A0A087YNE7_POEFO Loading...

RNA methyltransferase

AlphaFold DB , UniProt , Accession A0A087YNE7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 534 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	S	44.1	Very low	42.2	Very low	170 Å²	170	178.3 Å²	178.3	100%	1.189	90%	0.898	S	S	*	*				0	118.2	0	-53.2	0	0	0	0	110.8
2	F	30.4	Very low	42.5	Very low	215 Å²	215	183.5 Å²	183.5	94%	0.943	90%	0.899	S	S	*	*			trans	-116.4	139.8	167.4	-88.9	-92.7	0	0	0	109
3	K	39.6	Very low	42.8	Very low	204 Å²	204	188 Å²	188	89%	0.887	90%	0.9	S	S	*	*	P	Polyproline II helix	trans	-99.4	129.7	-175.8	-66.4	179	179.2	177	0	110.1
4	Y	43.7	Very low	43.1	Very low	222 Å²	222	180.6 Å²	180.6	87%	0.871	89%	0.886	S	S	*	*	P	Polyproline II helix	trans	-71.2	141.6	168.1	-76.7	-88.8	0	0	0	110.8
5	P	47.6	Very low	43.3	Very low	124 Å²	124	179.3 Å²	179.3	81%	0.805	88%	0.884	S	S	*	*	P	Polyproline II helix	trans	-70.6	148	173.9	30	-34.3	0	0	0	111.4
6	T	37.7	Very low	43.4	Very low	142 Å²	142	174.3 Å²	174.3	87%	0.871	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-77.5	146.7	-172.9	44.4	0	0	0	0	113.3
7	S	48.8	Very low	44.1	Very low	116 Å²	116	176.1 Å²	176.1	81%	0.811	88%	0.877	S	S	*	*	P	Polyproline II helix	trans	-71	132.2	-177.6	48.9	0	0	0	0	112.9	K9	S7-K9 PolarHBondContact O-N 2.86Å
8	G	40.9	Very low	44.7	Very low	74 Å²	74	171.5 Å²	171.5	76%	0.763	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-64.6	130.9	179.8	0	0	0	0	0	112.9	R10	G8-R10 PolarHBondContact O-N 2.88Å
9	K	40.5	Very low	45.3	Very low	213 Å²	213	170.7 Å²	170.7	93%	0.926	86%	0.863	S	S	*	*			trans	-66.1	101	-177.5	-69.4	176.6	179.2	175.7	0	111.8	S7 R11	S7-K9 PolarHBondContact O-N 2.86Å; K9-R11 PolarHBondContact O-N 3.24Å
10	R	46.3	Very low	45.9	Very low	237 Å²	237	167.7 Å²	167.7	89%	0.894	86%	0.859	S	S	*	*			trans	-62.4	119.2	171.2	-166.5	178.3	-172.5	-170.6	2.9	109.7	G8 R12	G8-R10 PolarHBondContact O-N 2.88Å; R10-R12 PolarHBondContact O-N 3.07Å
11	R	44.4	Very low	46.7	Very low	244 Å²	244	166 Å²	166	92%	0.921	86%	0.856	S	S	*	*			trans	-59.9	95.7	-177.1	-172.9	177.7	-176.8	177.6	1.7	111.3	K9 R13	K9-R11 PolarHBondContact O-N 3.24Å; R11-R13 PolarHBondContact O-N 3.48Å
12	R	46.4	Very low	47.8	Very low	241 Å²	241	163 Å²	163	91%	0.909	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-58.5	132	171.7	-73.6	-175.2	174.5	-177.7	-3	109.2	R10	R10-R12 PolarHBondContact O-N 3.07Å
13	R	46.2	Very low	49.6	Very low	242 Å²	242	156.9 Å²	156.9	91%	0.913	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-79.1	137.8	154.8	-71	-177.7	176.4	178.8	-2.7	106.8	R11	R11-R13 PolarHBondContact O-N 3.48Å
14	A	47	Very low	50.7	Low	85 Å²	85	152.6 Å²	152.6	70%	0.702	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-76.6	164.3	172.9	0	0	0	0	0	110.6
15	N	45.7	Very low	51.8	Low	161 Å²	161	148.9 Å²	148.9	86%	0.861	79%	0.794	S	S	*	*			trans	68	76.8	169.7	-55.9	14.3	0	0	0	115.7
16	S	45.6	Very low	53.1	Low	98 Å²	98	145.2 Å²	145.2	69%	0.685	77%	0.766	S	S	*	*			trans	-142.4	98.9	144.9	59.6	0	0	0	0	108.3	S18	S16-S18 PolarHBondContact O-N 3.05Å; S16-S18 VanDerWaalsContact O-N 3.09Å
17	E	55.3	Low	54.2	Low	205 Å²	205	145.8 Å²	145.8	96%	0.958	76%	0.763	S	S	*	*			trans	-73.3	97.6	167.8	-70.3	-178	153.1	0	0	107.3
18	S	53.8	Low	54.9	Low	94 Å²	94	147 Å²	147	66%	0.657	76%	0.759	S	S	*	*			trans	-157	103.3	-176.2	-57.3	0	0	0	0	107	S16 S20	S16-S18 PolarHBondContact O-N 3.05Å; S16-S18 VanDerWaalsContact O-N 3.09Å; S18-S20 PolarHBondContact O-N 3.44Å
19	D	57	Low	56.2	Low	156 Å²	156	146.2 Å²	146.2	83%	0.834	75%	0.751	S	S	*	*			trans	-55.8	140.8	169	-74.6	-49.1	0	0	0	109.3	V21	D19-V21 VanDerWaalsContact C-N 3.27Å; D19-V21 PolarHBondContact O-N 2.95Å
20	S	56.6	Low	57.9	Low	111 Å²	111	136.6 Å²	136.6	78%	0.776	71%	0.712	S	S	*	*			trans	-75.8	79.8	-173.4	57.3	0	0	0	0	110.9	S18 L22	S18-S20 PolarHBondContact O-N 3.44Å; S20-L22 PolarHBondContact O-N 3.21Å
21	V	63.4	Low	59.5	Low	133 Å²	133	128.8 Å²	128.8	81%	0.806	69%	0.689	S	S	*	*			trans	-56.9	110.1	174.2	-177.5	0	0	0	0	108.8	D19	D19-V21 VanDerWaalsContact C-N 3.27Å; D19-V21 PolarHBondContact O-N 2.95Å
22	L	66.6	Low	61.1	Low	105 Å²	105	121.3 Å²	121.3	55%	0.55	67%	0.666	S	S	.	*			trans	-66.7	147.4	175	-63.6	178.2	0	0	0	109.9	S20 T24 I32	S20-L22 PolarHBondContact O-N 3.21Å; L22-T24 PolarHBondContact O-N 3.35Å; L22-I32 HydrophobicContact CB-CG2 4.38Å; L22-I32 HydrophobicContact CD1-CD1 4.3Å
23	P	67.9	Low	62.6	Low	88 Å²	88	118.4 Å²	118.4	57%	0.571	66%	0.66	S	S	*	*			trans	-58.4	122.2	174.4	-22.7	33.7	0	0	0	110.9	F26	P23-F26 HydrophobicContact CB-CZ 4.31Å; P23-F26 WeakPolarHBondContact O-CE2 3.35Å; P23-F26 WeakPolarHBondContact O-CZ 3.47Å
24	T	63.8	Low	64.1	Low	113 Å²	113	107.7 Å²	107.7	69%	0.693	62%	0.621	S	S	*	*			trans	-99.5	-13.3	176.2	49.2	0	0	0	0	113.2	L22	L22-T24 PolarHBondContact O-N 3.35Å
25	N	65.3	Low	65.7	Low	144 Å²	144	106.9 Å²	106.9	77%	0.77	61%	0.609	S	S	*	*			trans	-108.7	105.5	-176.6	-68.3	-40.5	0	0	0	110.6
26	F	76.3	Confident	67.3	Low	48 Å²	48	104.2 Å²	104.2	21%	0.211	59%	0.594	C	S	.	*			trans	-107	123.2	176.1	-61.3	-87.4	0	0	0	110.1	P23 G29 G30 N31 I32 P35	P23-F26 HydrophobicContact CB-CZ 4.31Å; P23-F26 WeakPolarHBondContact O-CE2 3.35Å; P23-F26 WeakPolarHBondContact O-CZ 3.47Å; F26-G29 PolarHBondContact O-N 3.21Å; F26-G30 WeakPolarHBondContact CB-O 3.38Å; F26-G30 WeakPolarHBondContact CD2-O 3.3Å; F26-G30 WeakPolarHBondContact CG-O 3.38Å; F26-N31 VanDerWaalsContact CZ-C 3.45Å; F26-I32 HydrophobicContact CE2-CG2 4.09Å; F26-I32 HydrophobicContact CZ-CB 4.44Å; F26-I32 HydrophobicContact CZ-CG2 3.86Å; F26-P35 HydrophobicContact CD1-CB 3.87Å; F26-P35 HydrophobicContact CE1-CB 3.78Å; F26-P35 HydrophobicContact CE1-CG 4.24Å
27	L	59.9	Low	68.6	Low	153 Å²	153	101.2 Å²	101.2	80%	0.801	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-65.5	142	164.3	-66.7	89.8	0	0	0	107.8	G29	L27-G29 VanDerWaalsContact C-N 3.32Å
28	L	63.3	Low	69.6	Low	142 Å²	142	96.1 Å²	96.1	74%	0.743	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	73.9	9.3	-171.6	-51.7	148.7	0	0	0	115.5	G30 N37	L28-G30 VanDerWaalsContact C-N 3.33Å; L28-G30 PolarHBondContact O-N 3.06Å; L28-N37 PolarHBondContact O-ND2 3.4Å
29	G	68.6	Low	70.3	Confident	57 Å²	57	96.8 Å²	96.8	59%	0.588	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	75.6	18	171	0	0	0	0	0	115.1	F26 L27	F26-G29 PolarHBondContact O-N 3.21Å; L27-G29 VanDerWaalsContact C-N 3.32Å
30	G	76.3	Confident	70.7	Confident	11 Å²	11	90.2 Å²	90.2	11%	0.113	51%	0.511	C	S	.	.			trans	-65.8	-178.8	173.5	0	0	0	0	0	114	F26 L28 D34	F26-G30 WeakPolarHBondContact CB-O 3.38Å; F26-G30 WeakPolarHBondContact CD2-O 3.3Å; F26-G30 WeakPolarHBondContact CG-O 3.38Å; L28-G30 VanDerWaalsContact C-N 3.33Å; L28-G30 PolarHBondContact O-N 3.06Å; G30-D34 CarbonylContact C-O 3.54Å; G30-D34 WeakPolarHBondContact CA-O 3.46Å
31	N	80.6	Confident	71.1	Confident	74 Å²	74	90.4 Å²	90.4	40%	0.396	50%	0.503	S	S	.	.			trans	-137.6	179.2	178.7	68.3	68.9	0	0	0	111.3	F26 F33 D34 P35	F26-N31 VanDerWaalsContact CZ-C 3.45Å; N31-F33 PolarHBondContact O-N 3.06Å; N31-F33 VanDerWaalsContact O-N 3.1Å; N31-F33 WeakPolarHBondContact OD1-CA 3.46Å; N31-F33 PolarHBondContact OD1-N 3.31Å; N31-D34 PolarHBondContact N-O 3.06Å; N31-D34 CarbonylContact O-C 3.59Å; N31-D34 PolarHBondContact O-N 3.04Å; N31-D34 PolarHBondContact OD1-N 2.85Å; N31-D34 VanDerWaalsContact OD1-N 3.09Å; N31-P35 WeakPolarHBondContact O-CA 3.5Å; N31-P35 VanDerWaalsContact O-N 3.13Å
32	I	78.6	Confident	71.3	Confident	86 Å²	86	91.1 Å²	91.1	44%	0.441	50%	0.501	S	S	.	.	S	Bend	trans	-62.2	-18.5	-176.1	59.9	170.4	0	0	0	115	L22 F26	L22-I32 HydrophobicContact CB-CG2 4.38Å; L22-I32 HydrophobicContact CD1-CD1 4.3Å; F26-I32 HydrophobicContact CE2-CG2 4.09Å; F26-I32 HydrophobicContact CZ-CB 4.44Å; F26-I32 HydrophobicContact CZ-CG2 3.86Å
33	F	77.2	Confident	71.4	Confident	181 Å²	181	89.6 Å²	89.6	79%	0.794	49%	0.494	S	S	*	.	S	Bend	trans	-104.3	-20.8	177.2	-57.1	-65	0	0	0	113.3	N31	N31-F33 PolarHBondContact O-N 3.06Å; N31-F33 VanDerWaalsContact O-N 3.1Å; N31-F33 WeakPolarHBondContact OD1-CA 3.46Å; N31-F33 PolarHBondContact OD1-N 3.31Å
34	D	77.5	Confident	71.3	Confident	16 Å²	16	91.6 Å²	91.6	9%	0.086	50%	0.496	C	S	.	.			trans	-134.9	84.5	168.7	-176.8	-3.6	0	0	0	110.4	G30 N31 L36 N37 L38 N39	G30-D34 CarbonylContact C-O 3.54Å; G30-D34 WeakPolarHBondContact CA-O 3.46Å; N31-D34 PolarHBondContact N-O 3.06Å; N31-D34 CarbonylContact O-C 3.59Å; N31-D34 PolarHBondContact O-N 3.04Å; N31-D34 PolarHBondContact OD1-N 2.85Å; N31-D34 VanDerWaalsContact OD1-N 3.09Å; D34-L36 PolarHBondContact O-N 3.43Å; D34-L36 VanDerWaalsContact O-N 3.08Å; D34-L36 PolarHBondContact OD1-N 3.2Å; D34-N37 PolarHBondContact O-N 2.95Å; D34-N37 WeakPolarHBondContact OD1-CA 3.29Å; D34-N37 PolarHBondContact OD1-N 2.98Å; D34-N37 VanDerWaalsContact OD2-C 3.22Å; D34-N37 WeakPolarHBondContact OD2-CA 3.36Å; D34-L38 VanDerWaalsContact CG-N 3.35Å; D34-L38 PolarHBondContact OD1-N 2.78Å; D34-L38 VanDerWaalsContact OD1-N 3.1Å; D34-L38 PolarHBondContact OD2-N 2.87Å; D34-N39 WeakPolarHBondContact OD2-CB 3.39Å; D34-N39 PolarHBondContact OD2-N 2.83Å
35	P	79.6	Confident	71.8	Confident	69 Å²	69	93.5 Å²	93.5	45%	0.448	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.9	-174.1	-26.4	37.4	0	0	0	115.5	F26 N31	F26-P35 HydrophobicContact CD1-CB 3.87Å; F26-P35 HydrophobicContact CE1-CB 3.78Å; F26-P35 HydrophobicContact CE1-CG 4.24Å; N31-P35 WeakPolarHBondContact O-CA 3.5Å; N31-P35 VanDerWaalsContact O-N 3.13Å
36	L	79.6	Confident	71.9	Confident	105 Å²	105	89.6 Å²	89.6	55%	0.55	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	1.4	-176.7	-64.8	178.5	0	0	0	112.8	D34 L38	D34-L36 PolarHBondContact O-N 3.43Å; D34-L36 VanDerWaalsContact O-N 3.08Å; D34-L36 PolarHBondContact OD1-N 3.2Å; L36-L38 HydrophobicContact CB-CD1 4.33Å; L36-L38 HydrophobicContact CB-CD2 4.23Å; L36-L38 HydrophobicContact CB-CG 3.87Å; L36-L38 HydrophobicContact CD1-CD1 4.48Å; L36-L38 PolarHBondContact O-N 2.98Å
37	N	72.6	Confident	71.4	Confident	34 Å²	34	89.7 Å²	89.7	18%	0.182	48%	0.481	C	S	.	.			trans	57	31.5	-178.8	-157.6	15.2	0	0	0	114.3	L28 D34 N39 S40	L28-N37 PolarHBondContact O-ND2 3.4Å; D34-N37 PolarHBondContact O-N 2.95Å; D34-N37 WeakPolarHBondContact OD1-CA 3.29Å; D34-N37 PolarHBondContact OD1-N 2.98Å; D34-N37 VanDerWaalsContact OD2-C 3.22Å; D34-N37 WeakPolarHBondContact OD2-CA 3.36Å; N37-N39 VanDerWaalsContact C-N 3.28Å; N37-N39 PolarHBondContact O-N 3.31Å; N37-S40 WeakPolarHBondContact O-CB 3.39Å; N37-S40 PolarHBondContact O-N 3.25Å; N37-S40 VanDerWaalsContact O-N 3.16Å; N37-S40 PolarHBondContact O-OG 3.25Å; N37-S40 WeakPolarHBondContact OD1-CB 3.41Å; N37-S40 PolarHBondContact OD1-OG 2.71Å
38	L	76.4	Confident	72	Confident	98 Å²	98	89.7 Å²	89.7	51%	0.513	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-67.4	-27	-175.8	-61.5	179.3	0	0	0	113	D34 L36 S40 L41	D34-L38 VanDerWaalsContact CG-N 3.35Å; D34-L38 PolarHBondContact OD1-N 2.78Å; D34-L38 VanDerWaalsContact OD1-N 3.1Å; D34-L38 PolarHBondContact OD2-N 2.87Å; L36-L38 HydrophobicContact CB-CD1 4.33Å; L36-L38 HydrophobicContact CB-CD2 4.23Å; L36-L38 HydrophobicContact CB-CG 3.87Å; L36-L38 HydrophobicContact CD1-CD1 4.48Å; L36-L38 PolarHBondContact O-N 2.98Å; L38-S40 PolarHBondContact O-N 3.15Å; L38-L41 HydrophobicContact CD2-CD1 4.21Å; L38-L41 WeakPolarHBondContact O-CB 3.48Å; L38-L41 PolarHBondContact O-N 2.95Å; L38-L41 VanDerWaalsContact O-N 3.08Å
39	N	68.7	Low	72.3	Confident	109 Å²	109	86.3 Å²	86.3	58%	0.583	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-64.8	-25.1	175.1	-70.7	-26.4	0	0	0	112.3	D34 N37 L41 L42	D34-N39 WeakPolarHBondContact OD2-CB 3.39Å; D34-N39 PolarHBondContact OD2-N 2.83Å; N37-N39 VanDerWaalsContact C-N 3.28Å; N37-N39 PolarHBondContact O-N 3.31Å; N39-L41 PolarHBondContact O-N 2.75Å; N39-L42 WeakPolarHBondContact O-CB 3.23Å; N39-L42 PolarHBondContact O-N 3.38Å; N39-L42 VanDerWaalsContact O-N 3.1Å
40	S	65.4	Low	72.1	Confident	18 Å²	18	88.3 Å²	88.3	13%	0.126	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-67.2	-10.8	173.5	72.3	0	0	0	0	114.1	N37 L38	N37-S40 WeakPolarHBondContact O-CB 3.39Å; N37-S40 PolarHBondContact O-N 3.25Å; N37-S40 VanDerWaalsContact O-N 3.16Å; N37-S40 PolarHBondContact O-OG 3.25Å; N37-S40 WeakPolarHBondContact OD1-CB 3.41Å; N37-S40 PolarHBondContact OD1-OG 2.71Å; L38-S40 PolarHBondContact O-N 3.15Å
41	L	64.9	Low	71.6	Confident	114 Å²	114	93.4 Å²	93.4	60%	0.597	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-86.1	-10.6	173.6	-57	175.8	0	0	0	113.2	L38 N39	L38-L41 HydrophobicContact CD2-CD1 4.21Å; L38-L41 WeakPolarHBondContact O-CB 3.48Å; L38-L41 PolarHBondContact O-N 2.95Å; L38-L41 VanDerWaalsContact O-N 3.08Å; N39-L41 PolarHBondContact O-N 2.75Å
42	L	67.4	Low	71.2	Confident	148 Å²	148	93.8 Å²	93.8	78%	0.775	50%	0.497	S	S	*	.	S	Bend	trans	-87.4	-13.7	177.8	-57.3	176.4	0	0	0	112.8	N39	N39-L42 WeakPolarHBondContact O-CB 3.23Å; N39-L42 PolarHBondContact O-N 3.38Å; N39-L42 VanDerWaalsContact O-N 3.1Å
43	D	70.1	Confident	70.4	Confident	73 Å²	73	96.8 Å²	96.8	39%	0.39	51%	0.509	S	S	.	.			trans	-123.3	107.9	-179.2	-175.5	-38	0	0	0	109.2	E45 V46 N47	D43-E45 PolarHBondContact O-N 2.88Å; D43-E45 WeakPolarHBondContact OD1-CA 3.41Å; D43-E45 WeakPolarHBondContact OD1-CB 3.37Å; D43-E45 PolarHBondContact OD1-N 3.09Å; D43-V46 HydrophobicContact CB-CB 4.11Å; D43-V46 HydrophobicContact CB-CG2 4.1Å; D43-V46 PolarHBondContact OD1-N 2.87Å; D43-N47 VanDerWaalsContact O-CB 3.31Å; D43-N47 WeakPolarHBondContact O-CB 3.27Å; D43-N47 PolarHBondContact O-N 2.95Å
44	E	65.7	Low	69.5	Low	130 Å²	130	93.4 Å²	93.4	61%	0.607	50%	0.504	S	S	*	.	H	α-helix	trans	-65.9	-25.7	-179.2	-66.7	-163.2	171.9	0	0	113.7	R48	E44-R48 WeakPolarHBondContact O-CB 3.08Å; E44-R48 WeakPolarHBondContact O-CG 3.26Å; E44-R48 PolarHBondContact O-N 2.88Å; E44-R48 PolarHBondContact O-NE 2.99Å; E44-R48 IonicContact OE2-CZ 3.83Å; E44-R48 VanDerWaalsContact OE2-CZ 3.26Å; E44-R48 IonicContact OE2-NH1 2.97Å; E44-R48 PolarHBondContact OE2-NH1 3.39Å; E44-R48 IonicContact OE2-NH2 3.85Å; E44-R48 PolarHBondContact OE2-NH2 2.89Å
45	E	73.3	Confident	68.5	Low	153 Å²	153	96.6 Å²	96.6	72%	0.715	53%	0.525	S	S	*	.	H	α-helix	trans	-77.2	-42.8	-177.1	-169.4	161.6	-151.9	0	0	110.1	D43 N47 R48 A49	D43-E45 PolarHBondContact O-N 2.88Å; D43-E45 WeakPolarHBondContact OD1-CA 3.41Å; D43-E45 WeakPolarHBondContact OD1-CB 3.37Å; D43-E45 PolarHBondContact OD1-N 3.09Å; E45-N47 VanDerWaalsContact C-N 3.34Å; E45-N47 PolarHBondContact O-N 2.89Å; E45-R48 PolarHBondContact O-N 2.8Å; E45-A49 WeakPolarHBondContact O-CB 3.44Å; E45-A49 PolarHBondContact O-N 2.7Å
46	V	67.9	Low	67.3	Low	62 Å²	62	102.9 Å²	102.9	38%	0.376	55%	0.546	S	S	.	.	H	α-helix	trans	-61.6	-42	168.9	176.3	0	0	0	0	111.2	D43 A49 L50	D43-V46 HydrophobicContact CB-CB 4.11Å; D43-V46 HydrophobicContact CB-CG2 4.1Å; D43-V46 PolarHBondContact OD1-N 2.87Å; V46-A49 PolarHBondContact O-N 3.26Å; V46-L50 HydrophobicContact CG1-CD1 3.9Å; V46-L50 HydrophobicContact CG1-CG 4.36Å; V46-L50 WeakPolarHBondContact O-CG 3.47Å; V46-L50 PolarHBondContact O-N 3.01Å
47	N	67	Low	65.9	Low	51 Å²	51	103 Å²	103	27%	0.273	56%	0.555	S	S	.	*	H	α-helix	trans	-63	-43.6	177.7	-167.2	-24.9	0	0	0	112.1	D43 E45 N51	D43-N47 VanDerWaalsContact O-CB 3.31Å; D43-N47 WeakPolarHBondContact O-CB 3.27Å; D43-N47 PolarHBondContact O-N 2.95Å; E45-N47 VanDerWaalsContact C-N 3.34Å; E45-N47 PolarHBondContact O-N 2.89Å; N47-N51 PolarHBondContact O-N 3.12Å; N47-N51 PolarHBondContact O-ND2 3.43Å; N47-N51 PolarHBondContact OD1-ND2 2.87Å
48	R	71.6	Confident	64.8	Low	153 Å²	153	103.9 Å²	103.9	58%	0.577	56%	0.564	S	S	*	*	H	α-helix	trans	-60.7	-45.8	171.9	-85.5	-177.2	-80.5	-89.9	1.4	111.7	E44 E45 N51 A52	E44-R48 WeakPolarHBondContact O-CB 3.08Å; E44-R48 WeakPolarHBondContact O-CG 3.26Å; E44-R48 PolarHBondContact O-N 2.88Å; E44-R48 PolarHBondContact O-NE 2.99Å; E44-R48 IonicContact OE2-CZ 3.83Å; E44-R48 VanDerWaalsContact OE2-CZ 3.26Å; E44-R48 IonicContact OE2-NH1 2.97Å; E44-R48 PolarHBondContact OE2-NH1 3.39Å; E44-R48 IonicContact OE2-NH2 3.85Å; E44-R48 PolarHBondContact OE2-NH2 2.89Å; E45-R48 PolarHBondContact O-N 2.8Å; R48-N51 PolarHBondContact O-N 3.31Å; R48-A52 WeakPolarHBondContact O-CB 3.33Å; R48-A52 PolarHBondContact O-N 3.12Å
49	A	70.4	Confident	63.7	Low	71 Å²	71	105.2 Å²	105.2	59%	0.587	58%	0.578	S	S	*	*	H	α-helix	trans	-63.3	-42.7	-179.7	0	0	0	0	0	112.8	E45 V46 A52	E45-A49 WeakPolarHBondContact O-CB 3.44Å; E45-A49 PolarHBondContact O-N 2.7Å; V46-A49 PolarHBondContact O-N 3.26Å; A49-A52 PolarHBondContact O-N 3.3Å
50	L	64.3	Low	63.1	Low	99 Å²	99	107.7 Å²	107.7	52%	0.518	59%	0.591	S	S	.	*	H	α-helix	trans	-70.5	-29.1	179.6	-72	173.7	0	0	0	113.6	V46	V46-L50 HydrophobicContact CG1-CD1 3.9Å; V46-L50 HydrophobicContact CG1-CG 4.36Å; V46-L50 WeakPolarHBondContact O-CG 3.47Å; V46-L50 PolarHBondContact O-N 3.01Å
51	N	64.6	Low	62.6	Low	118 Å²	118	112.2 Å²	112.2	63%	0.631	62%	0.62	S	S	*	*	H	α-helix	trans	-94.9	-1.2	178.2	-71.5	-69.1	0	0	0	114.1	N47 R48 E53	N47-N51 PolarHBondContact O-N 3.12Å; N47-N51 PolarHBondContact O-ND2 3.43Å; N47-N51 PolarHBondContact OD1-ND2 2.87Å; R48-N51 PolarHBondContact O-N 3.31Å; N51-E53 VanDerWaalsContact C-N 3.31Å; N51-E53 PolarHBondContact O-N 3.25Å
52	A	71.9	Confident	62.3	Low	81 Å²	81	110.3 Å²	110.3	67%	0.669	62%	0.616	S	S	*	*	S	Bend	trans	-65.7	-30.8	178.8	0	0	0	0	0	113.3	R48 A49	R48-A52 WeakPolarHBondContact O-CB 3.33Å; R48-A52 PolarHBondContact O-N 3.12Å; A49-A52 PolarHBondContact O-N 3.3Å
53	E	61.8	Low	61.9	Low	149 Å²	149	113.7 Å²	113.7	70%	0.696	62%	0.624	S	S	*	*	S	Bend	trans	-112.7	128.9	172.6	-69.6	-161.5	176	0	0	111.6	N51	N51-E53 VanDerWaalsContact C-N 3.31Å; N51-E53 PolarHBondContact O-N 3.25Å
54	T	58.8	Low	61.3	Low	110 Å²	110	115.3 Å²	115.3	68%	0.675	64%	0.641	S	S	*	*			trans	-67.9	127.6	169.2	-62.7	0	0	0	0	109.7	K56 S58	T54-K56 PolarHBondContact O-N 3.35Å; T54-S58 WeakPolarHBondContact CG2-OG 3.14Å
55	P	57.7	Low	61.1	Low	84 Å²	84	118.9 Å²	118.9	55%	0.545	65%	0.649	S	S	.	*			trans	-61.3	137.8	-176.7	23.1	-33.8	0	0	0	112	S57 S58	P55-S57 PolarHBondContact O-N 3.38Å; P55-S58 WeakPolarHBondContact O-CB 3.43Å; P55-S58 PolarHBondContact O-N 3.01Å; P55-S58 PolarHBondContact O-OG 2.99Å
56	K	54.3	Low	60.7	Low	201 Å²	201	118.5 Å²	118.5	87%	0.874	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-3.9	-174.1	-65.5	175	-178.3	168.4	0	115.1	T54	T54-K56 PolarHBondContact O-N 3.35Å
57	S	48.5	Very low	60.7	Low	106 Å²	106	121.4 Å²	121.4	74%	0.741	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-11.3	171.7	49.1	0	0	0	0	114	P55 P59	P55-S57 PolarHBondContact O-N 3.38Å; S57-P59 WeakPolarHBondContact O-CD 3.3Å
58	S	51.2	Low	60.6	Low	54 Å²	54	124.6 Å²	124.6	38%	0.378	69%	0.693	S	S	.	*	S	Bend	trans	-63.4	120.6	172.9	-71.7	0	0	0	0	110.5	T54 P55 L60	T54-S58 WeakPolarHBondContact CG2-OG 3.14Å; P55-S58 WeakPolarHBondContact O-CB 3.43Å; P55-S58 PolarHBondContact O-N 3.01Å; P55-S58 PolarHBondContact O-OG 2.99Å; S58-L60 PolarHBondContact O-N 2.95Å
59	P	51.9	Low	60.3	Low	125 Å²	125	125.8 Å²	125.8	81%	0.812	71%	0.706	S	S	*	*			trans	-70.8	104.6	-175.5	27.7	-33.9	0	0	0	110.6	S57	S57-P59 WeakPolarHBondContact O-CD 3.3Å
60	L	56.3	Low	60.3	Low	162 Å²	162	129.3 Å²	129.3	85%	0.848	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-54.3	134	177.3	-67.5	174.9	0	0	0	110.7	S58 S62	S58-L60 PolarHBondContact O-N 2.95Å; L60-S62 PolarHBondContact O-N 2.92Å
61	P	55	Low	60.5	Low	113 Å²	113	131.3 Å²	131.3	73%	0.734	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-63.6	125.2	-179.7	25	-32.9	0	0	0	110.6	K63	P61-K63 PolarHBondContact O-N 2.84Å
62	S	59.7	Low	60.8	Low	73 Å²	73	132 Å²	132	51%	0.51	73%	0.726	S	S	.	*	P	Polyproline II helix	trans	-55.7	127	171.2	52.8	0	0	0	0	110	L60 S64	L60-S62 PolarHBondContact O-N 2.92Å; S62-S64 PolarHBondContact O-N 3.41Å
63	K	57.3	Low	60.8	Low	219 Å²	219	130.7 Å²	130.7	95%	0.952	71%	0.71	S	S	*	*	S	Bend	trans	-67.9	30.6	-174	-58.7	-170.9	177.2	-174.3	0	115.5	P61	P61-K63 PolarHBondContact O-N 2.84Å
64	S	57.6	Low	61.1	Low	107 Å²	107	135.4 Å²	135.4	75%	0.748	72%	0.722	S	S	*	*			trans	-155.8	56.4	-176	54.5	0	0	0	0	111.3	S62	S62-S64 PolarHBondContact O-N 3.41Å
65	R	61.6	Low	62	Low	206 Å²	206	133.2 Å²	133.2	78%	0.777	71%	0.706	S	S	*	*			trans	-115	140.6	159.8	-78.4	-170.4	175	-169.5	0.3	108.9
66	D	64.4	Low	62.7	Low	145 Å²	145	136.1 Å²	136.1	78%	0.775	72%	0.715	S	S	*	*			trans	-58.8	152.2	166.9	-46.7	-66.2	0	0	0	109.8	V68	D66-V68 PolarHBondContact O-N 2.91Å
67	P	69.3	Low	63.2	Low	122 Å²	122	132.2 Å²	132.2	79%	0.792	71%	0.708	S	S	*	*			trans	-53.1	132.7	177.5	-26	35.1	0	0	0	111.6	E69	P67-E69 PolarHBondContact O-N 3.03Å; P67-E69 VanDerWaalsContact O-N 3.15Å
68	V	64.8	Low	64.3	Low	119 Å²	119	127.8 Å²	127.8	72%	0.721	68%	0.677	S	S	*	*			trans	-75.2	106.1	172.6	179.6	0	0	0	0	107.4	D66 I70	D66-V68 PolarHBondContact O-N 2.91Å; V68-I70 PolarHBondContact O-N 3.35Å
69	E	65.6	Low	65.2	Low	178 Å²	178	128.6 Å²	128.6	83%	0.832	68%	0.68	S	S	*	*			trans	-59.9	110.5	174.7	-67.5	-178.1	157.2	0	0	110	P67 L71	P67-E69 PolarHBondContact O-N 3.03Å; P67-E69 VanDerWaalsContact O-N 3.15Å; E69-L71 PolarHBondContact O-N 3.45Å
70	I	69.2	Low	66	Low	145 Å²	145	128.3 Å²	128.3	74%	0.744	67%	0.671	S	S	*	*			trans	-82.2	101.9	175.8	-56.9	179.2	0	0	0	107.4	V68 I72	V68-I70 PolarHBondContact O-N 3.35Å; I70-I72 HydrophobicContact CG2-CG1 4.28Å; I70-I72 PolarHBondContact O-N 3.05Å
71	L	68.1	Low	66.3	Low	140 Å²	140	124.4 Å²	124.4	73%	0.733	65%	0.652	S	S	*	*			trans	-69.1	93.8	171.5	-72.4	170.3	0	0	0	109.6	E69 P73	E69-L71 PolarHBondContact O-N 3.45Å; L71-P73 WeakPolarHBondContact O-CD 3.37Å
72	I	72.6	Confident	66.8	Low	134 Å²	134	125.1 Å²	125.1	69%	0.687	65%	0.648	S	S	*	*			trans	-72.1	124.1	170.2	-57.7	176.8	0	0	0	108	I70	I70-I72 HydrophobicContact CG2-CG1 4.28Å; I70-I72 PolarHBondContact O-N 3.05Å
73	P	71.3	Confident	66.8	Low	52 Å²	52	127 Å²	127	34%	0.338	65%	0.652	S	S	.	*			trans	-61.8	152.7	175.6	-24.9	36.6	0	0	0	112.6	L71 D75 P79	L71-P73 WeakPolarHBondContact O-CD 3.37Å; P73-D75 VanDerWaalsContact C-N 3.26Å; P73-D75 WeakPolarHBondContact CB-O 3.49Å; P73-D75 PolarHBondContact O-N 3.26Å; P73-P79 HydrophobicContact CB-CB 4.21Å; P73-P79 HydrophobicContact CG-CB 3.76Å; P73-P79 WeakPolarHBondContact CG-O 3.33Å
74	R	68.8	Low	66.7	Low	248 Å²	248	120 Å²	120	94%	0.936	63%	0.631	S	S	*	*	S	Bend	trans	-66.4	-28.8	-179.7	-67.8	-177.8	178	176.5	-0.4	113.2
75	D	76.2	Confident	66.4	Low	65 Å²	65	117.9 Å²	117.9	35%	0.348	63%	0.626	S	S	.	*			trans	-120.8	125.3	171.1	-174.7	-15.3	0	0	0	108.1	P73 T77 D78	P73-D75 VanDerWaalsContact C-N 3.26Å; P73-D75 WeakPolarHBondContact CB-O 3.49Å; P73-D75 PolarHBondContact O-N 3.26Å; D75-T77 VanDerWaalsContact C-N 3.34Å; D75-T77 WeakPolarHBondContact OD1-CA 3.48Å; D75-T77 WeakPolarHBondContact OD1-CB 3.44Å; D75-T77 PolarHBondContact OD1-N 3.33Å; D75-T77 PolarHBondContact OD1-OG1 3.13Å; D75-T77 PolarHBondContact OD2-OG1 3Å; D75-D78 HydrophobicContact CB-CB 4.29Å; D75-D78 CarbonylContact O-C 3.55Å; D75-D78 VanDerWaalsContact O-C 3.26Å; D75-D78 PolarHBondContact OD1-N 3.03Å
76	I	72.1	Confident	66.1	Low	144 Å²	144	116.7 Å²	116.7	74%	0.738	63%	0.634	S	S	*	*	S	Bend	trans	-79.3	-18	178.2	58.7	171.8	0	0	0	112.8
77	T	66.8	Low	65.2	Low	119 Å²	119	115.6 Å²	115.6	73%	0.73	63%	0.632	S	S	*	*	S	Bend	trans	-87.3	-25	174.9	73.9	0	0	0	0	112	D75 P79	D75-T77 VanDerWaalsContact C-N 3.34Å; D75-T77 WeakPolarHBondContact OD1-CA 3.48Å; D75-T77 WeakPolarHBondContact OD1-CB 3.44Å; D75-T77 PolarHBondContact OD1-N 3.33Å; D75-T77 PolarHBondContact OD1-OG1 3.13Å; D75-T77 PolarHBondContact OD2-OG1 3Å; T77-P79 VanDerWaalsContact C-CD 3.47Å; T77-P79 WeakPolarHBondContact O-CD 3.5Å
78	D	70	Confident	63.8	Low	14 Å²	14	116.8 Å²	116.8	8%	0.075	63%	0.632	C	S	.	*			trans	-123.2	71.9	170.1	-171.1	2.4	0	0	0	111.9	D75 L80 N81 L82 N83	D75-D78 HydrophobicContact CB-CB 4.29Å; D75-D78 CarbonylContact O-C 3.55Å; D75-D78 VanDerWaalsContact O-C 3.26Å; D75-D78 PolarHBondContact OD1-N 3.03Å; D78-L80 PolarHBondContact O-N 3.24Å; D78-N81 PolarHBondContact O-N 2.68Å; D78-N81 WeakPolarHBondContact OD1-CA 3.46Å; D78-N81 PolarHBondContact OD1-N 3.04Å; D78-N81 VanDerWaalsContact OD2-C 3.3Å; D78-N81 WeakPolarHBondContact OD2-CA 3.45Å; D78-L82 VanDerWaalsContact CG-N 3.27Å; D78-L82 PolarHBondContact OD1-N 3.31Å; D78-L82 PolarHBondContact OD2-N 3.46Å; D78-N83 WeakPolarHBondContact CB-ND2 3.19Å; D78-N83 WeakPolarHBondContact OD2-CB 3.21Å; D78-N83 PolarHBondContact OD2-N 3.33Å; D78-N83 PolarHBondContact OD2-ND2 3.32Å
79	P	70.9	Confident	63.2	Low	70 Å²	70	116.4 Å²	116.4	46%	0.455	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	-1.9	-176	28	-36.6	0	0	0	114.5	P73 T77	P73-P79 HydrophobicContact CB-CB 4.21Å; P73-P79 HydrophobicContact CG-CB 3.76Å; P73-P79 WeakPolarHBondContact CG-O 3.33Å; T77-P79 VanDerWaalsContact C-CD 3.47Å; T77-P79 WeakPolarHBondContact O-CD 3.5Å
80	L	68.6	Low	62.3	Low	119 Å²	119	113 Å²	113	62%	0.623	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	-0.2	177.1	-62.4	178	0	0	0	112.9	D78 L82	D78-L80 PolarHBondContact O-N 3.24Å; L80-L82 VanDerWaalsContact C-N 3.29Å; L80-L82 HydrophobicContact CB-CD1 3.8Å; L80-L82 HydrophobicContact CB-CD2 4.43Å; L80-L82 HydrophobicContact CB-CG 3.69Å; L80-L82 HydrophobicContact CD1-CD1 4.04Å; L80-L82 PolarHBondContact O-N 3.44Å
81	N	63	Low	61	Low	81 Å²	81	114.2 Å²	114.2	43%	0.433	63%	0.631	S	S	.	*			trans	54.3	40.2	178.7	-150.7	102.2	0	0	0	113.2	D78 S84	D78-N81 PolarHBondContact O-N 2.68Å; D78-N81 WeakPolarHBondContact OD1-CA 3.46Å; D78-N81 PolarHBondContact OD1-N 3.04Å; D78-N81 VanDerWaalsContact OD2-C 3.3Å; D78-N81 WeakPolarHBondContact OD2-CA 3.45Å; N81-S84 PolarHBondContact ND2-OG 3.14Å; N81-S84 PolarHBondContact O-OG 2.81Å
82	L	64.2	Low	59.7	Low	128 Å²	128	114.4 Å²	114.4	67%	0.67	63%	0.632	S	S	*	*			trans	-87.8	-16.2	-174.3	-63.8	175.3	0	0	0	114.5	D78 L80	D78-L82 VanDerWaalsContact CG-N 3.27Å; D78-L82 PolarHBondContact OD1-N 3.31Å; D78-L82 PolarHBondContact OD2-N 3.46Å; L80-L82 VanDerWaalsContact C-N 3.29Å; L80-L82 HydrophobicContact CB-CD1 3.8Å; L80-L82 HydrophobicContact CB-CD2 4.43Å; L80-L82 HydrophobicContact CB-CG 3.69Å; L80-L82 HydrophobicContact CD1-CD1 4.04Å; L80-L82 PolarHBondContact O-N 3.44Å
83	N	59.6	Low	58	Low	111 Å²	111	112.5 Å²	112.5	59%	0.594	63%	0.626	S	S	*	*	S	Bend	trans	-84.1	-12.2	179.2	-63.9	-65.5	0	0	0	113.2	D78 G85	D78-N83 WeakPolarHBondContact CB-ND2 3.19Å; D78-N83 WeakPolarHBondContact OD2-CB 3.21Å; D78-N83 PolarHBondContact OD2-N 3.33Å; D78-N83 PolarHBondContact OD2-ND2 3.32Å; N83-G85 PolarHBondContact O-N 3.16Å
84	S	57.2	Low	56.4	Low	72 Å²	72	115.1 Å²	115.1	50%	0.503	65%	0.646	S	S	.	*	S	Bend	trans	-74.1	119.5	177.9	58.9	0	0	0	0	111.6	N81	N81-S84 PolarHBondContact ND2-OG 3.14Å; N81-S84 PolarHBondContact O-OG 2.81Å
85	G	50.1	Low	54.8	Low	63 Å²	63	108.9 Å²	108.9	65%	0.649	64%	0.637	S	S	*	*			trans	-59.3	156.5	171	0	0	0	0	0	112.8	N83 T87	N83-G85 PolarHBondContact O-N 3.16Å; G85-T87 PolarHBondContact O-N 3.23Å
86	I	55.3	Low	52.9	Low	181 Å²	181	114.9 Å²	114.9	93%	0.928	66%	0.657	S	S	*	*	S	Bend	trans	-71.7	97.4	-165.8	-56.7	169.7	0	0	0	112.5
87	T	45.7	Very low	51.3	Low	122 Å²	122	117.9 Å²	117.9	75%	0.748	66%	0.664	S	S	*	*	S	Bend	trans	-143.8	152.5	147	44.2	0	0	0	0	108.9	G85	G85-T87 PolarHBondContact O-N 3.23Å
88	D	40.5	Very low	50.1	Low	147 Å²	147	117.7 Å²	117.7	79%	0.786	67%	0.668	S	S	*	*			trans	59	81.5	176.8	-63.2	-10.5	0	0	0	117.5	S90	D88-S90 VanDerWaalsContact C-N 3.31Å; D88-S90 PolarHBondContact O-N 2.62Å
89	S	50.8	Low	48.4	Very low	112 Å²	112	119.8 Å²	119.8	78%	0.783	69%	0.693	S	S	*	*			trans	-70.5	75	174	61.9	0	0	0	0	113.6
90	S	46.6	Very low	46.8	Very low	106 Å²	106	120.2 Å²	120.2	74%	0.741	71%	0.709	S	S	*	*			trans	-112.5	51.8	170.8	56.6	0	0	0	0	112.3	D88	D88-S90 VanDerWaalsContact C-N 3.31Å; D88-S90 PolarHBondContact O-N 2.62Å
91	F	42.5	Very low	45.5	Very low	170 Å²	170	125.9 Å²	125.9	75%	0.746	72%	0.723	S	S	*	*			trans	-56.2	145.2	177.6	-76	-76.8	0	0	0	113	V93	F91-V93 PolarHBondContact O-N 3.44Å
92	L	41.8	Very low	44.3	Very low	145 Å²	145	132 Å²	132	76%	0.759	75%	0.745	S	S	*	*			trans	-47.3	109.4	-172.5	-65.6	172	0	0	0	112.9	S94	L92-S94 PolarHBondContact O-N 3.11Å
93	V	36.9	Very low	43	Very low	94 Å²	94	137.3 Å²	137.3	57%	0.57	76%	0.757	S	S	*	*			trans	-65.8	105.1	177.1	171.8	0	0	0	0	109.3	F91 Y96	F91-V93 PolarHBondContact O-N 3.44Å; V93-Y96 HydrophobicContact CG1-CD2 3.48Å; V93-Y96 VanDerWaalsContact CG1-CD2 3.48Å; V93-Y96 HydrophobicContact CG1-CE2 3.58Å; V93-Y96 HydrophobicContact CG2-CE2 4.48Å
94	S	37.3	Very low	41.9	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	76%	0.764	S	S	*	*			trans	-56.1	125.6	159.6	-69	0	0	0	0	107.9	L92 Y96	L92-S94 PolarHBondContact O-N 3.11Å; S94-Y96 PolarHBondContact O-N 3.21Å; S94-Y96 VanDerWaalsContact O-N 3.08Å
95	P	35	Very low	41.2	Very low	116 Å²	116	147.4 Å²	147.4	75%	0.753	78%	0.782	S	S	*	*			trans	-58	117.7	-162.5	17.8	-31.4	0	0	0	112.1	K97	P95-K97 PolarHBondContact O-N 3.06Å
96	Y	36.8	Very low	40.6	Very low	192 Å²	192	150 Å²	150	75%	0.753	78%	0.781	S	S	*	*			trans	-56.5	112.8	178.3	-80.5	-84.6	0	0	0	109.8	V93 S94 S98	V93-Y96 HydrophobicContact CG1-CD2 3.48Å; V93-Y96 VanDerWaalsContact CG1-CD2 3.48Å; V93-Y96 HydrophobicContact CG1-CE2 3.58Å; V93-Y96 HydrophobicContact CG2-CE2 4.48Å; S94-Y96 PolarHBondContact O-N 3.21Å; S94-Y96 VanDerWaalsContact O-N 3.08Å; Y96-S98 PolarHBondContact O-N 3.15Å
97	K	38.3	Very low	39.8	Very low	206 Å²	206	152.6 Å²	152.6	90%	0.896	78%	0.779	S	S	*	*			trans	-75.8	62.4	166.8	-72.5	-168.6	174.6	-178.1	0	111	P95 G99	P95-K97 PolarHBondContact O-N 3.06Å; K97-G99 VanDerWaalsContact C-N 3.3Å; K97-G99 PolarHBondContact O-N 3.38Å
98	S	40	Very low	39.2	Very low	116 Å²	116	153.8 Å²	153.8	81%	0.811	78%	0.776	S	S	*	*			trans	-58.9	92.7	161	-69	0	0	0	0	108.4	Y96	Y96-S98 PolarHBondContact O-N 3.15Å
99	G	36	Very low	39	Very low	58 Å²	58	156 Å²	156	60%	0.598	78%	0.781	S	S	*	*			trans	165.1	38.6	-166.8	0	0	0	0	0	113.7	K97 R101	K97-G99 VanDerWaalsContact C-N 3.3Å; K97-G99 PolarHBondContact O-N 3.38Å; G99-R101 PolarHBondContact O-N 2.73Å
100	G	37.3	Very low	38	Very low	78 Å²	78	154.3 Å²	154.3	80%	0.804	78%	0.781	S	S	*	*			trans	-66.2	78.6	174.9	0	0	0	0	0	111.9	K102	G100-K102 PolarHBondContact O-N 3.15Å
101	R	39.8	Very low	37.2	Very low	239 Å²	239	153.4 Å²	153.4	90%	0.902	79%	0.789	S	S	*	*			trans	-54.2	105.5	176.2	-75.1	-174	175.2	-177.3	-0.8	109.4	G99 R103	G99-R101 PolarHBondContact O-N 2.73Å; R101-R103 PolarHBondContact O-N 3.41Å
102	K	38.5	Very low	36.6	Very low	208 Å²	208	149.5 Å²	149.5	90%	0.904	80%	0.796	S	S	*	*			trans	-52.1	108	173.6	-83.6	-179.6	175.3	173.1	0	108.8	G100 H104	G100-K102 PolarHBondContact O-N 3.15Å; K102-H104 PolarHBondContact O-N 3.25Å
103	R	37.4	Very low	36.1	Very low	241 Å²	241	147.8 Å²	147.8	91%	0.909	80%	0.804	S	S	*	*			trans	-69.1	95.8	169.8	-81.1	-173.2	169.3	-169.5	-4.6	108.4	R101 R105	R101-R103 PolarHBondContact O-N 3.41Å; R103-R105 PolarHBondContact O-N 2.98Å
104	H	36.3	Very low	35.8	Very low	164 Å²	164	147.3 Å²	147.3	76%	0.759	82%	0.818	S	S	*	*			trans	-57.7	118	175.2	-161.8	-103.3	0	0	0	109.2	K102 N106	K102-H104 PolarHBondContact O-N 3.25Å; H104-N106 PolarHBondContact O-N 3.05Å
105	R	42.6	Very low	35.4	Very low	230 Å²	230	146 Å²	146	87%	0.868	82%	0.821	S	S	*	*			trans	-83.4	110.3	171.1	-90.7	-178.8	163	170.5	-4.8	107.6	R103 R107	R103-R105 PolarHBondContact O-N 2.98Å; R105-R107 PolarHBondContact O-N 2.81Å
106	N	36.2	Very low	35.2	Very low	119 Å²	119	145.4 Å²	145.4	64%	0.636	83%	0.826	S	S	*	*			trans	-60	111.1	169.6	-74.1	14.9	0	0	0	109.5	H104	H104-N106 PolarHBondContact O-N 3.05Å
107	R	38.8	Very low	35	Very low	234 Å²	234	142 Å²	142	88%	0.883	83%	0.83	S	S	*	*			trans	-82.8	125.2	152.2	-85.2	179	160.4	170	-7.5	106.9	R105	R105-R107 PolarHBondContact O-N 2.81Å
108	H	33	Very low	34.6	Very low	147 Å²	147	135.3 Å²	135.3	68%	0.681	82%	0.819	S	S	*	*			trans	-99.6	155.6	157.7	-77.9	-89.9	0	0	0	108.9
109	H	36.9	Very low	34.2	Very low	193 Å²	193	136.9 Å²	136.9	89%	0.894	82%	0.817	S	S	*	*			trans	68.3	128.7	-167.8	-43.2	-62.5	0	0	0	114.4
110	G	30.3	Very low	33.9	Very low	77 Å²	77	139.1 Å²	139.1	79%	0.794	82%	0.824	S	S	*	*			cis	163	140.7	-11.4	0	0	0	0	0	113.7
111	G	29.9	Very low	33.5	Very low	87 Å²	87	141.3 Å²	141.3	90%	0.897	82%	0.822	S	S	*	*			trans	88	156.4	172.3	0	0	0	0	0	115.7
112	G	29	Very low	33	Very low	88 Å²	88	135.8 Å²	135.8	91%	0.907	81%	0.814	S	S	*	*			trans	105.7	113.3	176.2	0	0	0	0	0	113.8
113	A	31.5	Very low	32.6	Very low	110 Å²	110	133.4 Å²	133.4	91%	0.909	81%	0.807	S	S	*	*			trans	-101.8	161.4	-173	0	0	0	0	0	114.1
114	G	30.1	Very low	32.1	Very low	84 Å²	84	129.1 Å²	129.1	87%	0.866	80%	0.799	S	S	*	*			trans	109.1	145.8	151.4	0	0	0	0	0	117.8
115	G	30.1	Very low	31.6	Very low	80 Å²	80	128.3 Å²	128.3	83%	0.825	80%	0.8	S	S	*	*			trans	116.1	61.1	151.1	0	0	0	0	0	120.6
116	A	31.4	Very low	31.8	Very low	102 Å²	102	122.2 Å²	122.2	84%	0.843	79%	0.79	S	S	*	*			trans	29.4	128.5	138.4	0	0	0	0	0	124.5
117	S	31.5	Very low	31.5	Very low	121 Å²	121	123.5 Å²	123.5	85%	0.846	80%	0.796	S	S	*	*			trans	84.9	155.8	130.7	-147.6	0	0	0	0	123.1
118	G	30.1	Very low	30.9	Very low	65 Å²	65	119.8 Å²	119.8	67%	0.67	79%	0.789	S	S	*	*			trans	79.9	106.5	173.4	0	0	0	0	0	115.6
119	I	31.9	Very low	30.7	Very low	150 Å²	150	117.4 Å²	117.4	77%	0.769	79%	0.785	S	S	*	*			cis	84.3	106.6	24.1	-50.7	174.4	0	0	0	115.3
120	S	29.8	Very low	30.2	Very low	105 Å²	105	114.9 Å²	114.9	73%	0.734	77%	0.774	S	S	*	*			trans	63.9	159.2	155	-71.5	0	0	0	0	119.6
121	T	29.5	Very low	30.2	Very low	124 Å²	124	118.3 Å²	118.3	76%	0.761	77%	0.766	S	S	*	*			cis	-150.8	159.2	-19.6	8.4	0	0	0	0	112
122	T	28.8	Very low	30.1	Very low	122 Å²	122	119 Å²	119	75%	0.748	76%	0.758	S	S	*	*			trans	-33.3	141.4	156.4	-26	0	0	0	0	116.4
123	Q	29.3	Very low	30.1	Very low	159 Å²	159	122 Å²	122	74%	0.743	75%	0.753	S	S	*	*				172.4	153.4	109	-90.4	-157	42.3	0	0	117.1
124	M	28.4	Very low	30	Very low	150 Å²	150	125 Å²	125	74%	0.739	75%	0.75	S	S	*	*			trans	19.9	126.9	156.8	-42.4	-52.3	-174.5	0	0	123.7
125	N	24.2	Very low	30	Very low	148 Å²	148	131 Å²	131	79%	0.791	75%	0.753	S	S	*	*				9.3	163.8	108.2	-84.4	21.8	0	0	0	120.6
126	P	47.2	Very low	29.9	Very low	101 Å²	101	131.1 Å²	131.1	66%	0.656	75%	0.745	S	S	*	*			cis	-145.3	-171.8	-21.9	37.2	-16	0	0	0	115.9
127	L	29.2	Very low	29.8	Very low	146 Å²	146	133.4 Å²	133.4	76%	0.764	74%	0.744	S	S	*	*			trans	82.7	167.9	142.7	-120.6	78.4	0	0	0	122.1
128	E	28	Very low	29.7	Very low	157 Å²	157	133.6 Å²	133.6	73%	0.734	74%	0.74	S	S	*	*			trans	73.7	161.9	170.9	-59.3	-65.6	129	0	0	120.6
129	T	28.4	Very low	29.8	Very low	96 Å²	96	135.1 Å²	135.1	59%	0.589	74%	0.74	S	S	*	*				-156.3	171.6	-73.5	-58.1	0	0	0	0	107.9
130	E	26.6	Very low	29.8	Very low	141 Å²	141	133 Å²	133	66%	0.659	73%	0.734	S	S	*	*			trans	73.1	158.7	160	-57.6	-147.5	155.8	0	0	117.6
131	K	30.5	Very low	29.8	Very low	148 Å²	148	136.6 Å²	136.6	64%	0.643	74%	0.739	S	S	*	*			cis	-166.4	168.8	-23	-109.2	-176.7	-166.7	139.3	0	107.9
132	S	27.9	Very low	29.8	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	74%	0.736	S	S	*	*			trans	63.6	155.2	144.3	62.7	0	0	0	0	119.3
133	D	27.1	Very low	29.9	Very low	152 Å²	152	134.1 Å²	134.1	81%	0.813	74%	0.744	S	S	*	*			cis	-151.6	179.6	-12.5	-130.8	-56.6	0	0	0	112.6
134	M	29.9	Very low	29.7	Very low	172 Å²	172	129.8 Å²	129.8	85%	0.847	74%	0.742	S	S	*	*			trans	-79.2	154.8	173.5	-54	-167.9	-179.2	0	0	113.7
135	K	29.7	Very low	29.8	Very low	211 Å²	211	131.2 Å²	131.2	92%	0.917	75%	0.749	S	S	*	*				-169.9	168.7	108	-134.9	164.7	-179.7	170.6	0	113.1
136	A	29.5	Very low	30.6	Very low	81 Å²	81	130.2 Å²	130.2	67%	0.669	75%	0.75	S	S	*	*			trans	-119.5	168.9	178.6	0	0	0	0	0	112.2
137	N	27.9	Very low	29.6	Very low	151 Å²	151	128.3 Å²	128.3	81%	0.807	75%	0.749	S	S	*	*			trans	-161.8	138.6	133.4	-87.4	-24.6	0	0	0	108.3
138	T	30.3	Very low	29.5	Very low	125 Å²	125	126.8 Å²	126.8	77%	0.767	75%	0.751	S	S	*	*				58.2	135.5	70.2	-5.3	0	0	0	0	112.7
139	S	32.4	Very low	29.4	Very low	97 Å²	97	123.7 Å²	123.7	68%	0.678	75%	0.746	S	S	*	*			cis	-151.4	-169.1	12.6	63.2	0	0	0	0	110.7
140	T	32	Very low	29.4	Very low	104 Å²	104	128.6 Å²	128.6	64%	0.638	76%	0.76	S	S	*	*			cis	-161.9	154.1	3.7	-9.1	0	0	0	0	110
141	E	29.4	Very low	29.5	Very low	182 Å²	182	125.7 Å²	125.7	85%	0.85	76%	0.76	S	S	*	*			trans	37.4	158.8	131.2	-74.9	175.2	-175.5	0	0	125
142	A	30	Very low	29.4	Very low	83 Å²	83	127.3 Å²	127.3	69%	0.686	77%	0.77	S	S	*	*			cis	-164	153.7	-9.1	0	0	0	0	0	114.9
143	A	29.9	Very low	29.4	Very low	110 Å²	110	128.5 Å²	128.5	91%	0.909	77%	0.768	S	S	*	*			trans	48.9	143.2	138.6	0	0	0	0	0	124.6
144	G	24.9	Very low	29.5	Very low	68 Å²	68	126.4 Å²	126.4	70%	0.701	76%	0.761	S	S	*	*			trans	167.1	99.8	164.6	0	0	0	0	0	116.1
145	M	30	Very low	29.7	Very low	181 Å²	181	122.7 Å²	122.7	89%	0.892	75%	0.752	S	S	*	*			trans	-136.3	168.5	165.3	-76.6	-76.9	103.8	0	0	106.9
146	P	41.6	Very low	29.9	Very low	126 Å²	126	121.9 Å²	121.9	82%	0.818	75%	0.748	S	S	*	*			cis	-137.2	-160.6	11	43.8	-25.3	0	0	0	114.1
147	G	25.5	Very low	29.8	Very low	62 Å²	62	125.2 Å²	125.2	64%	0.639	75%	0.75	S	S	*	*			trans	124.1	86.8	134.8	0	0	0	0	0	121.9
148	S	28.7	Very low	30	Very low	113 Å²	113	125.4 Å²	125.4	79%	0.79	75%	0.75	S	S	*	*			trans	52.3	126.9	133.4	61.4	0	0	0	0	125.2
149	S	25.5	Very low	30.1	Very low	92 Å²	92	124.3 Å²	124.3	64%	0.643	74%	0.74	S	S	*	*				91.9	150	123.7	71.3	0	0	0	0	123.5
150	F	27.4	Very low	30.1	Very low	200 Å²	200	124.4 Å²	124.4	88%	0.877	74%	0.74	S	S	*	*			trans	65.1	148.8	174.5	-58.9	-87.5	0	0	0	117.6
151	A	28.4	Very low	30.1	Very low	79 Å²	79	126.4 Å²	126.4	65%	0.653	75%	0.746	S	S	*	*			cis	-163.5	174.3	-25.8	0	0	0	0	0	111.2
152	Q	30	Very low	30	Very low	182 Å²	182	123 Å²	123	85%	0.85	74%	0.742	S	S	*	*			trans	-13.7	150.5	161.4	-74.1	168.5	-64.4	0	0	118.2
153	D	27.7	Very low	30	Very low	128 Å²	128	124.7 Å²	124.7	68%	0.684	75%	0.745	S	S	*	*				-159.3	169.1	75.1	-157.1	32.2	0	0	0	118.9
154	T	29.6	Very low	30	Very low	108 Å²	108	126.3 Å²	126.3	66%	0.663	74%	0.743	S	S	*	*			trans	1.5	158.1	160.3	58.5	0	0	0	0	121.6
155	S	33.2	Very low	30.3	Very low	93 Å²	93	128 Å²	128	65%	0.65	75%	0.75	S	S	*	*			cis	-172.8	-175.8	-11.6	52.6	0	0	0	0	107.9
156	K	33.5	Very low	30.2	Very low	194 Å²	194	122.8 Å²	122.8	84%	0.843	74%	0.743	S	S	*	*			cis	-146.6	170.7	13.8	-60.3	179.3	178.4	178.9	0	110.8
157	E	28.8	Very low	29.6	Very low	151 Å²	151	124.5 Å²	124.5	71%	0.706	75%	0.745	S	S	*	*			trans	-85.6	169.1	159	-60.7	170.4	71.6	0	0	112.9	N159	E157-N159 PolarHBondContact OE1-ND2 3.3Å
158	L	32.2	Very low	29.9	Very low	155 Å²	155	126 Å²	126	81%	0.812	75%	0.746	S	S	*	*				-171.7	126	104.7	-81.8	-178.3	0	0	0	106.8
159	N	31.6	Very low	30.1	Very low	103 Å²	103	128.6 Å²	128.6	55%	0.551	75%	0.745	S	S	*	*				67.5	139.6	71.3	-69.3	-36.8	0	0	0	113.2	E157	E157-N159 PolarHBondContact OE1-ND2 3.3Å
160	S	32.1	Very low	30.4	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	74%	0.743	S	S	*	*			cis	-152.5	145	15.8	-102.5	0	0	0	0	110.5
161	L	32	Very low	30.6	Very low	145 Å²	145	127.9 Å²	127.9	76%	0.759	74%	0.738	S	S	*	*				74.7	114.1	74.4	-75	172.2	0	0	0	118.1
162	S	26.8	Very low	30.7	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	74%	0.744	S	S	*	*			trans	174.1	133.6	142.5	56.4	0	0	0	0	108.4
163	T	29.9	Very low	30.7	Very low	120 Å²	120	125.5 Å²	125.5	74%	0.736	74%	0.743	S	S	*	*			cis	71.9	128.6	24.8	-23	0	0	0	0	111
164	V	30.9	Very low	30.8	Very low	144 Å²	144	127.1 Å²	127.1	87%	0.873	75%	0.751	S	S	*	*				-149.3	179	55.9	174	0	0	0	0	111.5
165	A	31.1	Very low	30.7	Very low	103 Å²	103	128 Å²	128	85%	0.851	76%	0.762	S	S	*	*			trans	-107.1	-177.5	-168	0	0	0	0	0	116.4
166	G	28.2	Very low	30.6	Very low	72 Å²	72	129.2 Å²	129.2	74%	0.742	77%	0.77	S	S	*	*			trans	141.5	121	175.5	0	0	0	0	0	109.7
167	D	28.7	Very low	30.4	Very low	162 Å²	162	125.8 Å²	125.8	87%	0.866	77%	0.77	S	S	*	*			cis	111.5	156.7	21.4	-168.2	34.1	0	0	0	112.6
168	S	32.3	Very low	30.5	Very low	93 Å²	93	124.2 Å²	124.2	65%	0.65	78%	0.776	S	S	*	*			trans	88	114.6	180	73.2	0	0	0	0	119.8
169	H	33.3	Very low	30.3	Very low	168 Å²	168	122.8 Å²	122.8	78%	0.778	78%	0.778	S	S	*	*				43.8	148.2	122.6	-78.9	-105.4	0	0	0	121.1
170	D	31.8	Very low	30.4	Very low	112 Å²	112	126.6 Å²	126.6	60%	0.599	79%	0.79	S	S	*	*			cis	-162.4	-179.3	12	-142.3	-42.9	0	0	0	114.3
171	H	31	Very low	30.2	Very low	164 Å²	164	129.4 Å²	129.4	76%	0.759	80%	0.797	S	S	*	*			trans	88.8	97.8	147	-67.8	-3.1	0	0	0	122.4
172	S	31.2	Very low	30.1	Very low	112 Å²	112	129.5 Å²	129.5	78%	0.783	80%	0.798	S	S	*	*			trans	-30.9	148.3	146.9	179.2	0	0	0	0	118.8
173	A	29.5	Very low	30.3	Very low	100 Å²	100	130.3 Å²	130.3	83%	0.826	80%	0.798	S	S	*	*			trans	-156.1	142.3	136.4	0	0	0	0	0	112.7
174	N	28.7	Very low	30.2	Very low	162 Å²	162	130.7 Å²	130.7	87%	0.866	80%	0.801	S	S	*	*			trans	-92.3	149.1	169.7	-74.7	-47.9	0	0	0	111.2
175	S	28.9	Very low	30.2	Very low	126 Å²	126	129.7 Å²	129.7	88%	0.881	80%	0.8	S	S	*	*			trans	-158.2	129.7	138.2	61	0	0	0	0	112.9
176	S	30.5	Very low	30.1	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	80%	0.796	S	S	*	*			trans	-103.5	142.5	169.9	56.3	0	0	0	0	110.2
177	S	30.2	Very low	31.1	Very low	121 Å²	121	131.7 Å²	131.7	85%	0.846	80%	0.799	S	S	*	*			trans	-149.1	134	154	60	0	0	0	0	111.9
178	S	29	Very low	31.1	Very low	118 Å²	118	128 Å²	128	83%	0.825	79%	0.791	S	S	*	*			trans	-107	140.4	169.6	59.1	0	0	0	0	109.4
179	C	28.7	Very low	31.2	Very low	125 Å²	125	131.9 Å²	131.9	85%	0.845	80%	0.799	S	S	*	*			trans	-141.3	119.7	159.1	43.6	0	0	0	0	110.9
180	K	33	Very low	31.1	Very low	184 Å²	184	132.1 Å²	132.1	80%	0.8	80%	0.8	S	S	*	*			trans	-82.1	159.9	152.6	-61.7	175.5	178.8	178	0	107.7
181	N	29.7	Very low	31.2	Very low	157 Å²	157	130.1 Å²	130.1	84%	0.84	80%	0.799	S	S	*	*				-179.7	160.2	117.7	-86.3	-10.5	0	0	0	110.6
182	D	29.7	Very low	31	Very low	147 Å²	147	128.7 Å²	128.7	79%	0.786	80%	0.802	S	S	*	*			trans	-104.2	-173.8	-168.3	-65.7	-84	0	0	0	113.6
183	V	31	Very low	32.3	Very low	127 Å²	127	128.4 Å²	128.4	77%	0.77	80%	0.798	S	S	*	*			trans	91.9	89.7	156.4	-164.6	0	0	0	0	118.7
184	T	28.1	Very low	32.3	Very low	129 Å²	129	131.8 Å²	131.8	79%	0.791	80%	0.8	S	S	*	*				42.1	121.6	117	-47.6	0	0	0	0	121.3
185	S	29.9	Very low	32.5	Very low	122 Å²	122	129 Å²	129	85%	0.853	79%	0.793	S	S	*	*				-170	156.6	124.9	29.2	0	0	0	0	114.2
186	A	28.3	Very low	32.7	Very low	94 Å²	94	128.7 Å²	128.7	78%	0.777	79%	0.791	S	S	*	*			trans	-135.4	-174.2	170.5	0	0	0	0	0	106.6
187	P	49	Very low	32.8	Very low	123 Å²	123	128 Å²	128	80%	0.799	79%	0.792	S	S	*	*			cis	-148.5	-154.2	25.1	44.9	-21.7	0	0	0	116.2
188	A	29.3	Very low	32.9	Very low	84 Å²	84	125.2 Å²	125.2	69%	0.694	78%	0.783	S	S	*	*			trans	80.6	132.4	171.8	0	0	0	0	0	116.8
189	E	34.8	Very low	33.2	Very low	175 Å²	175	125.4 Å²	125.4	82%	0.818	78%	0.779	S	S	*	*			cis	76.1	136.5	30.9	-51	-71.4	-177.6	0	0	113.3
190	E	31.9	Very low	33.7	Very low	174 Å²	174	125.4 Å²	125.4	81%	0.813	77%	0.771	S	S	*	*			cis	-157.2	170.6	9.9	-149.4	-169.3	152.4	0	0	112.9
191	A	32.2	Very low	34.1	Very low	70 Å²	70	123.4 Å²	123.4	58%	0.579	76%	0.764	S	S	*	*			trans	60.3	101.9	146.9	0	0	0	0	0	125.3
192	T	28.7	Very low	34.5	Very low	133 Å²	133	123.8 Å²	123.8	82%	0.816	76%	0.761	S	S	*	*				26.5	170.5	110.6	61.9	0	0	0	0	123.6
193	P	57.7	Low	34.6	Very low	107 Å²	107	120.9 Å²	120.9	70%	0.695	76%	0.757	S	S	*	*			cis	-141	-170.3	-40	40	-21.8	0	0	0	113.5
194	I	29.6	Very low	34.9	Very low	170 Å²	170	120.1 Å²	120.1	87%	0.872	76%	0.757	S	S	*	*			trans	176.5	169.6	134.4	-93.4	162.7	0	0	0	112.8
195	S	33	Very low	35.3	Very low	103 Å²	103	125.4 Å²	125.4	72%	0.72	76%	0.762	S	S	*	*			trans	-126.9	169.5	-158.8	61.6	0	0	0	0	116.5
196	S	32.1	Very low	35.5	Very low	120 Å²	120	130 Å²	130	84%	0.839	76%	0.761	S	S	*	*			trans	163.2	155.2	141.8	44.8	0	0	0	0	110.7
197	A	33	Very low	35.8	Very low	104 Å²	104	134.8 Å²	134.8	86%	0.86	77%	0.765	S	S	*	*			cis	-155.3	179.1	-12.3	0	0	0	0	0	107.5
198	G	31.7	Very low	34.8	Very low	63 Å²	63	141 Å²	141	65%	0.649	77%	0.772	S	S	*	*			cis	-143.1	-112.4	0.1	0	0	0	0	0	109.2
199	T	36.6	Very low	35	Very low	123 Å²	123	147.2 Å²	147.2	76%	0.755	78%	0.777	S	S	*	*			cis	172.3	143.7	-29.9	27.2	0	0	0	0	105.6
200	N	37.7	Very low	35	Very low	125 Å²	125	149.8 Å²	149.8	67%	0.668	78%	0.78	S	S	*	*			cis	-159.8	165.6	-10.8	-94.1	-13.6	0	0	0	105.5
201	H	42.3	Very low	35	Very low	142 Å²	142	147.4 Å²	147.4	66%	0.657	77%	0.772	S	S	*	*			cis	-160.3	-170.4	-1	-110.6	9.2	0	0	0	105.1
202	H	37.2	Very low	35.1	Very low	165 Å²	165	149.7 Å²	149.7	76%	0.764	79%	0.785	S	S	*	*			cis	-158.5	-173.2	2.7	-133	26.7	0	0	0	105.6
203	A	32.2	Very low	35.1	Very low	85 Å²	85	147.2 Å²	147.2	70%	0.702	79%	0.785	S	S	*	*			cis	-156.2	-170	-4.2	0	0	0	0	0	108.3
204	S	37.2	Very low	33.9	Very low	111 Å²	111	151.5 Å²	151.5	78%	0.776	79%	0.793	S	S	*	*			trans	-162.9	154.8	-178.2	172.4	0	0	0	0	114.2
205	R	35.9	Very low	33.9	Very low	240 Å²	240	151.5 Å²	151.5	91%	0.906	79%	0.792	S	S	*	*			trans	175.1	164.4	155.5	-96.7	152.7	-174	-144.2	4.6	112.4
206	R	34.8	Very low	33.6	Very low	220 Å²	220	155 Å²	155	83%	0.83	80%	0.797	S	S	*	*			cis	-174.3	126.9	-41.8	-161.3	-178	-163.3	-163.1	7.3	112.5
207	K	34.3	Very low	34.7	Very low	194 Å²	194	154.5 Å²	154.5	84%	0.843	79%	0.79	S	S	*	*			trans	36.3	135.8	156.6	-75.4	-173.4	172.8	-179.7	0	123.6
208	R	29.4	Very low	34.9	Very low	252 Å²	252	154.9 Å²	154.9	95%	0.951	78%	0.784	S	S	*	*				-151.5	-168	121.3	-130.6	175.5	-179.5	177.6	-0.2	114.4
209	R	32.9	Very low	35.1	Very low	215 Å²	215	158.2 Å²	158.2	81%	0.811	79%	0.791	S	S	*	*			trans	-164.1	142.1	-141.5	170	-165.7	-179.6	-164.8	4.7	115.5
210	R	35.3	Very low	34.7	Very low	229 Å²	229	158.8 Å²	158.8	86%	0.864	80%	0.795	S	S	*	*			trans	-178.6	130.5	145.5	-102	167	178.1	179.2	-1.8	109.6
211	N	32.2	Very low	34.3	Very low	124 Å²	124	161.4 Å²	161.4	66%	0.663	80%	0.803	S	S	*	*				70.5	141	84.1	-71.2	50.3	0	0	0	114
212	S	33	Very low	33.7	Very low	119 Å²	119	160.4 Å²	160.4	83%	0.832	81%	0.812	S	S	*	*			cis	-172.6	154.8	-6.1	41.4	0	0	0	0	111.5
213	G	28.9	Very low	33.5	Very low	81 Å²	81	159.2 Å²	159.2	84%	0.835	82%	0.816	S	S	*	*			trans	-171.7	165.2	175.6	0	0	0	0	0	112.8
214	K	32.5	Very low	33.6	Very low	197 Å²	197	160.5 Å²	160.5	86%	0.857	82%	0.817	S	S	*	*			trans	-154.4	153.7	-166.3	-143	-170	-178.1	-171.1	0	115
215	M	28.9	Very low	33.1	Very low	170 Å²	170	161.6 Å²	161.6	84%	0.837	82%	0.819	S	S	*	*			trans	84.7	151.7	159.8	-62.5	-179.4	63.9	0	0	121
216	E	27.9	Very low	32.6	Very low	177 Å²	177	155.2 Å²	155.2	83%	0.827	81%	0.81	S	S	*	*			trans	-128.8	174.7	179.1	-91.5	-164.9	161.3	0	0	109.2
217	P	54.2	Low	32.3	Very low	108 Å²	108	154.5 Å²	154.5	70%	0.701	81%	0.813	S	S	*	*			cis	-114.4	-92.8	-22.4	22.8	0.2	0	0	0	109.4
218	P	38.8	Very low	32.2	Very low	113 Å²	113	151.1 Å²	151.1	73%	0.734	81%	0.809	S	S	*	*			cis	-103.5	-157.3	-20.1	42.4	-31.5	0	0	0	112.5
219	V	35.3	Very low	32.3	Very low	132 Å²	132	145.1 Å²	145.1	80%	0.8	80%	0.803	S	S	*	*			trans	-134.2	137.9	173	173.2	0	0	0	0	110.3
220	T	27.5	Very low	32.3	Very low	135 Å²	135	146.8 Å²	146.8	83%	0.828	81%	0.809	S	S	*	*			trans	-150.4	161.3	161.2	35.1	0	0	0	0	112.7
221	H	29.9	Very low	32.1	Very low	180 Å²	180	139.3 Å²	139.3	83%	0.833	80%	0.803	S	S	*	*			trans	-90.6	154.8	-172.3	-45.7	-104.7	0	0	0	112.9
222	S	29	Very low	32.1	Very low	122 Å²	122	141.8 Å²	141.8	85%	0.853	82%	0.817	S	S	*	*			trans	179	138.1	135	-83.5	0	0	0	0	113.4
223	T	32.7	Very low	32	Very low	139 Å²	139	139.6 Å²	139.6	85%	0.853	81%	0.813	S	S	*	*			trans	-100.8	142.3	158.7	49.8	0	0	0	0	109.5
224	P	34.9	Very low	32.6	Very low	112 Å²	112	142.3 Å²	142.3	73%	0.727	82%	0.816	S	S	*	*				-150.3	147.1	124.8	34.2	-16.5	0	0	0	117.5
225	V	26.2	Very low	32.5	Very low	134 Å²	134	135.8 Å²	135.8	81%	0.812	80%	0.804	S	S	*	*			trans	45.4	104.1	134.2	-170.5	0	0	0	0	120.6
226	C	26.7	Very low	33.4	Very low	106 Å²	106	136.5 Å²	136.5	72%	0.716	81%	0.81	S	S	*	*				28.6	125.6	126.9	-168	0	0	0	0	121.3
227	K	27.1	Very low	33.9	Very low	205 Å²	205	139.4 Å²	139.4	89%	0.891	81%	0.814	S	S	*	*			trans	-164.9	151.3	130.1	-104.7	155.6	-168.4	175.9	0	112.4
228	T	33	Very low	33.2	Very low	124 Å²	124	142.8 Å²	142.8	76%	0.761	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-100.8	145.9	178.1	51.3	0	0	0	0	112.5
229	P	32.2	Very low	33.2	Very low	126 Å²	126	146.4 Å²	146.4	82%	0.818	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-96.2	153.4	149.3	34.6	-28.3	0	0	0	111.4
230	R	31.7	Very low	33.4	Very low	249 Å²	249	148.5 Å²	148.5	94%	0.94	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-94.2	155.3	169.6	-63.9	179.2	177.8	-168.3	1	110.1
231	G	31.8	Very low	34	Very low	73 Å²	73	149.8 Å²	149.8	75%	0.753	83%	0.825	S	S	*	*			trans	-170	134.5	170	0	0	0	0	0	110.8
232	D	31.7	Very low	34.4	Very low	176 Å²	176	148.6 Å²	148.6	94%	0.941	82%	0.823	S	S	*	*			trans	-85.6	149.3	-166.2	-59.1	-78.9	0	0	0	114.5
233	G	31.7	Very low	35	Very low	73 Å²	73	151.8 Å²	151.8	75%	0.753	83%	0.825	S	S	*	*			trans	173.9	121	175.8	0	0	0	0	0	113.1
234	P	40.8	Very low	35.5	Very low	138 Å²	138	151.3 Å²	151.3	90%	0.896	82%	0.817	S	S	*	*			trans	-96.4	153	-167.9	35.6	-35.9	0	0	0	115.8
235	G	31.3	Very low	35.9	Very low	59 Å²	59	154.7 Å²	154.7	61%	0.608	82%	0.823	S	S	*	*				101.7	72	129.1	0	0	0	0	0	120.7	R237	G235-R237 PolarHBondContact O-N 2.94Å; G235-R237 VanDerWaalsContact O-N 3.14Å
236	L	47.2	Very low	36.8	Very low	186 Å²	186	154.8 Å²	154.8	97%	0.974	82%	0.824	S	S	*	*				46.6	55.1	125.5	-82.1	161.4	0	0	0	119.2
237	R	38	Very low	37.7	Very low	237 Å²	237	158.2 Å²	158.2	89%	0.894	83%	0.826	S	S	*	*			trans	-133.9	7.3	171.3	-75.9	-160.1	174.3	-156.5	-1.2	119.1	G235	G235-R237 PolarHBondContact O-N 2.94Å; G235-R237 VanDerWaalsContact O-N 3.14Å
238	Q	39.3	Very low	38.7	Very low	179 Å²	179	156.4 Å²	156.4	84%	0.836	82%	0.821	S	S	*	*	S	Bend	trans	-109.9	0.9	-172.2	-112.5	176.5	6	0	0	118.6
239	H	39.3	Very low	39.6	Very low	189 Å²	189	159 Å²	159	88%	0.875	82%	0.824	S	S	*	*	S	Bend	trans	-101.4	19	179.3	-92.7	-55.8	0	0	0	116.2
240	Q	40.1	Very low	40.8	Very low	177 Å²	177	161.6 Å²	161.6	83%	0.827	83%	0.825	S	S	*	*	S	Bend	trans	-119.2	9.2	-178.9	-143.1	174.9	57.4	0	0	115.7
241	Q	39.6	Very low	42.8	Very low	162 Å²	162	157.9 Å²	157.9	76%	0.757	82%	0.816	S	S	*	*	S	Bend	trans	-110.7	-20.4	-178.8	-70.3	-172.7	-15.7	0	0	115.5	H243	Q241-H243 VanDerWaalsContact C-N 3.32Å; Q241-H243 PolarHBondContact O-N 3.22Å
242	L	38.9	Very low	45.3	Very low	154 Å²	154	161.1 Å²	161.1	81%	0.806	81%	0.809	S	S	*	*	G	3₁₀ helix	trans	-71.3	-19.6	-177.8	-94.2	158.5	0	0	0	114.8	N244	L242-N244 PolarHBondContact O-N 3.05Å
243	H	41.2	Very low	48.2	Very low	190 Å²	190	155.2 Å²	155.2	88%	0.88	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-88	6.4	-176.1	-101	-66.5	0	0	0	115.9	Q241	Q241-H243 VanDerWaalsContact C-N 3.32Å; Q241-H243 PolarHBondContact O-N 3.22Å
244	N	42.3	Very low	51.2	Low	128 Å²	128	154.2 Å²	154.2	68%	0.684	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-110.3	5.3	-173.8	-92.5	-45.5	0	0	0	115.8	L242	L242-N244 PolarHBondContact O-N 3.05Å
245	Q	44.7	Very low	53.9	Low	183 Å²	183	151.6 Å²	151.6	86%	0.855	72%	0.724	S	S	*	*			trans	-109	15.6	-175.8	-65.2	-143.5	33	0	0	116.2
246	V	43.5	Very low	56.9	Low	137 Å²	137	149.3 Å²	149.3	83%	0.83	70%	0.7	S	S	*	*			trans	-109	66.2	157.2	-167.2	0	0	0	0	109.6	E248	V246-E248 PolarHBondContact O-N 3.05Å
247	K	45.8	Very low	59.2	Low	177 Å²	177	141.4 Å²	141.4	77%	0.77	66%	0.659	S	S	*	*			trans	-67.6	105.7	152	-78.4	178.4	179.9	170.9	0	106.5	H249	K247-H249 PolarHBondContact O-N 2.97Å; K247-H249 VanDerWaalsContact O-N 3.07Å; K247-H249 PolarHBondContact O-ND1 2.71Å
248	E	47.9	Very low	61.8	Low	168 Å²	168	131.6 Å²	131.6	79%	0.785	62%	0.622	S	S	*	*			trans	-48.8	122.2	161.7	-78.8	-155.8	130.9	0	0	107.9	V246 Q250	V246-E248 PolarHBondContact O-N 3.05Å; E248-Q250 PolarHBondContact O-N 3.27Å
249	H	52.3	Low	64.2	Low	179 Å²	179	128.2 Å²	128.2	83%	0.829	61%	0.61	S	S	*	*			trans	-65.6	101.7	170.6	-78.5	53.8	0	0	0	106.7	K247 K251	K247-H249 PolarHBondContact O-N 2.97Å; K247-H249 VanDerWaalsContact O-N 3.07Å; K247-H249 PolarHBondContact O-ND1 2.71Å; H249-K251 PolarHBondContact O-N 2.77Å
250	Q	59	Low	66.6	Low	180 Å²	180	126.4 Å²	126.4	84%	0.841	60%	0.599	S	S	*	*			trans	-44.6	112.9	-176.8	-73.7	-173.9	-11.9	0	0	109.4	E248 K252	E248-Q250 PolarHBondContact O-N 3.27Å; Q250-K252 PolarHBondContact O-N 3.38Å
251	K	72.1	Confident	69	Low	170 Å²	170	119 Å²	119	74%	0.739	56%	0.564	S	S	*	*			trans	-55.2	110.7	-168.5	-79.1	-174.9	175.1	178.2	0	109.7	H249 F253	H249-K251 PolarHBondContact O-N 2.77Å; K251-F253 HydrophobicContact CB-CE1 4.49Å; K251-F253 HydrophobicContact CB-CZ 4.34Å; K251-F253 VanDerWaalsContact O-CD2 3.23Å; K251-F253 WeakPolarHBondContact O-CD2 3.48Å; K251-F253 WeakPolarHBondContact O-CE2 3.32Å; K251-F253 PolarHBondContact O-N 2.96Å
252	K	84.6	Confident	71.3	Confident	141 Å²	141	112.1 Å²	112.1	61%	0.613	53%	0.531	S	S	*	.			trans	-72.6	99.8	179.9	-68.6	-171.4	176.8	-170.6	0	108.4	Q250 Q254 L481	Q250-K252 PolarHBondContact O-N 3.38Å; K252-Q254 PolarHBondContact O-N 3.1Å; K252-L481 PolarHBondContact NZ-O 3.19Å
253	F	93.3	Very high	73.7	Confident	53 Å²	53	107.7 Å²	107.7	23%	0.232	52%	0.523	C	S	.	.			trans	-70.4	60.6	174.4	-58.4	-70.4	0	0	0	111.5	K251 Y255 G256 N257 Y258	K251-F253 HydrophobicContact CB-CE1 4.49Å; K251-F253 HydrophobicContact CB-CZ 4.34Å; K251-F253 VanDerWaalsContact O-CD2 3.23Å; K251-F253 WeakPolarHBondContact O-CD2 3.48Å; K251-F253 WeakPolarHBondContact O-CE2 3.32Å; K251-F253 PolarHBondContact O-N 2.96Å; F253-Y255 PolarHBondContact O-N 2.78Å; F253-G256 PolarHBondContact O-N 2.8Å; F253-G256 VanDerWaalsContact O-N 3.12Å; F253-N257 VanDerWaalsContact CA-OD1 3.3Å; F253-N257 WeakPolarHBondContact CA-OD1 3.22Å; F253-N257 WeakPolarHBondContact CD1-O 3.12Å; F253-N257 WeakPolarHBondContact CE1-O 3.17Å; F253-Y258 HydrophobicContact CB-CD1 3.68Å; F253-Y258 HydrophobicContact CB-CE1 3.51Å; F253-Y258 HydrophobicContact CB-CG 4.34Å; F253-Y258 HydrophobicContact CD1-CD1 4.17Å; F253-Y258 AromaticContact CD2-CD1 3.42Å; F253-Y258 HydrophobicContact CD2-CD1 3.42Å; F253-Y258 VanDerWaalsContact CD2-CD1 3.42Å; F253-Y258 AromaticContact CD2-CE1 3.57Å; F253-Y258 HydrophobicContact CD2-CE1 3.57Å; F253-Y258 HydrophobicContact CE2-CD1 4.03Å; F253-Y258 HydrophobicContact CE2-CE1 4.49Å; F253-Y258 AromaticContact CG-CD1 3.49Å; F253-Y258 HydrophobicContact CG-CD1 3.49Å; F253-Y258 VanDerWaalsContact CG-CD1 3.49Å; F253-Y258 AromaticContact CG-CE1 3.73Å; F253-Y258 HydrophobicContact CG-CE1 3.73Å; F253-Y258 HydrophobicContact CG-CG 4.28Å
254	Q	94.7	Very high	75.9	Confident	52 Å²	52	103.1 Å²	103.1	24%	0.243	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-24.4	-171.3	70.1	179.2	60.8	0	0	113.4	K252 N442 T482 I485	K252-Q254 PolarHBondContact O-N 3.1Å; Q254-N442 PolarHBondContact O-ND2 3.42Å; Q254-T482 HydrophobicContact CB-CG2 4.29Å; Q254-I485 HydrophobicContact CB-CD1 4.01Å
255	Y	96.8	Very high	78	Confident	83 Å²	83	97.2 Å²	97.2	33%	0.325	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	7.9	176.2	-53.4	-64.6	0	0	0	112.9	F253 N257 I316 W438 N442 W443	F253-Y255 PolarHBondContact O-N 2.78Å; Y255-N257 PolarHBondContact N-OD1 2.75Å; Y255-N257 PolarHBondContact O-N 3.13Å; Y255-I316 HydrophobicContact CD1-CD1 4.28Å; Y255-I316 HydrophobicContact CD2-CD1 4.39Å; Y255-I316 HydrophobicContact CD2-CG2 4.07Å; Y255-I316 HydrophobicContact CE1-CD1 4.22Å; Y255-I316 HydrophobicContact CE2-CD1 4.32Å; Y255-I316 HydrophobicContact CG-CD1 4.37Å; Y255-I316 HydrophobicContact CG-CG2 4.03Å; Y255-W438 WeakPolarHBondContact O-CB 3.47Å; Y255-N442 HydrophobicContact CD1-CB 4.27Å; Y255-N442 HydrophobicContact CE1-CB 4.17Å; Y255-N442 WeakPolarHBondContact CE1-OD1 3.47Å; Y255-W443 AromaticContact CD1-CH2 3.85Å; Y255-W443 HydrophobicContact CD1-CH2 3.85Å; Y255-W443 HydrophobicContact CD1-CZ3 4.38Å; Y255-W443 AromaticContact CE1-CH2 3.79Å; Y255-W443 HydrophobicContact CE1-CH2 3.79Å; Y255-W443 HydrophobicContact CE1-CZ2 4.07Å
256	G	94.4	Very high	80	Confident	10 Å²	10	89.3 Å²	89.3	10%	0.103	43%	0.43	C	S	.	.	S	Bend	trans	74.1	12.7	-172.7	0	0	0	0	0	114.1	F253 Y258 W438	F253-G256 PolarHBondContact O-N 2.8Å; F253-G256 VanDerWaalsContact O-N 3.12Å; G256-Y258 WeakPolarHBondContact O-CD2 3.42Å; G256-Y258 PolarHBondContact O-N 2.87Å; G256-W438 VanDerWaalsContact CA-CD2 3.41Å; G256-W438 VanDerWaalsContact N-CE3 3.32Å
257	N	95.2	Very high	81.8	Confident	21 Å²	21	84.9 Å²	84.9	11%	0.112	40%	0.404	C	S	.	.			trans	-70.7	46.3	-177.8	56.4	-48.8	0	0	0	113.6	F253 Y255 N259 D317 L320	F253-N257 VanDerWaalsContact CA-OD1 3.3Å; F253-N257 WeakPolarHBondContact CA-OD1 3.22Å; F253-N257 WeakPolarHBondContact CD1-O 3.12Å; F253-N257 WeakPolarHBondContact CE1-O 3.17Å; Y255-N257 PolarHBondContact N-OD1 2.75Å; Y255-N257 PolarHBondContact O-N 3.13Å; N257-N259 PolarHBondContact O-N 2.84Å; N257-D317 HydrophobicContact CB-CB 4Å; N257-D317 PolarHBondContact ND2-OD2 3.24Å; N257-L320 HydrophobicContact CB-CD1 3.72Å
258	Y	93.5	Very high	83.2	Confident	31 Å²	31	84.5 Å²	84.5	12%	0.122	41%	0.411	C	S	.	.			trans	-66.3	121	-179.4	-59.7	-74.8	0	0	0	111.1	F253 G256 K260 Y261 Y264 N294 W438 R478	F253-Y258 HydrophobicContact CB-CD1 3.68Å; F253-Y258 HydrophobicContact CB-CE1 3.51Å; F253-Y258 HydrophobicContact CB-CG 4.34Å; F253-Y258 HydrophobicContact CD1-CD1 4.17Å; F253-Y258 AromaticContact CD2-CD1 3.42Å; F253-Y258 HydrophobicContact CD2-CD1 3.42Å; F253-Y258 VanDerWaalsContact CD2-CD1 3.42Å; F253-Y258 AromaticContact CD2-CE1 3.57Å; F253-Y258 HydrophobicContact CD2-CE1 3.57Å; F253-Y258 HydrophobicContact CE2-CD1 4.03Å; F253-Y258 HydrophobicContact CE2-CE1 4.49Å; F253-Y258 AromaticContact CG-CD1 3.49Å; F253-Y258 HydrophobicContact CG-CD1 3.49Å; F253-Y258 VanDerWaalsContact CG-CD1 3.49Å; F253-Y258 AromaticContact CG-CE1 3.73Å; F253-Y258 HydrophobicContact CG-CE1 3.73Å; F253-Y258 HydrophobicContact CG-CG 4.28Å; G256-Y258 WeakPolarHBondContact O-CD2 3.42Å; G256-Y258 PolarHBondContact O-N 2.87Å; Y258-K260 PolarHBondContact O-N 3.17Å; Y258-Y261 HydrophobicContact CD2-CD2 4.45Å; Y258-Y261 WeakPolarHBondContact O-CB 3.49Å; Y258-Y261 PolarHBondContact O-N 3.46Å; Y258-Y264 WeakPolarHBondContact CB-OH 3.41Å; Y258-Y264 WeakPolarHBondContact CD2-OH 3.37Å; Y258-Y264 VanDerWaalsContact CG-OH 3.25Å; Y258-N294 PolarHBondContact O-ND2 3.25Å; Y258-N294 PolarHBondContact O-OD1 3.16Å; Y258-W438 HydrophobicContact CE2-CH2 4.12Å; Y258-W438 AromaticContact CE2-CZ2 3.73Å; Y258-W438 HydrophobicContact CE2-CZ2 3.73Å; Y258-W438 WeakPolarHBondContact OH-CH2 3.47Å; Y258-R478 PolarHBondContact OH-NE 3.4Å; Y258-R478 PolarHBondContact OH-NH2 3.38Å; Y258-R478 VanDerWaalsContact OH-NH2 3.13Å
259	N	89.8	Confident	84	Confident	107 Å²	107	82.9 Å²	82.9	57%	0.572	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-7.6	179.7	67.3	-24.8	0	0	0	115	N257 L320	N257-N259 PolarHBondContact O-N 2.84Å; N259-L320 HydrophobicContact CB-CD2 4.34Å
260	K	89.6	Confident	85.1	Confident	152 Å²	152	77 Å²	77	66%	0.661	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.3	23.5	175.3	-64.3	-171.3	175.8	-170.7	0	112.3	Y258 Y262 G263 Y264	Y258-K260 PolarHBondContact O-N 3.17Å; K260-Y262 PolarHBondContact O-N 2.85Å; K260-G263 PolarHBondContact O-N 2.77Å; K260-Y264 VanDerWaalsContact O-CD1 3.26Å; K260-Y264 WeakPolarHBondContact O-CD1 3.34Å; K260-Y264 PolarHBondContact O-N 2.81Å
261	Y	90.1	Very high	86.3	Confident	21 Å²	21	72.9 Å²	72.9	8%	0.082	38%	0.376	C	S	.	.	H	α-helix	trans	-49.2	-56.3	-172.7	-179.2	-91.1	0	0	0	113.2	Y258 G263 Y264 R265 N294 S434	Y258-Y261 HydrophobicContact CD2-CD2 4.45Å; Y258-Y261 WeakPolarHBondContact O-CB 3.49Å; Y258-Y261 PolarHBondContact O-N 3.46Å; Y261-G263 VanDerWaalsContact C-N 3.3Å; Y261-G263 PolarHBondContact O-N 3.28Å; Y261-Y264 HydrophobicContact CD2-CE2 4.4Å; Y261-Y264 WeakPolarHBondContact CD2-OH 3.41Å; Y261-Y264 WeakPolarHBondContact O-CD2 3.13Å; Y261-Y264 WeakPolarHBondContact O-CE2 3.33Å; Y261-Y264 PolarHBondContact O-N 3.3Å; Y261-R265 HydrophobicContact CE1-CB 4.36Å; Y261-R265 WeakPolarHBondContact O-CB 3.41Å; Y261-R265 PolarHBondContact O-N 2.94Å; Y261-R265 PolarHBondContact OH-NH1 2.93Å; Y261-N294 WeakPolarHBondContact CB-OD1 3.44Å; Y261-S434 WeakPolarHBondContact OH-CB 3.39Å; Y261-S434 PolarHBondContact OH-OG 2.64Å; Y261-S434 VanDerWaalsContact OH-OG 3.05Å
262	Y	88.9	Confident	87.2	Confident	18 Å²	18	65.3 Å²	65.3	7%	0.071	34%	0.344	C	S	.	.	H	α-helix	trans	-66.9	-30.3	-179.4	-65.8	-80.9	0	0	0	112.7	K260 Y264 R265 N266 C293 N294 H297 L298	K260-Y262 PolarHBondContact O-N 2.85Å; Y262-Y264 VanDerWaalsContact C-N 3.27Å; Y262-Y264 PolarHBondContact O-N 2.87Å; Y262-R265 PolarHBondContact O-N 2.89Å; Y262-N266 CarbonylContact O-C 3.46Å; Y262-N266 WeakPolarHBondContact O-CA 3.47Å; Y262-N266 PolarHBondContact O-N 3.39Å; Y262-C293 PolarHBondContact OH-O 2.82Å; Y262-N294 HydrophobicContact CE2-CB 4.07Å; Y262-H297 HydrophobicContact CD1-CB 3.87Å; Y262-H297 HydrophobicContact CD2-CB 3.92Å; Y262-H297 AromaticContact CD2-CD2 3.26Å; Y262-H297 WeakPolarHBondContact CD2-CD2 3.34Å; Y262-H297 AromaticContact CD2-CG 3.74Å; Y262-H297 HydrophobicContact CE1-CB 3.91Å; Y262-H297 HydrophobicContact CE2-CB 3.96Å; Y262-H297 AromaticContact CE2-CD2 3.7Å; Y262-H297 HydrophobicContact CG-CB 3.86Å; Y262-H297 AromaticContact CG-CD2 3.8Å; Y262-H297 AromaticContact CG-CG 3.84Å; Y262-L298 HydrophobicContact CE1-CB 4.27Å
263	G	88.1	Confident	87.6	Confident	61 Å²	61	59.6 Å²	59.6	63%	0.629	32%	0.321	S	S	*	.	H	α-helix	trans	-70.1	-14.8	179.7	0	0	0	0	0	115.5	K260 Y261	K260-G263 PolarHBondContact O-N 2.77Å; Y261-G263 VanDerWaalsContact C-N 3.3Å; Y261-G263 PolarHBondContact O-N 3.28Å
264	Y	87.2	Confident	87.6	Confident	94 Å²	94	57.4 Å²	57.4	37%	0.369	31%	0.311	S	S	.	.	H	α-helix	trans	-113	-20.1	167.9	62.8	-112.8	0	0	0	113.8	Y258 K260 Y261 Y262 F525	Y258-Y264 WeakPolarHBondContact CB-OH 3.41Å; Y258-Y264 WeakPolarHBondContact CD2-OH 3.37Å; Y258-Y264 VanDerWaalsContact CG-OH 3.25Å; K260-Y264 VanDerWaalsContact O-CD1 3.26Å; K260-Y264 WeakPolarHBondContact O-CD1 3.34Å; K260-Y264 PolarHBondContact O-N 2.81Å; Y261-Y264 HydrophobicContact CD2-CE2 4.4Å; Y261-Y264 WeakPolarHBondContact CD2-OH 3.41Å; Y261-Y264 WeakPolarHBondContact O-CD2 3.13Å; Y261-Y264 WeakPolarHBondContact O-CE2 3.33Å; Y261-Y264 PolarHBondContact O-N 3.3Å; Y262-Y264 VanDerWaalsContact C-N 3.27Å; Y262-Y264 PolarHBondContact O-N 2.87Å; Y264-F525 HydrophobicContact CD2-CE2 4.22Å; Y264-F525 AromaticContact CD2-CZ 3.77Å; Y264-F525 HydrophobicContact CD2-CZ 3.77Å; Y264-F525 HydrophobicContact CE2-CE1 4.2Å; Y264-F525 HydrophobicContact CE2-CE2 4.47Å; Y264-F525 AromaticContact CE2-CZ 3.59Å; Y264-F525 HydrophobicContact CE2-CZ 3.59Å
265	R	87.8	Confident	87.5	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-74.2	-42.3	172.8	-171.7	-172.6	174.6	110.4	17.4	111.1	Y261 Y262 P267 D272 R274 S434 E468 F525	Y261-R265 HydrophobicContact CE1-CB 4.36Å; Y261-R265 WeakPolarHBondContact O-CB 3.41Å; Y261-R265 PolarHBondContact O-N 2.94Å; Y261-R265 PolarHBondContact OH-NH1 2.93Å; Y262-R265 PolarHBondContact O-N 2.89Å; R265-P267 VanDerWaalsContact C-CD 3.5Å; R265-P267 WeakPolarHBondContact O-CD 3.44Å; R265-D272 IonicContact NE-OD1 2.83Å; R265-D272 IonicContact NE-OD2 3.75Å; R265-R274 VanDerWaalsContact CZ-NE 3.35Å; R265-S434 PolarHBondContact NH1-OG 3.18Å; R265-S434 VanDerWaalsContact NH1-OG 3.1Å; R265-E468 IonicContact CZ-OE1 3.98Å; R265-E468 IonicContact CZ-OE2 3.33Å; R265-E468 IonicContact NH1-OE1 3.5Å; R265-E468 PolarHBondContact NH1-OE1 3.4Å; R265-E468 IonicContact NH1-OE2 2.79Å; R265-E468 PolarHBondContact NH1-OE2 3.11Å; R265-E468 IonicContact NH2-OE1 3.58Å; R265-E468 PolarHBondContact NH2-OE1 2.92Å; R265-E468 IonicContact NH2-OE2 3.27Å; R265-F525 HydrophobicContact CB-CD1 4.34Å; R265-F525 HydrophobicContact CB-CE1 4.29Å; R265-F525 HydrophobicContact CG-CB 4.36Å; R265-F525 HydrophobicContact CG-CD1 3.65Å; R265-F525 HydrophobicContact CG-CE1 4.08Å; R265-F525 HydrophobicContact CG-CG 3.92Å
266	N	86.5	Confident	87.3	Confident	16 Å²	16	58.2 Å²	58.2	9%	0.086	32%	0.318	C	S	.	.	S	Bend	trans	-122	73	-175.3	-48.5	-5.5	0	0	0	107.7	Y262 S270 D272	Y262-N266 CarbonylContact O-C 3.46Å; Y262-N266 WeakPolarHBondContact O-CA 3.47Å; Y262-N266 PolarHBondContact O-N 3.39Å; N266-S270 VanDerWaalsContact C-OG 3.29Å; N266-S270 WeakPolarHBondContact CA-OG 3.44Å; N266-S270 WeakPolarHBondContact CB-O 3.08Å; N266-D272 WeakPolarHBondContact ND2-CA 3.47Å; N266-D272 VanDerWaalsContact ND2-CB 3.26Å; N266-D272 WeakPolarHBondContact ND2-CB 3.37Å; N266-D272 PolarHBondContact ND2-OD2 3.31Å
267	P	80.6	Confident	87.3	Confident	44 Å²	44	59.1 Å²	59.1	29%	0.286	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-59.6	157.6	-178.6	26.2	-34.7	0	0	0	111.5	R265 C269 S270	R265-P267 VanDerWaalsContact C-CD 3.5Å; R265-P267 WeakPolarHBondContact O-CD 3.44Å; P267-C269 PolarHBondContact O-N 3.08Å; P267-C269 VanDerWaalsContact O-N 3.16Å; P267-S270 WeakPolarHBondContact O-CB 3.34Å; P267-S270 PolarHBondContact O-N 3.49Å; P267-S270 VanDerWaalsContact O-N 3.1Å; P267-S270 PolarHBondContact O-OG 2.88Å
268	N	74.9	Confident	87.3	Confident	170 Å²	170	58.5 Å²	58.5	91%	0.909	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	56.9	25.7	-179.3	-53.1	-11.8	0	0	0	114.3	S270	N268-S270 PolarHBondContact O-N 2.99Å
269	C	65.2	Low	87.4	Confident	134 Å²	134	61.8 Å²	61.8	91%	0.905	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	56.8	29.1	-174.2	-61.4	0	0	0	0	114	P267	P267-C269 PolarHBondContact O-N 3.08Å; P267-C269 VanDerWaalsContact O-N 3.16Å
270	S	74.4	Confident	87.7	Confident	55 Å²	55	61 Å²	61	39%	0.385	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-56.4	150.8	172.6	44.2	0	0	0	0	112.4	N266 P267 N268	N266-S270 VanDerWaalsContact C-OG 3.29Å; N266-S270 WeakPolarHBondContact CA-OG 3.44Å; N266-S270 WeakPolarHBondContact CB-O 3.08Å; P267-S270 WeakPolarHBondContact O-CB 3.34Å; P267-S270 PolarHBondContact O-N 3.49Å; P267-S270 VanDerWaalsContact O-N 3.1Å; P267-S270 PolarHBondContact O-OG 2.88Å; N268-S270 PolarHBondContact O-N 2.99Å
271	E	84.9	Confident	88.1	Confident	94 Å²	94	59.3 Å²	59.3	44%	0.439	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-60.4	139.9	171.6	-171.9	171.1	-129.8	0	0	110.4	P273 I275 H276 Y301	E271-P273 VanDerWaalsContact O-CD 3.24Å; E271-P273 WeakPolarHBondContact O-CD 3.15Å; E271-I275 HydrophobicContact CG-CD1 4.17Å; E271-I275 HydrophobicContact CG-CG1 3.71Å; E271-H276 IonicContact OE2-CE1 3.7Å; E271-H276 PolarHBondContact OE2-CE1 2.98Å; E271-H276 IonicContact OE2-NE2 3.31Å; E271-Y301 HydrophobicContact CG-CE2 4.1Å; E271-Y301 WeakPolarHBondContact OE1-CE2 3.47Å; E271-Y301 PolarHBondContact OE1-OH 3.18Å
272	D	91	Very high	88.4	Confident	11 Å²	11	59.7 Å²	59.7	6%	0.059	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-67.6	117.8	-175.8	-164.6	-59.4	0	0	0	109.7	R265 N266 R274 I275 L298	R265-D272 IonicContact NE-OD1 2.83Å; R265-D272 IonicContact NE-OD2 3.75Å; N266-D272 WeakPolarHBondContact ND2-CA 3.47Å; N266-D272 VanDerWaalsContact ND2-CB 3.26Å; N266-D272 WeakPolarHBondContact ND2-CB 3.37Å; N266-D272 PolarHBondContact ND2-OD2 3.31Å; D272-R274 PolarHBondContact O-N 3.06Å; D272-R274 WeakPolarHBondContact OD1-CB 3.31Å; D272-R274 WeakPolarHBondContact OD1-CG 3.43Å; D272-R274 IonicContact OD1-CZ 2.71Å; D272-R274 PolarHBondContact OD1-N 2.93Å; D272-R274 IonicContact OD1-NE 3.19Å; D272-R274 PolarHBondContact OD1-NE 3.47Å; D272-R274 IonicContact OD1-NH2 2.72Å; D272-R274 IonicContact OD2-CZ 2.96Å; D272-R274 IonicContact OD2-NE 2.78Å; D272-R274 IonicContact OD2-NH2 3.1Å; D272-R274 PolarHBondContact OD2-NH2 3.39Å; D272-I275 HydrophobicContact CB-CG2 4.5Å; D272-I275 WeakPolarHBondContact O-CG1 3.47Å; D272-I275 PolarHBondContact O-N 3.44Å; D272-L298 HydrophobicContact CB-CD1 4.46Å
273	P	91.9	Very high	88.9	Confident	21 Å²	21	58.9 Å²	58.9	14%	0.136	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-56	-23.1	-172.7	-30.1	37.3	0	0	0	114.3	E271 I275 H276 P518 K519 C520	E271-P273 VanDerWaalsContact O-CD 3.24Å; E271-P273 WeakPolarHBondContact O-CD 3.15Å; P273-I275 PolarHBondContact O-N 3.35Å; P273-H276 WeakPolarHBondContact O-CB 3.35Å; P273-H276 PolarHBondContact O-N 3.48Å; P273-P518 HydrophobicContact CB-CB 3.72Å; P273-K519 VanDerWaalsContact CB-O 3.23Å; P273-K519 WeakPolarHBondContact CB-O 3.17Å; P273-K519 VanDerWaalsContact CG-O 3.31Å; P273-K519 WeakPolarHBondContact CG-O 3.37Å; P273-C520 HydrophobicContact CG-CB 4.34Å
274	R	94.3	Very high	89.3	Confident	6 Å²	6	64.1 Å²	64.1	2%	0.023	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-59.8	-28	176.5	-68.4	174.5	-71.6	175.8	11.4	113.4	R265 D272 H276 V277 L278 E468 P518	R265-R274 VanDerWaalsContact CZ-NE 3.35Å; D272-R274 PolarHBondContact O-N 3.06Å; D272-R274 WeakPolarHBondContact OD1-CB 3.31Å; D272-R274 WeakPolarHBondContact OD1-CG 3.43Å; D272-R274 IonicContact OD1-CZ 2.71Å; D272-R274 PolarHBondContact OD1-N 2.93Å; D272-R274 IonicContact OD1-NE 3.19Å; D272-R274 PolarHBondContact OD1-NE 3.47Å; D272-R274 IonicContact OD1-NH2 2.72Å; D272-R274 IonicContact OD2-CZ 2.96Å; D272-R274 IonicContact OD2-NE 2.78Å; D272-R274 IonicContact OD2-NH2 3.1Å; D272-R274 PolarHBondContact OD2-NH2 3.39Å; R274-H276 PolarHBondContact O-N 2.93Å; R274-H276 VanDerWaalsContact O-N 3.16Å; R274-V277 VanDerWaalsContact O-CG2 3.31Å; R274-V277 WeakPolarHBondContact O-CG2 3.35Å; R274-V277 PolarHBondContact O-N 3.42Å; R274-V277 VanDerWaalsContact O-N 3.14Å; R274-L278 WeakPolarHBondContact O-CG 3.18Å; R274-L278 PolarHBondContact O-N 3.24Å; R274-E468 WeakPolarHBondContact CD-OE2 3.41Å; R274-E468 IonicContact CZ-OE2 2.9Å; R274-E468 IonicContact NE-OE2 3.81Å; R274-E468 IonicContact NH1-OE2 2.87Å; R274-E468 PolarHBondContact NH1-OE2 3.21Å; R274-P518 HydrophobicContact CG-CG 4.19Å
275	I	92.6	Very high	89.8	Confident	17 Å²	17	62.1 Å²	62.1	9%	0.087	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-62.2	-26.3	-179.7	70.8	84.6	0	0	0	112.1	E271 D272 P273 V277 L278 L298 Y301 F306	E271-I275 HydrophobicContact CG-CD1 4.17Å; E271-I275 HydrophobicContact CG-CG1 3.71Å; D272-I275 HydrophobicContact CB-CG2 4.5Å; D272-I275 WeakPolarHBondContact O-CG1 3.47Å; D272-I275 PolarHBondContact O-N 3.44Å; P273-I275 PolarHBondContact O-N 3.35Å; I275-V277 VanDerWaalsContact C-N 3.26Å; I275-V277 PolarHBondContact O-N 2.83Å; I275-L278 PolarHBondContact O-N 3.13Å; I275-L298 HydrophobicContact CG2-CD1 3.55Å; I275-Y301 HydrophobicContact CB-CD1 4.32Å; I275-Y301 HydrophobicContact CB-CE1 3.81Å; I275-Y301 HydrophobicContact CD1-CE1 4.48Å; I275-Y301 WeakPolarHBondContact CD1-OH 3.5Å; I275-Y301 HydrophobicContact CG1-CE1 4.18Å; I275-Y301 HydrophobicContact CG2-CD1 3.63Å; I275-Y301 HydrophobicContact CG2-CE1 3.62Å; I275-Y301 HydrophobicContact CG2-CG 4.13Å; I275-F306 HydrophobicContact CB-CZ 4.47Å
276	H	92.2	Very high	90.3	Very high	136 Å²	136	66 Å²	66	63%	0.63	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-74.2	-11.7	-179.4	-65.2	78.8	0	0	0	113.9	E271 P273 R274	E271-H276 IonicContact OE2-CE1 3.7Å; E271-H276 PolarHBondContact OE2-CE1 2.98Å; E271-H276 IonicContact OE2-NE2 3.31Å; P273-H276 WeakPolarHBondContact O-CB 3.35Å; P273-H276 PolarHBondContact O-N 3.48Å; R274-H276 PolarHBondContact O-N 2.93Å; R274-H276 VanDerWaalsContact O-N 3.16Å
277	V	94.3	Very high	90.9	Very high	28 Å²	28	66.6 Å²	66.6	17%	0.17	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-113.6	0.9	174.7	-56.9	0	0	0	0	112.8	R274 I275 L515 P518 V529	R274-V277 VanDerWaalsContact O-CG2 3.31Å; R274-V277 WeakPolarHBondContact O-CG2 3.35Å; R274-V277 PolarHBondContact O-N 3.42Å; R274-V277 VanDerWaalsContact O-N 3.14Å; I275-V277 VanDerWaalsContact C-N 3.26Å; I275-V277 PolarHBondContact O-N 2.83Å; V277-L515 HydrophobicContact CB-CB 4.23Å; V277-L515 WeakPolarHBondContact CG1-O 3.18Å; V277-P518 HydrophobicContact CG1-CG 4.05Å; V277-P518 HydrophobicContact CG2-CG 3.72Å; V277-V529 HydrophobicContact CG2-CB 4.12Å; V277-V529 HydrophobicContact CG2-CG1 4.47Å; V277-V529 HydrophobicContact CG2-CG2 3.94Å
278	L	95.4	Very high	91.7	Very high	9 Å²	9	64.5 Å²	64.5	5%	0.047	33%	0.331	C	S	.	.	S	Bend	trans	-101.3	116.7	177	-66.5	179.5	0	0	0	109	R274 I275 W282 F283 F306 I466	R274-L278 WeakPolarHBondContact O-CG 3.18Å; R274-L278 PolarHBondContact O-N 3.24Å; I275-L278 PolarHBondContact O-N 3.13Å; L278-W282 HydrophobicContact CD2-CZ3 4.46Å; L278-F283 HydrophobicContact CB-CE2 4.02Å; L278-F283 HydrophobicContact CB-CZ 4.34Å; L278-F283 HydrophobicContact CD1-CZ 4.42Å; L278-F283 HydrophobicContact CD2-CZ 4.22Å; L278-F306 HydrophobicContact CB-CE2 3.85Å; L278-F306 HydrophobicContact CB-CZ 4.38Å; L278-I466 HydrophobicContact CD2-CD1 4.09Å; L278-I466 HydrophobicContact CD2-CG2 3.87Å
279	R	95.8	Very high	92.9	Very high	99 Å²	99	56.5 Å²	56.5	37%	0.374	29%	0.288	S	S	.	.			trans	-84.3	136.5	-177	-44.1	-176.5	-178.6	134.1	12.2	111.2	E281 W282 F283 E513	R279-E281 VanDerWaalsContact C-N 3.34Å; R279-E281 VanDerWaalsContact CB-CD 3.41Å; R279-E281 WeakPolarHBondContact CB-OE1 3.38Å; R279-E281 VanDerWaalsContact CB-OE2 3.26Å; R279-E281 WeakPolarHBondContact CB-OE2 3.37Å; R279-E281 VanDerWaalsContact CD-OE1 3.23Å; R279-E281 WeakPolarHBondContact CD-OE1 3.4Å; R279-E281 PolarHBondContact O-N 3.45Å; R279-W282 HydrophobicContact CB-CD2 3.91Å; R279-W282 HydrophobicContact CB-CE3 4.16Å; R279-W282 HydrophobicContact CB-CG 4.36Å; R279-W282 HydrophobicContact CB-CH2 4.45Å; R279-W282 HydrophobicContact CB-CZ2 4.24Å; R279-W282 HydrophobicContact CB-CZ3 4.41Å; R279-W282 HydrophobicContact CG-CD2 4.26Å; R279-W282 HydrophobicContact CG-CE3 4.35Å; R279-W282 HydrophobicContact CG-CH2 3.78Å; R279-W282 HydrophobicContact CG-CZ2 3.69Å; R279-W282 HydrophobicContact CG-CZ3 4.12Å; R279-W282 WeakPolarHBondContact O-CB 3.28Å; R279-W282 PolarHBondContact O-N 3.47Å; R279-F283 WeakPolarHBondContact O-CD2 3.49Å; R279-F283 WeakPolarHBondContact O-CE2 3.44Å; R279-E513 IonicContact CZ-OE1 2.82Å; R279-E513 IonicContact CZ-OE2 2.81Å; R279-E513 IonicContact NH1-OE1 3.91Å; R279-E513 IonicContact NH1-OE2 3.26Å; R279-E513 PolarHBondContact NH1-OE2 3.19Å; R279-E513 IonicContact NH2-OE1 2.78Å; R279-E513 PolarHBondContact NH2-OE1 2.92Å; R279-E513 IonicContact NH2-OE2 3.86Å; R279-E513 PolarHBondContact NH2-OE2 2.79Å
280	Q	96.3	Very high	94.5	Very high	90 Å²	90	50.4 Å²	50.4	42%	0.421	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-64.3	-37.3	-170.7	177.4	171.4	33.3	0	0	112.8	W282 F283 R284 M305 F306	Q280-W282 PolarHBondContact O-N 3.31Å; Q280-F283 PolarHBondContact O-N 3.26Å; Q280-R284 PolarHBondContact O-N 3.24Å; Q280-M305 PolarHBondContact NE2-O 3.03Å; Q280-F306 HydrophobicContact CB-CD1 3.92Å; Q280-F306 HydrophobicContact CB-CE1 4.36Å; Q280-F306 HydrophobicContact CB-CG 4.42Å; Q280-F306 HydrophobicContact CG-CB 4.18Å; Q280-F306 HydrophobicContact CG-CD1 3.95Å; Q280-F306 HydrophobicContact CG-CG 4.36Å
281	E	97.4	Very high	95.7	Very high	117 Å²	117	47.9 Å²	47.9	55%	0.547	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-63.7	-22.8	-178.5	71	-77.5	-176.9	0	0	113.6	R279 F283	R279-E281 VanDerWaalsContact C-N 3.34Å; R279-E281 VanDerWaalsContact CB-CD 3.41Å; R279-E281 WeakPolarHBondContact CB-OE1 3.38Å; R279-E281 VanDerWaalsContact CB-OE2 3.26Å; R279-E281 WeakPolarHBondContact CB-OE2 3.37Å; R279-E281 VanDerWaalsContact CD-OE1 3.23Å; R279-E281 WeakPolarHBondContact CD-OE1 3.4Å; R279-E281 PolarHBondContact O-N 3.45Å; E281-F283 VanDerWaalsContact C-N 3.28Å; E281-F283 PolarHBondContact O-N 2.96Å
282	W	97.7	Very high	96.3	Very high	30 Å²	30	44.9 Å²	44.9	11%	0.114	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-67.6	-29.1	172.8	-62.7	-17.4	0	0	0	112.8	L278 R279 Q280 K286 V429 L464 I466 L515 V531	L278-W282 HydrophobicContact CD2-CZ3 4.46Å; R279-W282 HydrophobicContact CB-CD2 3.91Å; R279-W282 HydrophobicContact CB-CE3 4.16Å; R279-W282 HydrophobicContact CB-CG 4.36Å; R279-W282 HydrophobicContact CB-CH2 4.45Å; R279-W282 HydrophobicContact CB-CZ2 4.24Å; R279-W282 HydrophobicContact CB-CZ3 4.41Å; R279-W282 HydrophobicContact CG-CD2 4.26Å; R279-W282 HydrophobicContact CG-CE3 4.35Å; R279-W282 HydrophobicContact CG-CH2 3.78Å; R279-W282 HydrophobicContact CG-CZ2 3.69Å; R279-W282 HydrophobicContact CG-CZ3 4.12Å; R279-W282 WeakPolarHBondContact O-CB 3.28Å; R279-W282 PolarHBondContact O-N 3.47Å; Q280-W282 PolarHBondContact O-N 3.31Å; W282-K286 WeakPolarHBondContact O-CG 3.27Å; W282-V429 WeakPolarHBondContact O-CG2 3.22Å; W282-L464 HydrophobicContact CB-CD1 3.89Å; W282-L464 HydrophobicContact CD2-CD1 4.15Å; W282-L464 HydrophobicContact CG-CD1 3.66Å; W282-I466 HydrophobicContact CE3-CD1 3.7Å; W282-I466 HydrophobicContact CZ3-CD1 4Å; W282-L515 HydrophobicContact CH2-CD1 3.46Å; W282-L515 VanDerWaalsContact CH2-CD1 3.46Å; W282-L515 HydrophobicContact CH2-CD2 3.67Å; W282-L515 HydrophobicContact CH2-CG 4.2Å; W282-L515 HydrophobicContact CZ2-CD2 4.35Å; W282-L515 HydrophobicContact CZ3-CD1 3.69Å; W282-V531 HydrophobicContact CH2-CG1 4.28Å; W282-V531 HydrophobicContact CZ2-CG1 4.42Å
283	F	98.4	Very high	96.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-32.8	-175.2	-54	-85.1	0	0	0	112.5	L278 R279 Q280 E281 G285 K286 V288 V302 F306 P308 V429 L431 I466	L278-F283 HydrophobicContact CB-CE2 4.02Å; L278-F283 HydrophobicContact CB-CZ 4.34Å; L278-F283 HydrophobicContact CD1-CZ 4.42Å; L278-F283 HydrophobicContact CD2-CZ 4.22Å; R279-F283 WeakPolarHBondContact O-CD2 3.49Å; R279-F283 WeakPolarHBondContact O-CE2 3.44Å; Q280-F283 PolarHBondContact O-N 3.26Å; E281-F283 VanDerWaalsContact C-N 3.28Å; E281-F283 PolarHBondContact O-N 2.96Å; F283-G285 PolarHBondContact O-N 2.87Å; F283-G285 VanDerWaalsContact O-N 3.13Å; F283-K286 VanDerWaalsContact O-CB 3.28Å; F283-K286 WeakPolarHBondContact O-CB 3.38Å; F283-K286 PolarHBondContact O-N 2.91Å; F283-V288 HydrophobicContact CD1-CG1 4.1Å; F283-V288 HydrophobicContact CD1-CG2 3.96Å; F283-V288 HydrophobicContact CE1-CG1 4.32Å; F283-V302 HydrophobicContact CB-CG1 4.47Å; F283-V302 HydrophobicContact CD1-CG1 3.8Å; F283-V302 HydrophobicContact CE1-CG1 4.23Å; F283-V302 HydrophobicContact CG-CG1 4.08Å; F283-F306 HydrophobicContact CB-CB 3.79Å; F283-F306 HydrophobicContact CD2-CB 4.11Å; F283-F306 AromaticContact CD2-CD2 3.46Å; F283-F306 HydrophobicContact CD2-CD2 3.46Å; F283-F306 VanDerWaalsContact CD2-CD2 3.46Å; F283-F306 HydrophobicContact CD2-CE2 4.18Å; F283-F306 HydrophobicContact CD2-CG 4.12Å; F283-F306 AromaticContact CE2-CD2 3.8Å; F283-F306 HydrophobicContact CE2-CD2 3.8Å; F283-F306 HydrophobicContact CE2-CE2 4.08Å; F283-F306 HydrophobicContact CG-CB 4.18Å; F283-F306 HydrophobicContact CG-CD2 4.08Å; F283-P308 HydrophobicContact CB-CB 4.48Å; F283-P308 WeakPolarHBondContact O-CA 3.14Å; F283-P308 WeakPolarHBondContact O-CB 3.34Å; F283-V429 HydrophobicContact CD1-CG1 4.37Å; F283-V429 HydrophobicContact CE1-CG1 3.87Å; F283-L431 HydrophobicContact CE1-CD1 4.34Å; F283-L431 HydrophobicContact CE1-CD2 3.85Å; F283-L431 HydrophobicContact CE1-CG 4.34Å; F283-L431 HydrophobicContact CZ-CD2 4.04Å; F283-I466 HydrophobicContact CE1-CD1 4.48Å; F283-I466 HydrophobicContact CZ-CD1 3.92Å
284	R	97.4	Very high	96.9	Very high	171 Å²	171	43.7 Å²	43.7	65%	0.645	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	117.6	-169.2	-162.1	178	-166.4	-90.3	5.2	111.9	Q280 K286 F306	Q280-R284 PolarHBondContact O-N 3.24Å; R284-K286 VanDerWaalsContact C-N 3.29Å; R284-K286 PolarHBondContact O-N 3.15Å; R284-F306 VanDerWaalsContact CA-O 3.32Å; R284-F306 WeakPolarHBondContact CA-O 3.25Å
285	G	96.8	Very high	96.9	Very high	52 Å²	52	43.9 Å²	43.9	54%	0.536	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	13.4	-177.9	0	0	0	0	0	116	F283 R307 A309	F283-G285 PolarHBondContact O-N 2.87Å; F283-G285 VanDerWaalsContact O-N 3.13Å; G285-R307 PolarHBondContact N-O 2.81Å; G285-A309 WeakPolarHBondContact O-CB 3.38Å
286	K	98.4	Very high	97.1	Very high	85 Å²	85	43 Å²	43	37%	0.37	21%	0.214	S	C	.	.			trans	-98.7	162.7	-179.6	-60.3	-53.7	-170.6	170.5	0	114.3	W282 F283 R284 V288 P308 A309 R310 D428	W282-K286 WeakPolarHBondContact O-CG 3.27Å; F283-K286 VanDerWaalsContact O-CB 3.28Å; F283-K286 WeakPolarHBondContact O-CB 3.38Å; F283-K286 PolarHBondContact O-N 2.91Å; R284-K286 VanDerWaalsContact C-N 3.29Å; R284-K286 PolarHBondContact O-N 3.15Å; K286-V288 HydrophobicContact CB-CG2 4.31Å; K286-P308 CarbonylContact O-C 3.44Å; K286-P308 WeakPolarHBondContact O-CB 3.47Å; K286-A309 PolarHBondContact O-N 2.99Å; K286-R310 PolarHBondContact O-N 2.86Å; K286-D428 WeakPolarHBondContact CA-OD2 3.35Å; K286-D428 HydrophobicContact CB-CB 4Å; K286-D428 WeakPolarHBondContact CB-OD2 3.48Å; K286-D428 HydrophobicContact CD-CB 3.95Å; K286-D428 HydrophobicContact CG-CB 4.2Å
287	D	98.6	Very high	97.2	Very high	30 Å²	30	40.8 Å²	40.8	16%	0.16	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	121.9	161.4	-80.3	-71.2	0	0	0	110.5	R310 Y427 D428 V429 R460	D287-R310 IonicContact OD1-CZ 3.97Å; D287-R310 IonicContact OD1-NE 3.93Å; D287-R310 PolarHBondContact OD1-NE 3.36Å; D287-R310 IonicContact OD1-NH2 3.44Å; D287-R310 PolarHBondContact OD1-NH2 2.89Å; D287-Y427 HydrophobicContact CB-CD1 4.07Å; D287-D428 PolarHBondContact N-OD2 2.87Å; D287-D428 PolarHBondContact O-N 3.1Å; D287-V429 PolarHBondContact O-N 3.38Å; D287-V429 VanDerWaalsContact O-N 3.17Å; D287-R460 IonicContact OD2-CZ 2.68Å; D287-R460 VanDerWaalsContact OD2-CZ 3.31Å; D287-R460 IonicContact OD2-NH1 3.79Å; D287-R460 PolarHBondContact OD2-NH1 3.01Å; D287-R460 IonicContact OD2-NH2 3.98Å; D287-R460 PolarHBondContact OD2-NH2 2.9Å
288	V	98.9	Very high	97.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.4	-174.6	-173.1	0	0	0	0	111.6	F283 K286 P308 R310 I311 L312 Y427 V429 L431	F283-V288 HydrophobicContact CD1-CG1 4.1Å; F283-V288 HydrophobicContact CD1-CG2 3.96Å; F283-V288 HydrophobicContact CE1-CG1 4.32Å; K286-V288 HydrophobicContact CB-CG2 4.31Å; V288-P308 HydrophobicContact CB-CB 4.38Å; V288-P308 HydrophobicContact CG2-CB 3.52Å; V288-P308 HydrophobicContact CG2-CG 4.29Å; V288-R310 PolarHBondContact N-O 2.82Å; V288-I311 HydrophobicContact CB-CB 4Å; V288-I311 HydrophobicContact CB-CD1 4.15Å; V288-I311 HydrophobicContact CB-CG1 3.89Å; V288-I311 HydrophobicContact CG1-CD1 3.75Å; V288-I311 HydrophobicContact CG1-CG1 3.92Å; V288-I311 CarbonylContact O-C 3.49Å; V288-I311 VanDerWaalsContact O-CA 3.3Å; V288-I311 WeakPolarHBondContact O-CA 3.3Å; V288-L312 PolarHBondContact O-N 3.26Å; V288-Y427 VanDerWaalsContact C-CD1 3.49Å; V288-V429 WeakPolarHBondContact CA-O 3.48Å; V288-V429 HydrophobicContact CG1-CB 4.29Å; V288-V429 HydrophobicContact CG2-CB 4.29Å; V288-L431 HydrophobicContact CG1-CG 4.49Å
289	L	98.9	Very high	97.3	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.7	172.5	177	68.8	0	0	0	110.1	L291 L312 L314 Y412 Y427 V429 I430 L431 H458	L289-L291 HydrophobicContact CD1-CD2 4.35Å; L289-L291 HydrophobicContact CD2-CD2 3.71Å; L289-L291 HydrophobicContact CD2-CG 4.42Å; L289-L291 HydrophobicContact CG-CD2 3.84Å; L289-L291 HydrophobicContact CG-CG 4.39Å; L289-L312 HydrophobicContact CD1-CB 4.21Å; L289-L312 HydrophobicContact CD1-CD2 4Å; L289-L312 HydrophobicContact CD1-CG 4.08Å; L289-L314 HydrophobicContact CD1-CB 4.33Å; L289-L314 HydrophobicContact CD1-CD1 4.45Å; L289-Y412 HydrophobicContact CD2-CE2 3.95Å; L289-Y427 HydrophobicContact CB-CD1 3.77Å; L289-Y427 HydrophobicContact CB-CD2 4.24Å; L289-Y427 HydrophobicContact CB-CE1 4.07Å; L289-Y427 HydrophobicContact CB-CG 3.89Å; L289-Y427 HydrophobicContact CD2-CD2 4.35Å; L289-V429 PolarHBondContact N-O 3.34Å; L289-I430 HydrophobicContact CB-CG1 4.17Å; L289-I430 HydrophobicContact CD2-CD1 4.21Å; L289-I430 HydrophobicContact CD2-CG1 4.25Å; L289-I430 HydrophobicContact CD2-CG2 4.25Å; L289-I430 CarbonylContact O-C 3.53Å; L289-I430 WeakPolarHBondContact O-CA 3.49Å; L289-L431 PolarHBondContact O-N 2.91Å; L289-H458 WeakPolarHBondContact CD2-CE1 3.33Å; L289-H458 VanDerWaalsContact CD2-ND1 3.29Å; L289-H458 WeakPolarHBondContact CD2-ND1 3.35Å
290	D	98.9	Very high	97.3	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.027	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	102.9	177.1	-176.8	28.7	0	0	0	110.9	C293 T299 L312 L314 L431	D290-C293 HydrophobicContact CB-CB 4.43Å; D290-C293 VanDerWaalsContact OD2-CB 3.24Å; D290-C293 WeakPolarHBondContact OD2-CB 3.35Å; D290-T299 HydrophobicContact CB-CG2 3.83Å; D290-T299 WeakPolarHBondContact OD2-CB 3.19Å; D290-T299 WeakPolarHBondContact OD2-CG2 3.45Å; D290-T299 PolarHBondContact OD2-OG1 2.71Å; D290-L312 PolarHBondContact N-O 3.09Å; D290-L314 PolarHBondContact O-N 3.48Å; D290-L431 HydrophobicContact CB-CD1 4.36Å
291	L	98.8	Very high	97.2	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.5	-180	-57	178.6	0	0	0	110.2	L289 L314 Y412 I430 L431 C432 V435	L289-L291 HydrophobicContact CD1-CD2 4.35Å; L289-L291 HydrophobicContact CD2-CD2 3.71Å; L289-L291 HydrophobicContact CD2-CG 4.42Å; L289-L291 HydrophobicContact CG-CD2 3.84Å; L289-L291 HydrophobicContact CG-CG 4.39Å; L291-L314 HydrophobicContact CD2-CD1 4.38Å; L291-Y412 HydrophobicContact CD1-CD1 3.66Å; L291-Y412 HydrophobicContact CD1-CE1 3.69Å; L291-Y412 HydrophobicContact CD1-CG 4.26Å; L291-Y412 HydrophobicContact CD2-CD1 3.8Å; L291-Y412 HydrophobicContact CD2-CD2 3.58Å; L291-Y412 HydrophobicContact CD2-CE1 4.14Å; L291-Y412 HydrophobicContact CD2-CE2 3.95Å; L291-Y412 HydrophobicContact CD2-CG 3.51Å; L291-Y412 HydrophobicContact CG-CD1 4.39Å; L291-I430 HydrophobicContact CD1-CG2 3.73Å; L291-I430 HydrophobicContact CG-CG2 3.98Å; L291-L431 VanDerWaalsContact CB-O 3.28Å; L291-L431 WeakPolarHBondContact CB-O 3.06Å; L291-L431 WeakPolarHBondContact CG-O 3.27Å; L291-L431 PolarHBondContact N-O 2.85Å; L291-C432 HydrophobicContact CD1-CB 4.35Å; L291-V435 HydrophobicContact CB-CG2 4.43Å; L291-V435 WeakPolarHBondContact O-CG2 3.45Å
292	G	98.3	Very high	97.2	Very high	31 Å²	31	26.8 Å²	26.8	32%	0.32	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	38	-179.5	0	0	0	0	0	113.2	N294 L314	G292-N294 PolarHBondContact O-N 2.66Å; G292-L314 WeakPolarHBondContact CA-O 3.24Å; G292-L314 PolarHBondContact N-O 2.94Å
293	C	98	Very high	97.1	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.007	13%	0.133	C	C	.	.			trans	-57.6	-16.8	-172.2	67.4	0	0	0	0	114.8	Y262 D290 G296 T299 L314 F407	Y262-C293 PolarHBondContact OH-O 2.82Å; D290-C293 HydrophobicContact CB-CB 4.43Å; D290-C293 VanDerWaalsContact OD2-CB 3.24Å; D290-C293 WeakPolarHBondContact OD2-CB 3.35Å; C293-G296 WeakPolarHBondContact O-CA 3.31Å; C293-G296 PolarHBondContact O-N 3.34Å; C293-T299 WeakPolarHBondContact CB-OG1 3.31Å; C293-L314 PolarHBondContact N-O 3.31Å; C293-F407 HydrophobicContact CB-CE1 4.4Å
294	N	97.6	Very high	96.8	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.037	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	-135.8	-177.2	-168.9	-88.5	0	0	0	110.2	Y258 Y261 Y262 G292 G296 D315 L320	Y258-N294 PolarHBondContact O-ND2 3.25Å; Y258-N294 PolarHBondContact O-OD1 3.16Å; Y261-N294 WeakPolarHBondContact CB-OD1 3.44Å; Y262-N294 HydrophobicContact CE2-CB 4.07Å; G292-N294 PolarHBondContact O-N 2.66Å; N294-G296 PolarHBondContact O-N 2.78Å; N294-G296 VanDerWaalsContact O-N 3.16Å; N294-D315 VanDerWaalsContact CA-OD2 3.27Å; N294-D315 WeakPolarHBondContact CA-OD2 3.38Å; N294-D315 PolarHBondContact N-OD2 3.1Å; N294-L320 HydrophobicContact CB-CD1 4.49Å; N294-L320 WeakPolarHBondContact ND2-CD1 3.41Å
295	S	95.4	Very high	96.6	Very high	9 Å²	9	23.3 Å²	23.3	6%	0.063	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	14.6	172.5	58.6	0	0	0	0	114.2	H297 A324 N327	S295-H297 PolarHBondContact O-CD2 3.03Å; S295-H297 PolarHBondContact O-N 3.47Å; S295-H297 PolarHBondContact OG-CD2 3.06Å; S295-H297 PolarHBondContact OG-NE2 3.15Å; S295-A324 WeakPolarHBondContact O-CA 3.35Å; S295-N327 PolarHBondContact O-ND2 2.82Å
296	G	95.7	Very high	96.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.109	C	C	.	.			trans	77.1	10.2	162.9	0	0	0	0	0	117.3	C293 N294 L298 T299 L300	C293-G296 WeakPolarHBondContact O-CA 3.31Å; C293-G296 PolarHBondContact O-N 3.34Å; N294-G296 PolarHBondContact O-N 2.78Å; N294-G296 VanDerWaalsContact O-N 3.16Å; G296-L298 PolarHBondContact O-N 2.91Å; G296-T299 WeakPolarHBondContact CA-OG1 3.39Å; G296-T299 WeakPolarHBondContact O-CB 3.43Å; G296-T299 PolarHBondContact O-N 3.07Å; G296-T299 PolarHBondContact O-OG1 2.85Å; G296-L300 WeakPolarHBondContact O-CB 3.49Å; G296-L300 VanDerWaalsContact O-CG 3.26Å; G296-L300 WeakPolarHBondContact O-CG 3.24Å; G296-L300 PolarHBondContact O-N 3Å
297	H	94.1	Very high	96.4	Very high	89 Å²	89	23.5 Å²	23.5	41%	0.412	11%	0.114	S	C	.	.	H	α-helix	trans	-61.1	-46	-172.5	-65.3	-116.1	0	0	0	112.6	Y262 S295 Y301 N327	Y262-H297 HydrophobicContact CD1-CB 3.87Å; Y262-H297 HydrophobicContact CD2-CB 3.92Å; Y262-H297 AromaticContact CD2-CD2 3.26Å; Y262-H297 WeakPolarHBondContact CD2-CD2 3.34Å; Y262-H297 AromaticContact CD2-CG 3.74Å; Y262-H297 HydrophobicContact CE1-CB 3.91Å; Y262-H297 HydrophobicContact CE2-CB 3.96Å; Y262-H297 AromaticContact CE2-CD2 3.7Å; Y262-H297 HydrophobicContact CG-CB 3.86Å; Y262-H297 AromaticContact CG-CD2 3.8Å; Y262-H297 AromaticContact CG-CG 3.84Å; S295-H297 PolarHBondContact O-CD2 3.03Å; S295-H297 PolarHBondContact O-N 3.47Å; S295-H297 PolarHBondContact OG-CD2 3.06Å; S295-H297 PolarHBondContact OG-NE2 3.15Å; H297-Y301 PolarHBondContact O-N 2.86Å; H297-Y301 VanDerWaalsContact O-N 3.13Å; H297-N327 PolarHBondContact NE2-ND2 3.02Å
298	L	94.8	Very high	96.4	Very high	4 Å²	4	22 Å²	22	2%	0.021	11%	0.106	C	C	.	.	H	α-helix	trans	-67.9	-38.9	175	-178.2	60.9	0	0	0	111.7	Y262 D272 I275 G296 L300 Y301 V302 L433	Y262-L298 HydrophobicContact CE1-CB 4.27Å; D272-L298 HydrophobicContact CB-CD1 4.46Å; I275-L298 HydrophobicContact CG2-CD1 3.55Å; G296-L298 PolarHBondContact O-N 2.91Å; L298-L300 VanDerWaalsContact C-N 3.34Å; L298-L300 PolarHBondContact O-N 2.87Å; L298-Y301 WeakPolarHBondContact O-CB 3.38Å; L298-Y301 PolarHBondContact O-N 2.74Å; L298-V302 HydrophobicContact CD1-CG2 4.34Å; L298-V302 WeakPolarHBondContact O-CG2 3.26Å; L298-V302 PolarHBondContact O-N 2.72Å; L298-L433 HydrophobicContact CD2-CD1 3.5Å; L298-L433 VanDerWaalsContact CD2-CD1 3.5Å
299	T	97.3	Very high	96.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.3	-43.3	177.4	-26.2	0	0	0	0	111.8	D290 C293 G296 A303 I311 F407	D290-T299 HydrophobicContact CB-CG2 3.83Å; D290-T299 WeakPolarHBondContact OD2-CB 3.19Å; D290-T299 WeakPolarHBondContact OD2-CG2 3.45Å; D290-T299 PolarHBondContact OD2-OG1 2.71Å; C293-T299 WeakPolarHBondContact CB-OG1 3.31Å; G296-T299 WeakPolarHBondContact CA-OG1 3.39Å; G296-T299 WeakPolarHBondContact O-CB 3.43Å; G296-T299 PolarHBondContact O-N 3.07Å; G296-T299 PolarHBondContact O-OG1 2.85Å; T299-A303 VanDerWaalsContact O-CB 3.3Å; T299-A303 WeakPolarHBondContact O-CB 3.3Å; T299-A303 PolarHBondContact O-N 3.17Å; T299-I311 HydrophobicContact CG2-CD1 3.74Å; T299-I311 HydrophobicContact CG2-CG1 3.92Å; T299-F407 HydrophobicContact CG2-CE1 3.86Å; T299-F407 HydrophobicContact CG2-CZ 4.17Å
300	L	95.5	Very high	96.2	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-68.7	-38.1	177.2	-68.1	171	0	0	0	112	G296 L298 A303 K304 N327 I328 Y331 F401 V405 F407	G296-L300 WeakPolarHBondContact O-CB 3.49Å; G296-L300 VanDerWaalsContact O-CG 3.26Å; G296-L300 WeakPolarHBondContact O-CG 3.24Å; G296-L300 PolarHBondContact O-N 3Å; L298-L300 VanDerWaalsContact C-N 3.34Å; L298-L300 PolarHBondContact O-N 2.87Å; L300-A303 PolarHBondContact O-N 3.04Å; L300-K304 PolarHBondContact O-N 2.92Å; L300-N327 HydrophobicContact CD1-CB 3.58Å; L300-I328 HydrophobicContact CD2-CG1 3.71Å; L300-Y331 HydrophobicContact CB-CD1 4.29Å; L300-Y331 HydrophobicContact CB-CE1 4.37Å; L300-F401 HydrophobicContact CD2-CE2 3.92Å; L300-F401 HydrophobicContact CD2-CZ 4.06Å; L300-V405 HydrophobicContact CD2-CG1 4.15Å; L300-V405 HydrophobicContact CD2-CG2 4.26Å; L300-F407 HydrophobicContact CD2-CE2 3.98Å; L300-F407 HydrophobicContact CD2-CZ 4.07Å; L300-F407 HydrophobicContact CG-CE2 4.5Å; L300-F407 HydrophobicContact CG-CZ 4.15Å
301	Y	94.3	Very high	96.2	Very high	41 Å²	41	27.1 Å²	27.1	16%	0.161	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-52.7	172.7	-172.8	-76.8	0	0	0	111	E271 I275 H297 L298 A303 K304 M305 F306	E271-Y301 HydrophobicContact CG-CE2 4.1Å; E271-Y301 WeakPolarHBondContact OE1-CE2 3.47Å; E271-Y301 PolarHBondContact OE1-OH 3.18Å; I275-Y301 HydrophobicContact CB-CD1 4.32Å; I275-Y301 HydrophobicContact CB-CE1 3.81Å; I275-Y301 HydrophobicContact CD1-CE1 4.48Å; I275-Y301 WeakPolarHBondContact CD1-OH 3.5Å; I275-Y301 HydrophobicContact CG1-CE1 4.18Å; I275-Y301 HydrophobicContact CG2-CD1 3.63Å; I275-Y301 HydrophobicContact CG2-CE1 3.62Å; I275-Y301 HydrophobicContact CG2-CG 4.13Å; H297-Y301 PolarHBondContact O-N 2.86Å; H297-Y301 VanDerWaalsContact O-N 3.13Å; L298-Y301 WeakPolarHBondContact O-CB 3.38Å; L298-Y301 PolarHBondContact O-N 2.74Å; Y301-A303 VanDerWaalsContact C-N 3.31Å; Y301-A303 PolarHBondContact O-N 2.86Å; Y301-K304 PolarHBondContact O-N 2.86Å; Y301-M305 HydrophobicContact CD1-CB 4.08Å; Y301-M305 HydrophobicContact CD1-CG 3.94Å; Y301-M305 HydrophobicContact CD2-CG 4.21Å; Y301-M305 HydrophobicContact CE1-CB 3.8Å; Y301-M305 HydrophobicContact CE1-CG 3.73Å; Y301-M305 HydrophobicContact CE2-CG 4.04Å; Y301-M305 HydrophobicContact CG-CG 4.17Å; Y301-M305 WeakPolarHBondContact O-CB 3.39Å; Y301-M305 WeakPolarHBondContact O-CG 3.42Å; Y301-M305 PolarHBondContact O-N 2.91Å; Y301-F306 HydrophobicContact CE1-CE1 4.17Å; Y301-F306 HydrophobicContact CE1-CZ 4.13Å
302	V	96.6	Very high	96.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	I	π-helix	trans	-59.6	-42.4	178.2	171.6	0	0	0	0	110.9	F283 L298 K304 F306 R307 P308 I311	F283-V302 HydrophobicContact CB-CG1 4.47Å; F283-V302 HydrophobicContact CD1-CG1 3.8Å; F283-V302 HydrophobicContact CE1-CG1 4.23Å; F283-V302 HydrophobicContact CG-CG1 4.08Å; L298-V302 HydrophobicContact CD1-CG2 4.34Å; L298-V302 WeakPolarHBondContact O-CG2 3.26Å; L298-V302 PolarHBondContact O-N 2.72Å; V302-K304 PolarHBondContact O-N 2.83Å; V302-F306 HydrophobicContact CB-CD2 4.29Å; V302-F306 HydrophobicContact CG1-CB 4.4Å; V302-F306 HydrophobicContact CG1-CD2 4.1Å; V302-F306 HydrophobicContact CG2-CD2 3.94Å; V302-F306 HydrophobicContact CG2-CE2 4.18Å; V302-F306 WeakPolarHBondContact O-CA 3.45Å; V302-F306 PolarHBondContact O-N 2.96Å; V302-R307 PolarHBondContact O-N 2.9Å; V302-P308 HydrophobicContact CG1-CG 4.46Å; V302-P308 VanDerWaalsContact O-CD 3.25Å; V302-P308 WeakPolarHBondContact O-CD 3.47Å; V302-I311 HydrophobicContact CB-CD1 4.12Å; V302-I311 HydrophobicContact CG1-CD1 3.73Å
303	A	96.1	Very high	96.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.12	C	C	.	.	I	π-helix	trans	-58.2	-46.6	177.7	0	0	0	0	0	113.3	T299 L300 Y301 I311 F401 N404 V405	T299-A303 VanDerWaalsContact O-CB 3.3Å; T299-A303 WeakPolarHBondContact O-CB 3.3Å; T299-A303 PolarHBondContact O-N 3.17Å; L300-A303 PolarHBondContact O-N 3.04Å; Y301-A303 VanDerWaalsContact C-N 3.31Å; Y301-A303 PolarHBondContact O-N 2.86Å; A303-I311 HydrophobicContact CB-CG2 3.6Å; A303-F401 HydrophobicContact CB-CD2 3.69Å; A303-F401 HydrophobicContact CB-CE2 3.93Å; A303-N404 PolarHBondContact O-ND2 2.92Å; A303-V405 HydrophobicContact CB-CB 3.76Å; A303-V405 HydrophobicContact CB-CG1 4.19Å; A303-V405 HydrophobicContact CB-CG2 4.26Å
304	K	91.9	Very high	96.3	Very high	50 Å²	50	27 Å²	27	22%	0.217	12%	0.123	C	C	.	.	I	π-helix	trans	-76.9	-54.8	179.9	176.6	-168	169.2	-177.7	0	112.2	L300 Y301 V302 R307 Y331 L335 F401	L300-K304 PolarHBondContact O-N 2.92Å; Y301-K304 PolarHBondContact O-N 2.86Å; V302-K304 PolarHBondContact O-N 2.83Å; K304-R307 WeakPolarHBondContact O-CG 3.1Å; K304-Y331 HydrophobicContact CB-CE1 3.76Å; K304-Y331 HydrophobicContact CD-CD1 4.33Å; K304-Y331 HydrophobicContact CD-CE1 3.44Å; K304-Y331 VanDerWaalsContact CD-CE1 3.44Å; K304-Y331 HydrophobicContact CG-CE1 4.19Å; K304-L335 HydrophobicContact CD-CD1 4.01Å; K304-L335 HydrophobicContact CD-CG 4.46Å; K304-L335 VanDerWaalsContact NZ-CD2 3.27Å; K304-F401 HydrophobicContact CB-CB 4.43Å; K304-F401 HydrophobicContact CB-CD2 4.07Å; K304-F401 HydrophobicContact CB-CG 4.08Å
305	M	93.2	Very high	96.3	Very high	77 Å²	77	27.2 Å²	27.2	38%	0.379	12%	0.124	S	C	.	.	I	π-helix	trans	-80.8	-45.4	-166.7	-57.1	-54.7	-67.1	0	0	111.5	Q280 Y301	Q280-M305 PolarHBondContact NE2-O 3.03Å; Y301-M305 HydrophobicContact CD1-CB 4.08Å; Y301-M305 HydrophobicContact CD1-CG 3.94Å; Y301-M305 HydrophobicContact CD2-CG 4.21Å; Y301-M305 HydrophobicContact CE1-CB 3.8Å; Y301-M305 HydrophobicContact CE1-CG 3.73Å; Y301-M305 HydrophobicContact CE2-CG 4.04Å; Y301-M305 HydrophobicContact CG-CG 4.17Å; Y301-M305 WeakPolarHBondContact O-CB 3.39Å; Y301-M305 WeakPolarHBondContact O-CG 3.42Å; Y301-M305 PolarHBondContact O-N 2.91Å
306	F	96.3	Very high	96.4	Very high	18 Å²	18	28.9 Å²	28.9	8%	0.079	13%	0.132	C	C	.	.	I	π-helix	trans	-90.7	-10	-177.3	-53.5	-24.4	0	0	0	113.9	I275 L278 Q280 F283 R284 Y301 V302	I275-F306 HydrophobicContact CB-CZ 4.47Å; L278-F306 HydrophobicContact CB-CE2 3.85Å; L278-F306 HydrophobicContact CB-CZ 4.38Å; Q280-F306 HydrophobicContact CB-CD1 3.92Å; Q280-F306 HydrophobicContact CB-CE1 4.36Å; Q280-F306 HydrophobicContact CB-CG 4.42Å; Q280-F306 HydrophobicContact CG-CB 4.18Å; Q280-F306 HydrophobicContact CG-CD1 3.95Å; Q280-F306 HydrophobicContact CG-CG 4.36Å; F283-F306 HydrophobicContact CB-CB 3.79Å; F283-F306 HydrophobicContact CD2-CB 4.11Å; F283-F306 AromaticContact CD2-CD2 3.46Å; F283-F306 HydrophobicContact CD2-CD2 3.46Å; F283-F306 VanDerWaalsContact CD2-CD2 3.46Å; F283-F306 HydrophobicContact CD2-CE2 4.18Å; F283-F306 HydrophobicContact CD2-CG 4.12Å; F283-F306 AromaticContact CE2-CD2 3.8Å; F283-F306 HydrophobicContact CE2-CD2 3.8Å; F283-F306 HydrophobicContact CE2-CE2 4.08Å; F283-F306 HydrophobicContact CG-CB 4.18Å; F283-F306 HydrophobicContact CG-CD2 4.08Å; R284-F306 VanDerWaalsContact CA-O 3.32Å; R284-F306 WeakPolarHBondContact CA-O 3.25Å; Y301-F306 HydrophobicContact CE1-CE1 4.17Å; Y301-F306 HydrophobicContact CE1-CZ 4.13Å; V302-F306 HydrophobicContact CB-CD2 4.29Å; V302-F306 HydrophobicContact CG1-CB 4.4Å; V302-F306 HydrophobicContact CG1-CD2 4.1Å; V302-F306 HydrophobicContact CG2-CD2 3.94Å; V302-F306 HydrophobicContact CG2-CE2 4.18Å; V302-F306 WeakPolarHBondContact O-CA 3.45Å; V302-F306 PolarHBondContact O-N 2.96Å
307	R	96.1	Very high	96.5	Very high	123 Å²	123	31 Å²	31	46%	0.464	14%	0.143	S	C	.	.			trans	48.9	57.4	172	-59.3	-169.1	64.5	168.4	-2.9	114.5	G285 V302 K304 G399	G285-R307 PolarHBondContact N-O 2.81Å; V302-R307 PolarHBondContact O-N 2.9Å; K304-R307 WeakPolarHBondContact O-CG 3.1Å; R307-G399 PolarHBondContact NE-O 2.96Å; R307-G399 PolarHBondContact NH2-O 3.4Å
308	P	98	Very high	96.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.145	C	C	.	.			trans	-61.9	147.7	165	30.2	-35.4	0	0	0	111.1	F283 K286 V288 V302 R310 I311 G399 N404	F283-P308 HydrophobicContact CB-CB 4.48Å; F283-P308 WeakPolarHBondContact O-CA 3.14Å; F283-P308 WeakPolarHBondContact O-CB 3.34Å; K286-P308 CarbonylContact O-C 3.44Å; K286-P308 WeakPolarHBondContact O-CB 3.47Å; V288-P308 HydrophobicContact CB-CB 4.38Å; V288-P308 HydrophobicContact CG2-CB 3.52Å; V288-P308 HydrophobicContact CG2-CG 4.29Å; V302-P308 HydrophobicContact CG1-CG 4.46Å; V302-P308 VanDerWaalsContact O-CD 3.25Å; V302-P308 WeakPolarHBondContact O-CD 3.47Å; P308-R310 PolarHBondContact O-N 2.9Å; P308-I311 HydrophobicContact CG-CB 3.85Å; P308-I311 HydrophobicContact CG-CG2 3.89Å; P308-G399 WeakPolarHBondContact O-CA 3.48Å; P308-N404 PolarHBondContact O-ND2 3.16Å
309	A	96.9	Very high	96.7	Very high	29 Å²	29	31.7 Å²	31.7	24%	0.24	17%	0.165	C	C	.	.	S	Bend	trans	-55.9	-40.1	176.2	0	0	0	0	0	110.5	G285 K286 P398 G399	G285-A309 WeakPolarHBondContact O-CB 3.38Å; K286-A309 PolarHBondContact O-N 2.99Å; A309-P398 HydrophobicContact CB-CB 4.38Å; A309-G399 PolarHBondContact O-N 3.08Å; A309-G399 VanDerWaalsContact O-N 3.17Å
310	R	97.4	Very high	96.7	Very high	84 Å²	84	32 Å²	32	32%	0.317	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	139.3	171.5	-178.6	179	61.5	110.2	3.1	110.3	K286 D287 V288 P308 N404 Y427	K286-R310 PolarHBondContact O-N 2.86Å; D287-R310 IonicContact OD1-CZ 3.97Å; D287-R310 IonicContact OD1-NE 3.93Å; D287-R310 PolarHBondContact OD1-NE 3.36Å; D287-R310 IonicContact OD1-NH2 3.44Å; D287-R310 PolarHBondContact OD1-NH2 2.89Å; V288-R310 PolarHBondContact N-O 2.82Å; P308-R310 PolarHBondContact O-N 2.9Å; R310-N404 CarbonylContact C-O 3.49Å; R310-N404 WeakPolarHBondContact CA-O 3.4Å; R310-Y427 PolarHBondContact NH1-OH 2.8Å; R310-Y427 VanDerWaalsContact NH2-CE1 3.33Å
311	I	98.5	Very high	96.8	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	132.6	167.2	-176.5	166.5	0	0	0	111.4	V288 T299 V302 A303 P308 N404 V405 S406	V288-I311 HydrophobicContact CB-CB 4Å; V288-I311 HydrophobicContact CB-CD1 4.15Å; V288-I311 HydrophobicContact CB-CG1 3.89Å; V288-I311 HydrophobicContact CG1-CD1 3.75Å; V288-I311 HydrophobicContact CG1-CG1 3.92Å; V288-I311 CarbonylContact O-C 3.49Å; V288-I311 VanDerWaalsContact O-CA 3.3Å; V288-I311 WeakPolarHBondContact O-CA 3.3Å; T299-I311 HydrophobicContact CG2-CD1 3.74Å; T299-I311 HydrophobicContact CG2-CG1 3.92Å; V302-I311 HydrophobicContact CB-CD1 4.12Å; V302-I311 HydrophobicContact CG1-CD1 3.73Å; A303-I311 HydrophobicContact CB-CG2 3.6Å; P308-I311 HydrophobicContact CG-CB 3.85Å; P308-I311 HydrophobicContact CG-CG2 3.89Å; I311-N404 PolarHBondContact N-O 3.34Å; I311-V405 HydrophobicContact CG2-CB 3.93Å; I311-V405 HydrophobicContact CG2-CG2 4.05Å; I311-V405 WeakPolarHBondContact O-CA 3.31Å; I311-S406 PolarHBondContact O-N 3.41Å; I311-S406 PolarHBondContact O-OG 2.81Å
312	L	98.6	Very high	96.8	Very high	18 Å²	18	35.8 Å²	35.8	9%	0.094	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	111.4	180	178.7	62.4	0	0	0	110.2	V288 L289 D290 S406 I408 Y427	V288-L312 PolarHBondContact O-N 3.26Å; L289-L312 HydrophobicContact CD1-CB 4.21Å; L289-L312 HydrophobicContact CD1-CD2 4Å; L289-L312 HydrophobicContact CD1-CG 4.08Å; D290-L312 PolarHBondContact N-O 3.09Å; L312-S406 WeakPolarHBondContact CA-O 3.23Å; L312-S406 VanDerWaalsContact CD1-OG 3.31Å; L312-S406 WeakPolarHBondContact CD1-OG 3.29Å; L312-I408 HydrophobicContact CD1-CB 4.44Å; L312-I408 HydrophobicContact CD1-CD1 4.19Å; L312-I408 HydrophobicContact CD1-CG1 3.9Å; L312-I408 HydrophobicContact CD1-CG2 3.95Å; L312-I408 HydrophobicContact CD2-CD1 3.96Å; L312-I408 HydrophobicContact CD2-CG1 4.46Å; L312-I408 HydrophobicContact CG-CD1 4.35Å; L312-I408 HydrophobicContact CG-CG1 4.32Å; L312-Y427 HydrophobicContact CB-CE1 4.39Å; L312-Y427 WeakPolarHBondContact CD2-OH 3.3Å
313	G	98.7	Very high	96.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	129.5	169.8	0	0	0	0	0	111.9	S406 F407 I408	G313-S406 PolarHBondContact N-O 3.14Å; G313-F407 CarbonylContact O-C 3.57Å; G313-F407 VanDerWaalsContact O-CA 3.3Å; G313-F407 WeakPolarHBondContact O-CA 3.18Å; G313-I408 PolarHBondContact O-N 2.94Å
314	L	98.6	Very high	96.6	Very high	15 Å²	15	37.3 Å²	37.3	8%	0.079	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.9	-179.2	-175.4	161.9	0	0	0	110.2	L289 D290 L291 G292 C293 I408 A410 Y412	L289-L314 HydrophobicContact CD1-CB 4.33Å; L289-L314 HydrophobicContact CD1-CD1 4.45Å; D290-L314 PolarHBondContact O-N 3.48Å; L291-L314 HydrophobicContact CD2-CD1 4.38Å; G292-L314 WeakPolarHBondContact CA-O 3.24Å; G292-L314 PolarHBondContact N-O 2.94Å; C293-L314 PolarHBondContact N-O 3.31Å; L314-I408 HydrophobicContact CB-CG1 4.36Å; L314-I408 HydrophobicContact CD1-CD1 4.33Å; L314-I408 HydrophobicContact CG-CG1 4.34Å; L314-A410 HydrophobicContact CD1-CB 4.14Å; L314-A410 HydrophobicContact CD2-CB 4.38Å; L314-A410 WeakPolarHBondContact CD2-O 3.38Å; L314-A410 HydrophobicContact CG-CB 4.1Å; L314-Y412 HydrophobicContact CD1-CD2 3.98Å
315	D	98.7	Very high	96.7	Very high	11 Å²	11	40.9 Å²	40.9	6%	0.059	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	157.4	172.3	-160	-68.8	0	0	0	110.4	N294 D317 I321 I408 K409 A410	N294-D315 VanDerWaalsContact CA-OD2 3.27Å; N294-D315 WeakPolarHBondContact CA-OD2 3.38Å; N294-D315 PolarHBondContact N-OD2 3.1Å; D315-D317 PolarHBondContact OD1-N 3.17Å; D315-I321 HydrophobicContact CB-CD1 3.74Å; D315-I321 HydrophobicContact CB-CG1 4Å; D315-I408 PolarHBondContact N-O 2.58Å; D315-K409 CarbonylContact O-C 3.59Å; D315-K409 VanDerWaalsContact O-CA 3.26Å; D315-K409 WeakPolarHBondContact O-CA 3.45Å; D315-A410 CarbonylContact C-O 3.06Å; D315-A410 PolarHBondContact O-N 3.45Å
316	I	97.6	Very high	96.5	Very high	44 Å²	44	41.4 Å²	41.4	23%	0.226	21%	0.21	C	C	.	.	S	Bend	trans	-81	-24.7	179.1	-164.2	166.9	0	0	0	112.2	Y255 K409 A410 N411 W443	Y255-I316 HydrophobicContact CD1-CD1 4.28Å; Y255-I316 HydrophobicContact CD2-CD1 4.39Å; Y255-I316 HydrophobicContact CD2-CG2 4.07Å; Y255-I316 HydrophobicContact CE1-CD1 4.22Å; Y255-I316 HydrophobicContact CE2-CD1 4.32Å; Y255-I316 HydrophobicContact CG-CD1 4.37Å; Y255-I316 HydrophobicContact CG-CG2 4.03Å; I316-K409 WeakPolarHBondContact O-CE 3.45Å; I316-A410 WeakPolarHBondContact CA-O 3.37Å; I316-N411 HydrophobicContact CD1-CB 4.21Å; I316-W443 HydrophobicContact CD1-CH2 3.89Å; I316-W443 HydrophobicContact CD1-CZ2 4.21Å
317	D	97.6	Very high	96.2	Very high	44 Å²	44	42.1 Å²	42.1	24%	0.235	22%	0.215	C	C	.	.			trans	-93.1	115.1	-176.2	-165.2	-47.4	0	0	0	112.2	N257 D315 G319 L320 I321	N257-D317 HydrophobicContact CB-CB 4Å; N257-D317 PolarHBondContact ND2-OD2 3.24Å; D315-D317 PolarHBondContact OD1-N 3.17Å; D317-G319 PolarHBondContact O-N 2.86Å; D317-G319 WeakPolarHBondContact OD1-CA 3.37Å; D317-G319 PolarHBondContact OD1-N 3.25Å; D317-L320 HydrophobicContact CB-CB 4.12Å; D317-L320 HydrophobicContact CB-CD1 3.83Å; D317-L320 HydrophobicContact CB-CG 3.82Å; D317-L320 PolarHBondContact O-N 3.42Å; D317-L320 VanDerWaalsContact O-N 3.15Å; D317-L320 PolarHBondContact OD1-N 3.24Å; D317-I321 PolarHBondContact O-N 2.69Å
318	S	96.7	Very high	95.9	Very high	65 Å²	65	37 Å²	37	46%	0.455	20%	0.197	S	C	.	.	H	α-helix	trans	-63	-25.8	177.9	26.4	0	0	0	0	113.9	H322	S318-H322 VanDerWaalsContact O-CB 3.28Å; S318-H322 WeakPolarHBondContact O-CB 3.46Å; S318-H322 PolarHBondContact O-N 2.97Å
319	G	96.3	Very high	95.1	Very high	42 Å²	42	41.8 Å²	41.8	43%	0.433	22%	0.215	S	C	.	.	H	α-helix	trans	-72.1	-37.8	174.3	0	0	0	0	0	112.3	D317 H322 A323	D317-G319 PolarHBondContact O-N 2.86Å; D317-G319 WeakPolarHBondContact OD1-CA 3.37Å; D317-G319 PolarHBondContact OD1-N 3.25Å; G319-H322 PolarHBondContact O-N 3.27Å; G319-A323 PolarHBondContact O-N 2.9Å
320	L	96.6	Very high	94.1	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.037	23%	0.23	C	C	.	.	H	α-helix	trans	-68.4	-43.8	174.1	-63	-179	0	0	0	111.4	N257 N259 N294 D317 H322 A323 A324	N257-L320 HydrophobicContact CB-CD1 3.72Å; N259-L320 HydrophobicContact CB-CD2 4.34Å; N294-L320 HydrophobicContact CB-CD1 4.49Å; N294-L320 WeakPolarHBondContact ND2-CD1 3.41Å; D317-L320 HydrophobicContact CB-CB 4.12Å; D317-L320 HydrophobicContact CB-CD1 3.83Å; D317-L320 HydrophobicContact CB-CG 3.82Å; D317-L320 PolarHBondContact O-N 3.42Å; D317-L320 VanDerWaalsContact O-N 3.15Å; D317-L320 PolarHBondContact OD1-N 3.24Å; L320-H322 VanDerWaalsContact C-N 3.32Å; L320-H322 PolarHBondContact O-N 3Å; L320-A323 CarbonylContact O-C 3.58Å; L320-A323 WeakPolarHBondContact O-CA 3.39Å; L320-A323 WeakPolarHBondContact O-CB 3.45Å; L320-A323 PolarHBondContact O-N 3.36Å; L320-A323 VanDerWaalsContact O-N 3.1Å; L320-A324 PolarHBondContact O-N 2.87Å
321	I	97.3	Very high	93.3	Very high	5 Å²	5	45 Å²	45	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-38.3	174.1	-66.6	-62.8	0	0	0	112.1	D315 D317 A323 A324 R325 F407 I408 K409	D315-I321 HydrophobicContact CB-CD1 3.74Å; D315-I321 HydrophobicContact CB-CG1 4Å; D317-I321 PolarHBondContact O-N 2.69Å; I321-A323 VanDerWaalsContact C-N 3.34Å; I321-A324 PolarHBondContact O-N 2.96Å; I321-R325 WeakPolarHBondContact O-CG 3.34Å; I321-R325 PolarHBondContact O-N 2.9Å; I321-F407 HydrophobicContact CD1-CB 4.2Å; I321-F407 HydrophobicContact CG2-CB 4.19Å; I321-I408 WeakPolarHBondContact CD1-O 3.2Å; I321-I408 WeakPolarHBondContact CG1-O 3.4Å; I321-K409 HydrophobicContact CG1-CB 4.26Å
322	H	94.9	Very high	92.3	Very high	120 Å²	120	46.1 Å²	46.1	56%	0.556	23%	0.232	S	C	*	.	H	α-helix	trans	-66.5	-35	173.4	-175.8	74.5	0	0	0	112.4	S318 G319 L320 K326	S318-H322 VanDerWaalsContact O-CB 3.28Å; S318-H322 WeakPolarHBondContact O-CB 3.46Å; S318-H322 PolarHBondContact O-N 2.97Å; G319-H322 PolarHBondContact O-N 3.27Å; L320-H322 VanDerWaalsContact C-N 3.32Å; L320-H322 PolarHBondContact O-N 3Å; H322-K326 WeakPolarHBondContact O-CG 3.46Å; H322-K326 PolarHBondContact O-N 3.03Å
323	A	94.2	Very high	91.2	Very high	32 Å²	32	46.1 Å²	46.1	26%	0.264	23%	0.233	S	C	.	.	H	α-helix	trans	-67.8	-44.6	172	0	0	0	0	0	112	G319 L320 I321 R325 K326 N327	G319-A323 PolarHBondContact O-N 2.9Å; L320-A323 CarbonylContact O-C 3.58Å; L320-A323 WeakPolarHBondContact O-CA 3.39Å; L320-A323 WeakPolarHBondContact O-CB 3.45Å; L320-A323 PolarHBondContact O-N 3.36Å; L320-A323 VanDerWaalsContact O-N 3.1Å; I321-A323 VanDerWaalsContact C-N 3.34Å; A323-R325 PolarHBondContact O-N 3.1Å; A323-K326 CarbonylContact O-C 3.51Å; A323-K326 WeakPolarHBondContact O-CA 3.37Å; A323-K326 WeakPolarHBondContact O-CB 3.31Å; A323-K326 PolarHBondContact O-N 3.04Å; A323-N327 WeakPolarHBondContact O-CB 3.17Å; A323-N327 VanDerWaalsContact O-CG 3.27Å; A323-N327 PolarHBondContact O-N 3.24Å; A323-N327 PolarHBondContact O-OD1 3.45Å
324	A	94.1	Very high	90	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-44.7	176.9	0	0	0	0	0	112.2	S295 L320 I321 K326 N327 I328 F407	S295-A324 WeakPolarHBondContact O-CA 3.35Å; L320-A324 PolarHBondContact O-N 2.87Å; I321-A324 PolarHBondContact O-N 2.96Å; A324-K326 VanDerWaalsContact C-N 3.29Å; A324-K326 PolarHBondContact O-N 2.79Å; A324-N327 WeakPolarHBondContact O-CB 3.21Å; A324-N327 PolarHBondContact O-N 2.75Å; A324-N327 VanDerWaalsContact O-N 3.14Å; A324-I328 PolarHBondContact O-N 3.35Å; A324-F407 HydrophobicContact CB-CD1 3.7Å; A324-F407 HydrophobicContact CB-CD2 4.02Å; A324-F407 HydrophobicContact CB-CE1 3.74Å; A324-F407 HydrophobicContact CB-CE2 4.05Å; A324-F407 HydrophobicContact CB-CG 3.85Å; A324-F407 HydrophobicContact CB-CZ 3.93Å
325	R	93.6	Very high	88.6	Confident	124 Å²	124	51.7 Å²	51.7	47%	0.468	26%	0.26	S	S	.	.	H	α-helix	trans	-65.1	-27.5	174.1	-67.5	174.7	-176.5	-174.5	-0.5	113.6	I321 A323 F407	I321-R325 WeakPolarHBondContact O-CG 3.34Å; I321-R325 PolarHBondContact O-N 2.9Å; A323-R325 PolarHBondContact O-N 3.1Å; R325-F407 HydrophobicContact CG-CB 4.03Å; R325-F407 HydrophobicContact CG-CD2 4.31Å; R325-F407 PolarHBondContact NE-O 3.37Å; R325-F407 VanDerWaalsContact NE-O 3.13Å; R325-F407 PolarHBondContact NH2-O 3.41Å
326	K	90.6	Very high	87.4	Confident	89 Å²	89	54.7 Å²	54.7	39%	0.387	27%	0.273	S	S	.	.	H	α-helix	trans	-75.1	-39.7	169.8	-81	173.6	164.7	168.2	0	111.7	H322 A323 A324 I328 R329 H330	H322-K326 WeakPolarHBondContact O-CG 3.46Å; H322-K326 PolarHBondContact O-N 3.03Å; A323-K326 CarbonylContact O-C 3.51Å; A323-K326 WeakPolarHBondContact O-CA 3.37Å; A323-K326 WeakPolarHBondContact O-CB 3.31Å; A323-K326 PolarHBondContact O-N 3.04Å; A324-K326 VanDerWaalsContact C-N 3.29Å; A324-K326 PolarHBondContact O-N 2.79Å; K326-I328 PolarHBondContact O-N 3.29Å; K326-R329 PolarHBondContact O-N 3.39Å; K326-H330 PolarHBondContact O-CD2 3.11Å; K326-H330 PolarHBondContact O-N 3.12Å
327	N	90.2	Very high	86.2	Confident	32 Å²	32	53 Å²	53	17%	0.171	27%	0.265	C	S	.	.	H	α-helix	trans	-61.8	-27.3	-179.5	-73.3	-8.4	0	0	0	113	S295 H297 L300 A323 A324 R329 H330 Y331	S295-N327 PolarHBondContact O-ND2 2.82Å; H297-N327 PolarHBondContact NE2-ND2 3.02Å; L300-N327 HydrophobicContact CD1-CB 3.58Å; A323-N327 WeakPolarHBondContact O-CB 3.17Å; A323-N327 VanDerWaalsContact O-CG 3.27Å; A323-N327 PolarHBondContact O-N 3.24Å; A323-N327 PolarHBondContact O-OD1 3.45Å; A324-N327 WeakPolarHBondContact O-CB 3.21Å; A324-N327 PolarHBondContact O-N 2.75Å; A324-N327 VanDerWaalsContact O-N 3.14Å; N327-R329 VanDerWaalsContact C-N 3.3Å; N327-R329 PolarHBondContact O-N 3.38Å; N327-H330 PolarHBondContact O-N 3.04Å; N327-Y331 VanDerWaalsContact O-CB 3.3Å; N327-Y331 WeakPolarHBondContact O-CB 3.39Å; N327-Y331 PolarHBondContact O-N 2.91Å
328	I	89.3	Confident	85	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.082	28%	0.277	C	S	.	.	H	α-helix	trans	-50.1	-50.7	168	-61.6	168.2	0	0	0	110.9	L300 A324 K326 Y331 L332 P402 F407	L300-I328 HydrophobicContact CD2-CG1 3.71Å; A324-I328 PolarHBondContact O-N 3.35Å; K326-I328 PolarHBondContact O-N 3.29Å; I328-Y331 PolarHBondContact O-N 2.82Å; I328-L332 HydrophobicContact CG2-CD1 4.08Å; I328-L332 WeakPolarHBondContact O-CG 3.45Å; I328-L332 PolarHBondContact O-N 3.11Å; I328-P402 HydrophobicContact CG2-CB 3.76Å; I328-F407 HydrophobicContact CD1-CD2 4.14Å; I328-F407 HydrophobicContact CD1-CE2 4.09Å; I328-F407 HydrophobicContact CG1-CE2 4.1Å
329	R	80.8	Confident	84	Confident	101 Å²	101	57.6 Å²	57.6	38%	0.381	28%	0.278	S	S	.	.	H	α-helix	trans	-69.1	-38.2	-178	-76.5	-179.4	-79.7	161.2	-11.5	113	K326 N327 Y331 L332 S333 I390	K326-R329 PolarHBondContact O-N 3.39Å; N327-R329 VanDerWaalsContact C-N 3.3Å; N327-R329 PolarHBondContact O-N 3.38Å; R329-Y331 VanDerWaalsContact C-N 3.33Å; R329-L332 PolarHBondContact O-N 2.83Å; R329-S333 WeakPolarHBondContact O-CB 3.31Å; R329-S333 PolarHBondContact O-N 3.27Å; R329-I390 HydrophobicContact CG-CD1 3.88Å; R329-I390 HydrophobicContact CG-CG1 4.04Å
330	H	76.8	Confident	82.9	Confident	121 Å²	121	55.8 Å²	55.8	56%	0.56	26%	0.259	S	S	*	.	H	α-helix	trans	-62.8	-42.3	173.2	-66.7	-65.9	0	0	0	111.1	K326 N327 L332 S333 E334	K326-H330 PolarHBondContact O-CD2 3.11Å; K326-H330 PolarHBondContact O-N 3.12Å; N327-H330 PolarHBondContact O-N 3.04Å; H330-L332 PolarHBondContact O-N 3.38Å; H330-S333 WeakPolarHBondContact O-CB 3.39Å; H330-S333 PolarHBondContact O-N 3.07Å; H330-S333 VanDerWaalsContact O-N 3.15Å; H330-E334 WeakPolarHBondContact O-CG 3.36Å; H330-E334 PolarHBondContact O-N 3.08Å
331	Y	78.9	Confident	81.8	Confident	60 Å²	60	61.6 Å²	61.6	24%	0.235	28%	0.28	C	S	.	.	H	α-helix	trans	-68	-33.1	-179.7	-155.9	-121	0	0	0	113.1	L300 K304 N327 I328 R329 L335 F401	L300-Y331 HydrophobicContact CB-CD1 4.29Å; L300-Y331 HydrophobicContact CB-CE1 4.37Å; K304-Y331 HydrophobicContact CB-CE1 3.76Å; K304-Y331 HydrophobicContact CD-CD1 4.33Å; K304-Y331 HydrophobicContact CD-CE1 3.44Å; K304-Y331 VanDerWaalsContact CD-CE1 3.44Å; K304-Y331 HydrophobicContact CG-CE1 4.19Å; N327-Y331 VanDerWaalsContact O-CB 3.3Å; N327-Y331 WeakPolarHBondContact O-CB 3.39Å; N327-Y331 PolarHBondContact O-N 2.91Å; I328-Y331 PolarHBondContact O-N 2.82Å; R329-Y331 VanDerWaalsContact C-N 3.33Å; Y331-L335 WeakPolarHBondContact O-CB 3.3Å; Y331-L335 PolarHBondContact O-N 3.1Å; Y331-L335 VanDerWaalsContact O-N 3.15Å; Y331-F401 AromaticContact CD1-CE1 3.89Å; Y331-F401 HydrophobicContact CD1-CE1 3.89Å; Y331-F401 HydrophobicContact CD1-CE2 4.32Å; Y331-F401 AromaticContact CD1-CZ 3.6Å; Y331-F401 HydrophobicContact CD1-CZ 3.6Å; Y331-F401 HydrophobicContact CE1-CZ 4.33Å
332	L	78.9	Confident	80.6	Confident	22 Å²	22	67.8 Å²	67.8	12%	0.115	31%	0.309	C	S	.	.	H	α-helix	trans	-68.6	-38.5	169.3	-67.2	166.6	0	0	0	112.4	I328 R329 H330 L335 Q336 P388 F401 P402	I328-L332 HydrophobicContact CG2-CD1 4.08Å; I328-L332 WeakPolarHBondContact O-CG 3.45Å; I328-L332 PolarHBondContact O-N 3.11Å; R329-L332 PolarHBondContact O-N 2.83Å; H330-L332 PolarHBondContact O-N 3.38Å; L332-L335 WeakPolarHBondContact O-CB 3.46Å; L332-L335 PolarHBondContact O-N 3.18Å; L332-Q336 WeakPolarHBondContact O-CG 3.34Å; L332-Q336 PolarHBondContact O-N 2.9Å; L332-P388 HydrophobicContact CB-CB 3.98Å; L332-P388 HydrophobicContact CB-CG 3.99Å; L332-P388 HydrophobicContact CD1-CB 4.19Å; L332-F401 HydrophobicContact CD2-CD1 3.98Å; L332-F401 HydrophobicContact CD2-CE1 3.69Å; L332-F401 HydrophobicContact CG-CE1 4.09Å; L332-P402 HydrophobicContact CD1-CB 4.3Å; L332-P402 HydrophobicContact CD1-CG 4.06Å; L332-P402 HydrophobicContact CD2-CB 4.46Å; L332-P402 HydrophobicContact CD2-CG 4.31Å
333	S	74.9	Confident	79.6	Confident	19 Å²	19	67.4 Å²	67.4	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-44.3	177.1	-176.7	0	0	0	0	112.2	R329 H330 L335 T337 P384	R329-S333 WeakPolarHBondContact O-CB 3.31Å; R329-S333 PolarHBondContact O-N 3.27Å; H330-S333 WeakPolarHBondContact O-CB 3.39Å; H330-S333 PolarHBondContact O-N 3.07Å; H330-S333 VanDerWaalsContact O-N 3.15Å; S333-L335 VanDerWaalsContact C-N 3.32Å; S333-T337 WeakPolarHBondContact O-CB 3.34Å; S333-T337 PolarHBondContact O-N 3.01Å; S333-T337 VanDerWaalsContact O-N 3.15Å; S333-T337 PolarHBondContact O-OG1 3.31Å; S333-P384 WeakPolarHBondContact OG-CD 3.45Å
334	E	72.8	Confident	78.6	Confident	105 Å²	105	67.6 Å²	67.6	49%	0.491	31%	0.309	S	S	.	.	H	α-helix	trans	-62.7	-40.1	174.2	-68.7	-59.5	128.1	0	0	111.1	H330 T337 Q338	H330-E334 WeakPolarHBondContact O-CG 3.36Å; H330-E334 PolarHBondContact O-N 3.08Å; E334-T337 CarbonylContact O-C 3.26Å; E334-T337 WeakPolarHBondContact O-CB 3.44Å; E334-T337 PolarHBondContact O-N 3.04Å; E334-Q338 WeakPolarHBondContact O-CG 3.36Å; E334-Q338 PolarHBondContact O-N 2.94Å
335	L	69.8	Low	77.6	Confident	27 Å²	27	70 Å²	70	14%	0.141	33%	0.329	C	S	.	.	H	α-helix	trans	-56.6	-56.6	175.3	-106.7	172	0	0	0	112.4	K304 Y331 L332 S333 T337 Q338 E339	K304-L335 HydrophobicContact CD-CD1 4.01Å; K304-L335 HydrophobicContact CD-CG 4.46Å; K304-L335 VanDerWaalsContact NZ-CD2 3.27Å; Y331-L335 WeakPolarHBondContact O-CB 3.3Å; Y331-L335 PolarHBondContact O-N 3.1Å; Y331-L335 VanDerWaalsContact O-N 3.15Å; L332-L335 WeakPolarHBondContact O-CB 3.46Å; L332-L335 PolarHBondContact O-N 3.18Å; S333-L335 VanDerWaalsContact C-N 3.32Å; L335-T337 PolarHBondContact O-N 3.5Å; L335-T337 VanDerWaalsContact O-N 3.11Å; L335-Q338 WeakPolarHBondContact O-CA 3.42Å; L335-Q338 WeakPolarHBondContact O-CB 3.43Å; L335-Q338 PolarHBondContact O-N 3.28Å; L335-E339 WeakPolarHBondContact O-CG 3.47Å; L335-E339 PolarHBondContact O-N 2.86Å
336	Q	74	Confident	76.4	Confident	73 Å²	73	66.8 Å²	66.8	34%	0.341	32%	0.323	S	S	.	.	H	α-helix	trans	-59.4	-26.9	178.2	-70.2	176.5	-12.7	0	0	112.7	L332 E339 A340	L332-Q336 WeakPolarHBondContact O-CG 3.34Å; L332-Q336 PolarHBondContact O-N 2.9Å; Q336-E339 WeakPolarHBondContact CA-OE2 3.43Å; Q336-A340 VanDerWaalsContact O-CB 3.27Å; Q336-A340 WeakPolarHBondContact O-CB 3.24Å; Q336-A340 PolarHBondContact O-N 3.42Å; Q336-A340 VanDerWaalsContact O-N 3.12Å
337	T	72.7	Confident	75	Confident	9 Å²	9	69.3 Å²	69.3	6%	0.055	34%	0.336	C	S	.	.	H	α-helix	trans	-79.5	-31.5	176.4	-53.9	0	0	0	0	111.9	S333 E334 L335 R341 I380	S333-T337 WeakPolarHBondContact O-CB 3.34Å; S333-T337 PolarHBondContact O-N 3.01Å; S333-T337 VanDerWaalsContact O-N 3.15Å; S333-T337 PolarHBondContact O-OG1 3.31Å; E334-T337 CarbonylContact O-C 3.26Å; E334-T337 WeakPolarHBondContact O-CB 3.44Å; E334-T337 PolarHBondContact O-N 3.04Å; L335-T337 PolarHBondContact O-N 3.5Å; L335-T337 VanDerWaalsContact O-N 3.11Å; T337-R341 WeakPolarHBondContact O-CB 3.41Å; T337-R341 WeakPolarHBondContact O-CD 3.47Å; T337-R341 WeakPolarHBondContact O-CG 3.26Å; T337-R341 PolarHBondContact O-N 3.06Å; T337-I380 HydrophobicContact CG2-CB 4.41Å; T337-I380 HydrophobicContact CG2-CG1 3.78Å
338	Q	71.5	Confident	73.6	Confident	105 Å²	105	76.4 Å²	76.4	49%	0.491	36%	0.361	S	S	.	.	H	α-helix	trans	-72.9	-44.3	171.7	-71.8	172.9	-11.3	0	0	111.3	E334 L335 R341 H342	E334-Q338 WeakPolarHBondContact O-CG 3.36Å; E334-Q338 PolarHBondContact O-N 2.94Å; L335-Q338 WeakPolarHBondContact O-CA 3.42Å; L335-Q338 WeakPolarHBondContact O-CB 3.43Å; L335-Q338 PolarHBondContact O-N 3.28Å; Q338-R341 PolarHBondContact O-N 3.34Å; Q338-H342 PolarHBondContact O-N 2.99Å
339	E	75.5	Confident	71.9	Confident	100 Å²	100	82.8 Å²	82.8	47%	0.467	39%	0.39	S	S	.	.	H	α-helix	trans	-59.2	-54.1	177.2	-69.9	160.6	168.3	0	0	110.6	L335 Q336 R341 H342 E343	L335-E339 WeakPolarHBondContact O-CG 3.47Å; L335-E339 PolarHBondContact O-N 2.86Å; Q336-E339 WeakPolarHBondContact CA-OE2 3.43Å; E339-R341 PolarHBondContact O-N 3.17Å; E339-H342 WeakPolarHBondContact O-CB 3.41Å; E339-H342 PolarHBondContact O-N 2.94Å; E339-E343 WeakPolarHBondContact O-CG 3.33Å; E339-E343 PolarHBondContact O-N 3.04Å
340	A	73.1	Confident	70.4	Confident	4 Å²	4	83.6 Å²	83.6	3%	0.033	40%	0.402	C	S	.	.	H	α-helix	trans	-64.5	-23.4	178.1	0	0	0	0	0	114.3	Q336 A344 V376	Q336-A340 VanDerWaalsContact O-CB 3.27Å; Q336-A340 WeakPolarHBondContact O-CB 3.24Å; Q336-A340 PolarHBondContact O-N 3.42Å; Q336-A340 VanDerWaalsContact O-N 3.12Å; A340-A344 VanDerWaalsContact O-CB 3.29Å; A340-A344 WeakPolarHBondContact O-CB 3.42Å; A340-A344 PolarHBondContact O-N 3.08Å; A340-V376 HydrophobicContact CB-CG1 4.02Å
341	R	74.8	Confident	69	Low	129 Å²	129	81.1 Å²	81.1	49%	0.487	41%	0.409	S	S	.	.	H	α-helix	trans	-74.3	-36.6	170.4	-79.5	171.1	-172.5	170.6	6.6	111.9	T337 Q338 E339 A345 I380	T337-R341 WeakPolarHBondContact O-CB 3.41Å; T337-R341 WeakPolarHBondContact O-CD 3.47Å; T337-R341 WeakPolarHBondContact O-CG 3.26Å; T337-R341 PolarHBondContact O-N 3.06Å; Q338-R341 PolarHBondContact O-N 3.34Å; E339-R341 PolarHBondContact O-N 3.17Å; R341-A345 WeakPolarHBondContact O-CB 3.41Å; R341-A345 PolarHBondContact O-N 3.43Å; R341-I380 HydrophobicContact CG-CD1 4.09Å
342	H	72.3	Confident	67.4	Low	135 Å²	135	87 Å²	87	63%	0.625	44%	0.436	S	S	*	.	H	α-helix	trans	-70.1	-45.1	177	-165.5	-57.1	0	0	0	111	Q338 E339 A344 A345 T346	Q338-H342 PolarHBondContact O-N 2.99Å; E339-H342 WeakPolarHBondContact O-CB 3.41Å; E339-H342 PolarHBondContact O-N 2.94Å; H342-A344 VanDerWaalsContact C-N 3.34Å; H342-A344 PolarHBondContact O-N 3.39Å; H342-A345 WeakPolarHBondContact O-CB 3.45Å; H342-A345 PolarHBondContact O-N 2.82Å; H342-T346 PolarHBondContact ND1-OG1 3.11Å; H342-T346 PolarHBondContact O-N 2.75Å; H342-T346 PolarHBondContact O-OG1 3.12Å
343	E	73.6	Confident	65.6	Low	113 Å²	113	91.8 Å²	91.8	53%	0.528	47%	0.466	S	S	.	.	H	α-helix	trans	-54.5	-49.4	173.7	-68.6	169.2	172.2	0	0	111.3	E339 A345 T346 Q347	E339-E343 WeakPolarHBondContact O-CG 3.33Å; E339-E343 PolarHBondContact O-N 3.04Å; E343-A345 VanDerWaalsContact C-N 3.25Å; E343-A345 PolarHBondContact O-N 3.34Å; E343-T346 PolarHBondContact O-N 3.46Å; E343-Q347 WeakPolarHBondContact O-CG 3.5Å; E343-Q347 PolarHBondContact O-N 3.39Å
344	A	73.3	Confident	64.1	Low	36 Å²	36	99.7 Å²	99.7	30%	0.298	50%	0.501	S	S	.	.	H	α-helix	trans	-68.8	-18.5	177.9	0	0	0	0	0	114.2	A340 H342 R348	A340-A344 VanDerWaalsContact O-CB 3.29Å; A340-A344 WeakPolarHBondContact O-CB 3.42Å; A340-A344 PolarHBondContact O-N 3.08Å; H342-A344 VanDerWaalsContact C-N 3.34Å; H342-A344 PolarHBondContact O-N 3.39Å; A344-R348 WeakPolarHBondContact O-CD 3.5Å; A344-R348 VanDerWaalsContact O-CG 3.3Å; A344-R348 WeakPolarHBondContact O-CG 3.26Å
345	A	72.2	Confident	62.4	Low	51 Å²	51	104.3 Å²	104.3	42%	0.421	52%	0.523	S	S	.	.	H	α-helix	trans	-82.1	-43.9	173	0	0	0	0	0	111.4	R341 H342 E343 R348 Q349	R341-A345 WeakPolarHBondContact O-CB 3.41Å; R341-A345 PolarHBondContact O-N 3.43Å; H342-A345 WeakPolarHBondContact O-CB 3.45Å; H342-A345 PolarHBondContact O-N 2.82Å; E343-A345 VanDerWaalsContact C-N 3.25Å; E343-A345 PolarHBondContact O-N 3.34Å; A345-R348 PolarHBondContact O-N 3.2Å; A345-Q349 PolarHBondContact O-N 3.22Å
346	T	68.1	Low	60.9	Low	55 Å²	55	110.7 Å²	110.7	34%	0.337	55%	0.554	S	S	.	*	H	α-helix	trans	-61.5	-46.9	175.9	-56.2	0	0	0	0	111.2	H342 E343 R348 Q349 D350	H342-T346 PolarHBondContact ND1-OG1 3.11Å; H342-T346 PolarHBondContact O-N 2.75Å; H342-T346 PolarHBondContact O-OG1 3.12Å; E343-T346 PolarHBondContact O-N 3.46Å; T346-R348 PolarHBondContact O-N 2.87Å; T346-Q349 PolarHBondContact O-N 3.05Å; T346-D350 PolarHBondContact O-N 3.44Å
347	Q	62.7	Low	59.2	Low	143 Å²	143	114.8 Å²	114.8	67%	0.668	57%	0.573	S	S	*	*	H	α-helix	trans	-58.8	-24	176.8	-71.9	173.7	-2.6	0	0	113.9	E343	E343-Q347 WeakPolarHBondContact O-CG 3.5Å; E343-Q347 PolarHBondContact O-N 3.39Å
348	R	59.3	Low	57.5	Low	181 Å²	181	120.8 Å²	120.8	68%	0.683	60%	0.6	S	S	*	*	H	α-helix	trans	-84.7	-8.7	175.4	-75	175.2	172.3	-160.6	-3.7	114	A344 A345 T346	A344-R348 WeakPolarHBondContact O-CD 3.5Å; A344-R348 VanDerWaalsContact O-CG 3.3Å; A344-R348 WeakPolarHBondContact O-CG 3.26Å; A345-R348 PolarHBondContact O-N 3.2Å; T346-R348 PolarHBondContact O-N 2.87Å
349	Q	53.5	Low	55.8	Low	150 Å²	150	124.3 Å²	124.3	70%	0.701	61%	0.614	S	S	*	*	H	α-helix	trans	-97.4	-40.4	175.9	-69.8	-174.9	-32.9	0	0	111.6	A345 T346	A345-Q349 PolarHBondContact O-N 3.22Å; T346-Q349 PolarHBondContact O-N 3.05Å
350	D	50.3	Low	53.9	Low	118 Å²	118	128.2 Å²	128.2	63%	0.631	63%	0.632	S	S	*	*	H	α-helix	trans	-69.1	-34.6	177.9	-60.5	-39.9	0	0	0	112.4	T346 K352	T346-D350 PolarHBondContact O-N 3.44Å; D350-K352 PolarHBondContact O-N 3.18Å
351	G	48	Very low	51.9	Low	69 Å²	69	132 Å²	132	71%	0.711	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	38	178.7	0	0	0	0	0	115.6
352	K	45	Very low	49.8	Very low	182 Å²	182	133 Å²	133	79%	0.791	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	5.8	-178	-95.4	-165.5	172.1	-168.2	0	116	D350	D350-K352 PolarHBondContact O-N 3.18Å
353	T	40.3	Very low	48	Very low	123 Å²	123	131.1 Å²	131.1	76%	0.755	68%	0.68	S	S	*	*	S	Bend	trans	-113.4	-17.9	-172.5	-47.6	0	0	0	0	114
354	E	43.3	Very low	47.1	Very low	185 Å²	185	131.7 Å²	131.7	86%	0.864	69%	0.694	S	S	*	*			trans	-132.4	89	-175.7	-66.5	-174.1	-177.5	0	0	112.6
355	E	37.9	Very low	45.1	Very low	202 Å²	202	136 Å²	136	94%	0.944	72%	0.721	S	S	*	*			trans	-134.9	83.7	160	-80	-161.6	154.2	0	0	110.4
356	M	38.6	Very low	43.7	Very low	162 Å²	162	138 Å²	138	80%	0.798	74%	0.738	S	S	*	*			trans	-155	121	159.2	-164.7	156.2	-175.8	0	0	111.9
357	E	36.4	Very low	42	Very low	159 Å²	159	143.1 Å²	143.1	74%	0.743	76%	0.763	S	S	*	*			trans	64.9	145.1	166	-69.6	179.6	-174	0	0	119.1
358	Q	37.2	Very low	40.5	Very low	135 Å²	135	141.9 Å²	141.9	63%	0.631	77%	0.769	S	S	*	*			cis	-164.1	156.6	-31.4	-135.8	-174.1	24	0	0	111.4
359	K	36.5	Very low	39.7	Very low	178 Å²	178	139 Å²	139	77%	0.774	78%	0.777	S	S	*	*			trans	77.2	145.2	156.2	-69.5	154.2	174.5	146	0	121
360	H	34.6	Very low	39	Very low	183 Å²	183	135.3 Å²	135.3	85%	0.847	77%	0.772	S	S	*	*			trans	-15.3	159.5	155.5	-112.4	24.7	0	0	0	119.5
361	C	31.6	Very low	38.7	Very low	84 Å²	84	135 Å²	135	57%	0.568	78%	0.779	S	S	*	*			cis	-154.4	176.4	19.7	53.5	0	0	0	0	115
362	D	30.8	Very low	38.3	Very low	149 Å²	149	137.9 Å²	137.9	80%	0.797	79%	0.787	S	S	*	*			trans	69	144.4	155	-54.3	-32.5	0	0	0	122.4
363	A	35.8	Very low	38.8	Very low	96 Å²	96	133.6 Å²	133.6	79%	0.793	78%	0.78	S	S	*	*			trans	-162.2	167.1	173.7	0	0	0	0	0	108.5
364	P	53.9	Low	39.5	Very low	125 Å²	125	130.8 Å²	130.8	81%	0.812	76%	0.757	S	S	*	*			cis	-126.1	168.8	-2.3	40.6	-27.2	0	0	0	114.1
365	S	31.5	Very low	40.5	Very low	125 Å²	125	125.1 Å²	125.1	87%	0.874	74%	0.736	S	S	*	*			trans	-139.7	151.9	146	62.9	0	0	0	0	108.9
366	A	42.8	Very low	41.2	Very low	93 Å²	93	118 Å²	118	77%	0.769	71%	0.706	S	S	*	*			trans	-107.2	133.8	-164.6	0	0	0	0	0	112.5
367	D	32.3	Very low	42	Very low	163 Å²	163	114 Å²	114	87%	0.872	70%	0.695	S	S	*	*			trans	-154.2	81.3	132.1	-131.9	-15.5	0	0	0	111.3	S369	D367-S369 PolarHBondContact O-N 2.84Å
368	C	30.6	Very low	43.3	Very low	117 Å²	117	109.3 Å²	109.3	79%	0.791	67%	0.674	S	S	*	*			trans	-81.8	81.3	-176.9	-72.4	0	0	0	0	111.7	A370	C368-A370 HydrophobicContact CB-CB 4.42Å; C368-A370 PolarHBondContact O-N 3.12Å
369	S	42.6	Very low	44.5	Very low	122 Å²	122	105.4 Å²	105.4	85%	0.853	65%	0.654	S	S	*	*			trans	-72.1	42.3	159.8	71.4	0	0	0	0	111.8	D367 S371	D367-S369 PolarHBondContact O-N 2.84Å; S369-S371 PolarHBondContact O-N 3.46Å
370	A	38.9	Very low	45.2	Very low	72 Å²	72	100.5 Å²	100.5	60%	0.595	64%	0.635	S	S	*	*			trans	-69.6	101.2	179.2	0	0	0	0	0	108.8	C368 C372	C368-A370 HydrophobicContact CB-CB 4.42Å; C368-A370 PolarHBondContact O-N 3.12Å; A370-C372 PolarHBondContact O-N 3.17Å; A370-C372 VanDerWaalsContact O-N 3.09Å
371	S	44.5	Very low	46.1	Very low	110 Å²	110	95.6 Å²	95.6	77%	0.769	62%	0.621	S	S	*	*			trans	-60.7	116.2	169.6	57	0	0	0	0	108.2	S369 S373	S369-S371 PolarHBondContact O-N 3.46Å; S371-S373 PolarHBondContact O-N 3.37Å
372	C	39.2	Very low	47.4	Very low	131 Å²	131	101.3 Å²	101.3	89%	0.885	63%	0.631	S	S	*	*			trans	-68	78.7	-172.5	-63.6	0	0	0	0	111.7	A370 F374	A370-C372 PolarHBondContact O-N 3.17Å; A370-C372 VanDerWaalsContact O-N 3.09Å; C372-F374 PolarHBondContact O-N 3.01Å; C372-F374 VanDerWaalsContact O-N 3.12Å
373	S	54.5	Low	48.5	Very low	92 Å²	92	95.1 Å²	95.1	64%	0.643	60%	0.603	S	S	*	*			trans	-63.2	110.9	-178.5	-173.6	0	0	0	0	109.9	S371 R379	S371-S373 PolarHBondContact O-N 3.37Å; S373-R379 PolarHBondContact OG-NH2 3.46Å
374	F	55.5	Low	49.6	Very low	63 Å²	63	92.1 Å²	92.1	28%	0.276	58%	0.575	S	S	.	*			trans	-61.1	126.4	-179.2	-176.5	-119.7	0	0	0	110.4	C372 V376 L378 R379 I385	C372-F374 PolarHBondContact O-N 3.01Å; C372-F374 VanDerWaalsContact O-N 3.12Å; F374-V376 PolarHBondContact O-N 3.03Å; F374-L378 HydrophobicContact CD1-CB 4.17Å; F374-L378 HydrophobicContact CD2-CD1 4.29Å; F374-L378 HydrophobicContact CE1-CB 3.43Å; F374-L378 VanDerWaalsContact CE1-CB 3.43Å; F374-L378 HydrophobicContact CE2-CB 3.98Å; F374-L378 HydrophobicContact CE2-CD1 3.57Å; F374-L378 HydrophobicContact CE2-CG 4.44Å; F374-L378 HydrophobicContact CZ-CB 3.34Å; F374-L378 HydrophobicContact CZ-CD1 3.75Å; F374-L378 HydrophobicContact CZ-CG 4.17Å; F374-R379 HydrophobicContact CD1-CG 4.3Å; F374-R379 PolarHBondContact O-NE 3.02Å; F374-R379 PolarHBondContact O-NH2 3.34Å; F374-I385 HydrophobicContact CB-CD1 3.77Å; F374-I385 HydrophobicContact CD1-CD1 3.88Å; F374-I385 HydrophobicContact CD1-CG1 3.69Å; F374-I385 HydrophobicContact CD2-CD1 3.48Å; F374-I385 VanDerWaalsContact CD2-CD1 3.48Å; F374-I385 HydrophobicContact CD2-CG1 3.95Å; F374-I385 HydrophobicContact CE1-CD1 4.22Å; F374-I385 HydrophobicContact CE1-CG1 3.63Å; F374-I385 HydrophobicContact CE2-CD1 3.86Å; F374-I385 HydrophobicContact CE2-CG1 3.9Å; F374-I385 HydrophobicContact CG-CD1 3.45Å; F374-I385 VanDerWaalsContact CG-CD1 3.45Å; F374-I385 HydrophobicContact CG-CG1 3.82Å; F374-I385 HydrophobicContact CZ-CD1 4.19Å; F374-I385 HydrophobicContact CZ-CG1 3.71Å
375	P	64.9	Low	49.9	Very low	66 Å²	66	92.6 Å²	92.6	43%	0.429	57%	0.569	S	S	.	*			trans	-48.2	132.6	-171.9	-32.9	35.4	0	0	0	113.9	S377 L378 R379	P375-S377 PolarHBondContact O-N 3.45Å; P375-L378 HydrophobicContact CB-CB 4.44Å; P375-L378 HydrophobicContact CB-CD1 4.21Å; P375-L378 HydrophobicContact CB-CG 4.19Å; P375-L378 HydrophobicContact CG-CD1 4.12Å; P375-L378 WeakPolarHBondContact O-CA 3.34Å; P375-L378 PolarHBondContact O-N 3.08Å; P375-R379 PolarHBondContact O-N 3.18Å
376	V	52.5	Low	51.2	Low	52 Å²	52	90.1 Å²	90.1	32%	0.315	56%	0.557	S	S	.	*	H	α-helix	trans	-58.5	-35	-177.7	178.2	0	0	0	0	111.3	A340 F374 L378 R379 I380	A340-V376 HydrophobicContact CB-CG1 4.02Å; F374-V376 PolarHBondContact O-N 3.03Å; V376-L378 VanDerWaalsContact C-N 3.35Å; V376-L378 PolarHBondContact O-N 3.34Å; V376-R379 WeakPolarHBondContact O-CB 3.35Å; V376-R379 PolarHBondContact O-N 2.94Å; V376-I380 HydrophobicContact CG1-CD1 3.86Å; V376-I380 HydrophobicContact CG1-CG1 4.43Å; V376-I380 WeakPolarHBondContact O-CB 3.46Å; V376-I380 VanDerWaalsContact O-CG1 3.3Å; V376-I380 WeakPolarHBondContact O-CG1 3.44Å; V376-I380 PolarHBondContact O-N 3.26Å
377	S	56.1	Low	51.7	Low	79 Å²	79	88.6 Å²	88.6	55%	0.552	54%	0.544	S	S	*	.	H	α-helix	trans	-60.7	-37	172.9	53.5	0	0	0	0	113.7	P375 S381	P375-S377 PolarHBondContact O-N 3.45Å; S377-S381 WeakPolarHBondContact O-CB 3.5Å; S377-S381 PolarHBondContact O-N 3.38Å; S377-S381 PolarHBondContact O-OG 3.37Å
378	L	63.8	Low	52.9	Low	60 Å²	60	81.3 Å²	81.3	31%	0.314	51%	0.505	S	S	.	.	H	α-helix	trans	-76.6	-37.5	174.7	-64	177.1	0	0	0	111.2	F374 P375 V376 I380 S381 R382	F374-L378 HydrophobicContact CD1-CB 4.17Å; F374-L378 HydrophobicContact CD2-CD1 4.29Å; F374-L378 HydrophobicContact CE1-CB 3.43Å; F374-L378 VanDerWaalsContact CE1-CB 3.43Å; F374-L378 HydrophobicContact CE2-CB 3.98Å; F374-L378 HydrophobicContact CE2-CD1 3.57Å; F374-L378 HydrophobicContact CE2-CG 4.44Å; F374-L378 HydrophobicContact CZ-CB 3.34Å; F374-L378 HydrophobicContact CZ-CD1 3.75Å; F374-L378 HydrophobicContact CZ-CG 4.17Å; P375-L378 HydrophobicContact CB-CB 4.44Å; P375-L378 HydrophobicContact CB-CD1 4.21Å; P375-L378 HydrophobicContact CB-CG 4.19Å; P375-L378 HydrophobicContact CG-CD1 4.12Å; P375-L378 WeakPolarHBondContact O-CA 3.34Å; P375-L378 PolarHBondContact O-N 3.08Å; V376-L378 VanDerWaalsContact C-N 3.35Å; V376-L378 PolarHBondContact O-N 3.34Å; L378-I380 VanDerWaalsContact C-N 3.3Å; L378-I380 PolarHBondContact O-N 3.42Å; L378-S381 PolarHBondContact O-N 3.25Å; L378-R382 WeakPolarHBondContact O-CA 3.31Å; L378-R382 VanDerWaalsContact O-CB 3.31Å; L378-R382 WeakPolarHBondContact O-CB 3.41Å; L378-R382 PolarHBondContact O-N 3Å
379	R	60.7	Low	54	Low	54 Å²	54	80.7 Å²	80.7	20%	0.204	50%	0.5	C	S	.	.	H	α-helix	trans	-55.4	-44.6	169.6	-118.3	178.6	-70.5	171.9	-5.3	111.6	S373 F374 P375 V376 G383	S373-R379 PolarHBondContact OG-NH2 3.46Å; F374-R379 HydrophobicContact CD1-CG 4.3Å; F374-R379 PolarHBondContact O-NE 3.02Å; F374-R379 PolarHBondContact O-NH2 3.34Å; P375-R379 PolarHBondContact O-N 3.18Å; V376-R379 WeakPolarHBondContact O-CB 3.35Å; V376-R379 PolarHBondContact O-N 2.94Å; R379-G383 CarbonylContact O-C 3.59Å; R379-G383 WeakPolarHBondContact O-CA 3.42Å; R379-G383 PolarHBondContact O-N 2.88Å
380	I	52.3	Low	54.6	Low	74 Å²	74	78.3 Å²	78.3	38%	0.379	48%	0.477	S	S	.	.	H	α-helix	trans	-68.2	-40.4	177.5	-71.5	163.3	0	0	0	112.7	T337 R341 V376 L378	T337-I380 HydrophobicContact CG2-CB 4.41Å; T337-I380 HydrophobicContact CG2-CG1 3.78Å; R341-I380 HydrophobicContact CG-CD1 4.09Å; V376-I380 HydrophobicContact CG1-CD1 3.86Å; V376-I380 HydrophobicContact CG1-CG1 4.43Å; V376-I380 WeakPolarHBondContact O-CB 3.46Å; V376-I380 VanDerWaalsContact O-CG1 3.3Å; V376-I380 WeakPolarHBondContact O-CG1 3.44Å; V376-I380 PolarHBondContact O-N 3.26Å; L378-I380 VanDerWaalsContact C-N 3.3Å; L378-I380 PolarHBondContact O-N 3.42Å
381	S	52.7	Low	55.1	Low	80 Å²	80	78.2 Å²	78.2	56%	0.559	47%	0.469	S	S	*	.	H	α-helix	trans	-96.3	-18	-170.9	59.1	0	0	0	0	115.4	S377 L378	S377-S381 WeakPolarHBondContact O-CB 3.5Å; S377-S381 PolarHBondContact O-N 3.38Å; S377-S381 PolarHBondContact O-OG 3.37Å; L378-S381 PolarHBondContact O-N 3.25Å
382	R	59	Low	55.2	Low	205 Å²	205	81.5 Å²	81.5	77%	0.774	47%	0.472	S	S	*	.	H	α-helix	trans	-122.4	-11.2	-179.3	-55.5	-67.8	178.9	82.7	-1.1	113.3	L378	L378-R382 WeakPolarHBondContact O-CA 3.31Å; L378-R382 VanDerWaalsContact O-CB 3.31Å; L378-R382 WeakPolarHBondContact O-CB 3.41Å; L378-R382 PolarHBondContact O-N 3Å
383	G	54.2	Low	55.3	Low	19 Å²	19	79 Å²	79	20%	0.196	45%	0.453	C	S	.	.			trans	80.5	176.9	-165.2	0	0	0	0	0	112.5	R379	R379-G383 CarbonylContact O-C 3.59Å; R379-G383 WeakPolarHBondContact O-CA 3.42Å; R379-G383 PolarHBondContact O-N 2.88Å
384	P	58.7	Low	54.8	Low	32 Å²	32	81.2 Å²	81.2	21%	0.208	47%	0.467	C	S	.	.			trans	-69	140.2	173.8	30.5	-35	0	0	0	110.9	S333 A386 P388	S333-P384 WeakPolarHBondContact OG-CD 3.45Å; P384-A386 VanDerWaalsContact C-N 3.33Å; P384-A386 WeakPolarHBondContact CB-O 3.49Å; P384-A386 PolarHBondContact O-N 3.19Å; P384-P388 HydrophobicContact CG-CG 4.36Å
385	I	61	Low	54.6	Low	135 Å²	135	83.9 Å²	83.9	69%	0.692	49%	0.488	S	S	*	.	S	Bend	trans	-56.6	-48	-177.5	-54.5	158.9	0	0	0	111.1	F374	F374-I385 HydrophobicContact CB-CD1 3.77Å; F374-I385 HydrophobicContact CD1-CD1 3.88Å; F374-I385 HydrophobicContact CD1-CG1 3.69Å; F374-I385 HydrophobicContact CD2-CD1 3.48Å; F374-I385 VanDerWaalsContact CD2-CD1 3.48Å; F374-I385 HydrophobicContact CD2-CG1 3.95Å; F374-I385 HydrophobicContact CE1-CD1 4.22Å; F374-I385 HydrophobicContact CE1-CG1 3.63Å; F374-I385 HydrophobicContact CE2-CD1 3.86Å; F374-I385 HydrophobicContact CE2-CG1 3.9Å; F374-I385 HydrophobicContact CG-CD1 3.45Å; F374-I385 VanDerWaalsContact CG-CD1 3.45Å; F374-I385 HydrophobicContact CG-CG1 3.82Å; F374-I385 HydrophobicContact CZ-CD1 4.19Å; F374-I385 HydrophobicContact CZ-CG1 3.71Å
386	A	57.8	Low	54.4	Low	74 Å²	74	82.8 Å²	82.8	61%	0.612	48%	0.482	S	S	*	.	S	Bend	trans	-95.5	138.7	172.4	0	0	0	0	0	108.8	P384	P384-A386 VanDerWaalsContact C-N 3.33Å; P384-A386 WeakPolarHBondContact CB-O 3.49Å; P384-A386 PolarHBondContact O-N 3.19Å
387	A	54.9	Low	55.3	Low	60 Å²	60	86.9 Å²	86.9	50%	0.496	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-58.9	133.3	166.4	0	0	0	0	0	108.7
388	P	56.7	Low	56.4	Low	11 Å²	11	88 Å²	88	7%	0.071	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-51.3	130.1	177.7	-29.1	36.2	0	0	0	110.2	L332 P384 I390	L332-P388 HydrophobicContact CB-CB 3.98Å; L332-P388 HydrophobicContact CB-CG 3.99Å; L332-P388 HydrophobicContact CD1-CB 4.19Å; P384-P388 HydrophobicContact CG-CG 4.36Å; P388-I390 PolarHBondContact O-N 2.96Å; P388-I390 VanDerWaalsContact O-N 3.09Å
389	P	53.6	Low	57.4	Low	103 Å²	103	85.4 Å²	85.4	67%	0.669	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-61.2	119.4	-174.8	23.8	-32.9	0	0	0	109.2	T391	P389-T391 VanDerWaalsContact C-N 3.28Å; P389-T391 HydrophobicContact CB-CG2 4.42Å; P389-T391 PolarHBondContact O-N 2.86Å
390	I	55.6	Low	58.8	Low	73 Å²	73	87.1 Å²	87.1	37%	0.374	50%	0.501	S	S	.	.			trans	-72.5	95.6	165.3	-53	177.1	0	0	0	104.8	R329 P388 E392	R329-I390 HydrophobicContact CG-CD1 3.88Å; R329-I390 HydrophobicContact CG-CG1 4.04Å; P388-I390 PolarHBondContact O-N 2.96Å; P388-I390 VanDerWaalsContact O-N 3.09Å; I390-E392 VanDerWaalsContact C-N 3.3Å; I390-E392 HydrophobicContact CG2-CG 4.21Å; I390-E392 PolarHBondContact O-N 2.84Å
391	T	48.5	Very low	60.6	Low	70 Å²	70	85 Å²	85	43%	0.429	49%	0.49	S	S	.	.			trans	-72.6	85.1	-178.9	37.5	0	0	0	0	110	P389 T393	P389-T391 VanDerWaalsContact C-N 3.28Å; P389-T391 HydrophobicContact CB-CG2 4.42Å; P389-T391 PolarHBondContact O-N 2.86Å; T391-T393 PolarHBondContact O-N 2.83Å
392	E	47.7	Very low	62.5	Low	179 Å²	179	82.2 Å²	82.2	84%	0.836	47%	0.47	S	S	*	.			trans	-69.3	29	171.4	-61	-174.8	163.4	0	0	112.4	I390	I390-E392 VanDerWaalsContact C-N 3.3Å; I390-E392 HydrophobicContact CG2-CG 4.21Å; I390-E392 PolarHBondContact O-N 2.84Å
393	T	41.4	Very low	64	Low	77 Å²	77	74.8 Å²	74.8	47%	0.472	45%	0.452	S	S	.	.			trans	-102.3	129.7	-175.4	52.4	0	0	0	0	111.1	T391 T395 S396	T391-T393 PolarHBondContact O-N 2.83Å; T393-T395 PolarHBondContact O-N 2.88Å; T393-T395 PolarHBondContact OG1-OG1 2.73Å; T393-S396 PolarHBondContact O-OG 3.13Å
394	C	43.2	Very low	66	Low	139 Å²	139	74.2 Å²	74.2	94%	0.939	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	23.6	-176.4	-58.3	0	0	0	0	115.9
395	T	52.1	Low	67.8	Low	119 Å²	119	73.3 Å²	73.3	73%	0.73	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-3.8	-179.3	49.6	0	0	0	0	113.3	T393	T393-T395 PolarHBondContact O-N 2.88Å; T393-T395 PolarHBondContact OG1-OG1 2.73Å
396	S	60.3	Low	69.5	Low	44 Å²	44	69.1 Å²	69.1	31%	0.308	42%	0.421	S	S	.	.	S	Bend	trans	-78.1	137.8	179.4	41	0	0	0	0	111.7	T393 A403	T393-S396 PolarHBondContact O-OG 3.13Å; S396-A403 WeakPolarHBondContact OG-CB 3.5Å
397	Q	71.7	Confident	71.4	Confident	137 Å²	137	65.9 Å²	65.9	64%	0.64	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-73	143.2	-178.5	-69.2	-66.6	-23.1	0	0	111	G399 Q400	Q397-G399 PolarHBondContact O-N 3.29Å; Q397-Q400 WeakPolarHBondContact O-CB 3.36Å; Q397-Q400 PolarHBondContact O-N 3.4Å
398	P	79.5	Confident	73.4	Confident	103 Å²	103	66.3 Å²	66.3	67%	0.669	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	133.2	174.8	-27.2	35.3	0	0	0	111.9	A309	A309-P398 HydrophobicContact CB-CB 4.38Å
399	G	84	Confident	75.4	Confident	5 Å²	5	71.8 Å²	71.8	5%	0.052	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	72	23.7	-175.4	0	0	0	0	0	115.6	R307 P308 A309 Q397	R307-G399 PolarHBondContact NE-O 2.96Å; R307-G399 PolarHBondContact NH2-O 3.4Å; P308-G399 WeakPolarHBondContact O-CA 3.48Å; A309-G399 PolarHBondContact O-N 3.08Å; A309-G399 VanDerWaalsContact O-N 3.17Å; Q397-G399 PolarHBondContact O-N 3.29Å
400	Q	90.1	Very high	77.5	Confident	90 Å²	90	68.5 Å²	68.5	42%	0.421	39%	0.39	S	S	.	.			trans	-96.2	123	163	-167.5	169.1	14.1	0	0	110.5	Q397 A403 N404	Q397-Q400 WeakPolarHBondContact O-CB 3.36Å; Q397-Q400 PolarHBondContact O-N 3.4Å; Q400-A403 PolarHBondContact O-N 3.31Å; Q400-A403 VanDerWaalsContact O-N 3.08Å; Q400-N404 PolarHBondContact O-N 2.95Å; Q400-N404 PolarHBondContact O-OD1 3.01Å
401	F	90.7	Very high	79.5	Confident	31 Å²	31	68 Å²	68	14%	0.136	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	139.8	171.5	-173.8	-90.7	0	0	0	109.7	L300 A303 K304 Y331 L332 N404 V405	L300-F401 HydrophobicContact CD2-CE2 3.92Å; L300-F401 HydrophobicContact CD2-CZ 4.06Å; A303-F401 HydrophobicContact CB-CD2 3.69Å; A303-F401 HydrophobicContact CB-CE2 3.93Å; K304-F401 HydrophobicContact CB-CB 4.43Å; K304-F401 HydrophobicContact CB-CD2 4.07Å; K304-F401 HydrophobicContact CB-CG 4.08Å; Y331-F401 AromaticContact CD1-CE1 3.89Å; Y331-F401 HydrophobicContact CD1-CE1 3.89Å; Y331-F401 HydrophobicContact CD1-CE2 4.32Å; Y331-F401 AromaticContact CD1-CZ 3.6Å; Y331-F401 HydrophobicContact CD1-CZ 3.6Å; Y331-F401 HydrophobicContact CE1-CZ 4.33Å; L332-F401 HydrophobicContact CD2-CD1 3.98Å; L332-F401 HydrophobicContact CD2-CE1 3.69Å; L332-F401 HydrophobicContact CG-CE1 4.09Å; F401-N404 WeakPolarHBondContact CA-OD1 3.36Å; F401-V405 HydrophobicContact CD2-CG1 3.99Å; F401-V405 HydrophobicContact CE2-CG1 3.61Å; F401-V405 HydrophobicContact CZ-CG1 4.45Å
402	P	92.1	Very high	81.9	Confident	21 Å²	21	65.1 Å²	65.1	14%	0.136	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	cis	-89.1	-5.9	4.5	38.1	-38.4	0	0	0	114.7	I328 L332 N404 V405	I328-P402 HydrophobicContact CG2-CB 3.76Å; L332-P402 HydrophobicContact CD1-CB 4.3Å; L332-P402 HydrophobicContact CD1-CG 4.06Å; L332-P402 HydrophobicContact CD2-CB 4.46Å; L332-P402 HydrophobicContact CD2-CG 4.31Å; P402-N404 PolarHBondContact O-N 3.01Å; P402-V405 WeakPolarHBondContact O-CG1 3.32Å; P402-V405 PolarHBondContact O-N 3.03Å; P402-V405 VanDerWaalsContact O-N 3.08Å
403	A	90.6	Very high	84.3	Confident	49 Å²	49	56.9 Å²	56.9	41%	0.405	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.7	-173.6	0	0	0	0	0	113.7	S396 Q400 V405	S396-A403 WeakPolarHBondContact OG-CB 3.5Å; Q400-A403 PolarHBondContact O-N 3.31Å; Q400-A403 VanDerWaalsContact O-N 3.08Å; A403-V405 VanDerWaalsContact C-N 3.29Å; A403-V405 PolarHBondContact O-N 3.21Å
404	N	95.2	Very high	86.9	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.032	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-5.2	176.8	75.8	-25	0	0	0	115.1	A303 P308 R310 I311 Q400 F401 P402	A303-N404 PolarHBondContact O-ND2 2.92Å; P308-N404 PolarHBondContact O-ND2 3.16Å; R310-N404 CarbonylContact C-O 3.49Å; R310-N404 WeakPolarHBondContact CA-O 3.4Å; I311-N404 PolarHBondContact N-O 3.34Å; Q400-N404 PolarHBondContact O-N 2.95Å; Q400-N404 PolarHBondContact O-OD1 3.01Å; F401-N404 WeakPolarHBondContact CA-OD1 3.36Å; P402-N404 PolarHBondContact O-N 3.01Å
405	V	96.4	Very high	89.4	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.079	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.6	179.9	58.5	0	0	0	0	113.4	L300 A303 I311 F401 P402 A403 F407	L300-V405 HydrophobicContact CD2-CG1 4.15Å; L300-V405 HydrophobicContact CD2-CG2 4.26Å; A303-V405 HydrophobicContact CB-CB 3.76Å; A303-V405 HydrophobicContact CB-CG1 4.19Å; A303-V405 HydrophobicContact CB-CG2 4.26Å; I311-V405 HydrophobicContact CG2-CB 3.93Å; I311-V405 HydrophobicContact CG2-CG2 4.05Å; I311-V405 WeakPolarHBondContact O-CA 3.31Å; F401-V405 HydrophobicContact CD2-CG1 3.99Å; F401-V405 HydrophobicContact CE2-CG1 3.61Å; F401-V405 HydrophobicContact CZ-CG1 4.45Å; P402-V405 WeakPolarHBondContact O-CG1 3.32Å; P402-V405 PolarHBondContact O-N 3.03Å; P402-V405 VanDerWaalsContact O-N 3.08Å; A403-V405 VanDerWaalsContact C-N 3.29Å; A403-V405 PolarHBondContact O-N 3.21Å; V405-F407 HydrophobicContact CG2-CD2 4.31Å; V405-F407 HydrophobicContact CG2-CE2 3.6Å; V405-F407 HydrophobicContact CG2-CZ 3.79Å
406	S	97	Very high	91.4	Very high	47 Å²	47	53.6 Å²	53.6	33%	0.329	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	156.6	177.2	58	0	0	0	0	111.2	I311 L312 G313	I311-S406 PolarHBondContact O-N 3.41Å; I311-S406 PolarHBondContact O-OG 2.81Å; L312-S406 WeakPolarHBondContact CA-O 3.23Å; L312-S406 VanDerWaalsContact CD1-OG 3.31Å; L312-S406 WeakPolarHBondContact CD1-OG 3.29Å; G313-S406 PolarHBondContact N-O 3.14Å
407	F	97.9	Very high	93.1	Very high	7 Å²	7	55.8 Å²	55.8	3%	0.031	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.1	-177.5	-68.8	-78.3	0	0	0	111.7	C293 T299 L300 G313 I321 A324 R325 I328 V405	C293-F407 HydrophobicContact CB-CE1 4.4Å; T299-F407 HydrophobicContact CG2-CE1 3.86Å; T299-F407 HydrophobicContact CG2-CZ 4.17Å; L300-F407 HydrophobicContact CD2-CE2 3.98Å; L300-F407 HydrophobicContact CD2-CZ 4.07Å; L300-F407 HydrophobicContact CG-CE2 4.5Å; L300-F407 HydrophobicContact CG-CZ 4.15Å; G313-F407 CarbonylContact O-C 3.57Å; G313-F407 VanDerWaalsContact O-CA 3.3Å; G313-F407 WeakPolarHBondContact O-CA 3.18Å; I321-F407 HydrophobicContact CD1-CB 4.2Å; I321-F407 HydrophobicContact CG2-CB 4.19Å; A324-F407 HydrophobicContact CB-CD1 3.7Å; A324-F407 HydrophobicContact CB-CD2 4.02Å; A324-F407 HydrophobicContact CB-CE1 3.74Å; A324-F407 HydrophobicContact CB-CE2 4.05Å; A324-F407 HydrophobicContact CB-CG 3.85Å; A324-F407 HydrophobicContact CB-CZ 3.93Å; R325-F407 HydrophobicContact CG-CB 4.03Å; R325-F407 HydrophobicContact CG-CD2 4.31Å; R325-F407 PolarHBondContact NE-O 3.37Å; R325-F407 VanDerWaalsContact NE-O 3.13Å; R325-F407 PolarHBondContact NH2-O 3.41Å; I328-F407 HydrophobicContact CD1-CD2 4.14Å; I328-F407 HydrophobicContact CD1-CE2 4.09Å; I328-F407 HydrophobicContact CG1-CE2 4.1Å; V405-F407 HydrophobicContact CG2-CD2 4.31Å; V405-F407 HydrophobicContact CG2-CE2 3.6Å; V405-F407 HydrophobicContact CG2-CZ 3.79Å
408	I	97.8	Very high	94.2	Very high	69 Å²	69	55.5 Å²	55.5	35%	0.354	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	148.7	178.6	62.6	171.8	0	0	0	112.9	L312 G313 L314 D315 I321	L312-I408 HydrophobicContact CD1-CB 4.44Å; L312-I408 HydrophobicContact CD1-CD1 4.19Å; L312-I408 HydrophobicContact CD1-CG1 3.9Å; L312-I408 HydrophobicContact CD1-CG2 3.95Å; L312-I408 HydrophobicContact CD2-CD1 3.96Å; L312-I408 HydrophobicContact CD2-CG1 4.46Å; L312-I408 HydrophobicContact CG-CD1 4.35Å; L312-I408 HydrophobicContact CG-CG1 4.32Å; G313-I408 PolarHBondContact O-N 2.94Å; L314-I408 HydrophobicContact CB-CG1 4.36Å; L314-I408 HydrophobicContact CD1-CD1 4.33Å; L314-I408 HydrophobicContact CG-CG1 4.34Å; D315-I408 PolarHBondContact N-O 2.58Å; I321-I408 WeakPolarHBondContact CD1-O 3.2Å; I321-I408 WeakPolarHBondContact CG1-O 3.4Å
409	K	98.3	Very high	95	Very high	125 Å²	125	53.7 Å²	53.7	54%	0.543	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112	171.5	-174.3	-138.4	-176.2	169.6	0	109.6	D315 I316 I321	D315-K409 CarbonylContact O-C 3.59Å; D315-K409 VanDerWaalsContact O-CA 3.26Å; D315-K409 WeakPolarHBondContact O-CA 3.45Å; I316-K409 WeakPolarHBondContact O-CE 3.45Å; I321-K409 HydrophobicContact CG1-CB 4.26Å
410	A	97	Very high	95.5	Very high	34 Å²	34	53.8 Å²	53.8	28%	0.281	29%	0.286	S	S	.	.			trans	-154.2	158.9	176.2	0	0	0	0	0	111.9	L314 D315 I316	L314-A410 HydrophobicContact CD1-CB 4.14Å; L314-A410 HydrophobicContact CD2-CB 4.38Å; L314-A410 WeakPolarHBondContact CD2-O 3.38Å; L314-A410 HydrophobicContact CG-CB 4.1Å; D315-A410 CarbonylContact C-O 3.06Å; D315-A410 PolarHBondContact O-N 3.45Å; I316-A410 WeakPolarHBondContact CA-O 3.37Å
411	N	98.1	Very high	95.6	Very high	62 Å²	62	55.2 Å²	55.2	33%	0.332	30%	0.295	S	S	.	.			trans	-90	128.1	159.7	-177.1	14.3	0	0	0	108.5	I316 V413 W443	I316-N411 HydrophobicContact CD1-CB 4.21Å; N411-V413 PolarHBondContact ND2-O 3.17Å; N411-V413 VanDerWaalsContact ND2-O 3.09Å; N411-V413 PolarHBondContact OD1-N 2.82Å; N411-W443 VanDerWaalsContact ND2-CZ2 3.33Å; N411-W443 WeakPolarHBondContact ND2-CZ2 3.46Å
412	Y	98.4	Very high	95.8	Very high	11 Å²	11	58.6 Å²	58.6	4%	0.043	32%	0.318	C	S	.	.			trans	-80.4	-23	175.9	-167	-110.4	0	0	0	112.8	L289 L291 L314 L414 L451 R454 A455 H458	L289-Y412 HydrophobicContact CD2-CE2 3.95Å; L291-Y412 HydrophobicContact CD1-CD1 3.66Å; L291-Y412 HydrophobicContact CD1-CE1 3.69Å; L291-Y412 HydrophobicContact CD1-CG 4.26Å; L291-Y412 HydrophobicContact CD2-CD1 3.8Å; L291-Y412 HydrophobicContact CD2-CD2 3.58Å; L291-Y412 HydrophobicContact CD2-CE1 4.14Å; L291-Y412 HydrophobicContact CD2-CE2 3.95Å; L291-Y412 HydrophobicContact CD2-CG 3.51Å; L291-Y412 HydrophobicContact CG-CD1 4.39Å; L314-Y412 HydrophobicContact CD1-CD2 3.98Å; Y412-L414 PolarHBondContact O-N 3.05Å; Y412-L451 HydrophobicContact CD1-CD1 4.17Å; Y412-L451 HydrophobicContact CD1-CG 3.98Å; Y412-L451 HydrophobicContact CE1-CG 4.28Å; Y412-R454 HydrophobicContact CE1-CB 4.13Å; Y412-R454 HydrophobicContact CE1-CG 4.14Å; Y412-R454 HydrophobicContact CE2-CG 4.3Å; Y412-R454 VanDerWaalsContact CZ-CD 3.48Å; Y412-R454 WeakPolarHBondContact O-CD 3.42Å; Y412-R454 PolarHBondContact O-NH1 2.71Å; Y412-A455 WeakPolarHBondContact OH-CA 3.47Å; Y412-A455 PolarHBondContact OH-N 2.97Å; Y412-H458 AromaticContact CE2-CE1 3.91Å; Y412-H458 AromaticContact CE2-ND1 3.72Å; Y412-H458 AromaticContact CZ-ND1 3.82Å; Y412-H458 PolarHBondContact OH-ND1 2.87Å; Y412-H458 VanDerWaalsContact OH-ND1 3.08Å
413	V	98.1	Very high	96	Very high	5 Å²	5	58.5 Å²	58.5	3%	0.03	32%	0.316	C	S	.	.	S	Bend	trans	-74.5	116.9	175.2	-173.4	0	0	0	0	109.3	N411 V439 W443	N411-V413 PolarHBondContact ND2-O 3.17Å; N411-V413 VanDerWaalsContact ND2-O 3.09Å; N411-V413 PolarHBondContact OD1-N 2.82Å; V413-V439 HydrophobicContact CG2-CB 4.27Å; V413-V439 HydrophobicContact CG2-CG1 3.6Å; V413-V439 HydrophobicContact CG2-CG2 3.76Å; V413-W443 HydrophobicContact CB-CD2 4.25Å; V413-W443 HydrophobicContact CB-CE3 4.37Å; V413-W443 HydrophobicContact CG1-CB 4.21Å; V413-W443 HydrophobicContact CG1-CD2 4.24Å; V413-W443 HydrophobicContact CG1-CG 4.03Å; V413-W443 HydrophobicContact CG2-CD2 4.19Å; V413-W443 HydrophobicContact CG2-CE3 3.82Å; V413-W443 HydrophobicContact CG2-CZ3 4.15Å
414	L	96.7	Very high	96.3	Very high	27 Å²	27	66 Å²	66	14%	0.141	33%	0.333	C	S	.	.			trans	-71.3	152.2	178.3	-66.3	167.9	0	0	0	111.7	Y412 L419 L420 R450 R454	Y412-L414 PolarHBondContact O-N 3.05Å; L414-L419 HydrophobicContact CB-CB 4.17Å; L414-L419 HydrophobicContact CB-CD1 4.5Å; L414-L419 HydrophobicContact CD1-CB 3.96Å; L414-L419 WeakPolarHBondContact CD1-O 3.5Å; L414-L419 HydrophobicContact CD2-CB 4.01Å; L414-L419 HydrophobicContact CD2-CD1 4.36Å; L414-L419 HydrophobicContact CG-CB 4.26Å; L414-L420 HydrophobicContact CD1-CD2 3.81Å; L414-L420 HydrophobicContact CD1-CG 4.16Å; L414-R450 VanDerWaalsContact O-CZ 3.28Å; L414-R450 PolarHBondContact O-NH1 2.85Å; L414-R454 HydrophobicContact CD1-CG 4.12Å
415	E	94.8	Very high	96.4	Very high	173 Å²	173	68 Å²	68	81%	0.808	35%	0.351	S	S	*	.	S	Bend	trans	-72.3	-31.5	-174.5	-60.4	-174.4	162.9	0	0	113.5	L419 R450	E415-L419 HydrophobicContact CB-CD1 4.35Å; E415-R450 PolarHBondContact O-NH1 3.25Å
416	N	95.3	Very high	96.5	Very high	66 Å²	66	71 Å²	71	35%	0.353	37%	0.365	S	S	.	.	S	Bend	trans	-145.2	171.2	177.7	62.2	64.5	0	0	0	110.5	N418 L419	N416-N418 WeakPolarHBondContact OD1-CB 3.47Å; N416-N418 PolarHBondContact OD1-N 3.05Å; N416-N418 VanDerWaalsContact OD1-N 3.1Å; N416-L419 WeakPolarHBondContact OD1-CG 3.26Å; N416-L419 PolarHBondContact OD1-N 3.45Å; N416-L419 VanDerWaalsContact OD1-N 3.11Å
417	D	94.8	Very high	96.6	Very high	91 Å²	91	69.1 Å²	69.1	49%	0.487	35%	0.35	S	S	.	.	S	Bend	trans	-78.9	-23.2	-177.6	-76.7	17.7	0	0	0	113	L419 L420 R450	D417-L419 PolarHBondContact O-N 2.85Å; D417-L420 HydrophobicContact CB-CD1 4.37Å; D417-L420 WeakPolarHBondContact O-CB 3.41Å; D417-L420 PolarHBondContact O-N 2.85Å; D417-R450 WeakPolarHBondContact OD1-CD 3.31Å; D417-R450 WeakPolarHBondContact OD1-CG 3.42Å; D417-R450 IonicContact OD1-NE 3.87Å
418	N	95.4	Very high	96.6	Very high	131 Å²	131	70.2 Å²	70.2	70%	0.701	36%	0.356	S	S	*	.	H	α-helix	trans	-62	-35.3	178.5	-59.4	-9.6	0	0	0	111.2	N416 L420 M421	N416-N418 WeakPolarHBondContact OD1-CB 3.47Å; N416-N418 PolarHBondContact OD1-N 3.05Å; N416-N418 VanDerWaalsContact OD1-N 3.1Å; N418-L420 PolarHBondContact O-N 3.44Å; N418-M421 WeakPolarHBondContact O-CB 3.33Å; N418-M421 PolarHBondContact O-N 3.01Å
419	L	95.7	Very high	96.7	Very high	64 Å²	64	67 Å²	67	34%	0.335	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-13.6	173.1	-67.5	171.5	0	0	0	114	L414 E415 N416 D417 M421 T422	L414-L419 HydrophobicContact CB-CB 4.17Å; L414-L419 HydrophobicContact CB-CD1 4.5Å; L414-L419 HydrophobicContact CD1-CB 3.96Å; L414-L419 WeakPolarHBondContact CD1-O 3.5Å; L414-L419 HydrophobicContact CD2-CB 4.01Å; L414-L419 HydrophobicContact CD2-CD1 4.36Å; L414-L419 HydrophobicContact CG-CB 4.26Å; E415-L419 HydrophobicContact CB-CD1 4.35Å; N416-L419 WeakPolarHBondContact OD1-CG 3.26Å; N416-L419 PolarHBondContact OD1-N 3.45Å; N416-L419 VanDerWaalsContact OD1-N 3.11Å; D417-L419 PolarHBondContact O-N 2.85Å; L419-M421 VanDerWaalsContact C-N 3.32Å; L419-T422 PolarHBondContact O-OG1 3.35Å; L419-T422 VanDerWaalsContact O-OG1 3.11Å
420	L	94.8	Very high	96.7	Very high	7 Å²	7	61.1 Å²	61.1	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-69.1	-34.2	169.5	-68.8	167.9	0	0	0	110.9	L414 D417 N418 T422 Q423 R450 K453 R454 R457	L414-L420 HydrophobicContact CD1-CD2 3.81Å; L414-L420 HydrophobicContact CD1-CG 4.16Å; D417-L420 HydrophobicContact CB-CD1 4.37Å; D417-L420 WeakPolarHBondContact O-CB 3.41Å; D417-L420 PolarHBondContact O-N 2.85Å; N418-L420 PolarHBondContact O-N 3.44Å; L420-T422 VanDerWaalsContact C-N 3.31Å; L420-T422 PolarHBondContact O-N 2.72Å; L420-Q423 WeakPolarHBondContact O-CB 3.4Å; L420-Q423 PolarHBondContact O-N 3.02Å; L420-R450 HydrophobicContact CD1-CG 4.25Å; L420-K453 HydrophobicContact CD1-CB 4.07Å; L420-K453 HydrophobicContact CD2-CB 4.18Å; L420-R454 HydrophobicContact CD2-CB 3.75Å; L420-R454 HydrophobicContact CD2-CG 4.4Å; L420-R457 WeakPolarHBondContact O-CD 3.43Å; L420-R457 PolarHBondContact O-NE 3.35Å
421	M	92.9	Very high	96.8	Very high	121 Å²	121	59.5 Å²	59.5	60%	0.596	30%	0.301	S	S	*	.	H	α-helix	trans	-65.8	-36.2	-175.6	-61.4	-56.3	111.9	0	0	111.7	N418 L419 Q423 R457	N418-M421 WeakPolarHBondContact O-CB 3.33Å; N418-M421 PolarHBondContact O-N 3.01Å; L419-M421 VanDerWaalsContact C-N 3.32Å; M421-Q423 VanDerWaalsContact C-N 3.31Å; M421-Q423 PolarHBondContact O-N 3.39Å; M421-R457 PolarHBondContact O-NH2 3.04Å
422	T	95.1	Very high	96.9	Very high	102 Å²	102	56.5 Å²	56.5	63%	0.626	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-14	177.5	59	0	0	0	0	114.1	L419 L420 R424	L419-T422 PolarHBondContact O-OG1 3.35Å; L419-T422 VanDerWaalsContact O-OG1 3.11Å; L420-T422 VanDerWaalsContact C-N 3.31Å; L420-T422 PolarHBondContact O-N 2.72Å; T422-R424 PolarHBondContact O-N 3.39Å
423	Q	96.8	Very high	96.8	Very high	18 Å²	18	56.4 Å²	56.4	8%	0.084	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-67.2	120.7	177.4	-174.7	60.9	80.6	0	0	110.9	L420 M421 E426 R454 R457 H458	L420-Q423 WeakPolarHBondContact O-CB 3.4Å; L420-Q423 PolarHBondContact O-N 3.02Å; M421-Q423 VanDerWaalsContact C-N 3.31Å; M421-Q423 PolarHBondContact O-N 3.39Å; Q423-E426 PolarHBondContact NE2-OE1 3.41Å; Q423-E426 VanDerWaalsContact NE2-OE1 3.12Å; Q423-R454 HydrophobicContact CG-CG 4.06Å; Q423-R457 HydrophobicContact CB-CB 4.35Å; Q423-R457 HydrophobicContact CG-CB 4.19Å; Q423-H458 VanDerWaalsContact CD-CD2 3.44Å; Q423-H458 HydrophobicContact CG-CB 4.13Å; Q423-H458 PolarHBondContact NE2-CD2 3.29Å; Q423-H458 PolarHBondContact NE2-NE2 3.09Å
424	R	96	Very high	96.8	Very high	206 Å²	206	56.5 Å²	56.5	78%	0.777	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-94	164.2	173.7	-61.6	-179.6	179.5	-175	-2.2	111	T422 R457 H458	T422-R424 PolarHBondContact O-N 3.39Å; R424-R457 CarbonylContact C-O 3.54Å; R424-H458 WeakPolarHBondContact O-CA 3.28Å
425	A	98.3	Very high	96.9	Very high	50 Å²	50	56.2 Å²	56.2	41%	0.413	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-81.3	124.6	172.4	0	0	0	0	0	110.6	R457 L459 R460	A425-R457 WeakPolarHBondContact CA-O 3.19Å; A425-R457 PolarHBondContact N-O 3.24Å; A425-L459 VanDerWaalsContact CB-O 3.31Å; A425-L459 WeakPolarHBondContact CB-O 3.34Å; A425-R460 HydrophobicContact CB-CG 4.25Å
426	E	98.1	Very high	97.1	Very high	76 Å²	76	48 Å²	48	36%	0.355	25%	0.247	S	C	.	.			trans	-134.6	-22.1	-170.3	-71.9	174.2	-128.1	0	0	113.7	Q423 H458 R460	Q423-E426 PolarHBondContact NE2-OE1 3.41Å; Q423-E426 VanDerWaalsContact NE2-OE1 3.12Å; E426-H458 PolarHBondContact N-O 3.29Å; E426-H458 IonicContact OE1-CD2 3.89Å; E426-H458 IonicContact OE1-NE2 3.71Å; E426-H458 IonicContact OE2-NE2 3.61Å; E426-R460 PolarHBondContact O-NH2 2.92Å
427	Y	98.8	Very high	97.2	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.027	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.3	-171.8	-60.9	-86.6	0	0	0	111.6	D287 V288 L289 R310 L312 H458 L459 R460	D287-Y427 HydrophobicContact CB-CD1 4.07Å; V288-Y427 VanDerWaalsContact C-CD1 3.49Å; L289-Y427 HydrophobicContact CB-CD1 3.77Å; L289-Y427 HydrophobicContact CB-CD2 4.24Å; L289-Y427 HydrophobicContact CB-CE1 4.07Å; L289-Y427 HydrophobicContact CB-CG 3.89Å; L289-Y427 HydrophobicContact CD2-CD2 4.35Å; R310-Y427 PolarHBondContact NH1-OH 2.8Å; R310-Y427 VanDerWaalsContact NH2-CE1 3.33Å; L312-Y427 HydrophobicContact CB-CE1 4.39Å; L312-Y427 WeakPolarHBondContact CD2-OH 3.3Å; Y427-H458 AromaticContact CD2-CD2 3.82Å; Y427-H458 AromaticContact CD2-CE1 3.53Å; Y427-H458 AromaticContact CD2-CG 3.95Å; Y427-H458 AromaticContact CD2-ND1 3.75Å; Y427-H458 AromaticContact CD2-NE2 3.61Å; Y427-H458 AromaticContact CE2-CD2 3.98Å; Y427-H458 AromaticContact CE2-CE1 3.36Å; Y427-H458 WeakPolarHBondContact CE2-CE1 3.15Å; Y427-H458 AromaticContact CE2-NE2 3.32Å; Y427-H458 VanDerWaalsContact CE2-NE2 3.32Å; Y427-H458 WeakPolarHBondContact CE2-NE2 3.49Å; Y427-H458 PolarHBondContact N-O 2.8Å; Y427-L459 CarbonylContact O-C 3.38Å; Y427-L459 VanDerWaalsContact O-CA 3.31Å; Y427-L459 WeakPolarHBondContact O-CA 3.26Å; Y427-R460 PolarHBondContact O-N 3.43Å
428	D	98.8	Very high	97.4	Very high	30 Å²	30	42.2 Å²	42.2	16%	0.16	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-28.6	172	-44.7	-61	0	0	0	111.2	K286 D287 L459 R460 G463 L464	K286-D428 WeakPolarHBondContact CA-OD2 3.35Å; K286-D428 HydrophobicContact CB-CB 4Å; K286-D428 WeakPolarHBondContact CB-OD2 3.48Å; K286-D428 HydrophobicContact CD-CB 3.95Å; K286-D428 HydrophobicContact CG-CB 4.2Å; D287-D428 PolarHBondContact N-OD2 2.87Å; D287-D428 PolarHBondContact O-N 3.1Å; D428-L459 WeakPolarHBondContact O-CD2 3.33Å; D428-R460 WeakPolarHBondContact OD1-CD 3.02Å; D428-R460 IonicContact OD1-CZ 3.81Å; D428-R460 IonicContact OD1-NE 3.69Å; D428-R460 IonicContact OD1-NH1 3.24Å; D428-R460 PolarHBondContact OD1-NH1 2.94Å; D428-R460 IonicContact OD2-NH1 3.46Å; D428-R460 PolarHBondContact OD2-NH1 3.46Å; D428-R460 VanDerWaalsContact OD2-NH1 3.1Å; D428-G463 CarbonylContact O-C 3.47Å; D428-G463 WeakPolarHBondContact O-CA 3.32Å; D428-L464 PolarHBondContact O-N 3.32Å
429	V	98.9	Very high	97.5	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.2	177	-173.8	0	0	0	0	111.1	W282 F283 D287 V288 L289 L431 L464 I466	W282-V429 WeakPolarHBondContact O-CG2 3.22Å; F283-V429 HydrophobicContact CD1-CG1 4.37Å; F283-V429 HydrophobicContact CE1-CG1 3.87Å; D287-V429 PolarHBondContact O-N 3.38Å; D287-V429 VanDerWaalsContact O-N 3.17Å; V288-V429 WeakPolarHBondContact CA-O 3.48Å; V288-V429 HydrophobicContact CG1-CB 4.29Å; V288-V429 HydrophobicContact CG2-CB 4.29Å; L289-V429 PolarHBondContact N-O 3.34Å; V429-L431 HydrophobicContact CG1-CD2 4.31Å; V429-L464 CarbonylContact C-O 3.5Å; V429-L464 WeakPolarHBondContact CA-O 3.08Å; V429-L464 HydrophobicContact CG1-CB 4.43Å; V429-L464 HydrophobicContact CG2-CB 4.31Å; V429-L464 HydrophobicContact CG2-CD1 4.48Å; V429-I466 HydrophobicContact CG1-CD1 3.95Å; V429-I466 HydrophobicContact CG1-CG1 4.28Å
430	I	98.9	Very high	97.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	117.9	170.5	-59.8	-178.7	0	0	0	109.2	L289 L291 A455 H458 L459 L464 F465 I466	L289-I430 HydrophobicContact CB-CG1 4.17Å; L289-I430 HydrophobicContact CD2-CD1 4.21Å; L289-I430 HydrophobicContact CD2-CG1 4.25Å; L289-I430 HydrophobicContact CD2-CG2 4.25Å; L289-I430 CarbonylContact O-C 3.53Å; L289-I430 WeakPolarHBondContact O-CA 3.49Å; L291-I430 HydrophobicContact CD1-CG2 3.73Å; L291-I430 HydrophobicContact CG-CG2 3.98Å; I430-A455 HydrophobicContact CD1-CB 4.27Å; I430-A455 WeakPolarHBondContact CD1-O 3.46Å; I430-H458 HydrophobicContact CD1-CB 3.77Å; I430-L459 HydrophobicContact CB-CD2 4.39Å; I430-L459 HydrophobicContact CD1-CD2 4.11Å; I430-L459 HydrophobicContact CD1-CG 3.85Å; I430-L459 HydrophobicContact CG1-CD2 3.74Å; I430-L459 HydrophobicContact CG1-CG 4.03Å; I430-L464 PolarHBondContact N-O 2.76Å; I430-F465 HydrophobicContact CB-CD2 4.07Å; I430-F465 HydrophobicContact CG2-CD2 3.99Å; I430-F465 HydrophobicContact CG2-CE2 4.13Å; I430-I466 PolarHBondContact O-N 3.32Å
431	L	98.9	Very high	97.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.1	170.6	-57.5	-179.4	0	0	0	109.7	F283 V288 L289 D290 L291 V429 L433 I466	F283-L431 HydrophobicContact CE1-CD1 4.34Å; F283-L431 HydrophobicContact CE1-CD2 3.85Å; F283-L431 HydrophobicContact CE1-CG 4.34Å; F283-L431 HydrophobicContact CZ-CD2 4.04Å; V288-L431 HydrophobicContact CG1-CG 4.49Å; L289-L431 PolarHBondContact O-N 2.91Å; D290-L431 HydrophobicContact CB-CD1 4.36Å; L291-L431 VanDerWaalsContact CB-O 3.28Å; L291-L431 WeakPolarHBondContact CB-O 3.06Å; L291-L431 WeakPolarHBondContact CG-O 3.27Å; L291-L431 PolarHBondContact N-O 2.85Å; V429-L431 HydrophobicContact CG1-CD2 4.31Å; L431-L433 HydrophobicContact CB-CD1 4.18Å; L431-L433 HydrophobicContact CB-CG 4.15Å; L431-L433 HydrophobicContact CD1-CD1 4.22Å; L431-L433 HydrophobicContact CD2-CD1 4.32Å; L431-L433 HydrophobicContact CG-CD1 4.48Å; L431-I466 HydrophobicContact CD2-CB 3.84Å; L431-I466 HydrophobicContact CD2-CD1 3.89Å; L431-I466 HydrophobicContact CD2-CG1 4.25Å; L431-I466 HydrophobicContact CD2-CG2 4.33Å
432	C	98.8	Very high	98.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	61.9	175.8	-165.9	0	0	0	0	109.7	L291 F465 I466 L467 E468	L291-C432 HydrophobicContact CD1-CB 4.35Å; C432-F465 HydrophobicContact CB-CD2 4.45Å; C432-F465 HydrophobicContact CB-CE2 3.52Å; C432-F465 HydrophobicContact CB-CZ 3.69Å; C432-I466 PolarHBondContact N-O 2.94Å; C432-L467 HydrophobicContact CB-CD1 3.76Å; C432-E468 PolarHBondContact O-N 3.44Å
433	L	98.3	Very high	98.3	Very high	8 Å²	8	26.3 Å²	26.3	4%	0.042	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	115.7	-165.6	-57.4	174.3	0	0	0	111	L298 L431 V435 I466 E468 V529	L298-L433 HydrophobicContact CD2-CD1 3.5Å; L298-L433 VanDerWaalsContact CD2-CD1 3.5Å; L431-L433 HydrophobicContact CB-CD1 4.18Å; L431-L433 HydrophobicContact CB-CG 4.15Å; L431-L433 HydrophobicContact CD1-CD1 4.22Å; L431-L433 HydrophobicContact CD2-CD1 4.32Å; L431-L433 HydrophobicContact CG-CD1 4.48Å; L433-V435 VanDerWaalsContact C-N 3.25Å; L433-V435 PolarHBondContact O-N 3.49Å; L433-I466 HydrophobicContact CD2-CG2 4.25Å; L433-E468 HydrophobicContact CB-CB 4.24Å; L433-E468 HydrophobicContact CD2-CB 3.71Å; L433-V529 HydrophobicContact CD2-CG1 4.45Å
434	S	97.4	Very high	98.4	Very high	8 Å²	8	25.8 Å²	25.8	6%	0.056	12%	0.122	C	C	.	.	S	Bend	trans	61.8	22.2	-175.5	-67.7	0	0	0	0	115.7	Y261 R265 E468 Q470 R527	Y261-S434 WeakPolarHBondContact OH-CB 3.39Å; Y261-S434 PolarHBondContact OH-OG 2.64Å; Y261-S434 VanDerWaalsContact OH-OG 3.05Å; R265-S434 PolarHBondContact NH1-OG 3.18Å; R265-S434 VanDerWaalsContact NH1-OG 3.1Å; S434-E468 WeakPolarHBondContact CA-O 3.13Å; S434-E468 PolarHBondContact N-O 3.03Å; S434-E468 PolarHBondContact N-OE2 3.35Å; S434-E468 PolarHBondContact OG-OE1 3.21Å; S434-E468 PolarHBondContact OG-OE2 3.4Å; S434-Q470 VanDerWaalsContact C-NE2 3.31Å; S434-Q470 PolarHBondContact O-NE2 2.97Å; S434-Q470 PolarHBondContact O-OE1 3Å; S434-R527 PolarHBondContact OG-NH1 2.9Å
435	V	98.2	Very high	98.5	Very high	20 Å²	20	17.3 Å²	17.3	12%	0.121	9%	0.092	C	C	.	.			trans	-94.7	-40	-178.2	177.3	0	0	0	0	113.6	L291 L433 K437 W438 V439 L451	L291-V435 HydrophobicContact CB-CG2 4.43Å; L291-V435 WeakPolarHBondContact O-CG2 3.45Å; L433-V435 VanDerWaalsContact C-N 3.25Å; L433-V435 PolarHBondContact O-N 3.49Å; V435-K437 VanDerWaalsContact C-N 3.35Å; V435-K437 PolarHBondContact O-N 3.27Å; V435-K437 VanDerWaalsContact O-N 3.14Å; V435-W438 PolarHBondContact O-N 3.39Å; V435-V439 HydrophobicContact CG1-CG2 3.76Å; V435-V439 PolarHBondContact O-N 3.16Å; V435-L451 HydrophobicContact CG1-CD1 4.31Å
436	T	98.4	Very high	98.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-51	-48.1	-162.7	51	0	0	0	0	113.5	W438 V439 H440 L448 F452 L467 P469 F499	T436-W438 VanDerWaalsContact C-N 3.29Å; T436-W438 PolarHBondContact O-N 3.47Å; T436-V439 PolarHBondContact O-N 2.91Å; T436-H440 WeakPolarHBondContact O-CB 3.49Å; T436-H440 PolarHBondContact O-N 2.77Å; T436-L448 HydrophobicContact CG2-CD1 4.09Å; T436-F452 HydrophobicContact CG2-CE1 4.11Å; T436-F452 HydrophobicContact CG2-CZ 4.14Å; T436-L467 HydrophobicContact CG2-CD1 3.63Å; T436-P469 WeakPolarHBondContact OG1-CA 3.48Å; T436-F499 HydrophobicContact CG2-CE2 4.13Å
437	K	98.4	Very high	98.5	Very high	14 Å²	14	15.2 Å²	15.2	6%	0.061	8%	0.083	C	C	.	.	H	α-helix	trans	-56.1	-40.5	178.3	174.3	172	62.7	-175.7	0	113.6	V435 H440 L441 Q470 S474 Y475	V435-K437 VanDerWaalsContact C-N 3.35Å; V435-K437 PolarHBondContact O-N 3.27Å; V435-K437 VanDerWaalsContact O-N 3.14Å; K437-H440 PolarHBondContact O-N 3.35Å; K437-L441 HydrophobicContact CD-CD1 4.37Å; K437-L441 HydrophobicContact CG-CD1 3.8Å; K437-L441 HydrophobicContact CG-CG 4.2Å; K437-L441 WeakPolarHBondContact O-CB 3.46Å; K437-L441 VanDerWaalsContact O-CG 3.29Å; K437-L441 WeakPolarHBondContact O-CG 3.45Å; K437-L441 PolarHBondContact O-N 2.93Å; K437-Q470 HydrophobicContact CB-CB 4.15Å; K437-Q470 HydrophobicContact CD-CB 4.4Å; K437-Q470 VanDerWaalsContact N-OE1 3.13Å; K437-S474 WeakPolarHBondContact CD-O 3.48Å; K437-S474 VanDerWaalsContact NZ-CB 3.28Å; K437-S474 PolarHBondContact NZ-O 3.19Å; K437-S474 PolarHBondContact NZ-OG 2.9Å; K437-Y475 WeakPolarHBondContact CA-OH 3.3Å; K437-Y475 HydrophobicContact CB-CD2 4.35Å; K437-Y475 HydrophobicContact CB-CE1 4.13Å; K437-Y475 HydrophobicContact CB-CE2 3.8Å; K437-Y475 HydrophobicContact CD-CD1 4.37Å; K437-Y475 HydrophobicContact CD-CD2 3.59Å; K437-Y475 HydrophobicContact CD-CE2 3.91Å; K437-Y475 HydrophobicContact CD-CG 3.84Å; K437-Y475 HydrophobicContact CG-CD1 3.87Å; K437-Y475 HydrophobicContact CG-CD2 3.82Å; K437-Y475 HydrophobicContact CG-CE1 3.82Å; K437-Y475 HydrophobicContact CG-CE2 3.78Å; K437-Y475 HydrophobicContact CG-CG 3.86Å
438	W	98.5	Very high	98.5	Very high	23 Å²	23	14.9 Å²	14.9	9%	0.087	8%	0.081	C	C	.	.	H	α-helix	trans	-73	-36.3	-175.8	-62.3	114.1	0	0	0	111.5	Y255 G256 Y258 V435 T436 N442 R478 L481	Y255-W438 WeakPolarHBondContact O-CB 3.47Å; G256-W438 VanDerWaalsContact CA-CD2 3.41Å; G256-W438 VanDerWaalsContact N-CE3 3.32Å; Y258-W438 HydrophobicContact CE2-CH2 4.12Å; Y258-W438 AromaticContact CE2-CZ2 3.73Å; Y258-W438 HydrophobicContact CE2-CZ2 3.73Å; Y258-W438 WeakPolarHBondContact OH-CH2 3.47Å; V435-W438 PolarHBondContact O-N 3.39Å; T436-W438 VanDerWaalsContact C-N 3.29Å; T436-W438 PolarHBondContact O-N 3.47Å; W438-N442 WeakPolarHBondContact O-CB 3.33Å; W438-N442 PolarHBondContact O-N 3.09Å; W438-N442 PolarHBondContact O-ND2 3.25Å; W438-R478 HydrophobicContact CH2-CB 4.33Å; W438-R478 HydrophobicContact CH2-CG 3.75Å; W438-R478 HydrophobicContact CZ3-CB 4.42Å; W438-R478 HydrophobicContact CZ3-CG 4.32Å; W438-L481 HydrophobicContact CH2-CD1 4.49Å; W438-L481 HydrophobicContact CZ3-CD1 3.98Å
439	V	98.6	Very high	98.5	Very high	10 Å²	10	16.5 Å²	16.5	6%	0.061	9%	0.087	C	C	.	.	H	α-helix	trans	-64.3	-49.9	169.9	163.1	0	0	0	0	110.9	V413 V435 T436 L441 N442 W443 L448 L451	V413-V439 HydrophobicContact CG2-CB 4.27Å; V413-V439 HydrophobicContact CG2-CG1 3.6Å; V413-V439 HydrophobicContact CG2-CG2 3.76Å; V435-V439 HydrophobicContact CG1-CG2 3.76Å; V435-V439 PolarHBondContact O-N 3.16Å; T436-V439 PolarHBondContact O-N 2.91Å; V439-L441 PolarHBondContact O-N 3.49Å; V439-N442 PolarHBondContact O-N 2.82Å; V439-W443 HydrophobicContact CB-CE3 4.35Å; V439-W443 HydrophobicContact CG1-CE3 4.37Å; V439-W443 HydrophobicContact CG2-CE3 4.35Å; V439-W443 HydrophobicContact CG2-CZ3 4.15Å; V439-W443 PolarHBondContact O-N 3.4Å; V439-L448 HydrophobicContact CG1-CB 4.32Å; V439-L448 HydrophobicContact CG1-CD1 4.15Å; V439-L451 HydrophobicContact CB-CD1 4.31Å; V439-L451 HydrophobicContact CG1-CB 4.33Å; V439-L451 HydrophobicContact CG1-CD1 4.13Å; V439-L451 HydrophobicContact CG2-CD1 3.76Å
440	H	98.6	Very high	98.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.4	-39.8	-176.8	-160.5	-171.6	0	0	0	112.7	T436 K437 G444 D445 L448 Y475 I492 L494 F499	T436-H440 WeakPolarHBondContact O-CB 3.49Å; T436-H440 PolarHBondContact O-N 2.77Å; K437-H440 PolarHBondContact O-N 3.35Å; H440-G444 WeakPolarHBondContact O-CA 3.26Å; H440-G444 PolarHBondContact O-N 2.98Å; H440-D445 IonicContact CD2-OD1 3.55Å; H440-L448 HydrophobicContact CB-CB 4.44Å; H440-L448 HydrophobicContact CB-CD2 4.18Å; H440-Y475 HydrophobicContact CB-CE1 4.02Å; H440-Y475 AromaticContact CE1-CE1 2.76Å; H440-Y475 WeakPolarHBondContact CE1-CE1 3.44Å; H440-Y475 AromaticContact CE1-CE2 3.98Å; H440-Y475 AromaticContact CE1-CZ 2.66Å; H440-Y475 PolarHBondContact CE1-OH 3.32Å; H440-Y475 AromaticContact CG-CE1 3.9Å; H440-Y475 AromaticContact ND1-CE1 3.34Å; H440-Y475 VanDerWaalsContact ND1-CE1 3.34Å; H440-Y475 WeakPolarHBondContact ND1-CE1 3.41Å; H440-Y475 AromaticContact ND1-CZ 3.55Å; H440-Y475 PolarHBondContact ND1-OH 3.11Å; H440-I492 WeakPolarHBondContact NE2-CG2 3.35Å; H440-L494 PolarHBondContact NE2-O 3.29Å; H440-F499 AromaticContact CE1-CZ 3.56Å; H440-F499 AromaticContact ND1-CZ 3.91Å; H440-F499 AromaticContact NE2-CE1 3.43Å; H440-F499 WeakPolarHBondContact NE2-CE1 3.46Å; H440-F499 AromaticContact NE2-CZ 3.63Å
441	L	98.5	Very high	98.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-71.3	-35.5	174.7	-73.5	177.5	0	0	0	113.1	K437 V439 Y475 R478 I485 N488 Y489 I492	K437-L441 HydrophobicContact CD-CD1 4.37Å; K437-L441 HydrophobicContact CG-CD1 3.8Å; K437-L441 HydrophobicContact CG-CG 4.2Å; K437-L441 WeakPolarHBondContact O-CB 3.46Å; K437-L441 VanDerWaalsContact O-CG 3.29Å; K437-L441 WeakPolarHBondContact O-CG 3.45Å; K437-L441 PolarHBondContact O-N 2.93Å; V439-L441 PolarHBondContact O-N 3.49Å; L441-Y475 HydrophobicContact CD1-CD1 4.35Å; L441-Y475 HydrophobicContact CD2-CD1 3.71Å; L441-Y475 HydrophobicContact CD2-CE1 4.49Å; L441-Y475 HydrophobicContact CG-CD1 3.84Å; L441-Y475 HydrophobicContact CG-CE1 4.32Å; L441-R478 HydrophobicContact CD1-CB 4.05Å; L441-I485 HydrophobicContact CB-CG1 4.29Å; L441-I485 HydrophobicContact CB-CG2 4.23Å; L441-I485 HydrophobicContact CD1-CG2 4.44Å; L441-I485 HydrophobicContact CD2-CG2 4.24Å; L441-N488 VanDerWaalsContact O-CB 3.31Å; L441-N488 WeakPolarHBondContact O-CB 3.42Å; L441-N488 PolarHBondContact O-ND2 2.97Å; L441-Y489 HydrophobicContact CD2-CD2 4.23Å; L441-I492 HydrophobicContact CD2-CD1 4.44Å
442	N	98.4	Very high	98.5	Very high	8 Å²	8	18.2 Å²	18.2	4%	0.043	9%	0.093	C	C	.	.	H	α-helix	trans	-87.1	-31.6	-175.8	-75.9	-83.5	0	0	0	113.9	Q254 Y255 W438 V439 N484 N488	Q254-N442 PolarHBondContact O-ND2 3.42Å; Y255-N442 HydrophobicContact CD1-CB 4.27Å; Y255-N442 HydrophobicContact CE1-CB 4.17Å; Y255-N442 WeakPolarHBondContact CE1-OD1 3.47Å; W438-N442 WeakPolarHBondContact O-CB 3.33Å; W438-N442 PolarHBondContact O-N 3.09Å; W438-N442 PolarHBondContact O-ND2 3.25Å; V439-N442 PolarHBondContact O-N 2.82Å; N442-N484 PolarHBondContact O-ND2 3.25Å; N442-N488 VanDerWaalsContact C-ND2 3.26Å; N442-N488 PolarHBondContact O-ND2 3.27Å
443	W	98.4	Very high	98.5	Very high	73 Å²	73	21.8 Å²	21.8	28%	0.277	11%	0.109	S	C	.	.	H	α-helix	trans	-125.3	7.2	-176.3	-60.7	-85	0	0	0	114.5	Y255 I316 N411 V413 V439 G447	Y255-W443 AromaticContact CD1-CH2 3.85Å; Y255-W443 HydrophobicContact CD1-CH2 3.85Å; Y255-W443 HydrophobicContact CD1-CZ3 4.38Å; Y255-W443 AromaticContact CE1-CH2 3.79Å; Y255-W443 HydrophobicContact CE1-CH2 3.79Å; Y255-W443 HydrophobicContact CE1-CZ2 4.07Å; I316-W443 HydrophobicContact CD1-CH2 3.89Å; I316-W443 HydrophobicContact CD1-CZ2 4.21Å; N411-W443 VanDerWaalsContact ND2-CZ2 3.33Å; N411-W443 WeakPolarHBondContact ND2-CZ2 3.46Å; V413-W443 HydrophobicContact CB-CD2 4.25Å; V413-W443 HydrophobicContact CB-CE3 4.37Å; V413-W443 HydrophobicContact CG1-CB 4.21Å; V413-W443 HydrophobicContact CG1-CD2 4.24Å; V413-W443 HydrophobicContact CG1-CG 4.03Å; V413-W443 HydrophobicContact CG2-CD2 4.19Å; V413-W443 HydrophobicContact CG2-CE3 3.82Å; V413-W443 HydrophobicContact CG2-CZ3 4.15Å; V439-W443 HydrophobicContact CB-CE3 4.35Å; V439-W443 HydrophobicContact CG1-CE3 4.37Å; V439-W443 HydrophobicContact CG2-CE3 4.35Å; V439-W443 HydrophobicContact CG2-CZ3 4.15Å; V439-W443 PolarHBondContact O-N 3.4Å; W443-G447 PolarHBondContact O-N 2.91Å
444	G	98.4	Very high	98.5	Very high	6 Å²	6	23.5 Å²	23.5	6%	0.062	12%	0.115	C	C	.	.	H	α-helix	trans	66.6	-170.6	177	0	0	0	0	0	114.3	H440 S446 G447 L448	H440-G444 WeakPolarHBondContact O-CA 3.26Å; H440-G444 PolarHBondContact O-N 2.98Å; G444-S446 VanDerWaalsContact C-N 3.26Å; G444-S446 PolarHBondContact O-N 3.46Å; G444-G447 PolarHBondContact O-N 2.88Å; G444-G447 VanDerWaalsContact O-N 3.11Å; G444-L448 PolarHBondContact O-N 2.9Å; G444-L448 VanDerWaalsContact O-N 3.07Å
445	D	98.6	Very high	98.5	Very high	28 Å²	28	23.1 Å²	23.1	15%	0.15	11%	0.112	C	C	.	.	H	α-helix	trans	-52	-45.5	174.1	-69.3	27.8	0	0	0	111	H440 G447 L448 K449 I492 R493 L494	H440-D445 IonicContact CD2-OD1 3.55Å; D445-G447 VanDerWaalsContact C-N 3.28Å; D445-G447 PolarHBondContact O-N 3.41Å; D445-L448 PolarHBondContact O-N 3.31Å; D445-L448 VanDerWaalsContact O-N 3.12Å; D445-K449 WeakPolarHBondContact O-CB 3.38Å; D445-K449 WeakPolarHBondContact O-CG 3.44Å; D445-K449 PolarHBondContact O-N 1.96Å; D445-I492 WeakPolarHBondContact OD1-CA 3.33Å; D445-I492 WeakPolarHBondContact OD1-CG1 3.35Å; D445-R493 PolarHBondContact OD1-N 3.01Å; D445-R493 WeakPolarHBondContact OD2-CA 3.47Å; D445-R493 WeakPolarHBondContact OD2-CB 3.5Å; D445-R493 PolarHBondContact OD2-N 3.3Å; D445-L494 PolarHBondContact OD2-N 2.76Å
446	S	98.2	Very high	98.6	Very high	83 Å²	83	25.1 Å²	25.1	58%	0.58	12%	0.118	S	C	*	.	H	α-helix	trans	-62.6	-32.4	-179.5	-44.8	0	0	0	0	113.1	G444 R450	G444-S446 VanDerWaalsContact C-N 3.26Å; G444-S446 PolarHBondContact O-N 3.46Å; S446-R450 WeakPolarHBondContact O-CB 3.23Å; S446-R450 WeakPolarHBondContact O-CG 3.47Å; S446-R450 PolarHBondContact O-N 2.97Å; S446-R450 PolarHBondContact O-NE 3.22Å
447	G	98.4	Very high	98.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-71.3	-41.8	172	0	0	0	0	0	113.1	W443 G444 D445 L451	W443-G447 PolarHBondContact O-N 2.91Å; G444-G447 PolarHBondContact O-N 2.88Å; G444-G447 VanDerWaalsContact O-N 3.11Å; D445-G447 VanDerWaalsContact C-N 3.28Å; D445-G447 PolarHBondContact O-N 3.41Å; G447-L451 PolarHBondContact O-N 3.26Å
448	L	98.8	Very high	98.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-70.7	-44.5	179	-175.2	67.2	0	0	0	112.2	T436 V439 H440 G444 D445 R450 L451 F452 L494 F499	T436-L448 HydrophobicContact CG2-CD1 4.09Å; V439-L448 HydrophobicContact CG1-CB 4.32Å; V439-L448 HydrophobicContact CG1-CD1 4.15Å; H440-L448 HydrophobicContact CB-CB 4.44Å; H440-L448 HydrophobicContact CB-CD2 4.18Å; G444-L448 PolarHBondContact O-N 2.9Å; G444-L448 VanDerWaalsContact O-N 3.07Å; D445-L448 PolarHBondContact O-N 3.31Å; D445-L448 VanDerWaalsContact O-N 3.12Å; L448-R450 VanDerWaalsContact C-N 3.3Å; L448-R450 PolarHBondContact O-N 3.14Å; L448-L451 WeakPolarHBondContact O-CB 3.44Å; L448-L451 PolarHBondContact O-N 3.28Å; L448-L451 VanDerWaalsContact O-N 3.07Å; L448-F452 HydrophobicContact CD1-CE1 4.16Å; L448-F452 HydrophobicContact CD1-CE2 3.95Å; L448-F452 HydrophobicContact CD1-CZ 3.74Å; L448-F452 HydrophobicContact CD2-CE2 3.81Å; L448-F452 HydrophobicContact CD2-CZ 4.11Å; L448-F452 HydrophobicContact CG-CD2 4.08Å; L448-F452 HydrophobicContact CG-CE2 3.56Å; L448-F452 HydrophobicContact CG-CZ 3.88Å; L448-F452 PolarHBondContact O-N 2.91Å; L448-L494 HydrophobicContact CD2-CD2 4.36Å; L448-F499 HydrophobicContact CD2-CD1 4.2Å; L448-F499 HydrophobicContact CD2-CE1 3.38Å; L448-F499 HydrophobicContact CD2-CE2 4.15Å; L448-F499 HydrophobicContact CD2-CZ 3.35Å
449	K	98.7	Very high	98.6	Very high	64 Å²	64	28 Å²	28	28%	0.278	13%	0.129	S	C	.	.	H	α-helix	trans	-58.8	-40.7	174	-70.2	-168.9	168.7	-161	0	111.2	D445 F452 K453 L494 Y502	D445-K449 WeakPolarHBondContact O-CB 3.38Å; D445-K449 WeakPolarHBondContact O-CG 3.44Å; D445-K449 PolarHBondContact O-N 1.96Å; K449-F452 PolarHBondContact O-N 2.91Å; K449-K453 WeakPolarHBondContact O-CB 3.44Å; K449-K453 WeakPolarHBondContact O-CG 3.44Å; K449-K453 PolarHBondContact O-N 3.42Å; K449-L494 HydrophobicContact CG-CD2 4.24Å; K449-Y502 HydrophobicContact CB-CE1 4.14Å; K449-Y502 HydrophobicContact CD-CE1 4.26Å; K449-Y502 HydrophobicContact CD-CE2 3.88Å; K449-Y502 WeakPolarHBondContact CD-OH 3.23Å; K449-Y502 VanDerWaalsContact CE-CE2 3.42Å; K449-Y502 HydrophobicContact CG-CE1 3.69Å; K449-Y502 HydrophobicContact CG-CE2 4.23Å
450	R	98.6	Very high	98.6	Very high	36 Å²	36	31.4 Å²	31.4	14%	0.136	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-43.4	170.3	-85.2	-178	-73.5	-165.5	5.6	113.2	L414 E415 D417 L420 S446 L448 F452 K453 R454	L414-R450 VanDerWaalsContact O-CZ 3.28Å; L414-R450 PolarHBondContact O-NH1 2.85Å; E415-R450 PolarHBondContact O-NH1 3.25Å; D417-R450 WeakPolarHBondContact OD1-CD 3.31Å; D417-R450 WeakPolarHBondContact OD1-CG 3.42Å; D417-R450 IonicContact OD1-NE 3.87Å; L420-R450 HydrophobicContact CD1-CG 4.25Å; S446-R450 WeakPolarHBondContact O-CB 3.23Å; S446-R450 WeakPolarHBondContact O-CG 3.47Å; S446-R450 PolarHBondContact O-N 2.97Å; S446-R450 PolarHBondContact O-NE 3.22Å; L448-R450 VanDerWaalsContact C-N 3.3Å; L448-R450 PolarHBondContact O-N 3.14Å; R450-F452 VanDerWaalsContact C-N 3.33Å; R450-F452 PolarHBondContact O-N 3.07Å; R450-K453 PolarHBondContact O-N 2.98Å; R450-R454 WeakPolarHBondContact O-CB 3.38Å; R450-R454 PolarHBondContact O-N 2.99Å
451	L	98.8	Very high	98.6	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-46.3	176	176.7	150.5	0	0	0	111.2	Y412 V435 V439 G447 L448 R454 A455 F465	Y412-L451 HydrophobicContact CD1-CD1 4.17Å; Y412-L451 HydrophobicContact CD1-CG 3.98Å; Y412-L451 HydrophobicContact CE1-CG 4.28Å; V435-L451 HydrophobicContact CG1-CD1 4.31Å; V439-L451 HydrophobicContact CB-CD1 4.31Å; V439-L451 HydrophobicContact CG1-CB 4.33Å; V439-L451 HydrophobicContact CG1-CD1 4.13Å; V439-L451 HydrophobicContact CG2-CD1 3.76Å; G447-L451 PolarHBondContact O-N 3.26Å; L448-L451 WeakPolarHBondContact O-CB 3.44Å; L448-L451 PolarHBondContact O-N 3.28Å; L448-L451 VanDerWaalsContact O-N 3.07Å; L451-R454 PolarHBondContact O-N 3.47Å; L451-A455 WeakPolarHBondContact O-CB 3.43Å; L451-A455 PolarHBondContact O-N 2.8Å; L451-F465 HydrophobicContact CD2-CZ 4.27Å
452	F	98.8	Very high	98.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.8	-48.5	179.3	-65.2	-36.6	0	0	0	112.2	T436 L448 K449 R450 R454 A455 Y456 F465 L467 F499 Y502 L503 V507	T436-F452 HydrophobicContact CG2-CE1 4.11Å; T436-F452 HydrophobicContact CG2-CZ 4.14Å; L448-F452 HydrophobicContact CD1-CE1 4.16Å; L448-F452 HydrophobicContact CD1-CE2 3.95Å; L448-F452 HydrophobicContact CD1-CZ 3.74Å; L448-F452 HydrophobicContact CD2-CE2 3.81Å; L448-F452 HydrophobicContact CD2-CZ 4.11Å; L448-F452 HydrophobicContact CG-CD2 4.08Å; L448-F452 HydrophobicContact CG-CE2 3.56Å; L448-F452 HydrophobicContact CG-CZ 3.88Å; L448-F452 PolarHBondContact O-N 2.91Å; K449-F452 PolarHBondContact O-N 2.91Å; R450-F452 VanDerWaalsContact C-N 3.33Å; R450-F452 PolarHBondContact O-N 3.07Å; F452-R454 VanDerWaalsContact C-N 3.28Å; F452-R454 PolarHBondContact O-N 3.46Å; F452-A455 PolarHBondContact O-N 3.1Å; F452-Y456 PolarHBondContact O-N 3.41Å; F452-F465 AromaticContact CD1-CE1 3.87Å; F452-F465 HydrophobicContact CD1-CE1 3.87Å; F452-F465 AromaticContact CD1-CZ 3.88Å; F452-F465 HydrophobicContact CD1-CZ 3.88Å; F452-F465 HydrophobicContact CE1-CE1 4.04Å; F452-F465 HydrophobicContact CE1-CZ 4.1Å; F452-L467 HydrophobicContact CE1-CD1 4.19Å; F452-L467 HydrophobicContact CE1-CD2 4.39Å; F452-F499 HydrophobicContact CE2-CD1 4.26Å; F452-F499 HydrophobicContact CE2-CG 4.22Å; F452-F499 HydrophobicContact CZ-CB 4.36Å; F452-F499 HydrophobicContact CZ-CD1 4.45Å; F452-F499 AromaticContact CZ-CD2 4Å; F452-F499 HydrophobicContact CZ-CD2 4Å; F452-F499 HydrophobicContact CZ-CE2 4.41Å; F452-F499 HydrophobicContact CZ-CG 4.03Å; F452-Y502 AromaticContact CD2-CD1 3.87Å; F452-Y502 HydrophobicContact CD2-CD1 3.87Å; F452-Y502 HydrophobicContact CD2-CE1 4.1Å; F452-Y502 HydrophobicContact CE2-CD1 4.45Å; F452-L503 HydrophobicContact CB-CD2 3.71Å; F452-L503 HydrophobicContact CD1-CD1 4.48Å; F452-L503 HydrophobicContact CD1-CD2 3.76Å; F452-L503 HydrophobicContact CD1-CG 4.47Å; F452-L503 HydrophobicContact CD2-CD2 4.22Å; F452-L503 HydrophobicContact CD2-CG 4.5Å; F452-L503 HydrophobicContact CE1-CD1 4.3Å; F452-L503 HydrophobicContact CE1-CD2 4.37Å; F452-L503 HydrophobicContact CG-CD2 3.67Å; F452-L503 HydrophobicContact CG-CG 4.38Å; F452-L503 HydrophobicContact CZ-CD1 4.47Å; F452-V507 HydrophobicContact CB-CG2 4.03Å
453	K	98.7	Very high	98.5	Very high	76 Å²	76	39.6 Å²	39.6	33%	0.33	21%	0.206	S	C	.	.	H	α-helix	trans	-61.3	-34.7	175.2	-71.1	-171.1	177	-169.1	0	112.5	L420 K449 R450 R457 Y502 E506 V507	L420-K453 HydrophobicContact CD1-CB 4.07Å; L420-K453 HydrophobicContact CD2-CB 4.18Å; K449-K453 WeakPolarHBondContact O-CB 3.44Å; K449-K453 WeakPolarHBondContact O-CG 3.44Å; K449-K453 PolarHBondContact O-N 3.42Å; R450-K453 PolarHBondContact O-N 2.98Å; K453-R457 WeakPolarHBondContact O-CG 3.37Å; K453-R457 PolarHBondContact O-N 2.79Å; K453-Y502 WeakPolarHBondContact CE-OH 3.47Å; K453-E506 WeakPolarHBondContact CE-O 3.35Å; K453-V507 HydrophobicContact CG-CG1 4.43Å; K453-V507 HydrophobicContact CG-CG2 4.07Å
454	R	98.6	Very high	98.6	Very high	44 Å²	44	37 Å²	37	17%	0.166	20%	0.197	C	C	.	.	H	α-helix	trans	-67.7	-49.9	173.9	-166.8	-174.4	-179.6	178.9	0.5	111.1	Y412 L414 L420 Q423 R450 L451 F452 Y456 R457 H458	Y412-R454 HydrophobicContact CE1-CB 4.13Å; Y412-R454 HydrophobicContact CE1-CG 4.14Å; Y412-R454 HydrophobicContact CE2-CG 4.3Å; Y412-R454 VanDerWaalsContact CZ-CD 3.48Å; Y412-R454 WeakPolarHBondContact O-CD 3.42Å; Y412-R454 PolarHBondContact O-NH1 2.71Å; L414-R454 HydrophobicContact CD1-CG 4.12Å; L420-R454 HydrophobicContact CD2-CB 3.75Å; L420-R454 HydrophobicContact CD2-CG 4.4Å; Q423-R454 HydrophobicContact CG-CG 4.06Å; R450-R454 WeakPolarHBondContact O-CB 3.38Å; R450-R454 PolarHBondContact O-N 2.99Å; L451-R454 PolarHBondContact O-N 3.47Å; F452-R454 VanDerWaalsContact C-N 3.28Å; F452-R454 PolarHBondContact O-N 3.46Å; R454-Y456 VanDerWaalsContact C-N 3.31Å; R454-Y456 PolarHBondContact O-N 3.3Å; R454-R457 PolarHBondContact O-N 3.06Å; R454-R457 VanDerWaalsContact O-N 3.12Å; R454-H458 WeakPolarHBondContact O-CB 3.43Å; R454-H458 PolarHBondContact O-N 2.97Å
455	A	98.7	Very high	98.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-56.6	-45.8	179.8	0	0	0	0	0	111.6	Y412 I430 L451 F452 R457 H458 L459 F465	Y412-A455 WeakPolarHBondContact OH-CA 3.47Å; Y412-A455 PolarHBondContact OH-N 2.97Å; I430-A455 HydrophobicContact CD1-CB 4.27Å; I430-A455 WeakPolarHBondContact CD1-O 3.46Å; L451-A455 WeakPolarHBondContact O-CB 3.43Å; L451-A455 PolarHBondContact O-N 2.8Å; F452-A455 PolarHBondContact O-N 3.1Å; A455-R457 PolarHBondContact O-N 3.11Å; A455-H458 PolarHBondContact O-N 3.24Å; A455-L459 PolarHBondContact O-N 3.19Å; A455-F465 HydrophobicContact CB-CD2 3.82Å; A455-F465 HydrophobicContact CB-CE2 3.58Å; A455-F465 HydrophobicContact CB-CZ 4.18Å
456	Y	98.8	Very high	98.6	Very high	61 Å²	61	35.3 Å²	35.3	24%	0.239	19%	0.187	C	C	.	.	H	α-helix	trans	-59.3	-44.8	174.6	-177.6	-100.9	0	0	0	113.1	F452 R454 H458 V507 G508 F509 K534	F452-Y456 PolarHBondContact O-N 3.41Å; R454-Y456 VanDerWaalsContact C-N 3.31Å; R454-Y456 PolarHBondContact O-N 3.3Å; Y456-H458 VanDerWaalsContact C-N 3.3Å; Y456-H458 PolarHBondContact O-N 3.08Å; Y456-V507 VanDerWaalsContact CB-CG1 3.49Å; Y456-V507 WeakPolarHBondContact CD1-O 3.45Å; Y456-V507 HydrophobicContact CD2-CG1 4.46Å; Y456-V507 HydrophobicContact CG-CG1 3.94Å; Y456-G508 VanDerWaalsContact CE2-C 3.44Å; Y456-G508 WeakPolarHBondContact CE2-O 3.46Å; Y456-G508 PolarHBondContact OH-O 2.63Å; Y456-F509 AromaticContact CD2-CD1 3.98Å; Y456-F509 HydrophobicContact CD2-CD1 3.98Å; Y456-F509 AromaticContact CD2-CD2 3.86Å; Y456-F509 HydrophobicContact CD2-CD2 3.86Å; Y456-F509 AromaticContact CD2-CE1 3.93Å; Y456-F509 HydrophobicContact CD2-CE1 3.93Å; Y456-F509 AromaticContact CD2-CE2 3.81Å; Y456-F509 HydrophobicContact CD2-CE2 3.81Å; Y456-F509 AromaticContact CD2-CG 3.95Å; Y456-F509 HydrophobicContact CD2-CG 3.95Å; Y456-F509 AromaticContact CD2-CZ 3.85Å; Y456-F509 HydrophobicContact CD2-CZ 3.85Å; Y456-F509 HydrophobicContact CE2-CD1 4.48Å; Y456-F509 HydrophobicContact CE2-CG 4.44Å; Y456-F509 HydrophobicContact CG-CE2 4.23Å; Y456-F509 HydrophobicContact CG-CZ 4.38Å; Y456-K534 HydrophobicContact CD2-CB 4.41Å; Y456-K534 HydrophobicContact CD2-CD 3.94Å; Y456-K534 HydrophobicContact CD2-CG 4.12Å; Y456-K534 HydrophobicContact CE2-CB 4.06Å; Y456-K534 HydrophobicContact CE2-CD 3.71Å; Y456-K534 HydrophobicContact CE2-CG 3.52Å; Y456-K534 WeakPolarHBondContact O-CD 3.45Å; Y456-K534 WeakPolarHBondContact O-CE 3.31Å; Y456-K534 PolarHBondContact O-NZ 3.14Å
457	R	98.4	Very high	98.6	Very high	90 Å²	90	31.4 Å²	31.4	34%	0.34	16%	0.159	S	C	.	.	H	α-helix	trans	-69.6	-26.2	176.4	-70.3	-179.8	68.2	83.1	-1.5	113.5	L420 M421 Q423 R424 A425 K453 R454 A455	L420-R457 WeakPolarHBondContact O-CD 3.43Å; L420-R457 PolarHBondContact O-NE 3.35Å; M421-R457 PolarHBondContact O-NH2 3.04Å; Q423-R457 HydrophobicContact CB-CB 4.35Å; Q423-R457 HydrophobicContact CG-CB 4.19Å; R424-R457 CarbonylContact C-O 3.54Å; A425-R457 WeakPolarHBondContact CA-O 3.19Å; A425-R457 PolarHBondContact N-O 3.24Å; K453-R457 WeakPolarHBondContact O-CG 3.37Å; K453-R457 PolarHBondContact O-N 2.79Å; R454-R457 PolarHBondContact O-N 3.06Å; R454-R457 VanDerWaalsContact O-N 3.12Å; A455-R457 PolarHBondContact O-N 3.11Å
458	H	98.5	Very high	98.6	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-82.5	-21.5	-178	-159.3	-159.3	0	0	0	113.4	L289 Y412 Q423 R424 E426 Y427 I430 R454 A455 Y456	L289-H458 WeakPolarHBondContact CD2-CE1 3.33Å; L289-H458 VanDerWaalsContact CD2-ND1 3.29Å; L289-H458 WeakPolarHBondContact CD2-ND1 3.35Å; Y412-H458 AromaticContact CE2-CE1 3.91Å; Y412-H458 AromaticContact CE2-ND1 3.72Å; Y412-H458 AromaticContact CZ-ND1 3.82Å; Y412-H458 PolarHBondContact OH-ND1 2.87Å; Y412-H458 VanDerWaalsContact OH-ND1 3.08Å; Q423-H458 VanDerWaalsContact CD-CD2 3.44Å; Q423-H458 HydrophobicContact CG-CB 4.13Å; Q423-H458 PolarHBondContact NE2-CD2 3.29Å; Q423-H458 PolarHBondContact NE2-NE2 3.09Å; R424-H458 WeakPolarHBondContact O-CA 3.28Å; E426-H458 PolarHBondContact N-O 3.29Å; E426-H458 IonicContact OE1-CD2 3.89Å; E426-H458 IonicContact OE1-NE2 3.71Å; E426-H458 IonicContact OE2-NE2 3.61Å; Y427-H458 AromaticContact CD2-CD2 3.82Å; Y427-H458 AromaticContact CD2-CE1 3.53Å; Y427-H458 AromaticContact CD2-CG 3.95Å; Y427-H458 AromaticContact CD2-ND1 3.75Å; Y427-H458 AromaticContact CD2-NE2 3.61Å; Y427-H458 AromaticContact CE2-CD2 3.98Å; Y427-H458 AromaticContact CE2-CE1 3.36Å; Y427-H458 WeakPolarHBondContact CE2-CE1 3.15Å; Y427-H458 AromaticContact CE2-NE2 3.32Å; Y427-H458 VanDerWaalsContact CE2-NE2 3.32Å; Y427-H458 WeakPolarHBondContact CE2-NE2 3.49Å; Y427-H458 PolarHBondContact N-O 2.8Å; I430-H458 HydrophobicContact CD1-CB 3.77Å; R454-H458 WeakPolarHBondContact O-CB 3.43Å; R454-H458 PolarHBondContact O-N 2.97Å; A455-H458 PolarHBondContact O-N 3.24Å; Y456-H458 VanDerWaalsContact C-N 3.3Å; Y456-H458 PolarHBondContact O-N 3.08Å
459	L	98.8	Very high	98.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	143.1	170.3	-76.8	171.1	0	0	0	112.5	A425 Y427 D428 I430 A455 F465 F509 K534	A425-L459 VanDerWaalsContact CB-O 3.31Å; A425-L459 WeakPolarHBondContact CB-O 3.34Å; Y427-L459 CarbonylContact O-C 3.38Å; Y427-L459 VanDerWaalsContact O-CA 3.31Å; Y427-L459 WeakPolarHBondContact O-CA 3.26Å; D428-L459 WeakPolarHBondContact O-CD2 3.33Å; I430-L459 HydrophobicContact CB-CD2 4.39Å; I430-L459 HydrophobicContact CD1-CD2 4.11Å; I430-L459 HydrophobicContact CD1-CG 3.85Å; I430-L459 HydrophobicContact CG1-CD2 3.74Å; I430-L459 HydrophobicContact CG1-CG 4.03Å; A455-L459 PolarHBondContact O-N 3.19Å; L459-F465 HydrophobicContact CD1-CB 3.91Å; L459-F509 HydrophobicContact CD1-CE1 3.81Å; L459-F509 HydrophobicContact CD1-CZ 4.21Å; L459-K534 HydrophobicContact CB-CD 3.82Å; L459-K534 PolarHBondContact O-NZ 2.86Å
460	R	98.7	Very high	98.5	Very high	81 Å²	81	29 Å²	29	31%	0.306	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	160.4	163.2	-60.2	-174.1	-171.1	128.3	-3.2	110.5	D287 A425 E426 Y427 D428 G463	D287-R460 IonicContact OD2-CZ 2.68Å; D287-R460 VanDerWaalsContact OD2-CZ 3.31Å; D287-R460 IonicContact OD2-NH1 3.79Å; D287-R460 PolarHBondContact OD2-NH1 3.01Å; D287-R460 IonicContact OD2-NH2 3.98Å; D287-R460 PolarHBondContact OD2-NH2 2.9Å; A425-R460 HydrophobicContact CB-CG 4.25Å; E426-R460 PolarHBondContact O-NH2 2.92Å; Y427-R460 PolarHBondContact O-N 3.43Å; D428-R460 WeakPolarHBondContact OD1-CD 3.02Å; D428-R460 IonicContact OD1-CZ 3.81Å; D428-R460 IonicContact OD1-NE 3.69Å; D428-R460 IonicContact OD1-NH1 3.24Å; D428-R460 PolarHBondContact OD1-NH1 2.94Å; D428-R460 IonicContact OD2-NH1 3.46Å; D428-R460 PolarHBondContact OD2-NH1 3.46Å; D428-R460 VanDerWaalsContact OD2-NH1 3.1Å; R460-G463 WeakPolarHBondContact O-CA 3.42Å; R460-G463 PolarHBondContact O-N 3.36Å
461	P	98.3	Very high	98.3	Very high	116 Å²	116	30 Å²	30	75%	0.753	16%	0.161	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-56.4	140.2	171.5	-22.3	34.1	0	0	0	111.2	G463	P461-G463 PolarHBondContact O-N 2.78Å
462	G	97.6	Very high	98.2	Very high	61 Å²	61	32.8 Å²	32.8	63%	0.629	17%	0.172	S	C	*	.	E	Extended strand (participates in β ladder)	trans	72.9	7	-171.2	0	0	0	0	0	114.4	K534	G462-K534 WeakPolarHBondContact CA-O 3.41Å; G462-K534 PolarHBondContact N-O 3.25Å
463	G	98.5	Very high	98	Very high	3 Å²	3	38.5 Å²	38.5	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	158.3	-179.7	0	0	0	0	0	113.9	D428 R460 P461 K534	D428-G463 CarbonylContact O-C 3.47Å; D428-G463 WeakPolarHBondContact O-CA 3.32Å; R460-G463 WeakPolarHBondContact O-CA 3.42Å; R460-G463 PolarHBondContact O-N 3.36Å; P461-G463 PolarHBondContact O-N 2.78Å; G463-K534 PolarHBondContact O-N 3.09Å
464	L	98.8	Very high	97.8	Very high	18 Å²	18	36 Å²	36	9%	0.094	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.2	-172.6	-54.8	-179.9	0	0	0	112.2	W282 D428 V429 I430 V531 F532 H533	W282-L464 HydrophobicContact CB-CD1 3.89Å; W282-L464 HydrophobicContact CD2-CD1 4.15Å; W282-L464 HydrophobicContact CG-CD1 3.66Å; D428-L464 PolarHBondContact O-N 3.32Å; V429-L464 CarbonylContact C-O 3.5Å; V429-L464 WeakPolarHBondContact CA-O 3.08Å; V429-L464 HydrophobicContact CG1-CB 4.43Å; V429-L464 HydrophobicContact CG2-CB 4.31Å; V429-L464 HydrophobicContact CG2-CD1 4.48Å; I430-L464 PolarHBondContact N-O 2.76Å; L464-V531 HydrophobicContact CB-CG2 3.92Å; L464-V531 HydrophobicContact CD1-CG2 4.44Å; L464-V531 HydrophobicContact CD2-CG2 3.99Å; L464-V531 HydrophobicContact CG-CG2 4.34Å; L464-F532 WeakPolarHBondContact CA-O 3.43Å; L464-H533 VanDerWaalsContact CD2-ND1 3.34Å; L464-H533 WeakPolarHBondContact CD2-ND1 3.46Å
465	F	98.8	Very high	97.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	110.9	169.9	180	-120.9	0	0	0	109.9	I430 C432 L451 F452 A455 L459 L467 L503 F509 V531 F532	I430-F465 HydrophobicContact CB-CD2 4.07Å; I430-F465 HydrophobicContact CG2-CD2 3.99Å; I430-F465 HydrophobicContact CG2-CE2 4.13Å; C432-F465 HydrophobicContact CB-CD2 4.45Å; C432-F465 HydrophobicContact CB-CE2 3.52Å; C432-F465 HydrophobicContact CB-CZ 3.69Å; L451-F465 HydrophobicContact CD2-CZ 4.27Å; F452-F465 AromaticContact CD1-CE1 3.87Å; F452-F465 HydrophobicContact CD1-CE1 3.87Å; F452-F465 AromaticContact CD1-CZ 3.88Å; F452-F465 HydrophobicContact CD1-CZ 3.88Å; F452-F465 HydrophobicContact CE1-CE1 4.04Å; F452-F465 HydrophobicContact CE1-CZ 4.1Å; A455-F465 HydrophobicContact CB-CD2 3.82Å; A455-F465 HydrophobicContact CB-CE2 3.58Å; A455-F465 HydrophobicContact CB-CZ 4.18Å; L459-F465 HydrophobicContact CD1-CB 3.91Å; F465-L467 HydrophobicContact CE1-CB 4.38Å; F465-L467 HydrophobicContact CE1-CD1 3.84Å; F465-L467 HydrophobicContact CE1-CD2 4.26Å; F465-L467 HydrophobicContact CE1-CG 4.39Å; F465-L467 HydrophobicContact CZ-CD1 3.84Å; F465-L503 HydrophobicContact CD1-CD1 4.43Å; F465-L503 HydrophobicContact CD1-CD2 4.36Å; F465-L503 HydrophobicContact CE1-CD1 4.12Å; F465-L503 HydrophobicContact CE1-CD2 4.09Å; F465-F509 HydrophobicContact CB-CD1 4.5Å; F465-F509 HydrophobicContact CB-CE1 3.48Å; F465-F509 VanDerWaalsContact CB-CE1 3.48Å; F465-F509 HydrophobicContact CB-CZ 3.54Å; F465-F509 HydrophobicContact CD1-CE2 4.28Å; F465-F509 AromaticContact CD1-CZ 3.94Å; F465-F509 HydrophobicContact CD1-CZ 3.94Å; F465-F509 HydrophobicContact CG-CE1 4.31Å; F465-F509 AromaticContact CG-CZ 3.88Å; F465-F509 HydrophobicContact CG-CZ 3.88Å; F465-V531 WeakPolarHBondContact O-CA 3.49Å; F465-F532 HydrophobicContact CB-CB 4.27Å; F465-F532 HydrophobicContact CD1-CD2 4.13Å; F465-F532 PolarHBondContact N-O 3.47Å; F465-F532 PolarHBondContact O-N 3.49Å
466	I	98.8	Very high	97.5	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.9	-175.4	-52.1	-179.2	0	0	0	109.8	L278 W282 F283 V429 I430 L431 C432 L433 V529 Y530 V531	L278-I466 HydrophobicContact CD2-CD1 4.09Å; L278-I466 HydrophobicContact CD2-CG2 3.87Å; W282-I466 HydrophobicContact CE3-CD1 3.7Å; W282-I466 HydrophobicContact CZ3-CD1 4Å; F283-I466 HydrophobicContact CE1-CD1 4.48Å; F283-I466 HydrophobicContact CZ-CD1 3.92Å; V429-I466 HydrophobicContact CG1-CD1 3.95Å; V429-I466 HydrophobicContact CG1-CG1 4.28Å; I430-I466 PolarHBondContact O-N 3.32Å; L431-I466 HydrophobicContact CD2-CB 3.84Å; L431-I466 HydrophobicContact CD2-CD1 3.89Å; L431-I466 HydrophobicContact CD2-CG1 4.25Å; L431-I466 HydrophobicContact CD2-CG2 4.33Å; C432-I466 PolarHBondContact N-O 2.94Å; L433-I466 HydrophobicContact CD2-CG2 4.25Å; I466-V529 HydrophobicContact CG2-CG1 3.71Å; I466-Y530 CarbonylContact C-O 3.6Å; I466-Y530 WeakPolarHBondContact CA-O 3.41Å; I466-V531 HydrophobicContact CG1-CB 4.25Å; I466-V531 HydrophobicContact CG1-CG2 4Å
467	L	98.8	Very high	97.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121.5	-164.3	-168.9	66.8	0	0	0	111.6	C432 T436 F452 F465 P469 L503 V529 Y530 F532	C432-L467 HydrophobicContact CB-CD1 3.76Å; T436-L467 HydrophobicContact CG2-CD1 3.63Å; F452-L467 HydrophobicContact CE1-CD1 4.19Å; F452-L467 HydrophobicContact CE1-CD2 4.39Å; F465-L467 HydrophobicContact CE1-CB 4.38Å; F465-L467 HydrophobicContact CE1-CD1 3.84Å; F465-L467 HydrophobicContact CE1-CD2 4.26Å; F465-L467 HydrophobicContact CE1-CG 4.39Å; F465-L467 HydrophobicContact CZ-CD1 3.84Å; L467-P469 WeakPolarHBondContact O-CD 3.49Å; L467-L503 HydrophobicContact CD2-CD1 3.73Å; L467-V529 WeakPolarHBondContact O-CA 3.25Å; L467-Y530 PolarHBondContact N-O 2.91Å; L467-Y530 PolarHBondContact O-N 3.02Å; L467-F532 HydrophobicContact CB-CD2 4.47Å; L467-F532 HydrophobicContact CB-CE2 4.15Å; L467-F532 HydrophobicContact CD2-CE2 3.83Å; L467-F532 HydrophobicContact CD2-CZ 4.47Å
468	E	98.1	Very high	97.1	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	84.3	167	-179.6	-150.5	171.9	0	0	107.7	R265 R274 C432 L433 S434 R527 V529	R265-E468 IonicContact CZ-OE1 3.98Å; R265-E468 IonicContact CZ-OE2 3.33Å; R265-E468 IonicContact NH1-OE1 3.5Å; R265-E468 PolarHBondContact NH1-OE1 3.4Å; R265-E468 IonicContact NH1-OE2 2.79Å; R265-E468 PolarHBondContact NH1-OE2 3.11Å; R265-E468 IonicContact NH2-OE1 3.58Å; R265-E468 PolarHBondContact NH2-OE1 2.92Å; R265-E468 IonicContact NH2-OE2 3.27Å; R274-E468 WeakPolarHBondContact CD-OE2 3.41Å; R274-E468 IonicContact CZ-OE2 2.9Å; R274-E468 IonicContact NE-OE2 3.81Å; R274-E468 IonicContact NH1-OE2 2.87Å; R274-E468 PolarHBondContact NH1-OE2 3.21Å; C432-E468 PolarHBondContact O-N 3.44Å; L433-E468 HydrophobicContact CB-CB 4.24Å; L433-E468 HydrophobicContact CD2-CB 3.71Å; S434-E468 WeakPolarHBondContact CA-O 3.13Å; S434-E468 PolarHBondContact N-O 3.03Å; S434-E468 PolarHBondContact N-OE2 3.35Å; S434-E468 PolarHBondContact OG-OE1 3.21Å; S434-E468 PolarHBondContact OG-OE2 3.4Å; E468-R527 HydrophobicContact CG-CB 4.03Å; E468-R527 IonicContact OE1-CZ 3.56Å; E468-R527 IonicContact OE1-NH1 2.75Å; E468-R527 PolarHBondContact OE1-NH1 3.3Å; E468-V529 HydrophobicContact CB-CG2 4.38Å; E468-V529 HydrophobicContact CG-CG2 4.46Å
469	P	97.9	Very high	96.9	Very high	9 Å²	9	46.5 Å²	46.5	6%	0.058	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-73.1	147.4	179.2	32.5	-32.9	0	0	0	110.5	T436 L467 F499 P528 Y530	T436-P469 WeakPolarHBondContact OG1-CA 3.48Å; L467-P469 WeakPolarHBondContact O-CD 3.49Å; P469-F499 HydrophobicContact CB-CD2 3.93Å; P469-F499 HydrophobicContact CB-CE2 4.09Å; P469-P528 WeakPolarHBondContact CD-O 3.5Å; P469-Y530 HydrophobicContact CG-CD2 4.17Å; P469-Y530 HydrophobicContact CG-CE2 3.91Å
470	Q	97.1	Very high	96.7	Very high	5 Å²	5	55.3 Å²	55.3	2%	0.023	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-90.9	139.7	173	-60.9	119.4	-40.8	0	0	111.3	S434 K437 Y475	S434-Q470 VanDerWaalsContact C-NE2 3.31Å; S434-Q470 PolarHBondContact O-NE2 2.97Å; S434-Q470 PolarHBondContact O-OE1 3Å; K437-Q470 HydrophobicContact CB-CB 4.15Å; K437-Q470 HydrophobicContact CD-CB 4.4Å; K437-Q470 VanDerWaalsContact N-OE1 3.13Å; Q470-Y475 WeakPolarHBondContact O-CE2 3.11Å
471	P	96	Very high	96.5	Very high	57 Å²	57	53.4 Å²	53.4	37%	0.37	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-70.1	155.9	-177.5	31.6	-38	0	0	0	111.7	E473 S474	P471-E473 VanDerWaalsContact C-N 3.32Å; P471-E473 WeakPolarHBondContact CB-OE2 3.28Å; P471-E473 PolarHBondContact O-N 2.87Å; P471-S474 VanDerWaalsContact O-CB 3.3Å; P471-S474 WeakPolarHBondContact O-CB 3.43Å; P471-S474 PolarHBondContact O-N 3.04Å; P471-S474 PolarHBondContact O-OG 2.76Å
472	W	96.4	Very high	96.4	Very high	58 Å²	58	49.5 Å²	49.5	22%	0.22	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-34	-166	177.8	-116.7	0	0	0	113.5	S474 Y475 Y489 I492 K495 P496	W472-S474 PolarHBondContact O-N 2.99Å; W472-S474 VanDerWaalsContact O-N 3.11Å; W472-Y475 AromaticContact CE3-CD1 3.9Å; W472-Y475 HydrophobicContact CE3-CD1 3.9Å; W472-Y475 AromaticContact CE3-CD2 3.91Å; W472-Y475 HydrophobicContact CE3-CD2 3.91Å; W472-Y475 HydrophobicContact CE3-CE1 4.19Å; W472-Y475 HydrophobicContact CE3-CE2 4.19Å; W472-Y475 AromaticContact CE3-CG 3.77Å; W472-Y475 HydrophobicContact CE3-CG 3.77Å; W472-Y475 AromaticContact CZ3-CD1 3.66Å; W472-Y475 HydrophobicContact CZ3-CD1 3.66Å; W472-Y475 HydrophobicContact CZ3-CD2 4.5Å; W472-Y475 HydrophobicContact CZ3-CE1 4.01Å; W472-Y475 AromaticContact CZ3-CG 3.94Å; W472-Y475 HydrophobicContact CZ3-CG 3.94Å; W472-Y475 VanDerWaalsContact O-CB 3.23Å; W472-Y475 WeakPolarHBondContact O-CB 3.42Å; W472-Y475 WeakPolarHBondContact O-CD2 3.43Å; W472-Y475 PolarHBondContact O-N 3.07Å; W472-Y489 HydrophobicContact CH2-CD2 4.03Å; W472-Y489 AromaticContact CH2-CE2 3.77Å; W472-Y489 HydrophobicContact CH2-CE2 3.77Å; W472-Y489 HydrophobicContact CZ2-CD2 4.45Å; W472-Y489 AromaticContact CZ2-CE2 3.76Å; W472-Y489 HydrophobicContact CZ2-CE2 3.76Å; W472-Y489 AromaticContact CZ2-CZ 3.89Å; W472-Y489 HydrophobicContact CZ3-CE2 4.49Å; W472-I492 HydrophobicContact CH2-CB 4.25Å; W472-I492 HydrophobicContact CH2-CG2 4.01Å; W472-I492 HydrophobicContact CZ3-CB 4.4Å; W472-I492 HydrophobicContact CZ3-CD1 4.34Å; W472-I492 HydrophobicContact CZ3-CG2 3.81Å; W472-K495 HydrophobicContact CD2-CD 4.4Å; W472-K495 HydrophobicContact CE3-CD 4.28Å; W472-K495 HydrophobicContact CH2-CD 4.45Å; W472-K495 HydrophobicContact CZ3-CD 4.31Å; W472-P496 HydrophobicContact CB-CG 4.37Å
473	E	94.5	Very high	96.3	Very high	120 Å²	120	52.8 Å²	52.8	56%	0.561	25%	0.245	S	C	*	.	H	α-helix	trans	-57.6	-32.3	177.5	-57.8	60.2	-118.2	0	0	110.3	P471 Y475 V476	P471-E473 VanDerWaalsContact C-N 3.32Å; P471-E473 WeakPolarHBondContact CB-OE2 3.28Å; P471-E473 PolarHBondContact O-N 2.87Å; E473-Y475 VanDerWaalsContact C-N 3.26Å; E473-Y475 PolarHBondContact O-N 3.37Å; E473-V476 WeakPolarHBondContact O-CB 3.5Å; E473-V476 PolarHBondContact O-N 3.09Å
474	S	94.8	Very high	96.3	Very high	24 Å²	24	55.3 Å²	55.3	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-76.1	-8.8	179.5	85	0	0	0	0	114	K437 P471 W472	K437-S474 WeakPolarHBondContact CD-O 3.48Å; K437-S474 VanDerWaalsContact NZ-CB 3.28Å; K437-S474 PolarHBondContact NZ-O 3.19Å; K437-S474 PolarHBondContact NZ-OG 2.9Å; P471-S474 VanDerWaalsContact O-CB 3.3Å; P471-S474 WeakPolarHBondContact O-CB 3.43Å; P471-S474 PolarHBondContact O-N 3.04Å; P471-S474 PolarHBondContact O-OG 2.76Å; W472-S474 PolarHBondContact O-N 2.99Å; W472-S474 VanDerWaalsContact O-N 3.11Å
475	Y	97	Very high	96.2	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-80.8	-38.3	168.4	-67.5	-123.9	0	0	0	110.7	K437 H440 L441 Q470 W472 E473 R477 R478 K479 I492 P496	K437-Y475 WeakPolarHBondContact CA-OH 3.3Å; K437-Y475 HydrophobicContact CB-CD2 4.35Å; K437-Y475 HydrophobicContact CB-CE1 4.13Å; K437-Y475 HydrophobicContact CB-CE2 3.8Å; K437-Y475 HydrophobicContact CD-CD1 4.37Å; K437-Y475 HydrophobicContact CD-CD2 3.59Å; K437-Y475 HydrophobicContact CD-CE2 3.91Å; K437-Y475 HydrophobicContact CD-CG 3.84Å; K437-Y475 HydrophobicContact CG-CD1 3.87Å; K437-Y475 HydrophobicContact CG-CD2 3.82Å; K437-Y475 HydrophobicContact CG-CE1 3.82Å; K437-Y475 HydrophobicContact CG-CE2 3.78Å; K437-Y475 HydrophobicContact CG-CG 3.86Å; H440-Y475 HydrophobicContact CB-CE1 4.02Å; H440-Y475 AromaticContact CE1-CE1 2.76Å; H440-Y475 WeakPolarHBondContact CE1-CE1 3.44Å; H440-Y475 AromaticContact CE1-CE2 3.98Å; H440-Y475 AromaticContact CE1-CZ 2.66Å; H440-Y475 PolarHBondContact CE1-OH 3.32Å; H440-Y475 AromaticContact CG-CE1 3.9Å; H440-Y475 AromaticContact ND1-CE1 3.34Å; H440-Y475 VanDerWaalsContact ND1-CE1 3.34Å; H440-Y475 WeakPolarHBondContact ND1-CE1 3.41Å; H440-Y475 AromaticContact ND1-CZ 3.55Å; H440-Y475 PolarHBondContact ND1-OH 3.11Å; L441-Y475 HydrophobicContact CD1-CD1 4.35Å; L441-Y475 HydrophobicContact CD2-CD1 3.71Å; L441-Y475 HydrophobicContact CD2-CE1 4.49Å; L441-Y475 HydrophobicContact CG-CD1 3.84Å; L441-Y475 HydrophobicContact CG-CE1 4.32Å; Q470-Y475 WeakPolarHBondContact O-CE2 3.11Å; W472-Y475 AromaticContact CE3-CD1 3.9Å; W472-Y475 HydrophobicContact CE3-CD1 3.9Å; W472-Y475 AromaticContact CE3-CD2 3.91Å; W472-Y475 HydrophobicContact CE3-CD2 3.91Å; W472-Y475 HydrophobicContact CE3-CE1 4.19Å; W472-Y475 HydrophobicContact CE3-CE2 4.19Å; W472-Y475 AromaticContact CE3-CG 3.77Å; W472-Y475 HydrophobicContact CE3-CG 3.77Å; W472-Y475 AromaticContact CZ3-CD1 3.66Å; W472-Y475 HydrophobicContact CZ3-CD1 3.66Å; W472-Y475 HydrophobicContact CZ3-CD2 4.5Å; W472-Y475 HydrophobicContact CZ3-CE1 4.01Å; W472-Y475 AromaticContact CZ3-CG 3.94Å; W472-Y475 HydrophobicContact CZ3-CG 3.94Å; W472-Y475 VanDerWaalsContact O-CB 3.23Å; W472-Y475 WeakPolarHBondContact O-CB 3.42Å; W472-Y475 WeakPolarHBondContact O-CD2 3.43Å; W472-Y475 PolarHBondContact O-N 3.07Å; E473-Y475 VanDerWaalsContact C-N 3.26Å; E473-Y475 PolarHBondContact O-N 3.37Å; Y475-R477 PolarHBondContact O-N 3.12Å; Y475-R478 CarbonylContact O-C 3.59Å; Y475-R478 PolarHBondContact O-N 3.07Å; Y475-K479 PolarHBondContact O-N 3.3Å; Y475-I492 HydrophobicContact CD1-CD1 4.41Å; Y475-I492 HydrophobicContact CE1-CD1 4.28Å; Y475-P496 HydrophobicContact CE2-CG 3.96Å
476	V	93.9	Very high	96.2	Very high	65 Å²	65	55.5 Å²	55.5	39%	0.394	26%	0.259	S	S	.	.	H	α-helix	trans	-55.4	-38.2	-178.5	-173.5	0	0	0	0	111.4	E473 R478 K479	E473-V476 WeakPolarHBondContact O-CB 3.5Å; E473-V476 PolarHBondContact O-N 3.09Å; V476-R478 PolarHBondContact O-N 2.24Å; V476-K479 WeakPolarHBondContact O-CG 3.38Å
477	R	92.6	Very high	96.1	Very high	211 Å²	211	62.6 Å²	62.6	80%	0.796	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-7.1	177.2	-58.5	-174.9	-176.3	-178.3	1.9	114.8	Y475	Y475-R477 PolarHBondContact O-N 3.12Å
478	R	94.6	Very high	96.1	Very high	94 Å²	94	63.4 Å²	63.4	36%	0.355	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	-11.9	-172.6	-61.3	-61.4	-175.8	-128.9	11.3	114.6	Y258 W438 L441 Y475 V476 K480 L481	Y258-R478 PolarHBondContact OH-NE 3.4Å; Y258-R478 PolarHBondContact OH-NH2 3.38Å; Y258-R478 VanDerWaalsContact OH-NH2 3.13Å; W438-R478 HydrophobicContact CH2-CB 4.33Å; W438-R478 HydrophobicContact CH2-CG 3.75Å; W438-R478 HydrophobicContact CZ3-CB 4.42Å; W438-R478 HydrophobicContact CZ3-CG 4.32Å; L441-R478 HydrophobicContact CD1-CB 4.05Å; Y475-R478 CarbonylContact O-C 3.59Å; Y475-R478 PolarHBondContact O-N 3.07Å; V476-R478 PolarHBondContact O-N 2.24Å; R478-K480 PolarHBondContact O-N 3.44Å; R478-L481 HydrophobicContact CB-CD1 4.12Å; R478-L481 WeakPolarHBondContact O-CG 3.37Å; R478-L481 PolarHBondContact O-N 2.89Å
479	K	94.7	Very high	96.1	Very high	54 Å²	54	65.2 Å²	65.2	24%	0.235	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-5.8	179.7	73	-174.1	170.2	-177.5	0	117.4	Y475 V476 N486 Y489	Y475-K479 PolarHBondContact O-N 3.3Å; V476-K479 WeakPolarHBondContact O-CG 3.38Å; K479-N486 VanDerWaalsContact O-CA 3.31Å; K479-N486 WeakPolarHBondContact O-CA 3.47Å; K479-N486 WeakPolarHBondContact O-CB 3.12Å; K479-N486 PolarHBondContact O-ND2 2.87Å; K479-Y489 HydrophobicContact CB-CD1 3.96Å; K479-Y489 HydrophobicContact CB-CD2 3.57Å; K479-Y489 HydrophobicContact CB-CE2 4.13Å; K479-Y489 HydrophobicContact CB-CG 3.46Å; K479-Y489 VanDerWaalsContact CB-CG 3.46Å; K479-Y489 HydrophobicContact CD-CD1 3.56Å; K479-Y489 HydrophobicContact CD-CD2 3.98Å; K479-Y489 HydrophobicContact CD-CE1 3.37Å; K479-Y489 HydrophobicContact CD-CE2 3.74Å; K479-Y489 HydrophobicContact CD-CG 3.89Å; K479-Y489 VanDerWaalsContact CD-CZ 3.45Å; K479-Y489 HydrophobicContact CG-CD1 4.36Å; K479-Y489 HydrophobicContact CG-CD2 4.43Å; K479-Y489 HydrophobicContact CG-CG 4.32Å; K479-Y489 PolarHBondContact NZ-OH 2.95Å
480	K	95	Very high	96.1	Very high	184 Å²	184	73.5 Å²	73.5	80%	0.8	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	14.1	179.2	-64.4	-167.3	177.8	-173.2	0	114	R478	R478-K480 PolarHBondContact O-N 3.44Å
481	L	94.6	Very high	96.2	Very high	41 Å²	41	76.4 Å²	76.4	22%	0.215	35%	0.348	C	S	.	.	S	Bend	trans	-68.8	-43.5	-178.4	-74.8	172.4	0	0	0	113.5	K252 W438 R478 I485	K252-L481 PolarHBondContact NZ-O 3.19Å; W438-L481 HydrophobicContact CH2-CD1 4.49Å; W438-L481 HydrophobicContact CZ3-CD1 3.98Å; R478-L481 HydrophobicContact CB-CD1 4.12Å; R478-L481 WeakPolarHBondContact O-CG 3.37Å; R478-L481 PolarHBondContact O-N 2.89Å; L481-I485 HydrophobicContact CB-CD1 4Å; L481-I485 HydrophobicContact CD1-CD1 4.45Å
482	T	95.9	Very high	96.3	Very high	34 Å²	34	74.1 Å²	74.1	21%	0.209	33%	0.332	C	S	.	.	S	Bend	trans	-143.7	160.4	176.1	69.9	0	0	0	0	109.5	Q254 I485 N486	Q254-T482 HydrophobicContact CB-CG2 4.29Å; T482-I485 HydrophobicContact CG2-CD1 4.41Å; T482-I485 PolarHBondContact O-N 2.81Å; T482-I485 WeakPolarHBondContact OG1-CB 3.35Å; T482-I485 WeakPolarHBondContact OG1-CG1 3.18Å; T482-I485 PolarHBondContact OG1-N 3.15Å; T482-N486 PolarHBondContact O-N 2.77Å
483	E	96.6	Very high	96.4	Very high	131 Å²	131	81.3 Å²	81.3	61%	0.612	36%	0.36	S	S	*	.	H	α-helix	trans	-67.6	-35.8	179.5	-169.8	54.1	-146	0	0	112.2	I485 N486 R487 R490	E483-I485 VanDerWaalsContact C-N 3.32Å; E483-I485 PolarHBondContact O-N 3.26Å; E483-N486 PolarHBondContact O-N 3.12Å; E483-N486 VanDerWaalsContact O-N 3.08Å; E483-R487 WeakPolarHBondContact O-CB 3.48Å; E483-R487 PolarHBondContact O-N 3.38Å; E483-R490 IonicContact OE1-NH1 3.81Å
484	N	96.8	Very high	96.5	Very high	55 Å²	55	76.3 Å²	76.3	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-57.7	-44.5	171.3	-179.7	57.9	0	0	0	111.8	N442 N486 R487 N488	N442-N484 PolarHBondContact O-ND2 3.25Å; N484-N486 VanDerWaalsContact C-N 3.3Å; N484-N486 PolarHBondContact O-N 3.41Å; N484-R487 PolarHBondContact O-N 2.78Å; N484-R487 PolarHBondContact OD1-NH2 3.22Å; N484-N488 WeakPolarHBondContact O-CB 3.21Å; N484-N488 PolarHBondContact O-N 2.9Å; N484-N488 PolarHBondContact O-ND2 3.13Å
485	I	97.9	Very high	96.7	Very high	0 Å²	0	77.7 Å²	77.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-63.6	-35	175.2	-76.1	172.6	0	0	0	111.6	Q254 L441 L481 T482 E483 Y489	Q254-I485 HydrophobicContact CB-CD1 4.01Å; L441-I485 HydrophobicContact CB-CG1 4.29Å; L441-I485 HydrophobicContact CB-CG2 4.23Å; L441-I485 HydrophobicContact CD1-CG2 4.44Å; L441-I485 HydrophobicContact CD2-CG2 4.24Å; L481-I485 HydrophobicContact CB-CD1 4Å; L481-I485 HydrophobicContact CD1-CD1 4.45Å; T482-I485 HydrophobicContact CG2-CD1 4.41Å; T482-I485 PolarHBondContact O-N 2.81Å; T482-I485 WeakPolarHBondContact OG1-CB 3.35Å; T482-I485 WeakPolarHBondContact OG1-CG1 3.18Å; T482-I485 PolarHBondContact OG1-N 3.15Å; E483-I485 VanDerWaalsContact C-N 3.32Å; E483-I485 PolarHBondContact O-N 3.26Å; I485-Y489 VanDerWaalsContact O-CB 3.25Å; I485-Y489 WeakPolarHBondContact O-CB 3.47Å; I485-Y489 PolarHBondContact O-N 3.1Å
486	N	97.8	Very high	96.7	Very high	22 Å²	22	78.4 Å²	78.4	12%	0.118	34%	0.344	C	S	.	.	H	α-helix	trans	-71.4	-45.4	177.7	-161.2	-94.5	0	0	0	112.4	K479 T482 E483 N484 Y489 R490	K479-N486 VanDerWaalsContact O-CA 3.31Å; K479-N486 WeakPolarHBondContact O-CA 3.47Å; K479-N486 WeakPolarHBondContact O-CB 3.12Å; K479-N486 PolarHBondContact O-ND2 2.87Å; T482-N486 PolarHBondContact O-N 2.77Å; E483-N486 PolarHBondContact O-N 3.12Å; E483-N486 VanDerWaalsContact O-N 3.08Å; N484-N486 VanDerWaalsContact C-N 3.3Å; N484-N486 PolarHBondContact O-N 3.41Å; N486-Y489 PolarHBondContact O-N 3.31Å; N486-R490 WeakPolarHBondContact O-CG 3.33Å; N486-R490 PolarHBondContact O-N 2.94Å; N486-R490 VanDerWaalsContact O-N 3.08Å; N486-R490 PolarHBondContact OD1-NE 3.11Å; N486-R490 PolarHBondContact OD1-NH1 3.31Å
487	R	98.1	Very high	96.8	Very high	150 Å²	150	81.2 Å²	81.2	57%	0.566	36%	0.357	S	S	*	.	H	α-helix	trans	-56.5	-50.8	173.2	178.7	177.5	63.8	-166.1	-0.6	111.3	E483 N484 R490 S491	E483-R487 WeakPolarHBondContact O-CB 3.48Å; E483-R487 PolarHBondContact O-N 3.38Å; N484-R487 PolarHBondContact O-N 2.78Å; N484-R487 PolarHBondContact OD1-NH2 3.22Å; R487-R490 WeakPolarHBondContact O-CB 3.42Å; R487-R490 PolarHBondContact O-N 3.33Å; R487-S491 PolarHBondContact O-N 3.1Å; R487-S491 VanDerWaalsContact O-N 3.12Å; R487-S491 PolarHBondContact O-OG 2.76Å
488	N	98.3	Very high	97.1	Very high	17 Å²	17	75.2 Å²	75.2	9%	0.091	34%	0.338	C	S	.	.	H	α-helix	trans	-63.7	-44.1	178.6	-66.8	-13.4	0	0	0	111.6	L441 N442 N484 R490 S491 I492	L441-N488 VanDerWaalsContact O-CB 3.31Å; L441-N488 WeakPolarHBondContact O-CB 3.42Å; L441-N488 PolarHBondContact O-ND2 2.97Å; N442-N488 VanDerWaalsContact C-ND2 3.26Å; N442-N488 PolarHBondContact O-ND2 3.27Å; N484-N488 WeakPolarHBondContact O-CB 3.21Å; N484-N488 PolarHBondContact O-N 2.9Å; N484-N488 PolarHBondContact O-ND2 3.13Å; N488-R490 PolarHBondContact O-N 2.98Å; N488-S491 WeakPolarHBondContact CA-OG 3.48Å; N488-S491 PolarHBondContact O-N 3.18Å; N488-S491 PolarHBondContact O-OG 2.88Å; N488-I492 VanDerWaalsContact O-CG1 3.31Å; N488-I492 WeakPolarHBondContact O-CG1 3.33Å; N488-I492 PolarHBondContact O-N 3.01Å
489	Y	98.2	Very high	97.3	Very high	39 Å²	39	70.8 Å²	70.8	15%	0.153	32%	0.321	C	S	.	.	H	α-helix	trans	-55.2	-37.4	174.8	173.8	-82.7	0	0	0	112.8	L441 W472 K479 I485 N486	L441-Y489 HydrophobicContact CD2-CD2 4.23Å; W472-Y489 HydrophobicContact CH2-CD2 4.03Å; W472-Y489 AromaticContact CH2-CE2 3.77Å; W472-Y489 HydrophobicContact CH2-CE2 3.77Å; W472-Y489 HydrophobicContact CZ2-CD2 4.45Å; W472-Y489 AromaticContact CZ2-CE2 3.76Å; W472-Y489 HydrophobicContact CZ2-CE2 3.76Å; W472-Y489 AromaticContact CZ2-CZ 3.89Å; W472-Y489 HydrophobicContact CZ3-CE2 4.49Å; K479-Y489 HydrophobicContact CB-CD1 3.96Å; K479-Y489 HydrophobicContact CB-CD2 3.57Å; K479-Y489 HydrophobicContact CB-CE2 4.13Å; K479-Y489 HydrophobicContact CB-CG 3.46Å; K479-Y489 VanDerWaalsContact CB-CG 3.46Å; K479-Y489 HydrophobicContact CD-CD1 3.56Å; K479-Y489 HydrophobicContact CD-CD2 3.98Å; K479-Y489 HydrophobicContact CD-CE1 3.37Å; K479-Y489 HydrophobicContact CD-CE2 3.74Å; K479-Y489 HydrophobicContact CD-CG 3.89Å; K479-Y489 VanDerWaalsContact CD-CZ 3.45Å; K479-Y489 HydrophobicContact CG-CD1 4.36Å; K479-Y489 HydrophobicContact CG-CD2 4.43Å; K479-Y489 HydrophobicContact CG-CG 4.32Å; K479-Y489 PolarHBondContact NZ-OH 2.95Å; I485-Y489 VanDerWaalsContact O-CB 3.25Å; I485-Y489 WeakPolarHBondContact O-CB 3.47Å; I485-Y489 PolarHBondContact O-N 3.1Å; N486-Y489 PolarHBondContact O-N 3.31Å
490	R	97.6	Very high	97.4	Very high	183 Å²	183	69 Å²	69	69%	0.691	32%	0.316	S	S	*	.	H	α-helix	trans	-72.2	-30.1	176.4	-72.2	167.9	167.3	151.1	-6.8	113.1	E483 N486 R487 N488	E483-R490 IonicContact OE1-NH1 3.81Å; N486-R490 WeakPolarHBondContact O-CG 3.33Å; N486-R490 PolarHBondContact O-N 2.94Å; N486-R490 VanDerWaalsContact O-N 3.08Å; N486-R490 PolarHBondContact OD1-NE 3.11Å; N486-R490 PolarHBondContact OD1-NH1 3.31Å; R487-R490 WeakPolarHBondContact O-CB 3.42Å; R487-R490 PolarHBondContact O-N 3.33Å; N488-R490 PolarHBondContact O-N 2.98Å
491	S	98	Very high	97.6	Very high	66 Å²	66	63.4 Å²	63.4	46%	0.462	30%	0.3	S	S	.	.	H	α-helix	trans	-93.8	-11.4	-178.4	62.7	0	0	0	0	114.9	R487 N488 R493	R487-S491 PolarHBondContact O-N 3.1Å; R487-S491 VanDerWaalsContact O-N 3.12Å; R487-S491 PolarHBondContact O-OG 2.76Å; N488-S491 WeakPolarHBondContact CA-OG 3.48Å; N488-S491 PolarHBondContact O-N 3.18Å; N488-S491 PolarHBondContact O-OG 2.88Å; S491-R493 PolarHBondContact O-N 3.19Å
492	I	98.4	Very high	97.8	Very high	8 Å²	8	62 Å²	62	4%	0.041	29%	0.292	C	S	.	.			trans	-58.7	119.2	-179.4	-79.2	161.9	0	0	0	111.4	H440 L441 D445 W472 Y475 N488 L494 K495	H440-I492 WeakPolarHBondContact NE2-CG2 3.35Å; L441-I492 HydrophobicContact CD2-CD1 4.44Å; D445-I492 WeakPolarHBondContact OD1-CA 3.33Å; D445-I492 WeakPolarHBondContact OD1-CG1 3.35Å; W472-I492 HydrophobicContact CH2-CB 4.25Å; W472-I492 HydrophobicContact CH2-CG2 4.01Å; W472-I492 HydrophobicContact CZ3-CB 4.4Å; W472-I492 HydrophobicContact CZ3-CD1 4.34Å; W472-I492 HydrophobicContact CZ3-CG2 3.81Å; Y475-I492 HydrophobicContact CD1-CD1 4.41Å; Y475-I492 HydrophobicContact CE1-CD1 4.28Å; N488-I492 VanDerWaalsContact O-CG1 3.31Å; N488-I492 WeakPolarHBondContact O-CG1 3.33Å; N488-I492 PolarHBondContact O-N 3.01Å; I492-L494 VanDerWaalsContact CG2-O 3.32Å; I492-L494 WeakPolarHBondContact CG2-O 3.49Å; I492-K495 HydrophobicContact CG2-CD 4.18Å; I492-K495 PolarHBondContact O-NZ 3.49Å
493	R	98.2	Very high	97.9	Very high	210 Å²	210	60.4 Å²	60.4	79%	0.792	28%	0.282	S	S	*	.			trans	-101.5	-53.2	175.5	-62.2	-171.2	-180	-151.6	-0.7	110.9	D445 S491 K495	D445-R493 PolarHBondContact OD1-N 3.01Å; D445-R493 WeakPolarHBondContact OD2-CA 3.47Å; D445-R493 WeakPolarHBondContact OD2-CB 3.5Å; D445-R493 PolarHBondContact OD2-N 3.3Å; S491-R493 PolarHBondContact O-N 3.19Å; R493-K495 WeakPolarHBondContact O-CD 3.48Å; R493-K495 WeakPolarHBondContact O-CG 3.15Å; R493-K495 PolarHBondContact O-N 2.75Å
494	L	98.3	Very high	98	Very high	14 Å²	14	55.7 Å²	55.7	7%	0.073	26%	0.262	C	S	.	.	S	Bend	trans	-61.9	119.2	177.2	-179.3	67.1	0	0	0	110.2	H440 D445 L448 K449 I492 Q498 F499 Y502	H440-L494 PolarHBondContact NE2-O 3.29Å; D445-L494 PolarHBondContact OD2-N 2.76Å; L448-L494 HydrophobicContact CD2-CD2 4.36Å; K449-L494 HydrophobicContact CG-CD2 4.24Å; I492-L494 VanDerWaalsContact CG2-O 3.32Å; I492-L494 WeakPolarHBondContact CG2-O 3.49Å; L494-Q498 HydrophobicContact CD1-CB 3.79Å; L494-F499 HydrophobicContact CD1-CD1 4.5Å; L494-F499 HydrophobicContact CD2-CD1 4.16Å; L494-F499 HydrophobicContact CD2-CE1 4.27Å; L494-F499 HydrophobicContact CG-CD1 3.99Å; L494-F499 HydrophobicContact CG-CE1 4.06Å; L494-Y502 HydrophobicContact CD1-CD2 4.46Å; L494-Y502 HydrophobicContact CD1-CG 4.15Å; L494-Y502 HydrophobicContact CD2-CD1 4.09Å; L494-Y502 HydrophobicContact CD2-CG 4.07Å
495	K	98.1	Very high	98	Very high	53 Å²	53	58.9 Å²	58.9	23%	0.23	28%	0.279	C	S	.	.			trans	-101.4	160.3	-179.1	-55.4	-51.5	-174.4	-172.4	0	112.6	W472 I492 R493 D497 Q498 F499	W472-K495 HydrophobicContact CD2-CD 4.4Å; W472-K495 HydrophobicContact CE3-CD 4.28Å; W472-K495 HydrophobicContact CH2-CD 4.45Å; W472-K495 HydrophobicContact CZ3-CD 4.31Å; I492-K495 HydrophobicContact CG2-CD 4.18Å; I492-K495 PolarHBondContact O-NZ 3.49Å; R493-K495 WeakPolarHBondContact O-CD 3.48Å; R493-K495 WeakPolarHBondContact O-CG 3.15Å; R493-K495 PolarHBondContact O-N 2.75Å; K495-D497 VanDerWaalsContact C-N 3.29Å; K495-D497 WeakPolarHBondContact CB-OD1 3.47Å; K495-D497 PolarHBondContact O-N 3.18Å; K495-Q498 HydrophobicContact CB-CG 4.33Å; K495-Q498 WeakPolarHBondContact O-CA 3.49Å; K495-Q498 WeakPolarHBondContact O-CB 3.32Å; K495-Q498 PolarHBondContact O-N 3.01Å; K495-F499 WeakPolarHBondContact O-CD1 3.34Å; K495-F499 WeakPolarHBondContact O-CE1 3.35Å; K495-F499 PolarHBondContact O-N 3.21Å
496	P	97.6	Very high	98	Very high	16 Å²	16	64.1 Å²	64.1	10%	0.104	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-57.8	-36.4	-176.1	-26.2	36.5	0	0	0	115.2	W472 Y475 Q498 F499	W472-P496 HydrophobicContact CB-CG 4.37Å; Y475-P496 HydrophobicContact CE2-CG 3.96Å; P496-Q498 PolarHBondContact O-N 2.94Å; P496-F499 HydrophobicContact CB-CD2 4.32Å; P496-F499 HydrophobicContact CB-CE2 3.98Å; P496-F499 HydrophobicContact CB-CZ 4.13Å; P496-F499 HydrophobicContact CG-CE2 4.36Å; P496-F499 HydrophobicContact CG-CZ 4.1Å; P496-F499 WeakPolarHBondContact O-CB 3.41Å; P496-F499 WeakPolarHBondContact O-CG 3.47Å; P496-F499 PolarHBondContact O-N 2.97Å
497	D	96.7	Very high	98	Very high	123 Å²	123	63.8 Å²	63.8	66%	0.658	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-59.8	-29.6	170.7	48.2	-67.6	0	0	0	113.2	K495	K495-D497 VanDerWaalsContact C-N 3.29Å; K495-D497 WeakPolarHBondContact CB-OD1 3.47Å; K495-D497 PolarHBondContact O-N 3.18Å
498	Q	97.9	Very high	98	Very high	86 Å²	86	58.1 Å²	58.1	40%	0.402	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-87.5	-6.7	178	-55.5	177.3	-37.1	0	0	113.1	L494 K495 P496 S500 S501 Y502	L494-Q498 HydrophobicContact CD1-CB 3.79Å; K495-Q498 HydrophobicContact CB-CG 4.33Å; K495-Q498 WeakPolarHBondContact O-CA 3.49Å; K495-Q498 WeakPolarHBondContact O-CB 3.32Å; K495-Q498 PolarHBondContact O-N 3.01Å; P496-Q498 PolarHBondContact O-N 2.94Å; Q498-S500 VanDerWaalsContact C-N 3.35Å; Q498-S500 PolarHBondContact O-N 3.03Å; Q498-S501 PolarHBondContact O-N 2.92Å; Q498-Y502 PolarHBondContact O-N 3.34Å
499	F	98.5	Very high	98	Very high	1 Å²	1	57.5 Å²	57.5	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-39.9	-174.8	-69.3	-6	0	0	0	112.4	T436 H440 L448 F452 P469 L494 K495 P496 Y502 L503	T436-F499 HydrophobicContact CG2-CE2 4.13Å; H440-F499 AromaticContact CE1-CZ 3.56Å; H440-F499 AromaticContact ND1-CZ 3.91Å; H440-F499 AromaticContact NE2-CE1 3.43Å; H440-F499 WeakPolarHBondContact NE2-CE1 3.46Å; H440-F499 AromaticContact NE2-CZ 3.63Å; L448-F499 HydrophobicContact CD2-CD1 4.2Å; L448-F499 HydrophobicContact CD2-CE1 3.38Å; L448-F499 HydrophobicContact CD2-CE2 4.15Å; L448-F499 HydrophobicContact CD2-CZ 3.35Å; F452-F499 HydrophobicContact CE2-CD1 4.26Å; F452-F499 HydrophobicContact CE2-CG 4.22Å; F452-F499 HydrophobicContact CZ-CB 4.36Å; F452-F499 HydrophobicContact CZ-CD1 4.45Å; F452-F499 AromaticContact CZ-CD2 4Å; F452-F499 HydrophobicContact CZ-CD2 4Å; F452-F499 HydrophobicContact CZ-CE2 4.41Å; F452-F499 HydrophobicContact CZ-CG 4.03Å; P469-F499 HydrophobicContact CB-CD2 3.93Å; P469-F499 HydrophobicContact CB-CE2 4.09Å; L494-F499 HydrophobicContact CD1-CD1 4.5Å; L494-F499 HydrophobicContact CD2-CD1 4.16Å; L494-F499 HydrophobicContact CD2-CE1 4.27Å; L494-F499 HydrophobicContact CG-CD1 3.99Å; L494-F499 HydrophobicContact CG-CE1 4.06Å; K495-F499 WeakPolarHBondContact O-CD1 3.34Å; K495-F499 WeakPolarHBondContact O-CE1 3.35Å; K495-F499 PolarHBondContact O-N 3.21Å; P496-F499 HydrophobicContact CB-CD2 4.32Å; P496-F499 HydrophobicContact CB-CE2 3.98Å; P496-F499 HydrophobicContact CB-CZ 4.13Å; P496-F499 HydrophobicContact CG-CE2 4.36Å; P496-F499 HydrophobicContact CG-CZ 4.1Å; P496-F499 WeakPolarHBondContact O-CB 3.41Å; P496-F499 WeakPolarHBondContact O-CG 3.47Å; P496-F499 PolarHBondContact O-N 2.97Å; F499-Y502 PolarHBondContact O-N 2.86Å; F499-L503 WeakPolarHBondContact O-CB 3.29Å; F499-L503 WeakPolarHBondContact O-CD1 2.76Å; F499-L503 VanDerWaalsContact O-CG 3.26Å; F499-L503 WeakPolarHBondContact O-CG 3.3Å; F499-L503 PolarHBondContact O-N 3.08Å
500	S	97.8	Very high	98	Very high	16 Å²	16	60.5 Å²	60.5	11%	0.112	31%	0.31	C	S	.	.	H	α-helix	trans	-64.9	-45.9	-179.2	-50.8	0	0	0	0	112.2	Q498 Y502 L503 T504	Q498-S500 VanDerWaalsContact C-N 3.35Å; Q498-S500 PolarHBondContact O-N 3.03Å; S500-Y502 VanDerWaalsContact C-N 3.34Å; S500-Y502 PolarHBondContact O-N 2.84Å; S500-L503 PolarHBondContact O-N 2.96Å; S500-T504 PolarHBondContact O-N 3.38Å; S500-T504 PolarHBondContact O-OG1 2.77Å
501	S	97.9	Very high	98	Very high	67 Å²	67	54.5 Å²	54.5	47%	0.469	30%	0.296	S	S	.	.	H	α-helix	trans	-61.7	-39.9	175.4	178	0	0	0	0	112	Q498 T504 N505	Q498-S501 PolarHBondContact O-N 2.92Å; S501-T504 PolarHBondContact O-OG1 3.37Å; S501-N505 WeakPolarHBondContact O-CB 3.43Å; S501-N505 PolarHBondContact O-N 2.78Å; S501-N505 PolarHBondContact OG-ND2 3.19Å
502	Y	98.6	Very high	98	Very high	11 Å²	11	55.9 Å²	55.9	4%	0.043	29%	0.294	C	S	.	.	H	α-helix	trans	-66.4	-38.3	174.2	-175	-100.3	0	0	0	112.6	K449 F452 K453 L494 Q498 F499 S500 E506 V507	K449-Y502 HydrophobicContact CB-CE1 4.14Å; K449-Y502 HydrophobicContact CD-CE1 4.26Å; K449-Y502 HydrophobicContact CD-CE2 3.88Å; K449-Y502 WeakPolarHBondContact CD-OH 3.23Å; K449-Y502 VanDerWaalsContact CE-CE2 3.42Å; K449-Y502 HydrophobicContact CG-CE1 3.69Å; K449-Y502 HydrophobicContact CG-CE2 4.23Å; F452-Y502 AromaticContact CD2-CD1 3.87Å; F452-Y502 HydrophobicContact CD2-CD1 3.87Å; F452-Y502 HydrophobicContact CD2-CE1 4.1Å; F452-Y502 HydrophobicContact CE2-CD1 4.45Å; K453-Y502 WeakPolarHBondContact CE-OH 3.47Å; L494-Y502 HydrophobicContact CD1-CD2 4.46Å; L494-Y502 HydrophobicContact CD1-CG 4.15Å; L494-Y502 HydrophobicContact CD2-CD1 4.09Å; L494-Y502 HydrophobicContact CD2-CG 4.07Å; Q498-Y502 PolarHBondContact O-N 3.34Å; F499-Y502 PolarHBondContact O-N 2.86Å; S500-Y502 VanDerWaalsContact C-N 3.34Å; S500-Y502 PolarHBondContact O-N 2.84Å; Y502-E506 HydrophobicContact CD2-CB 3.57Å; Y502-E506 HydrophobicContact CD2-CG 4.08Å; Y502-E506 HydrophobicContact CE2-CB 3.29Å; Y502-E506 HydrophobicContact CE2-CG 3.89Å; Y502-E506 HydrophobicContact CG-CB 4.35Å; Y502-E506 WeakPolarHBondContact O-CB 3.14Å; Y502-E506 PolarHBondContact O-N 2.9Å; Y502-E506 VanDerWaalsContact O-N 3.09Å; Y502-V507 HydrophobicContact CD1-CG2 3.88Å; Y502-V507 HydrophobicContact CE1-CG2 3.38Å; Y502-V507 PolarHBondContact O-N 3.01Å
503	L	98.6	Very high	97.9	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.308	C	S	.	.	I	π-helix	trans	-68.7	-40.8	179.9	-78.3	164.9	0	0	0	112.4	F452 F465 L467 F499 S500 V507 G508 F509 F532	F452-L503 HydrophobicContact CB-CD2 3.71Å; F452-L503 HydrophobicContact CD1-CD1 4.48Å; F452-L503 HydrophobicContact CD1-CD2 3.76Å; F452-L503 HydrophobicContact CD1-CG 4.47Å; F452-L503 HydrophobicContact CD2-CD2 4.22Å; F452-L503 HydrophobicContact CD2-CG 4.5Å; F452-L503 HydrophobicContact CE1-CD1 4.3Å; F452-L503 HydrophobicContact CE1-CD2 4.37Å; F452-L503 HydrophobicContact CG-CD2 3.67Å; F452-L503 HydrophobicContact CG-CG 4.38Å; F452-L503 HydrophobicContact CZ-CD1 4.47Å; F465-L503 HydrophobicContact CD1-CD1 4.43Å; F465-L503 HydrophobicContact CD1-CD2 4.36Å; F465-L503 HydrophobicContact CE1-CD1 4.12Å; F465-L503 HydrophobicContact CE1-CD2 4.09Å; L467-L503 HydrophobicContact CD2-CD1 3.73Å; F499-L503 WeakPolarHBondContact O-CB 3.29Å; F499-L503 WeakPolarHBondContact O-CD1 2.76Å; F499-L503 VanDerWaalsContact O-CG 3.26Å; F499-L503 WeakPolarHBondContact O-CG 3.3Å; F499-L503 PolarHBondContact O-N 3.08Å; S500-L503 PolarHBondContact O-N 2.96Å; L503-V507 HydrophobicContact CD2-CB 4.47Å; L503-V507 HydrophobicContact CD2-CG1 4.47Å; L503-V507 HydrophobicContact CD2-CG2 4.43Å; L503-V507 WeakPolarHBondContact O-CB 3.32Å; L503-G508 PolarHBondContact O-N 2.92Å; L503-F509 HydrophobicContact CB-CD2 4.11Å; L503-F509 HydrophobicContact CD2-CD2 3.76Å; L503-F509 HydrophobicContact CD2-CE2 3.6Å; L503-F509 PolarHBondContact O-N 3.18Å; L503-F509 VanDerWaalsContact O-N 3.11Å; L503-F532 HydrophobicContact CB-CD1 3.75Å; L503-F532 HydrophobicContact CB-CE1 3.57Å; L503-F532 HydrophobicContact CB-CZ 4.23Å; L503-F532 HydrophobicContact CD1-CD1 4.1Å; L503-F532 HydrophobicContact CD1-CD2 4.06Å; L503-F532 HydrophobicContact CD1-CE1 3.69Å; L503-F532 HydrophobicContact CD1-CE2 3.63Å; L503-F532 HydrophobicContact CD1-CG 4.3Å; L503-F532 HydrophobicContact CD1-CZ 3.45Å; L503-F532 VanDerWaalsContact CD1-CZ 3.45Å; L503-F532 HydrophobicContact CG-CE1 4.26Å; L503-F532 HydrophobicContact CG-CZ 4.46Å
504	T	98.1	Very high	97.9	Very high	33 Å²	33	53.4 Å²	53.4	20%	0.202	29%	0.291	C	S	.	.	I	π-helix	trans	-71.7	-55.7	174.3	53.5	0	0	0	0	111.2	S500 S501 G508 F509 F512	S500-T504 PolarHBondContact O-N 3.38Å; S500-T504 PolarHBondContact O-OG1 2.77Å; S501-T504 PolarHBondContact O-OG1 3.37Å; T504-G508 PolarHBondContact O-N 2.95Å; T504-F509 WeakPolarHBondContact CA-O 3.15Å; T504-F512 HydrophobicContact CG2-CD1 3.93Å; T504-F512 HydrophobicContact CG2-CE1 4.49Å
505	N	97.9	Very high	97.6	Very high	121 Å²	121	53.8 Å²	53.8	65%	0.647	29%	0.293	S	S	*	.	I	π-helix	trans	-83.7	-25.8	-162	-54.4	-5.4	0	0	0	113.9	S501	S501-N505 WeakPolarHBondContact O-CB 3.43Å; S501-N505 PolarHBondContact O-N 2.78Å; S501-N505 PolarHBondContact OG-ND2 3.19Å
506	E	97.7	Very high	97.3	Very high	110 Å²	110	52.4 Å²	52.4	51%	0.514	29%	0.293	S	S	.	.	I	π-helix	trans	-125.1	-7.2	-170.5	-82.4	-132.9	-118.3	0	0	114.8	K453 Y502	K453-E506 WeakPolarHBondContact CE-O 3.35Å; Y502-E506 HydrophobicContact CD2-CB 3.57Å; Y502-E506 HydrophobicContact CD2-CG 4.08Å; Y502-E506 HydrophobicContact CE2-CB 3.29Å; Y502-E506 HydrophobicContact CE2-CG 3.89Å; Y502-E506 HydrophobicContact CG-CB 4.35Å; Y502-E506 WeakPolarHBondContact O-CB 3.14Å; Y502-E506 PolarHBondContact O-N 2.9Å; Y502-E506 VanDerWaalsContact O-N 3.09Å
507	V	98.1	Very high	97	Very high	15 Å²	15	54.5 Å²	54.5	9%	0.091	31%	0.309	C	S	.	.	I	π-helix	trans	-115	-30.3	175	179.1	0	0	0	0	111.5	F452 K453 Y456 Y502 L503 F509	F452-V507 HydrophobicContact CB-CG2 4.03Å; K453-V507 HydrophobicContact CG-CG1 4.43Å; K453-V507 HydrophobicContact CG-CG2 4.07Å; Y456-V507 VanDerWaalsContact CB-CG1 3.49Å; Y456-V507 WeakPolarHBondContact CD1-O 3.45Å; Y456-V507 HydrophobicContact CD2-CG1 4.46Å; Y456-V507 HydrophobicContact CG-CG1 3.94Å; Y502-V507 HydrophobicContact CD1-CG2 3.88Å; Y502-V507 HydrophobicContact CE1-CG2 3.38Å; Y502-V507 PolarHBondContact O-N 3.01Å; L503-V507 HydrophobicContact CD2-CB 4.47Å; L503-V507 HydrophobicContact CD2-CG1 4.47Å; L503-V507 HydrophobicContact CD2-CG2 4.43Å; L503-V507 WeakPolarHBondContact O-CB 3.32Å; V507-F509 HydrophobicContact CB-CD2 4.36Å; V507-F509 HydrophobicContact CG1-CD2 3.93Å; V507-F509 HydrophobicContact CG1-CE2 3.78Å
508	G	97.8	Very high	96.5	Very high	32 Å²	32	49 Å²	49	33%	0.33	28%	0.28	S	S	.	.			trans	102.9	16.7	171.7	0	0	0	0	0	115.5	Y456 L503 T504	Y456-G508 VanDerWaalsContact CE2-C 3.44Å; Y456-G508 WeakPolarHBondContact CE2-O 3.46Å; Y456-G508 PolarHBondContact OH-O 2.63Å; L503-G508 PolarHBondContact O-N 2.92Å; T504-G508 PolarHBondContact O-N 2.95Å
509	F	98.6	Very high	95.8	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.018	30%	0.3	C	S	.	.			trans	-66.8	132.9	169.2	-73	-85.9	0	0	0	110	Y456 L459 F465 L503 T504 V507 F532 H533 K534	Y456-F509 AromaticContact CD2-CD1 3.98Å; Y456-F509 HydrophobicContact CD2-CD1 3.98Å; Y456-F509 AromaticContact CD2-CD2 3.86Å; Y456-F509 HydrophobicContact CD2-CD2 3.86Å; Y456-F509 AromaticContact CD2-CE1 3.93Å; Y456-F509 HydrophobicContact CD2-CE1 3.93Å; Y456-F509 AromaticContact CD2-CE2 3.81Å; Y456-F509 HydrophobicContact CD2-CE2 3.81Å; Y456-F509 AromaticContact CD2-CG 3.95Å; Y456-F509 HydrophobicContact CD2-CG 3.95Å; Y456-F509 AromaticContact CD2-CZ 3.85Å; Y456-F509 HydrophobicContact CD2-CZ 3.85Å; Y456-F509 HydrophobicContact CE2-CD1 4.48Å; Y456-F509 HydrophobicContact CE2-CG 4.44Å; Y456-F509 HydrophobicContact CG-CE2 4.23Å; Y456-F509 HydrophobicContact CG-CZ 4.38Å; L459-F509 HydrophobicContact CD1-CE1 3.81Å; L459-F509 HydrophobicContact CD1-CZ 4.21Å; F465-F509 HydrophobicContact CB-CD1 4.5Å; F465-F509 HydrophobicContact CB-CE1 3.48Å; F465-F509 VanDerWaalsContact CB-CE1 3.48Å; F465-F509 HydrophobicContact CB-CZ 3.54Å; F465-F509 HydrophobicContact CD1-CE2 4.28Å; F465-F509 AromaticContact CD1-CZ 3.94Å; F465-F509 HydrophobicContact CD1-CZ 3.94Å; F465-F509 HydrophobicContact CG-CE1 4.31Å; F465-F509 AromaticContact CG-CZ 3.88Å; F465-F509 HydrophobicContact CG-CZ 3.88Å; L503-F509 HydrophobicContact CB-CD2 4.11Å; L503-F509 HydrophobicContact CD2-CD2 3.76Å; L503-F509 HydrophobicContact CD2-CE2 3.6Å; L503-F509 PolarHBondContact O-N 3.18Å; L503-F509 VanDerWaalsContact O-N 3.11Å; T504-F509 WeakPolarHBondContact CA-O 3.15Å; V507-F509 HydrophobicContact CB-CD2 4.36Å; V507-F509 HydrophobicContact CG1-CD2 3.93Å; V507-F509 HydrophobicContact CG1-CE2 3.78Å; F509-F532 HydrophobicContact CB-CB 4.11Å; F509-F532 HydrophobicContact CB-CD1 4.28Å; F509-F532 HydrophobicContact CD1-CB 3.54Å; F509-F532 HydrophobicContact CD2-CB 4.5Å; F509-F532 HydrophobicContact CE1-CB 4.02Å; F509-F532 HydrophobicContact CG-CB 3.81Å; F509-H533 CarbonylContact C-O 3.57Å; F509-H533 WeakPolarHBondContact CA-O 3.23Å; F509-H533 WeakPolarHBondContact CB-O 3.34Å; F509-H533 WeakPolarHBondContact CD1-O 3.48Å; F509-K534 HydrophobicContact CD1-CB 4.41Å; F509-K534 HydrophobicContact CE1-CB 4.46Å
510	T	97.9	Very high	94.9	Very high	102 Å²	102	54.8 Å²	54.8	63%	0.626	31%	0.305	S	S	*	.			trans	-76.3	-32.8	-170.8	44.6	0	0	0	0	113.3	H533 K534	T510-H533 PolarHBondContact N-O 3.47Å; T510-H533 PolarHBondContact OG1-O 3.01Å; T510-H533 VanDerWaalsContact OG1-O 3.13Å; T510-K534 WeakPolarHBondContact CG2-OXT 3.13Å; T510-K534 PolarHBondContact OG1-OXT 3.24Å
511	S	97.6	Very high	93.9	Very high	57 Å²	57	58.8 Å²	58.8	40%	0.399	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	171.8	176.5	70.9	0	0	0	0	112.1	F532 H533	S511-F532 WeakPolarHBondContact O-CA 3.15Å; S511-H533 PolarHBondContact O-N 3.35Å; S511-H533 PolarHBondContact OG-CD2 3.37Å; S511-H533 VanDerWaalsContact OG-CD2 3.3Å
512	F	97.9	Very high	93	Very high	95 Å²	95	59.4 Å²	59.4	42%	0.417	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	146.4	169.7	75.1	-85.9	0	0	0	113.4	T504 Y530 V531 F532	T504-F512 HydrophobicContact CG2-CD1 3.93Å; T504-F512 HydrophobicContact CG2-CE1 4.49Å; F512-Y530 HydrophobicContact CD2-CD1 4.07Å; F512-Y530 HydrophobicContact CE2-CD1 4.27Å; F512-Y530 HydrophobicContact CE2-CE1 4.47Å; F512-V531 CarbonylContact C-O 3.55Å; F512-V531 WeakPolarHBondContact CA-O 3.37Å; F512-V531 WeakPolarHBondContact CB-O 3.35Å; F512-F532 HydrophobicContact CB-CD1 3.43Å; F512-F532 VanDerWaalsContact CB-CD1 3.43Å; F512-F532 HydrophobicContact CB-CD2 4.43Å; F512-F532 HydrophobicContact CB-CE1 3.51Å; F512-F532 HydrophobicContact CB-CG 3.89Å; F512-F532 HydrophobicContact CB-CZ 4.07Å; F512-F532 HydrophobicContact CD1-CE1 4.06Å; F512-F532 HydrophobicContact CD2-CE1 4.44Å; F512-F532 HydrophobicContact CD2-CZ 4.47Å; F512-F532 HydrophobicContact CG-CD1 4.18Å; F512-F532 AromaticContact CG-CE1 3.77Å; F512-F532 HydrophobicContact CG-CE1 3.77Å; F512-F532 HydrophobicContact CG-CZ 4.23Å
513	E	97.3	Very high	92.2	Very high	71 Å²	71	63.9 Å²	63.9	33%	0.332	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.8	173.8	-169.9	-167.3	157.7	0	0	109.4	R279 L515 Y530 V531	R279-E513 IonicContact CZ-OE1 2.82Å; R279-E513 IonicContact CZ-OE2 2.81Å; R279-E513 IonicContact NH1-OE1 3.91Å; R279-E513 IonicContact NH1-OE2 3.26Å; R279-E513 PolarHBondContact NH1-OE2 3.19Å; R279-E513 IonicContact NH2-OE1 2.78Å; R279-E513 PolarHBondContact NH2-OE1 2.92Å; R279-E513 IonicContact NH2-OE2 3.86Å; R279-E513 PolarHBondContact NH2-OE2 2.79Å; E513-L515 HydrophobicContact CB-CD2 4.35Å; E513-L515 HydrophobicContact CG-CD2 4.01Å; E513-Y530 CarbonylContact O-C 3.52Å; E513-Y530 VanDerWaalsContact O-CA 3.27Å; E513-Y530 WeakPolarHBondContact O-CA 3.34Å; E513-V531 HydrophobicContact CB-CG1 3.75Å; E513-V531 PolarHBondContact N-O 3.12Å; E513-V531 PolarHBondContact O-N 3.44Å
514	H	96.6	Very high	91.4	Very high	95 Å²	95	65.8 Å²	65.8	44%	0.44	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	113.8	169.8	169.6	-117.9	0	0	0	110	G516 P528 Y530	H514-G516 VanDerWaalsContact C-N 3.27Å; H514-G516 WeakPolarHBondContact NE2-CA 3.4Å; H514-G516 PolarHBondContact NE2-N 2.86Å; H514-G516 PolarHBondContact O-N 3.45Å; H514-P528 WeakPolarHBondContact NE2-CB 3.12Å; H514-Y530 HydrophobicContact CB-CD1 3.87Å; H514-Y530 HydrophobicContact CB-CE1 3.87Å; H514-Y530 AromaticContact CD2-CE1 3.66Å
515	L	93.7	Very high	90.9	Very high	22 Å²	22	65.2 Å²	65.2	12%	0.115	37%	0.374	C	S	.	.			trans	-85.9	5	-172.3	-52.9	177.5	0	0	0	113.6	V277 W282 E513 V529 V531	V277-L515 HydrophobicContact CB-CB 4.23Å; V277-L515 WeakPolarHBondContact CG1-O 3.18Å; W282-L515 HydrophobicContact CH2-CD1 3.46Å; W282-L515 VanDerWaalsContact CH2-CD1 3.46Å; W282-L515 HydrophobicContact CH2-CD2 3.67Å; W282-L515 HydrophobicContact CH2-CG 4.2Å; W282-L515 HydrophobicContact CZ2-CD2 4.35Å; W282-L515 HydrophobicContact CZ3-CD1 3.69Å; E513-L515 HydrophobicContact CB-CD2 4.35Å; E513-L515 HydrophobicContact CG-CD2 4.01Å; L515-V529 HydrophobicContact CB-CB 4.41Å; L515-V529 WeakPolarHBondContact CB-O 3.33Å; L515-V529 HydrophobicContact CD1-CG1 4.12Å; L515-V529 PolarHBondContact N-O 3.18Å; L515-V531 HydrophobicContact CD1-CB 4.19Å; L515-V531 HydrophobicContact CD1-CG1 4.12Å; L515-V531 HydrophobicContact CD2-CG1 3.88Å; L515-V531 HydrophobicContact CG-CG1 4.18Å
516	G	91.1	Very high	90.5	Very high	23 Å²	23	63.6 Å²	63.6	24%	0.237	36%	0.363	C	S	.	.			trans	91.6	179.9	-174	0	0	0	0	0	113.8	H514 P528 V529	H514-G516 VanDerWaalsContact C-N 3.27Å; H514-G516 WeakPolarHBondContact NE2-CA 3.4Å; H514-G516 PolarHBondContact NE2-N 2.86Å; H514-G516 PolarHBondContact O-N 3.45Å; G516-P528 WeakPolarHBondContact O-CA 3.48Å; G516-V529 PolarHBondContact O-N 3.49Å
517	S	90.1	Very high	90.4	Very high	61 Å²	61	59.2 Å²	59.2	43%	0.427	34%	0.341	S	S	.	.			trans	-112.3	112.4	176	-67.7	0	0	0	0	110	K519 R527 P528	S517-K519 PolarHBondContact O-N 3.42Å; S517-R527 WeakPolarHBondContact CA-O 3.33Å; S517-R527 VanDerWaalsContact OG-C 3.31Å; S517-P528 VanDerWaalsContact OG-CA 3.31Å; S517-P528 WeakPolarHBondContact OG-CA 3.44Å; S517-P528 VanDerWaalsContact OG-N 3.13Å
518	P	87.2	Confident	90.3	Very high	8 Å²	8	60.1 Å²	60.1	5%	0.052	35%	0.348	C	S	.	.			trans	-58.6	129.5	-177.9	-29.1	37.4	0	0	0	113.2	P273 R274 V277 C520 R527 V529	P273-P518 HydrophobicContact CB-CB 3.72Å; R274-P518 HydrophobicContact CG-CG 4.19Å; V277-P518 HydrophobicContact CG1-CG 4.05Å; V277-P518 HydrophobicContact CG2-CG 3.72Å; P518-C520 PolarHBondContact O-N 3.08Å; P518-R527 VanDerWaalsContact CD-O 3.24Å; P518-R527 WeakPolarHBondContact CD-O 3.31Å; P518-V529 HydrophobicContact CG-CG2 4.09Å
519	K	83.1	Confident	90.3	Very high	192 Å²	192	58.7 Å²	58.7	84%	0.835	33%	0.332	S	S	*	.			trans	-64.5	119.4	178.7	-63.8	-177.5	-177.6	177.9	0	109.7	P273 S517	P273-K519 VanDerWaalsContact CB-O 3.23Å; P273-K519 WeakPolarHBondContact CB-O 3.17Å; P273-K519 VanDerWaalsContact CG-O 3.31Å; P273-K519 WeakPolarHBondContact CG-O 3.37Å; S517-K519 PolarHBondContact O-N 3.42Å
520	C	79	Confident	90.3	Very high	15 Å²	15	60.9 Å²	60.9	10%	0.101	34%	0.341	C	S	.	.			trans	-134.5	148.4	-179.2	-174	0	0	0	0	109.8	P273 P518 D522 F525 Q526	P273-C520 HydrophobicContact CG-CB 4.34Å; P518-C520 PolarHBondContact O-N 3.08Å; C520-D522 VanDerWaalsContact C-N 3.27Å; C520-D522 PolarHBondContact O-N 3.03Å; C520-F525 HydrophobicContact CB-CB 4.22Å; C520-Q526 HydrophobicContact CB-CG 4.06Å; C520-Q526 PolarHBondContact O-NE2 3.32Å
521	S	76.4	Confident	90.3	Very high	100 Å²	100	56 Å²	56	70%	0.699	31%	0.311	S	S	*	.	S	Bend	trans	-65	-26.9	-177.7	55.2	0	0	0	0	114
522	D	80.6	Confident	90.4	Very high	80 Å²	80	53.3 Å²	53.3	43%	0.428	29%	0.292	S	S	.	.	S	Bend	trans	-104.4	117.5	168	172	9.5	0	0	0	109	C520 G524 F525	C520-D522 VanDerWaalsContact C-N 3.27Å; C520-D522 PolarHBondContact O-N 3.03Å; D522-G524 PolarHBondContact O-N 3.41Å; D522-G524 WeakPolarHBondContact OD1-CA 3.13Å; D522-G524 PolarHBondContact OD1-N 3.2Å; D522-F525 HydrophobicContact CB-CD2 3.91Å; D522-F525 HydrophobicContact CB-CE2 4.36Å; D522-F525 PolarHBondContact O-N 3.23Å; D522-F525 WeakPolarHBondContact OD2-CD2 3.44Å; D522-F525 VanDerWaalsContact OD2-CE2 3.23Å; D522-F525 WeakPolarHBondContact OD2-CE2 3.31Å
523	V	80.3	Confident	90.4	Very high	106 Å²	106	51.5 Å²	51.5	64%	0.642	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-52.9	-28.6	177.1	-174.2	0	0	0	0	111.5	F525 Q526	V523-F525 PolarHBondContact O-N 3.34Å; V523-F525 VanDerWaalsContact O-N 3.11Å; V523-Q526 PolarHBondContact O-N 2.92Å; V523-Q526 VanDerWaalsContact O-N 3.11Å
524	G	82.6	Confident	90.4	Very high	40 Å²	40	50.6 Å²	50.6	41%	0.412	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-61.2	-15.5	174.2	0	0	0	0	0	115.4	D522 R527	D522-G524 PolarHBondContact O-N 3.41Å; D522-G524 WeakPolarHBondContact OD1-CA 3.13Å; D522-G524 PolarHBondContact OD1-N 3.2Å; G524-R527 PolarHBondContact O-NE 3.03Å; G524-R527 PolarHBondContact O-NH2 3.07Å
525	F	87	Confident	90.1	Very high	20 Å²	20	48.4 Å²	48.4	9%	0.088	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-110.7	-6.1	173.7	-60.8	-83.7	0	0	0	114.3	Y264 R265 C520 D522 V523 R527	Y264-F525 HydrophobicContact CD2-CE2 4.22Å; Y264-F525 AromaticContact CD2-CZ 3.77Å; Y264-F525 HydrophobicContact CD2-CZ 3.77Å; Y264-F525 HydrophobicContact CE2-CE1 4.2Å; Y264-F525 HydrophobicContact CE2-CE2 4.47Å; Y264-F525 AromaticContact CE2-CZ 3.59Å; Y264-F525 HydrophobicContact CE2-CZ 3.59Å; R265-F525 HydrophobicContact CB-CD1 4.34Å; R265-F525 HydrophobicContact CB-CE1 4.29Å; R265-F525 HydrophobicContact CG-CB 4.36Å; R265-F525 HydrophobicContact CG-CD1 3.65Å; R265-F525 HydrophobicContact CG-CE1 4.08Å; R265-F525 HydrophobicContact CG-CG 3.92Å; C520-F525 HydrophobicContact CB-CB 4.22Å; D522-F525 HydrophobicContact CB-CD2 3.91Å; D522-F525 HydrophobicContact CB-CE2 4.36Å; D522-F525 PolarHBondContact O-N 3.23Å; D522-F525 WeakPolarHBondContact OD2-CD2 3.44Å; D522-F525 VanDerWaalsContact OD2-CE2 3.23Å; D522-F525 WeakPolarHBondContact OD2-CE2 3.31Å; V523-F525 PolarHBondContact O-N 3.34Å; V523-F525 VanDerWaalsContact O-N 3.11Å; F525-R527 PolarHBondContact O-N 2.8Å; F525-R527 VanDerWaalsContact O-N 3.12Å
526	Q	90.9	Very high	89.9	Confident	88 Å²	88	49.8 Å²	49.8	41%	0.411	28%	0.28	S	S	.	.			trans	-70.1	104.2	163.9	-61.4	-176.8	17.8	0	0	107.5	C520 V523	C520-Q526 HydrophobicContact CB-CG 4.06Å; C520-Q526 PolarHBondContact O-NE2 3.32Å; V523-Q526 PolarHBondContact O-N 2.92Å; V523-Q526 VanDerWaalsContact O-N 3.11Å
527	R	94.4	Very high	89.9	Confident	17 Å²	17	51.3 Å²	51.3	6%	0.064	28%	0.282	C	S	.	.			trans	-140.3	143.2	-174.6	-61.5	-179.1	-162.2	128.5	5.9	109.6	S434 E468 S517 P518 G524 F525 V529	S434-R527 PolarHBondContact OG-NH1 2.9Å; E468-R527 HydrophobicContact CG-CB 4.03Å; E468-R527 IonicContact OE1-CZ 3.56Å; E468-R527 IonicContact OE1-NH1 2.75Å; E468-R527 PolarHBondContact OE1-NH1 3.3Å; S517-R527 WeakPolarHBondContact CA-O 3.33Å; S517-R527 VanDerWaalsContact OG-C 3.31Å; P518-R527 VanDerWaalsContact CD-O 3.24Å; P518-R527 WeakPolarHBondContact CD-O 3.31Å; G524-R527 PolarHBondContact O-NE 3.03Å; G524-R527 PolarHBondContact O-NH2 3.07Å; F525-R527 PolarHBondContact O-N 2.8Å; F525-R527 VanDerWaalsContact O-N 3.12Å; R527-V529 PolarHBondContact O-N 3.17Å
528	P	95.9	Very high	89.8	Confident	35 Å²	35	50.7 Å²	50.7	23%	0.227	27%	0.274	C	S	.	.			trans	-62.7	138.5	176.5	28	-35.5	0	0	0	109.8	P469 H514 G516 S517 Y530	P469-P528 WeakPolarHBondContact CD-O 3.5Å; H514-P528 WeakPolarHBondContact NE2-CB 3.12Å; G516-P528 WeakPolarHBondContact O-CA 3.48Å; S517-P528 VanDerWaalsContact OG-CA 3.31Å; S517-P528 WeakPolarHBondContact OG-CA 3.44Å; S517-P528 VanDerWaalsContact OG-N 3.13Å; P528-Y530 HydrophobicContact CB-CD2 4.47Å; P528-Y530 HydrophobicContact CB-CE1 4.49Å; P528-Y530 HydrophobicContact CB-CE2 3.66Å; P528-Y530 HydrophobicContact CG-CE2 3.71Å
529	V	97.8	Very high	90	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	29%	0.288	C	S	.	.			trans	-107.5	133.2	167.1	-171.8	0	0	0	0	107.5	V277 L433 I466 L467 E468 L515 G516 P518 R527	V277-V529 HydrophobicContact CG2-CB 4.12Å; V277-V529 HydrophobicContact CG2-CG1 4.47Å; V277-V529 HydrophobicContact CG2-CG2 3.94Å; L433-V529 HydrophobicContact CD2-CG1 4.45Å; I466-V529 HydrophobicContact CG2-CG1 3.71Å; L467-V529 WeakPolarHBondContact O-CA 3.25Å; E468-V529 HydrophobicContact CB-CG2 4.38Å; E468-V529 HydrophobicContact CG-CG2 4.46Å; L515-V529 HydrophobicContact CB-CB 4.41Å; L515-V529 WeakPolarHBondContact CB-O 3.33Å; L515-V529 HydrophobicContact CD1-CG1 4.12Å; L515-V529 PolarHBondContact N-O 3.18Å; G516-V529 PolarHBondContact O-N 3.49Å; P518-V529 HydrophobicContact CG-CG2 4.09Å; R527-V529 PolarHBondContact O-N 3.17Å
530	Y	98.3	Very high	90.5	Very high	50 Å²	50	44.1 Å²	44.1	20%	0.196	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	150.3	176.6	-55.3	-86.8	0	0	0	109.5	I466 L467 P469 F512 E513 H514 P528 F532	I466-Y530 CarbonylContact C-O 3.6Å; I466-Y530 WeakPolarHBondContact CA-O 3.41Å; L467-Y530 PolarHBondContact N-O 2.91Å; L467-Y530 PolarHBondContact O-N 3.02Å; P469-Y530 HydrophobicContact CG-CD2 4.17Å; P469-Y530 HydrophobicContact CG-CE2 3.91Å; F512-Y530 HydrophobicContact CD2-CD1 4.07Å; F512-Y530 HydrophobicContact CE2-CD1 4.27Å; F512-Y530 HydrophobicContact CE2-CE1 4.47Å; E513-Y530 CarbonylContact O-C 3.52Å; E513-Y530 VanDerWaalsContact O-CA 3.27Å; E513-Y530 WeakPolarHBondContact O-CA 3.34Å; H514-Y530 HydrophobicContact CB-CD1 3.87Å; H514-Y530 HydrophobicContact CB-CE1 3.87Å; H514-Y530 AromaticContact CD2-CE1 3.66Å; P528-Y530 HydrophobicContact CB-CD2 4.47Å; P528-Y530 HydrophobicContact CB-CE1 4.49Å; P528-Y530 HydrophobicContact CB-CE2 3.66Å; P528-Y530 HydrophobicContact CG-CE2 3.71Å; Y530-F532 HydrophobicContact CG-CE2 4.44Å
531	V	98.5	Very high	91.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.7	162.7	57.4	0	0	0	0	108.8	W282 L464 F465 I466 F512 E513 L515	W282-V531 HydrophobicContact CH2-CG1 4.28Å; W282-V531 HydrophobicContact CZ2-CG1 4.42Å; L464-V531 HydrophobicContact CB-CG2 3.92Å; L464-V531 HydrophobicContact CD1-CG2 4.44Å; L464-V531 HydrophobicContact CD2-CG2 3.99Å; L464-V531 HydrophobicContact CG-CG2 4.34Å; F465-V531 WeakPolarHBondContact O-CA 3.49Å; I466-V531 HydrophobicContact CG1-CB 4.25Å; I466-V531 HydrophobicContact CG1-CG2 4Å; F512-V531 CarbonylContact C-O 3.55Å; F512-V531 WeakPolarHBondContact CA-O 3.37Å; F512-V531 WeakPolarHBondContact CB-O 3.35Å; E513-V531 HydrophobicContact CB-CG1 3.75Å; E513-V531 PolarHBondContact N-O 3.12Å; E513-V531 PolarHBondContact O-N 3.44Å; L515-V531 HydrophobicContact CD1-CB 4.19Å; L515-V531 HydrophobicContact CD1-CG1 4.12Å; L515-V531 HydrophobicContact CD2-CG1 3.88Å; L515-V531 HydrophobicContact CG-CG1 4.18Å
532	F	98.8	Very high	92.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.9	175	-65.5	-101	0	0	0	109.2	L464 F465 L467 L503 F509 S511 F512 Y530	L464-F532 WeakPolarHBondContact CA-O 3.43Å; F465-F532 HydrophobicContact CB-CB 4.27Å; F465-F532 HydrophobicContact CD1-CD2 4.13Å; F465-F532 PolarHBondContact N-O 3.47Å; F465-F532 PolarHBondContact O-N 3.49Å; L467-F532 HydrophobicContact CB-CD2 4.47Å; L467-F532 HydrophobicContact CB-CE2 4.15Å; L467-F532 HydrophobicContact CD2-CE2 3.83Å; L467-F532 HydrophobicContact CD2-CZ 4.47Å; L503-F532 HydrophobicContact CB-CD1 3.75Å; L503-F532 HydrophobicContact CB-CE1 3.57Å; L503-F532 HydrophobicContact CB-CZ 4.23Å; L503-F532 HydrophobicContact CD1-CD1 4.1Å; L503-F532 HydrophobicContact CD1-CD2 4.06Å; L503-F532 HydrophobicContact CD1-CE1 3.69Å; L503-F532 HydrophobicContact CD1-CE2 3.63Å; L503-F532 HydrophobicContact CD1-CG 4.3Å; L503-F532 HydrophobicContact CD1-CZ 3.45Å; L503-F532 VanDerWaalsContact CD1-CZ 3.45Å; L503-F532 HydrophobicContact CG-CE1 4.26Å; L503-F532 HydrophobicContact CG-CZ 4.46Å; F509-F532 HydrophobicContact CB-CB 4.11Å; F509-F532 HydrophobicContact CB-CD1 4.28Å; F509-F532 HydrophobicContact CD1-CB 3.54Å; F509-F532 HydrophobicContact CD2-CB 4.5Å; F509-F532 HydrophobicContact CE1-CB 4.02Å; F509-F532 HydrophobicContact CG-CB 3.81Å; S511-F532 WeakPolarHBondContact O-CA 3.15Å; F512-F532 HydrophobicContact CB-CD1 3.43Å; F512-F532 VanDerWaalsContact CB-CD1 3.43Å; F512-F532 HydrophobicContact CB-CD2 4.43Å; F512-F532 HydrophobicContact CB-CE1 3.51Å; F512-F532 HydrophobicContact CB-CG 3.89Å; F512-F532 HydrophobicContact CB-CZ 4.07Å; F512-F532 HydrophobicContact CD1-CE1 4.06Å; F512-F532 HydrophobicContact CD2-CE1 4.44Å; F512-F532 HydrophobicContact CD2-CZ 4.47Å; F512-F532 HydrophobicContact CG-CD1 4.18Å; F512-F532 AromaticContact CG-CE1 3.77Å; F512-F532 HydrophobicContact CG-CE1 3.77Å; F512-F532 HydrophobicContact CG-CZ 4.23Å; Y530-F532 HydrophobicContact CG-CE2 4.44Å
533	H	98.5	Very high	93.4	Very high	58 Å²	58	38.9 Å²	38.9	27%	0.269	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	136.4	-180	-61.3	-94.3	0	0	0	110.3	L464 F509 T510 S511	L464-H533 VanDerWaalsContact CD2-ND1 3.34Å; L464-H533 WeakPolarHBondContact CD2-ND1 3.46Å; F509-H533 CarbonylContact C-O 3.57Å; F509-H533 WeakPolarHBondContact CA-O 3.23Å; F509-H533 WeakPolarHBondContact CB-O 3.34Å; F509-H533 WeakPolarHBondContact CD1-O 3.48Å; T510-H533 PolarHBondContact N-O 3.47Å; T510-H533 PolarHBondContact OG1-O 3.01Å; T510-H533 VanDerWaalsContact OG1-O 3.13Å; S511-H533 PolarHBondContact O-N 3.35Å; S511-H533 PolarHBondContact OG-CD2 3.37Å; S511-H533 VanDerWaalsContact OG-CD2 3.3Å
534	K	98.1	Very high	94.6	Very high	52 Å²	52	32.8 Å²	32.8	23%	0.226	17%	0.173	C	C	.	.			trans	-93.3	0	171.9	173.7	165.5	178.5	-175.8	0	110.5	Y456 L459 G462 G463 F509 T510	Y456-K534 HydrophobicContact CD2-CB 4.41Å; Y456-K534 HydrophobicContact CD2-CD 3.94Å; Y456-K534 HydrophobicContact CD2-CG 4.12Å; Y456-K534 HydrophobicContact CE2-CB 4.06Å; Y456-K534 HydrophobicContact CE2-CD 3.71Å; Y456-K534 HydrophobicContact CE2-CG 3.52Å; Y456-K534 WeakPolarHBondContact O-CD 3.45Å; Y456-K534 WeakPolarHBondContact O-CE 3.31Å; Y456-K534 PolarHBondContact O-NZ 3.14Å; L459-K534 HydrophobicContact CB-CD 3.82Å; L459-K534 PolarHBondContact O-NZ 2.86Å; G462-K534 WeakPolarHBondContact CA-O 3.41Å; G462-K534 PolarHBondContact N-O 3.25Å; G463-K534 PolarHBondContact O-N 3.09Å; F509-K534 HydrophobicContact CD1-CB 4.41Å; F509-K534 HydrophobicContact CE1-CB 4.46Å; T510-K534 WeakPolarHBondContact CG2-OXT 3.13Å; T510-K534 PolarHBondContact OG1-OXT 3.24Å

Retrieved 534 of 534 residues in 279.4 ms (Link to these results)

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