeakPolarHBondContact O-CG 3.49Å; Q267-E271 PolarHBondContact O-N 3.37Å
268	V	77.1	Confident	73	Confident	82 Å²	82	107.2 Å²	107.2	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-60.4	-43.2	178.5	169.9	0	0	0	0	111	R264 E265 M270 E271 E272	R264-V268 WeakPolarHBondContact O-CG2 3.25Å; R264-V268 PolarHBondContact O-N 3.5Å; E265-V268 PolarHBondContact O-N 3.41Å; V268-M270 PolarHBondContact O-N 3.39Å; V268-E271 PolarHBondContact O-N 3.34Å; V268-E272 PolarHBondContact O-N 2.97Å
269	H	73.6	Confident	73.8	Confident	125 Å²	125	107.6 Å²	107.6	58%	0.579	52%	0.521	S	S	*	.	H	α-helix	trans	-64.1	-40.5	177.9	-173.4	61.9	0	0	0	112.8	E265 T266 Q267 E272 T273	E265-H269 PolarHBondContact O-N 3.18Å; T266-H269 PolarHBondContact O-N 2.96Å; Q267-H269 VanDerWaalsContact C-N 3.32Å; Q267-H269 PolarHBondContact O-N 3.42Å; H269-E272 PolarHBondContact O-N 2.77Å; H269-T273 PolarHBondContact O-N 2.77Å; H269-T273 PolarHBondContact O-OG1 3.15Å
270	M	73	Confident	74.6	Confident	123 Å²	123	107.7 Å²	107.7	61%	0.606	52%	0.521	S	S	*	.	H	α-helix	trans	-67.8	-39.2	176	177.8	169.7	32.8	0	0	112	T266 Q267 V268 E272 T273 L274	T266-M270 WeakPolarHBondContact O-CB 3.16Å; T266-M270 PolarHBondContact O-N 3.42Å; Q267-M270 PolarHBondContact O-N 3.49Å; V268-M270 PolarHBondContact O-N 3.39Å; M270-E272 VanDerWaalsContact C-N 3.33Å; M270-E272 PolarHBondContact O-N 2.96Å; M270-T273 PolarHBondContact O-N 2.91Å; M270-L274 WeakPolarHBondContact O-CB 3.36Å; M270-L274 PolarHBondContact O-N 3.37Å
271	E	74.1	Confident	75.3	Confident	109 Å²	109	110.1 Å²	110.1	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-61.5	-41.2	173.9	-77.2	177.8	-171.6	0	0	111.8	Q267 V268 L274 K275	Q267-E271 HydrophobicContact CG-CG 4.5Å; Q267-E271 PolarHBondContact NE2-OE1 3.06Å; Q267-E271 WeakPolarHBondContact O-CG 3.49Å; Q267-E271 PolarHBondContact O-N 3.37Å; V268-E271 PolarHBondContact O-N 3.34Å; E271-L274 PolarHBondContact O-N 3.43Å; E271-K275 WeakPolarHBondContact O-CB 3.16Å; E271-K275 PolarHBondContact O-N 2.87Å
272	E	78.8	Confident	75.6	Confident	117 Å²	117	106.7 Å²	106.7	55%	0.547	53%	0.525	S	S	.	.	H	α-helix	trans	-65.1	-41.2	175.5	-170.7	168.9	-153.5	0	0	111.9	V268 H269 M270 K275 N276	V268-E272 PolarHBondContact O-N 2.97Å; H269-E272 PolarHBondContact O-N 2.77Å; M270-E272 VanDerWaalsContact C-N 3.33Å; M270-E272 PolarHBondContact O-N 2.96Å; E272-K275 PolarHBondContact O-N 3.38Å; E272-N276 PolarHBondContact O-N 3.24Å
273	T	76.3	Confident	76.4	Confident	61 Å²	61	103.8 Å²	103.8	37%	0.374	52%	0.522	S	S	.	.	H	α-helix	trans	-61.5	-46.9	174.7	-54.7	0	0	0	0	111.1	H269 M270 K275 N276 E277	H269-T273 PolarHBondContact O-N 2.77Å; H269-T273 PolarHBondContact O-OG1 3.15Å; M270-T273 PolarHBondContact O-N 2.91Å; T273-K275 VanDerWaalsContact C-N 3.3Å; T273-K275 PolarHBondContact O-N 2.82Å; T273-N276 PolarHBondContact O-N 3.04Å; T273-E277 PolarHBondContact O-N 3.38Å
274	L	75.9	Confident	77.4	Confident	106 Å²	106	101.8 Å²	101.8	56%	0.555	51%	0.513	S	S	*	.	H	α-helix	trans	-63.2	-38	178.8	-156.7	83.6	0	0	0	111.5	M270 E271 E277 V278	M270-L274 WeakPolarHBondContact O-CB 3.36Å; M270-L274 PolarHBondContact O-N 3.37Å; E271-L274 PolarHBondContact O-N 3.43Å; L274-E277 PolarHBondContact O-N 3.49Å; L274-V278 WeakPolarHBondContact O-CB 3.45Å; L274-V278 VanDerWaalsContact O-CG2 3.28Å; L274-V278 WeakPolarHBondContact O-CG2 3.49Å; L274-V278 PolarHBondContact O-N 2.96Å
275	K	78.3	Confident	77.8	Confident	150 Å²	150	98.4 Å²	98.4	65%	0.652	51%	0.51	S	S	*	.	H	α-helix	trans	-62.6	-43	176.4	-169.8	-179.4	177.7	-172.5	0	111.6	E271 E272 T273 V278 E279	E271-K275 WeakPolarHBondContact O-CB 3.16Å; E271-K275 PolarHBondContact O-N 2.87Å; E272-K275 PolarHBondContact O-N 3.38Å; T273-K275 VanDerWaalsContact C-N 3.3Å; T273-K275 PolarHBondContact O-N 2.82Å; K275-V278 PolarHBondContact O-N 3.48Å; K275-E279 WeakPolarHBondContact O-CB 3.4Å; K275-E279 PolarHBondContact O-N 3.16Å
276	N	85.7	Confident	78.1	Confident	87 Å²	87	96.6 Å²	96.6	47%	0.465	50%	0.502	S	S	.	.	H	α-helix	trans	-63.7	-42.4	175.3	-69.7	-18.3	0	0	0	111.7	E272 T273 E279 I280	E272-N276 PolarHBondContact O-N 3.24Å; T273-N276 PolarHBondContact O-N 3.04Å; N276-E279 PolarHBondContact O-N 3.43Å; N276-I280 WeakPolarHBondContact O-CG1 3.5Å; N276-I280 PolarHBondContact O-N 3.38Å
277	E	80.6	Confident	78.7	Confident	113 Å²	113	98.5 Å²	98.5	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-63.7	-41.5	176.4	-71	-166.2	167.6	0	0	112.3	T273 L274 E279 I280 L281	T273-E277 PolarHBondContact O-N 3.38Å; L274-E277 PolarHBondContact O-N 3.49Å; E277-E279 VanDerWaalsContact C-N 3.33Å; E277-E279 PolarHBondContact O-N 3.47Å; E277-I280 PolarHBondContact O-N 3.09Å; E277-L281 WeakPolarHBondContact O-CB 3.33Å; E277-L281 WeakPolarHBondContact O-CG 3.47Å; E277-L281 PolarHBondContact O-N 3.26Å
278	V	79.1	Confident	79.2	Confident	86 Å²	86	99 Å²	99	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-64.2	-38.1	175.6	170.7	0	0	0	0	111.4	L274 K275 L281 S282	L274-V278 WeakPolarHBondContact O-CB 3.45Å; L274-V278 VanDerWaalsContact O-CG2 3.28Å; L274-V278 WeakPolarHBondContact O-CG2 3.49Å; L274-V278 PolarHBondContact O-N 2.96Å; K275-V278 PolarHBondContact O-N 3.48Å; V278-L281 PolarHBondContact O-N 3.14Å; V278-S282 WeakPolarHBondContact O-CB 3.33Å; V278-S282 PolarHBondContact O-N 3Å
279	E	84.4	Confident	79.1	Confident	120 Å²	120	102.1 Å²	102.1	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-65.3	-42	176.2	-173.9	167.8	-175.8	0	0	112	K275 N276 E277 S282 T283	K275-E279 WeakPolarHBondContact O-CB 3.4Å; K275-E279 PolarHBondContact O-N 3.16Å; N276-E279 PolarHBondContact O-N 3.43Å; E277-E279 VanDerWaalsContact C-N 3.33Å; E277-E279 PolarHBondContact O-N 3.47Å; E279-S282 PolarHBondContact O-N 2.89Å; E279-T283 PolarHBondContact O-N 2.92Å; E279-T283 PolarHBondContact O-OG1 3.49Å
280	I	84.6	Confident	79.1	Confident	102 Å²	102	100 Å²	100	52%	0.523	51%	0.51	S	S	.	.	H	α-helix	trans	-61	-48.6	172.5	-68.2	161.4	0	0	0	110.4	N276 E277 S282 T283 I284	N276-I280 WeakPolarHBondContact O-CG1 3.5Å; N276-I280 PolarHBondContact O-N 3.38Å; E277-I280 PolarHBondContact O-N 3.09Å; I280-S282 VanDerWaalsContact C-N 3.32Å; I280-S282 PolarHBondContact O-N 3.48Å; I280-T283 WeakPolarHBondContact O-CB 3.31Å; I280-T283 PolarHBondContact O-N 3.4Å; I280-T283 VanDerWaalsContact O-N 3.17Å; I280-I284 HydrophobicContact CG2-CD1 3.79Å; I280-I284 HydrophobicContact CG2-CG1 4.45Å; I280-I284 WeakPolarHBondContact O-CG1 3.4Å; I280-I284 PolarHBondContact O-N 2.91Å
281	L	76.6	Confident	79.2	Confident	103 Å²	103	99.9 Å²	99.9	54%	0.539	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-38.4	179	-73	172.3	0	0	0	112.2	E277 V278 T283 I284 T285	E277-L281 WeakPolarHBondContact O-CB 3.33Å; E277-L281 WeakPolarHBondContact O-CG 3.47Å; E277-L281 PolarHBondContact O-N 3.26Å; V278-L281 PolarHBondContact O-N 3.14Å; L281-T283 VanDerWaalsContact C-N 3.33Å; L281-I284 PolarHBondContact O-N 3.26Å; L281-T285 WeakPolarHBondContact O-CB 3.02Å; L281-T285 PolarHBondContact O-N 3.29Å; L281-T285 PolarHBondContact O-OG1 2.91Å
282	S	77.3	Confident	79.3	Confident	75 Å²	75	100.4 Å²	100.4	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-42.1	174.5	-174.8	0	0	0	0	111.4	V278 E279 I280 T285 E286	V278-S282 WeakPolarHBondContact O-CB 3.33Å; V278-S282 PolarHBondContact O-N 3Å; E279-S282 PolarHBondContact O-N 2.89Å; I280-S282 VanDerWaalsContact C-N 3.32Å; I280-S282 PolarHBondContact O-N 3.48Å; S282-T285 PolarHBondContact O-N 2.98Å; S282-E286 PolarHBondContact O-N 2.85Å
283	T	84.2	Confident	79.1	Confident	78 Å²	78	102.1 Å²	102.1	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-64.1	-47.2	177.5	-53.4	0	0	0	0	110.9	E279 I280 L281 T285 E286 D287	E279-T283 PolarHBondContact O-N 2.92Å; E279-T283 PolarHBondContact O-OG1 3.49Å; I280-T283 WeakPolarHBondContact O-CB 3.31Å; I280-T283 PolarHBondContact O-N 3.4Å; I280-T283 VanDerWaalsContact O-N 3.17Å; L281-T283 VanDerWaalsContact C-N 3.33Å; T283-T285 VanDerWaalsContact C-N 3.3Å; T283-T285 PolarHBondContact O-N 2.68Å; T283-E286 PolarHBondContact O-N 3.19Å; T283-D287 PolarHBondContact O-N 3.36Å
284	I	84.6	Confident	78.9	Confident	81 Å²	81	104.2 Å²	104.2	42%	0.415	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-41.4	175.9	-66.4	167.5	0	0	0	110.9	I280 L281 D287 L288	I280-I284 HydrophobicContact CG2-CD1 3.79Å; I280-I284 HydrophobicContact CG2-CG1 4.45Å; I280-I284 WeakPolarHBondContact O-CG1 3.4Å; I280-I284 PolarHBondContact O-N 2.91Å; L281-I284 PolarHBondContact O-N 3.26Å; I284-D287 PolarHBondContact O-N 3.28Å; I284-L288 HydrophobicContact CG2-CD1 3.93Å; I284-L288 HydrophobicContact CG2-CG 4.32Å; I284-L288 WeakPolarHBondContact O-CB 3.11Å; I284-L288 VanDerWaalsContact O-CG 3.29Å; I284-L288 WeakPolarHBondContact O-CG 3.44Å; I284-L288 PolarHBondContact O-N 3.07Å
285	T	78.1	Confident	78.6	Confident	88 Å²	88	104.9 Å²	104.9	54%	0.54	52%	0.519	S	S	.	.	H	α-helix	trans	-64.9	-41.9	-179.8	-57.1	0	0	0	0	111.1	L281 S282 T283 L288 R289	L281-T285 WeakPolarHBondContact O-CB 3.02Å; L281-T285 PolarHBondContact O-N 3.29Å; L281-T285 PolarHBondContact O-OG1 2.91Å; S282-T285 PolarHBondContact O-N 2.98Å; T283-T285 VanDerWaalsContact C-N 3.3Å; T283-T285 PolarHBondContact O-N 2.68Å; T285-L288 PolarHBondContact O-N 3.26Å; T285-R289 VanDerWaalsContact O-CB 3.32Å; T285-R289 WeakPolarHBondContact O-CB 3.48Å; T285-R289 PolarHBondContact O-N 3.25Å
286	E	81.2	Confident	78.3	Confident	84 Å²	84	100.2 Å²	100.2	39%	0.393	51%	0.506	S	S	.	.	H	α-helix	trans	-69.2	-38	177.1	-165.9	61	-166.7	0	0	111.8	S282 T283 R289 L290	S282-E286 PolarHBondContact O-N 2.85Å; T283-E286 PolarHBondContact O-N 3.19Å; E286-R289 WeakPolarHBondContact O-CB 3.26Å; E286-R289 PolarHBondContact O-N 3.45Å; E286-R289 IonicContact OE1-CZ 3.43Å; E286-R289 IonicContact OE1-NE 3.21Å; E286-R289 PolarHBondContact OE1-NE 3.08Å; E286-R289 IonicContact OE1-NH2 2.78Å; E286-R289 PolarHBondContact OE1-NH2 3.46Å; E286-R289 IonicContact OE2-CZ 3.87Å; E286-R289 IonicContact OE2-NE 2.68Å; E286-R289 PolarHBondContact OE2-NE 2.86Å; E286-R289 IonicContact OE2-NH2 3.91Å; E286-L290 HydrophobicContact CG-CD1 4.43Å; E286-L290 WeakPolarHBondContact O-CB 3.28Å; E286-L290 WeakPolarHBondContact O-CG 3.5Å; E286-L290 PolarHBondContact O-N 3.36Å
287	D	81.1	Confident	77.4	Confident	92 Å²	92	99.1 Å²	99.1	49%	0.492	50%	0.5	S	S	.	.	H	α-helix	trans	-61.5	-42.8	172.5	-88.9	2.2	0	0	0	112.3	T283 I284 L290 K291	T283-D287 PolarHBondContact O-N 3.36Å; I284-D287 PolarHBondContact O-N 3.28Å; D287-L290 PolarHBondContact O-N 2.89Å; D287-K291 WeakPolarHBondContact O-CG 3.22Å; D287-K291 PolarHBondContact O-N 3.01Å
288	L	77.8	Confident	76.7	Confident	98 Å²	98	98.4 Å²	98.4	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-65.7	-40.7	174.6	-73	172.7	0	0	0	111.1	I284 T285 L290 K291 D292	I284-L288 HydrophobicContact CG2-CD1 3.93Å; I284-L288 HydrophobicContact CG2-CG 4.32Å; I284-L288 WeakPolarHBondContact O-CB 3.11Å; I284-L288 VanDerWaalsContact O-CG 3.29Å; I284-L288 WeakPolarHBondContact O-CG 3.44Å; I284-L288 PolarHBondContact O-N 3.07Å; T285-L288 PolarHBondContact O-N 3.26Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L288-L290 PolarHBondContact O-N 2.67Å; L288-K291 PolarHBondContact O-N 2.93Å; L288-D292 PolarHBondContact O-N 3.39Å
289	R	75.8	Confident	75.7	Confident	147 Å²	147	99.6 Å²	99.6	56%	0.555	50%	0.502	S	S	*	.	H	α-helix	trans	-63.8	-38.9	177.1	-159	-177	77.6	80.8	5	111.9	T285 E286 W293	T285-R289 VanDerWaalsContact O-CB 3.32Å; T285-R289 WeakPolarHBondContact O-CB 3.48Å; T285-R289 PolarHBondContact O-N 3.25Å; E286-R289 WeakPolarHBondContact O-CB 3.26Å; E286-R289 PolarHBondContact O-N 3.45Å; E286-R289 IonicContact OE1-CZ 3.43Å; E286-R289 IonicContact OE1-NE 3.21Å; E286-R289 PolarHBondContact OE1-NE 3.08Å; E286-R289 IonicContact OE1-NH2 2.78Å; E286-R289 PolarHBondContact OE1-NH2 3.46Å; E286-R289 IonicContact OE2-CZ 3.87Å; E286-R289 IonicContact OE2-NE 2.68Å; E286-R289 PolarHBondContact OE2-NE 2.86Å; E286-R289 IonicContact OE2-NH2 3.91Å; R289-W293 WeakPolarHBondContact O-CB 3.47Å; R289-W293 PolarHBondContact O-N 3.01Å
290	L	74.1	Confident	74.6	Confident	80 Å²	80	100 Å²	100	42%	0.419	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-45.5	172.8	-82.2	158.6	0	0	0	111.3	E286 D287 L288 D292 W293 E294	E286-L290 HydrophobicContact CG-CD1 4.43Å; E286-L290 WeakPolarHBondContact O-CB 3.28Å; E286-L290 WeakPolarHBondContact O-CG 3.5Å; E286-L290 PolarHBondContact O-N 3.36Å; D287-L290 PolarHBondContact O-N 2.89Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L288-L290 PolarHBondContact O-N 2.67Å; L290-D292 PolarHBondContact O-N 3.46Å; L290-W293 WeakPolarHBondContact O-CB 3.49Å; L290-W293 PolarHBondContact O-N 2.77Å; L290-E294 WeakPolarHBondContact O-CG 3.42Å; L290-E294 PolarHBondContact O-N 2.92Å
291	K	75.2	Confident	73.2	Confident	120 Å²	120	101.5 Å²	101.5	52%	0.522	51%	0.511	S	S	.	.	H	α-helix	trans	-63	-39.4	175.8	-78.5	179.6	178.5	172.5	0	113.3	D287 L288 W293 E294 H295	D287-K291 WeakPolarHBondContact O-CG 3.22Å; D287-K291 PolarHBondContact O-N 3.01Å; L288-K291 PolarHBondContact O-N 2.93Å; K291-W293 VanDerWaalsContact C-N 3.35Å; K291-E294 PolarHBondContact O-N 3.34Å; K291-H295 PolarHBondContact O-N 3.44Å; K291-H295 PolarHBondContact O-ND1 3.1Å
292	D	74.9	Confident	72.3	Confident	120 Å²	120	102.7 Å²	102.7	64%	0.642	52%	0.516	S	S	*	.	H	α-helix	trans	-65.8	-39.2	174.9	-87.5	-5.7	0	0	0	111.4	L288 L290 H295 S296	L288-D292 PolarHBondContact O-N 3.39Å; L290-D292 PolarHBondContact O-N 3.46Å; D292-H295 PolarHBondContact O-N 2.71Å; D292-S296 VanDerWaalsContact O-CB 3.31Å; D292-S296 WeakPolarHBondContact O-CB 3.31Å; D292-S296 PolarHBondContact O-N 2.99Å
293	W	75.1	Confident	71	Confident	153 Å²	153	104 Å²	104	58%	0.58	52%	0.521	S	S	*	.	H	α-helix	trans	-63.6	-44.7	173.8	179.2	86.3	0	0	0	111.8	R289 L290 K291 S296 N297	R289-W293 WeakPolarHBondContact O-CB 3.47Å; R289-W293 PolarHBondContact O-N 3.01Å; L290-W293 WeakPolarHBondContact O-CB 3.49Å; L290-W293 PolarHBondContact O-N 2.77Å; K291-W293 VanDerWaalsContact C-N 3.35Å; W293-S296 PolarHBondContact O-N 3.35Å; W293-N297 WeakPolarHBondContact CH2-ND2 3.29Å; W293-N297 WeakPolarHBondContact CZ2-ND2 3.43Å; W293-N297 WeakPolarHBondContact O-CB 3.38Å; W293-N297 PolarHBondContact O-N 2.75Å
294	E	72.3	Confident	69.1	Low	106 Å²	106	105.4 Å²	105.4	50%	0.495	53%	0.534	S	S	.	.	H	α-helix	trans	-60.1	-46.6	175.1	-73	179.7	168.2	0	0	111.8	L290 K291 S296 N297 I298	L290-E294 WeakPolarHBondContact O-CG 3.42Å; L290-E294 PolarHBondContact O-N 2.92Å; K291-E294 PolarHBondContact O-N 3.34Å; E294-S296 PolarHBondContact O-N 3.12Å; E294-N297 PolarHBondContact O-N 3.48Å; E294-I298 VanDerWaalsContact O-CG1 3.3Å; E294-I298 WeakPolarHBondContact O-CG1 3.41Å; E294-I298 PolarHBondContact O-N 3.45Å
295	H	70.6	Confident	67.2	Low	119 Å²	119	109.4 Å²	109.4	55%	0.551	56%	0.556	S	S	*	*	H	α-helix	trans	-60.9	-42	175.2	-83.5	78.6	0	0	0	112.3	K291 D292 N297 I298 L299	K291-H295 PolarHBondContact O-N 3.44Å; K291-H295 PolarHBondContact O-ND1 3.1Å; D292-H295 PolarHBondContact O-N 2.71Å; H295-N297 VanDerWaalsContact C-N 3.32Å; H295-N297 PolarHBondContact O-N 3.31Å; H295-I298 PolarHBondContact O-N 3.39Å; H295-L299 WeakPolarHBondContact O-CB 3.4Å; H295-L299 WeakPolarHBondContact O-CG 3.47Å; H295-L299 PolarHBondContact O-N 3.07Å
296	S	70.4	Confident	65.6	Low	53 Å²	53	114.9 Å²	114.9	37%	0.371	58%	0.575	S	S	.	*	H	α-helix	trans	-63.3	-37.7	176	-170.8	0	0	0	0	112	D292 W293 E294 L299 K300	D292-S296 VanDerWaalsContact O-CB 3.31Å; D292-S296 WeakPolarHBondContact O-CB 3.31Å; D292-S296 PolarHBondContact O-N 2.99Å; W293-S296 PolarHBondContact O-N 3.35Å; E294-S296 PolarHBondContact O-N 3.12Å; S296-L299 PolarHBondContact O-N 3.05Å; S296-K300 WeakPolarHBondContact O-CB 3.43Å; S296-K300 WeakPolarHBondContact O-CG 3.34Å; S296-K300 PolarHBondContact O-N 2.93Å
297	N	66.8	Low	64.1	Low	64 Å²	64	113.8 Å²	113.8	34%	0.342	59%	0.586	S	S	.	*	H	α-helix	trans	-70.7	-38.7	177.2	-123	12.3	0	0	0	112.2	W293 E294 H295 K300 N301	W293-N297 WeakPolarHBondContact CH2-ND2 3.29Å; W293-N297 WeakPolarHBondContact CZ2-ND2 3.43Å; W293-N297 WeakPolarHBondContact O-CB 3.38Å; W293-N297 PolarHBondContact O-N 2.75Å; E294-N297 PolarHBondContact O-N 3.48Å; H295-N297 VanDerWaalsContact C-N 3.32Å; H295-N297 PolarHBondContact O-N 3.31Å; N297-K300 PolarHBondContact O-N 2.85Å; N297-N301 PolarHBondContact O-N 2.9Å
298	I	65.6	Low	62.4	Low	98 Å²	98	115.1 Å²	115.1	50%	0.503	60%	0.6	S	S	.	*	H	α-helix	trans	-60.8	-46.7	171.9	-67.7	165	0	0	0	109.9	E294 H295 K300 N301 I302	E294-I298 VanDerWaalsContact O-CG1 3.3Å; E294-I298 WeakPolarHBondContact O-CG1 3.41Å; E294-I298 PolarHBondContact O-N 3.45Å; H295-I298 PolarHBondContact O-N 3.39Å; I298-K300 PolarHBondContact O-N 3.31Å; I298-N301 PolarHBondContact O-N 3.31Å; I298-I302 HydrophobicContact CG2-CD1 3.97Å; I298-I302 VanDerWaalsContact O-CG1 3.31Å; I298-I302 WeakPolarHBondContact O-CG1 3.3Å; I298-I302 PolarHBondContact O-N 3.39Å; I298-I302 VanDerWaalsContact O-N 3.14Å
299	L	59.9	Low	61.2	Low	110 Å²	110	116.9 Å²	116.9	58%	0.576	62%	0.617	S	S	*	*	H	α-helix	trans	-61.2	-42.5	176.2	-81.1	161.1	0	0	0	112.4	H295 S296 N301 I302 T303	H295-L299 WeakPolarHBondContact O-CB 3.4Å; H295-L299 WeakPolarHBondContact O-CG 3.47Å; H295-L299 PolarHBondContact O-N 3.07Å; S296-L299 PolarHBondContact O-N 3.05Å; L299-N301 PolarHBondContact O-N 3.46Å; L299-I302 PolarHBondContact O-N 2.92Å; L299-I302 VanDerWaalsContact O-N 3.15Å; L299-T303 PolarHBondContact O-N 3.42Å; L299-T303 VanDerWaalsContact O-N 3.16Å; L299-T303 PolarHBondContact O-OG1 2.95Å
300	K	60.2	Low	59.6	Low	130 Å²	130	112.9 Å²	112.9	57%	0.565	62%	0.621	S	S	*	*	H	α-helix	trans	-62.2	-41.6	176.3	-80.9	178.1	-179.7	176	0	112.6	S296 N297 I298 I302 T303	S296-K300 WeakPolarHBondContact O-CB 3.43Å; S296-K300 WeakPolarHBondContact O-CG 3.34Å; S296-K300 PolarHBondContact O-N 2.93Å; N297-K300 PolarHBondContact O-N 2.85Å; I298-K300 PolarHBondContact O-N 3.31Å; K300-I302 PolarHBondContact O-N 3.29Å; K300-T303 WeakPolarHBondContact CA-OG1 3.36Å; K300-T303 PolarHBondContact O-N 3.49Å; K300-T303 VanDerWaalsContact O-N 3.12Å; K300-T303 PolarHBondContact O-OG1 2.96Å
301	N	55.8	Low	58.3	Low	133 Å²	133	115.3 Å²	115.3	71%	0.711	64%	0.642	S	S	*	*	H	α-helix	trans	-65.6	-26.3	175.9	-81.5	-10.3	0	0	0	112.8	N297 I298 L299	N297-N301 PolarHBondContact O-N 2.9Å; I298-N301 PolarHBondContact O-N 3.31Å; L299-N301 PolarHBondContact O-N 3.46Å
302	I	56.7	Low	57	Low	127 Å²	127	119.7 Å²	119.7	65%	0.651	66%	0.661	S	S	*	*	H	α-helix	trans	-78.6	-23.7	174.5	-65.3	164.7	0	0	0	111.6	I298 L299 K300	I298-I302 HydrophobicContact CG2-CD1 3.97Å; I298-I302 VanDerWaalsContact O-CG1 3.31Å; I298-I302 WeakPolarHBondContact O-CG1 3.3Å; I298-I302 PolarHBondContact O-N 3.39Å; I298-I302 VanDerWaalsContact O-N 3.14Å; L299-I302 PolarHBondContact O-N 2.92Å; L299-I302 VanDerWaalsContact O-N 3.15Å; K300-I302 PolarHBondContact O-N 3.29Å
303	T	51.3	Low	55.5	Low	103 Å²	103	117.2 Å²	117.2	63%	0.632	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	10.8	-176.3	52.7	0	0	0	0	116.4	L299 K300 L305	L299-T303 PolarHBondContact O-N 3.42Å; L299-T303 VanDerWaalsContact O-N 3.16Å; L299-T303 PolarHBondContact O-OG1 2.95Å; K300-T303 WeakPolarHBondContact CA-OG1 3.36Å; K300-T303 PolarHBondContact O-N 3.49Å; K300-T303 VanDerWaalsContact O-N 3.12Å; K300-T303 PolarHBondContact O-OG1 2.96Å; T303-L305 VanDerWaalsContact C-N 3.31Å; T303-L305 PolarHBondContact O-N 2.87Å
304	S	44.2	Very low	54.2	Low	108 Å²	108	119.2 Å²	119.2	76%	0.755	68%	0.68	S	S	*	*			trans	-83.4	70.4	175	-162.6	0	0	0	0	112.3
305	L	43.9	Very low	53	Low	165 Å²	165	124.1 Å²	124.1	86%	0.864	70%	0.699	S	S	*	*			trans	-139.8	98.9	159.7	-89.7	165.5	0	0	0	107.3	T303 G307	T303-L305 VanDerWaalsContact C-N 3.31Å; T303-L305 PolarHBondContact O-N 2.87Å; L305-G307 PolarHBondContact O-N 3.24Å
306	E	45.4	Very low	51.9	Low	203 Å²	203	121.6 Å²	121.6	95%	0.949	71%	0.706	S	S	*	*			trans	-70.9	112.6	178.2	-156	169	-162.5	0	0	109.3
307	G	48.1	Very low	50.8	Low	60 Å²	60	127 Å²	127	62%	0.619	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-87.1	145.7	174.5	0	0	0	0	0	111.6	L305	L305-G307 PolarHBondContact O-N 3.24Å
308	P	46.3	Very low	50	Low	121 Å²	121	130.8 Å²	130.8	79%	0.786	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-67.2	157.5	-175	27.7	-33.6	0	0	0	112.6	G310	P308-G310 PolarHBondContact O-N 2.96Å
309	P	52.6	Low	49.1	Very low	134 Å²	134	128.7 Å²	128.7	87%	0.87	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-63.4	125.2	-172.4	-17.3	29.5	0	0	0	112.2
310	G	42.7	Very low	48.7	Very low	63 Å²	63	129.8 Å²	129.8	65%	0.649	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-74.4	153.4	173.2	0	0	0	0	0	112.7	P308	P308-G310 PolarHBondContact O-N 2.96Å
311	P	45.4	Very low	48.4	Very low	132 Å²	132	131.5 Å²	131.5	86%	0.857	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-66	145.7	-175.4	27	-33.6	0	0	0	112.4	G313	P311-G313 PolarHBondContact O-N 3.46Å; P311-G313 VanDerWaalsContact O-N 3.12Å
312	K	47.8	Very low	48	Very low	211 Å²	211	128.1 Å²	128.1	92%	0.917	78%	0.784	S	S	*	*			trans	-65.9	106.2	-178.8	-161.8	175.1	-172.7	177.5	0	110.2
313	G	43.4	Very low	47.6	Very low	68 Å²	68	127.1 Å²	127.1	70%	0.701	79%	0.794	S	S	*	*			trans	-76.3	149.7	176.1	0	0	0	0	0	113.2	P311	P311-G313 PolarHBondContact O-N 3.46Å; P311-G313 VanDerWaalsContact O-N 3.12Å
314	E	49.3	Very low	47.7	Very low	195 Å²	195	127.7 Å²	127.7	91%	0.911	80%	0.802	S	S	*	*			trans	-63.5	150.8	-179	-67.6	179.8	153.7	0	0	112.9	G316	E314-G316 PolarHBondContact O-N 2.96Å
315	K	47.6	Very low	47.9	Very low	209 Å²	209	125.9 Å²	125.9	91%	0.909	80%	0.801	S	S	*	*			trans	-67.7	101.6	-173.6	-167.5	-179.7	-175.5	-175.5	0	110.2
316	G	46.7	Very low	48	Very low	67 Å²	67	125.2 Å²	125.2	69%	0.691	80%	0.803	S	S	*	*			trans	-74.4	144.9	171.1	0	0	0	0	0	112.3	E314	E314-G316 PolarHBondContact O-N 2.96Å
317	D	46.9	Very low	48.2	Very low	165 Å²	165	120 Å²	120	88%	0.882	80%	0.795	S	S	*	*			trans	-60.8	142.4	-177.3	-66	-47.5	0	0	0	113.2	G319	D317-G319 PolarHBondContact O-N 3.08Å
318	V	49.4	Very low	48.3	Very low	145 Å²	145	120.3 Å²	120.3	88%	0.879	80%	0.798	S	S	*	*			trans	-68.3	113.7	-179.2	176.4	0	0	0	0	109.4
319	G	46.4	Very low	48.1	Very low	54 Å²	54	123.3 Å²	123.3	56%	0.557	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-64.4	149	165.6	0	0	0	0	0	111	D317 L321	D317-G319 PolarHBondContact O-N 3.08Å; G319-L321 PolarHBondContact O-N 3.18Å
320	P	53.3	Low	48	Very low	132 Å²	132	124.4 Å²	124.4	86%	0.857	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-61.3	135.6	-178.1	24	-31.6	0	0	0	111.2	G322	P320-G322 PolarHBondContact O-N 2.85Å
321	L	52.3	Low	48.1	Very low	166 Å²	166	124.8 Å²	124.8	87%	0.869	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-59.3	124.8	178.6	-154	78.1	0	0	0	109.7	G319	G319-L321 PolarHBondContact O-N 3.18Å
322	G	48.2	Very low	47.9	Very low	63 Å²	63	126.8 Å²	126.8	65%	0.649	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-59.5	148.8	171.6	0	0	0	0	0	111.4	P320 S324	P320-G322 PolarHBondContact O-N 2.85Å; G322-S324 PolarHBondContact O-N 3.16Å
323	A	48.9	Very low	47.7	Very low	105 Å²	105	128 Å²	128	87%	0.868	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-54.9	131.3	-177.9	0	0	0	0	0	112	G325	A323-G325 PolarHBondContact O-N 2.88Å
324	S	51.9	Low	47.5	Very low	115 Å²	115	128 Å²	128	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-61	130.4	173.7	-69.6	0	0	0	0	110.8	G322	G322-S324 PolarHBondContact O-N 3.16Å
325	G	49.9	Very low	47.1	Very low	71 Å²	71	128.2 Å²	128.2	73%	0.732	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-60.5	151.6	170.2	0	0	0	0	0	112.1	A323 A327	A323-G325 PolarHBondContact O-N 2.88Å; G325-A327 PolarHBondContact O-N 2.98Å
326	V	45.9	Very low	46.7	Very low	150 Å²	150	125 Å²	125	91%	0.909	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-58.3	132.9	-178.3	-175.6	0	0	0	0	110.6
327	A	48.2	Very low	46.2	Very low	93 Å²	93	125.5 Å²	125.5	77%	0.769	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-66.8	133.5	179.4	0	0	0	0	0	111.7	G325	G325-A327 PolarHBondContact O-N 2.98Å
328	G	50.3	Low	46.3	Very low	67 Å²	67	126.9 Å²	126.9	69%	0.691	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.5	146.3	170.9	0	0	0	0	0	112
329	L	41.9	Very low	45.7	Very low	185 Å²	185	130.2 Å²	130.2	97%	0.969	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.7	135.6	178.5	-85.9	157.1	0	0	0	111.9
330	I	50.2	Low	45.3	Very low	157 Å²	157	131.3 Å²	131.3	81%	0.805	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-82.3	130.7	-176.7	-69.3	166.2	0	0	0	110
331	G	46.3	Very low	45.1	Very low	71 Å²	71	135.8 Å²	135.8	73%	0.732	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-65.4	134.3	173.6	0	0	0	0	0	112.5
332	M	41.3	Very low	44.4	Very low	174 Å²	174	137.4 Å²	137.4	86%	0.857	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-78.5	133.4	-177.2	-72.7	-176	59.2	0	0	112.7
333	R	43.6	Very low	44.2	Very low	237 Å²	237	137.4 Å²	137.4	89%	0.894	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-83.1	142.6	177.4	176.5	-178.4	-74.2	-175.7	-4.2	110.4
334	G	37.9	Very low	44.3	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-61.1	154.5	-174.8	0	0	0	0	0	116.4
335	F	41.4	Very low	43.8	Very low	199 Å²	199	145.6 Å²	145.6	87%	0.873	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-74.7	147.3	-174	-67.7	-82	0	0	0	113.9
336	T	38.9	Very low	43.3	Very low	142 Å²	142	145.9 Å²	145.9	87%	0.871	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-97.5	140.9	175.4	-48.4	0	0	0	0	109.7
337	G	37.2	Very low	43.5	Very low	77 Å²	77	147.5 Å²	147.5	79%	0.794	85%	0.847	S	S	*	*			trans	-75.9	174.2	-166.2	0	0	0	0	0	118.9
338	E	48.5	Very low	43	Very low	194 Å²	194	153 Å²	153	91%	0.907	85%	0.853	S	S	*	*			trans	-59.9	154.5	-165.4	-64.3	177.9	131.9	0	0	118.6
339	K	37.4	Very low	42.9	Very low	216 Å²	216	152.9 Å²	152.9	94%	0.939	85%	0.852	S	S	*	*			trans	-141.3	113.3	152	-84.6	-172	-179.9	176.4	0	112.8
340	G	37.8	Very low	43.1	Very low	77 Å²	77	150.5 Å²	150.5	79%	0.794	85%	0.848	S	S	*	*				63.5	116.5	126.8	0	0	0	0	0	122.1
341	F	48.3	Very low	42.5	Very low	226 Å²	226	148.4 Å²	148.4	99%	0.991	85%	0.847	S	S	*	*			trans	-65	149.2	173.4	-68.8	-88.2	0	0	0	115.9
342	Q	38.4	Very low	42.4	Very low	199 Å²	199	147.9 Å²	147.9	93%	0.93	84%	0.841	S	S	*	*			trans	-132.1	130.2	165.4	-167.8	163.7	75	0	0	110.6
343	G	43.9	Very low	42.2	Very low	64 Å²	64	147.6 Å²	147.6	66%	0.66	84%	0.837	S	S	*	*			trans	-77.4	177	-167.8	0	0	0	0	0	116.7
344	P	51	Low	42.2	Very low	140 Å²	140	144.1 Å²	144.1	91%	0.909	84%	0.837	S	S	*	*			trans	-78.8	148.6	-165.1	31.3	-34.3	0	0	0	113.7
345	R	41.1	Very low	42.3	Very low	252 Å²	252	144.2 Å²	144.2	95%	0.951	84%	0.838	S	S	*	*			trans	-104	131.8	179.6	-155.8	174	-175.1	179.4	1.2	110.5
346	G	38.6	Very low	42.1	Very low	76 Å²	76	143.5 Å²	143.5	78%	0.784	84%	0.842	S	S	*	*			trans	-82.3	175.1	-167.5	0	0	0	0	0	118.2
347	L	51.1	Low	42.2	Very low	185 Å²	185	145.8 Å²	145.8	97%	0.969	84%	0.843	S	S	*	*			trans	-61.2	153.5	-172.6	-67.8	158.9	0	0	0	116
348	K	38.4	Very low	42.6	Very low	208 Å²	208	145.5 Å²	145.5	90%	0.904	84%	0.839	S	S	*	*			trans	-148.4	123.1	163.6	-160.1	175.6	-175.4	-177.4	0	111.5
349	G	46.9	Very low	42.4	Very low	65 Å²	65	146 Å²	146	67%	0.67	84%	0.842	S	S	*	*			trans	-91.9	178.4	169.4	0	0	0	0	0	112.9
350	P	45.8	Very low	42.5	Very low	135 Å²	135	145.7 Å²	145.7	88%	0.877	84%	0.84	S	S	*	*			trans	-142.1	171.5	135.6	31.9	-13	0	0	0	115.7
351	S	39.6	Very low	42.8	Very low	113 Å²	113	145 Å²	145	79%	0.79	83%	0.833	S	S	*	*			trans	-87.7	178	-161.5	-50.4	0	0	0	0	117.2
352	G	43.4	Very low	42.5	Very low	59 Å²	59	142.6 Å²	142.6	61%	0.608	83%	0.831	S	S	*	*			trans	-56.4	-168.8	179.8	0	0	0	0	0	117.7
353	H	37.5	Very low	42.7	Very low	168 Å²	168	142 Å²	142	78%	0.778	83%	0.83	S	S	*	*				-164.6	162.2	54.9	-21.6	-76.3	0	0	0	114.2
354	D	42.6	Very low	42.6	Very low	165 Å²	165	142.2 Å²	142.2	88%	0.882	83%	0.832	S	S	*	*			trans	72.3	135.2	147.1	-57.2	-18.2	0	0	0	123.8
355	G	40.7	Very low	42.4	Very low	69 Å²	69	141.8 Å²	141.8	71%	0.711	83%	0.83	S	S	*	*			trans	-104.3	-175.6	-169.3	0	0	0	0	0	115.7
356	L	37.9	Very low	42.8	Very low	184 Å²	184	139 Å²	139	96%	0.963	83%	0.828	S	S	*	*			trans	-138.2	150.5	161.5	-81.5	175.5	0	0	0	111
357	Q	39.7	Very low	42.8	Very low	190 Å²	190	138.6 Å²	138.6	89%	0.888	82%	0.823	S	S	*	*			trans	-77	151.9	-163.3	-174.8	170.6	17.3	0	0	113.7
358	G	45.7	Very low	42.7	Very low	70 Å²	70	136.2 Å²	136.2	72%	0.722	82%	0.819	S	S	*	*			trans	-86.2	172.4	-174.8	0	0	0	0	0	116.2
359	E	43.6	Very low	42.9	Very low	206 Å²	206	136 Å²	136	96%	0.963	82%	0.818	S	S	*	*			trans	-125.4	149	161.9	-74.2	-163.4	148.1	0	0	111
360	K	41.1	Very low	42.5	Very low	208 Å²	208	136.5 Å²	136.5	90%	0.904	82%	0.823	S	S	*	*			trans	-107.7	124.7	-169.6	173.5	-173.4	179.6	-176.5	0	109.8
361	G	43.8	Very low	42.5	Very low	62 Å²	62	138 Å²	138	64%	0.639	82%	0.824	S	S	*	*			trans	80.8	133.2	141.2	0	0	0	0	0	118.7
362	D	41.2	Very low	42.5	Very low	176 Å²	176	144.2 Å²	144.2	94%	0.941	83%	0.83	S	S	*	*				-157.2	151.6	121.4	-90.5	-26.4	0	0	0	111.4
363	M	44.3	Very low	42.2	Very low	186 Å²	186	144.8 Å²	144.8	92%	0.916	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-86.4	143.6	-170.5	-168	170.8	46.3	0	0	111.1
364	G	40.9	Very low	42.4	Very low	69 Å²	69	144.9 Å²	144.9	71%	0.711	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-72.6	162.7	-169.2	0	0	0	0	0	115.9
365	P	46.3	Very low	42.3	Very low	132 Å²	132	148.7 Å²	148.7	86%	0.857	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-95.3	147.5	164.6	32.9	-28.7	0	0	0	113.3
366	E	49.8	Very low	42	Very low	193 Å²	193	148.9 Å²	148.9	90%	0.902	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-65.4	146.9	-180	-163.3	173.8	-170.8	0	0	113.2
367	G	39.2	Very low	41.9	Very low	67 Å²	67	148.7 Å²	148.7	69%	0.691	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-75.7	147.6	-178.2	0	0	0	0	0	113.8
368	P	48	Very low	41.9	Very low	135 Å²	135	149.6 Å²	149.6	88%	0.877	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-78.5	130.5	172	28.1	-30.4	0	0	0	112.4
369	K	43.2	Very low	41.3	Very low	204 Å²	204	149.8 Å²	149.8	89%	0.887	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-54.8	146.2	169.7	-118.9	168.2	178.6	168.6	0	112.6
370	G	39.1	Very low	41.1	Very low	75 Å²	75	149.7 Å²	149.7	77%	0.773	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-64.7	151.7	178.2	0	0	0	0	0	114.7
371	N	44.3	Very low	41	Very low	168 Å²	168	149.8 Å²	149.8	90%	0.898	85%	0.848	S	S	*	*			trans	-104.7	145.6	169.8	-76.2	-28.9	0	0	0	111.6
372	R	40.5	Very low	40.5	Very low	243 Å²	243	150 Å²	150	92%	0.917	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-67.1	146.2	-171	-166.8	178.4	-152.3	169.8	3.8	112.4
373	G	36.6	Very low	40.6	Very low	71 Å²	71	150 Å²	150	73%	0.732	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-68.3	148.2	-177.9	0	0	0	0	0	115
374	D	42.4	Very low	40.3	Very low	169 Å²	169	152.9 Å²	152.9	90%	0.904	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-88.7	134.8	169.2	-73	-37.3	0	0	0	111.2
375	R	41	Very low	40.2	Very low	246 Å²	246	152.8 Å²	152.8	93%	0.928	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-78.8	142.3	-177.7	-174	-179.8	-81.2	-178.7	-8.1	109.4
376	G	32.9	Very low	39.8	Very low	73 Å²	73	153.6 Å²	153.6	75%	0.753	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-63.8	161.7	-165.2	0	0	0	0	0	118.1
377	L	36.8	Very low	39.4	Very low	180 Å²	180	155.2 Å²	155.2	94%	0.942	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-86.4	131	164.1	-67.6	172.7	0	0	0	109.7
378	K	40.1	Very low	39.2	Very low	209 Å²	209	155.8 Å²	155.8	91%	0.909	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-75.1	138.3	177	-168.2	175.8	-178.7	-179.2	0	109
379	G	32.8	Very low	38.6	Very low	73 Å²	73	158.3 Å²	158.3	75%	0.753	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-66	158.9	-161.9	0	0	0	0	0	117.8
380	E	39.2	Very low	38.4	Very low	204 Å²	204	157.3 Å²	157.3	95%	0.953	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-86.6	143	160.5	-69.7	-172.8	140.8	0	0	110.3
381	K	39.1	Very low	38.2	Very low	211 Å²	211	159.6 Å²	159.6	92%	0.917	85%	0.846	S	S	*	*			trans	-93.6	112.7	-173.1	-179.1	-177.4	179.6	-175.4	0	108.6
382	G	33.8	Very low	38	Very low	67 Å²	67	158.1 Å²	158.1	69%	0.691	84%	0.842	S	S	*	*			trans	38.7	111.3	151.1	0	0	0	0	0	119.5
383	D	43	Very low	38.4	Very low	174 Å²	174	152.8 Å²	152.8	93%	0.93	83%	0.832	S	S	*	*			trans	-109.7	146.7	145.1	-82.2	-38.1	0	0	0	111.2
384	R	37.4	Very low	39.4	Very low	247 Å²	247	156.5 Å²	156.5	93%	0.932	83%	0.831	S	S	*	*			trans	-79.6	141.5	-161.9	-165	174.4	-163.8	161.9	1.7	110.1
385	G	38.6	Very low	41	Very low	68 Å²	68	153.2 Å²	153.2	70%	0.701	82%	0.816	S	S	*	*			trans	-47.8	146.5	-167.6	0	0	0	0	0	117.5
386	D	38.6	Very low	43.4	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	79%	0.787	S	S	*	*			trans	-141.8	122.5	143.4	-96.9	-40.9	0	0	0	109.3
387	R	40.9	Very low	46.4	Very low	227 Å²	227	141 Å²	141	86%	0.857	75%	0.752	S	S	*	*			trans	41.7	106.8	165.4	-91	171	-86	-161.5	-5.5	118.5	E389	R387-E389 PolarHBondContact O-N 3.24Å; R387-E389 VanDerWaalsContact O-N 3.08Å
388	G	34.6	Very low	49.2	Very low	80 Å²	80	137.1 Å²	137.1	83%	0.825	73%	0.725	S	S	*	*			trans	-44	109.1	173.2	0	0	0	0	0	113.9	K390	G388-K390 PolarHBondContact O-N 3.37Å
389	E	35.8	Very low	51.9	Low	187 Å²	187	128.6 Å²	128.6	87%	0.874	69%	0.689	S	S	*	*			trans	-60	107.3	152.4	-167.9	164.1	-162.1	0	0	106.6	R387 T391	R387-E389 PolarHBondContact O-N 3.24Å; R387-E389 VanDerWaalsContact O-N 3.08Å; E389-T391 PolarHBondContact O-N 2.93Å
390	K	38.7	Very low	55	Low	183 Å²	183	126.9 Å²	126.9	80%	0.796	66%	0.664	S	S	*	*			trans	-54.2	112.6	168.2	-76.1	-177.6	175.2	-174.1	0	106.2	G388 V392	G388-K390 PolarHBondContact O-N 3.37Å; K390-V392 PolarHBondContact O-N 3.16Å
391	T	34.3	Very low	57.7	Low	124 Å²	124	122.6 Å²	122.6	76%	0.761	65%	0.648	S	S	*	*			trans	-40.8	130.2	155	46.6	0	0	0	0	107.3	E389 D393	E389-T391 PolarHBondContact O-N 2.93Å; T391-D393 VanDerWaalsContact C-N 3.29Å; T391-D393 PolarHBondContact O-N 3.39Å
392	V	40.7	Very low	60.3	Low	136 Å²	136	113.9 Å²	113.9	82%	0.824	62%	0.618	S	S	*	*			trans	-45.3	98.9	178	179.5	0	0	0	0	108.1	K390 E394	K390-V392 PolarHBondContact O-N 3.16Å; V392-E394 PolarHBondContact O-N 3.43Å
393	D	48.7	Very low	63.2	Low	132 Å²	132	116.3 Å²	116.3	71%	0.706	63%	0.625	S	S	*	*			trans	-69.2	112.1	173.7	-162.1	14.4	0	0	0	102.9	T391 T395	T391-D393 VanDerWaalsContact C-N 3.29Å; T391-D393 PolarHBondContact O-N 3.39Å; D393-T395 VanDerWaalsContact C-N 3.3Å; D393-T395 PolarHBondContact O-N 2.9Å
394	E	58.7	Low	65.5	Low	149 Å²	149	109.1 Å²	109.1	70%	0.696	59%	0.591	S	S	*	*			trans	-59.5	101.2	177.2	-71.9	-175	157.6	0	0	106.4	V392 L396	V392-E394 PolarHBondContact O-N 3.43Å; E394-L396 HydrophobicContact CB-CD2 4.49Å; E394-L396 WeakPolarHBondContact O-CG 3.29Å; E394-L396 PolarHBondContact O-N 2.9Å
395	T	75.2	Confident	68.1	Low	99 Å²	99	102.3 Å²	102.3	61%	0.607	58%	0.579	S	S	*	*			trans	-60.2	100.1	-179.4	-4.1	0	0	0	0	108.8	D393 V397 W418	D393-T395 VanDerWaalsContact C-N 3.3Å; D393-T395 PolarHBondContact O-N 2.9Å; T395-V397 VanDerWaalsContact C-N 3.34Å; T395-W418 VanDerWaalsContact O-CH2 3.3Å; T395-W418 WeakPolarHBondContact O-CH2 3.42Å
396	L	91.2	Very high	70.9	Confident	58 Å²	58	101.7 Å²	101.7	30%	0.304	56%	0.558	S	S	.	*			trans	-80.7	-16.5	-176.5	-63.9	179.7	0	0	0	112.8	E394 V412 F413 M437	E394-L396 HydrophobicContact CB-CD2 4.49Å; E394-L396 WeakPolarHBondContact O-CG 3.29Å; E394-L396 PolarHBondContact O-N 2.9Å; L396-V412 CarbonylContact O-C 3.56Å; L396-V412 WeakPolarHBondContact O-CA 3.29Å; L396-F413 PolarHBondContact O-N 3.26Å; L396-M437 HydrophobicContact CB-CE 4.31Å
397	V	95.7	Very high	73.7	Confident	5 Å²	5	96.1 Å²	96.1	3%	0.03	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	147	-179	73.5	0	0	0	0	110.7	T395 V410 E411 V412 V434 M437 L438	T395-V397 VanDerWaalsContact C-N 3.34Å; V397-V410 HydrophobicContact CG2-CG1 3.95Å; V397-E411 CarbonylContact C-O 3.52Å; V397-E411 WeakPolarHBondContact CA-O 3.38Å; V397-E411 WeakPolarHBondContact CG2-O 3.41Å; V397-V412 HydrophobicContact CG2-CG1 4.07Å; V397-V434 HydrophobicContact CG2-CG1 3.99Å; V397-M437 HydrophobicContact CB-CE 4.15Å; V397-M437 HydrophobicContact CG1-CB 3.99Å; V397-M437 HydrophobicContact CG1-CE 3.8Å; V397-M437 HydrophobicContact CG1-SD 4.12Å; V397-L438 HydrophobicContact CG1-CD1 4.44Å; V397-L438 HydrophobicContact CG1-CD2 3.83Å; V397-L438 HydrophobicContact CG1-CG 3.88Å
398	R	95.7	Very high	76.4	Confident	98 Å²	98	85.3 Å²	85.3	37%	0.37	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.7	173.1	71.4	-176.8	-177	-177.3	0.7	111.3	V400 E411 W418	R398-V400 HydrophobicContact CG-CG2 3.8Å; R398-E411 HydrophobicContact CG-CB 3.9Å; R398-E411 IonicContact CZ-OE2 3.23Å; R398-E411 PolarHBondContact N-O 3.48Å; R398-E411 IonicContact NE-OE2 3.08Å; R398-E411 PolarHBondContact NE-OE2 3.19Å; R398-E411 IonicContact NH2-OE2 3.98Å; R398-E411 PolarHBondContact NH2-OE2 3.23Å; R398-E411 PolarHBondContact O-N 2.77Å; R398-W418 HydrophobicContact CB-CH2 3.94Å; R398-W418 HydrophobicContact CB-CZ3 3.95Å; R398-W418 HydrophobicContact CG-CD2 4.42Å; R398-W418 HydrophobicContact CG-CE3 3.8Å; R398-W418 HydrophobicContact CG-CH2 3.81Å; R398-W418 HydrophobicContact CG-CZ2 4.42Å; R398-W418 HydrophobicContact CG-CZ3 3.47Å; R398-W418 VanDerWaalsContact CG-CZ3 3.47Å
399	L	97.3	Very high	79.4	Confident	30 Å²	30	82.4 Å²	82.4	16%	0.157	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.5	170.9	-56.1	-178.1	0	0	0	109.6	R409 V410 V434 L438 V494	L399-R409 WeakPolarHBondContact CA-O 3.43Å; L399-V410 HydrophobicContact CD2-CG2 3.97Å; L399-V434 HydrophobicContact CD2-CG1 4.14Å; L399-L438 HydrophobicContact CD1-CD1 3.74Å; L399-L438 HydrophobicContact CD2-CD1 4.04Å; L399-L438 HydrophobicContact CG-CD1 3.54Å; L399-V494 HydrophobicContact CD1-CG1 4.01Å; L399-V494 HydrophobicContact CD2-CG1 3.52Å; L399-V494 HydrophobicContact CG-CG1 4.44Å
400	V	97.6	Very high	82.4	Confident	37 Å²	37	73.5 Å²	73.5	22%	0.224	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.7	-174.4	-172.7	0	0	0	0	110.7	R398 G402 G408 R409 E411	R398-V400 HydrophobicContact CG-CG2 3.8Å; V400-G402 VanDerWaalsContact C-N 3.31Å; V400-G402 PolarHBondContact O-N 3.05Å; V400-G408 CarbonylContact O-C 2.85Å; V400-G408 WeakPolarHBondContact O-CA 3.2Å; V400-R409 PolarHBondContact N-O 3.42Å; V400-R409 PolarHBondContact O-N 2.98Å; V400-E411 HydrophobicContact CG2-CB 4.46Å; V400-E411 HydrophobicContact CG2-CG 4.17Å
401	N	95.8	Very high	85.2	Confident	114 Å²	114	65.5 Å²	65.5	61%	0.61	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	62.4	29.5	171.8	-156.3	45.5	0	0	0	115.4	F452	N401-F452 WeakPolarHBondContact CB-O 3.35Å; N401-F452 PolarHBondContact ND2-O 2.99Å
402	G	94.1	Very high	88.2	Confident	29 Å²	29	59.6 Å²	59.6	30%	0.299	34%	0.338	S	S	.	.	S	Bend	trans	-91.7	173	163.4	0	0	0	0	0	112.6	V400 G404 E407	V400-G402 VanDerWaalsContact C-N 3.31Å; V400-G402 PolarHBondContact O-N 3.05Å; G402-G404 PolarHBondContact O-N 2.99Å; G402-E407 WeakPolarHBondContact CA-O 3.38Å
403	S	93.8	Very high	90.8	Very high	118 Å²	118	56.1 Å²	56.1	83%	0.825	31%	0.312	S	S	*	.	S	Bend	trans	-72.9	-13.5	179	-35.9	0	0	0	0	112.6	E407	S403-E407 WeakPolarHBondContact CA-OE1 3.39Å; S403-E407 WeakPolarHBondContact CB-OE1 3.47Å; S403-E407 PolarHBondContact N-OE1 3.11Å; S403-E407 PolarHBondContact OG-OE1 2.96Å
404	G	91.8	Very high	92.9	Very high	22 Å²	22	51.6 Å²	51.6	23%	0.227	29%	0.287	C	S	.	.	S	Bend	trans	-159.7	179.3	177.4	0	0	0	0	0	112.2	G402 H406 E407	G402-G404 PolarHBondContact O-N 2.99Å; G404-H406 PolarHBondContact O-N 3.42Å; G404-H406 VanDerWaalsContact O-N 3.14Å; G404-E407 PolarHBondContact O-N 3.37Å
405	P	93.3	Very high	94.4	Very high	104 Å²	104	51 Å²	51	68%	0.675	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-5.3	-175.2	31	-37.2	0	0	0	114.3	Y440	P405-Y440 PolarHBondContact O-OH 3.3Å
406	H	96.1	Very high	95	Very high	55 Å²	55	57 Å²	57	26%	0.255	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-0	-179.6	63.5	-79.7	0	0	0	112.1	G404 Y440 C496 T498	G404-H406 PolarHBondContact O-N 3.42Å; G404-H406 VanDerWaalsContact O-N 3.14Å; H406-Y440 WeakPolarHBondContact CA-OH 3.43Å; H406-Y440 HydrophobicContact CB-CD1 4.41Å; H406-Y440 HydrophobicContact CB-CE1 3.68Å; H406-Y440 HydrophobicContact CB-CE2 4.29Å; H406-Y440 PolarHBondContact N-OH 2.97Å; H406-C496 HydrophobicContact CB-CB 4.39Å; H406-C496 WeakPolarHBondContact O-CB 3.48Å; H406-C496 PolarHBondContact O-N 3.02Å; H406-T498 HydrophobicContact CB-CG2 3.79Å
407	E	97.6	Very high	94.9	Very high	31 Å²	31	60.8 Å²	60.8	15%	0.145	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	155.5	176.4	58.1	167.4	-164.9	0	0	112.1	G402 S403 G404 F452 V494 T495	G402-E407 WeakPolarHBondContact CA-O 3.38Å; S403-E407 WeakPolarHBondContact CA-OE1 3.39Å; S403-E407 WeakPolarHBondContact CB-OE1 3.47Å; S403-E407 PolarHBondContact N-OE1 3.11Å; S403-E407 PolarHBondContact OG-OE1 2.96Å; G404-E407 PolarHBondContact O-N 3.37Å; E407-F452 HydrophobicContact CB-CE1 4.33Å; E407-F452 HydrophobicContact CB-CZ 4.07Å; E407-F452 HydrophobicContact CG-CE1 4.39Å; E407-V494 CarbonylContact C-O 3.53Å; E407-V494 VanDerWaalsContact CA-O 3.23Å; E407-V494 WeakPolarHBondContact CA-O 3.3Å; E407-T495 HydrophobicContact CB-CG2 4.07Å; E407-T495 PolarHBondContact OE2-OG1 2.96Å
408	G	98.1	Very high	94.9	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.6	-179	175	0	0	0	0	0	113.4	V400 F452 G493 V494	V400-G408 CarbonylContact O-C 2.85Å; V400-G408 WeakPolarHBondContact O-CA 3.2Å; G408-F452 WeakPolarHBondContact O-CD2 3.42Å; G408-G493 VanDerWaalsContact O-CA 3.25Å; G408-G493 WeakPolarHBondContact O-CA 3.44Å; G408-V494 PolarHBondContact N-O 3.27Å; G408-V494 PolarHBondContact O-N 3.36Å
409	R	98.5	Very high	95	Very high	20 Å²	20	59.4 Å²	59.4	8%	0.075	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	136	167.9	-179	176.9	60.7	-101.3	-2.9	109.1	L399 V400 E411 T420 F452 G453 D491	L399-R409 WeakPolarHBondContact CA-O 3.43Å; V400-R409 PolarHBondContact N-O 3.42Å; V400-R409 PolarHBondContact O-N 2.98Å; R409-E411 IonicContact CZ-OE1 3.59Å; R409-E411 IonicContact NE-OE1 3.01Å; R409-E411 PolarHBondContact NE-OE1 3.36Å; R409-E411 IonicContact NH2-OE1 3.4Å; R409-E411 PolarHBondContact NH2-OE1 2.79Å; R409-T420 HydrophobicContact CG-CG2 4.39Å; R409-F452 HydrophobicContact CB-CB 4.12Å; R409-F452 PolarHBondContact NH1-O 3.38Å; R409-G453 WeakPolarHBondContact CD-O 3.35Å; R409-G453 PolarHBondContact NH1-O 3.38Å; R409-D491 HydrophobicContact CG-CB 4.13Å
410	V	98.3	Very high	95.1	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.3	178.6	-176.7	0	0	0	0	109.2	V397 L399 V421 W426 V434 A492 V494	V397-V410 HydrophobicContact CG2-CG1 3.95Å; L399-V410 HydrophobicContact CD2-CG2 3.97Å; V410-V421 HydrophobicContact CB-CG2 4.39Å; V410-V421 HydrophobicContact CG1-CG2 3.92Å; V410-W426 HydrophobicContact CG2-CH2 4.38Å; V410-W426 HydrophobicContact CG2-CZ2 4.02Å; V410-V434 HydrophobicContact CG1-CG1 4.27Å; V410-V434 HydrophobicContact CG1-CG2 4.19Å; V410-V434 HydrophobicContact CG2-CG1 4.36Å; V410-A492 PolarHBondContact N-O 3.48Å; V410-V494 HydrophobicContact CG2-CB 4.34Å; V410-V494 HydrophobicContact CG2-CG1 3.83Å
411	E	98.1	Very high	95.1	Very high	14 Å²	14	56.3 Å²	56.3	7%	0.065	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.7	170.7	-70.2	-179.8	-168.4	0	0	109.9	V397 R398 V400 R409 W418 G419 T420	V397-E411 CarbonylContact C-O 3.52Å; V397-E411 WeakPolarHBondContact CA-O 3.38Å; V397-E411 WeakPolarHBondContact CG2-O 3.41Å; R398-E411 HydrophobicContact CG-CB 3.9Å; R398-E411 IonicContact CZ-OE2 3.23Å; R398-E411 PolarHBondContact N-O 3.48Å; R398-E411 IonicContact NE-OE2 3.08Å; R398-E411 PolarHBondContact NE-OE2 3.19Å; R398-E411 IonicContact NH2-OE2 3.98Å; R398-E411 PolarHBondContact NH2-OE2 3.23Å; R398-E411 PolarHBondContact O-N 2.77Å; V400-E411 HydrophobicContact CG2-CB 4.46Å; V400-E411 HydrophobicContact CG2-CG 4.17Å; R409-E411 IonicContact CZ-OE1 3.59Å; R409-E411 IonicContact NE-OE1 3.01Å; R409-E411 PolarHBondContact NE-OE1 3.36Å; R409-E411 IonicContact NH2-OE1 3.4Å; R409-E411 PolarHBondContact NH2-OE1 2.79Å; E411-W418 HydrophobicContact CB-CE3 4.02Å; E411-W418 WeakPolarHBondContact O-CZ3 3.34Å; E411-G419 CarbonylContact C-O 3.37Å; E411-G419 VanDerWaalsContact CA-O 3.23Å; E411-G419 WeakPolarHBondContact CA-O 3.47Å; E411-T420 HydrophobicContact CG-CG2 3.99Å
412	V	97.3	Very high	95.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.2	179.8	-62.7	0	0	0	0	110.8	L396 V397 W418 G419 V421 W460 M461 I473 W481	L396-V412 CarbonylContact O-C 3.56Å; L396-V412 WeakPolarHBondContact O-CA 3.29Å; V397-V412 HydrophobicContact CG2-CG1 4.07Å; V412-W418 WeakPolarHBondContact O-CA 3.37Å; V412-G419 PolarHBondContact N-O 3.49Å; V412-G419 PolarHBondContact O-N 2.98Å; V412-V421 HydrophobicContact CG1-CG2 3.98Å; V412-V421 HydrophobicContact CG2-CG2 4.34Å; V412-W460 HydrophobicContact CG2-CB 3.55Å; V412-W460 HydrophobicContact CG2-CG 4.11Å; V412-M461 HydrophobicContact CB-SD 4.48Å; V412-M461 HydrophobicContact CG1-SD 4.04Å; V412-M461 HydrophobicContact CG2-CG 4.11Å; V412-M461 HydrophobicContact CG2-SD 4.04Å; V412-I473 HydrophobicContact CG1-CG2 4.03Å; V412-W481 HydrophobicContact CG2-CZ3 4.39Å
413	F	94.3	Very high	95.3	Very high	64 Å²	64	50 Å²	50	28%	0.281	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	114	-179.9	-166.8	-109.1	0	0	0	110.5	L396 R416 W418	L396-F413 PolarHBondContact O-N 3.26Å; F413-R416 VanDerWaalsContact CZ-C 3.43Å; F413-R416 HydrophobicContact CZ-CB 4.35Å; F413-W418 HydrophobicContact CB-CD2 4.23Å; F413-W418 HydrophobicContact CB-CE3 4Å; F413-W418 HydrophobicContact CB-CH2 3.94Å; F413-W418 HydrophobicContact CB-CZ2 4.16Å; F413-W418 HydrophobicContact CB-CZ3 3.85Å; F413-W418 AromaticContact CD2-CD1 3.85Å; F413-W418 AromaticContact CD2-CD2 3.81Å; F413-W418 HydrophobicContact CD2-CD2 3.81Å; F413-W418 AromaticContact CD2-CE2 3.61Å; F413-W418 HydrophobicContact CD2-CE3 4.42Å; F413-W418 AromaticContact CD2-CG 3.98Å; F413-W418 HydrophobicContact CD2-CG 3.98Å; F413-W418 HydrophobicContact CD2-CZ2 4.1Å; F413-W418 AromaticContact CD2-NE1 3.62Å; F413-W418 AromaticContact CE2-NE1 3.9Å; F413-W418 HydrophobicContact CG-CD2 4.5Å; F413-W418 HydrophobicContact CG-CZ2 4.38Å
414	H	92.4	Very high	95.5	Very high	37 Å²	37	46.5 Å²	46.5	17%	0.171	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143.9	178.1	-171.1	68.8	0	0	0	110	R416 R417 W460 W481	H414-R416 PolarHBondContact O-N 3.06Å; H414-R416 VanDerWaalsContact O-N 3.08Å; H414-R417 PolarHBondContact N-O 3Å; H414-R417 PolarHBondContact O-N 3.41Å; H414-W460 HydrophobicContact CB-CD2 3.99Å; H414-W460 HydrophobicContact CB-CE3 4.45Å; H414-W460 HydrophobicContact CB-CG 4.25Å; H414-W460 HydrophobicContact CB-CZ2 4.17Å; H414-W460 AromaticContact CD2-CE3 3.96Å; H414-W460 AromaticContact CD2-CH2 3.88Å; H414-W460 AromaticContact CD2-CZ3 3.73Å; H414-W460 VanDerWaalsContact O-CZ2 3.29Å; H414-W460 WeakPolarHBondContact O-CZ2 3.49Å; H414-W481 HydrophobicContact CB-CE3 3.89Å; H414-W481 HydrophobicContact CB-CH2 4.21Å; H414-W481 HydrophobicContact CB-CZ3 3.71Å; H414-W481 AromaticContact CD2-CD2 3.58Å; H414-W481 AromaticContact CD2-CE3 3.66Å; H414-W481 AromaticContact CD2-CG 3.78Å; H414-W481 AromaticContact CE1-CD1 3.73Å; H414-W481 AromaticContact CE1-CD2 3.58Å; H414-W481 AromaticContact CE1-CE2 3.39Å; H414-W481 AromaticContact CE1-CG 3.81Å; H414-W481 AromaticContact CE1-CZ2 3.89Å; H414-W481 AromaticContact CE1-NE1 3.5Å; H414-W481 PolarHBondContact CE1-NE1 2.87Å; H414-W481 AromaticContact CG-CD2 3.71Å; H414-W481 AromaticContact CG-CE3 3.54Å; H414-W481 AromaticContact CG-CZ3 3.73Å; H414-W481 AromaticContact ND1-CD2 3.71Å; H414-W481 AromaticContact ND1-CE2 3.53Å; H414-W481 AromaticContact ND1-CE3 3.9Å; H414-W481 AromaticContact ND1-CH2 3.81Å; H414-W481 AromaticContact ND1-CZ2 3.6Å; H414-W481 AromaticContact ND1-CZ3 3.95Å; H414-W481 AromaticContact NE2-CD1 3.61Å; H414-W481 AromaticContact NE2-CD2 3.51Å; H414-W481 AromaticContact NE2-CE2 3.81Å; H414-W481 AromaticContact NE2-CG 3.39Å; H414-W481 AromaticContact NE2-NE1 3.86Å
415	E	89.6	Confident	95.6	Very high	136 Å²	136	49.4 Å²	49.4	64%	0.636	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.8	43.5	-178.7	-70.6	-174.7	163.1	0	0	114.4	R417 W460	E415-R417 PolarHBondContact O-N 3.43Å; E415-W460 HydrophobicContact CB-CH2 4.23Å; E415-W460 HydrophobicContact CB-CZ2 4.41Å
416	R	88	Confident	95.9	Very high	225 Å²	225	44.6 Å²	44.6	85%	0.849	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	17.9	179.8	-49.9	178.6	66.9	-174.6	0.8	114.9	F413 H414	F413-R416 VanDerWaalsContact CZ-C 3.43Å; F413-R416 HydrophobicContact CZ-CB 4.35Å; H414-R416 PolarHBondContact O-N 3.06Å; H414-R416 VanDerWaalsContact O-N 3.08Å
417	R	90.4	Very high	95.9	Very high	137 Å²	137	44.5 Å²	44.5	52%	0.517	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	145.5	-179.2	-62.3	177.5	65.3	-179.8	-0.5	111.5	H414 E415 W460	H414-R417 PolarHBondContact N-O 3Å; H414-R417 PolarHBondContact O-N 3.41Å; E415-R417 PolarHBondContact O-N 3.43Å; R417-W460 HydrophobicContact CB-CZ2 4.23Å; R417-W460 PolarHBondContact O-NE1 3.33Å
418	W	96.1	Very high	95.9	Very high	74 Å²	74	48.2 Å²	48.2	28%	0.28	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	144.1	168.6	-67.7	97.6	0	0	0	110.4	T395 R398 E411 V412 F413	T395-W418 VanDerWaalsContact O-CH2 3.3Å; T395-W418 WeakPolarHBondContact O-CH2 3.42Å; R398-W418 HydrophobicContact CB-CH2 3.94Å; R398-W418 HydrophobicContact CB-CZ3 3.95Å; R398-W418 HydrophobicContact CG-CD2 4.42Å; R398-W418 HydrophobicContact CG-CE3 3.8Å; R398-W418 HydrophobicContact CG-CH2 3.81Å; R398-W418 HydrophobicContact CG-CZ2 4.42Å; R398-W418 HydrophobicContact CG-CZ3 3.47Å; R398-W418 VanDerWaalsContact CG-CZ3 3.47Å; E411-W418 HydrophobicContact CB-CE3 4.02Å; E411-W418 WeakPolarHBondContact O-CZ3 3.34Å; V412-W418 WeakPolarHBondContact O-CA 3.37Å; F413-W418 HydrophobicContact CB-CD2 4.23Å; F413-W418 HydrophobicContact CB-CE3 4Å; F413-W418 HydrophobicContact CB-CH2 3.94Å; F413-W418 HydrophobicContact CB-CZ2 4.16Å; F413-W418 HydrophobicContact CB-CZ3 3.85Å; F413-W418 AromaticContact CD2-CD1 3.85Å; F413-W418 AromaticContact CD2-CD2 3.81Å; F413-W418 HydrophobicContact CD2-CD2 3.81Å; F413-W418 AromaticContact CD2-CE2 3.61Å; F413-W418 HydrophobicContact CD2-CE3 4.42Å; F413-W418 AromaticContact CD2-CG 3.98Å; F413-W418 HydrophobicContact CD2-CG 3.98Å; F413-W418 HydrophobicContact CD2-CZ2 4.1Å; F413-W418 AromaticContact CD2-NE1 3.62Å; F413-W418 AromaticContact CE2-NE1 3.9Å; F413-W418 HydrophobicContact CG-CD2 4.5Å; F413-W418 HydrophobicContact CG-CZ2 4.38Å
419	G	97.2	Very high	95.8	Very high	1 Å²	1	53 Å²	53	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	163.8	172.2	0	0	0	0	0	110.5	E411 V412 L458	E411-G419 CarbonylContact C-O 3.37Å; E411-G419 VanDerWaalsContact CA-O 3.23Å; E411-G419 WeakPolarHBondContact CA-O 3.47Å; V412-G419 PolarHBondContact N-O 3.49Å; V412-G419 PolarHBondContact O-N 2.98Å; G419-L458 CarbonylContact C-O 3.58Å; G419-L458 WeakPolarHBondContact CA-O 3.3Å
420	T	98.2	Very high	95.8	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	177.9	-174.1	56.8	0	0	0	0	112	R409 E411 L458 I459 W460 H488 D491	R409-T420 HydrophobicContact CG-CG2 4.39Å; E411-T420 HydrophobicContact CG-CG2 3.99Å; T420-L458 PolarHBondContact N-O 3.02Å; T420-I459 CarbonylContact O-C 3.6Å; T420-I459 WeakPolarHBondContact OG1-CG1 3.42Å; T420-W460 PolarHBondContact O-N 3.39Å; T420-H488 PolarHBondContact OG1-CE1 2.92Å; T420-H488 PolarHBondContact OG1-ND1 2.89Å; T420-D491 WeakPolarHBondContact CB-OD1 3.48Å; T420-D491 WeakPolarHBondContact CG2-OD2 3.24Å; T420-D491 PolarHBondContact OG1-OD1 3.36Å
421	V	98.3	Very high	95.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.6	176.5	-179.8	0	0	0	0	107.8	V410 V412 W426 M461 V464 D491 A492	V410-V421 HydrophobicContact CB-CG2 4.39Å; V410-V421 HydrophobicContact CG1-CG2 3.92Å; V412-V421 HydrophobicContact CG1-CG2 3.98Å; V412-V421 HydrophobicContact CG2-CG2 4.34Å; V421-W426 HydrophobicContact CG1-CE3 4.04Å; V421-W426 HydrophobicContact CG1-CZ3 3.82Å; V421-M461 CarbonylContact C-O 3.58Å; V421-M461 WeakPolarHBondContact CA-O 3.32Å; V421-M461 HydrophobicContact CG1-CB 4.09Å; V421-M461 HydrophobicContact CG2-CB 4.19Å; V421-V464 HydrophobicContact CG1-CG2 3.67Å; V421-D491 WeakPolarHBondContact O-CA 3.4Å; V421-A492 HydrophobicContact CB-CB 4.38Å; V421-A492 HydrophobicContact CG1-CB 4.4Å; V421-A492 WeakPolarHBondContact O-CB 3.31Å; V421-A492 PolarHBondContact O-N 3.31Å
422	C	98.1	Very high	95.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-73.7	150.2	174.6	-178.5	0	0	0	0	111.6	D424 I459 M461 D462 C486 E490	C422-D424 PolarHBondContact SG-N 2.96Å; C422-D424 VanDerWaalsContact SG-N 3.38Å; C422-I459 HydrophobicContact CB-CG2 4.05Å; C422-M461 PolarHBondContact N-O 3.43Å; C422-D462 HydrophobicContact CB-CB 4.06Å; C422-D462 VanDerWaalsContact CB-OD1 3.3Å; C422-D462 WeakPolarHBondContact CB-OD1 3.43Å; C422-D462 PolarHBondContact SG-OD1 2.68Å; C422-C486 HydrophobicContact CB-CB 3.63Å; C422-C486 WeakPolarHBondContact CB-SG 3.28Å; C422-C486 WeakPolarHBondContact SG-CB 3.48Å; C422-C486 CovalentContact SG-SG 2.01Å; C422-C486 PolarHBondContact SG-SG 3.27Å; C422-E490 CarbonylContact C-O 3.57Å; C422-E490 WeakPolarHBondContact CA-O 3.47Å
423	D	97.1	Very high	95.7	Very high	12 Å²	12	53.6 Å²	53.6	6%	0.064	24%	0.238	C	C	.	.			trans	-84.2	-3.4	179	79	49.6	0	0	0	115.3	V425 W426 K448 T449 E490 A492	D423-V425 PolarHBondContact O-N 3.17Å; D423-W426 HydrophobicContact CB-CB 4.24Å; D423-W426 WeakPolarHBondContact O-CB 3.4Å; D423-W426 PolarHBondContact O-N 3.24Å; D423-K448 HydrophobicContact CB-CB 3.81Å; D423-K448 HydrophobicContact CB-CD 4Å; D423-K448 HydrophobicContact CB-CG 3.82Å; D423-K448 PolarHBondContact O-NZ 3.44Å; D423-K448 WeakPolarHBondContact OD2-CB 3.39Å; D423-T449 PolarHBondContact OD2-N 3.31Å; D423-E490 WeakPolarHBondContact CB-O 3.43Å; D423-E490 PolarHBondContact N-O 3.23Å; D423-E490 VanDerWaalsContact OD2-CA 3.27Å; D423-E490 WeakPolarHBondContact OD2-CA 3.28Å; D423-A492 HydrophobicContact CB-CB 4.18Å
424	D	96.4	Very high	95.9	Very high	44 Å²	44	50.6 Å²	50.6	24%	0.235	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	124.6	172.3	-86.9	-9.5	0	0	0	109.1	C422 W426 D462 N485	C422-D424 PolarHBondContact SG-N 2.96Å; C422-D424 VanDerWaalsContact SG-N 3.38Å; D424-W426 PolarHBondContact O-N 2.88Å; D424-D462 WeakPolarHBondContact CB-OD1 3.44Å; D424-N485 PolarHBondContact OD2-ND2 3.46Å
425	V	95.4	Very high	96.1	Very high	82 Å²	82	48.8 Å²	48.8	50%	0.497	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	-4.6	-173.6	-168.5	0	0	0	0	115.1	D423 D427 D463 A465	D423-V425 PolarHBondContact O-N 3.17Å; V425-D427 PolarHBondContact O-N 3.11Å; V425-D427 VanDerWaalsContact O-N 3.17Å; V425-D463 WeakPolarHBondContact CG2-OD1 3.48Å; V425-A465 HydrophobicContact CG1-CB 4.47Å
426	W	97.9	Very high	96.4	Very high	3 Å²	3	46.2 Å²	46.2	1%	0.011	20%	0.201	C	C	.	.			trans	-54.4	119	-180	-171.6	-111.5	0	0	0	112.6	V410 V421 D423 D424 D430 V434 K448 V464 I473 A492 G493	V410-W426 HydrophobicContact CG2-CH2 4.38Å; V410-W426 HydrophobicContact CG2-CZ2 4.02Å; V421-W426 HydrophobicContact CG1-CE3 4.04Å; V421-W426 HydrophobicContact CG1-CZ3 3.82Å; D423-W426 HydrophobicContact CB-CB 4.24Å; D423-W426 WeakPolarHBondContact O-CB 3.4Å; D423-W426 PolarHBondContact O-N 3.24Å; D424-W426 PolarHBondContact O-N 2.88Å; W426-D430 HydrophobicContact CD2-CB 4.05Å; W426-D430 HydrophobicContact CE3-CB 3.53Å; W426-D430 HydrophobicContact CH2-CB 3.68Å; W426-D430 HydrophobicContact CZ2-CB 4.19Å; W426-D430 HydrophobicContact CZ3-CB 3.33Å; W426-V434 HydrophobicContact CH2-CG2 3.94Å; W426-K448 WeakPolarHBondContact O-CE 3.42Å; W426-K448 PolarHBondContact O-NZ 3.38Å; W426-V464 HydrophobicContact CE3-CB 4.11Å; W426-V464 HydrophobicContact CZ3-CB 4.14Å; W426-V464 HydrophobicContact CZ3-CG1 4.14Å; W426-V464 HydrophobicContact CZ3-CG2 4.41Å; W426-I473 HydrophobicContact CH2-CD1 3.97Å; W426-I473 HydrophobicContact CZ3-CD1 3.94Å; W426-A492 HydrophobicContact CD2-CB 3.74Å; W426-A492 HydrophobicContact CE3-CB 4.28Å; W426-A492 HydrophobicContact CG-CB 3.82Å; W426-A492 HydrophobicContact CZ2-CB 4.44Å; W426-G493 PolarHBondContact NE1-O 3.41Å
427	D	96.6	Very high	96.7	Very high	53 Å²	53	38 Å²	38	28%	0.283	17%	0.173	S	C	.	.			trans	-132.4	178.2	-176.2	85.3	19.9	0	0	0	112.7	V425 K429 D430 G431	V425-D427 PolarHBondContact O-N 3.11Å; V425-D427 VanDerWaalsContact O-N 3.17Å; D427-K429 VanDerWaalsContact C-N 3.26Å; D427-K429 PolarHBondContact O-N 3.12Å; D427-K429 WeakPolarHBondContact OD1-CA 3.29Å; D427-K429 WeakPolarHBondContact OD1-CB 3.42Å; D427-K429 PolarHBondContact OD1-N 3.45Å; D427-D430 PolarHBondContact N-OD2 2.99Å; D427-D430 PolarHBondContact O-N 2.95Å; D427-D430 PolarHBondContact OD1-N 2.85Å; D427-G431 PolarHBondContact O-N 3.49Å
428	K	97.1	Very high	96.8	Very high	109 Å²	109	34 Å²	34	47%	0.474	16%	0.161	S	C	.	.	H	α-helix	trans	-63.4	-29.7	-176.1	-173.9	170.1	179.1	161.4	0	113.3	D430 G431 D432 A443	K428-D430 VanDerWaalsContact C-N 3.33Å; K428-G431 PolarHBondContact O-N 2.87Å; K428-D432 WeakPolarHBondContact O-CB 3.43Å; K428-D432 VanDerWaalsContact O-CG 3.31Å; K428-D432 PolarHBondContact O-N 3.23Å; K428-A443 WeakPolarHBondContact CE-O 3.38Å; K428-A443 HydrophobicContact CG-CB 4.45Å; K428-A443 PolarHBondContact NZ-O 3.12Å
429	K	97.8	Very high	96.7	Very high	102 Å²	102	33.7 Å²	33.7	44%	0.443	18%	0.181	S	C	.	.	H	α-helix	trans	-68.3	-37.9	179	-58.1	168.1	-173.2	156.4	0	110.6	D427 D432 V433	D427-K429 VanDerWaalsContact C-N 3.26Å; D427-K429 PolarHBondContact O-N 3.12Å; D427-K429 WeakPolarHBondContact OD1-CA 3.29Å; D427-K429 WeakPolarHBondContact OD1-CB 3.42Å; D427-K429 PolarHBondContact OD1-N 3.45Å; K429-D432 PolarHBondContact O-N 3.11Å; K429-V433 WeakPolarHBondContact O-CG2 3.46Å; K429-V433 PolarHBondContact O-N 3.26Å; K429-V433 VanDerWaalsContact O-N 3.07Å
430	D	97.8	Very high	96.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.7	-45.9	175.3	-45.6	-51.7	0	0	0	110.3	W426 D427 K428 D432 V433 V434 V464 C466	W426-D430 HydrophobicContact CD2-CB 4.05Å; W426-D430 HydrophobicContact CE3-CB 3.53Å; W426-D430 HydrophobicContact CH2-CB 3.68Å; W426-D430 HydrophobicContact CZ2-CB 4.19Å; W426-D430 HydrophobicContact CZ3-CB 3.33Å; D427-D430 PolarHBondContact N-OD2 2.99Å; D427-D430 PolarHBondContact O-N 2.95Å; D427-D430 PolarHBondContact OD1-N 2.85Å; K428-D430 VanDerWaalsContact C-N 3.33Å; D430-D432 VanDerWaalsContact C-N 3.33Å; D430-D432 PolarHBondContact O-N 3.34Å; D430-V433 PolarHBondContact O-N 3.41Å; D430-V434 PolarHBondContact O-N 3.32Å; D430-V434 VanDerWaalsContact O-N 3.07Å; D430-V464 HydrophobicContact CB-CG1 4.22Å; D430-C466 WeakPolarHBondContact OD1-CA 3.45Å; D430-C466 WeakPolarHBondContact OD1-CB 3.41Å; D430-C466 PolarHBondContact OD1-N 3.3Å; D430-C466 PolarHBondContact OD1-SG 3.3Å
431	G	97.1	Very high	96.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-42.4	172.5	0	0	0	0	0	113	D427 K428 V433 V434 C435 A443	D427-G431 PolarHBondContact O-N 3.49Å; K428-G431 PolarHBondContact O-N 2.87Å; G431-V433 VanDerWaalsContact C-N 3.34Å; G431-V433 PolarHBondContact O-N 3.49Å; G431-V434 PolarHBondContact O-N 3.06Å; G431-C435 WeakPolarHBondContact O-CB 3.48Å; G431-C435 PolarHBondContact O-N 3.42Å; G431-C435 PolarHBondContact O-SG 3.01Å; G431-C435 VanDerWaalsContact O-SG 3.32Å; G431-A443 VanDerWaalsContact C-CB 3.46Å
432	D	97.3	Very high	96.2	Very high	46 Å²	46	41.7 Å²	41.7	25%	0.246	23%	0.226	C	C	.	.	H	α-helix	trans	-61.2	-42.2	178.2	-81.1	-27.6	0	0	0	111.4	K428 K429 D430 R436 G442 A443	K428-D432 WeakPolarHBondContact O-CB 3.43Å; K428-D432 VanDerWaalsContact O-CG 3.31Å; K428-D432 PolarHBondContact O-N 3.23Å; K429-D432 PolarHBondContact O-N 3.11Å; D430-D432 VanDerWaalsContact C-N 3.33Å; D430-D432 PolarHBondContact O-N 3.34Å; D432-R436 WeakPolarHBondContact O-CB 3.45Å; D432-R436 VanDerWaalsContact O-CG 3.31Å; D432-R436 WeakPolarHBondContact O-CG 3.43Å; D432-R436 PolarHBondContact O-N 3.49Å; D432-G442 WeakPolarHBondContact OD1-CA 3.38Å; D432-A443 PolarHBondContact OD1-N 2.89Å
433	V	97.6	Very high	96.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.9	-49.5	175	174.3	0	0	0	0	110.4	K429 D430 G431 C435 R436 M437 C466 E470 I473	K429-V433 WeakPolarHBondContact O-CG2 3.46Å; K429-V433 PolarHBondContact O-N 3.26Å; K429-V433 VanDerWaalsContact O-N 3.07Å; D430-V433 PolarHBondContact O-N 3.41Å; G431-V433 VanDerWaalsContact C-N 3.34Å; G431-V433 PolarHBondContact O-N 3.49Å; V433-C435 PolarHBondContact O-N 3.46Å; V433-R436 PolarHBondContact O-N 3.32Å; V433-M437 HydrophobicContact CG1-CG 4.49Å; V433-M437 HydrophobicContact CG1-SD 4.34Å; V433-M437 VanDerWaalsContact O-CG 3.3Å; V433-M437 WeakPolarHBondContact O-CG 3.25Å; V433-M437 PolarHBondContact O-N 3.07Å; V433-C466 HydrophobicContact CG2-CB 4.02Å; V433-E470 HydrophobicContact CG1-CB 4.24Å; V433-E470 HydrophobicContact CG2-CB 4.14Å; V433-I473 HydrophobicContact CG1-CB 4.23Å
434	V	97.3	Very high	96.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-45.3	179	172.9	0	0	0	0	111.9	V397 L399 V410 W426 D430 G431 R436 M437 L438 I473 V494	V397-V434 HydrophobicContact CG2-CG1 3.99Å; L399-V434 HydrophobicContact CD2-CG1 4.14Å; V410-V434 HydrophobicContact CG1-CG1 4.27Å; V410-V434 HydrophobicContact CG1-CG2 4.19Å; V410-V434 HydrophobicContact CG2-CG1 4.36Å; W426-V434 HydrophobicContact CH2-CG2 3.94Å; D430-V434 PolarHBondContact O-N 3.32Å; D430-V434 VanDerWaalsContact O-N 3.07Å; G431-V434 PolarHBondContact O-N 3.06Å; V434-R436 PolarHBondContact O-N 3.32Å; V434-M437 WeakPolarHBondContact O-CB 3.4Å; V434-M437 PolarHBondContact O-N 3.39Å; V434-L438 HydrophobicContact CG1-CD1 4.04Å; V434-L438 WeakPolarHBondContact O-CG 3.5Å; V434-L438 PolarHBondContact O-N 3.32Å; V434-L438 VanDerWaalsContact O-N 3.15Å; V434-I473 HydrophobicContact CG2-CB 4.34Å; V434-I473 HydrophobicContact CG2-CD1 3.5Å; V434-I473 HydrophobicContact CG2-CG1 4.37Å; V434-V494 HydrophobicContact CG1-CG1 4.14Å
435	C	96.8	Very high	96.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-40.6	179.2	-72	0	0	0	0	111.7	G431 V433 L438 G439 Y440 G442 V494 C496	G431-C435 WeakPolarHBondContact O-CB 3.48Å; G431-C435 PolarHBondContact O-N 3.42Å; G431-C435 PolarHBondContact O-SG 3.01Å; G431-C435 VanDerWaalsContact O-SG 3.32Å; V433-C435 PolarHBondContact O-N 3.46Å; C435-L438 PolarHBondContact O-N 3.15Å; C435-G439 PolarHBondContact O-N 2.92Å; C435-Y440 WeakPolarHBondContact O-CB 3.16Å; C435-Y440 PolarHBondContact O-N 3.48Å; C435-G442 VanDerWaalsContact CB-C 3.43Å; C435-V494 VanDerWaalsContact SG-CG2 3.52Å; C435-C496 WeakPolarHBondContact CA-SG 3.48Å; C435-C496 HydrophobicContact CB-CB 3.78Å; C435-C496 WeakPolarHBondContact CB-SG 3.46Å; C435-C496 WeakPolarHBondContact SG-CA 3.39Å; C435-C496 WeakPolarHBondContact SG-CB 3.49Å; C435-C496 CovalentContact SG-SG 2.04Å; C435-C496 PolarHBondContact SG-SG 3.31Å
436	R	95.2	Very high	96.2	Very high	82 Å²	82	47.8 Å²	47.8	31%	0.309	25%	0.246	S	C	.	.	H	α-helix	trans	-65.2	-39.9	174.8	-75.3	-171.2	-62	105.4	-2.8	112.7	D432 V433 V434 L438 G439 Y440 G468 E470	D432-R436 WeakPolarHBondContact O-CB 3.45Å; D432-R436 VanDerWaalsContact O-CG 3.31Å; D432-R436 WeakPolarHBondContact O-CG 3.43Å; D432-R436 PolarHBondContact O-N 3.49Å; V433-R436 PolarHBondContact O-N 3.32Å; V434-R436 PolarHBondContact O-N 3.32Å; R436-L438 PolarHBondContact O-N 2.94Å; R436-G439 PolarHBondContact O-N 2.92Å; R436-Y440 WeakPolarHBondContact CA-O 3.49Å; R436-G468 PolarHBondContact NH2-O 2.89Å; R436-E470 VanDerWaalsContact CZ-O 3.27Å; R436-E470 PolarHBondContact NH1-O 3Å; R436-E470 PolarHBondContact NH2-O 3.23Å
437	M	94.6	Very high	96.2	Very high	51 Å²	51	48.9 Å²	48.9	25%	0.251	25%	0.251	S	S	.	.	H	α-helix	trans	-57.1	-36.9	173.7	-72.9	175.5	76.1	0	0	112.2	L396 V397 V433 V434 G439 D471 T472 I473	L396-M437 HydrophobicContact CB-CE 4.31Å; V397-M437 HydrophobicContact CB-CE 4.15Å; V397-M437 HydrophobicContact CG1-CB 3.99Å; V397-M437 HydrophobicContact CG1-CE 3.8Å; V397-M437 HydrophobicContact CG1-SD 4.12Å; V433-M437 HydrophobicContact CG1-CG 4.49Å; V433-M437 HydrophobicContact CG1-SD 4.34Å; V433-M437 VanDerWaalsContact O-CG 3.3Å; V433-M437 WeakPolarHBondContact O-CG 3.25Å; V433-M437 PolarHBondContact O-N 3.07Å; V434-M437 WeakPolarHBondContact O-CB 3.4Å; V434-M437 PolarHBondContact O-N 3.39Å; M437-G439 VanDerWaalsContact C-N 3.27Å; M437-G439 PolarHBondContact O-N 3.35Å; M437-D471 VanDerWaalsContact CG-O 3.25Å; M437-D471 WeakPolarHBondContact CG-O 3.28Å; M437-T472 WeakPolarHBondContact CE-OG1 3.47Å; M437-T472 VanDerWaalsContact SD-CA 3.56Å; M437-I473 HydrophobicContact CE-CG2 4.19Å; M437-I473 HydrophobicContact SD-CB 3.88Å; M437-I473 HydrophobicContact SD-CG2 3.76Å; M437-I473 PolarHBondContact SD-N 3.24Å
438	L	94	Very high	96.2	Very high	53 Å²	53	50 Å²	50	28%	0.277	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-0.8	178.8	-67.7	168.4	0	0	0	113.5	V397 L399 V434 C435 R436 Y440	V397-L438 HydrophobicContact CG1-CD1 4.44Å; V397-L438 HydrophobicContact CG1-CD2 3.83Å; V397-L438 HydrophobicContact CG1-CG 3.88Å; L399-L438 HydrophobicContact CD1-CD1 3.74Å; L399-L438 HydrophobicContact CD2-CD1 4.04Å; L399-L438 HydrophobicContact CG-CD1 3.54Å; V434-L438 HydrophobicContact CG1-CD1 4.04Å; V434-L438 WeakPolarHBondContact O-CG 3.5Å; V434-L438 PolarHBondContact O-N 3.32Å; V434-L438 VanDerWaalsContact O-N 3.15Å; C435-L438 PolarHBondContact O-N 3.15Å; R436-L438 PolarHBondContact O-N 2.94Å; L438-Y440 HydrophobicContact CB-CD2 3.78Å; L438-Y440 HydrophobicContact CB-CE2 3.88Å
439	G	94.1	Very high	96	Very high	68 Å²	68	49.8 Å²	49.8	70%	0.701	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	10.5	177.4	0	0	0	0	0	115.4	C435 R436 M437	C435-G439 PolarHBondContact O-N 2.92Å; R436-G439 PolarHBondContact O-N 2.92Å; M437-G439 VanDerWaalsContact C-N 3.27Å; M437-G439 PolarHBondContact O-N 3.35Å
440	Y	95.6	Very high	95.6	Very high	54 Å²	54	45.5 Å²	45.5	21%	0.212	25%	0.246	C	C	.	.			trans	-88.5	164.7	174	-59.9	-75.4	0	0	0	111.8	P405 H406 C435 R436 L438 G442 C496 N497	P405-Y440 PolarHBondContact O-OH 3.3Å; H406-Y440 WeakPolarHBondContact CA-OH 3.43Å; H406-Y440 HydrophobicContact CB-CD1 4.41Å; H406-Y440 HydrophobicContact CB-CE1 3.68Å; H406-Y440 HydrophobicContact CB-CE2 4.29Å; H406-Y440 PolarHBondContact N-OH 2.97Å; C435-Y440 WeakPolarHBondContact O-CB 3.16Å; C435-Y440 PolarHBondContact O-N 3.48Å; R436-Y440 WeakPolarHBondContact CA-O 3.49Å; L438-Y440 HydrophobicContact CB-CD2 3.78Å; L438-Y440 HydrophobicContact CB-CE2 3.88Å; Y440-G442 VanDerWaalsContact C-N 3.31Å; Y440-G442 PolarHBondContact O-N 3.02Å; Y440-C496 HydrophobicContact CD1-CB 4.22Å; Y440-C496 HydrophobicContact CD2-CB 3.67Å; Y440-C496 HydrophobicContact CE2-CB 4.32Å; Y440-C496 HydrophobicContact CG-CB 3.61Å; Y440-N497 WeakPolarHBondContact CD1-O 3.39Å
441	T	93.4	Very high	95.5	Very high	113 Å²	113	53.3 Å²	53.3	69%	0.693	28%	0.276	S	S	*	.	S	Bend	trans	-72.7	-23.4	-177.6	54.6	0	0	0	0	113.6	N497	T441-N497 WeakPolarHBondContact OG1-CB 3.47Å
442	G	94	Very high	95.5	Very high	4 Å²	4	54.1 Å²	54.1	4%	0.041	28%	0.279	C	S	.	.			trans	160.8	179.2	178.9	0	0	0	0	0	111.8	D432 C435 Y440 C496 N497	D432-G442 WeakPolarHBondContact OD1-CA 3.38Å; C435-G442 VanDerWaalsContact CB-C 3.43Å; Y440-G442 VanDerWaalsContact C-N 3.31Å; Y440-G442 PolarHBondContact O-N 3.02Å; G442-C496 WeakPolarHBondContact O-CA 3.28Å; G442-N497 PolarHBondContact O-N 3.3Å
443	A	96.7	Very high	95.3	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.008	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	127.6	173.5	0	0	0	0	0	110.8	K428 G431 D432 V494	K428-A443 WeakPolarHBondContact CE-O 3.38Å; K428-A443 HydrophobicContact CG-CB 4.45Å; K428-A443 PolarHBondContact NZ-O 3.12Å; G431-A443 VanDerWaalsContact C-CB 3.46Å; D432-A443 PolarHBondContact OD1-N 2.89Å; A443-V494 HydrophobicContact CB-CG2 3.74Å
444	F	96.3	Very high	95.3	Very high	126 Å²	126	58.6 Å²	58.6	55%	0.553	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	-53.7	163.7	179.5	-104.9	0	0	0	109.4	T495 N497	F444-T495 WeakPolarHBondContact CA-O 3.5Å; F444-T495 HydrophobicContact CB-CG2 4.38Å; F444-T495 WeakPolarHBondContact CB-O 3.47Å; F444-T495 HydrophobicContact CD1-CG2 4.32Å; F444-T495 PolarHBondContact N-O 3.16Å; F444-N497 WeakPolarHBondContact CB-OD1 3.31Å; F444-N497 WeakPolarHBondContact CD2-OD1 3.42Å
445	E	96.5	Very high	95.1	Very high	98 Å²	98	58.9 Å²	58.9	46%	0.458	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	149.2	-174.6	-171.5	169.9	-154.3	0	0	110.9	H447 V494 T495	E445-H447 IonicContact OE2-CE1 3.47Å; E445-H447 PolarHBondContact OE2-CE1 3.48Å; E445-H447 IonicContact OE2-NE2 3.46Å; E445-V494 WeakPolarHBondContact O-CG2 3.37Å; E445-T495 PolarHBondContact N-O 3.12Å; E445-T495 VanDerWaalsContact N-O 3.13Å; E445-T495 PolarHBondContact O-N 3.39Å
446	I	97.6	Very high	94.8	Very high	41 Å²	41	64.7 Å²	64.7	21%	0.21	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	147.2	172.6	60.4	92.1	0	0	0	109.5	K448 V494	I446-K448 HydrophobicContact CD1-CG 4.36Å; I446-V494 HydrophobicContact CG2-CG2 4.35Å
447	H	97.3	Very high	94.7	Very high	25 Å²	25	63.1 Å²	63.1	12%	0.116	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.8	-176.3	-60.3	-82.3	0	0	0	110.1	E445 R451 F452 G493 T495	E445-H447 IonicContact OE2-CE1 3.47Å; E445-H447 PolarHBondContact OE2-CE1 3.48Å; E445-H447 IonicContact OE2-NE2 3.46Å; H447-R451 HydrophobicContact CB-CB 3.67Å; H447-R451 HydrophobicContact CB-CG 4.01Å; H447-F452 HydrophobicContact CB-CE2 4.16Å; H447-F452 AromaticContact CD2-CE2 3.45Å; H447-F452 VanDerWaalsContact CD2-CE2 3.45Å; H447-F452 WeakPolarHBondContact CD2-CE2 3.43Å; H447-F452 AromaticContact CD2-CZ 3.82Å; H447-F452 AromaticContact CG-CE2 3.86Å; H447-G493 PolarHBondContact N-O 3.36Å; H447-G493 PolarHBondContact O-N 2.82Å; H447-T495 PolarHBondContact NE2-OG1 3.12Å
448	K	96.2	Very high	94.6	Very high	78 Å²	78	61.7 Å²	61.7	34%	0.339	35%	0.348	S	S	.	.			trans	-111.4	176.3	175.6	-56.9	-155.1	176.9	-146.5	0	109.8	D423 W426 I446 G450	D423-K448 HydrophobicContact CB-CB 3.81Å; D423-K448 HydrophobicContact CB-CD 4Å; D423-K448 HydrophobicContact CB-CG 3.82Å; D423-K448 PolarHBondContact O-NZ 3.44Å; D423-K448 WeakPolarHBondContact OD2-CB 3.39Å; W426-K448 WeakPolarHBondContact O-CE 3.42Å; W426-K448 PolarHBondContact O-NZ 3.38Å; I446-K448 HydrophobicContact CD1-CG 4.36Å; K448-G450 VanDerWaalsContact C-N 3.29Å; K448-G450 PolarHBondContact O-N 2.93Å
449	T	93.3	Very high	94.7	Very high	103 Å²	103	60 Å²	60	63%	0.632	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	37.4	169.8	60.2	0	0	0	0	113.6	D423 R451 V489	D423-T449 PolarHBondContact OD2-N 3.31Å; T449-R451 PolarHBondContact O-N 3.41Å; T449-V489 CarbonylContact C-O 3.54Å; T449-V489 WeakPolarHBondContact CA-O 3.44Å
450	G	90.1	Very high	94.9	Very high	12 Å²	12	57.4 Å²	57.4	12%	0.124	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	35.2	172.5	0	0	0	0	0	114.4	K448 F452 G453 V489 D491	K448-G450 VanDerWaalsContact C-N 3.29Å; K448-G450 PolarHBondContact O-N 2.93Å; G450-F452 PolarHBondContact O-N 2.83Å; G450-F452 VanDerWaalsContact O-N 3.08Å; G450-G453 CarbonylContact O-C 3.49Å; G450-G453 VanDerWaalsContact O-CA 3.31Å; G450-G453 WeakPolarHBondContact O-CA 3.29Å; G450-G453 PolarHBondContact O-N 2.89Å; G450-V489 PolarHBondContact N-O 3.17Å; G450-V489 VanDerWaalsContact N-O 3.09Å; G450-D491 WeakPolarHBondContact CA-O 3.32Å; G450-D491 PolarHBondContact N-O 3.46Å; G450-D491 VanDerWaalsContact N-O 3.09Å
451	R	94.6	Very high	95	Very high	164 Å²	164	54.9 Å²	54.9	62%	0.619	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-34.7	-176.9	176.1	61.8	-178.6	83.8	2.5	115.1	H447 T449 G453	H447-R451 HydrophobicContact CB-CB 3.67Å; H447-R451 HydrophobicContact CB-CG 4.01Å; T449-R451 PolarHBondContact O-N 3.41Å; R451-G453 VanDerWaalsContact C-N 3.31Å
452	F	96.6	Very high	95.2	Very high	17 Å²	17	49.5 Å²	49.5	8%	0.075	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	28.5	177.8	-61.1	-75.7	0	0	0	111.7	N401 E407 G408 R409 H447 G450	N401-F452 WeakPolarHBondContact CB-O 3.35Å; N401-F452 PolarHBondContact ND2-O 2.99Å; E407-F452 HydrophobicContact CB-CE1 4.33Å; E407-F452 HydrophobicContact CB-CZ 4.07Å; E407-F452 HydrophobicContact CG-CE1 4.39Å; G408-F452 WeakPolarHBondContact O-CD2 3.42Å; R409-F452 HydrophobicContact CB-CB 4.12Å; R409-F452 PolarHBondContact NH1-O 3.38Å; H447-F452 HydrophobicContact CB-CE2 4.16Å; H447-F452 AromaticContact CD2-CE2 3.45Å; H447-F452 VanDerWaalsContact CD2-CE2 3.45Å; H447-F452 WeakPolarHBondContact CD2-CE2 3.43Å; H447-F452 AromaticContact CD2-CZ 3.82Å; H447-F452 AromaticContact CG-CE2 3.86Å; G450-F452 PolarHBondContact O-N 2.83Å; G450-F452 VanDerWaalsContact O-N 3.08Å
453	G	94.5	Very high	95.3	Very high	31 Å²	31	52.5 Å²	52.5	32%	0.32	28%	0.28	S	S	.	.			trans	78.7	157	-173.3	0	0	0	0	0	112.5	R409 G450 R451	R409-G453 WeakPolarHBondContact CD-O 3.35Å; R409-G453 PolarHBondContact NH1-O 3.38Å; G450-G453 CarbonylContact O-C 3.49Å; G450-G453 VanDerWaalsContact O-CA 3.31Å; G450-G453 WeakPolarHBondContact O-CA 3.29Å; G450-G453 PolarHBondContact O-N 2.89Å; R451-G453 VanDerWaalsContact C-N 3.31Å
454	Q	96.7	Very high	95.4	Very high	110 Å²	110	52.4 Å²	52.4	51%	0.514	28%	0.28	S	S	.	.			trans	-72.4	138.4	176.8	-59.7	-177.6	19.3	0	0	109.9	H488	Q454-H488 HydrophobicContact CB-CB 4.01Å; Q454-H488 WeakPolarHBondContact CG-O 3.46Å
455	G	93.1	Very high	95.4	Very high	6 Å²	6	48.4 Å²	48.4	6%	0.062	27%	0.27	C	S	.	.			trans	-76	-170.6	167.5	0	0	0	0	0	111.8	D491	G455-D491 WeakPolarHBondContact CA-OD2 3.44Å; G455-D491 PolarHBondContact N-OD2 3.14Å
456	T	90.7	Very high	95.4	Very high	122 Å²	122	44.1 Å²	44.1	75%	0.748	25%	0.251	S	S	*	.			trans	-141.9	151.8	179.3	58.8	0	0	0	0	109.6
457	G	93.3	Very high	95.3	Very high	49 Å²	49	47.4 Å²	47.4	51%	0.505	27%	0.273	S	S	.	.	S	Bend	trans	89.9	-122.5	175.5	0	0	0	0	0	112.8	H488	G457-H488 PolarHBondContact N-NE2 3.35Å; G457-H488 PolarHBondContact O-NE2 2.86Å
458	L	92.1	Very high	95	Very high	20 Å²	20	46.9 Å²	46.9	11%	0.105	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	139.5	-173.8	-65.8	169.7	0	0	0	110.3	H233 G419 T420 W460	H233-L458 VanDerWaalsContact CE1-CD2 3.47Å; H233-L458 WeakPolarHBondContact CE1-CD2 3.39Å; G419-L458 CarbonylContact C-O 3.58Å; G419-L458 WeakPolarHBondContact CA-O 3.3Å; T420-L458 PolarHBondContact N-O 3.02Å; L458-W460 HydrophobicContact CB-CD2 4.29Å; L458-W460 HydrophobicContact CD1-CD2 4.38Å; L458-W460 HydrophobicContact CD1-CE3 4.49Å; L458-W460 HydrophobicContact CD1-CH2 3.51Å; L458-W460 HydrophobicContact CD1-CZ2 3.34Å; L458-W460 HydrophobicContact CD1-CZ3 4.08Å
459	I	96.6	Very high	94.8	Very high	17 Å²	17	49.9 Å²	49.9	9%	0.087	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	107.2	159.9	-58	168.3	0	0	0	105.1	T420 C422 T484 C486	T420-I459 CarbonylContact O-C 3.6Å; T420-I459 WeakPolarHBondContact OG1-CG1 3.42Å; C422-I459 HydrophobicContact CB-CG2 4.05Å; I459-T484 HydrophobicContact CB-CG2 3.87Å; I459-T484 HydrophobicContact CD1-CG2 4.27Å; I459-T484 HydrophobicContact CG2-CG2 4.05Å; I459-C486 HydrophobicContact CD1-CB 4.31Å; I459-C486 WeakPolarHBondContact CD1-O 3.32Å
460	W	97.9	Very high	94.9	Very high	14 Å²	14	46.2 Å²	46.2	5%	0.053	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-33.7	-170.8	-87.2	138	0	0	0	113.4	V412 H414 E415 R417 T420 L458 W481 G482	V412-W460 HydrophobicContact CG2-CB 3.55Å; V412-W460 HydrophobicContact CG2-CG 4.11Å; H414-W460 HydrophobicContact CB-CD2 3.99Å; H414-W460 HydrophobicContact CB-CE3 4.45Å; H414-W460 HydrophobicContact CB-CG 4.25Å; H414-W460 HydrophobicContact CB-CZ2 4.17Å; H414-W460 AromaticContact CD2-CE3 3.96Å; H414-W460 AromaticContact CD2-CH2 3.88Å; H414-W460 AromaticContact CD2-CZ3 3.73Å; H414-W460 VanDerWaalsContact O-CZ2 3.29Å; H414-W460 WeakPolarHBondContact O-CZ2 3.49Å; E415-W460 HydrophobicContact CB-CH2 4.23Å; E415-W460 HydrophobicContact CB-CZ2 4.41Å; R417-W460 HydrophobicContact CB-CZ2 4.23Å; R417-W460 PolarHBondContact O-NE1 3.33Å; T420-W460 PolarHBondContact O-N 3.39Å; L458-W460 HydrophobicContact CB-CD2 4.29Å; L458-W460 HydrophobicContact CD1-CD2 4.38Å; L458-W460 HydrophobicContact CD1-CE3 4.49Å; L458-W460 HydrophobicContact CD1-CH2 3.51Å; L458-W460 HydrophobicContact CD1-CZ2 3.34Å; L458-W460 HydrophobicContact CD1-CZ3 4.08Å; W460-W481 HydrophobicContact CB-CE3 4.15Å; W460-W481 HydrophobicContact CB-CZ3 4.22Å; W460-W481 HydrophobicContact CE3-CB 4.41Å; W460-W481 HydrophobicContact CE3-CE3 4.29Å; W460-W481 WeakPolarHBondContact O-CA 3.44Å; W460-G482 PolarHBondContact O-N 3.4Å
461	M	98	Very high	95	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	142.1	-173.4	-56.3	-178.3	71	0	0	110.1	V412 V421 C422 V464 I473 F478 W481	V412-M461 HydrophobicContact CB-SD 4.48Å; V412-M461 HydrophobicContact CG1-SD 4.04Å; V412-M461 HydrophobicContact CG2-CG 4.11Å; V412-M461 HydrophobicContact CG2-SD 4.04Å; V421-M461 CarbonylContact C-O 3.58Å; V421-M461 WeakPolarHBondContact CA-O 3.32Å; V421-M461 HydrophobicContact CG1-CB 4.09Å; V421-M461 HydrophobicContact CG2-CB 4.19Å; C422-M461 PolarHBondContact N-O 3.43Å; M461-V464 HydrophobicContact CB-CG2 3.82Å; M461-V464 HydrophobicContact CE-CG2 4.22Å; M461-I473 HydrophobicContact CE-CG1 3.95Å; M461-I473 HydrophobicContact SD-CD1 4.36Å; M461-I473 HydrophobicContact SD-CG1 4.24Å; M461-I473 HydrophobicContact SD-CG2 4.37Å; M461-F478 HydrophobicContact CB-CD2 4.24Å; M461-F478 HydrophobicContact CE-CB 4.27Å; M461-F478 HydrophobicContact CE-CD1 3.54Å; M461-F478 HydrophobicContact CE-CD2 4.08Å; M461-F478 HydrophobicContact CE-CE1 3.79Å; M461-F478 HydrophobicContact CE-CE2 4.27Å; M461-F478 HydrophobicContact CE-CG 3.72Å; M461-F478 HydrophobicContact CE-CZ 4.15Å; M461-F478 HydrophobicContact CG-CD2 4.22Å; M461-F478 HydrophobicContact CG-CE2 4.21Å; M461-W481 HydrophobicContact CG-CE3 4.24Å; M461-W481 HydrophobicContact CG-CH2 4.49Å; M461-W481 HydrophobicContact CG-CZ3 3.79Å; M461-W481 HydrophobicContact SD-CH2 4.31Å; M461-W481 HydrophobicContact SD-CZ3 4.12Å
462	D	97.4	Very high	95	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.273	C	S	.	.			trans	-148.3	157.2	179.5	-169.7	9.2	0	0	0	109.4	C422 D424 V464 F478 S479 T484 N485 C486	C422-D462 HydrophobicContact CB-CB 4.06Å; C422-D462 VanDerWaalsContact CB-OD1 3.3Å; C422-D462 WeakPolarHBondContact CB-OD1 3.43Å; C422-D462 PolarHBondContact SG-OD1 2.68Å; D424-D462 WeakPolarHBondContact CB-OD1 3.44Å; D462-V464 PolarHBondContact O-N 2.97Å; D462-F478 VanDerWaalsContact O-CB 3.31Å; D462-F478 WeakPolarHBondContact O-CB 3.48Å; D462-S479 WeakPolarHBondContact CB-OG 3.45Å; D462-S479 WeakPolarHBondContact O-CB 3.42Å; D462-S479 PolarHBondContact O-N 3Å; D462-S479 PolarHBondContact O-OG 2.99Å; D462-S479 VanDerWaalsContact O-OG 3.11Å; D462-T484 VanDerWaalsContact CG-OG1 3.23Å; D462-T484 WeakPolarHBondContact OD2-CA 3.31Å; D462-T484 WeakPolarHBondContact OD2-CB 3.25Å; D462-T484 PolarHBondContact OD2-OG1 3.41Å; D462-N485 PolarHBondContact OD2-N 3.42Å; D462-N485 VanDerWaalsContact OD2-N 3.14Å; D462-N485 PolarHBondContact OD2-OD1 3Å; D462-C486 VanDerWaalsContact CG-SG 3.6Å; D462-C486 PolarHBondContact OD1-SG 3.37Å; D462-C486 VanDerWaalsContact OD1-SG 3.41Å; D462-C486 PolarHBondContact OD2-SG 3.47Å; D462-C486 VanDerWaalsContact OD2-SG 3.36Å
463	D	96.7	Very high	94.9	Very high	67 Å²	67	44.1 Å²	44.1	36%	0.358	27%	0.269	S	S	.	.	S	Bend	trans	48.1	44.4	-171.2	-69.9	-43.2	0	0	0	112	V425 A465 F478	V425-D463 WeakPolarHBondContact CG2-OD1 3.48Å; D463-A465 PolarHBondContact O-N 2.86Å; D463-F478 WeakPolarHBondContact O-CA 3.48Å
464	V	97.8	Very high	94.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.265	C	S	.	.			trans	-67.8	120.9	-179.3	-173.2	0	0	0	0	108.4	V421 W426 D430 M461 D462 I473 C476 F478	V421-V464 HydrophobicContact CG1-CG2 3.67Å; W426-V464 HydrophobicContact CE3-CB 4.11Å; W426-V464 HydrophobicContact CZ3-CB 4.14Å; W426-V464 HydrophobicContact CZ3-CG1 4.14Å; W426-V464 HydrophobicContact CZ3-CG2 4.41Å; D430-V464 HydrophobicContact CB-CG1 4.22Å; M461-V464 HydrophobicContact CB-CG2 3.82Å; M461-V464 HydrophobicContact CE-CG2 4.22Å; D462-V464 PolarHBondContact O-N 2.97Å; V464-I473 HydrophobicContact CG1-CD1 4.31Å; V464-I473 HydrophobicContact CG1-CG1 4.22Å; V464-C476 HydrophobicContact CG1-CB 4.22Å; V464-F478 HydrophobicContact CG2-CB 4.18Å
465	A	96.5	Very high	94.7	Very high	42 Å²	42	45.2 Å²	45.2	35%	0.347	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-133.9	70.8	-175.1	0	0	0	0	0	109.4	V425 D463 K477	V425-A465 HydrophobicContact CG1-CB 4.47Å; D463-A465 PolarHBondContact O-N 2.86Å; A465-K477 PolarHBondContact N-O 3.25Å
466	C	97.4	Very high	94.9	Very high	7 Å²	7	45.2 Å²	45.2	5%	0.047	27%	0.265	C	S	.	.			trans	-65.5	147.2	173	-62.2	0	0	0	0	111	D430 V433 G468 C476	D430-C466 WeakPolarHBondContact OD1-CA 3.45Å; D430-C466 WeakPolarHBondContact OD1-CB 3.41Å; D430-C466 PolarHBondContact OD1-N 3.3Å; D430-C466 PolarHBondContact OD1-SG 3.3Å; V433-C466 HydrophobicContact CG2-CB 4.02Å; C466-G468 VanDerWaalsContact C-N 3.31Å; C466-C476 HydrophobicContact CB-CB 3.91Å; C466-C476 WeakPolarHBondContact CB-SG 3.44Å; C466-C476 WeakPolarHBondContact SG-CB 3.36Å; C466-C476 CovalentContact SG-SG 2.02Å; C466-C476 PolarHBondContact SG-SG 3.41Å
467	V	94.8	Very high	95.1	Very high	111 Å²	111	47.4 Å²	47.4	67%	0.673	26%	0.264	S	S	*	.			trans	-75	-28.3	168.2	-177.6	0	0	0	0	110.2	E470	V467-E470 WeakPolarHBondContact CB-OE1 3.39Å; V467-E470 PolarHBondContact N-OE1 2.87Å; V467-E470 PolarHBondContact N-OE2 3.47Å
468	G	89.9	Confident	95.3	Very high	14 Å²	14	47 Å²	47	14%	0.144	25%	0.249	C	C	.	.	S	Bend	trans	108.4	-7	177.2	0	0	0	0	0	114.1	R436 C466 E470	R436-G468 PolarHBondContact NH2-O 2.89Å; C466-G468 VanDerWaalsContact C-N 3.31Å; G468-E470 WeakPolarHBondContact CA-OE2 3.5Å; G468-E470 PolarHBondContact N-OE2 2.94Å
469	N	92.8	Very high	95.3	Very high	141 Å²	141	48.1 Å²	48.1	75%	0.754	26%	0.259	S	S	*	.			trans	-109.3	0.9	-177	-69.8	-11.1	0	0	0	113.1
470	E	96.4	Very high	95.1	Very high	25 Å²	25	48.2 Å²	48.2	12%	0.117	26%	0.263	C	S	.	.			trans	-64.7	147.3	178.6	-65.2	86.4	164	0	0	111.2	V433 R436 V467 G468 Q475	V433-E470 HydrophobicContact CG1-CB 4.24Å; V433-E470 HydrophobicContact CG2-CB 4.14Å; R436-E470 VanDerWaalsContact CZ-O 3.27Å; R436-E470 PolarHBondContact NH1-O 3Å; R436-E470 PolarHBondContact NH2-O 3.23Å; V467-E470 WeakPolarHBondContact CB-OE1 3.39Å; V467-E470 PolarHBondContact N-OE1 2.87Å; V467-E470 PolarHBondContact N-OE2 3.47Å; G468-E470 WeakPolarHBondContact CA-OE2 3.5Å; G468-E470 PolarHBondContact N-OE2 2.94Å; E470-Q475 HydrophobicContact CB-CB 4.24Å; E470-Q475 HydrophobicContact CG-CB 4.1Å
471	D	91.4	Very high	95	Very high	124 Å²	124	51.5 Å²	51.5	66%	0.663	28%	0.276	S	S	*	.	S	Bend	trans	-83.2	-25.6	176.3	-69.2	-38	0	0	0	111.8	M437	M437-D471 VanDerWaalsContact CG-O 3.25Å; M437-D471 WeakPolarHBondContact CG-O 3.28Å
472	T	93.8	Very high	94.7	Very high	25 Å²	25	53.2 Å²	53.2	15%	0.153	29%	0.294	C	S	.	.	S	Bend	trans	-138.4	144.6	176.8	172.7	0	0	0	0	111	M437 H474 Q475	M437-T472 WeakPolarHBondContact CE-OG1 3.47Å; M437-T472 VanDerWaalsContact SD-CA 3.56Å; T472-H474 HydrophobicContact CG2-CB 4.28Å; T472-H474 PolarHBondContact O-N 3.25Å; T472-H474 VanDerWaalsContact O-N 3.13Å; T472-H474 PolarHBondContact OG1-N 2.78Å; T472-Q475 HydrophobicContact CG2-CB 4.26Å; T472-Q475 HydrophobicContact CG2-CG 3.59Å; T472-Q475 WeakPolarHBondContact O-CB 3.4Å; T472-Q475 PolarHBondContact O-N 3.21Å
473	I	95.7	Very high	94.5	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-59.2	-24.9	176.2	-167.7	170.9	0	0	0	111.8	V412 W426 V433 V434 M437 M461 V464 Q475 C476	V412-I473 HydrophobicContact CG1-CG2 4.03Å; W426-I473 HydrophobicContact CH2-CD1 3.97Å; W426-I473 HydrophobicContact CZ3-CD1 3.94Å; V433-I473 HydrophobicContact CG1-CB 4.23Å; V434-I473 HydrophobicContact CG2-CB 4.34Å; V434-I473 HydrophobicContact CG2-CD1 3.5Å; V434-I473 HydrophobicContact CG2-CG1 4.37Å; M437-I473 HydrophobicContact CE-CG2 4.19Å; M437-I473 HydrophobicContact SD-CB 3.88Å; M437-I473 HydrophobicContact SD-CG2 3.76Å; M437-I473 PolarHBondContact SD-N 3.24Å; M461-I473 HydrophobicContact CE-CG1 3.95Å; M461-I473 HydrophobicContact SD-CD1 4.36Å; M461-I473 HydrophobicContact SD-CG1 4.24Å; M461-I473 HydrophobicContact SD-CG2 4.37Å; V464-I473 HydrophobicContact CG1-CD1 4.31Å; V464-I473 HydrophobicContact CG1-CG1 4.22Å; I473-Q475 PolarHBondContact O-N 2.92Å; I473-C476 WeakPolarHBondContact O-CB 3.32Å; I473-C476 PolarHBondContact O-N 2.94Å; I473-C476 VanDerWaalsContact O-N 3.1Å
474	H	93.6	Very high	94.4	Very high	48 Å²	48	59.3 Å²	59.3	22%	0.222	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-66.8	-18.5	176.1	-63	-171	0	0	0	113.4	T472 W481	T472-H474 HydrophobicContact CG2-CB 4.28Å; T472-H474 PolarHBondContact O-N 3.25Å; T472-H474 VanDerWaalsContact O-N 3.13Å; T472-H474 PolarHBondContact OG1-N 2.78Å; H474-W481 HydrophobicContact CB-CZ2 4.42Å; H474-W481 AromaticContact CD2-CH2 3.61Å; H474-W481 AromaticContact CE1-CH2 3.91Å; H474-W481 AromaticContact CG-CH2 3.82Å; H474-W481 AromaticContact NE2-CH2 3.69Å
475	Q	93.3	Very high	94.1	Very high	116 Å²	116	64.9 Å²	64.9	54%	0.542	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-86.6	-15.7	175.5	-72.7	166.3	3.4	0	0	112.7	E470 T472 I473	E470-Q475 HydrophobicContact CB-CB 4.24Å; E470-Q475 HydrophobicContact CG-CB 4.1Å; T472-Q475 HydrophobicContact CG2-CB 4.26Å; T472-Q475 HydrophobicContact CG2-CG 3.59Å; T472-Q475 WeakPolarHBondContact O-CB 3.4Å; T472-Q475 PolarHBondContact O-N 3.21Å; I473-Q475 PolarHBondContact O-N 2.92Å
476	C	96	Very high	94	Very high	7 Å²	7	63.8 Å²	63.8	5%	0.047	34%	0.341	C	S	.	.	S	Bend	trans	-65.2	158.3	177.3	-59.8	0	0	0	0	110.4	V464 C466 I473 F478	V464-C476 HydrophobicContact CG1-CB 4.22Å; C466-C476 HydrophobicContact CB-CB 3.91Å; C466-C476 WeakPolarHBondContact CB-SG 3.44Å; C466-C476 WeakPolarHBondContact SG-CB 3.36Å; C466-C476 CovalentContact SG-SG 2.02Å; C466-C476 PolarHBondContact SG-SG 3.41Å; I473-C476 WeakPolarHBondContact O-CB 3.32Å; I473-C476 PolarHBondContact O-N 2.94Å; I473-C476 VanDerWaalsContact O-N 3.1Å; C476-F478 VanDerWaalsContact O-CD1 3.27Å; C476-F478 WeakPolarHBondContact O-CD1 3.35Å
477	K	96.3	Very high	93.7	Very high	167 Å²	167	65 Å²	65	73%	0.726	36%	0.355	S	S	*	.	B	Isolated β-bridge	trans	-76.9	133.4	170.3	-173	-178.5	175.6	-170.2	0	108.5	A465	A465-K477 PolarHBondContact N-O 3.25Å
478	F	96.9	Very high	93.9	Very high	40 Å²	40	61.6 Å²	61.6	18%	0.175	33%	0.332	C	S	.	.			trans	-151.6	171.6	175	65.3	-80.8	0	0	0	109.5	M461 D462 D463 V464 C476 G480 W481	M461-F478 HydrophobicContact CB-CD2 4.24Å; M461-F478 HydrophobicContact CE-CB 4.27Å; M461-F478 HydrophobicContact CE-CD1 3.54Å; M461-F478 HydrophobicContact CE-CD2 4.08Å; M461-F478 HydrophobicContact CE-CE1 3.79Å; M461-F478 HydrophobicContact CE-CE2 4.27Å; M461-F478 HydrophobicContact CE-CG 3.72Å; M461-F478 HydrophobicContact CE-CZ 4.15Å; M461-F478 HydrophobicContact CG-CD2 4.22Å; M461-F478 HydrophobicContact CG-CE2 4.21Å; D462-F478 VanDerWaalsContact O-CB 3.31Å; D462-F478 WeakPolarHBondContact O-CB 3.48Å; D463-F478 WeakPolarHBondContact O-CA 3.48Å; V464-F478 HydrophobicContact CG2-CB 4.18Å; C476-F478 VanDerWaalsContact O-CD1 3.27Å; C476-F478 WeakPolarHBondContact O-CD1 3.35Å; F478-G480 VanDerWaalsContact CD2-N 3.31Å; F478-G480 VanDerWaalsContact CE2-C 3.44Å; F478-G480 PolarHBondContact O-N 3.24Å; F478-G480 VanDerWaalsContact O-N 3.12Å; F478-W481 AromaticContact CE2-CD2 3.94Å; F478-W481 HydrophobicContact CE2-CD2 3.94Å; F478-W481 HydrophobicContact CE2-CE3 4.19Å; F478-W481 HydrophobicContact CE2-CG 4.2Å; F478-W481 AromaticContact CZ-CD2 3.85Å; F478-W481 HydrophobicContact CZ-CD2 3.85Å; F478-W481 AromaticContact CZ-CE2 3.59Å; F478-W481 HydrophobicContact CZ-CE3 4.31Å; F478-W481 HydrophobicContact CZ-CG 4.28Å; F478-W481 HydrophobicContact CZ-CH2 4.31Å; F478-W481 AromaticContact CZ-CZ2 3.85Å; F478-W481 HydrophobicContact CZ-CZ2 3.85Å; F478-W481 AromaticContact CZ-NE1 3.84Å
479	S	91.9	Very high	94.1	Very high	45 Å²	45	64.7 Å²	64.7	32%	0.315	35%	0.348	S	S	.	.	S	Bend	trans	-60	-19.1	-176.4	63.2	0	0	0	0	115.1	D462 K483	D462-S479 WeakPolarHBondContact CB-OG 3.45Å; D462-S479 WeakPolarHBondContact O-CB 3.42Å; D462-S479 PolarHBondContact O-N 3Å; D462-S479 PolarHBondContact O-OG 2.99Å; D462-S479 VanDerWaalsContact O-OG 3.11Å; S479-K483 WeakPolarHBondContact CB-O 3.35Å; S479-K483 PolarHBondContact OG-O 3.48Å
480	G	92.6	Very high	94.4	Very high	18 Å²	18	60.8 Å²	60.8	19%	0.186	33%	0.325	C	S	.	.			trans	109.5	155.8	-174.8	0	0	0	0	0	112.7	F478 G482 K483	F478-G480 VanDerWaalsContact CD2-N 3.31Å; F478-G480 VanDerWaalsContact CE2-C 3.44Å; F478-G480 PolarHBondContact O-N 3.24Å; F478-G480 VanDerWaalsContact O-N 3.12Å; G480-G482 PolarHBondContact O-N 2.92Å; G480-K483 WeakPolarHBondContact O-CB 3.29Å; G480-K483 PolarHBondContact O-N 3.07Å; G480-K483 VanDerWaalsContact O-N 3.1Å
481	W	95.1	Very high	94.4	Very high	83 Å²	83	59.7 Å²	59.7	31%	0.314	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	124.6	-171.1	-63.9	109.6	0	0	0	113.2	V412 H414 W460 M461 H474 F478 K483	V412-W481 HydrophobicContact CG2-CZ3 4.39Å; H414-W481 HydrophobicContact CB-CE3 3.89Å; H414-W481 HydrophobicContact CB-CH2 4.21Å; H414-W481 HydrophobicContact CB-CZ3 3.71Å; H414-W481 AromaticContact CD2-CD2 3.58Å; H414-W481 AromaticContact CD2-CE3 3.66Å; H414-W481 AromaticContact CD2-CG 3.78Å; H414-W481 AromaticContact CE1-CD1 3.73Å; H414-W481 AromaticContact CE1-CD2 3.58Å; H414-W481 AromaticContact CE1-CE2 3.39Å; H414-W481 AromaticContact CE1-CG 3.81Å; H414-W481 AromaticContact CE1-CZ2 3.89Å; H414-W481 AromaticContact CE1-NE1 3.5Å; H414-W481 PolarHBondContact CE1-NE1 2.87Å; H414-W481 AromaticContact CG-CD2 3.71Å; H414-W481 AromaticContact CG-CE3 3.54Å; H414-W481 AromaticContact CG-CZ3 3.73Å; H414-W481 AromaticContact ND1-CD2 3.71Å; H414-W481 AromaticContact ND1-CE2 3.53Å; H414-W481 AromaticContact ND1-CE3 3.9Å; H414-W481 AromaticContact ND1-CH2 3.81Å; H414-W481 AromaticContact ND1-CZ2 3.6Å; H414-W481 AromaticContact ND1-CZ3 3.95Å; H414-W481 AromaticContact NE2-CD1 3.61Å; H414-W481 AromaticContact NE2-CD2 3.51Å; H414-W481 AromaticContact NE2-CE2 3.81Å; H414-W481 AromaticContact NE2-CG 3.39Å; H414-W481 AromaticContact NE2-NE1 3.86Å; W460-W481 HydrophobicContact CB-CE3 4.15Å; W460-W481 HydrophobicContact CB-CZ3 4.22Å; W460-W481 HydrophobicContact CE3-CB 4.41Å; W460-W481 HydrophobicContact CE3-CE3 4.29Å; W460-W481 WeakPolarHBondContact O-CA 3.44Å; M461-W481 HydrophobicContact CG-CE3 4.24Å; M461-W481 HydrophobicContact CG-CH2 4.49Å; M461-W481 HydrophobicContact CG-CZ3 3.79Å; M461-W481 HydrophobicContact SD-CH2 4.31Å; M461-W481 HydrophobicContact SD-CZ3 4.12Å; H474-W481 HydrophobicContact CB-CZ2 4.42Å; H474-W481 AromaticContact CD2-CH2 3.61Å; H474-W481 AromaticContact CE1-CH2 3.91Å; H474-W481 AromaticContact CG-CH2 3.82Å; H474-W481 AromaticContact NE2-CH2 3.69Å; F478-W481 AromaticContact CE2-CD2 3.94Å; F478-W481 HydrophobicContact CE2-CD2 3.94Å; F478-W481 HydrophobicContact CE2-CE3 4.19Å; F478-W481 HydrophobicContact CE2-CG 4.2Å; F478-W481 AromaticContact CZ-CD2 3.85Å; F478-W481 HydrophobicContact CZ-CD2 3.85Å; F478-W481 AromaticContact CZ-CE2 3.59Å; F478-W481 HydrophobicContact CZ-CE3 4.31Å; F478-W481 HydrophobicContact CZ-CG 4.28Å; F478-W481 HydrophobicContact CZ-CH2 4.31Å; F478-W481 AromaticContact CZ-CZ2 3.85Å; F478-W481 HydrophobicContact CZ-CZ2 3.85Å; F478-W481 AromaticContact CZ-NE1 3.84Å; W481-K483 PolarHBondContact O-N 2.94Å; W481-K483 VanDerWaalsContact O-N 3.16Å
482	G	91.8	Very high	94.8	Very high	38 Å²	38	53.9 Å²	53.9	39%	0.392	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	8.2	177.8	0	0	0	0	0	114.5	W460 G480	W460-G482 PolarHBondContact O-N 3.4Å; G480-G482 PolarHBondContact O-N 2.92Å
483	K	93.2	Very high	95	Very high	144 Å²	144	52.8 Å²	52.8	63%	0.626	28%	0.283	S	S	*	.			trans	-96.9	100.7	177.9	-64.2	-179.3	-177.6	177.1	0	108.7	S479 G480 W481	S479-K483 WeakPolarHBondContact CB-O 3.35Å; S479-K483 PolarHBondContact OG-O 3.48Å; G480-K483 WeakPolarHBondContact O-CB 3.29Å; G480-K483 PolarHBondContact O-N 3.07Å; G480-K483 VanDerWaalsContact O-N 3.1Å; W481-K483 PolarHBondContact O-N 2.94Å; W481-K483 VanDerWaalsContact O-N 3.16Å
484	T	94.3	Very high	95.1	Very high	50 Å²	50	52.8 Å²	52.8	31%	0.307	28%	0.283	S	S	.	.			trans	-141.6	151.1	-179.2	-178.4	0	0	0	0	111.9	I459 D462 C486	I459-T484 HydrophobicContact CB-CG2 3.87Å; I459-T484 HydrophobicContact CD1-CG2 4.27Å; I459-T484 HydrophobicContact CG2-CG2 4.05Å; D462-T484 VanDerWaalsContact CG-OG1 3.23Å; D462-T484 WeakPolarHBondContact OD2-CA 3.31Å; D462-T484 WeakPolarHBondContact OD2-CB 3.25Å; D462-T484 PolarHBondContact OD2-OG1 3.41Å; T484-C486 VanDerWaalsContact OG1-CB 3.24Å; T484-C486 WeakPolarHBondContact OG1-CB 3.44Å; T484-C486 PolarHBondContact OG1-N 3.36Å; T484-C486 PolarHBondContact OG1-SG 3.46Å
485	N	91.6	Very high	95.3	Very high	118 Å²	118	51.3 Å²	51.3	63%	0.631	28%	0.277	S	S	*	.	S	Bend	trans	-98.4	5.8	165.7	53.4	-80	0	0	0	112.9	D424 D462	D424-N485 PolarHBondContact OD2-ND2 3.46Å; D462-N485 PolarHBondContact OD2-N 3.42Å; D462-N485 VanDerWaalsContact OD2-N 3.14Å; D462-N485 PolarHBondContact OD2-OD1 3Å
486	C	94.3	Very high	95.5	Very high	18 Å²	18	46 Å²	46	12%	0.122	25%	0.253	C	S	.	.			trans	-95.1	158.3	-172.1	-49.6	0	0	0	0	113.6	C422 I459 D462 T484 E490	C422-C486 HydrophobicContact CB-CB 3.63Å; C422-C486 WeakPolarHBondContact CB-SG 3.28Å; C422-C486 WeakPolarHBondContact SG-CB 3.48Å; C422-C486 CovalentContact SG-SG 2.01Å; C422-C486 PolarHBondContact SG-SG 3.27Å; I459-C486 HydrophobicContact CD1-CB 4.31Å; I459-C486 WeakPolarHBondContact CD1-O 3.32Å; D462-C486 VanDerWaalsContact CG-SG 3.6Å; D462-C486 PolarHBondContact OD1-SG 3.37Å; D462-C486 VanDerWaalsContact OD1-SG 3.41Å; D462-C486 PolarHBondContact OD2-SG 3.47Å; D462-C486 VanDerWaalsContact OD2-SG 3.36Å; T484-C486 VanDerWaalsContact OG1-CB 3.24Å; T484-C486 WeakPolarHBondContact OG1-CB 3.44Å; T484-C486 PolarHBondContact OG1-N 3.36Å; T484-C486 PolarHBondContact OG1-SG 3.46Å; C486-E490 VanDerWaalsContact CA-OE2 3.24Å; C486-E490 WeakPolarHBondContact CA-OE2 3.45Å; C486-E490 HydrophobicContact CB-CB 4.16Å; C486-E490 WeakPolarHBondContact CB-OE2 3.49Å
487	G	92.8	Very high	95.4	Very high	34 Å²	34	48.7 Å²	48.7	35%	0.351	27%	0.267	S	S	.	.			trans	-103.9	168.8	162.5	0	0	0	0	0	112.2	V489 E490	G487-V489 PolarHBondContact O-N 3.21Å; G487-E490 PolarHBondContact N-OE2 2.93Å; G487-E490 WeakPolarHBondContact O-CB 3.46Å; G487-E490 PolarHBondContact O-N 3.28Å
488	H	97.2	Very high	94.8	Very high	38 Å²	38	48.2 Å²	48.2	18%	0.176	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-64.4	-12.8	178.1	-75.6	-56.7	0	0	0	114.5	T420 Q454 G457 E490 D491	T420-H488 PolarHBondContact OG1-CE1 2.92Å; T420-H488 PolarHBondContact OG1-ND1 2.89Å; Q454-H488 HydrophobicContact CB-CB 4.01Å; Q454-H488 WeakPolarHBondContact CG-O 3.46Å; G457-H488 PolarHBondContact N-NE2 3.35Å; G457-H488 PolarHBondContact O-NE2 2.86Å; H488-E490 PolarHBondContact O-N 3.43Å; H488-D491 IonicContact CG-OD1 3Å; H488-D491 IonicContact CG-OD2 2.79Å; H488-D491 IonicContact ND1-OD1 2.8Å; H488-D491 PolarHBondContact ND1-OD1 3.15Å; H488-D491 VanDerWaalsContact ND1-OD1 3.08Å; H488-D491 IonicContact ND1-OD2 3.33Å; H488-D491 PolarHBondContact ND1-OD2 3.48Å; H488-D491 VanDerWaalsContact O-CG 3.31Å; H488-D491 PolarHBondContact O-N 2.89Å
489	V	95.6	Very high	94.7	Very high	80 Å²	80	48.7 Å²	48.7	49%	0.485	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-56.8	-28.1	165.6	154.7	0	0	0	0	111.3	T449 G450 G487	T449-V489 CarbonylContact C-O 3.54Å; T449-V489 WeakPolarHBondContact CA-O 3.44Å; G450-V489 PolarHBondContact N-O 3.17Å; G450-V489 VanDerWaalsContact N-O 3.09Å; G487-V489 PolarHBondContact O-N 3.21Å
490	E	97.6	Very high	94.8	Very high	59 Å²	59	48.8 Å²	48.8	28%	0.276	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-102.1	20.8	-176	-62.4	160.4	126	0	0	111.5	C422 D423 C486 G487 H488 A492	C422-E490 CarbonylContact C-O 3.57Å; C422-E490 WeakPolarHBondContact CA-O 3.47Å; D423-E490 WeakPolarHBondContact CB-O 3.43Å; D423-E490 PolarHBondContact N-O 3.23Å; D423-E490 VanDerWaalsContact OD2-CA 3.27Å; D423-E490 WeakPolarHBondContact OD2-CA 3.28Å; C486-E490 VanDerWaalsContact CA-OE2 3.24Å; C486-E490 WeakPolarHBondContact CA-OE2 3.45Å; C486-E490 HydrophobicContact CB-CB 4.16Å; C486-E490 WeakPolarHBondContact CB-OE2 3.49Å; G487-E490 PolarHBondContact N-OE2 2.93Å; G487-E490 WeakPolarHBondContact O-CB 3.46Å; G487-E490 PolarHBondContact O-N 3.28Å; H488-E490 PolarHBondContact O-N 3.43Å; E490-A492 PolarHBondContact O-N 2.99Å
491	D	97.9	Very high	94.9	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.011	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-67	128	176.9	-74.4	-26.6	0	0	0	110.9	R409 T420 V421 G450 G455 H488	R409-D491 HydrophobicContact CG-CB 4.13Å; T420-D491 WeakPolarHBondContact CB-OD1 3.48Å; T420-D491 WeakPolarHBondContact CG2-OD2 3.24Å; T420-D491 PolarHBondContact OG1-OD1 3.36Å; V421-D491 WeakPolarHBondContact O-CA 3.4Å; G450-D491 WeakPolarHBondContact CA-O 3.32Å; G450-D491 PolarHBondContact N-O 3.46Å; G450-D491 VanDerWaalsContact N-O 3.09Å; G455-D491 WeakPolarHBondContact CA-OD2 3.44Å; G455-D491 PolarHBondContact N-OD2 3.14Å; H488-D491 IonicContact CG-OD1 3Å; H488-D491 IonicContact CG-OD2 2.79Å; H488-D491 IonicContact ND1-OD1 2.8Å; H488-D491 PolarHBondContact ND1-OD1 3.15Å; H488-D491 VanDerWaalsContact ND1-OD1 3.08Å; H488-D491 IonicContact ND1-OD2 3.33Å; H488-D491 PolarHBondContact ND1-OD2 3.48Å; H488-D491 VanDerWaalsContact O-CG 3.31Å; H488-D491 PolarHBondContact O-N 2.89Å
492	A	98.4	Very high	94.9	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.008	29%	0.285	C	S	.	.			trans	-75	146.2	-179.9	0	0	0	0	0	112.6	V410 V421 D423 W426 E490	V410-A492 PolarHBondContact N-O 3.48Å; V421-A492 HydrophobicContact CB-CB 4.38Å; V421-A492 HydrophobicContact CG1-CB 4.4Å; V421-A492 WeakPolarHBondContact O-CB 3.31Å; V421-A492 PolarHBondContact O-N 3.31Å; D423-A492 HydrophobicContact CB-CB 4.18Å; W426-A492 HydrophobicContact CD2-CB 3.74Å; W426-A492 HydrophobicContact CE3-CB 4.28Å; W426-A492 HydrophobicContact CG-CB 3.82Å; W426-A492 HydrophobicContact CZ2-CB 4.44Å; E490-A492 PolarHBondContact O-N 2.99Å
493	G	98.1	Very high	95.1	Very high	3 Å²	3	49.3 Å²	49.3	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	165.6	175	0	0	0	0	0	112.4	G408 W426 H447	G408-G493 VanDerWaalsContact O-CA 3.25Å; G408-G493 WeakPolarHBondContact O-CA 3.44Å; W426-G493 PolarHBondContact NE1-O 3.41Å; H447-G493 PolarHBondContact N-O 3.36Å; H447-G493 PolarHBondContact O-N 2.82Å
494	V	98.3	Very high	95.3	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	148.2	176.6	67.7	0	0	0	0	110.6	L399 E407 G408 V410 V434 C435 A443 E445 I446	L399-V494 HydrophobicContact CD1-CG1 4.01Å; L399-V494 HydrophobicContact CD2-CG1 3.52Å; L399-V494 HydrophobicContact CG-CG1 4.44Å; E407-V494 CarbonylContact C-O 3.53Å; E407-V494 VanDerWaalsContact CA-O 3.23Å; E407-V494 WeakPolarHBondContact CA-O 3.3Å; G408-V494 PolarHBondContact N-O 3.27Å; G408-V494 PolarHBondContact O-N 3.36Å; V410-V494 HydrophobicContact CG2-CB 4.34Å; V410-V494 HydrophobicContact CG2-CG1 3.83Å; V434-V494 HydrophobicContact CG1-CG1 4.14Å; C435-V494 VanDerWaalsContact SG-CG2 3.52Å; A443-V494 HydrophobicContact CB-CG2 3.74Å; E445-V494 WeakPolarHBondContact O-CG2 3.37Å; I446-V494 HydrophobicContact CG2-CG2 4.35Å
495	T	98.3	Very high	95.3	Very high	16 Å²	16	42.5 Å²	42.5	10%	0.098	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121.1	165.2	-59.6	0	0	0	0	107.3	E407 F444 E445 H447	E407-T495 HydrophobicContact CB-CG2 4.07Å; E407-T495 PolarHBondContact OE2-OG1 2.96Å; F444-T495 WeakPolarHBondContact CA-O 3.5Å; F444-T495 HydrophobicContact CB-CG2 4.38Å; F444-T495 WeakPolarHBondContact CB-O 3.47Å; F444-T495 HydrophobicContact CD1-CG2 4.32Å; F444-T495 PolarHBondContact N-O 3.16Å; E445-T495 PolarHBondContact N-O 3.12Å; E445-T495 VanDerWaalsContact N-O 3.13Å; E445-T495 PolarHBondContact O-N 3.39Å; H447-T495 PolarHBondContact NE2-OG1 3.12Å
496	C	97.9	Very high	95.6	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.027	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	151.5	-178.1	-56.9	0	0	0	0	111.9	H406 C435 Y440 G442	H406-C496 HydrophobicContact CB-CB 4.39Å; H406-C496 WeakPolarHBondContact O-CB 3.48Å; H406-C496 PolarHBondContact O-N 3.02Å; C435-C496 WeakPolarHBondContact CA-SG 3.48Å; C435-C496 HydrophobicContact CB-CB 3.78Å; C435-C496 WeakPolarHBondContact CB-SG 3.46Å; C435-C496 WeakPolarHBondContact SG-CA 3.39Å; C435-C496 WeakPolarHBondContact SG-CB 3.49Å; C435-C496 CovalentContact SG-SG 2.04Å; C435-C496 PolarHBondContact SG-SG 3.31Å; Y440-C496 HydrophobicContact CD1-CB 4.22Å; Y440-C496 HydrophobicContact CD2-CB 3.67Å; Y440-C496 HydrophobicContact CE2-CB 4.32Å; Y440-C496 HydrophobicContact CG-CB 3.61Å; G442-C496 WeakPolarHBondContact O-CA 3.28Å
497	N	93.1	Very high	95.7	Very high	65 Å²	65	38.3 Å²	38.3	35%	0.348	23%	0.231	S	C	.	.			trans	-72.7	125.5	170.9	-79.4	-38.7	0	0	0	110.6	Y440 T441 G442 F444	Y440-N497 WeakPolarHBondContact CD1-O 3.39Å; T441-N497 WeakPolarHBondContact OG1-CB 3.47Å; G442-N497 PolarHBondContact O-N 3.3Å; F444-N497 WeakPolarHBondContact CB-OD1 3.31Å; F444-N497 WeakPolarHBondContact CD2-OD1 3.42Å
498	T	83.6	Confident	96	Very high	157 Å²	157	38.6 Å²	38.6	96%	0.963	22%	0.22	S	C	*	.			trans	-79.8	0	-179.6	46.4	0	0	0	0	114.3	H406	H406-T498 HydrophobicContact CB-CG2 3.79Å

Retrieved 498 of 498 residues in 2308.5 ms (Link to these results)

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