A0A060VCX9_HUMAN Loading...

MHC class I antigen

Involved in the presentation of foreign antigens to the immune system.

AlphaFold DB , UniProt , Accession A0A060VCX9, Species HUMAN (Homo sapiens, Human), Gene HLA-C, Length 338 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	40	Very low	240 Å²	240	142.1 Å²	142.1	100%	1.182	71%	0.711	S	S	*	*				0	103.1	0	-77.1	163.7	152.6	0	0	108	V3	M1-V3 PolarHBondContact O-N 3.17Å
2	R	33	Very low	40.2	Very low	253 Å²	253	140.9 Å²	140.9	96%	0.955	71%	0.708	S	S	*	*			trans	-80.4	108	170.5	-93.8	-179.9	173.3	164.9	-2.4	106.5	M4	R2-M4 PolarHBondContact O-N 2.65Å
3	V	36.2	Very low	40	Very low	139 Å²	139	137.7 Å²	137.7	84%	0.842	69%	0.693	S	S	*	*			trans	-67.1	104.2	170.5	179	0	0	0	0	106.3	M1 A5	M1-V3 PolarHBondContact O-N 3.17Å; V3-A5 PolarHBondContact O-N 3.21Å
4	M	37.3	Very low	40	Very low	170 Å²	170	132.1 Å²	132.1	84%	0.837	67%	0.674	S	S	*	*			trans	-80	97.9	174.9	-159.4	168.2	67.6	0	0	106.1	R2	R2-M4 PolarHBondContact O-N 2.65Å
5	A	41	Very low	40.3	Very low	53 Å²	53	125.7 Å²	125.7	44%	0.438	65%	0.653	S	S	.	*			trans	-57.3	141.9	172.7	0	0	0	0	0	109.2	V3 R7 I10	V3-A5 PolarHBondContact O-N 3.21Å; A5-R7 PolarHBondContact O-N 2.88Å; A5-I10 HydrophobicContact CB-CD1 4.32Å
6	P	41.4	Very low	40.6	Very low	73 Å²	73	120 Å²	120	47%	0.474	63%	0.63	S	S	.	*			trans	-63	122.9	-177.2	-12.3	25.8	0	0	0	109	T8 L9 I10	P6-T8 PolarHBondContact O-N 2.93Å; P6-L9 HydrophobicContact CB-CB 4.49Å; P6-L9 WeakPolarHBondContact O-CB 3.39Å; P6-L9 PolarHBondContact O-N 3.32Å; P6-I10 PolarHBondContact O-N 2.72Å
7	R	44	Very low	40.5	Very low	213 Å²	213	119.3 Å²	119.3	80%	0.804	63%	0.626	S	S	*	*	H	α-helix	trans	-55	-25.2	179.7	-83.1	177	162.6	151.2	-6.2	113.4	A5 L11	A5-R7 PolarHBondContact O-N 2.88Å; R7-L11 WeakPolarHBondContact O-CG 3.34Å; R7-L11 PolarHBondContact O-N 3.48Å
8	T	46.3	Very low	40.3	Very low	100 Å²	100	115.7 Å²	115.7	61%	0.613	62%	0.617	S	S	*	*	H	α-helix	trans	-68.3	-38.2	173.7	26.4	0	0	0	0	113.3	P6 I10 L11 L12	P6-T8 PolarHBondContact O-N 2.93Å; T8-I10 VanDerWaalsContact C-N 3.33Å; T8-I10 PolarHBondContact O-N 3.01Å; T8-L11 PolarHBondContact O-N 2.95Å; T8-L12 PolarHBondContact O-N 3.07Å; T8-L12 VanDerWaalsContact O-N 3.16Å
9	L	40.8	Very low	40.4	Very low	106 Å²	106	113.7 Å²	113.7	56%	0.555	61%	0.606	S	S	*	*	H	α-helix	trans	-68	-36.7	177.7	-133.1	109.7	0	0	0	111.3	P6 L13	P6-L9 HydrophobicContact CB-CB 4.49Å; P6-L9 WeakPolarHBondContact O-CB 3.39Å; P6-L9 PolarHBondContact O-N 3.32Å; L9-L13 HydrophobicContact CD2-CD1 4.1Å; L9-L13 WeakPolarHBondContact O-CB 3.12Å; L9-L13 WeakPolarHBondContact O-CD1 3.29Å; L9-L13 WeakPolarHBondContact O-CG 3.43Å; L9-L13 PolarHBondContact O-N 2.88Å
10	I	41.2	Very low	40.5	Very low	91 Å²	91	112 Å²	112	47%	0.467	60%	0.6	S	S	.	*	H	α-helix	trans	-67	-40.3	177.7	-62.8	173.2	0	0	0	110.6	A5 P6 T8 S14	A5-I10 HydrophobicContact CB-CD1 4.32Å; P6-I10 PolarHBondContact O-N 2.72Å; T8-I10 VanDerWaalsContact C-N 3.33Å; T8-I10 PolarHBondContact O-N 3.01Å; I10-S14 WeakPolarHBondContact O-CB 3.37Å; I10-S14 PolarHBondContact O-N 2.95Å; I10-S14 PolarHBondContact O-OG 3.04Å
11	L	45.5	Very low	40.4	Very low	125 Å²	125	114.6 Å²	114.6	65%	0.654	61%	0.608	S	S	*	*	H	α-helix	trans	-68.9	-40.7	178.7	-74.8	165.1	0	0	0	112.9	R7 T8 S14 G15	R7-L11 WeakPolarHBondContact O-CG 3.34Å; R7-L11 PolarHBondContact O-N 3.48Å; T8-L11 PolarHBondContact O-N 2.95Å; L11-S14 PolarHBondContact O-N 3.3Å; L11-G15 PolarHBondContact O-N 3.19Å
12	L	42.7	Very low	41	Very low	128 Å²	128	107.5 Å²	107.5	67%	0.67	58%	0.578	S	S	*	*	H	α-helix	trans	-66.7	-41.6	175.8	-74.8	167.1	0	0	0	112.2	T8 S14 G15 A16	T8-L12 PolarHBondContact O-N 3.07Å; T8-L12 VanDerWaalsContact O-N 3.16Å; L12-S14 VanDerWaalsContact C-N 3.32Å; L12-S14 PolarHBondContact O-N 3.49Å; L12-G15 PolarHBondContact O-N 3.25Å; L12-A16 WeakPolarHBondContact O-CB 3.39Å; L12-A16 PolarHBondContact O-N 3.48Å
13	L	37.7	Very low	41.8	Very low	99 Å²	99	97.4 Å²	97.4	52%	0.518	54%	0.54	S	S	.	.	H	α-helix	trans	-64.7	-36.2	173.1	-77.5	162.9	0	0	0	111.9	L9 L17	L9-L13 HydrophobicContact CD2-CD1 4.1Å; L9-L13 WeakPolarHBondContact O-CB 3.12Å; L9-L13 WeakPolarHBondContact O-CD1 3.29Å; L9-L13 WeakPolarHBondContact O-CG 3.43Å; L9-L13 PolarHBondContact O-N 2.88Å; L13-L17 VanDerWaalsContact O-CB 3.22Å; L13-L17 WeakPolarHBondContact O-CB 3.24Å; L13-L17 WeakPolarHBondContact O-CD1 3.48Å; L13-L17 VanDerWaalsContact O-CG 3.22Å; L13-L17 WeakPolarHBondContact O-CG 3.37Å; L13-L17 PolarHBondContact O-N 2.89Å
14	S	40	Very low	42.9	Very low	60 Å²	60	93.7 Å²	93.7	42%	0.42	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-40.6	176.6	-53.5	0	0	0	0	112	I10 L11 L12 A18	I10-S14 WeakPolarHBondContact O-CB 3.37Å; I10-S14 PolarHBondContact O-N 2.95Å; I10-S14 PolarHBondContact O-OG 3.04Å; L11-S14 PolarHBondContact O-N 3.3Å; L12-S14 VanDerWaalsContact C-N 3.32Å; L12-S14 PolarHBondContact O-N 3.49Å; S14-A18 VanDerWaalsContact O-CB 3.23Å; S14-A18 WeakPolarHBondContact O-CB 3.24Å; S14-A18 PolarHBondContact O-N 2.99Å
15	G	44.3	Very low	44.6	Very low	35 Å²	35	87 Å²	87	36%	0.361	50%	0.499	S	S	.	.	H	α-helix	trans	-67.4	-45.1	176.1	0	0	0	0	0	112.2	L11 L12 L19	L11-G15 PolarHBondContact O-N 3.19Å; L12-G15 PolarHBondContact O-N 3.25Å; G15-L19 WeakPolarHBondContact O-CD1 3.38Å; G15-L19 PolarHBondContact O-N 2.92Å; G15-L19 VanDerWaalsContact O-N 3.08Å
16	A	44.5	Very low	47	Very low	35 Å²	35	87 Å²	87	29%	0.289	50%	0.495	S	S	.	.	H	α-helix	trans	-63.2	-44	176	0	0	0	0	0	112.1	L12 L19 T20	L12-A16 WeakPolarHBondContact O-CB 3.39Å; L12-A16 PolarHBondContact O-N 3.48Å; A16-L19 PolarHBondContact O-N 3.17Å; A16-T20 WeakPolarHBondContact O-CG2 3.37Å; A16-T20 PolarHBondContact O-N 3.34Å; A16-T20 PolarHBondContact O-OG1 3.46Å; A16-T20 VanDerWaalsContact O-OG1 3.11Å
17	L	38.5	Very low	49.5	Very low	108 Å²	108	85 Å²	85	57%	0.565	48%	0.48	S	S	*	.	H	α-helix	trans	-65.9	-42.5	178.2	-77.3	164.6	0	0	0	112.5	L13 L19 T20 E21	L13-L17 VanDerWaalsContact O-CB 3.22Å; L13-L17 WeakPolarHBondContact O-CB 3.24Å; L13-L17 WeakPolarHBondContact O-CD1 3.48Å; L13-L17 VanDerWaalsContact O-CG 3.22Å; L13-L17 WeakPolarHBondContact O-CG 3.37Å; L13-L17 PolarHBondContact O-N 2.89Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 3.25Å; L17-T20 VanDerWaalsContact CA-OG1 3.3Å; L17-T20 WeakPolarHBondContact CA-OG1 3.45Å; L17-T20 PolarHBondContact O-N 2.99Å; L17-T20 PolarHBondContact O-OG1 2.94Å; L17-E21 PolarHBondContact O-N 3.01Å
18	A	38.3	Very low	52.1	Low	55 Å²	55	76 Å²	76	46%	0.455	45%	0.45	S	S	.	.	H	α-helix	trans	-64.1	-37.3	177.7	0	0	0	0	0	112.2	S14 T22	S14-A18 VanDerWaalsContact O-CB 3.23Å; S14-A18 WeakPolarHBondContact O-CB 3.24Å; S14-A18 PolarHBondContact O-N 2.99Å; A18-T22 WeakPolarHBondContact O-CG2 3.37Å; A18-T22 PolarHBondContact O-N 3.04Å; A18-T22 PolarHBondContact O-OG1 2.89Å
19	L	41.8	Very low	54.6	Low	78 Å²	78	71.3 Å²	71.3	41%	0.408	42%	0.42	S	S	.	.	H	α-helix	trans	-70.2	-44.1	173.6	-90.9	138.3	0	0	0	111.6	G15 A16 L17 E21 T22 W23	G15-L19 WeakPolarHBondContact O-CD1 3.38Å; G15-L19 PolarHBondContact O-N 2.92Å; G15-L19 VanDerWaalsContact O-N 3.08Å; A16-L19 PolarHBondContact O-N 3.17Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 3.25Å; L19-E21 PolarHBondContact O-N 2.81Å; L19-T22 WeakPolarHBondContact CA-OG1 3.4Å; L19-T22 PolarHBondContact O-N 2.94Å; L19-T22 VanDerWaalsContact O-N 3.11Å; L19-T22 PolarHBondContact O-OG1 2.8Å; L19-W23 HydrophobicContact CD2-CZ2 4.22Å; L19-W23 PolarHBondContact O-N 3.36Å
20	T	41.3	Very low	57.3	Low	79 Å²	79	68.5 Å²	68.5	49%	0.485	40%	0.403	S	S	.	.	H	α-helix	trans	-63.8	-36.2	178	52	0	0	0	0	113.7	A16 L17 T22 W23	A16-T20 WeakPolarHBondContact O-CG2 3.37Å; A16-T20 PolarHBondContact O-N 3.34Å; A16-T20 PolarHBondContact O-OG1 3.46Å; A16-T20 VanDerWaalsContact O-OG1 3.11Å; L17-T20 VanDerWaalsContact CA-OG1 3.3Å; L17-T20 WeakPolarHBondContact CA-OG1 3.45Å; L17-T20 PolarHBondContact O-N 2.99Å; L17-T20 PolarHBondContact O-OG1 2.94Å; T20-T22 VanDerWaalsContact C-N 3.29Å; T20-T22 PolarHBondContact O-N 2.88Å; T20-W23 PolarHBondContact O-N 3.38Å
21	E	39.7	Very low	60.1	Low	167 Å²	167	64.9 Å²	64.9	78%	0.78	38%	0.383	S	S	*	.	H	α-helix	trans	-68.2	-28	174.6	-93.5	-172.9	156.3	0	0	112.5	L17 L19 W23	L17-E21 PolarHBondContact O-N 3.01Å; L19-E21 PolarHBondContact O-N 2.81Å; E21-W23 VanDerWaalsContact C-N 3.35Å
22	T	45.2	Very low	62.6	Low	90 Å²	90	63 Å²	63	55%	0.552	37%	0.37	S	S	*	.	H	α-helix	trans	-78	-16	177.9	51.7	0	0	0	0	114.2	A18 L19 T20	A18-T22 WeakPolarHBondContact O-CG2 3.37Å; A18-T22 PolarHBondContact O-N 3.04Å; A18-T22 PolarHBondContact O-OG1 2.89Å; L19-T22 WeakPolarHBondContact CA-OG1 3.4Å; L19-T22 PolarHBondContact O-N 2.94Å; L19-T22 VanDerWaalsContact O-N 3.11Å; L19-T22 PolarHBondContact O-OG1 2.8Å; T20-T22 VanDerWaalsContact C-N 3.29Å; T20-T22 PolarHBondContact O-N 2.88Å
23	W	50.7	Low	65.3	Low	42 Å²	42	57.2 Å²	57.2	16%	0.159	34%	0.34	C	S	.	.	H	α-helix	trans	-98.2	-34.1	-169.8	-71.8	30.9	0	0	0	113.2	L19 T20 E21 G25 E236 E288	L19-W23 HydrophobicContact CD2-CZ2 4.22Å; L19-W23 PolarHBondContact O-N 3.36Å; T20-W23 PolarHBondContact O-N 3.38Å; E21-W23 VanDerWaalsContact C-N 3.35Å; W23-G25 PolarHBondContact O-N 2.69Å; W23-E236 HydrophobicContact CD2-CG 4.47Å; W23-E236 HydrophobicContact CE3-CG 4.33Å; W23-E236 HydrophobicContact CH2-CB 4.4Å; W23-E236 HydrophobicContact CH2-CG 3.51Å; W23-E236 HydrophobicContact CZ2-CG 3.63Å; W23-E236 HydrophobicContact CZ3-CB 4.33Å; W23-E236 HydrophobicContact CZ3-CG 3.85Å; W23-E236 WeakPolarHBondContact CZ3-O 3.2Å; W23-E288 HydrophobicContact CE3-CB 4.27Å
24	A	57.7	Low	68.2	Low	61 Å²	61	54.5 Å²	54.5	50%	0.504	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	110	-175.3	0	0	0	0	0	112	P129	A24-P129 WeakPolarHBondContact O-CG 3.35Å
25	G	74.2	Confident	71	Confident	29 Å²	29	51.7 Å²	51.7	30%	0.299	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	12.1	163.5	0	0	0	0	0	116.9	W23 P129	W23-G25 PolarHBondContact O-N 2.69Å; G25-P129 VanDerWaalsContact O-CA 3.3Å; G25-P129 WeakPolarHBondContact O-CA 3.47Å
26	S	90.6	Very high	73.5	Confident	53 Å²	53	52.4 Å²	52.4	37%	0.371	31%	0.305	S	S	.	.			trans	-84.3	142.8	164.1	65.9	0	0	0	0	110.6	L127	S26-L127 VanDerWaalsContact CA-O 3.26Å; S26-L127 WeakPolarHBondContact CA-O 3.37Å; S26-L127 WeakPolarHBondContact CB-O 3.45Å
27	H	95.4	Very high	75.9	Confident	32 Å²	32	51.6 Å²	51.6	15%	0.148	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153	179.6	-67.2	-77.5	0	0	0	111	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.24Å; H27-D53 WeakPolarHBondContact CA-OD1 3.49Å; H27-D53 IonicContact CE1-OD2 3.13Å; H27-D53 IonicContact CG-OD2 3.37Å; H27-D53 IonicContact ND1-OD1 3.01Å; H27-D53 IonicContact ND1-OD2 3.83Å; H27-D53 PolarHBondContact ND1-OD2 3.11Å; H27-D126 CarbonylContact O-C 3.51Å; H27-D126 WeakPolarHBondContact O-CA 3.36Å; H27-L127 PolarHBondContact N-O 2.61Å; H27-L127 PolarHBondContact O-N 3.35Å; H27-L192 HydrophobicContact CB-CD1 4.44Å; H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 4.01Å; H27-L196 HydrophobicContact CB-CG 4.43Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.47Å
28	S	97.5	Very high	78.2	Confident	24 Å²	24	53.3 Å²	53.3	17%	0.168	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	150.3	179.4	69.1	0	0	0	0	112	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.58Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.46Å; S28-D53 PolarHBondContact N-OD1 2.98Å; S28-D53 PolarHBondContact O-N 3.38Å; S28-C125 WeakPolarHBondContact CA-O 3.29Å; S28-D126 WeakPolarHBondContact CB-OD1 3.43Å
29	M	98.6	Very high	80.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	120	167.8	-175.4	172.1	60.2	0	0	108.3	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.17Å; M29-Y31 HydrophobicContact CG-CE2 4.04Å; M29-Y31 HydrophobicContact SD-CE2 3.99Å; M29-Y51 CarbonylContact C-O 3.53Å; M29-Y51 WeakPolarHBondContact CA-O 3.44Å; M29-V52 HydrophobicContact CG-CG2 4.36Å; M29-F57 HydrophobicContact CG-CE1 4.44Å; M29-F57 HydrophobicContact SD-CZ 4.41Å; M29-G124 CarbonylContact O-C 3.58Å; M29-G124 WeakPolarHBondContact O-CA 3.33Å; M29-C125 PolarHBondContact N-O 2.93Å; M29-C125 PolarHBondContact O-N 3.38Å; M29-C188 HydrophobicContact CE-CB 4.18Å; M29-C188 VanDerWaalsContact CE-O 3.22Å; M29-C188 WeakPolarHBondContact CE-O 3.33Å; M29-C188 WeakPolarHBondContact CE-SG 3.49Å; M29-W191 HydrophobicContact CE-CB 4.07Å; M29-W191 HydrophobicContact SD-CB 4.43Å; M29-L192 HydrophobicContact CB-CB 4.06Å; M29-L192 HydrophobicContact CB-CD1 4.04Å; M29-L192 HydrophobicContact CB-CD2 3.94Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.28Å; M29-L192 HydrophobicContact SD-CB 4.43Å; M29-Y195 HydrophobicContact SD-CD2 3.72Å; M29-Y195 HydrophobicContact SD-CE2 3.56Å; M29-Y195 VanDerWaalsContact SD-CE2 3.56Å
30	R	98.6	Very high	81.8	Confident	48 Å²	48	53.3 Å²	53.3	18%	0.181	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.2	-175.8	-57	-62.4	-177.7	75.5	2.6	110.6	F32 G50 Y51 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.45Å; R30-F32 HydrophobicContact CB-CE2 3.62Å; R30-F32 HydrophobicContact CB-CZ 3.95Å; R30-G50 CarbonylContact O-C 3.59Å; R30-G50 WeakPolarHBondContact O-CA 3.21Å; R30-Y51 PolarHBondContact N-O 3.45Å; R30-Y51 PolarHBondContact O-N 2.87Å; R30-D126 IonicContact CZ-OD1 3.72Å; R30-D126 IonicContact NE-OD1 2.58Å; R30-D126 PolarHBondContact NE-OD1 3.19Å; R30-D126 VanDerWaalsContact NE-OD1 3.13Å; R30-D126 VanDerWaalsContact NH2-CG 3.25Å; R30-D126 IonicContact NH2-OD1 3.44Å; R30-D126 PolarHBondContact NH2-OD1 2.95Å; R30-D126 IonicContact NH2-OD2 2.76Å; R30-D126 PolarHBondContact NH2-OD2 2.96Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.27Å; R30-Y137 PolarHBondContact NH2-OH 2.83Å
31	Y	98.7	Very high	83.7	Confident	15 Å²	15	58.2 Å²	58.2	6%	0.059	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.7	169.5	-68.7	-90.7	0	0	0	109.5	M29 V49 F57 V58 M122 F123	M29-Y31 HydrophobicContact CE-CE2 4.17Å; M29-Y31 HydrophobicContact CG-CE2 4.04Å; M29-Y31 HydrophobicContact SD-CE2 3.99Å; Y31-V49 WeakPolarHBondContact CA-O 3.43Å; Y31-F57 AromaticContact CE1-CZ 3.92Å; Y31-F57 HydrophobicContact CE1-CZ 3.92Å; Y31-F57 AromaticContact CZ-CZ 3.74Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.36Å; Y31-V58 HydrophobicContact CE1-CG1 4.01Å; Y31-M122 WeakPolarHBondContact O-CA 3.37Å; Y31-F123 VanDerWaalsContact CB-CE1 3.49Å; Y31-F123 VanDerWaalsContact CB-CZ 3.48Å; Y31-F123 HydrophobicContact CD2-CD2 4.39Å; Y31-F123 AromaticContact CD2-CE2 3.7Å; Y31-F123 HydrophobicContact CD2-CE2 3.7Å; Y31-F123 AromaticContact CD2-CZ 3.86Å; Y31-F123 HydrophobicContact CD2-CZ 3.86Å; Y31-F123 HydrophobicContact CE2-CE2 4.45Å; Y31-F123 HydrophobicContact CG-CE1 4.27Å; Y31-F123 HydrophobicContact CG-CE2 4.08Å; Y31-F123 AromaticContact CG-CZ 3.75Å; Y31-F123 HydrophobicContact CG-CZ 3.75Å; Y31-F123 PolarHBondContact N-O 3.28Å; Y31-F123 PolarHBondContact O-N 3.03Å
32	F	98.8	Very high	85.8	Confident	86 Å²	86	53.2 Å²	53.2	38%	0.377	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.3	175.1	-56.4	-95.4	0	0	0	108.3	R30 A48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CD2 4.45Å; R30-F32 HydrophobicContact CB-CE2 3.62Å; R30-F32 HydrophobicContact CB-CZ 3.95Å; F32-A48 CarbonylContact O-C 3.53Å; F32-A48 VanDerWaalsContact O-CA 3.29Å; F32-A48 WeakPolarHBondContact O-CA 3.34Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.34Å; F32-V49 PolarHBondContact N-O 3.47Å; F32-V49 PolarHBondContact O-N 3.14Å; F32-Y51 HydrophobicContact CD2-CD2 4.13Å; F32-Y51 HydrophobicContact CE2-CD2 4.16Å; F32-R121 CarbonylContact C-O 3.57Å; F32-R121 WeakPolarHBondContact CA-O 3.47Å; F32-M122 HydrophobicContact CD1-CB 3.93Å; F32-M122 HydrophobicContact CD1-CG 3.66Å; F32-M122 HydrophobicContact CE1-CB 4.06Å; F32-M122 HydrophobicContact CE1-CG 3.37Å; F32-M122 HydrophobicContact CG-CG 4.48Å; F32-M122 HydrophobicContact CZ-CG 3.98Å
33	S	98.6	Very high	87.9	Confident	5 Å²	5	53.9 Å²	53.9	4%	0.035	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.2	169.9	65.1	0	0	0	0	111.2	I47 Q120 R121	S33-I47 CarbonylContact C-O 3.55Å; S33-I47 VanDerWaalsContact CA-O 3.24Å; S33-I47 WeakPolarHBondContact CA-O 3.46Å; S33-Q120 CarbonylContact O-C 3.48Å; S33-Q120 VanDerWaalsContact O-CA 3.31Å; S33-Q120 WeakPolarHBondContact O-CA 3.49Å; S33-R121 PolarHBondContact N-O 3.16Å; S33-R121 PolarHBondContact O-N 2.88Å
34	T	98.8	Very high	90	Very high	42 Å²	42	53.1 Å²	53.1	26%	0.258	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	124.9	177.9	-56.8	0	0	0	0	108.9	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 3.96Å; T34-F46 WeakPolarHBondContact O-CA 3.36Å; T34-I47 PolarHBondContact N-O 2.94Å; T34-I47 PolarHBondContact O-N 2.94Å; T34-T118 HydrophobicContact CG2-CG2 3.84Å; T34-L119 CarbonylContact C-O 3.53Å; T34-L119 WeakPolarHBondContact CA-O 3.11Å; T34-Q120 HydrophobicContact CG2-CG 3.98Å
35	S	98.4	Very high	91.9	Very high	1 Å²	1	55 Å²	55	1%	0.007	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.4	168.8	-80.1	0	0	0	0	110.7	R45 F46 D98 T118 L119	S35-R45 CarbonylContact C-O 3.59Å; S35-R45 VanDerWaalsContact CA-O 3.24Å; S35-R45 WeakPolarHBondContact CA-O 3.43Å; S35-F46 WeakPolarHBondContact OG-CD2 3.47Å; S35-D98 WeakPolarHBondContact OG-CB 3.38Å; S35-T118 CarbonylContact O-C 3.59Å; S35-T118 WeakPolarHBondContact O-CA 3.25Å; S35-L119 PolarHBondContact N-O 2.84Å; S35-L119 PolarHBondContact O-N 3.38Å
36	V	97.6	Very high	93	Very high	50 Å²	50	53.7 Å²	53.7	30%	0.303	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	115.6	178.6	-173.6	0	0	0	0	109	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 3.96Å; V36-P44 CarbonylContact O-C 3.55Å; V36-P44 WeakPolarHBondContact O-CA 3.48Å; V36-P44 WeakPolarHBondContact O-CB 3.43Å; V36-R45 PolarHBondContact N-O 2.94Å; V36-R45 PolarHBondContact O-N 3.09Å; V36-H117 CarbonylContact C-O 3.55Å; V36-H117 WeakPolarHBondContact CA-O 3.32Å; V36-T118 HydrophobicContact CG2-CG2 4.28Å
37	S	94.6	Very high	93.4	Very high	19 Å²	19	53.6 Å²	53.6	13%	0.133	29%	0.288	C	S	.	.			trans	-76.5	135.3	172.2	62.4	0	0	0	0	110.4	S116 H117	S37-S116 WeakPolarHBondContact O-CA 3.21Å; S37-S116 WeakPolarHBondContact O-CB 3.44Å; S37-S116 PolarHBondContact O-OG 3.27Å; S37-H117 PolarHBondContact N-O 3.11Å; S37-H117 PolarHBondContact OG-N 2.88Å; S37-H117 PolarHBondContact OG-O 3.32Å
38	W	87.8	Confident	93.6	Very high	143 Å²	143	52.3 Å²	52.3	54%	0.542	28%	0.282	S	S	.	.			trans	-126.9	96.1	172.8	-154.5	-26.3	0	0	0	109.9	G40 R41	W38-G40 PolarHBondContact O-N 3.4Å; W38-R41 HydrophobicContact CB-CB 4.1Å; W38-R41 HydrophobicContact CD2-CB 4.34Å; W38-R41 HydrophobicContact CD2-CG 4.33Å; W38-R41 VanDerWaalsContact CE2-CD 3.5Å; W38-R41 HydrophobicContact CG-CB 3.92Å; W38-R41 HydrophobicContact CG-CG 4.07Å; W38-R41 PolarHBondContact O-N 3.07Å; W38-R41 VanDerWaalsContact O-N 3.09Å
39	P	78.9	Confident	93.6	Very high	46 Å²	46	52.5 Å²	52.5	30%	0.299	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	132.5	178.2	-27.1	36.6	0	0	0	111.3	R41 E113 G115	P39-R41 VanDerWaalsContact C-N 3.28Å; P39-R41 PolarHBondContact O-N 3.45Å; P39-E113 WeakPolarHBondContact CB-O 3.28Å; P39-E113 WeakPolarHBondContact CG-O 3.49Å; P39-G115 WeakPolarHBondContact CG-O 3.39Å
40	G	76.4	Confident	93.6	Very high	88 Å²	88	52.5 Å²	52.5	91%	0.907	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	-1.1	-179.9	0	0	0	0	0	116.3	W38	W38-G40 PolarHBondContact O-N 3.4Å
41	R	81.2	Confident	93.6	Very high	182 Å²	182	53.6 Å²	53.6	69%	0.687	29%	0.287	S	S	*	.	S	Bend	trans	-117.1	15.9	179.2	-61.9	-161	-178.4	-157.5	-4	114.9	W38 P39	W38-R41 HydrophobicContact CB-CB 4.1Å; W38-R41 HydrophobicContact CD2-CB 4.34Å; W38-R41 HydrophobicContact CD2-CG 4.33Å; W38-R41 VanDerWaalsContact CE2-CD 3.5Å; W38-R41 HydrophobicContact CG-CB 3.92Å; W38-R41 HydrophobicContact CG-CG 4.07Å; W38-R41 PolarHBondContact O-N 3.07Å; W38-R41 VanDerWaalsContact O-N 3.09Å; P39-R41 VanDerWaalsContact C-N 3.28Å; P39-R41 PolarHBondContact O-N 3.45Å
42	G	83.9	Confident	93.6	Very high	61 Å²	61	52.9 Å²	52.9	63%	0.629	28%	0.284	S	S	*	.	S	Bend	trans	106	-150.1	176.2	0	0	0	0	0	112.9
43	E	89.9	Confident	93.5	Very high	105 Å²	105	50.1 Å²	50.1	49%	0.491	27%	0.274	S	S	.	.	S	Bend	trans	-75.9	155	-179.6	-64.5	-55.7	162	0	0	112.3	R45 R99	E43-R45 PolarHBondContact O-N 3.37Å; E43-R99 VanDerWaalsContact CD-NH2 3.27Å; E43-R99 IonicContact OE1-CZ 3.35Å; E43-R99 IonicContact OE1-NE 3.67Å; E43-R99 PolarHBondContact OE1-NE 2.79Å; E43-R99 IonicContact OE1-NH1 3.7Å; E43-R99 IonicContact OE1-NH2 3.11Å; E43-R99 PolarHBondContact OE1-NH2 3.35Å; E43-R99 WeakPolarHBondContact OE2-CD 3.18Å; E43-R99 IonicContact OE2-CZ 2.72Å; E43-R99 IonicContact OE2-NE 3.24Å; E43-R99 PolarHBondContact OE2-NE 2.03Å; E43-R99 IonicContact OE2-NH1 2.68Å; E43-R99 IonicContact OE2-NH2 3.75Å; E43-R99 PolarHBondContact OE2-NH2 2.96Å
44	P	94.4	Very high	93.3	Very high	26 Å²	26	53 Å²	53	17%	0.169	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-56.1	128.7	172.7	-24.5	34.8	0	0	0	111.3	V36 F46 R99 L102	V36-P44 CarbonylContact O-C 3.55Å; V36-P44 WeakPolarHBondContact O-CA 3.48Å; V36-P44 WeakPolarHBondContact O-CB 3.43Å; P44-F46 PolarHBondContact O-N 3.37Å; P44-R99 HydrophobicContact CG-CB 4.39Å; P44-R99 HydrophobicContact CG-CG 4.29Å; P44-L102 HydrophobicContact CB-CD1 3.65Å; P44-L102 HydrophobicContact CG-CD1 3.8Å
45	R	96.9	Very high	93.2	Very high	99 Å²	99	51.6 Å²	51.6	37%	0.374	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	131.4	173	-178.3	179.6	-173.9	179.2	-3.6	108.8	S35 V36 E43 I47 D61 S62 D63	S35-R45 CarbonylContact C-O 3.59Å; S35-R45 VanDerWaalsContact CA-O 3.24Å; S35-R45 WeakPolarHBondContact CA-O 3.43Å; V36-R45 PolarHBondContact N-O 2.94Å; V36-R45 PolarHBondContact O-N 3.09Å; E43-R45 PolarHBondContact O-N 3.37Å; R45-I47 HydrophobicContact CG-CG1 4.32Å; R45-D61 IonicContact CZ-OD1 3.54Å; R45-D61 IonicContact CZ-OD2 3.56Å; R45-D61 IonicContact NE-OD1 3.89Å; R45-D61 PolarHBondContact NE-OD1 3.07Å; R45-D61 IonicContact NE-OD2 3.99Å; R45-D61 IonicContact NH2-OD1 2.71Å; R45-D61 PolarHBondContact NH2-OD1 3.32Å; R45-D61 IonicContact NH2-OD2 2.77Å; R45-D61 PolarHBondContact NH2-OD2 2.98Å; R45-S62 WeakPolarHBondContact CA-OG 3.42Å; R45-D63 WeakPolarHBondContact CD-OD2 3.43Å; R45-D63 HydrophobicContact CG-CB 4.5Å; R45-D63 WeakPolarHBondContact CG-OD2 3.36Å; R45-D63 IonicContact NE-OD2 3.72Å
46	F	98.3	Very high	93.2	Very high	2 Å²	2	54 Å²	54	1%	0.009	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.3	176.2	174.5	-89.1	0	0	0	110	T34 S35 P44 A48 F60 S62 Y91 Q94 A95 D98	T34-F46 WeakPolarHBondContact O-CA 3.36Å; S35-F46 WeakPolarHBondContact OG-CD2 3.47Å; P44-F46 PolarHBondContact O-N 3.37Å; F46-A48 HydrophobicContact CE1-CB 3.68Å; F46-A48 HydrophobicContact CZ-CB 3.81Å; F46-F60 AromaticContact CD1-CD1 3.64Å; F46-F60 HydrophobicContact CD1-CD1 3.64Å; F46-F60 AromaticContact CD1-CE1 3.75Å; F46-F60 HydrophobicContact CD1-CE1 3.75Å; F46-F60 AromaticContact CE1-CD1 3.82Å; F46-F60 HydrophobicContact CE1-CD1 3.82Å; F46-F60 HydrophobicContact CE1-CE1 4.2Å; F46-S62 PolarHBondContact N-OG 2.88Å; F46-S62 PolarHBondContact O-N 3.47Å; F46-S62 PolarHBondContact O-OG 3.4Å; F46-Y91 HydrophobicContact CE1-CD1 4.26Å; F46-Q94 HydrophobicContact CE2-CB 4.11Å; F46-Q94 HydrophobicContact CE2-CG 3.65Å; F46-Q94 HydrophobicContact CZ-CB 3.92Å; F46-Q94 HydrophobicContact CZ-CG 3.8Å; F46-A95 HydrophobicContact CB-CB 3.65Å; F46-A95 HydrophobicContact CD1-CB 3.85Å; F46-A95 HydrophobicContact CD2-CB 4.06Å; F46-A95 HydrophobicContact CG-CB 3.58Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.3Å
47	I	98.6	Very high	93.2	Very high	52 Å²	52	51.7 Å²	51.7	27%	0.267	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	134.5	173.5	-59.8	170.1	0	0	0	107.5	S33 T34 R45 V49 F60	S33-I47 CarbonylContact C-O 3.55Å; S33-I47 VanDerWaalsContact CA-O 3.24Å; S33-I47 WeakPolarHBondContact CA-O 3.46Å; T34-I47 PolarHBondContact N-O 2.94Å; T34-I47 PolarHBondContact O-N 2.94Å; R45-I47 HydrophobicContact CG-CG1 4.32Å; I47-V49 HydrophobicContact CG2-CG1 4.5Å; I47-F60 WeakPolarHBondContact CA-O 3.34Å
48	A	98.6	Very high	93.4	Very high	4 Å²	4	50.8 Å²	50.8	3%	0.033	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	141.8	169.8	0	0	0	0	0	110.7	F32 F46 R59 F60 Y91	F32-A48 CarbonylContact O-C 3.53Å; F32-A48 VanDerWaalsContact O-CA 3.29Å; F32-A48 WeakPolarHBondContact O-CA 3.34Å; F46-A48 HydrophobicContact CE1-CB 3.68Å; F46-A48 HydrophobicContact CZ-CB 3.81Å; A48-R59 CarbonylContact O-C 3.49Å; A48-R59 WeakPolarHBondContact O-CA 3.47Å; A48-F60 HydrophobicContact CB-CB 4.37Å; A48-F60 PolarHBondContact N-O 3Å; A48-F60 PolarHBondContact O-N 3.42Å; A48-Y91 HydrophobicContact CB-CD1 3.67Å; A48-Y91 HydrophobicContact CB-CE1 3.62Å
49	V	98.8	Very high	93.9	Very high	29 Å²	29	48 Å²	48	18%	0.176	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.7	175.5	-63	0	0	0	0	109.4	Y31 F32 I47 Y51 Q56 V58 R59	Y31-V49 WeakPolarHBondContact CA-O 3.43Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.34Å; F32-V49 PolarHBondContact N-O 3.47Å; F32-V49 PolarHBondContact O-N 3.14Å; I47-V49 HydrophobicContact CG2-CG1 4.5Å; V49-Y51 HydrophobicContact CB-CE2 4.12Å; V49-Y51 HydrophobicContact CG2-CD2 4.36Å; V49-Y51 HydrophobicContact CG2-CE2 3.8Å; V49-Q56 VanDerWaalsContact CG1-NE2 3.27Å; V49-V58 WeakPolarHBondContact CA-O 3.46Å; V49-R59 HydrophobicContact CG1-CB 4.47Å; V49-R59 HydrophobicContact CG1-CG 4.24Å
50	G	98.6	Very high	94.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	139.9	175.7	0	0	0	0	0	110.6	R30 Q56 F57 V58	R30-G50 CarbonylContact O-C 3.59Å; R30-G50 WeakPolarHBondContact O-CA 3.21Å; G50-Q56 WeakPolarHBondContact O-CA 3.3Å; G50-F57 WeakPolarHBondContact O-CD1 3.33Å; G50-F57 PolarHBondContact O-N 3.4Å; G50-V58 PolarHBondContact N-O 2.98Å; G50-V58 PolarHBondContact O-N 3.34Å
51	Y	98.6	Very high	95.8	Very high	70 Å²	70	42.4 Å²	42.4	28%	0.275	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.9	179.9	-74.8	-102.5	0	0	0	110.1	M29 R30 F32 V49 T55 Q56	M29-Y51 CarbonylContact C-O 3.53Å; M29-Y51 WeakPolarHBondContact CA-O 3.44Å; R30-Y51 PolarHBondContact N-O 3.45Å; R30-Y51 PolarHBondContact O-N 2.87Å; F32-Y51 HydrophobicContact CD2-CD2 4.13Å; F32-Y51 HydrophobicContact CE2-CD2 4.16Å; V49-Y51 HydrophobicContact CB-CE2 4.12Å; V49-Y51 HydrophobicContact CG2-CD2 4.36Å; V49-Y51 HydrophobicContact CG2-CE2 3.8Å; Y51-T55 VanDerWaalsContact CA-O 3.3Å; Y51-T55 WeakPolarHBondContact CA-O 3.31Å; Y51-Q56 HydrophobicContact CD1-CB 3.95Å; Y51-Q56 HydrophobicContact CD2-CG 4.36Å; Y51-Q56 HydrophobicContact CE1-CB 3.46Å; Y51-Q56 VanDerWaalsContact CE1-CB 3.46Å; Y51-Q56 HydrophobicContact CE1-CG 4.19Å; Y51-Q56 HydrophobicContact CE2-CB 4.08Å; Y51-Q56 HydrophobicContact CE2-CG 3.85Å; Y51-Q56 HydrophobicContact CG-CB 4.44Å; Y51-Q56 PolarHBondContact OH-OE1 3.33Å
52	V	98.2	Very high	96.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.5	156.3	177.6	0	0	0	0	105.8	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.58Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.46Å; M29-V52 HydrophobicContact CG-CG2 4.36Å; V52-D54 PolarHBondContact O-N 3.3Å; V52-T55 PolarHBondContact N-O 3.37Å; V52-T55 WeakPolarHBondContact O-CB 3.46Å; V52-T55 PolarHBondContact O-N 2.94Å; V52-F57 HydrophobicContact CG2-CD1 3.95Å; V52-F57 HydrophobicContact CG2-CE1 4Å; V52-W75 HydrophobicContact CG2-CH2 4Å; V52-L192 HydrophobicContact CG1-CD1 3.61Å; V52-L192 HydrophobicContact CG2-CD1 4.28Å; V52-Y195 HydrophobicContact CG2-CD2 3.96Å; V52-Y195 HydrophobicContact CG2-CG 4.44Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.08Å; V52-L203 HydrophobicContact CG1-CD1 3.91Å; V52-L203 HydrophobicContact CG1-CD2 4.04Å; V52-L203 HydrophobicContact CG1-CG 4.49Å
53	D	96	Very high	97.2	Very high	29 Å²	29	37.4 Å²	37.4	16%	0.155	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	-122.9	-167.1	-53.8	-39.7	0	0	0	110.6	H27 S28	H27-D53 VanDerWaalsContact CA-OD1 3.24Å; H27-D53 WeakPolarHBondContact CA-OD1 3.49Å; H27-D53 IonicContact CE1-OD2 3.13Å; H27-D53 IonicContact CG-OD2 3.37Å; H27-D53 IonicContact ND1-OD1 3.01Å; H27-D53 IonicContact ND1-OD2 3.83Å; H27-D53 PolarHBondContact ND1-OD2 3.11Å; S28-D53 PolarHBondContact N-OD1 2.98Å; S28-D53 PolarHBondContact O-N 3.38Å
54	D	95.8	Very high	97.4	Very high	64 Å²	64	34 Å²	34	34%	0.342	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	7.3	179.7	-64.8	-53.4	0	0	0	113.5	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 3.3Å; D54-Y233 HydrophobicContact CB-CE2 4Å; D54-P234 VanDerWaalsContact OD2-CB 3.26Å; D54-P234 WeakPolarHBondContact OD2-CB 3.46Å; D54-A235 HydrophobicContact CB-CB 4.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.25Å; D54-A235 PolarHBondContact OD2-N 2.97Å; D54-F265 HydrophobicContact CB-CE2 3.79Å; D54-F265 HydrophobicContact CB-CZ 3.73Å
55	T	96.6	Very high	97.5	Very high	14 Å²	14	38.4 Å²	38.4	9%	0.086	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	114.7	-175.3	-59.6	0	0	0	0	111.5	Y51 V52 F57 E73 L203 Y233	Y51-T55 VanDerWaalsContact CA-O 3.3Å; Y51-T55 WeakPolarHBondContact CA-O 3.31Å; V52-T55 PolarHBondContact N-O 3.37Å; V52-T55 WeakPolarHBondContact O-CB 3.46Å; V52-T55 PolarHBondContact O-N 2.94Å; T55-F57 PolarHBondContact O-N 3.47Å; T55-E73 VanDerWaalsContact CG2-CD 3.5Å; T55-E73 HydrophobicContact CG2-CG 3.6Å; T55-E73 WeakPolarHBondContact CG2-OE1 3.27Å; T55-L203 HydrophobicContact CG2-CD2 4.14Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.41Å; T55-Y233 PolarHBondContact OG1-OH 3.35Å
56	Q	97.4	Very high	97.4	Very high	52 Å²	52	37.6 Å²	37.6	24%	0.243	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	120.6	176	-169.4	-176.9	-9.1	0	0	110.6	V49 G50 Y51 V58 R72 E73	V49-Q56 VanDerWaalsContact CG1-NE2 3.27Å; G50-Q56 WeakPolarHBondContact O-CA 3.3Å; Y51-Q56 HydrophobicContact CD1-CB 3.95Å; Y51-Q56 HydrophobicContact CD2-CG 4.36Å; Y51-Q56 HydrophobicContact CE1-CB 3.46Å; Y51-Q56 VanDerWaalsContact CE1-CB 3.46Å; Y51-Q56 HydrophobicContact CE1-CG 4.19Å; Y51-Q56 HydrophobicContact CE2-CB 4.08Å; Y51-Q56 HydrophobicContact CE2-CG 3.85Å; Y51-Q56 HydrophobicContact CG-CB 4.44Å; Y51-Q56 PolarHBondContact OH-OE1 3.33Å; Q56-V58 PolarHBondContact NE2-O 3.39Å; Q56-R72 HydrophobicContact CG-CB 4.47Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 WeakPolarHBondContact O-CB 3.19Å; Q56-E73 WeakPolarHBondContact O-CG 3.5Å
57	F	97.8	Very high	97.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-19.5	-178.3	74.7	-87.8	0	0	0	114.6	M29 Y31 G50 V52 T55 R72 E73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.44Å; M29-F57 HydrophobicContact SD-CZ 4.41Å; Y31-F57 AromaticContact CE1-CZ 3.92Å; Y31-F57 HydrophobicContact CE1-CZ 3.92Å; Y31-F57 AromaticContact CZ-CZ 3.74Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.36Å; G50-F57 WeakPolarHBondContact O-CD1 3.33Å; G50-F57 PolarHBondContact O-N 3.4Å; V52-F57 HydrophobicContact CG2-CD1 3.95Å; V52-F57 HydrophobicContact CG2-CE1 4Å; T55-F57 PolarHBondContact O-N 3.47Å; F57-R72 PolarHBondContact O-N 3.05Å; F57-E73 HydrophobicContact CB-CB 4.41Å; F57-E73 HydrophobicContact CB-CG 4.28Å; F57-W75 HydrophobicContact CB-CH2 3.14Å; F57-W75 HydrophobicContact CB-CZ2 3.39Å; F57-W75 HydrophobicContact CB-CZ3 4.02Å; F57-W75 HydrophobicContact CD1-CH2 4.07Å; F57-W75 HydrophobicContact CD2-CH2 4.03Å; F57-W75 HydrophobicContact CD2-CZ3 4.31Å; F57-W75 AromaticContact CG-CH2 3.52Å; F57-W75 HydrophobicContact CG-CH2 3.52Å; F57-W75 HydrophobicContact CG-CZ2 4.23Å; F57-W75 HydrophobicContact CG-CZ3 4.25Å; F57-V76 HydrophobicContact CB-CG1 4.33Å; F57-V76 HydrophobicContact CD2-CB 4.39Å; F57-V76 HydrophobicContact CD2-CG1 4.39Å; F57-V76 HydrophobicContact CD2-CG2 4.07Å; F57-V76 WeakPolarHBondContact O-CG1 3.36Å; F57-Y195 HydrophobicContact CE2-CD2 4.5Å; F57-Y195 AromaticContact CE2-CE2 3.83Å; F57-Y195 HydrophobicContact CE2-CE2 3.83Å; F57-Y195 AromaticContact CE2-CZ 3.97Å; F57-Y195 HydrophobicContact CZ-CD2 4.37Å; F57-Y195 AromaticContact CZ-CE2 3.8Å; F57-Y195 HydrophobicContact CZ-CE2 3.8Å
58	V	98.1	Very high	97.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	149.4	-179.1	66.3	0	0	0	0	112.1	Y31 V49 G50 Q56 E70 W84 Y91	Y31-V58 HydrophobicContact CE1-CG1 4.01Å; V49-V58 WeakPolarHBondContact CA-O 3.46Å; G50-V58 PolarHBondContact N-O 2.98Å; G50-V58 PolarHBondContact O-N 3.34Å; Q56-V58 PolarHBondContact NE2-O 3.39Å; V58-E70 WeakPolarHBondContact CA-O 3.32Å; V58-W84 HydrophobicContact CG2-CZ3 4.01Å; V58-Y91 WeakPolarHBondContact CG1-OH 3.41Å; V58-Y91 HydrophobicContact CG2-CE2 4.32Å
59	R	98.3	Very high	97.1	Very high	84 Å²	84	43.9 Å²	43.9	32%	0.317	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.6	170.8	-179.3	171.1	166.5	-177	-2.9	111.2	A48 V49 D61 E70 R72	A48-R59 CarbonylContact O-C 3.49Å; A48-R59 WeakPolarHBondContact O-CA 3.47Å; V49-R59 HydrophobicContact CG1-CB 4.47Å; V49-R59 HydrophobicContact CG1-CG 4.24Å; R59-D61 IonicContact NH2-OD2 3.35Å; R59-D61 PolarHBondContact NH2-OD2 3.3Å; R59-D61 VanDerWaalsContact NH2-OD2 3.11Å; R59-E70 PolarHBondContact N-O 2.87Å; R59-E70 PolarHBondContact O-N 3.49Å; R59-R72 HydrophobicContact CB-CG 4.2Å
60	F	98.6	Very high	97.1	Very high	3 Å²	3	45.2 Å²	45.2	1%	0.013	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141	165.9	178.2	-83.8	0	0	0	109.2	F46 I47 A48 P67 R68 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.64Å; F46-F60 HydrophobicContact CD1-CD1 3.64Å; F46-F60 AromaticContact CD1-CE1 3.75Å; F46-F60 HydrophobicContact CD1-CE1 3.75Å; F46-F60 AromaticContact CE1-CD1 3.82Å; F46-F60 HydrophobicContact CE1-CD1 3.82Å; F46-F60 HydrophobicContact CE1-CE1 4.2Å; I47-F60 WeakPolarHBondContact CA-O 3.34Å; A48-F60 HydrophobicContact CB-CB 4.37Å; A48-F60 PolarHBondContact N-O 3Å; A48-F60 PolarHBondContact O-N 3.42Å; F60-P67 HydrophobicContact CE2-CB 3.91Å; F60-P67 HydrophobicContact CZ-CB 3.67Å; F60-R68 WeakPolarHBondContact CD2-O 3.35Å; F60-Y91 HydrophobicContact CB-CD1 4.22Å; F60-Y91 HydrophobicContact CB-CD2 3.64Å; F60-Y91 HydrophobicContact CB-CE2 4.04Å; F60-Y91 HydrophobicContact CB-CG 3.76Å; F60-Y91 HydrophobicContact CD1-CG 4.34Å; F60-Y91 AromaticContact CD2-CD2 3.69Å; F60-Y91 HydrophobicContact CD2-CD2 3.69Å; F60-Y91 AromaticContact CD2-CG 3.9Å; F60-Y91 HydrophobicContact CD2-CG 3.9Å; F60-Y91 AromaticContact CG-CD2 3.83Å; F60-Y91 HydrophobicContact CG-CD2 3.83Å; F60-Y91 AromaticContact CG-CG 3.74Å; F60-Y91 HydrophobicContact CG-CG 3.74Å; F60-K92 HydrophobicContact CE2-CG 4.35Å; F60-K92 HydrophobicContact CZ-CG 4.09Å
61	D	98.3	Very high	97	Very high	15 Å²	15	47.3 Å²	47.3	8%	0.08	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	121.5	176.4	-161.4	-27.5	0	0	0	109.3	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 3.54Å; R45-D61 IonicContact CZ-OD2 3.56Å; R45-D61 IonicContact NE-OD1 3.89Å; R45-D61 PolarHBondContact NE-OD1 3.07Å; R45-D61 IonicContact NE-OD2 3.99Å; R45-D61 IonicContact NH2-OD1 2.71Å; R45-D61 PolarHBondContact NH2-OD1 3.32Å; R45-D61 IonicContact NH2-OD2 2.77Å; R45-D61 PolarHBondContact NH2-OD2 2.98Å; R59-D61 IonicContact NH2-OD2 3.35Å; R59-D61 PolarHBondContact NH2-OD2 3.3Å; R59-D61 VanDerWaalsContact NH2-OD2 3.11Å; D61-D63 PolarHBondContact O-N 2.93Å; D61-D63 PolarHBondContact OD1-N 3.31Å; D61-A64 HydrophobicContact CB-CB 4.42Å; D61-A64 WeakPolarHBondContact O-CB 3.18Å; D61-A64 PolarHBondContact O-N 2.94Å
62	S	97.1	Very high	96.9	Very high	35 Å²	35	49 Å²	49	25%	0.245	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-24	-179.6	62.9	0	0	0	0	113.3	R45 F46 A64 P67	R45-S62 WeakPolarHBondContact CA-OG 3.42Å; F46-S62 PolarHBondContact N-OG 2.88Å; F46-S62 PolarHBondContact O-N 3.47Å; F46-S62 PolarHBondContact O-OG 3.4Å; S62-A64 VanDerWaalsContact C-N 3.34Å; S62-P67 WeakPolarHBondContact O-CG 3.45Å
63	D	95.6	Very high	96.8	Very high	103 Å²	103	51.1 Å²	51.1	55%	0.551	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-1.9	-176.5	-70.1	10.5	0	0	0	112.2	R45 D61	R45-D63 WeakPolarHBondContact CD-OD2 3.43Å; R45-D63 HydrophobicContact CG-CB 4.5Å; R45-D63 WeakPolarHBondContact CG-OD2 3.36Å; R45-D63 IonicContact NE-OD2 3.72Å; D61-D63 PolarHBondContact O-N 2.93Å; D61-D63 PolarHBondContact OD1-N 3.31Å
64	A	95.4	Very high	96.8	Very high	33 Å²	33	54.1 Å²	54.1	27%	0.273	30%	0.3	S	S	.	.	S	Bend	trans	-62.2	148.3	172.2	0	0	0	0	0	110.6	D61 S62 S66 P67	D61-A64 HydrophobicContact CB-CB 4.42Å; D61-A64 WeakPolarHBondContact O-CB 3.18Å; D61-A64 PolarHBondContact O-N 2.94Å; S62-A64 VanDerWaalsContact C-N 3.34Å; A64-S66 PolarHBondContact O-N 2.96Å; A64-S66 VanDerWaalsContact O-N 3.13Å; A64-P67 WeakPolarHBondContact O-CD 3.47Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.49Å
65	A	95.1	Very high	96.8	Very high	118 Å²	118	51.7 Å²	51.7	98%	0.975	29%	0.286	S	S	*	.	S	Bend	trans	-57.9	-30.9	179.5	0	0	0	0	0	113.1
66	S	95	Very high	96.8	Very high	82 Å²	82	51 Å²	51	57%	0.573	28%	0.282	S	S	*	.	S	Bend	trans	-134.2	89.8	171.4	-173.5	0	0	0	0	109.3	A64 R68	A64-S66 PolarHBondContact O-N 2.96Å; A64-S66 VanDerWaalsContact O-N 3.13Å; S66-R68 PolarHBondContact O-N 3.36Å; S66-R68 VanDerWaalsContact O-N 3.08Å
67	P	96.3	Very high	96.6	Very high	34 Å²	34	54.1 Å²	54.1	22%	0.221	30%	0.297	C	S	.	.			trans	-64.8	111.2	-175.1	-24.1	35.4	0	0	0	111.9	F60 S62 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.91Å; F60-P67 HydrophobicContact CZ-CB 3.67Å; S62-P67 WeakPolarHBondContact O-CG 3.45Å; A64-P67 WeakPolarHBondContact O-CD 3.47Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.49Å; P67-K92 WeakPolarHBondContact O-CE 3.23Å; P67-K92 PolarHBondContact O-NZ 2.92Å
68	R	97.4	Very high	96.4	Very high	151 Å²	151	60 Å²	60	57%	0.57	32%	0.324	S	S	*	.			trans	-145.7	159.7	177.3	63.5	-176.3	173	172.8	-0.2	110.9	F60 S66 E70 T88	F60-R68 WeakPolarHBondContact CD2-O 3.35Å; S66-R68 PolarHBondContact O-N 3.36Å; S66-R68 VanDerWaalsContact O-N 3.08Å; R68-E70 HydrophobicContact CG-CG 4.39Å; R68-E70 PolarHBondContact O-N 3.42Å; R68-T88 HydrophobicContact CB-CG2 4.21Å
69	G	97.1	Very high	96.3	Very high	6 Å²	6	60.5 Å²	60.5	6%	0.062	33%	0.326	C	S	.	.			trans	-65.1	127.3	168.6	0	0	0	0	0	109.3	T88	G69-T88 PolarHBondContact N-OG1 2.92Å
70	E	97.2	Very high	96.1	Very high	57 Å²	57	58.2 Å²	58.2	27%	0.266	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.5	-179.1	-65.2	177.7	164	0	0	109.6	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.32Å; R59-E70 PolarHBondContact N-O 2.87Å; R59-E70 PolarHBondContact O-N 3.49Å; R68-E70 HydrophobicContact CG-CG 4.39Å; R68-E70 PolarHBondContact O-N 3.42Å; E70-R72 IonicContact OE2-CZ 3.94Å; E70-R72 IonicContact OE2-NH2 3.44Å; E70-R72 PolarHBondContact OE2-NH2 2.9Å
71	P	97.6	Very high	95.9	Very high	44 Å²	44	62.7 Å²	62.7	29%	0.286	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	148.7	171.7	27.9	-32.9	0	0	0	110.4	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.87Å; P71-E77 HydrophobicContact CB-CG 3.53Å; P71-E77 HydrophobicContact CG-CG 3.71Å; P71-W84 HydrophobicContact CB-CH2 3.61Å; P71-W84 HydrophobicContact CB-CZ2 3.75Å; P71-W84 HydrophobicContact CG-CH2 4.23Å; P71-W84 HydrophobicContact CG-CZ2 4.19Å
72	R	96.9	Very high	95.9	Very high	104 Å²	104	69.8 Å²	69.8	39%	0.392	39%	0.391	S	S	.	.			trans	-122.5	-7.1	173	-61.4	-65.9	166.6	176	-5.9	112.9	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CG-CB 4.47Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 WeakPolarHBondContact O-CB 3.19Å; F57-R72 PolarHBondContact O-N 3.05Å; R59-R72 HydrophobicContact CB-CG 4.2Å; E70-R72 IonicContact OE2-CZ 3.94Å; E70-R72 IonicContact OE2-NH2 3.44Å; E70-R72 PolarHBondContact OE2-NH2 2.9Å
73	E	95.8	Very high	95.9	Very high	46 Å²	46	68.5 Å²	68.5	22%	0.215	38%	0.381	C	S	.	.	S	Bend	trans	-136.5	143.5	179.1	-72.6	-62.8	148.7	0	0	111.7	T55 Q56 F57 W75 V76 E77	T55-E73 VanDerWaalsContact CG2-CD 3.5Å; T55-E73 HydrophobicContact CG2-CG 3.6Å; T55-E73 WeakPolarHBondContact CG2-OE1 3.27Å; Q56-E73 WeakPolarHBondContact O-CG 3.5Å; F57-E73 HydrophobicContact CB-CB 4.41Å; F57-E73 HydrophobicContact CB-CG 4.28Å; E73-W75 VanDerWaalsContact C-N 3.29Å; E73-W75 HydrophobicContact CB-CD2 4.12Å; E73-W75 HydrophobicContact CB-CG 4.27Å; E73-W75 HydrophobicContact CB-CZ2 3.97Å; E73-W75 VanDerWaalsContact CB-NE1 3.3Å; E73-W75 HydrophobicContact CG-CZ2 4.01Å; E73-W75 PolarHBondContact O-N 2.93Å; E73-V76 HydrophobicContact CB-CG1 4.44Å; E73-V76 WeakPolarHBondContact O-CG1 3.35Å; E73-V76 PolarHBondContact O-N 3.37Å; E73-E77 PolarHBondContact O-N 3.37Å
74	P	95.4	Very high	96	Very high	91 Å²	91	65.3 Å²	65.3	59%	0.591	36%	0.361	S	S	*	.	H	α-helix	trans	-58.7	-36.3	-179.1	-25.5	34.6	0	0	0	114	V76 E77	P74-V76 PolarHBondContact O-N 3.37Å; P74-E77 WeakPolarHBondContact O-CB 3.41Å; P74-E77 PolarHBondContact O-N 3.35Å; P74-E77 VanDerWaalsContact O-N 3.11Å
75	W	95.5	Very high	96.1	Very high	13 Å²	13	68.9 Å²	68.9	5%	0.049	38%	0.376	C	S	.	.	H	α-helix	trans	-70.4	-14.3	-176.4	55.1	-103.2	0	0	0	114.1	V52 F57 E73 Q78 Y195 N198 T202 L203	V52-W75 HydrophobicContact CG2-CH2 4Å; F57-W75 HydrophobicContact CB-CH2 3.14Å; F57-W75 HydrophobicContact CB-CZ2 3.39Å; F57-W75 HydrophobicContact CB-CZ3 4.02Å; F57-W75 HydrophobicContact CD1-CH2 4.07Å; F57-W75 HydrophobicContact CD2-CH2 4.03Å; F57-W75 HydrophobicContact CD2-CZ3 4.31Å; F57-W75 AromaticContact CG-CH2 3.52Å; F57-W75 HydrophobicContact CG-CH2 3.52Å; F57-W75 HydrophobicContact CG-CZ2 4.23Å; F57-W75 HydrophobicContact CG-CZ3 4.25Å; E73-W75 VanDerWaalsContact C-N 3.29Å; E73-W75 HydrophobicContact CB-CD2 4.12Å; E73-W75 HydrophobicContact CB-CG 4.27Å; E73-W75 HydrophobicContact CB-CZ2 3.97Å; E73-W75 VanDerWaalsContact CB-NE1 3.3Å; E73-W75 HydrophobicContact CG-CZ2 4.01Å; E73-W75 PolarHBondContact O-N 2.93Å; W75-Q78 VanDerWaalsContact O-CG 3.3Å; W75-Q78 WeakPolarHBondContact O-CG 3.39Å; W75-Q78 PolarHBondContact O-NE2 3.3Å; W75-Y195 HydrophobicContact CE3-CD1 4.27Å; W75-Y195 HydrophobicContact CH2-CG 4.27Å; W75-Y195 AromaticContact CZ3-CD1 3.62Å; W75-Y195 HydrophobicContact CZ3-CD1 3.62Å; W75-Y195 HydrophobicContact CZ3-CD2 4.4Å; W75-Y195 HydrophobicContact CZ3-CE1 4.38Å; W75-Y195 AromaticContact CZ3-CG 3.64Å; W75-Y195 HydrophobicContact CZ3-CG 3.64Å; W75-N198 HydrophobicContact CB-CB 4.37Å; W75-T202 VanDerWaalsContact CD1-OG1 3.32Å; W75-L203 HydrophobicContact CD2-CD1 4.45Å; W75-L203 HydrophobicContact CH2-CD1 4.28Å; W75-L203 HydrophobicContact CZ2-CD1 3.88Å; W75-L203 HydrophobicContact CZ2-CD2 4.13Å; W75-L203 HydrophobicContact CZ2-CG 4.38Å
76	V	96.6	Very high	96.2	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-97.5	-20.1	170.6	71.7	0	0	0	0	112.2	F57 P71 E73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.33Å; F57-V76 HydrophobicContact CD2-CB 4.39Å; F57-V76 HydrophobicContact CD2-CG1 4.39Å; F57-V76 HydrophobicContact CD2-CG2 4.07Å; F57-V76 WeakPolarHBondContact O-CG1 3.36Å; P71-V76 HydrophobicContact CB-CG1 3.87Å; E73-V76 HydrophobicContact CB-CG1 4.44Å; E73-V76 WeakPolarHBondContact O-CG1 3.35Å; E73-V76 PolarHBondContact O-N 3.37Å; P74-V76 PolarHBondContact O-N 3.37Å; V76-Q78 PolarHBondContact O-N 2.72Å; V76-E79 HydrophobicContact CG2-CG 3.99Å; V76-E79 VanDerWaalsContact O-CB 3.29Å; V76-E79 WeakPolarHBondContact O-CB 3.47Å; V76-E79 WeakPolarHBondContact O-CG 3.32Å; V76-E79 PolarHBondContact O-N 3.17Å; V76-Y83 HydrophobicContact CG2-CE1 4.16Å; V76-W84 HydrophobicContact CG1-CH2 4.14Å; V76-W84 HydrophobicContact CG1-CZ2 4.34Å; V76-W84 HydrophobicContact CG2-CH2 3.97Å; V76-W84 HydrophobicContact CG2-CZ2 4.01Å; V76-W84 WeakPolarHBondContact O-CZ2 3.36Å; V76-Y195 HydrophobicContact CG2-CE1 4.31Å
77	E	94.1	Very high	96.3	Very high	118 Å²	118	65 Å²	65	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-60.1	-29.7	177.4	-69.1	-177.9	174.6	0	0	112.8	P71 E73 P74 E79	P71-E77 HydrophobicContact CB-CG 3.53Å; P71-E77 HydrophobicContact CG-CG 3.71Å; E73-E77 PolarHBondContact O-N 3.37Å; P74-E77 WeakPolarHBondContact O-CB 3.41Å; P74-E77 PolarHBondContact O-N 3.35Å; P74-E77 VanDerWaalsContact O-N 3.11Å; E77-E79 PolarHBondContact O-N 3.43Å
78	Q	93.1	Very high	96.4	Very high	122 Å²	122	63.9 Å²	63.9	57%	0.57	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.9	176	65.9	-179.3	10.4	0	0	114.2	W75 V76 N198	W75-Q78 VanDerWaalsContact O-CG 3.3Å; W75-Q78 WeakPolarHBondContact O-CG 3.39Å; W75-Q78 PolarHBondContact O-NE2 3.3Å; V76-Q78 PolarHBondContact O-N 2.72Å; Q78-N198 VanDerWaalsContact NE2-CB 3.3Å; Q78-N198 PolarHBondContact NE2-ND2 3.44Å; Q78-N198 VanDerWaalsContact NE2-ND2 3.12Å; Q78-N198 PolarHBondContact NE2-OD1 3.28Å
79	E	95.3	Very high	96.4	Very high	11 Å²	11	61.6 Å²	61.6	5%	0.051	31%	0.312	C	S	.	.	S	Bend	trans	-65	135.3	173.1	-66.5	-62	152.4	0	0	110.9	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CG 3.99Å; V76-E79 VanDerWaalsContact O-CB 3.29Å; V76-E79 WeakPolarHBondContact O-CB 3.47Å; V76-E79 WeakPolarHBondContact O-CG 3.32Å; V76-E79 PolarHBondContact O-N 3.17Å; E77-E79 PolarHBondContact O-N 3.43Å; E79-Y83 HydrophobicContact CB-CD1 3.49Å; E79-Y83 VanDerWaalsContact CB-CD1 3.49Å; E79-Y83 HydrophobicContact CB-CD2 4.49Å; E79-Y83 HydrophobicContact CB-CE1 4.08Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.05Å; E79-Y83 HydrophobicContact CG-CD2 4.48Å; E79-Y83 HydrophobicContact CG-CE1 4.24Å; E79-Y83 HydrophobicContact CG-CG 4.19Å; E79-W84 PolarHBondContact O-NE1 3.35Å; E79-R194 IonicContact OE1-CZ 3.26Å; E79-R194 VanDerWaalsContact OE1-CZ 3.26Å; E79-R194 IonicContact OE1-NE 3.86Å; E79-R194 PolarHBondContact OE1-NE 2.9Å; E79-R194 IonicContact OE1-NH2 2.98Å; E79-R194 PolarHBondContact OE1-NH2 3.46Å; E79-R194 IonicContact OE2-CZ 3.32Å; E79-R194 IonicContact OE2-NE 3.5Å; E79-R194 IonicContact OE2-NH2 2.69Å; E79-R194 PolarHBondContact OE2-NH2 3.41Å; E79-N198 PolarHBondContact OE1-ND2 3.03Å
80	G	94.2	Very high	96.4	Very high	36 Å²	36	64.7 Å²	64.7	37%	0.371	32%	0.324	S	S	.	.			trans	-67.7	167.8	-174.3	0	0	0	0	0	114.4	E82 Y83 W84	G80-E82 PolarHBondContact O-N 3.05Å; G80-E82 VanDerWaalsContact O-N 3.17Å; G80-Y83 WeakPolarHBondContact O-CB 3.42Å; G80-Y83 PolarHBondContact O-N 3.23Å; G80-W84 PolarHBondContact O-N 3.5Å
81	P	95.9	Very high	96.4	Very high	98 Å²	98	62.7 Å²	62.7	64%	0.636	31%	0.314	S	S	*	.	H	α-helix	trans	-57.3	-35	-177.8	22.5	-33.4	0	0	0	113.2	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.27Å; P81-Y83 PolarHBondContact O-N 3.19Å; P81-W84 PolarHBondContact O-N 3.16Å; P81-D85 WeakPolarHBondContact O-CB 3.41Å; P81-D85 PolarHBondContact O-N 3.06Å
82	E	96.9	Very high	96.5	Very high	164 Å²	164	64.7 Å²	64.7	77%	0.766	32%	0.318	S	S	*	.	H	α-helix	trans	-60.5	-34.9	177.4	-62.8	-177.3	178.1	0	0	113.1	G80 R86	G80-E82 PolarHBondContact O-N 3.05Å; G80-E82 VanDerWaalsContact O-N 3.17Å; E82-R86 WeakPolarHBondContact O-CB 3.04Å; E82-R86 PolarHBondContact O-N 3.47Å
83	Y	96.8	Very high	96.5	Very high	8 Å²	8	67.4 Å²	67.4	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-51.8	174.7	168	-92.1	0	0	0	110	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.16Å; E79-Y83 HydrophobicContact CB-CD1 3.49Å; E79-Y83 VanDerWaalsContact CB-CD1 3.49Å; E79-Y83 HydrophobicContact CB-CD2 4.49Å; E79-Y83 HydrophobicContact CB-CE1 4.08Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.05Å; E79-Y83 HydrophobicContact CG-CD2 4.48Å; E79-Y83 HydrophobicContact CG-CE1 4.24Å; E79-Y83 HydrophobicContact CG-CG 4.19Å; G80-Y83 WeakPolarHBondContact O-CB 3.42Å; G80-Y83 PolarHBondContact O-N 3.23Å; P81-Y83 VanDerWaalsContact C-N 3.27Å; P81-Y83 PolarHBondContact O-N 3.19Å; Y83-D85 PolarHBondContact O-N 2.94Å; Y83-R86 PolarHBondContact O-N 3.4Å; Y83-E87 HydrophobicContact CD1-CG 4.42Å; Y83-E87 HydrophobicContact CD2-CG 4.14Å; Y83-E87 HydrophobicContact CE1-CG 4.04Å; Y83-E87 HydrophobicContact CE2-CG 3.71Å; Y83-E87 HydrophobicContact CG-CG 4.45Å; Y83-E87 WeakPolarHBondContact O-CG 3.37Å; Y83-E87 PolarHBondContact O-N 2.86Å; Y83-W191 AromaticContact CD2-CH2 3.5Å; Y83-W191 HydrophobicContact CD2-CH2 3.5Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.5Å; Y83-W191 HydrophobicContact CD2-CZ2 4.2Å; Y83-W191 AromaticContact CD2-CZ3 3.77Å; Y83-W191 HydrophobicContact CD2-CZ3 3.77Å; Y83-W191 HydrophobicContact CE2-CE3 4.21Å; Y83-W191 AromaticContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CZ2 4.46Å; Y83-W191 AromaticContact CE2-CZ3 3.7Å; Y83-W191 HydrophobicContact CE2-CZ3 3.7Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.28Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.43Å; Y83-Y195 PolarHBondContact OH-OH 2.86Å
84	W	97.5	Very high	96.6	Very high	36 Å²	36	67 Å²	67	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-39.2	-177.8	-67.9	112.2	0	0	0	113	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG2-CZ3 4.01Å; P71-W84 HydrophobicContact CB-CH2 3.61Å; P71-W84 HydrophobicContact CB-CZ2 3.75Å; P71-W84 HydrophobicContact CG-CH2 4.23Å; P71-W84 HydrophobicContact CG-CZ2 4.19Å; V76-W84 HydrophobicContact CG1-CH2 4.14Å; V76-W84 HydrophobicContact CG1-CZ2 4.34Å; V76-W84 HydrophobicContact CG2-CH2 3.97Å; V76-W84 HydrophobicContact CG2-CZ2 4.01Å; V76-W84 WeakPolarHBondContact O-CZ2 3.36Å; E79-W84 PolarHBondContact O-NE1 3.35Å; G80-W84 PolarHBondContact O-N 3.5Å; P81-W84 PolarHBondContact O-N 3.16Å; W84-T88 WeakPolarHBondContact O-CB 3.4Å; W84-T88 PolarHBondContact O-N 2.88Å; W84-T88 PolarHBondContact O-OG1 2.84Å
85	D	97.7	Very high	96.7	Very high	107 Å²	107	63.8 Å²	63.8	57%	0.572	31%	0.307	S	S	*	.	H	α-helix	trans	-63.9	-46.7	174.4	-75.8	-21.8	0	0	0	110.8	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.41Å; P81-D85 PolarHBondContact O-N 3.06Å; Y83-D85 PolarHBondContact O-N 2.94Å; D85-T88 PolarHBondContact O-N 3.27Å; D85-Q89 VanDerWaalsContact O-CG 3.29Å; D85-Q89 WeakPolarHBondContact O-CG 2.94Å; D85-Q89 PolarHBondContact O-N 3.06Å
86	R	97.2	Very high	96.8	Very high	105 Å²	105	69 Å²	69	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-46.6	178.8	-175.9	-178.6	66.6	-146.7	-5.1	112.1	E82 Y83 Q89 K90	E82-R86 WeakPolarHBondContact O-CB 3.04Å; E82-R86 PolarHBondContact O-N 3.47Å; Y83-R86 PolarHBondContact O-N 3.4Å; R86-Q89 PolarHBondContact O-N 2.79Å; R86-K90 WeakPolarHBondContact O-CG 3.46Å; R86-K90 PolarHBondContact O-N 3.24Å
87	E	97.1	Very high	96.8	Very high	13 Å²	13	70.8 Å²	70.8	6%	0.061	35%	0.347	C	S	.	.	H	α-helix	trans	-66.2	-41.8	178.6	-65.1	-42.1	117.9	0	0	111.1	Y83 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.42Å; Y83-E87 HydrophobicContact CD2-CG 4.14Å; Y83-E87 HydrophobicContact CE1-CG 4.04Å; Y83-E87 HydrophobicContact CE2-CG 3.71Å; Y83-E87 HydrophobicContact CG-CG 4.45Å; Y83-E87 WeakPolarHBondContact O-CG 3.37Å; Y83-E87 PolarHBondContact O-N 2.86Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 3.11Å; E87-K90 WeakPolarHBondContact O-CB 3.11Å; E87-K90 PolarHBondContact O-N 2.68Å; E87-K90 VanDerWaalsContact O-N 3.08Å; E87-K90 IonicContact OE1-NZ 3.59Å; E87-K90 PolarHBondContact OE1-NZ 2.84Å; E87-K90 WeakPolarHBondContact OE2-CD 3.21Å; E87-K90 IonicContact OE2-NZ 3.03Å; E87-K90 PolarHBondContact OE2-NZ 3.29Å; E87-Y91 HydrophobicContact CB-CE2 4.13Å; E87-Y91 WeakPolarHBondContact O-CD2 3.34Å; E87-Y91 PolarHBondContact O-N 2.94Å
88	T	98.2	Very high	97	Very high	11 Å²	11	65.2 Å²	65.2	7%	0.067	32%	0.321	C	S	.	.	H	α-helix	trans	-56.5	-44.6	173.3	-64.6	0	0	0	0	111.9	R68 G69 W84 D85 K90 Y91 K92	R68-T88 HydrophobicContact CB-CG2 4.21Å; G69-T88 PolarHBondContact N-OG1 2.92Å; W84-T88 WeakPolarHBondContact O-CB 3.4Å; W84-T88 PolarHBondContact O-N 2.88Å; W84-T88 PolarHBondContact O-OG1 2.84Å; D85-T88 PolarHBondContact O-N 3.27Å; T88-K90 VanDerWaalsContact C-N 3.35Å; T88-Y91 PolarHBondContact O-N 2.79Å; T88-K92 HydrophobicContact CG2-CD 4.18Å; T88-K92 WeakPolarHBondContact O-CG 3.46Å; T88-K92 PolarHBondContact O-N 2.81Å
89	Q	98.1	Very high	97.1	Very high	103 Å²	103	62.5 Å²	62.5	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-68.4	-32.4	177.3	-68.7	-59.5	-23.7	0	0	112.8	D85 R86 E87 R93	D85-Q89 VanDerWaalsContact O-CG 3.29Å; D85-Q89 WeakPolarHBondContact O-CG 2.94Å; D85-Q89 PolarHBondContact O-N 3.06Å; R86-Q89 PolarHBondContact O-N 2.79Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 3.11Å; Q89-R93 WeakPolarHBondContact O-CB 3.22Å; Q89-R93 WeakPolarHBondContact O-CG 3.22Å; Q89-R93 PolarHBondContact O-N 3.33Å; Q89-R93 PolarHBondContact O-NE 3Å
90	K	97.3	Very high	97.2	Very high	71 Å²	71	65 Å²	65	31%	0.309	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-46.5	171.9	-73.4	170.2	178	173.7	0	111.1	R86 E87 T88 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.46Å; R86-K90 PolarHBondContact O-N 3.24Å; E87-K90 WeakPolarHBondContact O-CB 3.11Å; E87-K90 PolarHBondContact O-N 2.68Å; E87-K90 VanDerWaalsContact O-N 3.08Å; E87-K90 IonicContact OE1-NZ 3.59Å; E87-K90 PolarHBondContact OE1-NZ 2.84Å; E87-K90 WeakPolarHBondContact OE2-CD 3.21Å; E87-K90 IonicContact OE2-NZ 3.03Å; E87-K90 PolarHBondContact OE2-NZ 3.29Å; T88-K90 VanDerWaalsContact C-N 3.35Å; K90-K92 PolarHBondContact O-N 3.08Å; K90-R93 PolarHBondContact O-N 2.91Å; K90-Q94 PolarHBondContact O-N 3.32Å
91	Y	98.3	Very high	97.3	Very high	16 Å²	16	65.5 Å²	65.5	6%	0.063	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-45.3	176.8	-64.6	-51.3	0	0	0	112.2	F46 A48 V58 F60 E87 T88 R93 Q94 A95	F46-Y91 HydrophobicContact CE1-CD1 4.26Å; A48-Y91 HydrophobicContact CB-CD1 3.67Å; A48-Y91 HydrophobicContact CB-CE1 3.62Å; V58-Y91 WeakPolarHBondContact CG1-OH 3.41Å; V58-Y91 HydrophobicContact CG2-CE2 4.32Å; F60-Y91 HydrophobicContact CB-CD1 4.22Å; F60-Y91 HydrophobicContact CB-CD2 3.64Å; F60-Y91 HydrophobicContact CB-CE2 4.04Å; F60-Y91 HydrophobicContact CB-CG 3.76Å; F60-Y91 HydrophobicContact CD1-CG 4.34Å; F60-Y91 AromaticContact CD2-CD2 3.69Å; F60-Y91 HydrophobicContact CD2-CD2 3.69Å; F60-Y91 AromaticContact CD2-CG 3.9Å; F60-Y91 HydrophobicContact CD2-CG 3.9Å; F60-Y91 AromaticContact CG-CD2 3.83Å; F60-Y91 HydrophobicContact CG-CD2 3.83Å; F60-Y91 AromaticContact CG-CG 3.74Å; F60-Y91 HydrophobicContact CG-CG 3.74Å; E87-Y91 HydrophobicContact CB-CE2 4.13Å; E87-Y91 WeakPolarHBondContact O-CD2 3.34Å; E87-Y91 PolarHBondContact O-N 2.94Å; T88-Y91 PolarHBondContact O-N 2.79Å; Y91-R93 VanDerWaalsContact C-N 3.35Å; Y91-R93 PolarHBondContact O-N 2.92Å; Y91-Q94 PolarHBondContact O-N 3.45Å; Y91-A95 WeakPolarHBondContact O-CB 3.26Å; Y91-A95 PolarHBondContact O-N 2.74Å
92	K	98	Very high	97.4	Very high	85 Å²	85	61.1 Å²	61.1	37%	0.37	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-40.6	176.8	-72.9	178.2	178.4	176.6	0	112.7	F60 P67 T88 K90 Q96	F60-K92 HydrophobicContact CE2-CG 4.35Å; F60-K92 HydrophobicContact CZ-CG 4.09Å; P67-K92 WeakPolarHBondContact O-CE 3.23Å; P67-K92 PolarHBondContact O-NZ 2.92Å; T88-K92 HydrophobicContact CG2-CD 4.18Å; T88-K92 WeakPolarHBondContact O-CG 3.46Å; T88-K92 PolarHBondContact O-N 2.81Å; K90-K92 PolarHBondContact O-N 3.08Å; K92-Q96 WeakPolarHBondContact O-CG 3.41Å; K92-Q96 PolarHBondContact O-N 2.59Å
93	R	97.9	Very high	97.3	Very high	161 Å²	161	59.2 Å²	59.2	61%	0.608	27%	0.273	S	S	*	.	H	α-helix	trans	-66.3	-40.5	174.5	-76.2	-174.5	-69.1	172.4	-2.8	112.2	Q89 K90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.22Å; Q89-R93 WeakPolarHBondContact O-CG 3.22Å; Q89-R93 PolarHBondContact O-N 3.33Å; Q89-R93 PolarHBondContact O-NE 3Å; K90-R93 PolarHBondContact O-N 2.91Å; Y91-R93 VanDerWaalsContact C-N 3.35Å; Y91-R93 PolarHBondContact O-N 2.92Å; R93-Q96 PolarHBondContact O-N 3.34Å; R93-A97 PolarHBondContact O-N 2.92Å
94	Q	98	Very high	97.2	Very high	39 Å²	39	63.7 Å²	63.7	18%	0.182	29%	0.292	C	S	.	.	H	α-helix	trans	-65.4	-43.7	176.6	-171.3	64.3	57.2	0	0	111.4	F46 K90 Y91 Q96 A97 D98	F46-Q94 HydrophobicContact CE2-CB 4.11Å; F46-Q94 HydrophobicContact CE2-CG 3.65Å; F46-Q94 HydrophobicContact CZ-CB 3.92Å; F46-Q94 HydrophobicContact CZ-CG 3.8Å; K90-Q94 PolarHBondContact O-N 3.32Å; Y91-Q94 PolarHBondContact O-N 3.45Å; Q94-Q96 VanDerWaalsContact C-N 3.3Å; Q94-Q96 PolarHBondContact O-N 3.04Å; Q94-A97 WeakPolarHBondContact O-CB 3.41Å; Q94-A97 PolarHBondContact O-N 2.99Å; Q94-D98 PolarHBondContact NE2-OD1 3.37Å; Q94-D98 PolarHBondContact O-N 2.96Å
95	A	97.7	Very high	97.2	Very high	22 Å²	22	62.3 Å²	62.3	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-57.5	-42.4	175.9	0	0	0	0	0	112.3	F46 Y91 D98 R99	F46-A95 HydrophobicContact CB-CB 3.65Å; F46-A95 HydrophobicContact CD1-CB 3.85Å; F46-A95 HydrophobicContact CD2-CB 4.06Å; F46-A95 HydrophobicContact CG-CB 3.58Å; Y91-A95 WeakPolarHBondContact O-CB 3.26Å; Y91-A95 PolarHBondContact O-N 2.74Å; A95-D98 PolarHBondContact O-N 3.4Å; A95-R99 WeakPolarHBondContact O-CB 3.49Å; A95-R99 PolarHBondContact O-N 2.99Å
96	Q	97.1	Very high	97.2	Very high	122 Å²	122	60.1 Å²	60.1	57%	0.57	27%	0.272	S	S	*	.	H	α-helix	trans	-63.7	-42.3	174	-72.9	-86.2	-20.3	0	0	112.1	K92 R93 Q94 V100	K92-Q96 WeakPolarHBondContact O-CG 3.41Å; K92-Q96 PolarHBondContact O-N 2.59Å; R93-Q96 PolarHBondContact O-N 3.34Å; Q94-Q96 VanDerWaalsContact C-N 3.3Å; Q94-Q96 PolarHBondContact O-N 3.04Å; Q96-V100 PolarHBondContact O-N 2.79Å
97	A	97.1	Very high	97.1	Very high	39 Å²	39	57.2 Å²	57.2	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-44.5	176.8	0	0	0	0	0	111.7	R93 Q94 R99 V100 N101	R93-A97 PolarHBondContact O-N 2.92Å; Q94-A97 WeakPolarHBondContact O-CB 3.41Å; Q94-A97 PolarHBondContact O-N 2.99Å; A97-R99 VanDerWaalsContact C-N 3.35Å; A97-R99 PolarHBondContact O-N 3.05Å; A97-V100 PolarHBondContact O-N 2.97Å; A97-V100 VanDerWaalsContact O-N 3.1Å; A97-N101 WeakPolarHBondContact O-CB 3.42Å; A97-N101 PolarHBondContact O-N 2.97Å; A97-N101 PolarHBondContact O-ND2 3.24Å
98	D	97.5	Very high	97.1	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-67	-36.7	-178.7	-71.6	-6.1	0	0	0	111.7	S35 F46 Q94 A95 V100 N101 L102 L119	S35-D98 WeakPolarHBondContact OG-CB 3.38Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.3Å; Q94-D98 PolarHBondContact NE2-OD1 3.37Å; Q94-D98 PolarHBondContact O-N 2.96Å; A95-D98 PolarHBondContact O-N 3.4Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 3.45Å; D98-N101 PolarHBondContact O-N 2.82Å; D98-L102 WeakPolarHBondContact O-CB 3.45Å; D98-L102 WeakPolarHBondContact O-CG 3.4Å; D98-L102 PolarHBondContact O-N 3.11Å; D98-L119 HydrophobicContact CB-CD2 4.09Å
99	R	96.1	Very high	97.1	Very high	65 Å²	65	62 Å²	62	25%	0.245	29%	0.291	C	S	.	.	H	α-helix	trans	-55	-45.9	169	175.8	-168.8	-179.6	-168.7	1.8	112.2	E43 P44 A95 A97 R103	E43-R99 VanDerWaalsContact CD-NH2 3.27Å; E43-R99 IonicContact OE1-CZ 3.35Å; E43-R99 IonicContact OE1-NE 3.67Å; E43-R99 PolarHBondContact OE1-NE 2.79Å; E43-R99 IonicContact OE1-NH1 3.7Å; E43-R99 IonicContact OE1-NH2 3.11Å; E43-R99 PolarHBondContact OE1-NH2 3.35Å; E43-R99 WeakPolarHBondContact OE2-CD 3.18Å; E43-R99 IonicContact OE2-CZ 2.72Å; E43-R99 IonicContact OE2-NE 3.24Å; E43-R99 PolarHBondContact OE2-NE 2.03Å; E43-R99 IonicContact OE2-NH1 2.68Å; E43-R99 IonicContact OE2-NH2 3.75Å; E43-R99 PolarHBondContact OE2-NH2 2.96Å; P44-R99 HydrophobicContact CG-CB 4.39Å; P44-R99 HydrophobicContact CG-CG 4.29Å; A95-R99 WeakPolarHBondContact O-CB 3.49Å; A95-R99 PolarHBondContact O-N 2.99Å; A97-R99 VanDerWaalsContact C-N 3.35Å; A97-R99 PolarHBondContact O-N 3.05Å; R99-R103 VanDerWaalsContact CZ-NH2 3.27Å
100	V	96.4	Very high	97	Very high	62 Å²	62	64.4 Å²	64.4	38%	0.376	31%	0.307	S	S	.	.	H	α-helix	trans	-69.2	-39.5	177.7	174.2	0	0	0	0	110.9	Q96 A97 D98 R103 K104	Q96-V100 PolarHBondContact O-N 2.79Å; A97-V100 PolarHBondContact O-N 2.97Å; A97-V100 VanDerWaalsContact O-N 3.1Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 3.45Å; V100-R103 PolarHBondContact O-N 3.25Å; V100-K104 HydrophobicContact CG1-CD 4.3Å; V100-K104 WeakPolarHBondContact O-CG 3.3Å; V100-K104 PolarHBondContact O-N 2.83Å; V100-K104 VanDerWaalsContact O-N 3.15Å
101	N	97.2	Very high	96.9	Very high	48 Å²	48	63.8 Å²	63.8	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-66	-41.9	179.9	-68.6	-26.9	0	0	0	111.9	A97 D98 R103 K104 L105 L119	A97-N101 WeakPolarHBondContact O-CB 3.42Å; A97-N101 PolarHBondContact O-N 2.97Å; A97-N101 PolarHBondContact O-ND2 3.24Å; D98-N101 PolarHBondContact O-N 2.82Å; N101-R103 VanDerWaalsContact C-N 3.3Å; N101-R103 PolarHBondContact O-N 2.86Å; N101-K104 WeakPolarHBondContact O-CB 3.36Å; N101-K104 PolarHBondContact O-N 3.29Å; N101-K104 VanDerWaalsContact O-N 3.08Å; N101-L105 WeakPolarHBondContact O-CB 3.36Å; N101-L105 VanDerWaalsContact O-CG 3.27Å; N101-L105 WeakPolarHBondContact O-CG 3.39Å; N101-L105 PolarHBondContact O-N 3.49Å; N101-L119 HydrophobicContact CB-CD2 3.78Å
102	L	97.1	Very high	96.6	Very high	6 Å²	6	66.8 Å²	66.8	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-56	-43.3	175	-78.3	167.3	0	0	0	111.9	P44 D98 R106 H117 L119 Y142	P44-L102 HydrophobicContact CB-CD1 3.65Å; P44-L102 HydrophobicContact CG-CD1 3.8Å; D98-L102 WeakPolarHBondContact O-CB 3.45Å; D98-L102 WeakPolarHBondContact O-CG 3.4Å; D98-L102 PolarHBondContact O-N 3.11Å; L102-R106 WeakPolarHBondContact O-CB 3.44Å; L102-R106 PolarHBondContact O-N 3.31Å; L102-H117 HydrophobicContact CD2-CB 4.21Å; L102-L119 HydrophobicContact CD2-CB 3.67Å; L102-L119 HydrophobicContact CG-CB 4.09Å; L102-Y142 HydrophobicContact CD2-CE2 4.02Å
103	R	94.7	Very high	96.1	Very high	124 Å²	124	68.9 Å²	68.9	47%	0.468	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-40.6	175.3	-65.7	177.5	-170	154.6	-1.6	112.7	R99 V100 N101 G107	R99-R103 VanDerWaalsContact CZ-NH2 3.27Å; V100-R103 PolarHBondContact O-N 3.25Å; N101-R103 VanDerWaalsContact C-N 3.3Å; N101-R103 PolarHBondContact O-N 2.86Å; R103-G107 PolarHBondContact O-N 2.9Å
104	K	96.1	Very high	95.6	Very high	101 Å²	101	68.2 Å²	68.2	44%	0.439	35%	0.348	S	S	.	.	H	α-helix	trans	-66	-46.6	178	-73	174.6	179.5	169.8	0	111.3	V100 N101 G107 Y108	V100-K104 HydrophobicContact CG1-CD 4.3Å; V100-K104 WeakPolarHBondContact O-CG 3.3Å; V100-K104 PolarHBondContact O-N 2.83Å; V100-K104 VanDerWaalsContact O-N 3.15Å; N101-K104 WeakPolarHBondContact O-CB 3.36Å; N101-K104 PolarHBondContact O-N 3.29Å; N101-K104 VanDerWaalsContact O-N 3.08Å; K104-G107 CarbonylContact O-C 3.56Å; K104-G107 WeakPolarHBondContact O-CA 3.37Å; K104-G107 PolarHBondContact O-N 2.94Å; K104-G107 VanDerWaalsContact O-N 3.12Å; K104-Y108 WeakPolarHBondContact O-CD1 3.42Å; K104-Y108 PolarHBondContact O-N 2.89Å
105	L	97.5	Very high	95.2	Very high	7 Å²	7	67.2 Å²	67.2	4%	0.037	35%	0.348	C	S	.	.	H	α-helix	trans	-60.4	-48.3	179.3	-70.9	165.9	0	0	0	110.6	N101 G107 Y108 Y109 L119 Y142 Y147	N101-L105 WeakPolarHBondContact O-CB 3.36Å; N101-L105 VanDerWaalsContact O-CG 3.27Å; N101-L105 WeakPolarHBondContact O-CG 3.39Å; N101-L105 PolarHBondContact O-N 3.49Å; L105-G107 PolarHBondContact O-N 2.94Å; L105-Y108 PolarHBondContact O-N 3.45Å; L105-Y109 HydrophobicContact CD2-CE2 4.28Å; L105-Y109 VanDerWaalsContact O-CD2 3.23Å; L105-Y109 WeakPolarHBondContact O-CD2 3.37Å; L105-Y109 PolarHBondContact O-N 3.18Å; L105-L119 HydrophobicContact CD1-CD1 3.83Å; L105-L119 HydrophobicContact CD1-CD2 4.27Å; L105-Y142 HydrophobicContact CB-CD1 4.45Å; L105-Y142 HydrophobicContact CB-CD2 4.14Å; L105-Y142 HydrophobicContact CB-CE1 4.09Å; L105-Y142 HydrophobicContact CB-CE2 3.75Å; L105-Y142 HydrophobicContact CB-CG 4.45Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.91Å; L105-Y142 HydrophobicContact CD1-CG 4.1Å; L105-Y142 HydrophobicContact CG-CD2 4.39Å; L105-Y142 HydrophobicContact CG-CE2 4.43Å; L105-Y147 HydrophobicContact CD2-CD1 4.4Å; L105-Y147 HydrophobicContact CD2-CD2 4.05Å; L105-Y147 HydrophobicContact CD2-CE1 3.82Å; L105-Y147 HydrophobicContact CD2-CE2 3.39Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.49Å
106	R	95.8	Very high	95.1	Very high	62 Å²	62	69.3 Å²	69.3	23%	0.234	36%	0.362	C	S	.	.	H	α-helix	trans	-51.3	-43.7	172.8	-170.8	-172.7	67.4	177.3	9.3	112.3	L102 N110 Q111 E113	L102-R106 WeakPolarHBondContact O-CB 3.44Å; L102-R106 PolarHBondContact O-N 3.31Å; R106-N110 PolarHBondContact O-N 2.9Å; R106-N110 VanDerWaalsContact O-N 3.13Å; R106-Q111 HydrophobicContact CG-CB 3.75Å; R106-Q111 PolarHBondContact O-N 3.08Å; R106-E113 IonicContact CZ-OE1 3.92Å; R106-E113 IonicContact NH1-OE1 3.95Å; R106-E113 IonicContact NH2-OE1 2.85Å; R106-E113 PolarHBondContact NH2-OE1 2.99Å
107	G	95.9	Very high	95.1	Very high	43 Å²	43	64.1 Å²	64.1	44%	0.443	34%	0.338	S	S	.	.	H	α-helix	trans	-66	-43.8	175.3	0	0	0	0	0	113.7	R103 K104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 2.9Å; K104-G107 CarbonylContact O-C 3.56Å; K104-G107 WeakPolarHBondContact O-CA 3.37Å; K104-G107 PolarHBondContact O-N 2.94Å; K104-G107 VanDerWaalsContact O-N 3.12Å; L105-G107 PolarHBondContact O-N 2.94Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 3.42Å; G107-N110 PolarHBondContact O-N 3.27Å; G107-N110 PolarHBondContact O-OD1 3.31Å
108	Y	97.6	Very high	95.1	Very high	58 Å²	58	64.1 Å²	64.1	23%	0.227	33%	0.333	C	S	.	.	H	α-helix	trans	-62.6	-34.1	178.4	-64.2	-13.8	0	0	0	112.8	K104 L105 I166 K170	K104-Y108 WeakPolarHBondContact O-CD1 3.42Å; K104-Y108 PolarHBondContact O-N 2.89Å; L105-Y108 PolarHBondContact O-N 3.45Å; Y108-I166 HydrophobicContact CD1-CD1 4.17Å; Y108-I166 HydrophobicContact CD2-CD1 4.49Å; Y108-I166 HydrophobicContact CE1-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.11Å; Y108-I166 HydrophobicContact CE2-CB 4.24Å; Y108-I166 HydrophobicContact CE2-CG2 4.1Å; Y108-I166 HydrophobicContact CG-CD1 4.19Å; Y108-K170 PolarHBondContact OH-NZ 2.76Å
109	Y	97.4	Very high	95.2	Very high	68 Å²	68	64.2 Å²	64.2	27%	0.267	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	4	178.5	-69.5	-71.8	0	0	0	113.9	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.28Å; L105-Y109 VanDerWaalsContact O-CD2 3.23Å; L105-Y109 WeakPolarHBondContact O-CD2 3.37Å; L105-Y109 PolarHBondContact O-N 3.18Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 3.42Å; Y109-Q111 PolarHBondContact O-N 2.96Å; Y109-Y142 AromaticContact CD2-CD1 3.77Å; Y109-Y142 HydrophobicContact CD2-CD1 3.77Å; Y109-Y142 AromaticContact CD2-CE1 3.52Å; Y109-Y142 HydrophobicContact CD2-CE1 3.52Å; Y109-Y142 AromaticContact CE2-CD1 3.54Å; Y109-Y142 HydrophobicContact CE2-CD1 3.54Å; Y109-Y142 AromaticContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CG-CE1 4.42Å; Y109-Y147 HydrophobicContact CE2-CD2 4.37Å; Y109-Y147 HydrophobicContact CE2-CE2 4.08Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.41Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.48Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.04Å; Y109-D161 VanDerWaalsContact OH-CG 3.25Å; Y109-D161 PolarHBondContact OH-OD1 2.84Å; Y109-D161 PolarHBondContact OH-OD2 3.18Å; Y109-A163 HydrophobicContact CD1-CB 4.13Å; Y109-A163 HydrophobicContact CD2-CB 4.42Å; Y109-A163 HydrophobicContact CE1-CB 3.58Å; Y109-A163 HydrophobicContact CE2-CB 3.9Å; Y109-A163 VanDerWaalsContact CZ-CB 3.45Å
110	N	96.3	Very high	95.3	Very high	153 Å²	153	64.8 Å²	64.8	82%	0.818	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	40.1	-177	-57	-53.2	0	0	0	113.3	R106 G107	R106-N110 PolarHBondContact O-N 2.9Å; R106-N110 VanDerWaalsContact O-N 3.13Å; G107-N110 PolarHBondContact O-N 3.27Å; G107-N110 PolarHBondContact O-OD1 3.31Å
111	Q	95.8	Very high	95.4	Very high	58 Å²	58	62.4 Å²	62.4	27%	0.271	32%	0.324	S	S	.	.			trans	-85.8	151.2	-177.3	-70.2	168.8	-34.5	0	0	111.7	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.75Å; R106-Q111 PolarHBondContact O-N 3.08Å; Y109-Q111 PolarHBondContact O-N 2.96Å; Q111-H117 PolarHBondContact NE2-CE1 3.03Å; Q111-H117 PolarHBondContact OE1-CE1 2.71Å; Q111-H117 PolarHBondContact OE1-ND1 2.97Å; Q111-Y142 PolarHBondContact OE1-OH 3.04Å; Q111-D143 PolarHBondContact NE2-OD2 3.4Å
112	S	92.4	Very high	95.5	Very high	79 Å²	79	61.1 Å²	61.1	55%	0.552	32%	0.317	S	S	*	.			trans	-66.6	152.6	179.3	58.2	0	0	0	0	112.9	D114 G115	S112-D114 VanDerWaalsContact C-N 3.28Å; S112-D114 PolarHBondContact O-N 3.46Å; S112-G115 PolarHBondContact O-N 3.43Å
113	E	86.6	Confident	95.6	Very high	129 Å²	129	62.3 Å²	62.3	60%	0.603	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-24.7	178.5	-57.7	-150.8	125.5	0	0	114.2	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.28Å; P39-E113 WeakPolarHBondContact CG-O 3.49Å; R106-E113 IonicContact CZ-OE1 3.92Å; R106-E113 IonicContact NH1-OE1 3.95Å; R106-E113 IonicContact NH2-OE1 2.85Å; R106-E113 PolarHBondContact NH2-OE1 2.99Å; E113-G115 VanDerWaalsContact C-N 3.26Å; E113-G115 PolarHBondContact O-N 3.38Å
114	D	86.8	Confident	95.7	Very high	146 Å²	146	56.4 Å²	56.4	78%	0.781	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-3.8	-178	-56.9	-41.3	0	0	0	113.3	S112	S112-D114 VanDerWaalsContact C-N 3.28Å; S112-D114 PolarHBondContact O-N 3.46Å
115	G	89.9	Confident	95.8	Very high	18 Å²	18	51.6 Å²	51.6	19%	0.186	28%	0.278	C	S	.	.			trans	-77.7	133.8	178.1	0	0	0	0	0	113	P39 S112 E113 H117	P39-G115 WeakPolarHBondContact CG-O 3.39Å; S112-G115 PolarHBondContact O-N 3.43Å; E113-G115 VanDerWaalsContact C-N 3.26Å; E113-G115 PolarHBondContact O-N 3.38Å; G115-H117 PolarHBondContact O-CD2 2.94Å; G115-H117 VanDerWaalsContact O-CD2 3.28Å
116	S	95.1	Very high	95.9	Very high	66 Å²	66	52.5 Å²	52.5	46%	0.462	28%	0.283	S	S	.	.			trans	-80.4	134.4	164.2	-177.4	0	0	0	0	109.3	S37	S37-S116 WeakPolarHBondContact O-CA 3.21Å; S37-S116 WeakPolarHBondContact O-CB 3.44Å; S37-S116 PolarHBondContact O-OG 3.27Å
117	H	97.3	Very high	95.9	Very high	14 Å²	14	49.8 Å²	49.8	7%	0.065	27%	0.273	C	S	.	.			trans	-132.7	150.6	-177	-64.1	-70.5	0	0	0	110.6	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 CarbonylContact C-O 3.55Å; V36-H117 WeakPolarHBondContact CA-O 3.32Å; S37-H117 PolarHBondContact N-O 3.11Å; S37-H117 PolarHBondContact OG-N 2.88Å; S37-H117 PolarHBondContact OG-O 3.32Å; L102-H117 HydrophobicContact CD2-CB 4.21Å; Q111-H117 PolarHBondContact NE2-CE1 3.03Å; Q111-H117 PolarHBondContact OE1-CE1 2.71Å; Q111-H117 PolarHBondContact OE1-ND1 2.97Å; G115-H117 PolarHBondContact O-CD2 2.94Å; G115-H117 VanDerWaalsContact O-CD2 3.28Å; H117-Y142 HydrophobicContact CB-CE2 3.84Å; H117-Y142 WeakPolarHBondContact CB-OH 3.46Å; H117-Y142 AromaticContact CG-CZ 3.97Å; H117-Y142 AromaticContact ND1-CZ 3.89Å; H117-Y142 PolarHBondContact ND1-OH 2.63Å; H117-D143 WeakPolarHBondContact CA-OD1 3.49Å; H117-D143 WeakPolarHBondContact CB-OD1 3.23Å; H117-D143 IonicContact CE1-OD2 2.89Å; H117-D143 IonicContact CG-OD1 3.72Å; H117-D143 IonicContact CG-OD2 3.49Å; H117-D143 IonicContact ND1-OD1 2.76Å; H117-D143 IonicContact ND1-OD2 3.27Å; H117-D143 PolarHBondContact ND1-OD2 2.83Å
118	T	98.4	Very high	95.8	Very high	38 Å²	38	47.9 Å²	47.9	23%	0.233	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.6	-176.4	-57.8	0	0	0	0	110.3	T34 S35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 3.84Å; S35-T118 CarbonylContact O-C 3.59Å; S35-T118 WeakPolarHBondContact O-CA 3.25Å; V36-T118 HydrophobicContact CG2-CG2 4.28Å; T118-Q120 HydrophobicContact CG2-CG 3.96Å; T118-Y142 CarbonylContact O-C 3.52Å; T118-Y142 WeakPolarHBondContact O-CA 3.18Å; T118-Y142 VanDerWaalsContact O-CD2 3.31Å; T118-Y142 WeakPolarHBondContact O-CD2 3.33Å; T118-D143 PolarHBondContact N-OD1 3.38Å; T118-D143 PolarHBondContact O-N 2.97Å
119	L	98.7	Very high	95.4	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.2	170.4	176.6	61.8	0	0	0	108.7	T34 S35 D98 N101 L102 L105 F140	T34-L119 CarbonylContact C-O 3.53Å; T34-L119 WeakPolarHBondContact CA-O 3.11Å; S35-L119 PolarHBondContact N-O 2.84Å; S35-L119 PolarHBondContact O-N 3.38Å; D98-L119 HydrophobicContact CB-CD2 4.09Å; N101-L119 HydrophobicContact CB-CD2 3.78Å; L102-L119 HydrophobicContact CD2-CB 3.67Å; L102-L119 HydrophobicContact CG-CB 4.09Å; L105-L119 HydrophobicContact CD1-CD1 3.83Å; L105-L119 HydrophobicContact CD1-CD2 4.27Å; L119-F140 HydrophobicContact CD1-CD1 4.23Å
120	Q	98.8	Very high	94.9	Very high	76 Å²	76	51.1 Å²	51.1	36%	0.355	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	146.8	177.6	-68	170.2	-76.8	0	0	110.1	S33 T34 T118 F140 A141	S33-Q120 CarbonylContact O-C 3.48Å; S33-Q120 VanDerWaalsContact O-CA 3.31Å; S33-Q120 WeakPolarHBondContact O-CA 3.49Å; T34-Q120 HydrophobicContact CG2-CG 3.98Å; T118-Q120 HydrophobicContact CG2-CG 3.96Å; Q120-F140 CarbonylContact O-C 3.55Å; Q120-F140 VanDerWaalsContact O-CA 3.23Å; Q120-F140 WeakPolarHBondContact O-CA 3.32Å; Q120-A141 HydrophobicContact CB-CB 4.32Å; Q120-A141 PolarHBondContact N-O 3.46Å; Q120-A141 PolarHBondContact O-N 3.11Å
121	R	98.6	Very high	94.6	Very high	12 Å²	12	44.7 Å²	44.7	5%	0.045	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.8	173.3	-173.5	-171.9	-178.5	-139.4	-16.8	109.7	F32 S33 F123 N138 Q139 F140	F32-R121 CarbonylContact C-O 3.57Å; F32-R121 WeakPolarHBondContact CA-O 3.47Å; S33-R121 PolarHBondContact N-O 3.16Å; S33-R121 PolarHBondContact O-N 2.88Å; R121-F123 HydrophobicContact CG-CD1 4.3Å; R121-N138 PolarHBondContact NE-OD1 2.85Å; R121-N138 PolarHBondContact NH2-OD1 2.94Å; R121-Q139 WeakPolarHBondContact CA-O 3.36Å; R121-F140 HydrophobicContact CB-CD1 3.83Å; R121-F140 HydrophobicContact CB-CE1 3.81Å; R121-F140 HydrophobicContact CB-CG 4.46Å; R121-F140 HydrophobicContact CB-CZ 4.39Å; R121-F140 VanDerWaalsContact CD-CE1 3.4Å; R121-F140 HydrophobicContact CG-CD1 3.84Å; R121-F140 HydrophobicContact CG-CD2 4.29Å; R121-F140 HydrophobicContact CG-CE1 3.52Å; R121-F140 HydrophobicContact CG-CE2 3.96Å; R121-F140 HydrophobicContact CG-CG 4.23Å; R121-F140 HydrophobicContact CG-CZ 3.59Å
122	M	98.7	Very high	94.5	Very high	22 Å²	22	50.1 Å²	50.1	11%	0.108	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.7	166.1	-176.3	-79.6	-78.6	0	0	108.9	Y31 F32 Y137 N138 Q139	Y31-M122 WeakPolarHBondContact O-CA 3.37Å; F32-M122 HydrophobicContact CD1-CB 3.93Å; F32-M122 HydrophobicContact CD1-CG 3.66Å; F32-M122 HydrophobicContact CE1-CB 4.06Å; F32-M122 HydrophobicContact CE1-CG 3.37Å; F32-M122 HydrophobicContact CG-CG 4.48Å; F32-M122 HydrophobicContact CZ-CG 3.98Å; M122-Y137 HydrophobicContact CE-CD1 4.1Å; M122-Y137 HydrophobicContact CE-CG 4.14Å; M122-Y137 HydrophobicContact SD-CG 4.42Å; M122-N138 WeakPolarHBondContact O-CA 3.26Å; M122-Q139 HydrophobicContact CB-CG 4.09Å; M122-Q139 VanDerWaalsContact CE-CD 3.48Å; M122-Q139 HydrophobicContact CE-CG 4.02Å; M122-Q139 PolarHBondContact N-O 2.7Å; M122-Q139 PolarHBondContact O-N 2.76Å
123	F	98.6	Very high	94.7	Very high	31 Å²	31	48.8 Å²	48.8	14%	0.136	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	154.4	171.8	69.9	-83.5	0	0	0	110.9	Y31 R121 Y137 N138 Y183	Y31-F123 VanDerWaalsContact CB-CE1 3.49Å; Y31-F123 VanDerWaalsContact CB-CZ 3.48Å; Y31-F123 HydrophobicContact CD2-CD2 4.39Å; Y31-F123 AromaticContact CD2-CE2 3.7Å; Y31-F123 HydrophobicContact CD2-CE2 3.7Å; Y31-F123 AromaticContact CD2-CZ 3.86Å; Y31-F123 HydrophobicContact CD2-CZ 3.86Å; Y31-F123 HydrophobicContact CE2-CE2 4.45Å; Y31-F123 HydrophobicContact CG-CE1 4.27Å; Y31-F123 HydrophobicContact CG-CE2 4.08Å; Y31-F123 AromaticContact CG-CZ 3.75Å; Y31-F123 HydrophobicContact CG-CZ 3.75Å; Y31-F123 PolarHBondContact N-O 3.28Å; Y31-F123 PolarHBondContact O-N 3.03Å; R121-F123 HydrophobicContact CG-CD1 4.3Å; F123-Y137 WeakPolarHBondContact CA-O 3.41Å; F123-Y137 VanDerWaalsContact CB-O 3.31Å; F123-Y137 WeakPolarHBondContact CB-O 3.23Å; F123-N138 HydrophobicContact CB-CB 4.2Å; F123-Y183 AromaticContact CD2-CE1 3.86Å; F123-Y183 HydrophobicContact CD2-CE1 3.86Å; F123-Y183 AromaticContact CE2-CE1 3.83Å; F123-Y183 HydrophobicContact CE2-CE1 3.83Å
124	G	98.4	Very high	95.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.2	-177.1	-175.3	0	0	0	0	0	113.7	M29 Y137 L184	M29-G124 CarbonylContact O-C 3.58Å; M29-G124 WeakPolarHBondContact O-CA 3.33Å; G124-Y137 PolarHBondContact N-O 2.92Å; G124-Y137 VanDerWaalsContact N-O 3.09Å; G124-Y137 PolarHBondContact O-N 3.36Å; G124-L184 WeakPolarHBondContact O-CD2 3.35Å
125	C	98.4	Very high	95.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	149.2	-178.2	52.5	0	0	0	0	111.1	S28 M29 L133 R135 C188	S28-C125 WeakPolarHBondContact CA-O 3.29Å; M29-C125 PolarHBondContact N-O 2.93Å; M29-C125 PolarHBondContact O-N 3.38Å; C125-L133 HydrophobicContact CB-CD1 3.54Å; C125-R135 CarbonylContact C-O 3.59Å; C125-R135 WeakPolarHBondContact CA-O 3.45Å; C125-C188 HydrophobicContact CB-CB 3.91Å; C125-C188 WeakPolarHBondContact CB-SG 3.49Å; C125-C188 PolarHBondContact N-SG 3.47Å; C125-C188 WeakPolarHBondContact SG-CB 3.37Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.98Å
126	D	97.8	Very high	95.9	Very high	26 Å²	26	45 Å²	45	14%	0.139	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.3	172.1	-58.3	-11.7	0	0	0	108.8	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.51Å; H27-D126 WeakPolarHBondContact O-CA 3.36Å; S28-D126 WeakPolarHBondContact CB-OD1 3.43Å; R30-D126 IonicContact CZ-OD1 3.72Å; R30-D126 IonicContact NE-OD1 2.58Å; R30-D126 PolarHBondContact NE-OD1 3.19Å; R30-D126 VanDerWaalsContact NE-OD1 3.13Å; R30-D126 VanDerWaalsContact NH2-CG 3.25Å; R30-D126 IonicContact NH2-OD1 3.44Å; R30-D126 PolarHBondContact NH2-OD1 2.95Å; R30-D126 IonicContact NH2-OD2 2.76Å; R30-D126 PolarHBondContact NH2-OD2 2.96Å; D126-L134 HydrophobicContact CB-CB 4.45Å; D126-L134 PolarHBondContact O-N 3.33Å; D126-R135 HydrophobicContact CB-CB 4.46Å; D126-R135 PolarHBondContact N-O 3.41Å; D126-R135 PolarHBondContact O-N 3.21Å; D126-Y137 WeakPolarHBondContact OD1-CE2 3.32Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.32Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.28Å; D126-Y137 PolarHBondContact OD2-OH 3.4Å
127	L	96.6	Very high	96.1	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.5	174.2	-55.6	-176.4	0	0	0	110.1	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.26Å; S26-L127 WeakPolarHBondContact CA-O 3.37Å; S26-L127 WeakPolarHBondContact CB-O 3.45Å; H27-L127 PolarHBondContact N-O 2.61Å; H27-L127 PolarHBondContact O-N 3.35Å; L127-R132 CarbonylContact C-O 3.42Å; L127-R132 VanDerWaalsContact CA-O 3.24Å; L127-R132 WeakPolarHBondContact CA-O 3.26Å; L127-V189 HydrophobicContact CD1-CG1 4.38Å; L127-V189 HydrophobicContact CD2-CB 4.18Å; L127-V189 HydrophobicContact CD2-CG1 3.77Å; L127-V189 HydrophobicContact CD2-CG2 3.86Å; L127-L192 HydrophobicContact CB-CD2 4.46Å; L127-L192 HydrophobicContact CD1-CB 4.19Å; L127-L192 HydrophobicContact CD1-CD2 3.65Å; L127-L192 HydrophobicContact CD1-CG 3.72Å; L127-L192 HydrophobicContact CG-CD2 3.57Å; L127-L192 HydrophobicContact CG-CG 4.22Å; L127-R193 HydrophobicContact CD1-CG 3.95Å
128	G	93.2	Very high	96.1	Very high	4 Å²	4	42.9 Å²	42.9	4%	0.041	21%	0.214	C	C	.	.			trans	-80.6	178.3	170.7	0	0	0	0	0	111.7	D130 G131 R132 L134	G128-D130 PolarHBondContact O-N 3.38Å; G128-D130 VanDerWaalsContact O-N 3.14Å; G128-G131 WeakPolarHBondContact O-CA 3.47Å; G128-G131 PolarHBondContact O-N 2.82Å; G128-R132 PolarHBondContact N-O 3.45Å; G128-L134 VanDerWaalsContact N-CG 3.34Å
129	P	89	Confident	96.1	Very high	98 Å²	98	44.5 Å²	44.5	64%	0.636	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.9	178.1	-24.5	35	0	0	0	114.1	A24 G25 G131	A24-P129 WeakPolarHBondContact O-CG 3.35Å; G25-P129 VanDerWaalsContact O-CA 3.3Å; G25-P129 WeakPolarHBondContact O-CA 3.47Å; P129-G131 PolarHBondContact O-N 3.22Å
130	D	88.8	Confident	96.1	Very high	95 Å²	95	45 Å²	45	51%	0.508	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	3.2	174.2	71.2	-14.2	0	0	0	113.3	G128 R132	G128-D130 PolarHBondContact O-N 3.38Å; G128-D130 VanDerWaalsContact O-N 3.14Å; D130-R132 PolarHBondContact O-N 3.47Å; D130-R132 WeakPolarHBondContact OD1-CB 3.5Å; D130-R132 PolarHBondContact OD1-N 3.25Å; D130-R132 WeakPolarHBondContact OD2-CD 2.98Å; D130-R132 VanDerWaalsContact OD2-CG 3.31Å; D130-R132 WeakPolarHBondContact OD2-CG 3.19Å; D130-R132 IonicContact OD2-CZ 3.94Å; D130-R132 IonicContact OD2-NE 3.61Å; D130-R132 IonicContact OD2-NH1 2.98Å
131	G	88.7	Confident	96.1	Very high	19 Å²	19	42.2 Å²	42.2	20%	0.196	21%	0.211	C	C	.	.	S	Bend	trans	71.3	9.8	-178	0	0	0	0	0	114.1	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.47Å; G128-G131 PolarHBondContact O-N 2.82Å; P129-G131 PolarHBondContact O-N 3.22Å; G131-R193 VanDerWaalsContact O-CZ 3.29Å; G131-R193 PolarHBondContact O-NE 3.2Å; G131-R193 PolarHBondContact O-NH2 3.15Å
132	R	93.5	Very high	96.1	Very high	171 Å²	171	42.1 Å²	42.1	65%	0.645	21%	0.21	S	C	*	.			trans	-88.1	153.7	178.2	-62.3	-173.6	-176	160.4	-3.2	111.4	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.42Å; L127-R132 VanDerWaalsContact CA-O 3.24Å; L127-R132 WeakPolarHBondContact CA-O 3.26Å; G128-R132 PolarHBondContact N-O 3.45Å; D130-R132 PolarHBondContact O-N 3.47Å; D130-R132 WeakPolarHBondContact OD1-CB 3.5Å; D130-R132 PolarHBondContact OD1-N 3.25Å; D130-R132 WeakPolarHBondContact OD2-CD 2.98Å; D130-R132 VanDerWaalsContact OD2-CG 3.31Å; D130-R132 WeakPolarHBondContact OD2-CG 3.19Å; D130-R132 IonicContact OD2-CZ 3.94Å; D130-R132 IonicContact OD2-NE 3.61Å; D130-R132 IonicContact OD2-NH1 2.98Å; R132-L134 PolarHBondContact O-N 3.06Å; R132-L134 VanDerWaalsContact O-N 3.17Å
133	L	96.2	Very high	96.1	Very high	51 Å²	51	44 Å²	44	27%	0.267	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	118.9	175.3	-176.8	73.5	0	0	0	110	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.54Å; L133-R135 WeakPolarHBondContact CD1-O 3.42Å; L133-L154 HydrophobicContact CD2-CD1 4.32Å; L133-E185 HydrophobicContact CD2-CB 4.4Å; L133-E185 HydrophobicContact CD2-CG 3.69Å; L133-V189 HydrophobicContact CB-CG2 4.06Å; L133-V189 HydrophobicContact CD1-CG2 4.12Å
134	L	95.8	Very high	96	Very high	117 Å²	117	45.3 Å²	45.3	61%	0.613	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	-46.1	167.9	-70.5	177.5	0	0	0	110.7	D126 G128 R132	D126-L134 HydrophobicContact CB-CB 4.45Å; D126-L134 PolarHBondContact O-N 3.33Å; G128-L134 VanDerWaalsContact N-CG 3.34Å; R132-L134 PolarHBondContact O-N 3.06Å; R132-L134 VanDerWaalsContact O-N 3.17Å
135	R	96.2	Very high	96	Very high	95 Å²	95	53 Å²	53	36%	0.358	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	142.7	-174.2	-171	162.3	168.5	148.8	9.6	112	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.59Å; C125-R135 WeakPolarHBondContact CA-O 3.45Å; D126-R135 HydrophobicContact CB-CB 4.46Å; D126-R135 PolarHBondContact N-O 3.41Å; D126-R135 PolarHBondContact O-N 3.21Å; L133-R135 WeakPolarHBondContact CD1-O 3.42Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-CZ 3.48Å; R135-Y137 WeakPolarHBondContact CD-OH 3.42Å; R135-Y137 HydrophobicContact CG-CD2 4.47Å; R135-Y137 HydrophobicContact CG-CE1 4.03Å; R135-Y137 HydrophobicContact CG-CE2 3.76Å; R135-Y137 PolarHBondContact NE-OH 3.01Å; R135-E152 VanDerWaalsContact CZ-CD 3.5Å; R135-E152 IonicContact CZ-OE1 3.84Å; R135-E152 VanDerWaalsContact NH1-CD 3.31Å; R135-E152 IonicContact NH1-OE1 3.33Å; R135-E152 PolarHBondContact NH1-OE1 3.34Å; R135-E152 IonicContact NH1-OE2 3.89Å; R135-E152 VanDerWaalsContact NH2-CG 3.33Å; R135-E152 IonicContact NH2-OE1 3.54Å; R135-E152 PolarHBondContact NH2-OE1 2.86Å
136	G	97.8	Very high	96	Very high	3 Å²	3	58.8 Å²	58.8	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	150	171.7	0	0	0	0	0	111.3
137	Y	98.1	Very high	96.1	Very high	33 Å²	33	58 Å²	58	13%	0.129	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.4	-177.9	-53.6	-96.8	0	0	0	110.8	R30 M122 F123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CZ 3.27Å; R30-Y137 PolarHBondContact NH2-OH 2.83Å; M122-Y137 HydrophobicContact CE-CD1 4.1Å; M122-Y137 HydrophobicContact CE-CG 4.14Å; M122-Y137 HydrophobicContact SD-CG 4.42Å; F123-Y137 WeakPolarHBondContact CA-O 3.41Å; F123-Y137 VanDerWaalsContact CB-O 3.31Å; F123-Y137 WeakPolarHBondContact CB-O 3.23Å; G124-Y137 PolarHBondContact N-O 2.92Å; G124-Y137 VanDerWaalsContact N-O 3.09Å; G124-Y137 PolarHBondContact O-N 3.36Å; D126-Y137 WeakPolarHBondContact OD1-CE2 3.32Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.32Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.28Å; D126-Y137 PolarHBondContact OD2-OH 3.4Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-CZ 3.48Å; R135-Y137 WeakPolarHBondContact CD-OH 3.42Å; R135-Y137 HydrophobicContact CG-CD2 4.47Å; R135-Y137 HydrophobicContact CG-CE1 4.03Å; R135-Y137 HydrophobicContact CG-CE2 3.76Å; R135-Y137 PolarHBondContact NE-OH 3.01Å
138	N	98.4	Very high	96.2	Very high	2 Å²	2	58 Å²	58	1%	0.011	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	103.4	163.7	-173.8	29.1	0	0	0	109	R121 M122 F123 L150 W157 R180	R121-N138 PolarHBondContact NE-OD1 2.85Å; R121-N138 PolarHBondContact NH2-OD1 2.94Å; M122-N138 WeakPolarHBondContact O-CA 3.26Å; F123-N138 HydrophobicContact CB-CB 4.2Å; N138-L150 HydrophobicContact CB-CB 4.09Å; N138-L150 HydrophobicContact CB-CD2 4.25Å; N138-L150 WeakPolarHBondContact O-CB 3.2Å; N138-L150 PolarHBondContact O-N 3.02Å; N138-W157 WeakPolarHBondContact ND2-CH2 3.39Å; N138-R180 VanDerWaalsContact ND2-CD 3.33Å; N138-R180 WeakPolarHBondContact ND2-CD 3.24Å; N138-R180 WeakPolarHBondContact ND2-CG 3.19Å
139	Q	98.6	Very high	96.4	Very high	71 Å²	71	59.4 Å²	59.4	33%	0.332	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.6	-174.2	64.1	-165.8	56.4	0	0	111.4	R121 M122 I148 A149	R121-Q139 WeakPolarHBondContact CA-O 3.36Å; M122-Q139 HydrophobicContact CB-CG 4.09Å; M122-Q139 VanDerWaalsContact CE-CD 3.48Å; M122-Q139 HydrophobicContact CE-CG 4.02Å; M122-Q139 PolarHBondContact N-O 2.7Å; M122-Q139 PolarHBondContact O-N 2.76Å; Q139-I148 WeakPolarHBondContact CA-O 3.35Å; Q139-A149 HydrophobicContact CB-CB 3.87Å
140	F	98.8	Very high	96.9	Very high	15 Å²	15	55.4 Å²	55.4	7%	0.066	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.6	-179.1	-65.9	-104.7	0	0	0	110	L119 Q120 R121 Y147 I148 W171	L119-F140 HydrophobicContact CD1-CD1 4.23Å; Q120-F140 CarbonylContact O-C 3.55Å; Q120-F140 VanDerWaalsContact O-CA 3.23Å; Q120-F140 WeakPolarHBondContact O-CA 3.32Å; R121-F140 HydrophobicContact CB-CD1 3.83Å; R121-F140 HydrophobicContact CB-CE1 3.81Å; R121-F140 HydrophobicContact CB-CG 4.46Å; R121-F140 HydrophobicContact CB-CZ 4.39Å; R121-F140 VanDerWaalsContact CD-CE1 3.4Å; R121-F140 HydrophobicContact CG-CD1 3.84Å; R121-F140 HydrophobicContact CG-CD2 4.29Å; R121-F140 HydrophobicContact CG-CE1 3.52Å; R121-F140 HydrophobicContact CG-CE2 3.96Å; R121-F140 HydrophobicContact CG-CG 4.23Å; R121-F140 HydrophobicContact CG-CZ 3.59Å; F140-Y147 HydrophobicContact CB-CD1 4.44Å; F140-Y147 WeakPolarHBondContact O-CB 3.38Å; F140-Y147 PolarHBondContact O-N 3.19Å; F140-I148 HydrophobicContact CB-CG2 4.21Å; F140-I148 HydrophobicContact CD2-CG2 4.1Å; F140-I148 HydrophobicContact CG-CG2 4.46Å; F140-I148 PolarHBondContact N-O 3.22Å; F140-I148 PolarHBondContact O-N 3.39Å; F140-W171 AromaticContact CD2-CH2 3.83Å; F140-W171 HydrophobicContact CD2-CH2 3.83Å; F140-W171 HydrophobicContact CD2-CZ3 4.26Å; F140-W171 AromaticContact CE2-CH2 3.44Å; F140-W171 HydrophobicContact CE2-CH2 3.44Å; F140-W171 VanDerWaalsContact CE2-CH2 3.44Å; F140-W171 HydrophobicContact CE2-CZ2 4.48Å; F140-W171 HydrophobicContact CE2-CZ3 4.01Å; F140-W171 AromaticContact CZ-CH2 3.84Å; F140-W171 HydrophobicContact CZ-CH2 3.84Å
141	A	98.8	Very high	97.3	Very high	17 Å²	17	53.2 Å²	53.2	14%	0.14	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	145.1	171.6	0	0	0	0	0	110	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.32Å; Q120-A141 PolarHBondContact N-O 3.46Å; Q120-A141 PolarHBondContact O-N 3.11Å; A141-K145 CarbonylContact C-O 3.57Å; A141-K145 WeakPolarHBondContact CA-O 3.44Å; A141-K145 VanDerWaalsContact CB-O 3.25Å; A141-K145 WeakPolarHBondContact CB-O 3.31Å
142	Y	98.7	Very high	97.7	Very high	10 Å²	10	58.6 Å²	58.6	4%	0.039	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	127.9	177.1	-175.8	-117.1	0	0	0	109.7	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4.02Å; L105-Y142 HydrophobicContact CB-CD1 4.45Å; L105-Y142 HydrophobicContact CB-CD2 4.14Å; L105-Y142 HydrophobicContact CB-CE1 4.09Å; L105-Y142 HydrophobicContact CB-CE2 3.75Å; L105-Y142 HydrophobicContact CB-CG 4.45Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.91Å; L105-Y142 HydrophobicContact CD1-CG 4.1Å; L105-Y142 HydrophobicContact CG-CD2 4.39Å; L105-Y142 HydrophobicContact CG-CE2 4.43Å; Y109-Y142 AromaticContact CD2-CD1 3.77Å; Y109-Y142 HydrophobicContact CD2-CD1 3.77Å; Y109-Y142 AromaticContact CD2-CE1 3.52Å; Y109-Y142 HydrophobicContact CD2-CE1 3.52Å; Y109-Y142 AromaticContact CE2-CD1 3.54Å; Y109-Y142 HydrophobicContact CE2-CD1 3.54Å; Y109-Y142 AromaticContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CG-CE1 4.42Å; Q111-Y142 PolarHBondContact OE1-OH 3.04Å; H117-Y142 HydrophobicContact CB-CE2 3.84Å; H117-Y142 WeakPolarHBondContact CB-OH 3.46Å; H117-Y142 AromaticContact CG-CZ 3.97Å; H117-Y142 AromaticContact ND1-CZ 3.89Å; H117-Y142 PolarHBondContact ND1-OH 2.63Å; T118-Y142 CarbonylContact O-C 3.52Å; T118-Y142 WeakPolarHBondContact O-CA 3.18Å; T118-Y142 VanDerWaalsContact O-CD2 3.31Å; T118-Y142 WeakPolarHBondContact O-CD2 3.33Å; Y142-G144 PolarHBondContact O-N 3.1Å; Y142-K145 PolarHBondContact N-O 2.6Å; Y142-K145 PolarHBondContact O-N 3.5Å
143	D	97.9	Very high	97.7	Very high	61 Å²	61	53.8 Å²	53.8	33%	0.326	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	41	-174.9	-65	-22.2	0	0	0	113.1	Q111 H117 T118 K145	Q111-D143 PolarHBondContact NE2-OD2 3.4Å; H117-D143 WeakPolarHBondContact CA-OD1 3.49Å; H117-D143 WeakPolarHBondContact CB-OD1 3.23Å; H117-D143 IonicContact CE1-OD2 2.89Å; H117-D143 IonicContact CG-OD1 3.72Å; H117-D143 IonicContact CG-OD2 3.49Å; H117-D143 IonicContact ND1-OD1 2.76Å; H117-D143 IonicContact ND1-OD2 3.27Å; H117-D143 PolarHBondContact ND1-OD2 2.83Å; T118-D143 PolarHBondContact N-OD1 3.38Å; T118-D143 PolarHBondContact O-N 2.97Å; D143-K145 VanDerWaalsContact C-N 3.3Å; D143-K145 PolarHBondContact O-N 3.46Å
144	G	97.2	Very high	97.7	Very high	59 Å²	59	51.7 Å²	51.7	61%	0.608	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	6.1	178	0	0	0	0	0	115.4	Y142	Y142-G144 PolarHBondContact O-N 3.1Å
145	K	98.4	Very high	97.7	Very high	161 Å²	161	52.9 Å²	52.9	70%	0.7	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	145	177.4	-61.6	-180	-176.8	177.5	0	110.8	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.57Å; A141-K145 WeakPolarHBondContact CA-O 3.44Å; A141-K145 VanDerWaalsContact CB-O 3.25Å; A141-K145 WeakPolarHBondContact CB-O 3.31Å; Y142-K145 PolarHBondContact N-O 2.6Å; Y142-K145 PolarHBondContact O-N 3.5Å; D143-K145 VanDerWaalsContact C-N 3.3Å; D143-K145 PolarHBondContact O-N 3.46Å; K145-Y147 PolarHBondContact O-N 3.28Å
146	D	98.6	Very high	97.7	Very high	123 Å²	123	54 Å²	54	66%	0.658	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.6	135	173.5	-69.1	-34.7	0	0	0	110.7	A160	D146-A160 HydrophobicContact CB-CB 4.4Å; D146-A160 WeakPolarHBondContact O-CB 3.32Å
147	Y	98.8	Very high	97.7	Very high	10 Å²	10	54.3 Å²	54.3	4%	0.039	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-62.5	179.6	179.4	-107.9	0	0	0	110.5	L105 Y109 F140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.4Å; L105-Y147 HydrophobicContact CD2-CD2 4.05Å; L105-Y147 HydrophobicContact CD2-CE1 3.82Å; L105-Y147 HydrophobicContact CD2-CE2 3.39Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.49Å; Y109-Y147 HydrophobicContact CE2-CD2 4.37Å; Y109-Y147 HydrophobicContact CE2-CE2 4.08Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.41Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.48Å; F140-Y147 HydrophobicContact CB-CD1 4.44Å; F140-Y147 WeakPolarHBondContact O-CB 3.38Å; F140-Y147 PolarHBondContact O-N 3.19Å; K145-Y147 PolarHBondContact O-N 3.28Å; Y147-A160 WeakPolarHBondContact O-CB 3.35Å; Y147-A160 PolarHBondContact O-N 2.79Å; Y147-A163 HydrophobicContact CE2-CB 4.5Å; Y147-A163 PolarHBondContact OH-O 3.13Å; Y147-A164 HydrophobicContact CD2-CB 3.86Å; Y147-A164 HydrophobicContact CE1-CB 4.43Å; Y147-A164 HydrophobicContact CE2-CB 3.7Å; Y147-A164 HydrophobicContact CG-CB 4.29Å; Y147-A164 WeakPolarHBondContact O-CB 3.3Å; Y147-T167 HydrophobicContact CE1-CG2 4.2Å; Y147-T167 PolarHBondContact OH-OG1 2.93Å
148	I	98.7	Very high	97.7	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.015	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	139.2	178.8	-161.1	173.9	0	0	0	110.6	Q139 F140 W157 T158 T167 Q168 W171	Q139-I148 WeakPolarHBondContact CA-O 3.35Å; F140-I148 HydrophobicContact CB-CG2 4.21Å; F140-I148 HydrophobicContact CD2-CG2 4.1Å; F140-I148 HydrophobicContact CG-CG2 4.46Å; F140-I148 PolarHBondContact N-O 3.22Å; F140-I148 PolarHBondContact O-N 3.39Å; I148-W157 HydrophobicContact CD1-CB 4.02Å; I148-W157 HydrophobicContact CD1-CD2 4.42Å; I148-W157 HydrophobicContact CD1-CE3 4.26Å; I148-W157 HydrophobicContact CD1-CG 4.35Å; I148-W157 HydrophobicContact CG1-CB 4.15Å; I148-W157 HydrophobicContact CG1-CE3 4.07Å; I148-T158 WeakPolarHBondContact CA-O 3.17Å; I148-T158 WeakPolarHBondContact CG1-O 3.42Å; I148-T167 HydrophobicContact CD1-CG2 4.06Å; I148-Q168 HydrophobicContact CD1-CB 3.92Å; I148-W171 HydrophobicContact CD1-CE3 4.1Å; I148-W171 HydrophobicContact CD1-CZ3 4.3Å; I148-W171 HydrophobicContact CG2-CE3 4.48Å; I148-W171 HydrophobicContact CG2-CH2 4.04Å; I148-W171 HydrophobicContact CG2-CZ3 3.67Å
149	A	98.7	Very high	97.8	Very high	33 Å²	33	57.5 Å²	57.5	27%	0.273	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.2	179.8	0	0	0	0	0	111.6	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.87Å; A149-W157 CarbonylContact O-C 3.52Å; A149-W157 WeakPolarHBondContact O-CA 3.5Å; A149-T158 PolarHBondContact N-O 2.88Å; A149-T158 PolarHBondContact O-N 2.62Å
150	L	98.6	Very high	97.7	Very high	14 Å²	14	57 Å²	57	7%	0.073	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.7	169.3	-174.3	67.8	0	0	0	108.7	N138 L154 W157 A177 R180 L184	N138-L150 HydrophobicContact CB-CB 4.09Å; N138-L150 HydrophobicContact CB-CD2 4.25Å; N138-L150 WeakPolarHBondContact O-CB 3.2Å; N138-L150 PolarHBondContact O-N 3.02Å; L150-L154 HydrophobicContact CD2-CB 4.33Å; L150-L154 HydrophobicContact CD2-CD2 3.74Å; L150-L154 HydrophobicContact CG-CD2 4.27Å; L150-W157 HydrophobicContact CB-CE3 3.95Å; L150-W157 HydrophobicContact CB-CH2 4.09Å; L150-W157 HydrophobicContact CB-CZ3 3.68Å; L150-W157 HydrophobicContact CD1-CD2 4.05Å; L150-W157 HydrophobicContact CD1-CE3 4.31Å; L150-W157 HydrophobicContact CD1-CH2 4.22Å; L150-W157 HydrophobicContact CD1-CZ2 3.93Å; L150-W157 HydrophobicContact CD1-CZ3 4.37Å; L150-A177 HydrophobicContact CD1-CB 3.99Å; L150-R180 HydrophobicContact CD2-CB 4.1Å; L150-L184 HydrophobicContact CD2-CD1 4.04Å
151	N	97.8	Very high	97.7	Very high	49 Å²	49	58.9 Å²	58.9	26%	0.262	32%	0.32	S	S	.	.			trans	-68.7	162.8	-179.1	-68.6	-1.4	0	0	0	111.5	D153 L154 F156 T158	N151-D153 PolarHBondContact O-N 3.02Å; N151-D153 VanDerWaalsContact O-N 3.14Å; N151-L154 WeakPolarHBondContact O-CA 3.36Å; N151-L154 PolarHBondContact O-N 3.36Å; N151-F156 WeakPolarHBondContact CB-O 3.44Å; N151-F156 PolarHBondContact N-O 3.3Å; N151-T158 WeakPolarHBondContact OD1-CB 3.12Å; N151-T158 PolarHBondContact OD1-N 2.89Å; N151-T158 PolarHBondContact OD1-OG1 2.93Å
152	E	95.4	Very high	97.7	Very high	133 Å²	133	63.3 Å²	63.3	62%	0.621	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-28.5	-179.3	-65.1	-178.2	-176.5	0	0	113.4	R135 L154	R135-E152 VanDerWaalsContact CZ-CD 3.5Å; R135-E152 IonicContact CZ-OE1 3.84Å; R135-E152 VanDerWaalsContact NH1-CD 3.31Å; R135-E152 IonicContact NH1-OE1 3.33Å; R135-E152 PolarHBondContact NH1-OE1 3.34Å; R135-E152 IonicContact NH1-OE2 3.89Å; R135-E152 VanDerWaalsContact NH2-CG 3.33Å; R135-E152 IonicContact NH2-OE1 3.54Å; R135-E152 PolarHBondContact NH2-OE1 2.86Å; E152-L154 PolarHBondContact O-N 2.86Å
153	D	94.3	Very high	97.6	Very high	70 Å²	70	63 Å²	63	37%	0.374	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.2	176.4	73.2	-4	0	0	0	114.4	N151 R155 F156	N151-D153 PolarHBondContact O-N 3.02Å; N151-D153 VanDerWaalsContact O-N 3.14Å; D153-R155 WeakPolarHBondContact O-CG 3.48Å; D153-R155 PolarHBondContact O-N 3.29Å; D153-R155 PolarHBondContact OD1-N 3Å; D153-F156 PolarHBondContact OD1-N 3.37Å; D153-F156 WeakPolarHBondContact OD2-CD2 3.49Å
154	L	96.7	Very high	97.7	Very high	7 Å²	7	60.1 Å²	60.1	4%	0.037	33%	0.33	C	S	.	.	S	Bend	trans	57.4	23.3	-179.3	-51.4	-179.8	0	0	0	114.3	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.32Å; L150-L154 HydrophobicContact CD2-CB 4.33Å; L150-L154 HydrophobicContact CD2-CD2 3.74Å; L150-L154 HydrophobicContact CG-CD2 4.27Å; N151-L154 WeakPolarHBondContact O-CA 3.36Å; N151-L154 PolarHBondContact O-N 3.36Å; E152-L154 PolarHBondContact O-N 2.86Å; L154-R181 HydrophobicContact CB-CB 4.05Å; L154-R181 HydrophobicContact CB-CG 3.87Å; L154-R181 HydrophobicContact CD1-CG 4.12Å; L154-L184 HydrophobicContact CD1-CB 4.42Å; L154-L184 HydrophobicContact CD2-CD1 3.94Å; L154-E185 HydrophobicContact CD1-CG 4.24Å
155	R	95.6	Very high	97.7	Very high	142 Å²	142	60.9 Å²	60.9	54%	0.536	32%	0.317	S	S	.	.	S	Bend	trans	-119.2	-37.8	-175.7	-70.4	166.7	-170.5	-95.2	9.5	112.9	D153 A177 R181	D153-R155 WeakPolarHBondContact O-CG 3.48Å; D153-R155 PolarHBondContact O-N 3.29Å; D153-R155 PolarHBondContact OD1-N 3Å; R155-A177 VanDerWaalsContact O-CB 3.3Å; R155-A177 WeakPolarHBondContact O-CB 3.49Å; R155-R181 VanDerWaalsContact CZ-NH1 3.32Å; R155-R181 VanDerWaalsContact NH2-NH1 3.12Å
156	F	96.2	Very high	97.7	Very high	119 Å²	119	56 Å²	56	52%	0.522	30%	0.299	S	S	.	.			trans	-113.4	160.4	-176.5	-58.6	-73.6	0	0	0	112.2	N151 D153	N151-F156 WeakPolarHBondContact CB-O 3.44Å; N151-F156 PolarHBondContact N-O 3.3Å; D153-F156 PolarHBondContact OD1-N 3.37Å; D153-F156 WeakPolarHBondContact OD2-CD2 3.49Å
157	W	98.3	Very high	97.7	Very high	8 Å²	8	51 Å²	51	3%	0.03	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140.8	176.5	-62.3	91.8	0	0	0	110.1	N138 I148 A149 L150 Q168 W171 E176 R180	N138-W157 WeakPolarHBondContact ND2-CH2 3.39Å; I148-W157 HydrophobicContact CD1-CB 4.02Å; I148-W157 HydrophobicContact CD1-CD2 4.42Å; I148-W157 HydrophobicContact CD1-CE3 4.26Å; I148-W157 HydrophobicContact CD1-CG 4.35Å; I148-W157 HydrophobicContact CG1-CB 4.15Å; I148-W157 HydrophobicContact CG1-CE3 4.07Å; A149-W157 CarbonylContact O-C 3.52Å; A149-W157 WeakPolarHBondContact O-CA 3.5Å; L150-W157 HydrophobicContact CB-CE3 3.95Å; L150-W157 HydrophobicContact CB-CH2 4.09Å; L150-W157 HydrophobicContact CB-CZ3 3.68Å; L150-W157 HydrophobicContact CD1-CD2 4.05Å; L150-W157 HydrophobicContact CD1-CE3 4.31Å; L150-W157 HydrophobicContact CD1-CH2 4.22Å; L150-W157 HydrophobicContact CD1-CZ2 3.93Å; L150-W157 HydrophobicContact CD1-CZ3 4.37Å; W157-Q168 HydrophobicContact CB-CG 4.23Å; W157-Q168 PolarHBondContact O-NE2 3Å; W157-W171 AromaticContact CD2-CE3 3.8Å; W157-W171 HydrophobicContact CD2-CE3 3.8Å; W157-W171 HydrophobicContact CD2-CZ3 4.27Å; W157-W171 AromaticContact CE2-CE3 3.63Å; W157-W171 AromaticContact CE3-CE3 3.8Å; W157-W171 HydrophobicContact CE3-CE3 3.8Å; W157-W171 AromaticContact CE3-CZ3 3.79Å; W157-W171 HydrophobicContact CE3-CZ3 3.79Å; W157-W171 AromaticContact CH2-CE3 3.47Å; W157-W171 HydrophobicContact CH2-CE3 3.47Å; W157-W171 VanDerWaalsContact CH2-CE3 3.47Å; W157-W171 HydrophobicContact CH2-CH2 4.42Å; W157-W171 AromaticContact CH2-CZ3 3.36Å; W157-W171 HydrophobicContact CH2-CZ3 3.36Å; W157-W171 HydrophobicContact CZ2-CD2 4.4Å; W157-W171 AromaticContact CZ2-CE3 3.48Å; W157-W171 HydrophobicContact CZ2-CE3 3.48Å; W157-W171 VanDerWaalsContact CZ2-CE3 3.48Å; W157-W171 AromaticContact CZ2-CZ3 3.9Å; W157-W171 HydrophobicContact CZ2-CZ3 3.9Å; W157-W171 AromaticContact CZ3-CE3 3.67Å; W157-W171 HydrophobicContact CZ3-CE3 3.67Å; W157-W171 HydrophobicContact CZ3-CH2 4.49Å; W157-W171 AromaticContact CZ3-CZ3 3.32Å; W157-W171 HydrophobicContact CZ3-CZ3 3.32Å; W157-E176 HydrophobicContact CZ2-CB 4.34Å; W157-R180 HydrophobicContact CH2-CG 4.46Å; W157-R180 HydrophobicContact CZ2-CG 4.48Å
158	T	98.5	Very high	97.7	Very high	79 Å²	79	52.4 Å²	52.4	49%	0.485	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	117.5	167.3	-64.5	0	0	0	0	108.7	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.17Å; I148-T158 WeakPolarHBondContact CG1-O 3.42Å; A149-T158 PolarHBondContact N-O 2.88Å; A149-T158 PolarHBondContact O-N 2.62Å; N151-T158 WeakPolarHBondContact OD1-CB 3.12Å; N151-T158 PolarHBondContact OD1-N 2.89Å; N151-T158 PolarHBondContact OD1-OG1 2.93Å
159	A	98.6	Very high	97.7	Very high	23 Å²	23	59.8 Å²	59.8	19%	0.19	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133.6	175.3	0	0	0	0	0	110.4	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.7Å; A159-Q165 HydrophobicContact CB-CG 3.99Å; A159-Q168 HydrophobicContact CB-CB 4.37Å
160	A	98.4	Very high	97.6	Very high	61 Å²	61	63.5 Å²	63.5	50%	0.504	32%	0.317	S	S	.	.	S	Bend	trans	-75.8	-31.2	-178.1	0	0	0	0	0	113.3	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.4Å; D146-A160 WeakPolarHBondContact O-CB 3.32Å; Y147-A160 WeakPolarHBondContact O-CB 3.35Å; Y147-A160 PolarHBondContact O-N 2.79Å
161	D	98.2	Very high	97.6	Very high	54 Å²	54	65.4 Å²	65.4	29%	0.289	32%	0.323	S	S	.	.	S	Bend	trans	-150.3	-175.9	-178.2	67.6	28.1	0	0	0	113.2	Y109 A163 A164 Q165	Y109-D161 WeakPolarHBondContact CE1-OD2 3.04Å; Y109-D161 VanDerWaalsContact OH-CG 3.25Å; Y109-D161 PolarHBondContact OH-OD1 2.84Å; Y109-D161 PolarHBondContact OH-OD2 3.18Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.96Å; D161-A163 WeakPolarHBondContact OD1-CA 3.15Å; D161-A163 WeakPolarHBondContact OD1-CB 3.21Å; D161-A163 PolarHBondContact OD1-N 3.09Å; D161-A164 PolarHBondContact O-N 3.2Å; D161-A164 PolarHBondContact OD1-N 3.42Å; D161-Q165 WeakPolarHBondContact O-CG 3.45Å; D161-Q165 PolarHBondContact O-N 3.22Å
162	T	98	Very high	97.6	Very high	110 Å²	110	67.1 Å²	67.1	68%	0.675	33%	0.33	S	S	*	.	H	α-helix	trans	-65	-28.8	-179.3	50.9	0	0	0	0	113.9
163	A	97.9	Very high	97.7	Very high	4 Å²	4	65 Å²	65	3%	0.033	34%	0.335	C	S	.	.	H	α-helix	trans	-73	-42.9	175.4	0	0	0	0	0	110.1	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.13Å; Y109-A163 HydrophobicContact CD2-CB 4.42Å; Y109-A163 HydrophobicContact CE1-CB 3.58Å; Y109-A163 HydrophobicContact CE2-CB 3.9Å; Y109-A163 VanDerWaalsContact CZ-CB 3.45Å; Y147-A163 HydrophobicContact CE2-CB 4.5Å; Y147-A163 PolarHBondContact OH-O 3.13Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.96Å; D161-A163 WeakPolarHBondContact OD1-CA 3.15Å; D161-A163 WeakPolarHBondContact OD1-CB 3.21Å; D161-A163 PolarHBondContact OD1-N 3.09Å; A163-Q165 VanDerWaalsContact C-N 3.28Å; A163-Q165 PolarHBondContact O-N 2.88Å; A163-I166 VanDerWaalsContact O-CB 3.26Å; A163-I166 WeakPolarHBondContact O-CB 3.37Å; A163-I166 PolarHBondContact O-N 3.2Å
164	A	98.4	Very high	97.9	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-33.8	174	0	0	0	0	0	113.2	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.86Å; Y147-A164 HydrophobicContact CE1-CB 4.43Å; Y147-A164 HydrophobicContact CE2-CB 3.7Å; Y147-A164 HydrophobicContact CG-CB 4.29Å; Y147-A164 WeakPolarHBondContact O-CB 3.3Å; A159-A164 HydrophobicContact CB-CB 3.7Å; D161-A164 PolarHBondContact O-N 3.2Å; D161-A164 PolarHBondContact OD1-N 3.42Å; A164-I166 PolarHBondContact O-N 3.2Å; A164-T167 WeakPolarHBondContact O-CA 3.45Å; A164-T167 WeakPolarHBondContact O-CB 3.45Å; A164-T167 PolarHBondContact O-N 3.36Å; A164-Q168 PolarHBondContact O-N 2.99Å
165	Q	98.6	Very high	97.9	Very high	75 Å²	75	71.5 Å²	71.5	35%	0.35	37%	0.365	S	S	.	.	H	α-helix	trans	-59.4	-28.7	173.2	-72.9	175.6	9.2	0	0	112.9	A159 D161 A163 Q168 R169	A159-Q165 HydrophobicContact CB-CG 3.99Å; D161-Q165 WeakPolarHBondContact O-CG 3.45Å; D161-Q165 PolarHBondContact O-N 3.22Å; A163-Q165 VanDerWaalsContact C-N 3.28Å; A163-Q165 PolarHBondContact O-N 2.88Å; Q165-Q168 PolarHBondContact O-N 3.02Å; Q165-R169 WeakPolarHBondContact O-CG 3.3Å; Q165-R169 PolarHBondContact O-N 3.12Å; Q165-R169 VanDerWaalsContact O-N 3.1Å
166	I	98.2	Very high	98	Very high	60 Å²	60	66.9 Å²	66.9	31%	0.308	35%	0.349	S	S	.	.	H	α-helix	trans	-66.3	-43.4	174.3	-56.4	171.1	0	0	0	109.9	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.17Å; Y108-I166 HydrophobicContact CD2-CD1 4.49Å; Y108-I166 HydrophobicContact CE1-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.11Å; Y108-I166 HydrophobicContact CE2-CB 4.24Å; Y108-I166 HydrophobicContact CE2-CG2 4.1Å; Y108-I166 HydrophobicContact CG-CD1 4.19Å; A163-I166 VanDerWaalsContact O-CB 3.26Å; A163-I166 WeakPolarHBondContact O-CB 3.37Å; A163-I166 PolarHBondContact O-N 3.2Å; A164-I166 PolarHBondContact O-N 3.2Å; I166-K170 WeakPolarHBondContact O-CG 3.37Å; I166-K170 PolarHBondContact O-N 2.85Å
167	T	98.2	Very high	98.1	Very high	16 Å²	16	61.7 Å²	61.7	10%	0.098	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-44.9	174.9	-69.7	0	0	0	0	111.2	Y147 I148 A164 R169 K170 W171	Y147-T167 HydrophobicContact CE1-CG2 4.2Å; Y147-T167 PolarHBondContact OH-OG1 2.93Å; I148-T167 HydrophobicContact CD1-CG2 4.06Å; A164-T167 WeakPolarHBondContact O-CA 3.45Å; A164-T167 WeakPolarHBondContact O-CB 3.45Å; A164-T167 PolarHBondContact O-N 3.36Å; T167-R169 PolarHBondContact O-N 2.83Å; T167-K170 WeakPolarHBondContact O-CB 3.34Å; T167-K170 PolarHBondContact O-N 2.83Å; T167-K170 VanDerWaalsContact O-N 3.12Å; T167-W171 HydrophobicContact CG2-CD2 3.67Å; T167-W171 HydrophobicContact CG2-CE3 4.06Å; T167-W171 HydrophobicContact CG2-CG 4.1Å; T167-W171 HydrophobicContact CG2-CH2 4.19Å; T167-W171 HydrophobicContact CG2-CZ2 3.84Å; T167-W171 HydrophobicContact CG2-CZ3 4.3Å; T167-W171 PolarHBondContact O-N 3.28Å
168	Q	98.5	Very high	98	Very high	41 Å²	41	66.7 Å²	66.7	19%	0.192	35%	0.352	C	S	.	.	H	α-helix	trans	-51.5	-54.6	177.8	176.1	175.5	17.9	0	0	111.6	I148 W157 A159 A164 Q165 K170 W171 E172	I148-Q168 HydrophobicContact CD1-CB 3.92Å; W157-Q168 HydrophobicContact CB-CG 4.23Å; W157-Q168 PolarHBondContact O-NE2 3Å; A159-Q168 HydrophobicContact CB-CB 4.37Å; A164-Q168 PolarHBondContact O-N 2.99Å; Q165-Q168 PolarHBondContact O-N 3.02Å; Q168-K170 VanDerWaalsContact C-N 3.27Å; Q168-K170 PolarHBondContact O-N 3.16Å; Q168-W171 PolarHBondContact O-N 2.64Å; Q168-W171 VanDerWaalsContact O-N 3.12Å; Q168-E172 HydrophobicContact CG-CG 4.33Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.26Å; Q168-E172 PolarHBondContact NE2-OE1 3.3Å; Q168-E172 WeakPolarHBondContact O-CB 3.42Å; Q168-E172 WeakPolarHBondContact O-CG 3.42Å; Q168-E172 PolarHBondContact O-N 3.28Å
169	R	98.4	Very high	97.9	Very high	157 Å²	157	68.7 Å²	68.7	59%	0.592	36%	0.356	S	S	*	.	H	α-helix	trans	-58.8	-38.3	-179.8	-68	170.9	-166.2	156.2	8.4	112.5	Q165 T167 A173	Q165-R169 WeakPolarHBondContact O-CG 3.3Å; Q165-R169 PolarHBondContact O-N 3.12Å; Q165-R169 VanDerWaalsContact O-N 3.1Å; T167-R169 PolarHBondContact O-N 2.83Å; R169-A173 WeakPolarHBondContact O-CB 3.47Å; R169-A173 PolarHBondContact O-N 2.96Å; R169-A173 VanDerWaalsContact O-N 3.07Å
170	K	97.8	Very high	97.9	Very high	111 Å²	111	70.9 Å²	70.9	48%	0.483	36%	0.359	S	S	.	.	H	α-helix	trans	-66.8	-43.5	177.2	-72.4	176.1	-179.8	-177.9	0	111.5	Y108 I166 T167 Q168 A174	Y108-K170 PolarHBondContact OH-NZ 2.76Å; I166-K170 WeakPolarHBondContact O-CG 3.37Å; I166-K170 PolarHBondContact O-N 2.85Å; T167-K170 WeakPolarHBondContact O-CB 3.34Å; T167-K170 PolarHBondContact O-N 2.83Å; T167-K170 VanDerWaalsContact O-N 3.12Å; Q168-K170 VanDerWaalsContact C-N 3.27Å; Q168-K170 PolarHBondContact O-N 3.16Å; K170-A174 WeakPolarHBondContact O-CB 3.13Å; K170-A174 PolarHBondContact O-N 2.85Å
171	W	97.9	Very high	97.8	Very high	54 Å²	54	71.2 Å²	71.2	21%	0.205	35%	0.348	C	S	.	.	H	α-helix	trans	-72.1	-35.6	-179	-76.1	5.1	0	0	0	112.8	F140 I148 W157 T167 Q168 A174 R175 E176	F140-W171 AromaticContact CD2-CH2 3.83Å; F140-W171 HydrophobicContact CD2-CH2 3.83Å; F140-W171 HydrophobicContact CD2-CZ3 4.26Å; F140-W171 AromaticContact CE2-CH2 3.44Å; F140-W171 HydrophobicContact CE2-CH2 3.44Å; F140-W171 VanDerWaalsContact CE2-CH2 3.44Å; F140-W171 HydrophobicContact CE2-CZ2 4.48Å; F140-W171 HydrophobicContact CE2-CZ3 4.01Å; F140-W171 AromaticContact CZ-CH2 3.84Å; F140-W171 HydrophobicContact CZ-CH2 3.84Å; I148-W171 HydrophobicContact CD1-CE3 4.1Å; I148-W171 HydrophobicContact CD1-CZ3 4.3Å; I148-W171 HydrophobicContact CG2-CE3 4.48Å; I148-W171 HydrophobicContact CG2-CH2 4.04Å; I148-W171 HydrophobicContact CG2-CZ3 3.67Å; W157-W171 AromaticContact CD2-CE3 3.8Å; W157-W171 HydrophobicContact CD2-CE3 3.8Å; W157-W171 HydrophobicContact CD2-CZ3 4.27Å; W157-W171 AromaticContact CE2-CE3 3.63Å; W157-W171 AromaticContact CE3-CE3 3.8Å; W157-W171 HydrophobicContact CE3-CE3 3.8Å; W157-W171 AromaticContact CE3-CZ3 3.79Å; W157-W171 HydrophobicContact CE3-CZ3 3.79Å; W157-W171 AromaticContact CH2-CE3 3.47Å; W157-W171 HydrophobicContact CH2-CE3 3.47Å; W157-W171 VanDerWaalsContact CH2-CE3 3.47Å; W157-W171 HydrophobicContact CH2-CH2 4.42Å; W157-W171 AromaticContact CH2-CZ3 3.36Å; W157-W171 HydrophobicContact CH2-CZ3 3.36Å; W157-W171 HydrophobicContact CZ2-CD2 4.4Å; W157-W171 AromaticContact CZ2-CE3 3.48Å; W157-W171 HydrophobicContact CZ2-CE3 3.48Å; W157-W171 VanDerWaalsContact CZ2-CE3 3.48Å; W157-W171 AromaticContact CZ2-CZ3 3.9Å; W157-W171 HydrophobicContact CZ2-CZ3 3.9Å; W157-W171 AromaticContact CZ3-CE3 3.67Å; W157-W171 HydrophobicContact CZ3-CE3 3.67Å; W157-W171 HydrophobicContact CZ3-CH2 4.49Å; W157-W171 AromaticContact CZ3-CZ3 3.32Å; W157-W171 HydrophobicContact CZ3-CZ3 3.32Å; T167-W171 HydrophobicContact CG2-CD2 3.67Å; T167-W171 HydrophobicContact CG2-CE3 4.06Å; T167-W171 HydrophobicContact CG2-CG 4.1Å; T167-W171 HydrophobicContact CG2-CH2 4.19Å; T167-W171 HydrophobicContact CG2-CZ2 3.84Å; T167-W171 HydrophobicContact CG2-CZ3 4.3Å; T167-W171 PolarHBondContact O-N 3.28Å; Q168-W171 PolarHBondContact O-N 2.64Å; Q168-W171 VanDerWaalsContact O-N 3.12Å; W171-A174 CarbonylContact O-C 3.56Å; W171-A174 PolarHBondContact O-N 2.85Å; W171-R175 PolarHBondContact O-N 3.46Å; W171-E176 HydrophobicContact CB-CB 3.93Å; W171-E176 HydrophobicContact CB-CG 3.94Å; W171-E176 HydrophobicContact CD2-CG 4.5Å; W171-E176 HydrophobicContact CG-CB 4.1Å; W171-E176 HydrophobicContact CG-CG 3.84Å; W171-E176 PolarHBondContact O-N 3.01Å
172	E	97.8	Very high	97.8	Very high	86 Å²	86	71.7 Å²	71.7	40%	0.402	36%	0.359	S	S	.	.	H	α-helix	trans	-64.4	-46.7	171.7	-72.9	169.9	174.9	0	0	111	Q168 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.33Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.26Å; Q168-E172 PolarHBondContact NE2-OE1 3.3Å; Q168-E172 WeakPolarHBondContact O-CB 3.42Å; Q168-E172 WeakPolarHBondContact O-CG 3.42Å; Q168-E172 PolarHBondContact O-N 3.28Å; E172-A174 VanDerWaalsContact C-N 3.27Å; E172-A174 PolarHBondContact O-N 2.82Å; E172-R175 PolarHBondContact O-N 2.86Å
173	A	97.9	Very high	97.8	Very high	88 Å²	88	68.9 Å²	68.9	73%	0.727	34%	0.336	S	S	*	.	H	α-helix	trans	-61.3	-35.4	176	0	0	0	0	0	112.8	R169 R175	R169-A173 WeakPolarHBondContact O-CB 3.47Å; R169-A173 PolarHBondContact O-N 2.96Å; R169-A173 VanDerWaalsContact O-N 3.07Å; A173-R175 VanDerWaalsContact C-N 3.35Å
174	A	97.6	Very high	97.9	Very high	52 Å²	52	68.9 Å²	68.9	43%	0.43	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.2	176.8	0	0	0	0	0	114.1	K170 W171 E172 E176	K170-A174 WeakPolarHBondContact O-CB 3.13Å; K170-A174 PolarHBondContact O-N 2.85Å; W171-A174 CarbonylContact O-C 3.56Å; W171-A174 PolarHBondContact O-N 2.85Å; E172-A174 VanDerWaalsContact C-N 3.27Å; E172-A174 PolarHBondContact O-N 2.82Å; A174-E176 HydrophobicContact CB-CG 4.07Å; A174-E176 PolarHBondContact O-N 2.63Å
175	R	97.1	Very high	97.8	Very high	161 Å²	161	73 Å²	73	61%	0.608	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	38.3	-176.7	-57.3	-178.8	175	-156.6	3.2	113.8	W171 E172 A173 A177 E178	W171-R175 PolarHBondContact O-N 3.46Å; E172-R175 PolarHBondContact O-N 2.86Å; A173-R175 VanDerWaalsContact C-N 3.35Å; R175-A177 PolarHBondContact O-N 3.37Å; R175-E178 HydrophobicContact CB-CG 4.26Å; R175-E178 WeakPolarHBondContact CD-OE1 3.31Å; R175-E178 IonicContact NH1-OE1 2.71Å; R175-E178 WeakPolarHBondContact O-CB 3.47Å; R175-E178 PolarHBondContact O-N 3.32Å; R175-E178 VanDerWaalsContact O-N 3.07Å
176	E	97.1	Very high	97.8	Very high	45 Å²	45	70.6 Å²	70.6	21%	0.21	35%	0.35	C	S	.	.	H	α-helix	trans	-59.1	-31.8	-178.7	-72.7	-76.2	170.4	0	0	112.5	W157 W171 A174 E178 Q179 R180	W157-E176 HydrophobicContact CZ2-CB 4.34Å; W171-E176 HydrophobicContact CB-CB 3.93Å; W171-E176 HydrophobicContact CB-CG 3.94Å; W171-E176 HydrophobicContact CD2-CG 4.5Å; W171-E176 HydrophobicContact CG-CB 4.1Å; W171-E176 HydrophobicContact CG-CG 3.84Å; W171-E176 PolarHBondContact O-N 3.01Å; A174-E176 HydrophobicContact CB-CG 4.07Å; A174-E176 PolarHBondContact O-N 2.63Å; E176-E178 VanDerWaalsContact C-N 3.28Å; E176-E178 PolarHBondContact O-N 2.97Å; E176-Q179 PolarHBondContact O-N 3.42Å; E176-R180 WeakPolarHBondContact O-CG 3.38Å; E176-R180 PolarHBondContact O-N 3.4Å
177	A	97.9	Very high	97.8	Very high	10 Å²	10	70.1 Å²	70.1	8%	0.083	35%	0.35	C	S	.	.	H	α-helix	trans	-58.7	-38.7	176.6	0	0	0	0	0	112.2	L150 R155 R175 Q179 R180 R181	L150-A177 HydrophobicContact CD1-CB 3.99Å; R155-A177 VanDerWaalsContact O-CB 3.3Å; R155-A177 WeakPolarHBondContact O-CB 3.49Å; R175-A177 PolarHBondContact O-N 3.37Å; A177-Q179 PolarHBondContact O-N 2.64Å; A177-R180 PolarHBondContact O-N 3.31Å; A177-R181 WeakPolarHBondContact O-CB 3.36Å; A177-R181 PolarHBondContact O-N 2.94Å
178	E	97.6	Very high	97.8	Very high	114 Å²	114	69.3 Å²	69.3	53%	0.533	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-42.3	179.4	-63.6	177.7	-175.2	0	0	111.3	R175 E176 A182	R175-E178 HydrophobicContact CB-CG 4.26Å; R175-E178 WeakPolarHBondContact CD-OE1 3.31Å; R175-E178 IonicContact NH1-OE1 2.71Å; R175-E178 WeakPolarHBondContact O-CB 3.47Å; R175-E178 PolarHBondContact O-N 3.32Å; R175-E178 VanDerWaalsContact O-N 3.07Å; E176-E178 VanDerWaalsContact C-N 3.28Å; E176-E178 PolarHBondContact O-N 2.97Å; E178-A182 WeakPolarHBondContact O-CB 3.42Å; E178-A182 PolarHBondContact O-N 3.18Å
179	Q	96.2	Very high	97.7	Very high	120 Å²	120	67.8 Å²	67.8	56%	0.561	34%	0.338	S	S	*	.	H	α-helix	trans	-66.9	-41.5	177.3	-61.2	-176.6	16.3	0	0	111.9	E176 A177 A182 Y183	E176-Q179 PolarHBondContact O-N 3.42Å; A177-Q179 PolarHBondContact O-N 2.64Å; Q179-A182 PolarHBondContact O-N 3.4Å; Q179-Y183 PolarHBondContact O-N 3.12Å; Q179-Y183 VanDerWaalsContact O-N 3.13Å
180	R	97.6	Very high	97.7	Very high	70 Å²	70	66.2 Å²	66.2	26%	0.264	34%	0.338	S	S	.	.	H	α-helix	trans	-67.1	-42.4	178	-63.1	-60.4	172.1	-170.5	-2.2	111.4	N138 L150 W157 E176 A177 Y183 L184	N138-R180 VanDerWaalsContact ND2-CD 3.33Å; N138-R180 WeakPolarHBondContact ND2-CD 3.24Å; N138-R180 WeakPolarHBondContact ND2-CG 3.19Å; L150-R180 HydrophobicContact CD2-CB 4.1Å; W157-R180 HydrophobicContact CH2-CG 4.46Å; W157-R180 HydrophobicContact CZ2-CG 4.48Å; E176-R180 WeakPolarHBondContact O-CG 3.38Å; E176-R180 PolarHBondContact O-N 3.4Å; A177-R180 PolarHBondContact O-N 3.31Å; R180-Y183 PolarHBondContact O-N 3.31Å; R180-L184 WeakPolarHBondContact O-CB 3.2Å; R180-L184 WeakPolarHBondContact O-CG 3.5Å; R180-L184 PolarHBondContact O-N 2.89Å
181	R	98.1	Very high	97.7	Very high	68 Å²	68	62.9 Å²	62.9	26%	0.257	32%	0.322	S	S	.	.	H	α-helix	trans	-59.2	-47.6	174.2	-175.9	173.2	-179.3	-143	-11.8	111.8	L154 R155 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.05Å; L154-R181 HydrophobicContact CB-CG 3.87Å; L154-R181 HydrophobicContact CD1-CG 4.12Å; R155-R181 VanDerWaalsContact CZ-NH1 3.32Å; R155-R181 VanDerWaalsContact NH2-NH1 3.12Å; A177-R181 WeakPolarHBondContact O-CB 3.36Å; A177-R181 PolarHBondContact O-N 2.94Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.86Å; R181-L184 PolarHBondContact O-N 3.14Å; R181-L184 VanDerWaalsContact O-N 3.14Å; R181-E185 HydrophobicContact CG-CG 4.1Å; R181-E185 IonicContact CZ-OE1 2.76Å; R181-E185 VanDerWaalsContact CZ-OE1 3.27Å; R181-E185 IonicContact CZ-OE2 3.02Å; R181-E185 VanDerWaalsContact NE-CD 3.32Å; R181-E185 IonicContact NE-OE1 2.72Å; R181-E185 PolarHBondContact NE-OE1 3.17Å; R181-E185 IonicContact NE-OE2 3.34Å; R181-E185 PolarHBondContact NE-OE2 3.26Å; R181-E185 IonicContact NH2-OE1 3.54Å; R181-E185 PolarHBondContact NH2-OE1 3.12Å; R181-E185 IonicContact NH2-OE2 2.7Å; R181-E185 PolarHBondContact NH2-OE2 3.37Å; R181-E185 WeakPolarHBondContact O-CB 3.48Å; R181-E185 PolarHBondContact O-N 2.82Å
182	A	98.1	Very high	97.7	Very high	64 Å²	64	60.3 Å²	60.3	53%	0.529	31%	0.312	S	S	.	.	H	α-helix	trans	-59	-40.5	177.7	0	0	0	0	0	112.7	E178 Q179 G186	E178-A182 WeakPolarHBondContact O-CB 3.42Å; E178-A182 PolarHBondContact O-N 3.18Å; Q179-A182 PolarHBondContact O-N 3.4Å; A182-G186 PolarHBondContact O-N 2.9Å; A182-G186 VanDerWaalsContact O-N 3.1Å
183	Y	97.9	Very high	97.7	Very high	51 Å²	51	62.1 Å²	62.1	20%	0.2	32%	0.316	C	S	.	.	I	π-helix	trans	-65.4	-45.8	173.8	172.1	-95	0	0	0	112.2	F123 Q179 R180 R181 T187 C188	F123-Y183 AromaticContact CD2-CE1 3.86Å; F123-Y183 HydrophobicContact CD2-CE1 3.86Å; F123-Y183 AromaticContact CE2-CE1 3.83Å; F123-Y183 HydrophobicContact CE2-CE1 3.83Å; Q179-Y183 PolarHBondContact O-N 3.12Å; Q179-Y183 VanDerWaalsContact O-N 3.13Å; R180-Y183 PolarHBondContact O-N 3.31Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.86Å; Y183-T187 HydrophobicContact CD2-CG2 3.88Å; Y183-T187 HydrophobicContact CE2-CG2 3.66Å; Y183-T187 PolarHBondContact O-N 2.83Å; Y183-T187 VanDerWaalsContact O-N 3.13Å; Y183-C188 HydrophobicContact CD1-CB 4.41Å; Y183-C188 HydrophobicContact CE1-CB 4.01Å; Y183-C188 WeakPolarHBondContact O-CB 3.42Å; Y183-C188 PolarHBondContact O-N 2.84Å
184	L	98.4	Very high	97.6	Very high	3 Å²	3	63.8 Å²	63.8	2%	0.016	30%	0.303	C	S	.	.	I	π-helix	trans	-70.7	-38.6	-175.2	-70.4	171.4	0	0	0	112.8	G124 L150 L154 R180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.35Å; L150-L184 HydrophobicContact CD2-CD1 4.04Å; L154-L184 HydrophobicContact CD1-CB 4.42Å; L154-L184 HydrophobicContact CD2-CD1 3.94Å; R180-L184 WeakPolarHBondContact O-CB 3.2Å; R180-L184 WeakPolarHBondContact O-CG 3.5Å; R180-L184 PolarHBondContact O-N 2.89Å; R181-L184 PolarHBondContact O-N 3.14Å; R181-L184 VanDerWaalsContact O-N 3.14Å; L184-V189 WeakPolarHBondContact O-CG2 3.33Å
185	E	97.7	Very high	97.6	Very high	88 Å²	88	61.3 Å²	61.3	41%	0.411	28%	0.283	S	S	.	.	I	π-helix	trans	-80.3	-26.1	178.2	-69.2	-179.9	164.7	0	0	113.2	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.4Å; L133-E185 HydrophobicContact CD2-CG 3.69Å; L154-E185 HydrophobicContact CD1-CG 4.24Å; R181-E185 HydrophobicContact CG-CG 4.1Å; R181-E185 IonicContact CZ-OE1 2.76Å; R181-E185 VanDerWaalsContact CZ-OE1 3.27Å; R181-E185 IonicContact CZ-OE2 3.02Å; R181-E185 VanDerWaalsContact NE-CD 3.32Å; R181-E185 IonicContact NE-OE1 2.72Å; R181-E185 PolarHBondContact NE-OE1 3.17Å; R181-E185 IonicContact NE-OE2 3.34Å; R181-E185 PolarHBondContact NE-OE2 3.26Å; R181-E185 IonicContact NH2-OE1 3.54Å; R181-E185 PolarHBondContact NH2-OE1 3.12Å; R181-E185 IonicContact NH2-OE2 2.7Å; R181-E185 PolarHBondContact NH2-OE2 3.37Å; R181-E185 WeakPolarHBondContact O-CB 3.48Å; R181-E185 PolarHBondContact O-N 2.82Å
186	G	97.6	Very high	97.5	Very high	23 Å²	23	54.3 Å²	54.3	24%	0.237	26%	0.257	C	S	.	.	I	π-helix	trans	-107	-88	-179.2	0	0	0	0	0	112.3	A182 C188 V189 E190	A182-G186 PolarHBondContact O-N 2.9Å; A182-G186 VanDerWaalsContact O-N 3.1Å; G186-C188 VanDerWaalsContact C-N 3.32Å; G186-C188 PolarHBondContact O-N 2.83Å; G186-V189 PolarHBondContact O-N 3.03Å; G186-V189 VanDerWaalsContact O-N 3.12Å; G186-E190 WeakPolarHBondContact O-CG 3.34Å; G186-E190 PolarHBondContact O-N 2.72Å
187	T	97.7	Very high	97.5	Very high	50 Å²	50	58.3 Å²	58.3	31%	0.307	28%	0.276	S	S	.	.	I	π-helix	trans	-54	-44	-170.7	-55.3	0	0	0	0	113.2	Y183 V189 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.88Å; Y183-T187 HydrophobicContact CE2-CG2 3.66Å; Y183-T187 PolarHBondContact O-N 2.83Å; Y183-T187 VanDerWaalsContact O-N 3.13Å; T187-V189 PolarHBondContact O-N 2.73Å; T187-E190 PolarHBondContact O-N 3.13Å; T187-W191 VanDerWaalsContact CG2-CD1 3.46Å; T187-W191 WeakPolarHBondContact O-CB 3.5Å; T187-W191 PolarHBondContact O-N 2.73Å
188	C	98.3	Very high	97.4	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.1	-47.4	-179.7	-169.9	0	0	0	0	111.5	M29 C125 Y183 G186 W191 L192	M29-C188 HydrophobicContact CE-CB 4.18Å; M29-C188 VanDerWaalsContact CE-O 3.22Å; M29-C188 WeakPolarHBondContact CE-O 3.33Å; M29-C188 WeakPolarHBondContact CE-SG 3.49Å; C125-C188 HydrophobicContact CB-CB 3.91Å; C125-C188 WeakPolarHBondContact CB-SG 3.49Å; C125-C188 PolarHBondContact N-SG 3.47Å; C125-C188 WeakPolarHBondContact SG-CB 3.37Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.98Å; Y183-C188 HydrophobicContact CD1-CB 4.41Å; Y183-C188 HydrophobicContact CE1-CB 4.01Å; Y183-C188 WeakPolarHBondContact O-CB 3.42Å; Y183-C188 PolarHBondContact O-N 2.84Å; G186-C188 VanDerWaalsContact C-N 3.32Å; G186-C188 PolarHBondContact O-N 2.83Å; C188-W191 PolarHBondContact O-N 2.84Å; C188-L192 WeakPolarHBondContact O-CB 3.38Å; C188-L192 PolarHBondContact O-N 3.05Å
189	V	98.1	Very high	97.3	Very high	8 Å²	8	55 Å²	55	5%	0.048	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-45.5	178	178.4	0	0	0	0	111.2	L127 L133 L184 G186 T187 L192 R193	L127-V189 HydrophobicContact CD1-CG1 4.38Å; L127-V189 HydrophobicContact CD2-CB 4.18Å; L127-V189 HydrophobicContact CD2-CG1 3.77Å; L127-V189 HydrophobicContact CD2-CG2 3.86Å; L133-V189 HydrophobicContact CB-CG2 4.06Å; L133-V189 HydrophobicContact CD1-CG2 4.12Å; L184-V189 WeakPolarHBondContact O-CG2 3.33Å; G186-V189 PolarHBondContact O-N 3.03Å; G186-V189 VanDerWaalsContact O-N 3.12Å; T187-V189 PolarHBondContact O-N 2.73Å; V189-L192 PolarHBondContact O-N 2.86Å; V189-R193 WeakPolarHBondContact O-CG 3.27Å; V189-R193 PolarHBondContact O-N 3.09Å
190	E	97.8	Very high	97.1	Very high	125 Å²	125	54.5 Å²	54.5	58%	0.584	26%	0.257	S	S	*	.	H	α-helix	trans	-61.2	-46.7	179.7	-71.7	173	174.9	0	0	112.1	G186 T187 R194	G186-E190 WeakPolarHBondContact O-CG 3.34Å; G186-E190 PolarHBondContact O-N 2.72Å; T187-E190 PolarHBondContact O-N 3.13Å; E190-R194 PolarHBondContact O-N 3.34Å; E190-R194 VanDerWaalsContact O-N 3.1Å
191	W	97.8	Very high	96.8	Very high	41 Å²	41	59.7 Å²	59.7	16%	0.155	28%	0.284	C	S	.	.	H	α-helix	trans	-69	-41.5	179.5	-81.9	99.7	0	0	0	112.3	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.07Å; M29-W191 HydrophobicContact SD-CB 4.43Å; Y83-W191 AromaticContact CD2-CH2 3.5Å; Y83-W191 HydrophobicContact CD2-CH2 3.5Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.5Å; Y83-W191 HydrophobicContact CD2-CZ2 4.2Å; Y83-W191 AromaticContact CD2-CZ3 3.77Å; Y83-W191 HydrophobicContact CD2-CZ3 3.77Å; Y83-W191 HydrophobicContact CE2-CE3 4.21Å; Y83-W191 AromaticContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CZ2 4.46Å; Y83-W191 AromaticContact CE2-CZ3 3.7Å; Y83-W191 HydrophobicContact CE2-CZ3 3.7Å; T187-W191 VanDerWaalsContact CG2-CD1 3.46Å; T187-W191 WeakPolarHBondContact O-CB 3.5Å; T187-W191 PolarHBondContact O-N 2.73Å; C188-W191 PolarHBondContact O-N 2.84Å; W191-R193 PolarHBondContact O-N 2.96Å; W191-R194 WeakPolarHBondContact O-CB 3.31Å; W191-R194 PolarHBondContact O-N 2.81Å; W191-Y195 HydrophobicContact CB-CE2 4.04Å; W191-Y195 HydrophobicContact CE3-CD1 4.44Å; W191-Y195 AromaticContact CE3-CE1 3.55Å; W191-Y195 HydrophobicContact CE3-CE1 3.55Å; W191-Y195 HydrophobicContact CE3-CE2 4.24Å; W191-Y195 AromaticContact CE3-CZ 3.42Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.42Å; W191-Y195 AromaticContact CZ3-CE1 3.94Å; W191-Y195 HydrophobicContact CZ3-CE1 3.94Å; W191-Y195 VanDerWaalsContact O-CD2 3.27Å; W191-Y195 WeakPolarHBondContact O-CD2 3.45Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 2.92Å
192	L	98.1	Very high	96.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-45	176.8	174.9	50.4	0	0	0	111.2	H27 M29 V52 L127 C188 V189 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.44Å; M29-L192 HydrophobicContact CB-CB 4.06Å; M29-L192 HydrophobicContact CB-CD1 4.04Å; M29-L192 HydrophobicContact CB-CD2 3.94Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.28Å; M29-L192 HydrophobicContact SD-CB 4.43Å; V52-L192 HydrophobicContact CG1-CD1 3.61Å; V52-L192 HydrophobicContact CG2-CD1 4.28Å; L127-L192 HydrophobicContact CB-CD2 4.46Å; L127-L192 HydrophobicContact CD1-CB 4.19Å; L127-L192 HydrophobicContact CD1-CD2 3.65Å; L127-L192 HydrophobicContact CD1-CG 3.72Å; L127-L192 HydrophobicContact CG-CD2 3.57Å; L127-L192 HydrophobicContact CG-CG 4.22Å; C188-L192 WeakPolarHBondContact O-CB 3.38Å; C188-L192 PolarHBondContact O-N 3.05Å; V189-L192 PolarHBondContact O-N 2.86Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R194 PolarHBondContact O-N 2.81Å; L192-Y195 PolarHBondContact O-N 3.25Å; L192-L196 HydrophobicContact CD1-CD1 3.83Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.83Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.24Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.45Å; L192-L196 PolarHBondContact O-N 2.93Å
193	R	96.6	Very high	96.1	Very high	124 Å²	124	55.3 Å²	55.3	47%	0.468	26%	0.258	S	S	.	.	H	α-helix	trans	-59	-42.9	174.4	-72	175.7	-175.7	164.9	-0.3	112.5	L127 G131 V189 W191 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.95Å; G131-R193 VanDerWaalsContact O-CZ 3.29Å; G131-R193 PolarHBondContact O-NE 3.2Å; G131-R193 PolarHBondContact O-NH2 3.15Å; V189-R193 WeakPolarHBondContact O-CG 3.27Å; V189-R193 PolarHBondContact O-N 3.09Å; W191-R193 PolarHBondContact O-N 2.96Å; R193-L196 PolarHBondContact O-N 2.82Å; R193-E197 PolarHBondContact O-N 3.08Å
194	R	96.7	Very high	95.7	Very high	122 Å²	122	57.2 Å²	57.2	46%	0.46	27%	0.269	S	S	.	.	H	α-helix	trans	-62.2	-43.6	176.6	177.3	176.1	173.8	137.7	1.3	111.7	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 3.26Å; E79-R194 VanDerWaalsContact OE1-CZ 3.26Å; E79-R194 IonicContact OE1-NE 3.86Å; E79-R194 PolarHBondContact OE1-NE 2.9Å; E79-R194 IonicContact OE1-NH2 2.98Å; E79-R194 PolarHBondContact OE1-NH2 3.46Å; E79-R194 IonicContact OE2-CZ 3.32Å; E79-R194 IonicContact OE2-NE 3.5Å; E79-R194 IonicContact OE2-NH2 2.69Å; E79-R194 PolarHBondContact OE2-NH2 3.41Å; E190-R194 PolarHBondContact O-N 3.34Å; E190-R194 VanDerWaalsContact O-N 3.1Å; W191-R194 WeakPolarHBondContact O-CB 3.31Å; W191-R194 PolarHBondContact O-N 2.81Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R194 PolarHBondContact O-N 2.81Å; R194-E197 PolarHBondContact O-N 3.24Å; R194-N198 WeakPolarHBondContact O-CB 3.29Å; R194-N198 PolarHBondContact O-N 2.91Å; R194-N198 PolarHBondContact O-OD1 2.89Å
195	Y	97.3	Very high	95.3	Very high	1 Å²	1	61.2 Å²	61.2	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-67	-40	178.2	-62.3	-32.6	0	0	0	112.4	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.72Å; M29-Y195 HydrophobicContact SD-CE2 3.56Å; M29-Y195 VanDerWaalsContact SD-CE2 3.56Å; V52-Y195 HydrophobicContact CG2-CD2 3.96Å; V52-Y195 HydrophobicContact CG2-CG 4.44Å; F57-Y195 HydrophobicContact CE2-CD2 4.5Å; F57-Y195 AromaticContact CE2-CE2 3.83Å; F57-Y195 HydrophobicContact CE2-CE2 3.83Å; F57-Y195 AromaticContact CE2-CZ 3.97Å; F57-Y195 HydrophobicContact CZ-CD2 4.37Å; F57-Y195 AromaticContact CZ-CE2 3.8Å; F57-Y195 HydrophobicContact CZ-CE2 3.8Å; W75-Y195 HydrophobicContact CE3-CD1 4.27Å; W75-Y195 HydrophobicContact CH2-CG 4.27Å; W75-Y195 AromaticContact CZ3-CD1 3.62Å; W75-Y195 HydrophobicContact CZ3-CD1 3.62Å; W75-Y195 HydrophobicContact CZ3-CD2 4.4Å; W75-Y195 HydrophobicContact CZ3-CE1 4.38Å; W75-Y195 AromaticContact CZ3-CG 3.64Å; W75-Y195 HydrophobicContact CZ3-CG 3.64Å; V76-Y195 HydrophobicContact CG2-CE1 4.31Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.28Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.43Å; Y83-Y195 PolarHBondContact OH-OH 2.86Å; W191-Y195 HydrophobicContact CB-CE2 4.04Å; W191-Y195 HydrophobicContact CE3-CD1 4.44Å; W191-Y195 AromaticContact CE3-CE1 3.55Å; W191-Y195 HydrophobicContact CE3-CE1 3.55Å; W191-Y195 HydrophobicContact CE3-CE2 4.24Å; W191-Y195 AromaticContact CE3-CZ 3.42Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.42Å; W191-Y195 AromaticContact CZ3-CE1 3.94Å; W191-Y195 HydrophobicContact CZ3-CE1 3.94Å; W191-Y195 VanDerWaalsContact O-CD2 3.27Å; W191-Y195 WeakPolarHBondContact O-CD2 3.45Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 2.92Å; L192-Y195 PolarHBondContact O-N 3.25Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 2.71Å; Y195-N198 PolarHBondContact O-N 2.84Å; Y195-G199 WeakPolarHBondContact O-CA 3.16Å; Y195-G199 PolarHBondContact O-N 3.03Å; Y195-L203 WeakPolarHBondContact O-CD1 3.12Å
196	L	95.9	Very high	95.1	Very high	14 Å²	14	58.9 Å²	58.9	7%	0.073	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-34.8	174.9	-70.4	169.5	0	0	0	112.7	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 4.01Å; H27-L196 HydrophobicContact CB-CG 4.43Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.47Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; L192-L196 HydrophobicContact CD1-CD1 3.83Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.83Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.24Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.45Å; L192-L196 PolarHBondContact O-N 2.93Å; R193-L196 PolarHBondContact O-N 2.82Å; L196-K200 VanDerWaalsContact O-CA 3.24Å; L196-K200 WeakPolarHBondContact O-CA 3.46Å; L196-K200 WeakPolarHBondContact O-CB 3.24Å; L196-K200 PolarHBondContact O-N 2.86Å; L196-L203 HydrophobicContact CD2-CB 4.15Å; L196-L203 HydrophobicContact CD2-CD1 4.35Å; L196-Q204 PolarHBondContact O-NE2 2.95Å
197	E	95.4	Very high	94.9	Very high	128 Å²	128	61 Å²	61	60%	0.598	28%	0.283	S	S	*	.	H	α-helix	trans	-72.8	-47.6	174.4	-171.8	60.8	-152.6	0	0	111.3	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 3.08Å; R194-E197 PolarHBondContact O-N 3.24Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 2.71Å; E197-G199 VanDerWaalsContact C-N 3.35Å; E197-G199 PolarHBondContact O-N 3.32Å; E197-K200 WeakPolarHBondContact O-CB 3.16Å; E197-K200 PolarHBondContact O-N 2.93Å
198	N	96.1	Very high	94.8	Very high	53 Å²	53	63.3 Å²	63.3	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-41.3	179.5	-73.3	-3	0	0	0	112.8	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.37Å; Q78-N198 VanDerWaalsContact NE2-CB 3.3Å; Q78-N198 PolarHBondContact NE2-ND2 3.44Å; Q78-N198 VanDerWaalsContact NE2-ND2 3.12Å; Q78-N198 PolarHBondContact NE2-OD1 3.28Å; E79-N198 PolarHBondContact OE1-ND2 3.03Å; R194-N198 WeakPolarHBondContact O-CB 3.29Å; R194-N198 PolarHBondContact O-N 2.91Å; R194-N198 PolarHBondContact O-OD1 2.89Å; Y195-N198 PolarHBondContact O-N 2.84Å
199	G	95.2	Very high	94.8	Very high	2 Å²	2	63.7 Å²	63.7	2%	0.021	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	24.9	-176.6	0	0	0	0	0	113.1	Y195 E197 E201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.16Å; Y195-G199 PolarHBondContact O-N 3.03Å; E197-G199 VanDerWaalsContact C-N 3.35Å; E197-G199 PolarHBondContact O-N 3.32Å; G199-E201 VanDerWaalsContact C-N 3.26Å; G199-E201 PolarHBondContact O-N 3.09Å; G199-T202 PolarHBondContact O-N 3.49Å; G199-T202 PolarHBondContact O-OG1 2.89Å; G199-L203 WeakPolarHBondContact O-CB 3.47Å; G199-L203 WeakPolarHBondContact O-CG 3.39Å; G199-L203 PolarHBondContact O-N 3.33Å
200	K	93.3	Very high	94.8	Very high	109 Å²	109	70.6 Å²	70.6	47%	0.474	32%	0.322	S	S	.	.	H	α-helix	trans	-52.7	-41.6	-172.6	-177	172.2	-175.4	173.6	0	113.7	L196 E197 T202 Q204	L196-K200 VanDerWaalsContact O-CA 3.24Å; L196-K200 WeakPolarHBondContact O-CA 3.46Å; L196-K200 WeakPolarHBondContact O-CB 3.24Å; L196-K200 PolarHBondContact O-N 2.86Å; E197-K200 WeakPolarHBondContact O-CB 3.16Å; E197-K200 PolarHBondContact O-N 2.93Å; K200-T202 VanDerWaalsContact C-N 3.28Å; K200-T202 PolarHBondContact O-N 3.34Å; K200-Q204 HydrophobicContact CG-CB 4.49Å; K200-Q204 HydrophobicContact CG-CG 4.5Å; K200-Q204 WeakPolarHBondContact O-CB 3.31Å; K200-Q204 PolarHBondContact O-N 2.76Å
201	E	90.5	Very high	94.8	Very high	180 Å²	180	66.3 Å²	66.3	84%	0.841	30%	0.304	S	S	*	.	H	α-helix	trans	-66.9	-27.7	-179.1	-63	-174.8	167.2	0	0	113.4	G199	G199-E201 VanDerWaalsContact C-N 3.26Å; G199-E201 PolarHBondContact O-N 3.09Å
202	T	90.4	Very high	94.7	Very high	36 Å²	36	68.2 Å²	68.2	22%	0.221	32%	0.315	C	S	.	.	H	α-helix	trans	-100	-39.3	-178.6	36.3	0	0	0	0	113.2	W75 G199 K200 R205	W75-T202 VanDerWaalsContact CD1-OG1 3.32Å; G199-T202 PolarHBondContact O-N 3.49Å; G199-T202 PolarHBondContact O-OG1 2.89Å; K200-T202 VanDerWaalsContact C-N 3.28Å; K200-T202 PolarHBondContact O-N 3.34Å; T202-R205 WeakPolarHBondContact O-CG 3.49Å; T202-R205 PolarHBondContact O-NE 3.07Å
203	L	91.6	Very high	94.7	Very high	4 Å²	4	69.3 Å²	69.3	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-89.2	-30.4	-172.3	-63.3	171.7	0	0	0	113	V52 T55 W75 Y195 L196 G199	V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.08Å; V52-L203 HydrophobicContact CG1-CD1 3.91Å; V52-L203 HydrophobicContact CG1-CD2 4.04Å; V52-L203 HydrophobicContact CG1-CG 4.49Å; T55-L203 HydrophobicContact CG2-CD2 4.14Å; W75-L203 HydrophobicContact CD2-CD1 4.45Å; W75-L203 HydrophobicContact CH2-CD1 4.28Å; W75-L203 HydrophobicContact CZ2-CD1 3.88Å; W75-L203 HydrophobicContact CZ2-CD2 4.13Å; W75-L203 HydrophobicContact CZ2-CG 4.38Å; Y195-L203 WeakPolarHBondContact O-CD1 3.12Å; L196-L203 HydrophobicContact CD2-CB 4.15Å; L196-L203 HydrophobicContact CD2-CD1 4.35Å; G199-L203 WeakPolarHBondContact O-CB 3.47Å; G199-L203 WeakPolarHBondContact O-CG 3.39Å; G199-L203 PolarHBondContact O-N 3.33Å
204	Q	89.3	Confident	94.7	Very high	91 Å²	91	65 Å²	65	43%	0.425	31%	0.309	S	S	.	.	S	Bend	trans	-102.4	19.5	179.2	-57	179.7	32.5	0	0	112.1	L196 K200	L196-Q204 PolarHBondContact O-NE2 2.95Å; K200-Q204 HydrophobicContact CG-CB 4.49Å; K200-Q204 HydrophobicContact CG-CG 4.5Å; K200-Q204 WeakPolarHBondContact O-CB 3.31Å; K200-Q204 PolarHBondContact O-N 2.76Å
205	R	90.4	Very high	94.7	Very high	87 Å²	87	61.7 Å²	61.7	33%	0.328	30%	0.299	S	S	.	.			trans	-90.8	148.7	170.4	79.3	-170.5	174.3	-166	3.4	109.4	T202 E207 Y233	T202-R205 WeakPolarHBondContact O-CG 3.49Å; T202-R205 PolarHBondContact O-NE 3.07Å; R205-E207 IonicContact CZ-OE1 2.59Å; R205-E207 IonicContact NE-OE1 3.06Å; R205-E207 PolarHBondContact NE-OE1 3.34Å; R205-E207 IonicContact NH1-OE1 3.3Å; R205-E207 IonicContact NH2-OE1 3.68Å; R205-Y233 HydrophobicContact CG-CD1 4.18Å; R205-Y233 WeakPolarHBondContact O-CD1 3.3Å
206	A	92.3	Very high	94.5	Very high	39 Å²	39	65.5 Å²	65.5	32%	0.322	32%	0.316	S	S	.	.			trans	-120.9	121	164.7	0	0	0	0	0	108.7	Y233	A206-Y233 CarbonylContact C-O 3.51Å; A206-Y233 WeakPolarHBondContact CA-O 3.05Å
207	E	94.4	Very high	94.4	Very high	67 Å²	67	69.5 Å²	69.5	31%	0.313	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-98.2	119.2	175.1	-68.2	-173	-142.1	0	0	108.9	R205 F232 Y233 H287	R205-E207 IonicContact CZ-OE1 2.59Å; R205-E207 IonicContact NE-OE1 3.06Å; R205-E207 PolarHBondContact NE-OE1 3.34Å; R205-E207 IonicContact NH1-OE1 3.3Å; R205-E207 IonicContact NH2-OE1 3.68Å; E207-F232 WeakPolarHBondContact O-CA 3.2Å; E207-F232 WeakPolarHBondContact O-CB 3.24Å; E207-Y233 PolarHBondContact N-O 2.97Å; E207-Y233 PolarHBondContact O-N 3Å; E207-Y233 VanDerWaalsContact O-N 3.09Å; E207-H287 PolarHBondContact O-CE1 3.12Å
208	H	95.3	Very high	94.2	Very high	98 Å²	98	67.9 Å²	67.9	45%	0.454	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-69.2	145.1	-178.1	-54.2	-100.9	0	0	0	112.1	K210 G289 L290	H208-K210 PolarHBondContact O-N 2.82Å; H208-G289 PolarHBondContact CE1-O 2.98Å; H208-G289 PolarHBondContact ND1-O 3.46Å; H208-L290 HydrophobicContact CB-CD2 4.12Å; H208-L290 WeakPolarHBondContact ND1-CA 3.43Å; H208-L290 PolarHBondContact ND1-N 3.38Å
209	P	97.6	Very high	94	Very high	8 Å²	8	67.9 Å²	67.9	5%	0.052	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-67.7	129.6	176.3	28.2	-34.9	0	0	0	111.9	T211 A229 F232 I237 V285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.91Å; P209-T211 HydrophobicContact CG-CG2 4.14Å; P209-T211 PolarHBondContact O-N 3.14Å; P209-A229 HydrophobicContact CB-CB 3.86Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.9Å; P209-F232 HydrophobicContact CB-CG 4.15Å; P209-I237 HydrophobicContact CB-CD1 4.01Å; P209-I237 HydrophobicContact CG-CD1 4.11Å; P209-V285 HydrophobicContact CG-CG1 3.95Å; P209-H287 HydrophobicContact CG-CB 4.09Å; P209-L290 HydrophobicContact CG-CD1 3.88Å; P209-L290 HydrophobicContact CG-CD2 4.48Å; P209-L290 HydrophobicContact CG-CG 4.23Å
210	K	97.9	Very high	93.7	Very high	154 Å²	154	74.9 Å²	74.9	67%	0.67	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	109.8	163.9	-65.5	170.8	-172.8	163.3	0	107.9	H208 L230	H208-K210 PolarHBondContact O-N 2.82Å; K210-L230 WeakPolarHBondContact CB-O 3.14Å; K210-L230 PolarHBondContact N-O 2.87Å; K210-L230 PolarHBondContact O-N 3.4Å
211	T	97.8	Very high	93.6	Very high	34 Å²	34	76.7 Å²	76.7	21%	0.209	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	143.7	-171.8	57.3	0	0	0	0	113.2	P209 W228 A229 V285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.91Å; P209-T211 HydrophobicContact CG-CG2 4.14Å; P209-T211 PolarHBondContact O-N 3.14Å; T211-W228 WeakPolarHBondContact CA-O 3.04Å; T211-W228 WeakPolarHBondContact CB-O 3.33Å; T211-A229 HydrophobicContact CG2-CB 4.26Å; T211-V285 HydrophobicContact CG2-CB 4.42Å; T211-V285 HydrophobicContact CG2-CG1 4.14Å; T211-V285 HydrophobicContact CG2-CG2 4.05Å; T211-L294 HydrophobicContact CG2-CD1 4.35Å; T211-L296 VanDerWaalsContact CB-CD1 3.48Å; T211-L296 HydrophobicContact CG2-CD1 4.14Å
212	H	97.1	Very high	93.8	Very high	81 Å²	81	72.5 Å²	72.5	38%	0.375	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	159.1	172.7	63.5	-75.3	0	0	0	110.8	W228	H212-W228 AromaticContact CD2-CD1 4Å; H212-W228 VanDerWaalsContact CE1-CB 3.42Å; H212-W228 WeakPolarHBondContact CE1-CB 3.44Å; H212-W228 AromaticContact CE1-CD1 3.91Å; H212-W228 AromaticContact CE1-CG 3.68Å; H212-W228 PolarHBondContact N-O 2.91Å; H212-W228 AromaticContact NE2-CD1 3.49Å; H212-W228 AromaticContact NE2-CG 3.73Å; H212-W228 PolarHBondContact O-N 3.3Å
213	V	98	Very high	94.1	Very high	23 Å²	23	70.9 Å²	70.9	14%	0.139	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.2	176.4	-179.6	0	0	0	0	109.3	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.41Å; V213-L225 HydrophobicContact CG1-CD2 4.4Å; V213-R226 WeakPolarHBondContact CA-O 3.36Å; V213-C227 HydrophobicContact CG2-CB 4.41Å; V213-W241 HydrophobicContact CG1-CH2 3.86Å; V213-W241 HydrophobicContact CG1-CZ2 4.33Å; V213-W241 HydrophobicContact CG2-CH2 4.25Å; V213-L296 HydrophobicContact CG2-CB 3.87Å; V213-W298 HydrophobicContact CB-CB 4.45Å; V213-W298 HydrophobicContact CG1-CB 3.79Å
214	T	96.6	Very high	94.3	Very high	34 Å²	34	71.7 Å²	71.7	21%	0.209	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	147.8	175.2	54.7	0	0	0	0	110.1	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-CE1 3.01Å; T214-H216 VanDerWaalsContact OG1-CE1 3.29Å; T214-L225 WeakPolarHBondContact O-CA 3.32Å; T214-R226 PolarHBondContact N-O 3.19Å; T214-R226 PolarHBondContact O-N 2.82Å; T214-R226 WeakPolarHBondContact OG1-CB 3.2Å; T214-R226 PolarHBondContact OG1-O 3.05Å; T214-R226 VanDerWaalsContact OG1-O 3.11Å; T214-W228 PolarHBondContact OG1-NE1 2.74Å
215	H	95.7	Very high	94.7	Very high	53 Å²	53	67.3 Å²	67.3	25%	0.245	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125	-179.4	169	-90.4	0	0	0	109.4	A223 L225 E278 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.33Å; H215-L225 HydrophobicContact CB-CD2 3.99Å; H215-E278 IonicContact NE2-OE1 3.69Å; H215-W298 HydrophobicContact CB-CD2 4.11Å; H215-W298 HydrophobicContact CB-CG 4.14Å; H215-W298 HydrophobicContact CB-CZ2 4.03Å; H215-W298 AromaticContact CG-CE2 3.78Å; H215-W298 AromaticContact CG-CZ2 3.8Å; H215-W298 AromaticContact CG-NE1 4Å
216	H	94.2	Very high	95.1	Very high	80 Å²	80	65.6 Å²	65.6	37%	0.37	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	105.5	-179.4	-58.3	84.3	0	0	0	108.7	T214 V218 A223 T224 R226	T214-H216 PolarHBondContact OG1-CE1 3.01Å; T214-H216 VanDerWaalsContact OG1-CE1 3.29Å; H216-V218 PolarHBondContact O-N 3.41Å; H216-A223 CarbonylContact O-C 3.57Å; H216-A223 WeakPolarHBondContact O-CA 3.36Å; H216-T224 PolarHBondContact N-O 3.45Å; H216-T224 PolarHBondContact O-N 3.31Å; H216-R226 PolarHBondContact CE1-NH1 3.26Å; H216-R226 VanDerWaalsContact CE1-NH1 3.32Å
217	P	93.3	Very high	95.4	Very high	99 Å²	99	63.8 Å²	63.8	64%	0.643	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.4	131.5	172.6	-18.5	29.1	0	0	0	110.3
218	V	90.7	Very high	95.6	Very high	94 Å²	94	62.9 Å²	62.9	57%	0.57	32%	0.32	S	S	*	.			trans	-104.6	-41.7	175.8	-178.9	0	0	0	0	109.9	H216 E222 T224	H216-V218 PolarHBondContact O-N 3.41Å; V218-E222 PolarHBondContact N-O 3.34Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.33Å
219	S	91.6	Very high	95.7	Very high	52 Å²	52	58.2 Å²	58.2	36%	0.364	30%	0.299	S	S	.	.	S	Bend	trans	-147.1	-177.9	175.1	72.7	0	0	0	0	110.5	H221 E222	S219-H221 PolarHBondContact O-N 3.07Å; S219-H221 PolarHBondContact OG-N 2.91Å; S219-H221 VanDerWaalsContact OG-N 3.17Å; S219-E222 PolarHBondContact N-O 3.07Å; S219-E222 VanDerWaalsContact O-O 3.1Å; S219-E222 PolarHBondContact OG-N 3.27Å
220	D	88.9	Confident	95.8	Very high	150 Å²	150	60.4 Å²	60.4	80%	0.802	31%	0.31	S	S	*	.	S	Bend	trans	-67.1	-10.8	172.6	-66.2	-22.7	0	0	0	113.3
221	H	92.6	Very high	95.7	Very high	146 Å²	146	53.9 Å²	53.9	68%	0.676	29%	0.286	S	S	*	.	S	Bend	trans	-114.5	-16.5	-176.1	-56.9	-46	0	0	0	113.3	S219 P274 S275	S219-H221 PolarHBondContact O-N 3.07Å; S219-H221 PolarHBondContact OG-N 2.91Å; S219-H221 VanDerWaalsContact OG-N 3.17Å; H221-P274 WeakPolarHBondContact O-CA 3.47Å; H221-S275 PolarHBondContact O-N 3.3Å; H221-S275 PolarHBondContact O-OG 2.93Å
222	E	94.9	Very high	95.7	Very high	93 Å²	93	52.3 Å²	52.3	44%	0.435	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144.7	-170.6	-66.8	179	172.4	0	0	112.3	V218 S219 V272 V273 S275	V218-E222 PolarHBondContact N-O 3.34Å; S219-E222 PolarHBondContact N-O 3.07Å; S219-E222 VanDerWaalsContact O-O 3.1Å; S219-E222 PolarHBondContact OG-N 3.27Å; E222-V272 HydrophobicContact CB-CG1 4.12Å; E222-V272 HydrophobicContact CG-CG1 4.32Å; E222-V273 WeakPolarHBondContact CA-O 3.44Å; E222-S275 PolarHBondContact N-OG 2.93Å
223	A	95.5	Very high	95.7	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	155.5	171.2	0	0	0	0	0	110.7	H215 H216 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.33Å; H216-A223 CarbonylContact O-C 3.57Å; H216-A223 WeakPolarHBondContact O-CA 3.36Å; A223-V273 HydrophobicContact CB-CG2 4.46Å; A223-V273 PolarHBondContact N-O 2.59Å; A223-V273 WeakPolarHBondContact O-CG2 3.5Å; A223-V273 PolarHBondContact O-N 2.58Å
224	T	97.3	Very high	95.5	Very high	21 Å²	21	48.3 Å²	48.3	13%	0.129	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121	170.2	-53.5	0	0	0	0	109.6	H216 V218 A270 V271	H216-T224 PolarHBondContact N-O 3.45Å; H216-T224 PolarHBondContact O-N 3.31Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.33Å; T224-A270 HydrophobicContact CG2-CB 3.92Å; T224-V271 WeakPolarHBondContact CA-O 3.22Å
225	L	97.8	Very high	95.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	126.7	165.2	-64.3	-175.6	0	0	0	108.9	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.41Å; V213-L225 HydrophobicContact CG1-CD2 4.4Å; T214-L225 WeakPolarHBondContact O-CA 3.32Å; H215-L225 HydrophobicContact CB-CD2 3.99Å; L225-W241 HydrophobicContact CB-CH2 3.73Å; L225-W241 HydrophobicContact CB-CZ2 3.8Å; L225-W241 HydrophobicContact CD1-CH2 4.07Å; L225-W241 HydrophobicContact CD1-CZ3 4.25Å; L225-A270 CarbonylContact O-C 3.56Å; L225-A270 WeakPolarHBondContact O-CA 3.39Å; L225-V271 HydrophobicContact CB-CG1 4.23Å; L225-V271 PolarHBondContact N-O 3.44Å; L225-V271 PolarHBondContact O-N 3.29Å; L225-V273 HydrophobicContact CD1-CG1 4.02Å; L225-V273 HydrophobicContact CD1-CG2 4.07Å; L225-V273 HydrophobicContact CG-CG1 4.16Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; L225-E278 HydrophobicContact CD1-CB 4.1Å; L225-E278 HydrophobicContact CD2-CB 4.45Å; L225-E278 HydrophobicContact CD2-CG 4.34Å; L225-W298 HydrophobicContact CD1-CB 4.48Å; L225-W298 HydrophobicContact CD2-CB 3.84Å; L225-W298 HydrophobicContact CD2-CD2 4.43Å; L225-W298 HydrophobicContact CD2-CG 4Å
226	R	98.2	Very high	95.5	Very high	51 Å²	51	50.1 Å²	50.1	19%	0.192	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	118.3	175.8	-179.3	-176.9	-60.8	114.1	3.8	110.6	V213 T214 H216 W228 W268 A269 A270	V213-R226 WeakPolarHBondContact CA-O 3.36Å; T214-R226 PolarHBondContact N-O 3.19Å; T214-R226 PolarHBondContact O-N 2.82Å; T214-R226 WeakPolarHBondContact OG1-CB 3.2Å; T214-R226 PolarHBondContact OG1-O 3.05Å; T214-R226 VanDerWaalsContact OG1-O 3.11Å; H216-R226 PolarHBondContact CE1-NH1 3.26Å; H216-R226 VanDerWaalsContact CE1-NH1 3.32Å; R226-W228 HydrophobicContact CG-CZ2 4.42Å; R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.1Å; R226-W268 HydrophobicContact CG-CE3 3.87Å; R226-W268 HydrophobicContact CG-CG 4.21Å; R226-A269 WeakPolarHBondContact CA-O 3.34Å; R226-A270 HydrophobicContact CB-CB 4.01Å; R226-A270 HydrophobicContact CG-CB 4.15Å
227	C	98.3	Very high	95.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	122.3	175.6	-173	0	0	0	0	109.5	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.41Å; C227-W241 HydrophobicContact CB-CH2 4.44Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; C227-W268 CarbonylContact O-C 3.6Å; C227-W268 WeakPolarHBondContact O-CA 3.42Å; C227-W268 WeakPolarHBondContact O-CB 3.4Å; C227-A269 PolarHBondContact N-O 2.98Å; C227-A269 PolarHBondContact O-N 3.02Å; C227-C283 HydrophobicContact CB-CB 3.52Å; C227-C283 WeakPolarHBondContact CB-SG 3.49Å; C227-C283 WeakPolarHBondContact SG-CB 3.22Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 2.84Å
228	W	98.4	Very high	95.8	Very high	49 Å²	49	44.1 Å²	44.1	19%	0.186	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	141.6	-179.9	-69.1	89.6	0	0	0	110.5	T211 H212 T214 R226 L230 W268	T211-W228 WeakPolarHBondContact CA-O 3.04Å; T211-W228 WeakPolarHBondContact CB-O 3.33Å; H212-W228 AromaticContact CD2-CD1 4Å; H212-W228 VanDerWaalsContact CE1-CB 3.42Å; H212-W228 WeakPolarHBondContact CE1-CB 3.44Å; H212-W228 AromaticContact CE1-CD1 3.91Å; H212-W228 AromaticContact CE1-CG 3.68Å; H212-W228 PolarHBondContact N-O 2.91Å; H212-W228 AromaticContact NE2-CD1 3.49Å; H212-W228 AromaticContact NE2-CG 3.73Å; H212-W228 PolarHBondContact O-N 3.3Å; T214-W228 PolarHBondContact OG1-NE1 2.74Å; R226-W228 HydrophobicContact CG-CZ2 4.42Å; W228-L230 HydrophobicContact CE3-CD2 3.9Å; W228-L230 HydrophobicContact CZ3-CD2 4.46Å; W228-W268 HydrophobicContact CD2-CB 3.97Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.86Å; W228-W268 AromaticContact CE3-CD1 3.85Å; W228-W268 HydrophobicContact CE3-CG 4.16Å; W228-W268 HydrophobicContact CG-CB 4.39Å; W228-W268 AromaticContact CH2-CD1 3.67Å; W228-W268 HydrophobicContact CH2-CG 4.29Å; W228-W268 HydrophobicContact CZ3-CB 4.29Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.08Å
229	A	98.4	Very high	96.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.8	162.1	0	0	0	0	0	107.7	P209 T211 F232 I237 L239 Q266 K267	P209-A229 HydrophobicContact CB-CB 3.86Å; T211-A229 HydrophobicContact CG2-CB 4.26Å; A229-F232 HydrophobicContact CB-CD1 4.05Å; A229-F232 HydrophobicContact CB-CE1 3.79Å; A229-F232 WeakPolarHBondContact O-CE1 3.42Å; A229-I237 HydrophobicContact CB-CD1 3.68Å; A229-L239 HydrophobicContact CB-CD1 4.02Å; A229-L239 HydrophobicContact CB-CD2 4.18Å; A229-Q266 VanDerWaalsContact O-CA 3.3Å; A229-Q266 WeakPolarHBondContact O-CA 3.46Å; A229-K267 PolarHBondContact N-O 3.07Å; A229-K267 PolarHBondContact O-N 2.89Å; A229-K267 VanDerWaalsContact O-O 3.08Å
230	L	98.3	Very high	96.3	Very high	54 Å²	54	39.4 Å²	39.4	28%	0.283	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147	-174.9	-58.4	176.7	0	0	0	110.9	K210 W228 Q266	K210-L230 WeakPolarHBondContact CB-O 3.14Å; K210-L230 PolarHBondContact N-O 2.87Å; K210-L230 PolarHBondContact O-N 3.4Å; W228-L230 HydrophobicContact CE3-CD2 3.9Å; W228-L230 HydrophobicContact CZ3-CD2 4.46Å; L230-Q266 HydrophobicContact CD2-CB 3.56Å
231	G	97.4	Very high	96.8	Very high	17 Å²	17	32.3 Å²	32.3	18%	0.175	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	67.8	37.9	168.7	0	0	0	0	0	113.4	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.35Å; G231-F265 PolarHBondContact N-O 2.76Å
232	F	97.3	Very high	97	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	155	178.9	59	-90.6	0	0	0	112.3	E207 P209 A229 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.2Å; E207-F232 WeakPolarHBondContact O-CB 3.24Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.9Å; P209-F232 HydrophobicContact CB-CG 4.15Å; A229-F232 HydrophobicContact CB-CD1 4.05Å; A229-F232 HydrophobicContact CB-CE1 3.79Å; A229-F232 WeakPolarHBondContact O-CE1 3.42Å; F232-P234 WeakPolarHBondContact CD2-O 3.28Å; F232-I237 HydrophobicContact CD1-CD1 3.88Å; F232-I237 HydrophobicContact CD2-CB 4.28Å; F232-I237 HydrophobicContact CD2-CD1 3.96Å; F232-I237 HydrophobicContact CE1-CD1 3.78Å; F232-I237 HydrophobicContact CE1-CG2 4.45Å; F232-I237 HydrophobicContact CE2-CB 3.75Å; F232-I237 HydrophobicContact CE2-CD1 3.89Å; F232-I237 HydrophobicContact CE2-CG1 4.4Å; F232-I237 HydrophobicContact CE2-CG2 3.57Å; F232-I237 HydrophobicContact CG-CD1 3.98Å; F232-I237 HydrophobicContact CZ-CB 4.14Å; F232-I237 HydrophobicContact CZ-CD1 3.82Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; F232-T257 HydrophobicContact CE2-CG2 4.12Å; F232-T257 HydrophobicContact CZ-CG2 3.97Å; F232-T264 WeakPolarHBondContact O-CA 2.99Å; F232-F265 WeakPolarHBondContact CD1-O 3.3Å; F232-F265 HydrophobicContact CD2-CB 3.93Å; F232-F265 HydrophobicContact CE1-CB 4.31Å; F232-F265 WeakPolarHBondContact CE1-O 3.48Å; F232-F265 HydrophobicContact CE2-CB 3.47Å; F232-F265 VanDerWaalsContact CE2-CB 3.47Å; F232-F265 HydrophobicContact CE2-CG 4.48Å; F232-F265 HydrophobicContact CG-CB 4.5Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 3.34Å; F232-F265 PolarHBondContact O-N 3.47Å; F232-K267 HydrophobicContact CE1-CB 4.42Å; F232-K267 HydrophobicContact CZ-CB 4.13Å; F232-H287 AromaticContact CD2-CD2 3.85Å; F232-H287 AromaticContact CD2-NE2 3.7Å
233	Y	95.6	Very high	97	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.016	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-150.7	135.4	174	178.8	-84.9	0	0	0	108.8	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.41Å; T55-Y233 PolarHBondContact OG1-OH 3.35Å; R205-Y233 HydrophobicContact CG-CD1 4.18Å; R205-Y233 WeakPolarHBondContact O-CD1 3.3Å; A206-Y233 CarbonylContact C-O 3.51Å; A206-Y233 WeakPolarHBondContact CA-O 3.05Å; E207-Y233 PolarHBondContact N-O 2.97Å; E207-Y233 PolarHBondContact O-N 3Å; E207-Y233 VanDerWaalsContact O-N 3.09Å; Y233-G263 WeakPolarHBondContact CD2-O 3.35Å; Y233-F265 HydrophobicContact CD2-CD2 4.46Å; Y233-F265 AromaticContact CD2-CE2 3.99Å; Y233-F265 HydrophobicContact CD2-CE2 3.99Å; Y233-F265 HydrophobicContact CE2-CE2 4.44Å; Y233-H287 PolarHBondContact O-CE1 3.49Å
234	P	95.2	Very high	96.9	Very high	16 Å²	16	31 Å²	31	10%	0.104	16%	0.158	C	C	.	.	S	Bend	cis	-71.9	178.4	2.6	30.2	-36.5	0	0	0	113.4	D54 F232 E236 H287 E288	D54-P234 VanDerWaalsContact OD2-CB 3.26Å; D54-P234 WeakPolarHBondContact OD2-CB 3.46Å; F232-P234 WeakPolarHBondContact CD2-O 3.28Å; P234-E236 VanDerWaalsContact C-N 3.31Å; P234-E236 PolarHBondContact O-N 3.03Å; P234-H287 PolarHBondContact O-NE2 2.04Å; P234-E288 WeakPolarHBondContact CG-OE2 3.5Å
235	A	96.2	Very high	96.6	Very high	13 Å²	13	32.3 Å²	32.3	11%	0.107	18%	0.175	C	C	.	.	S	Bend	trans	-69.6	-26.8	-175.6	0	0	0	0	0	113.6	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.25Å; D54-A235 PolarHBondContact OD2-N 2.97Å; A235-I237 PolarHBondContact O-N 2.88Å; A235-T257 HydrophobicContact CB-CG2 4.3Å; A235-T257 WeakPolarHBondContact O-CG2 3.41Å; A235-F265 HydrophobicContact CB-CD1 3.68Å; A235-F265 HydrophobicContact CB-CD2 3.67Å; A235-F265 HydrophobicContact CB-CE1 3.65Å; A235-F265 HydrophobicContact CB-CE2 3.66Å; A235-F265 HydrophobicContact CB-CG 3.71Å; A235-F265 HydrophobicContact CB-CZ 3.66Å
236	E	95.3	Very high	96.4	Very high	113 Å²	113	38.4 Å²	38.4	53%	0.528	20%	0.204	S	C	.	.			trans	-64.7	117.9	-179.7	-170.5	57.5	-141.4	0	0	110	W23 P234 H287	W23-E236 HydrophobicContact CD2-CG 4.47Å; W23-E236 HydrophobicContact CE3-CG 4.33Å; W23-E236 HydrophobicContact CH2-CB 4.4Å; W23-E236 HydrophobicContact CH2-CG 3.51Å; W23-E236 HydrophobicContact CZ2-CG 3.63Å; W23-E236 HydrophobicContact CZ3-CB 4.33Å; W23-E236 HydrophobicContact CZ3-CG 3.85Å; W23-E236 WeakPolarHBondContact CZ3-O 3.2Å; P234-E236 VanDerWaalsContact C-N 3.31Å; P234-E236 PolarHBondContact O-N 3.03Å; E236-H287 PolarHBondContact O-CD2 2.91Å
237	I	96.1	Very high	96.2	Very high	9 Å²	9	40.4 Å²	40.4	5%	0.046	22%	0.218	C	C	.	.			trans	-154.1	142.5	-176.6	-164.2	171.6	0	0	0	109.6	P209 A229 F232 A235 L239 K267 V285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.01Å; P209-I237 HydrophobicContact CG-CD1 4.11Å; A229-I237 HydrophobicContact CB-CD1 3.68Å; F232-I237 HydrophobicContact CD1-CD1 3.88Å; F232-I237 HydrophobicContact CD2-CB 4.28Å; F232-I237 HydrophobicContact CD2-CD1 3.96Å; F232-I237 HydrophobicContact CE1-CD1 3.78Å; F232-I237 HydrophobicContact CE1-CG2 4.45Å; F232-I237 HydrophobicContact CE2-CB 3.75Å; F232-I237 HydrophobicContact CE2-CD1 3.89Å; F232-I237 HydrophobicContact CE2-CG1 4.4Å; F232-I237 HydrophobicContact CE2-CG2 3.57Å; F232-I237 HydrophobicContact CG-CD1 3.98Å; F232-I237 HydrophobicContact CZ-CB 4.14Å; F232-I237 HydrophobicContact CZ-CD1 3.82Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; A235-I237 PolarHBondContact O-N 2.88Å; I237-L239 HydrophobicContact CB-CD1 4.5Å; I237-L239 HydrophobicContact CD1-CD1 3.68Å; I237-L239 HydrophobicContact CG1-CD1 3.68Å; I237-L239 HydrophobicContact CG2-CD1 4.11Å; I237-K267 HydrophobicContact CG2-CB 4.24Å; I237-K267 HydrophobicContact CG2-CD 3.64Å; I237-V285 HydrophobicContact CD1-CG1 4Å; I237-V285 HydrophobicContact CG1-CG1 4.33Å; I237-Q286 VanDerWaalsContact CG1-O 3.28Å; I237-Q286 WeakPolarHBondContact CG1-O 3.44Å; I237-H287 HydrophobicContact CD1-CB 4.31Å; I237-H287 HydrophobicContact CG1-CB 4.06Å
238	T	97	Very high	95.9	Very high	44 Å²	44	41.9 Å²	41.9	27%	0.27	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.5	174.6	-62.5	0	0	0	0	110.5	T240 V285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.08Å; T238-V285 WeakPolarHBondContact O-CA 3.24Å; T238-Q286 PolarHBondContact N-O 3.39Å; T238-Q286 PolarHBondContact O-N 2.99Å
239	L	97.6	Very high	95.5	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.037	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.3	172.9	-86.6	63.9	0	0	0	108.7	A229 I237 L254 K267 A269 H284 V285	A229-L239 HydrophobicContact CB-CD1 4.02Å; A229-L239 HydrophobicContact CB-CD2 4.18Å; I237-L239 HydrophobicContact CB-CD1 4.5Å; I237-L239 HydrophobicContact CD1-CD1 3.68Å; I237-L239 HydrophobicContact CG1-CD1 3.68Å; I237-L239 HydrophobicContact CG2-CD1 4.11Å; L239-L254 HydrophobicContact CB-CD1 4.14Å; L239-K267 HydrophobicContact CD1-CD 4.34Å; L239-K267 HydrophobicContact CD2-CB 4.41Å; L239-A269 HydrophobicContact CB-CB 4.04Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; L239-H284 WeakPolarHBondContact CA-O 3.48Å; L239-V285 HydrophobicContact CD1-CG1 4.09Å; L239-V285 HydrophobicContact CG-CG2 4.31Å
240	T	97.3	Very high	95	Very high	39 Å²	39	53.8 Å²	53.8	24%	0.239	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.3	178.3	48.5	0	0	0	0	111.1	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.08Å; T240-C283 CarbonylContact O-C 3.56Å; T240-C283 WeakPolarHBondContact O-CA 3.5Å; T240-H284 PolarHBondContact N-O 3.13Å; T240-H284 PolarHBondContact O-N 3.14Å; T240-H284 WeakPolarHBondContact OG1-CB 3.27Å
241	W	97.9	Very high	94.5	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.7	169	-82.2	107.3	0	0	0	109.9	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.86Å; V213-W241 HydrophobicContact CG1-CZ2 4.33Å; V213-W241 HydrophobicContact CG2-CH2 4.25Å; L225-W241 HydrophobicContact CB-CH2 3.73Å; L225-W241 HydrophobicContact CB-CZ2 3.8Å; L225-W241 HydrophobicContact CD1-CH2 4.07Å; L225-W241 HydrophobicContact CD1-CZ3 4.25Å; C227-W241 HydrophobicContact CB-CH2 4.44Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; W241-Q248 HydrophobicContact CB-CB 4.25Å; W241-Q248 PolarHBondContact O-N 3.01Å; W241-A269 PolarHBondContact NE1-O 2.99Å; W241-V271 HydrophobicContact CB-CG1 4.38Å; W241-V271 HydrophobicContact CD2-CG1 3.64Å; W241-V271 HydrophobicContact CE3-CG1 4.08Å; W241-V271 HydrophobicContact CG-CB 4.18Å; W241-V271 HydrophobicContact CG-CG1 3.77Å; W241-V271 HydrophobicContact CZ2-CG1 4.35Å; W241-T282 WeakPolarHBondContact CA-O 3.34Å; W241-T282 VanDerWaalsContact CE3-C 3.41Å; W241-C283 HydrophobicContact CD2-CB 4.11Å; W241-C283 HydrophobicContact CE3-CB 4.01Å; W241-C283 HydrophobicContact CH2-CB 3.92Å; W241-C283 HydrophobicContact CZ2-CB 4.04Å; W241-C283 HydrophobicContact CZ3-CB 3.9Å
242	Q	97.3	Very high	94.4	Very high	37 Å²	37	56.8 Å²	56.8	17%	0.173	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146	172.9	-68.4	-173.6	-9.5	0	0	110.5	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.55Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.34Å; Q242-D247 VanDerWaalsContact CG-OD1 3.25Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.4Å; Q242-D247 PolarHBondContact NE2-OD1 2.92Å; Q242-Y281 CarbonylContact O-C 3.56Å; Q242-Y281 VanDerWaalsContact O-CA 3.27Å; Q242-Y281 WeakPolarHBondContact O-CA 3.37Å; Q242-T282 PolarHBondContact N-O 2.76Å; Q242-T282 PolarHBondContact O-N 2.84Å; Q242-H284 PolarHBondContact OE1-NE2 2.81Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.11Å
243	W	95.6	Very high	94.3	Very high	74 Å²	74	62.1 Å²	62.1	28%	0.28	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.1	169.9	176.3	75.9	0	0	0	108.4	G245 E246 Q248 E277 R280 Y281	W243-G245 PolarHBondContact O-N 2.79Å; W243-E246 PolarHBondContact N-O 3.18Å; W243-E246 PolarHBondContact O-N 3.03Å; W243-Q248 HydrophobicContact CB-CG 3.98Å; W243-E277 PolarHBondContact NE1-OE2 3Å; W243-R280 VanDerWaalsContact CE2-NH2 3.28Å; W243-R280 VanDerWaalsContact NE1-CZ 3.29Å; W243-Y281 HydrophobicContact CB-CD1 4.21Å; W243-Y281 HydrophobicContact CB-CE1 3.97Å; W243-Y281 AromaticContact CD1-CD2 3.99Å; W243-Y281 AromaticContact CD1-CE2 3.54Å; W243-Y281 AromaticContact CD1-CZ 3.55Å; W243-Y281 HydrophobicContact CG-CE1 4.28Å
244	D	92.9	Very high	94.4	Very high	102 Å²	102	66.1 Å²	66.1	55%	0.545	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	30.6	-173	-69.4	-22.5	0	0	0	114.6	R280	D244-R280 PolarHBondContact N-O 2.68Å; D244-R280 IonicContact OD1-NE 3.73Å; D244-R280 IonicContact OD2-CZ 3.18Å; D244-R280 IonicContact OD2-NE 2.88Å; D244-R280 PolarHBondContact OD2-NE 2.7Å; D244-R280 IonicContact OD2-NH2 2.65Å; D244-R280 PolarHBondContact OD2-NH2 2.97Å
245	G	89.6	Confident	94.4	Very high	48 Å²	48	67 Å²	67	50%	0.495	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	0.1	-179.9	0	0	0	0	0	115.4	W243	W243-G245 PolarHBondContact O-N 2.79Å
246	E	93.9	Very high	94.4	Very high	127 Å²	127	74 Å²	74	59%	0.593	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	126.8	175.6	-63	-170.8	168.7	0	0	111.7	Q242 W243 Q248	Q242-E246 CarbonylContact C-O 3.55Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.34Å; W243-E246 PolarHBondContact N-O 3.18Å; W243-E246 PolarHBondContact O-N 3.03Å; E246-Q248 PolarHBondContact O-NE2 3.17Å
247	D	93.8	Very high	94.6	Very high	94 Å²	94	70.7 Å²	70.7	50%	0.503	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	132.3	-178.7	-68.8	-22.9	0	0	0	112.4	Q242	Q242-D247 VanDerWaalsContact CG-OD1 3.25Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.4Å; Q242-D247 PolarHBondContact NE2-OD1 2.92Å
248	Q	93.8	Very high	94.6	Very high	30 Å²	30	75.1 Å²	75.1	14%	0.14	39%	0.389	C	S	.	.			trans	-103.6	38.5	-177.1	-58.9	-60.4	-64.1	0	0	112.3	W241 W243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.25Å; W241-Q248 PolarHBondContact O-N 3.01Å; W243-Q248 HydrophobicContact CB-CG 3.98Å; E246-Q248 PolarHBondContact O-NE2 3.17Å; Q248-Q250 VanDerWaalsContact C-N 3.31Å; Q248-Q250 PolarHBondContact O-N 3.36Å; Q248-D251 PolarHBondContact O-N 3.38Å; Q248-T252 WeakPolarHBondContact O-CB 3.49Å; Q248-T252 PolarHBondContact O-N 3.38Å; Q248-T252 VanDerWaalsContact O-N 3.08Å; Q248-T252 PolarHBondContact O-OG1 3.18Å; Q248-Y281 HydrophobicContact CG-CE1 4.39Å
249	T	88.3	Confident	94.6	Very high	108 Å²	108	77.5 Å²	77.5	66%	0.663	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-36.1	-169.1	-47.5	0	0	0	0	113.9
250	Q	88.6	Confident	94.6	Very high	191 Å²	191	79.5 Å²	79.5	89%	0.893	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-32.4	-178.1	-66.5	-173.8	4.6	0	0	113	Q248 T252	Q248-Q250 VanDerWaalsContact C-N 3.31Å; Q248-Q250 PolarHBondContact O-N 3.36Å; Q250-T252 VanDerWaalsContact C-N 3.35Å
251	D	87.6	Confident	94.4	Very high	111 Å²	111	81.3 Å²	81.3	59%	0.594	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	0.2	-177.9	-55.9	-57.9	0	0	0	112.5	Q248	Q248-D251 PolarHBondContact O-N 3.38Å
252	T	94.6	Very high	94.1	Very high	23 Å²	23	86.7 Å²	86.7	14%	0.141	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.1	179	-64.4	0	0	0	0	110.9	Q248 Q250 L254 A269 A270	Q248-T252 WeakPolarHBondContact O-CB 3.49Å; Q248-T252 PolarHBondContact O-N 3.38Å; Q248-T252 VanDerWaalsContact O-N 3.08Å; Q248-T252 PolarHBondContact O-OG1 3.18Å; Q250-T252 VanDerWaalsContact C-N 3.35Å; T252-L254 HydrophobicContact CG2-CB 4.41Å; T252-L254 PolarHBondContact O-N 3.24Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; T252-A270 CarbonylContact C-O 3.57Å; T252-A270 VanDerWaalsContact CA-O 3.32Å; T252-A270 WeakPolarHBondContact CA-O 3.42Å
253	E	96.6	Very high	93.8	Very high	113 Å²	113	86.9 Å²	86.9	53%	0.528	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	105.8	163	-173.9	-173.8	-171.5	0	0	109	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.26Å; E253-W268 HydrophobicContact CG-CH2 3.93Å; E253-W268 HydrophobicContact CG-CZ3 3.87Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.37Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.49Å; E253-A269 CarbonylContact O-C 3.6Å; E253-A269 WeakPolarHBondContact O-CA 3.39Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 2.98Å; E253-A270 PolarHBondContact O-N 2.8Å
254	L	96.6	Very high	93.9	Very high	88 Å²	88	83.8 Å²	83.8	46%	0.461	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.2	177.4	-173.9	68	0	0	0	109.9	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.14Å; T252-L254 HydrophobicContact CG2-CB 4.41Å; T252-L254 PolarHBondContact O-N 3.24Å; L254-K267 HydrophobicContact CD1-CD 4.41Å; L254-A269 HydrophobicContact CD1-CB 3.67Å
255	V	96.6	Very high	94.1	Very high	34 Å²	34	80.2 Å²	80.2	21%	0.206	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-85.6	153.9	174.6	-64.6	0	0	0	0	112.2	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.44Å; V255-K267 VanDerWaalsContact O-CE 3.26Å; V255-K267 WeakPolarHBondContact O-CE 3.21Å; V255-K267 WeakPolarHBondContact O-CG 3.33Å; V255-K267 PolarHBondContact O-NZ 3.4Å; V255-W268 HydrophobicContact CB-CD2 4.49Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.96Å; V255-W268 HydrophobicContact CG1-CE3 4.26Å; V255-W268 HydrophobicContact CG1-CH2 3.56Å; V255-W268 HydrophobicContact CG1-CZ2 3.17Å; V255-W268 HydrophobicContact CG1-CZ3 4.06Å; V255-W268 HydrophobicContact CG2-CD2 3.74Å; V255-W268 HydrophobicContact CG2-CE3 4.46Å; V255-W268 HydrophobicContact CG2-CG 3.72Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.34Å; V255-W268 PolarHBondContact N-O 2.84Å
256	E	96.4	Very high	94.5	Very high	161 Å²	161	80 Å²	80	75%	0.752	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-57.7	147	168.3	-67.3	-57.3	157.2	0	0	111.8	R258	E256-R258 PolarHBondContact O-N 3.39Å
257	T	97.7	Very high	94.8	Very high	42 Å²	42	74.7 Å²	74.7	26%	0.258	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-66.9	130.9	174	-56.6	0	0	0	0	108.5	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.12Å; F232-T257 HydrophobicContact CZ-CG2 3.97Å; A235-T257 HydrophobicContact CB-CG2 4.3Å; A235-T257 WeakPolarHBondContact O-CG2 3.41Å; T257-F265 HydrophobicContact CG2-CB 3.8Å; T257-F265 HydrophobicContact CG2-CD1 3.92Å; T257-F265 HydrophobicContact CG2-CG 4.14Å; T257-K267 WeakPolarHBondContact OG1-CD 3.35Å; T257-K267 PolarHBondContact OG1-NZ 3.28Å
258	R	97.2	Very high	95	Very high	102 Å²	102	71.5 Å²	71.5	39%	0.385	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	145	-175	68.5	-169	-179.7	176.2	5.3	111.4	E256 F265 Q266	E256-R258 PolarHBondContact O-N 3.39Å; R258-F265 WeakPolarHBondContact O-CA 3.2Å; R258-Q266 HydrophobicContact CG-CG 3.57Å; R258-Q266 PolarHBondContact N-O 3.45Å; R258-Q266 WeakPolarHBondContact O-CG 3.39Å; R258-Q266 PolarHBondContact O-N 3.07Å
259	P	97.1	Very high	95.2	Very high	94 Å²	94	70 Å²	70	61%	0.61	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	145.4	177.7	28.5	-34.6	0	0	0	111	F265	P259-F265 HydrophobicContact CB-CE1 4.33Å
260	A	96.6	Very high	95.6	Very high	49 Å²	49	65 Å²	65	41%	0.405	36%	0.364	S	S	.	.			trans	-88.6	-18.7	173.1	0	0	0	0	0	112.8	D262 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.43Å; A260-T264 WeakPolarHBondContact CB-O 3.46Å; A260-T264 PolarHBondContact N-O 2.81Å
261	G	93.1	Very high	96.1	Very high	78 Å²	78	56 Å²	56	80%	0.804	32%	0.322	S	S	*	.	S	Bend	trans	97.8	-5.1	178.6	0	0	0	0	0	114.9
262	D	92.6	Very high	96.5	Very high	114 Å²	114	54.4 Å²	54.4	61%	0.61	32%	0.316	S	S	*	.	S	Bend	trans	-107.9	13.8	176.6	60.3	0.5	0	0	0	112.9	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.43Å; D262-T264 WeakPolarHBondContact OD1-CB 3.21Å; D262-T264 PolarHBondContact OD1-N 3.47Å; D262-T264 PolarHBondContact OD1-OG1 3.1Å
263	G	91.5	Very high	96.6	Very high	42 Å²	42	53.4 Å²	53.4	43%	0.433	31%	0.31	S	S	.	.	S	Bend	trans	89.1	-2.8	-173.8	0	0	0	0	0	114.2	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.35Å
264	T	96.6	Very high	96.5	Very high	8 Å²	8	50.5 Å²	50.5	5%	0.049	30%	0.301	C	S	.	.			trans	-104.3	172.8	175.1	74.7	0	0	0	0	112.7	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.35Å; F232-T264 WeakPolarHBondContact O-CA 2.99Å; A260-T264 WeakPolarHBondContact CB-O 3.46Å; A260-T264 PolarHBondContact N-O 2.81Å; D262-T264 WeakPolarHBondContact OD1-CB 3.21Å; D262-T264 PolarHBondContact OD1-N 3.47Å; D262-T264 PolarHBondContact OD1-OG1 3.1Å
265	F	98.1	Very high	96.3	Very high	27 Å²	27	49 Å²	49	12%	0.118	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	163.1	-177.6	-63.5	-86.5	0	0	0	112.5	D54 G231 F232 Y233 A235 T257 R258 P259	D54-F265 HydrophobicContact CB-CE2 3.79Å; D54-F265 HydrophobicContact CB-CZ 3.73Å; G231-F265 PolarHBondContact N-O 2.76Å; F232-F265 WeakPolarHBondContact CD1-O 3.3Å; F232-F265 HydrophobicContact CD2-CB 3.93Å; F232-F265 HydrophobicContact CE1-CB 4.31Å; F232-F265 WeakPolarHBondContact CE1-O 3.48Å; F232-F265 HydrophobicContact CE2-CB 3.47Å; F232-F265 VanDerWaalsContact CE2-CB 3.47Å; F232-F265 HydrophobicContact CE2-CG 4.48Å; F232-F265 HydrophobicContact CG-CB 4.5Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 3.34Å; F232-F265 PolarHBondContact O-N 3.47Å; Y233-F265 HydrophobicContact CD2-CD2 4.46Å; Y233-F265 AromaticContact CD2-CE2 3.99Å; Y233-F265 HydrophobicContact CD2-CE2 3.99Å; Y233-F265 HydrophobicContact CE2-CE2 4.44Å; A235-F265 HydrophobicContact CB-CD1 3.68Å; A235-F265 HydrophobicContact CB-CD2 3.67Å; A235-F265 HydrophobicContact CB-CE1 3.65Å; A235-F265 HydrophobicContact CB-CE2 3.66Å; A235-F265 HydrophobicContact CB-CG 3.71Å; A235-F265 HydrophobicContact CB-CZ 3.66Å; T257-F265 HydrophobicContact CG2-CB 3.8Å; T257-F265 HydrophobicContact CG2-CD1 3.92Å; T257-F265 HydrophobicContact CG2-CG 4.14Å; R258-F265 WeakPolarHBondContact O-CA 3.2Å; P259-F265 HydrophobicContact CB-CE1 4.33Å
266	Q	98.2	Very high	96	Very high	43 Å²	43	50.6 Å²	50.6	20%	0.201	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	145.1	174.6	43.4	168.3	-22.2	0	0	110.2	A229 L230 R258	A229-Q266 VanDerWaalsContact O-CA 3.3Å; A229-Q266 WeakPolarHBondContact O-CA 3.46Å; L230-Q266 HydrophobicContact CD2-CB 3.56Å; R258-Q266 HydrophobicContact CG-CG 3.57Å; R258-Q266 PolarHBondContact N-O 3.45Å; R258-Q266 WeakPolarHBondContact O-CG 3.39Å; R258-Q266 PolarHBondContact O-N 3.07Å
267	K	98.5	Very high	95.9	Very high	17 Å²	17	46 Å²	46	7%	0.074	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	154.6	176.8	-161.5	-176.5	-171.7	70.3	0	109	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 3.07Å; A229-K267 PolarHBondContact O-N 2.89Å; A229-K267 VanDerWaalsContact O-O 3.08Å; F232-K267 HydrophobicContact CE1-CB 4.42Å; F232-K267 HydrophobicContact CZ-CB 4.13Å; I237-K267 HydrophobicContact CG2-CB 4.24Å; I237-K267 HydrophobicContact CG2-CD 3.64Å; L239-K267 HydrophobicContact CD1-CD 4.34Å; L239-K267 HydrophobicContact CD2-CB 4.41Å; L254-K267 HydrophobicContact CD1-CD 4.41Å; V255-K267 HydrophobicContact CG2-CG 4.44Å; V255-K267 VanDerWaalsContact O-CE 3.26Å; V255-K267 WeakPolarHBondContact O-CE 3.21Å; V255-K267 WeakPolarHBondContact O-CG 3.33Å; V255-K267 PolarHBondContact O-NZ 3.4Å; T257-K267 WeakPolarHBondContact OG1-CD 3.35Å; T257-K267 PolarHBondContact OG1-NZ 3.28Å
268	W	98.3	Very high	95.7	Very high	26 Å²	26	44.9 Å²	44.9	10%	0.098	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	156.1	169.5	59.5	-99	0	0	0	111.7	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.1Å; R226-W268 HydrophobicContact CG-CE3 3.87Å; R226-W268 HydrophobicContact CG-CG 4.21Å; C227-W268 CarbonylContact O-C 3.6Å; C227-W268 WeakPolarHBondContact O-CA 3.42Å; C227-W268 WeakPolarHBondContact O-CB 3.4Å; W228-W268 HydrophobicContact CD2-CB 3.97Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.86Å; W228-W268 AromaticContact CE3-CD1 3.85Å; W228-W268 HydrophobicContact CE3-CG 4.16Å; W228-W268 HydrophobicContact CG-CB 4.39Å; W228-W268 AromaticContact CH2-CD1 3.67Å; W228-W268 HydrophobicContact CH2-CG 4.29Å; W228-W268 HydrophobicContact CZ3-CB 4.29Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.08Å; E253-W268 HydrophobicContact CB-CZ3 4.26Å; E253-W268 HydrophobicContact CG-CH2 3.93Å; E253-W268 HydrophobicContact CG-CZ3 3.87Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.37Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.49Å; V255-W268 HydrophobicContact CB-CD2 4.49Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.96Å; V255-W268 HydrophobicContact CG1-CE3 4.26Å; V255-W268 HydrophobicContact CG1-CH2 3.56Å; V255-W268 HydrophobicContact CG1-CZ2 3.17Å; V255-W268 HydrophobicContact CG1-CZ3 4.06Å; V255-W268 HydrophobicContact CG2-CD2 3.74Å; V255-W268 HydrophobicContact CG2-CE3 4.46Å; V255-W268 HydrophobicContact CG2-CG 3.72Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.34Å; V255-W268 PolarHBondContact N-O 2.84Å; W268-A270 HydrophobicContact CE3-CB 3.93Å; W268-A270 HydrophobicContact CZ3-CB 3.61Å
269	A	98.3	Very high	95.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.2	174.2	0	0	0	0	0	108.6	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.34Å; C227-A269 PolarHBondContact N-O 2.98Å; C227-A269 PolarHBondContact O-N 3.02Å; L239-A269 HydrophobicContact CB-CB 4.04Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; W241-A269 PolarHBondContact NE1-O 2.99Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; E253-A269 CarbonylContact O-C 3.6Å; E253-A269 WeakPolarHBondContact O-CA 3.39Å; L254-A269 HydrophobicContact CD1-CB 3.67Å
270	A	97.8	Very high	95.5	Very high	2 Å²	2	43.8 Å²	43.8	2%	0.017	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	146	179.4	0	0	0	0	0	112	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.92Å; L225-A270 CarbonylContact O-C 3.56Å; L225-A270 WeakPolarHBondContact O-CA 3.39Å; R226-A270 HydrophobicContact CB-CB 4.01Å; R226-A270 HydrophobicContact CG-CB 4.15Å; T252-A270 CarbonylContact C-O 3.57Å; T252-A270 VanDerWaalsContact CA-O 3.32Å; T252-A270 WeakPolarHBondContact CA-O 3.42Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 2.98Å; E253-A270 PolarHBondContact O-N 2.8Å; W268-A270 HydrophobicContact CE3-CB 3.93Å; W268-A270 HydrophobicContact CZ3-CB 3.61Å
271	V	97.5	Very high	95.6	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.018	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141.7	176	62.3	0	0	0	0	108.8	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.22Å; L225-V271 HydrophobicContact CB-CG1 4.23Å; L225-V271 PolarHBondContact N-O 3.44Å; L225-V271 PolarHBondContact O-N 3.29Å; W241-V271 HydrophobicContact CB-CG1 4.38Å; W241-V271 HydrophobicContact CD2-CG1 3.64Å; W241-V271 HydrophobicContact CE3-CG1 4.08Å; W241-V271 HydrophobicContact CG-CB 4.18Å; W241-V271 HydrophobicContact CG-CG1 3.77Å; W241-V271 HydrophobicContact CZ2-CG1 4.35Å; V271-V273 HydrophobicContact CG1-CG1 3.77Å; V271-V273 HydrophobicContact CG2-CG1 4.37Å; V271-Y281 HydrophobicContact CG1-CD1 4.05Å; V271-Y281 HydrophobicContact CG1-CE1 4.45Å; V271-Y281 HydrophobicContact CG2-CD1 4.45Å; V271-Y281 HydrophobicContact CG2-CE1 4.07Å
272	V	97	Very high	95.8	Very high	77 Å²	77	39.1 Å²	39.1	47%	0.467	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	128.6	171.4	-178.7	0	0	0	0	107.9	E222	E222-V272 HydrophobicContact CB-CG1 4.12Å; E222-V272 HydrophobicContact CG-CG1 4.32Å
273	V	96	Very high	96	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.5	-174.8	-52.2	0	0	0	0	110.6	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.44Å; A223-V273 HydrophobicContact CB-CG2 4.46Å; A223-V273 PolarHBondContact N-O 2.59Å; A223-V273 WeakPolarHBondContact O-CG2 3.5Å; A223-V273 PolarHBondContact O-N 2.58Å; L225-V273 HydrophobicContact CD1-CG1 4.02Å; L225-V273 HydrophobicContact CD1-CG2 4.07Å; L225-V273 HydrophobicContact CG-CG1 4.16Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; V271-V273 HydrophobicContact CG1-CG1 3.77Å; V271-V273 HydrophobicContact CG2-CG1 4.37Å; V273-E278 HydrophobicContact CG2-CG 3.91Å; V273-Y281 HydrophobicContact CB-CD2 3.94Å; V273-Y281 HydrophobicContact CB-CE2 3.59Å; V273-Y281 HydrophobicContact CG1-CD1 3.78Å; V273-Y281 HydrophobicContact CG1-CD2 3.53Å; V273-Y281 HydrophobicContact CG1-CE1 3.69Å; V273-Y281 HydrophobicContact CG1-CE2 3.46Å; V273-Y281 VanDerWaalsContact CG1-CE2 3.46Å; V273-Y281 HydrophobicContact CG1-CG 3.69Å
274	P	95.5	Very high	96.3	Very high	53 Å²	53	33.3 Å²	33.3	34%	0.344	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	140.1	170	-20.3	32.3	0	0	0	111.4	H221 G276 E277	H221-P274 WeakPolarHBondContact O-CA 3.47Å; P274-G276 PolarHBondContact O-N 2.86Å; P274-E277 HydrophobicContact CB-CB 4.33Å; P274-E277 HydrophobicContact CB-CG 4.16Å; P274-E277 PolarHBondContact O-N 3.41Å; P274-E277 VanDerWaalsContact O-N 3.07Å
275	S	91.7	Very high	96.4	Very high	57 Å²	57	33 Å²	33	40%	0.399	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	128.1	175.9	-64	0	0	0	0	111.2	H221 E222 E278	H221-S275 PolarHBondContact O-N 3.3Å; H221-S275 PolarHBondContact O-OG 2.93Å; E222-S275 PolarHBondContact N-OG 2.93Å; S275-E278 WeakPolarHBondContact CA-OE1 3.41Å
276	G	90.6	Very high	96.3	Very high	66 Å²	66	34.2 Å²	34.2	68%	0.68	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.1	-10.3	-176.7	0	0	0	0	0	114.8	P274 E278	P274-G276 PolarHBondContact O-N 2.86Å; G276-E278 WeakPolarHBondContact CA-OE2 3.44Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.9Å; G276-E278 PolarHBondContact N-OE2 3.24Å
277	E	94.4	Very high	96.2	Very high	64 Å²	64	32.7 Å²	32.7	30%	0.299	18%	0.182	S	C	.	.			trans	-97.7	3.1	176.2	-65.3	-158.2	-155.4	0	0	113.6	W243 P274 Q279 R280 Y281	W243-E277 PolarHBondContact NE1-OE2 3Å; P274-E277 HydrophobicContact CB-CB 4.33Å; P274-E277 HydrophobicContact CB-CG 4.16Å; P274-E277 PolarHBondContact O-N 3.41Å; P274-E277 VanDerWaalsContact O-N 3.07Å; E277-Q279 PolarHBondContact O-N 3.47Å; E277-R280 WeakPolarHBondContact O-CB 3.46Å; E277-R280 PolarHBondContact O-N 3.11Å; E277-R280 IonicContact OE1-NH1 3.91Å; E277-R280 IonicContact OE2-CZ 3.65Å; E277-R280 IonicContact OE2-NH1 2.72Å; E277-R280 PolarHBondContact OE2-NH1 3.07Å; E277-Y281 HydrophobicContact CB-CE2 4.36Å; E277-Y281 WeakPolarHBondContact O-CD2 3.35Å
278	E	94.3	Very high	95.8	Very high	20 Å²	20	35.6 Å²	35.6	9%	0.093	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-58.1	-29.2	-171	-56.4	82.6	179.1	0	0	113	H215 L225 V273 S275 G276 R280 Y281 W298	H215-E278 IonicContact NE2-OE1 3.69Å; L225-E278 HydrophobicContact CD1-CB 4.1Å; L225-E278 HydrophobicContact CD2-CB 4.45Å; L225-E278 HydrophobicContact CD2-CG 4.34Å; V273-E278 HydrophobicContact CG2-CG 3.91Å; S275-E278 WeakPolarHBondContact CA-OE1 3.41Å; G276-E278 WeakPolarHBondContact CA-OE2 3.44Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.9Å; G276-E278 PolarHBondContact N-OE2 3.24Å; E278-R280 VanDerWaalsContact C-N 3.3Å; E278-R280 PolarHBondContact O-N 2.72Å; E278-Y281 PolarHBondContact O-N 3.34Å; E278-W298 HydrophobicContact CB-CD2 4.44Å; E278-W298 HydrophobicContact CB-CE3 3.42Å; E278-W298 VanDerWaalsContact CB-CE3 3.42Å; E278-W298 HydrophobicContact CB-CZ3 3.8Å; E278-W298 HydrophobicContact CG-CE3 3.8Å; E278-W298 HydrophobicContact CG-CZ3 3.8Å
279	Q	94.3	Very high	95.5	Very high	89 Å²	89	34.9 Å²	34.9	42%	0.416	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-75.5	-15.6	-179.4	-63.6	-57	-51	0	0	114.1	E277 Y281 W298	E277-Q279 PolarHBondContact O-N 3.47Å; Q279-Y281 VanDerWaalsContact C-N 3.31Å; Q279-W298 PolarHBondContact NE2-O 3.35Å
280	R	95.8	Very high	95.3	Very high	83 Å²	83	36.1 Å²	36.1	31%	0.313	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-79	-19.4	174.1	-60.7	176.6	70.4	-170.8	2.4	112.1	W243 D244 E277 E278	W243-R280 VanDerWaalsContact CE2-NH2 3.28Å; W243-R280 VanDerWaalsContact NE1-CZ 3.29Å; D244-R280 PolarHBondContact N-O 2.68Å; D244-R280 IonicContact OD1-NE 3.73Å; D244-R280 IonicContact OD2-CZ 3.18Å; D244-R280 IonicContact OD2-NE 2.88Å; D244-R280 PolarHBondContact OD2-NE 2.7Å; D244-R280 IonicContact OD2-NH2 2.65Å; D244-R280 PolarHBondContact OD2-NH2 2.97Å; E277-R280 WeakPolarHBondContact O-CB 3.46Å; E277-R280 PolarHBondContact O-N 3.11Å; E277-R280 IonicContact OE1-NH1 3.91Å; E277-R280 IonicContact OE2-CZ 3.65Å; E277-R280 IonicContact OE2-NH1 2.72Å; E277-R280 PolarHBondContact OE2-NH1 3.07Å; E278-R280 VanDerWaalsContact C-N 3.3Å; E278-R280 PolarHBondContact O-N 2.72Å
281	Y	96.9	Very high	94.9	Very high	18 Å²	18	41.8 Å²	41.8	7%	0.071	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	128.4	179.4	-69.2	-95.2	0	0	0	111.3	Q242 W243 Q248 V271 V273 E277 E278 Q279	Q242-Y281 CarbonylContact O-C 3.56Å; Q242-Y281 VanDerWaalsContact O-CA 3.27Å; Q242-Y281 WeakPolarHBondContact O-CA 3.37Å; W243-Y281 HydrophobicContact CB-CD1 4.21Å; W243-Y281 HydrophobicContact CB-CE1 3.97Å; W243-Y281 AromaticContact CD1-CD2 3.99Å; W243-Y281 AromaticContact CD1-CE2 3.54Å; W243-Y281 AromaticContact CD1-CZ 3.55Å; W243-Y281 HydrophobicContact CG-CE1 4.28Å; Q248-Y281 HydrophobicContact CG-CE1 4.39Å; V271-Y281 HydrophobicContact CG1-CD1 4.05Å; V271-Y281 HydrophobicContact CG1-CE1 4.45Å; V271-Y281 HydrophobicContact CG2-CD1 4.45Å; V271-Y281 HydrophobicContact CG2-CE1 4.07Å; V273-Y281 HydrophobicContact CB-CD2 3.94Å; V273-Y281 HydrophobicContact CB-CE2 3.59Å; V273-Y281 HydrophobicContact CG1-CD1 3.78Å; V273-Y281 HydrophobicContact CG1-CD2 3.53Å; V273-Y281 HydrophobicContact CG1-CE1 3.69Å; V273-Y281 HydrophobicContact CG1-CE2 3.46Å; V273-Y281 VanDerWaalsContact CG1-CE2 3.46Å; V273-Y281 HydrophobicContact CG1-CG 3.69Å; E277-Y281 HydrophobicContact CB-CE2 4.36Å; E277-Y281 WeakPolarHBondContact O-CD2 3.35Å; E278-Y281 PolarHBondContact O-N 3.34Å; Q279-Y281 VanDerWaalsContact C-N 3.31Å
282	T	97.7	Very high	94.7	Very high	11 Å²	11	48.8 Å²	48.8	7%	0.067	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.5	174.5	46.3	0	0	0	0	110.7	W241 Q242 H284 T295 L296 R297	W241-T282 WeakPolarHBondContact CA-O 3.34Å; W241-T282 VanDerWaalsContact CE3-C 3.41Å; Q242-T282 PolarHBondContact N-O 2.76Å; Q242-T282 PolarHBondContact O-N 2.84Å; T282-H284 PolarHBondContact OG1-NE2 3.13Å; T282-T295 HydrophobicContact CG2-CG2 3.92Å; T282-L296 CarbonylContact C-O 3.6Å; T282-L296 WeakPolarHBondContact CA-O 3.44Å; T282-R297 HydrophobicContact CG2-CG 3.61Å; T282-R297 VanDerWaalsContact CG2-NE 3.28Å
283	C	98	Very high	94.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.6	169.7	173	0	0	0	0	109.5	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.52Å; C227-C283 WeakPolarHBondContact CB-SG 3.49Å; C227-C283 WeakPolarHBondContact SG-CB 3.22Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 2.84Å; T240-C283 CarbonylContact O-C 3.56Å; T240-C283 WeakPolarHBondContact O-CA 3.5Å; W241-C283 HydrophobicContact CD2-CB 4.11Å; W241-C283 HydrophobicContact CE3-CB 4.01Å; W241-C283 HydrophobicContact CH2-CB 3.92Å; W241-C283 HydrophobicContact CZ2-CB 4.04Å; W241-C283 HydrophobicContact CZ3-CB 3.9Å; C283-T295 CarbonylContact O-C 3.57Å; C283-T295 WeakPolarHBondContact O-CA 3.32Å; C283-L296 HydrophobicContact CB-CB 4.25Å; C283-L296 PolarHBondContact N-O 3.46Å; C283-L296 PolarHBondContact O-N 3.45Å
284	H	97.6	Very high	94.6	Very high	35 Å²	35	51.3 Å²	51.3	16%	0.162	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.5	176.7	-64.7	-104	0	0	0	109.7	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.48Å; T240-H284 PolarHBondContact N-O 3.13Å; T240-H284 PolarHBondContact O-N 3.14Å; T240-H284 WeakPolarHBondContact OG1-CB 3.27Å; Q242-H284 PolarHBondContact OE1-NE2 2.81Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.11Å; T282-H284 PolarHBondContact OG1-NE2 3.13Å; H284-L294 CarbonylContact C-O 3.54Å; H284-L294 WeakPolarHBondContact CA-O 3.49Å; H284-T295 PolarHBondContact CE1-OG1 3.42Å; H284-T295 PolarHBondContact ND1-OG1 3.04Å
285	V	97.8	Very high	94.7	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	121.6	-178.6	-174.4	0	0	0	0	109.1	P209 T211 I237 T238 L239 L290 P293 L294 L296	P209-V285 HydrophobicContact CG-CG1 3.95Å; T211-V285 HydrophobicContact CG2-CB 4.42Å; T211-V285 HydrophobicContact CG2-CG1 4.14Å; T211-V285 HydrophobicContact CG2-CG2 4.05Å; I237-V285 HydrophobicContact CD1-CG1 4Å; I237-V285 HydrophobicContact CG1-CG1 4.33Å; T238-V285 WeakPolarHBondContact O-CA 3.24Å; L239-V285 HydrophobicContact CD1-CG1 4.09Å; L239-V285 HydrophobicContact CG-CG2 4.31Å; V285-L290 HydrophobicContact CG1-CD1 4.23Å; V285-P293 WeakPolarHBondContact O-CA 3.28Å; V285-L294 HydrophobicContact CB-CB 4.33Å; V285-L294 PolarHBondContact N-O 3.1Å; V285-L294 PolarHBondContact O-N 2.82Å; V285-L296 HydrophobicContact CG2-CD1 3.83Å
286	Q	96.6	Very high	94.9	Very high	54 Å²	54	51.6 Å²	51.6	25%	0.252	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.1	174.5	-57.7	177.4	12.4	0	0	108.9	I237 T238 P293	I237-Q286 VanDerWaalsContact CG1-O 3.28Å; I237-Q286 WeakPolarHBondContact CG1-O 3.44Å; T238-Q286 PolarHBondContact N-O 3.39Å; T238-Q286 PolarHBondContact O-N 2.99Å; Q286-P293 HydrophobicContact CG-CB 3.98Å; Q286-P293 HydrophobicContact CG-CG 4.09Å
287	H	95.3	Very high	95.2	Very high	10 Å²	10	55.4 Å²	55.4	5%	0.046	28%	0.278	C	S	.	.			trans	-156.1	144.1	-177.9	-175	-101	0	0	0	108.7	E207 P209 F232 Y233 P234 E236 I237 G289 L290	E207-H287 PolarHBondContact O-CE1 3.12Å; P209-H287 HydrophobicContact CG-CB 4.09Å; F232-H287 AromaticContact CD2-CD2 3.85Å; F232-H287 AromaticContact CD2-NE2 3.7Å; Y233-H287 PolarHBondContact O-CE1 3.49Å; P234-H287 PolarHBondContact O-NE2 2.04Å; E236-H287 PolarHBondContact O-CD2 2.91Å; I237-H287 HydrophobicContact CD1-CB 4.31Å; I237-H287 HydrophobicContact CG1-CB 4.06Å; H287-G289 PolarHBondContact ND1-N 2.95Å; H287-G289 PolarHBondContact O-N 3.5Å; H287-L290 HydrophobicContact CB-CD1 3.97Å; H287-L290 HydrophobicContact CB-CG 4.19Å; H287-L290 WeakPolarHBondContact O-CB 3.5Å; H287-L290 PolarHBondContact O-N 3.05Å
288	E	91.3	Very high	95.2	Very high	78 Å²	78	54.5 Å²	54.5	36%	0.364	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-34.6	-179.3	-176.4	-175.3	177.1	0	0	112.6	W23 P234 L290	W23-E288 HydrophobicContact CE3-CB 4.27Å; P234-E288 WeakPolarHBondContact CG-OE2 3.5Å; E288-L290 VanDerWaalsContact C-N 3.27Å; E288-L290 PolarHBondContact O-N 3.22Å
289	G	90.9	Very high	94.9	Very high	12 Å²	12	62 Å²	62	12%	0.124	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-44.1	175.8	0	0	0	0	0	110.9	H208 H287	H208-G289 PolarHBondContact CE1-O 2.98Å; H208-G289 PolarHBondContact ND1-O 3.46Å; H287-G289 PolarHBondContact ND1-N 2.95Å; H287-G289 PolarHBondContact O-N 3.5Å
290	L	93.5	Very high	94.3	Very high	25 Å²	25	61.7 Å²	61.7	13%	0.131	31%	0.31	C	S	.	.			trans	-68.9	129.5	-170.6	-65.6	168.1	0	0	0	112.6	H208 P209 V285 H287 E288 E292 L294	H208-L290 HydrophobicContact CB-CD2 4.12Å; H208-L290 WeakPolarHBondContact ND1-CA 3.43Å; H208-L290 PolarHBondContact ND1-N 3.38Å; P209-L290 HydrophobicContact CG-CD1 3.88Å; P209-L290 HydrophobicContact CG-CD2 4.48Å; P209-L290 HydrophobicContact CG-CG 4.23Å; V285-L290 HydrophobicContact CG1-CD1 4.23Å; H287-L290 HydrophobicContact CB-CD1 3.97Å; H287-L290 HydrophobicContact CB-CG 4.19Å; H287-L290 WeakPolarHBondContact O-CB 3.5Å; H287-L290 PolarHBondContact O-N 3.05Å; E288-L290 VanDerWaalsContact C-N 3.27Å; E288-L290 PolarHBondContact O-N 3.22Å; L290-E292 WeakPolarHBondContact CB-O 3.21Å; L290-E292 PolarHBondContact O-N 3.18Å; L290-L294 HydrophobicContact CD1-CD1 3.99Å; L290-L294 HydrophobicContact CD1-CG 3.85Å; L290-L294 HydrophobicContact CD2-CD1 3.66Å; L290-L294 HydrophobicContact CD2-CD2 4.37Å; L290-L294 HydrophobicContact CD2-CG 3.83Å; L290-L294 HydrophobicContact CG-CG 4.46Å
291	P	91.2	Very high	92.8	Very high	122 Å²	122	62.2 Å²	62.2	79%	0.792	33%	0.326	S	S	*	.	S	Bend	trans	-66.3	-31	176.2	28.7	-35	0	0	0	111.8
292	E	92.1	Very high	90.5	Very high	150 Å²	150	66.9 Å²	66.9	70%	0.701	36%	0.362	S	S	*	.	S	Bend	trans	-141.6	148.4	174.4	-65.4	-177.2	179.5	0	0	109.3	L290 L294	L290-E292 WeakPolarHBondContact CB-O 3.21Å; L290-E292 PolarHBondContact O-N 3.18Å; E292-L294 PolarHBondContact O-N 3.1Å
293	P	94.8	Very high	88.1	Confident	70 Å²	70	74 Å²	74	46%	0.455	39%	0.394	S	S	.	.			trans	-53.7	136.6	174.2	-27.6	36.2	0	0	0	112.7	V285 Q286	V285-P293 WeakPolarHBondContact O-CA 3.28Å; Q286-P293 HydrophobicContact CG-CB 3.98Å; Q286-P293 HydrophobicContact CG-CG 4.09Å
294	L	96	Very high	85.5	Confident	60 Å²	60	79.2 Å²	79.2	31%	0.314	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.6	175.8	-63.5	178.3	0	0	0	110.5	T211 H284 V285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.35Å; H284-L294 CarbonylContact C-O 3.54Å; H284-L294 WeakPolarHBondContact CA-O 3.49Å; V285-L294 HydrophobicContact CB-CB 4.33Å; V285-L294 PolarHBondContact N-O 3.1Å; V285-L294 PolarHBondContact O-N 2.82Å; L290-L294 HydrophobicContact CD1-CD1 3.99Å; L290-L294 HydrophobicContact CD1-CG 3.85Å; L290-L294 HydrophobicContact CD2-CD1 3.66Å; L290-L294 HydrophobicContact CD2-CD2 4.37Å; L290-L294 HydrophobicContact CD2-CG 3.83Å; L290-L294 HydrophobicContact CG-CG 4.46Å; E292-L294 PolarHBondContact O-N 3.1Å
295	T	97.4	Very high	83.3	Confident	83 Å²	83	83.9 Å²	83.9	51%	0.509	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	119.7	170	-56.3	0	0	0	0	109.2	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 3.92Å; C283-T295 CarbonylContact O-C 3.57Å; C283-T295 WeakPolarHBondContact O-CA 3.32Å; H284-T295 PolarHBondContact CE1-OG1 3.42Å; H284-T295 PolarHBondContact ND1-OG1 3.04Å
296	L	96.7	Very high	81.2	Confident	34 Å²	34	89.1 Å²	89.1	18%	0.178	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.6	-173.8	-62	150.4	0	0	0	110	T211 V213 T282 C283 V285	T211-L296 VanDerWaalsContact CB-CD1 3.48Å; T211-L296 HydrophobicContact CG2-CD1 4.14Å; V213-L296 HydrophobicContact CG2-CB 3.87Å; T282-L296 CarbonylContact C-O 3.6Å; T282-L296 WeakPolarHBondContact CA-O 3.44Å; C283-L296 HydrophobicContact CB-CB 4.25Å; C283-L296 PolarHBondContact N-O 3.46Å; C283-L296 PolarHBondContact O-N 3.45Å; V285-L296 HydrophobicContact CG2-CD1 3.83Å
297	R	95.8	Very high	79.3	Confident	145 Å²	145	90.7 Å²	90.7	55%	0.547	50%	0.501	S	S	.	.			trans	-121.1	155.3	167.2	-69.4	-175.2	-179.8	162.3	-0.3	109.2	T282 K299	T282-R297 HydrophobicContact CG2-CG 3.61Å; T282-R297 VanDerWaalsContact CG2-NE 3.28Å; R297-K299 PolarHBondContact O-N 3.21Å
298	W	95.3	Very high	77.7	Confident	45 Å²	45	95.9 Å²	95.9	17%	0.17	53%	0.528	C	S	.	.			trans	-63.4	127.6	168.1	171.4	60	0	0	0	110.2	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.45Å; V213-W298 HydrophobicContact CG1-CB 3.79Å; H215-W298 HydrophobicContact CB-CD2 4.11Å; H215-W298 HydrophobicContact CB-CG 4.14Å; H215-W298 HydrophobicContact CB-CZ2 4.03Å; H215-W298 AromaticContact CG-CE2 3.78Å; H215-W298 AromaticContact CG-CZ2 3.8Å; H215-W298 AromaticContact CG-NE1 4Å; L225-W298 HydrophobicContact CD1-CB 4.48Å; L225-W298 HydrophobicContact CD2-CB 3.84Å; L225-W298 HydrophobicContact CD2-CD2 4.43Å; L225-W298 HydrophobicContact CD2-CG 4Å; E278-W298 HydrophobicContact CB-CD2 4.44Å; E278-W298 HydrophobicContact CB-CE3 3.42Å; E278-W298 VanDerWaalsContact CB-CE3 3.42Å; E278-W298 HydrophobicContact CB-CZ3 3.8Å; E278-W298 HydrophobicContact CG-CE3 3.8Å; E278-W298 HydrophobicContact CG-CZ3 3.8Å; Q279-W298 PolarHBondContact NE2-O 3.35Å; W298-P300 HydrophobicContact CH2-CB 4.37Å; W298-P300 HydrophobicContact CH2-CG 3.95Å; W298-P300 HydrophobicContact CZ2-CB 4.14Å; W298-P300 HydrophobicContact CZ2-CG 4.07Å; W298-P300 HydrophobicContact CZ3-CG 4.16Å
299	K	88.9	Confident	76.5	Confident	179 Å²	179	98.1 Å²	98.1	78%	0.778	55%	0.546	S	S	*	.			trans	-108.5	121.2	171	-70.4	-178	179.7	176.8	0	108.2	R297 S301	R297-K299 PolarHBondContact O-N 3.21Å; K299-S301 PolarHBondContact O-N 2.9Å
300	P	80.4	Confident	75.4	Confident	81 Å²	81	99.7 Å²	99.7	53%	0.526	56%	0.563	S	S	.	*			trans	-55.3	132	171.4	-21.3	30.8	0	0	0	109.5	W298 S302	W298-P300 HydrophobicContact CH2-CB 4.37Å; W298-P300 HydrophobicContact CH2-CG 3.95Å; W298-P300 HydrophobicContact CZ2-CB 4.14Å; W298-P300 HydrophobicContact CZ2-CG 4.07Å; W298-P300 HydrophobicContact CZ3-CG 4.16Å; P300-S302 PolarHBondContact O-N 2.88Å
301	S	64.4	Low	74.5	Confident	95 Å²	95	102.8 Å²	102.8	66%	0.664	58%	0.579	S	S	*	*			trans	-58.8	111.9	175.6	175.4	0	0	0	0	109.1	K299 Q303	K299-S301 PolarHBondContact O-N 2.9Å; S301-Q303 PolarHBondContact O-N 3.41Å; S301-Q303 PolarHBondContact OG-N 3.37Å
302	S	49.5	Very low	73.9	Confident	116 Å²	116	101.2 Å²	101.2	81%	0.811	57%	0.566	S	S	*	*			trans	-80.6	56.3	167.4	61.6	0	0	0	0	109.3	P300 P304	P300-S302 PolarHBondContact O-N 2.88Å; S302-P304 WeakPolarHBondContact O-CD 3.36Å
303	Q	46.4	Very low	73.3	Confident	159 Å²	159	96.7 Å²	96.7	74%	0.743	56%	0.555	S	S	*	*			trans	-74	113	158.1	-86.1	-174.3	-20.7	0	0	105.9	S301 T305	S301-Q303 PolarHBondContact O-N 3.41Å; S301-Q303 PolarHBondContact OG-N 3.37Å; Q303-T305 PolarHBondContact O-N 3.19Å
304	P	43.3	Very low	72.7	Confident	110 Å²	110	95 Å²	95	71%	0.714	55%	0.55	S	S	*	*			trans	-59.1	117.3	167.7	24.9	-30.2	0	0	0	105.7	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.36Å; P304-I306 PolarHBondContact O-N 2.8Å
305	T	50.9	Low	72.3	Confident	134 Å²	134	97.4 Å²	97.4	82%	0.822	56%	0.563	S	S	*	*			trans	-58.8	94.7	164	-39	0	0	0	0	104.9	Q303 P307	Q303-T305 PolarHBondContact O-N 3.19Å; T305-P307 VanDerWaalsContact O-CD 3.29Å; T305-P307 WeakPolarHBondContact O-CD 3.49Å
306	I	54	Low	71.7	Confident	109 Å²	109	96.1 Å²	96.1	56%	0.559	56%	0.56	S	S	*	*			trans	-51.9	119.1	170	-64.1	173.3	0	0	0	103.5	P304 I308 I311	P304-I306 PolarHBondContact O-N 2.8Å; I306-I308 HydrophobicContact CG2-CG1 4.45Å; I306-I308 WeakPolarHBondContact O-CG1 3.49Å; I306-I308 PolarHBondContact O-N 3.43Å; I306-I311 HydrophobicContact CG2-CD1 3.76Å
307	P	56.8	Low	71.2	Confident	88 Å²	88	98.7 Å²	98.7	57%	0.571	58%	0.577	S	S	*	*			trans	-74.7	79	-174.6	29.7	-32.5	0	0	0	106.9	T305 V309 G310 I311	T305-P307 VanDerWaalsContact O-CD 3.29Å; T305-P307 WeakPolarHBondContact O-CD 3.49Å; P307-V309 PolarHBondContact O-N 2.8Å; P307-V309 VanDerWaalsContact O-N 3.14Å; P307-G310 WeakPolarHBondContact O-CA 3.34Å; P307-G310 PolarHBondContact O-N 3.35Å; P307-I311 PolarHBondContact O-N 3.45Å; P307-I311 VanDerWaalsContact O-N 3.11Å
308	I	61.5	Low	70.8	Confident	119 Å²	119	97.3 Å²	97.3	61%	0.61	58%	0.58	S	S	*	*	H	α-helix	trans	-54.1	-36.2	-179.9	-67	167.1	0	0	0	108.7	I306 G310 I311 V312	I306-I308 HydrophobicContact CG2-CG1 4.45Å; I306-I308 WeakPolarHBondContact O-CG1 3.49Å; I306-I308 PolarHBondContact O-N 3.43Å; I308-G310 PolarHBondContact O-N 2.92Å; I308-I311 PolarHBondContact O-N 3Å; I308-V312 HydrophobicContact CG2-CG2 4.26Å; I308-V312 WeakPolarHBondContact O-CB 3.22Å; I308-V312 WeakPolarHBondContact O-CG2 3.33Å; I308-V312 PolarHBondContact O-N 3.19Å
309	V	66.3	Low	70.3	Confident	124 Å²	124	97.8 Å²	97.8	75%	0.752	59%	0.594	S	S	*	*	H	α-helix	trans	-61.6	-41.5	174.6	-178.4	0	0	0	0	112.5	P307 A313	P307-V309 PolarHBondContact O-N 2.8Å; P307-V309 VanDerWaalsContact O-N 3.14Å; V309-A313 VanDerWaalsContact O-CB 3.29Å; V309-A313 WeakPolarHBondContact O-CB 3.33Å; V309-A313 PolarHBondContact O-N 2.9Å
310	G	68.7	Low	70.3	Confident	45 Å²	45	93.5 Å²	93.5	46%	0.464	58%	0.582	S	S	.	*	H	α-helix	trans	-68.9	-37.9	178.8	0	0	0	0	0	112.8	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.34Å; P307-G310 PolarHBondContact O-N 3.35Å; I308-G310 PolarHBondContact O-N 2.92Å; G310-G314 PolarHBondContact O-N 3.05Å
311	I	74.9	Confident	70.6	Confident	91 Å²	91	94.7 Å²	94.7	47%	0.467	58%	0.584	S	S	.	*	H	α-helix	trans	-69	-44.2	176.4	-62	173.5	0	0	0	110.5	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 3.76Å; P307-I311 PolarHBondContact O-N 3.45Å; P307-I311 VanDerWaalsContact O-N 3.11Å; I308-I311 PolarHBondContact O-N 3Å; I311-G314 PolarHBondContact O-N 3.28Å; I311-L315 HydrophobicContact CG2-CD1 3.98Å; I311-L315 HydrophobicContact CG2-CG 4.46Å; I311-L315 WeakPolarHBondContact O-CB 3.29Å; I311-L315 WeakPolarHBondContact O-CG 3.41Å; I311-L315 PolarHBondContact O-N 3.48Å
312	V	77.9	Confident	71.5	Confident	89 Å²	89	93.3 Å²	93.3	54%	0.539	58%	0.578	S	S	.	*	H	α-helix	trans	-64.4	-43.6	177.8	172.2	0	0	0	0	111.2	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.26Å; I308-V312 WeakPolarHBondContact O-CB 3.22Å; I308-V312 WeakPolarHBondContact O-CG2 3.33Å; I308-V312 PolarHBondContact O-N 3.19Å; V312-L315 PolarHBondContact O-N 3.22Å; V312-A316 WeakPolarHBondContact O-CB 3.41Å; V312-A316 PolarHBondContact O-N 3.17Å
313	A	78.6	Confident	73.2	Confident	55 Å²	55	92.2 Å²	92.2	46%	0.455	57%	0.566	S	S	.	*	H	α-helix	trans	-62.7	-43.5	175.5	0	0	0	0	0	111.9	V309 A316 V317	V309-A313 VanDerWaalsContact O-CB 3.29Å; V309-A313 WeakPolarHBondContact O-CB 3.33Å; V309-A313 PolarHBondContact O-N 2.9Å; A313-A316 PolarHBondContact O-N 3.41Å; A313-V317 WeakPolarHBondContact O-CG2 3.33Å; A313-V317 PolarHBondContact O-N 3.41Å; A313-V317 VanDerWaalsContact O-N 3.09Å
314	G	82.9	Confident	75	Confident	35 Å²	35	89.4 Å²	89.4	36%	0.361	56%	0.556	S	S	.	*	H	α-helix	trans	-62.5	-43.3	177.3	0	0	0	0	0	113.3	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 3.05Å; I311-G314 PolarHBondContact O-N 3.28Å; G314-V317 PolarHBondContact O-N 2.94Å; G314-L318 PolarHBondContact O-N 3.36Å
315	L	87.1	Confident	76.9	Confident	110 Å²	110	86.2 Å²	86.2	58%	0.576	54%	0.543	S	S	*	.	H	α-helix	trans	-66.2	-38.3	176.8	-73	172.2	0	0	0	112.3	I311 V312 L318 A319	I311-L315 HydrophobicContact CG2-CD1 3.98Å; I311-L315 HydrophobicContact CG2-CG 4.46Å; I311-L315 WeakPolarHBondContact O-CB 3.29Å; I311-L315 WeakPolarHBondContact O-CG 3.41Å; I311-L315 PolarHBondContact O-N 3.48Å; V312-L315 PolarHBondContact O-N 3.22Å; L315-L318 PolarHBondContact O-N 3.22Å; L315-A319 WeakPolarHBondContact O-CB 3.43Å; L315-A319 PolarHBondContact O-N 3.26Å
316	A	84.6	Confident	78.3	Confident	55 Å²	55	82.5 Å²	82.5	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-63	-43.1	175.8	0	0	0	0	0	111.7	V312 A313 A319 V320	V312-A316 WeakPolarHBondContact O-CB 3.41Å; V312-A316 PolarHBondContact O-N 3.17Å; A313-A316 PolarHBondContact O-N 3.41Å; A316-A319 PolarHBondContact O-N 2.87Å; A316-V320 WeakPolarHBondContact O-CG2 3.42Å; A316-V320 PolarHBondContact O-N 2.99Å; A316-V320 VanDerWaalsContact O-N 3.07Å
317	V	86.7	Confident	79.5	Confident	89 Å²	89	83 Å²	83	54%	0.539	53%	0.527	S	S	.	.	H	α-helix	trans	-63.6	-44	176.7	173.3	0	0	0	0	111.3	A313 G314 A319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.33Å; A313-V317 PolarHBondContact O-N 3.41Å; A313-V317 VanDerWaalsContact O-N 3.09Å; G314-V317 PolarHBondContact O-N 2.94Å; V317-A319 VanDerWaalsContact C-N 3.35Å; V317-A319 PolarHBondContact O-N 3.44Å; V317-V320 PolarHBondContact O-N 2.92Å; V317-L321 HydrophobicContact CG1-CD1 4.04Å; V317-L321 HydrophobicContact CG1-CG 4.46Å; V317-L321 WeakPolarHBondContact O-CG 3.38Å; V317-L321 PolarHBondContact O-N 2.82Å
318	L	86.7	Confident	80.5	Confident	115 Å²	115	83 Å²	83	60%	0.602	53%	0.525	S	S	*	.	H	α-helix	trans	-61.2	-41.5	176.7	-85.1	164.2	0	0	0	112.5	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 3.36Å; L315-L318 PolarHBondContact O-N 3.22Å; L318-L321 PolarHBondContact O-N 3.44Å; L318-A322 WeakPolarHBondContact O-CB 3.09Å; L318-A322 PolarHBondContact O-N 2.83Å
319	A	86.8	Confident	81.1	Confident	56 Å²	56	79.9 Å²	79.9	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-43.6	176.8	0	0	0	0	0	111.7	L315 A316 V317 A322 V323	L315-A319 WeakPolarHBondContact O-CB 3.43Å; L315-A319 PolarHBondContact O-N 3.26Å; A316-A319 PolarHBondContact O-N 2.87Å; V317-A319 VanDerWaalsContact C-N 3.35Å; V317-A319 PolarHBondContact O-N 3.44Å; A319-A322 PolarHBondContact O-N 3.31Å; A319-V323 WeakPolarHBondContact O-CG2 3.41Å; A319-V323 PolarHBondContact O-N 3.3Å
320	V	87.6	Confident	81.6	Confident	88 Å²	88	77.7 Å²	77.7	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-44.4	176.6	172.3	0	0	0	0	111.2	A316 V317 A322 V323 L324	A316-V320 WeakPolarHBondContact O-CG2 3.42Å; A316-V320 PolarHBondContact O-N 2.99Å; A316-V320 VanDerWaalsContact O-N 3.07Å; V317-V320 PolarHBondContact O-N 2.92Å; V320-A322 PolarHBondContact O-N 3.08Å; V320-V323 PolarHBondContact O-N 3.13Å; V320-L324 HydrophobicContact CG1-CD1 3.96Å; V320-L324 WeakPolarHBondContact O-CG 3.3Å; V320-L324 PolarHBondContact O-N 2.71Å
321	L	86.5	Confident	81.8	Confident	106 Å²	106	79.4 Å²	79.4	56%	0.555	51%	0.505	S	S	*	.	H	α-helix	trans	-64.2	-38.6	177.8	-71	173.7	0	0	0	112.4	V317 L318 L324 G325	V317-L321 HydrophobicContact CG1-CD1 4.04Å; V317-L321 HydrophobicContact CG1-CG 4.46Å; V317-L321 WeakPolarHBondContact O-CG 3.38Å; V317-L321 PolarHBondContact O-N 2.82Å; L318-L321 PolarHBondContact O-N 3.44Å; L321-L324 PolarHBondContact O-N 3.25Å; L321-G325 PolarHBondContact O-N 2.69Å
322	A	84.9	Confident	81.7	Confident	66 Å²	66	81.3 Å²	81.3	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-42.5	176	0	0	0	0	0	112	L318 A319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.09Å; L318-A322 PolarHBondContact O-N 2.83Å; A319-A322 PolarHBondContact O-N 3.31Å; V320-A322 PolarHBondContact O-N 3.08Å; A322-G325 PolarHBondContact O-N 2.98Å; A322-A326 WeakPolarHBondContact O-CB 3.29Å; A322-A326 PolarHBondContact O-N 3.35Å
323	V	84.4	Confident	81.1	Confident	93 Å²	93	81.3 Å²	81.3	56%	0.564	52%	0.516	S	S	*	.	H	α-helix	trans	-64	-44.8	175.9	173.3	0	0	0	0	110.9	A319 V320 G325 A326 M327	A319-V323 WeakPolarHBondContact O-CG2 3.41Å; A319-V323 PolarHBondContact O-N 3.3Å; V320-V323 PolarHBondContact O-N 3.13Å; V323-G325 PolarHBondContact O-N 3.35Å; V323-A326 PolarHBondContact O-N 3.39Å; V323-M327 HydrophobicContact CG1-CG 4.44Å; V323-M327 VanDerWaalsContact O-CG 3.24Å; V323-M327 WeakPolarHBondContact O-CG 3.16Å; V323-M327 PolarHBondContact O-N 3Å
324	L	83.2	Confident	80.4	Confident	101 Å²	101	87.7 Å²	87.7	53%	0.529	53%	0.529	S	S	.	.	H	α-helix	trans	-61.9	-43.7	176.3	-73.2	169.4	0	0	0	111.7	V320 L321 A326 M327 V328	V320-L324 HydrophobicContact CG1-CD1 3.96Å; V320-L324 WeakPolarHBondContact O-CG 3.3Å; V320-L324 PolarHBondContact O-N 2.71Å; L321-L324 PolarHBondContact O-N 3.25Å; L324-A326 PolarHBondContact O-N 3.12Å; L324-M327 PolarHBondContact O-N 2.77Å; L324-V328 WeakPolarHBondContact O-CG2 3.37Å; L324-V328 PolarHBondContact O-N 3.36Å
325	G	83.3	Confident	79.2	Confident	42 Å²	42	96.2 Å²	96.2	43%	0.433	55%	0.55	S	S	.	.	H	α-helix	trans	-60.1	-43.9	175.3	0	0	0	0	0	112.7	L321 A322 V323 V328 A329	L321-G325 PolarHBondContact O-N 2.69Å; A322-G325 PolarHBondContact O-N 2.98Å; V323-G325 PolarHBondContact O-N 3.35Å; G325-V328 PolarHBondContact O-N 2.87Å; G325-A329 WeakPolarHBondContact O-CB 3.18Å; G325-A329 PolarHBondContact O-N 3.17Å
326	A	80.4	Confident	77.7	Confident	56 Å²	56	100.1 Å²	100.1	46%	0.463	56%	0.562	S	S	.	*	H	α-helix	trans	-63.6	-41.9	176.1	0	0	0	0	0	112.1	A322 V323 L324 A329 V330	A322-A326 WeakPolarHBondContact O-CB 3.29Å; A322-A326 PolarHBondContact O-N 3.35Å; V323-A326 PolarHBondContact O-N 3.39Å; L324-A326 PolarHBondContact O-N 3.12Å; A326-A329 PolarHBondContact O-N 3.01Å; A326-V330 VanDerWaalsContact O-CG2 3.31Å; A326-V330 WeakPolarHBondContact O-CG2 3.41Å; A326-V330 PolarHBondContact O-N 3.08Å
327	M	78.7	Confident	76.2	Confident	121 Å²	121	102.3 Å²	102.3	60%	0.596	57%	0.574	S	S	*	*	H	α-helix	trans	-62.6	-43.8	176.9	-71.5	-71.4	-78	0	0	111.8	V323 L324 V330 V331	V323-M327 HydrophobicContact CG1-CG 4.44Å; V323-M327 VanDerWaalsContact O-CG 3.24Å; V323-M327 WeakPolarHBondContact O-CG 3.16Å; V323-M327 PolarHBondContact O-N 3Å; L324-M327 PolarHBondContact O-N 2.77Å; M327-V330 PolarHBondContact O-N 3.34Å; M327-V331 VanDerWaalsContact O-CG2 3.3Å; M327-V331 WeakPolarHBondContact O-CG2 3.29Å; M327-V331 PolarHBondContact O-N 3.35Å
328	V	78.3	Confident	74.4	Confident	88 Å²	88	105.5 Å²	105.5	53%	0.533	60%	0.601	S	S	.	*	H	α-helix	trans	-62.6	-44	175.6	173	0	0	0	0	110.9	L324 G325 V330 V331 M332	L324-V328 WeakPolarHBondContact O-CG2 3.37Å; L324-V328 PolarHBondContact O-N 3.36Å; G325-V328 PolarHBondContact O-N 2.87Å; V328-V330 PolarHBondContact O-N 3.22Å; V328-V331 PolarHBondContact O-N 3.43Å; V328-M332 HydrophobicContact CG1-CG 4.39Å; V328-M332 HydrophobicContact CG1-SD 4.12Å; V328-M332 WeakPolarHBondContact O-CB 3.41Å; V328-M332 WeakPolarHBondContact O-CG 3.16Å; V328-M332 PolarHBondContact O-N 3.46Å
329	A	74.3	Confident	73.8	Confident	52 Å²	52	105.1 Å²	105.1	43%	0.43	60%	0.601	S	S	.	*	H	α-helix	trans	-61.3	-43.2	176.9	0	0	0	0	0	112.2	G325 A326 M332 C333	G325-A329 WeakPolarHBondContact O-CB 3.18Å; G325-A329 PolarHBondContact O-N 3.17Å; A326-A329 PolarHBondContact O-N 3.01Å; A329-M332 PolarHBondContact O-N 3.24Å; A329-C333 WeakPolarHBondContact O-CB 3.35Å; A329-C333 PolarHBondContact O-N 3.21Å; A329-C333 PolarHBondContact O-SG 3.31Å
330	V	76.2	Confident	73.1	Confident	79 Å²	79	107.6 Å²	107.6	48%	0.479	61%	0.608	S	S	.	*	H	α-helix	trans	-63.5	-43.2	176.2	170	0	0	0	0	111.5	A326 M327 V328 C333 R334	A326-V330 VanDerWaalsContact O-CG2 3.31Å; A326-V330 WeakPolarHBondContact O-CG2 3.41Å; A326-V330 PolarHBondContact O-N 3.08Å; M327-V330 PolarHBondContact O-N 3.34Å; V328-V330 PolarHBondContact O-N 3.22Å; V330-C333 PolarHBondContact O-N 2.94Å; V330-R334 PolarHBondContact O-N 3.41Å
331	V	73.9	Confident	72.3	Confident	81 Å²	81	108.7 Å²	108.7	49%	0.491	61%	0.612	S	S	.	*	H	α-helix	trans	-64.7	-41.7	177.2	170.5	0	0	0	0	111.2	M327 V328 R334 R335	M327-V331 VanDerWaalsContact O-CG2 3.3Å; M327-V331 WeakPolarHBondContact O-CG2 3.29Å; M327-V331 PolarHBondContact O-N 3.35Å; V328-V331 PolarHBondContact O-N 3.43Å; V331-R334 PolarHBondContact O-N 2.72Å; V331-R335 PolarHBondContact O-N 2.9Å
332	M	71.9	Confident	71.5	Confident	130 Å²	130	108.9 Å²	108.9	64%	0.64	62%	0.615	S	S	*	*	H	α-helix	trans	-64.9	-40.6	175.7	-73.3	-174.4	71.3	0	0	112.1	V328 A329 R335 K336	V328-M332 HydrophobicContact CG1-CG 4.39Å; V328-M332 HydrophobicContact CG1-SD 4.12Å; V328-M332 WeakPolarHBondContact O-CB 3.41Å; V328-M332 WeakPolarHBondContact O-CG 3.16Å; V328-M332 PolarHBondContact O-N 3.46Å; A329-M332 PolarHBondContact O-N 3.24Å; M332-R335 PolarHBondContact O-N 3.17Å; M332-K336 PolarHBondContact O-N 3.11Å
333	C	66.9	Low	70.7	Confident	89 Å²	89	111.6 Å²	111.6	60%	0.601	62%	0.62	S	S	*	*	H	α-helix	trans	-64.5	-39.4	174.5	-76.9	0	0	0	0	112.1	A329 V330 K336 S337	A329-C333 WeakPolarHBondContact O-CB 3.35Å; A329-C333 PolarHBondContact O-N 3.21Å; A329-C333 PolarHBondContact O-SG 3.31Å; V330-C333 PolarHBondContact O-N 2.94Å; C333-K336 PolarHBondContact O-N 3.3Å; C333-S337 PolarHBondContact O-N 3.04Å; C333-S337 PolarHBondContact O-OG 3.01Å
334	R	62.5	Low	69.8	Low	190 Å²	190	112.8 Å²	112.8	72%	0.717	62%	0.623	S	S	*	*	H	α-helix	trans	-68.1	-35.1	175	-78.1	-172.3	167.3	-177.2	-2.6	113.2	V330 V331 K336 S337	V330-R334 PolarHBondContact O-N 3.41Å; V331-R334 PolarHBondContact O-N 2.72Å; R334-K336 VanDerWaalsContact C-N 3.26Å; R334-K336 PolarHBondContact O-N 3.07Å; R334-S337 WeakPolarHBondContact CA-OG 3.46Å; R334-S337 PolarHBondContact O-N 3.3Å; R334-S337 PolarHBondContact O-OG 2.87Å
335	R	59	Low	68.8	Low	213 Å²	213	113.6 Å²	113.6	80%	0.804	63%	0.63	S	S	*	*	H	α-helix	trans	-70.1	-19.8	173.7	-102.3	-175.1	169.6	179.3	-2.4	114.2	V331 M332	V331-R335 PolarHBondContact O-N 2.9Å; M332-R335 PolarHBondContact O-N 3.17Å
336	K	54.9	Low	67.7	Low	193 Å²	193	119.2 Å²	119.2	84%	0.839	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-7.1	179.7	-140.4	176.4	-174.8	-178	0	113.1	M332 C333 R334	M332-K336 PolarHBondContact O-N 3.11Å; C333-K336 PolarHBondContact O-N 3.3Å; R334-K336 VanDerWaalsContact C-N 3.26Å; R334-K336 PolarHBondContact O-N 3.07Å
337	S	53.2	Low	66.6	Low	101 Å²	101	124.4 Å²	124.4	71%	0.706	66%	0.661	S	S	*	*			trans	-114.7	7.6	-178.9	42.9	0	0	0	0	113.5	C333 R334	C333-S337 PolarHBondContact O-N 3.04Å; C333-S337 PolarHBondContact O-OG 3.01Å; R334-S337 WeakPolarHBondContact CA-OG 3.46Å; R334-S337 PolarHBondContact O-N 3.3Å; R334-S337 PolarHBondContact O-OG 2.87Å
338	S	49.5	Very low	65.5	Low	156 Å²	156	124.7 Å²	124.7	100%	1.091	67%	0.667	S	S	*	*			trans	-117	0	162.6	-175.9	0	0	0	0	108.7

Retrieved 338 of 338 residues in 1539.3 ms (Link to these results)

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