A0A090KFX9_HUMAN Loading...

HLA class I antigen

AlphaFold DB , UniProt , Accession A0A090KFX9, Species HUMAN (Homo sapiens, Human), Gene HLA-B, Length 362 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	34.4	Very low	46	Very low	240 Å²	240	135.4 Å²	135.4	100%	1.182	70%	0.698	S	S	*	*				0	111.8	0	-72.4	167.6	-179.2	0	0	107.7	V3	M1-V3 PolarHBondContact O-N 3.47Å
2	R	36.8	Very low	46.1	Very low	245 Å²	245	134.5 Å²	134.5	93%	0.925	69%	0.694	S	S	*	*			trans	-82.3	109.7	172.4	-90.1	-179.4	173.9	164.9	-2.2	106.9	T4	R2-T4 PolarHBondContact O-N 3.38Å; R2-T4 VanDerWaalsContact O-N 3.12Å
3	V	38.5	Very low	45.8	Very low	140 Å²	140	131.8 Å²	131.8	85%	0.848	68%	0.681	S	S	*	*			trans	-74.2	99.6	171	-179.8	0	0	0	0	106.7	M1 A5	M1-V3 PolarHBondContact O-N 3.47Å; V3-A5 PolarHBondContact O-N 3.12Å
4	T	43.5	Very low	45.5	Very low	124 Å²	124	126.9 Å²	126.9	76%	0.761	66%	0.664	S	S	*	*			trans	-76.5	107.8	168.4	38.9	0	0	0	0	108.1	R2	R2-T4 PolarHBondContact O-N 3.38Å; R2-T4 VanDerWaalsContact O-N 3.12Å
5	A	44.1	Very low	45.4	Very low	56 Å²	56	121.9 Å²	121.9	46%	0.463	65%	0.648	S	S	.	*			trans	-60.2	141.4	169.6	0	0	0	0	0	109.7	V3 R7 L10	V3-A5 PolarHBondContact O-N 3.12Å; A5-R7 PolarHBondContact O-N 3.05Å; A5-L10 HydrophobicContact CB-CD1 4.37Å
6	P	55.7	Low	45.3	Very low	77 Å²	77	117.2 Å²	117.2	50%	0.5	63%	0.631	S	S	.	*			trans	-59.7	136	179.3	-17.2	28.1	0	0	0	110.6	T8 V9 L10	P6-T8 PolarHBondContact O-N 3.44Å; P6-V9 HydrophobicContact CB-CG2 4.18Å; P6-V9 HydrophobicContact CG-CG2 4.05Å; P6-V9 WeakPolarHBondContact O-CB 3.49Å; P6-V9 PolarHBondContact O-N 3.2Å; P6-L10 PolarHBondContact O-N 2.92Å
7	R	51.4	Low	44.9	Very low	222 Å²	222	116.7 Å²	116.7	84%	0.838	63%	0.628	S	S	*	*	H	α-helix	trans	-51.1	-31.8	179.3	-104.7	178.3	164.3	139.1	-5	113.4	A5 L10 L11	A5-R7 PolarHBondContact O-N 3.05Å; R7-L10 PolarHBondContact O-N 3.02Å; R7-L11 VanDerWaalsContact O-CG 3.25Å; R7-L11 WeakPolarHBondContact O-CG 3.25Å; R7-L11 PolarHBondContact O-N 2.98Å
8	T	52.3	Low	44.6	Very low	97 Å²	97	113.1 Å²	113.1	60%	0.595	62%	0.617	S	S	*	*	H	α-helix	trans	-66.6	-41.2	175.4	32.6	0	0	0	0	113.2	P6 L10 L11 L12	P6-T8 PolarHBondContact O-N 3.44Å; T8-L10 VanDerWaalsContact C-N 3.33Å; T8-L11 PolarHBondContact O-N 2.96Å; T8-L12 WeakPolarHBondContact O-CG 3.46Å; T8-L12 PolarHBondContact O-N 3.33Å
9	V	52.7	Low	44.3	Very low	67 Å²	67	111.9 Å²	111.9	41%	0.406	61%	0.609	S	S	.	*	H	α-helix	trans	-66.7	-38.7	175.5	177.7	0	0	0	0	110.4	P6 L13	P6-V9 HydrophobicContact CB-CG2 4.18Å; P6-V9 HydrophobicContact CG-CG2 4.05Å; P6-V9 WeakPolarHBondContact O-CB 3.49Å; P6-V9 PolarHBondContact O-N 3.2Å; V9-L13 HydrophobicContact CG1-CD1 3.88Å; V9-L13 WeakPolarHBondContact O-CB 3.33Å; V9-L13 WeakPolarHBondContact O-CD1 3.36Å; V9-L13 WeakPolarHBondContact O-CG 3.36Å; V9-L13 PolarHBondContact O-N 3.46Å
10	L	44.6	Very low	44.1	Very low	103 Å²	103	110.5 Å²	110.5	54%	0.539	60%	0.604	S	S	.	*	H	α-helix	trans	-64	-41.5	175.4	-135.7	91.1	0	0	0	111.7	A5 P6 R7 T8 S14	A5-L10 HydrophobicContact CB-CD1 4.37Å; P6-L10 PolarHBondContact O-N 2.92Å; R7-L10 PolarHBondContact O-N 3.02Å; T8-L10 VanDerWaalsContact C-N 3.33Å; L10-S14 WeakPolarHBondContact O-CB 3.49Å; L10-S14 PolarHBondContact O-N 2.8Å; L10-S14 PolarHBondContact O-OG 2.6Å
11	L	52.4	Low	43.9	Very low	118 Å²	118	113.1 Å²	113.1	62%	0.618	61%	0.613	S	S	*	*	H	α-helix	trans	-68.7	-40.4	178.2	-73.2	166.3	0	0	0	112.6	R7 T8 S14 A15	R7-L11 VanDerWaalsContact O-CG 3.25Å; R7-L11 WeakPolarHBondContact O-CG 3.25Å; R7-L11 PolarHBondContact O-N 2.98Å; T8-L11 PolarHBondContact O-N 2.96Å; L11-S14 WeakPolarHBondContact O-CB 3.39Å; L11-S14 PolarHBondContact O-N 2.7Å; L11-A15 WeakPolarHBondContact O-CB 3.39Å; L11-A15 PolarHBondContact O-N 3.43Å
12	L	46.5	Very low	44.4	Very low	125 Å²	125	106 Å²	106	65%	0.654	58%	0.582	S	S	*	*	H	α-helix	trans	-65.8	-42	175.2	-73.1	168.3	0	0	0	111.8	T8 S14 A15 A16	T8-L12 WeakPolarHBondContact O-CG 3.46Å; T8-L12 PolarHBondContact O-N 3.33Å; L12-S14 VanDerWaalsContact C-N 3.31Å; L12-S14 PolarHBondContact O-N 2.66Å; L12-A15 PolarHBondContact O-N 3.27Å; L12-A16 WeakPolarHBondContact O-CB 3.45Å; L12-A16 PolarHBondContact O-N 3.49Å
13	L	42.3	Very low	44.9	Very low	100 Å²	100	96.5 Å²	96.5	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-64.2	-36.9	172.6	-76.7	164.1	0	0	0	111.8	V9 L17	V9-L13 HydrophobicContact CG1-CD1 3.88Å; V9-L13 WeakPolarHBondContact O-CB 3.33Å; V9-L13 WeakPolarHBondContact O-CD1 3.36Å; V9-L13 WeakPolarHBondContact O-CG 3.36Å; V9-L13 PolarHBondContact O-N 3.46Å; L13-L17 WeakPolarHBondContact O-CB 3.38Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 WeakPolarHBondContact O-CG 3.33Å; L13-L17 PolarHBondContact O-N 2.62Å
14	S	41.4	Very low	45.8	Very low	63 Å²	63	92.8 Å²	92.8	44%	0.441	53%	0.531	S	S	.	.	H	α-helix	trans	-67.1	-40.8	176.6	-52.6	0	0	0	0	111.8	L10 L11 L12 A18	L10-S14 WeakPolarHBondContact O-CB 3.49Å; L10-S14 PolarHBondContact O-N 2.8Å; L10-S14 PolarHBondContact O-OG 2.6Å; L11-S14 WeakPolarHBondContact O-CB 3.39Å; L11-S14 PolarHBondContact O-N 2.7Å; L12-S14 VanDerWaalsContact C-N 3.31Å; L12-S14 PolarHBondContact O-N 2.66Å; S14-A18 VanDerWaalsContact O-CB 3.28Å; S14-A18 WeakPolarHBondContact O-CB 3.36Å; S14-A18 PolarHBondContact O-N 3.02Å
15	A	44.8	Very low	47.4	Very low	52 Å²	52	88 Å²	88	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-68.2	-43	176.1	0	0	0	0	0	111.7	L11 L12 A18 L19	L11-A15 WeakPolarHBondContact O-CB 3.39Å; L11-A15 PolarHBondContact O-N 3.43Å; L12-A15 PolarHBondContact O-N 3.27Å; A15-A18 PolarHBondContact O-N 2.88Å; A15-L19 WeakPolarHBondContact O-CB 3.47Å; A15-L19 WeakPolarHBondContact O-CD1 3.24Å; A15-L19 PolarHBondContact O-N 2.91Å
16	A	43.3	Very low	49.6	Very low	46 Å²	46	87.9 Å²	87.9	38%	0.38	50%	0.501	S	S	.	.	H	α-helix	trans	-64.3	-40.9	174.8	0	0	0	0	0	112.1	L12 L19 T20	L12-A16 WeakPolarHBondContact O-CB 3.45Å; L12-A16 PolarHBondContact O-N 3.49Å; A16-L19 PolarHBondContact O-N 2.9Å; A16-T20 WeakPolarHBondContact O-CG2 3.49Å; A16-T20 PolarHBondContact O-N 2.85Å; A16-T20 PolarHBondContact O-OG1 2.89Å
17	L	39.5	Very low	51.6	Low	109 Å²	109	85.6 Å²	85.6	57%	0.571	48%	0.484	S	S	*	.	H	α-helix	trans	-66.3	-40.8	175.7	-78.8	163.6	0	0	0	112.2	L13 L19 T20 E21	L13-L17 WeakPolarHBondContact O-CB 3.38Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 WeakPolarHBondContact O-CG 3.33Å; L13-L17 PolarHBondContact O-N 2.62Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 2.8Å; L17-T20 VanDerWaalsContact CA-OG1 3.3Å; L17-T20 WeakPolarHBondContact CA-OG1 3.22Å; L17-T20 PolarHBondContact O-N 3.18Å; L17-T20 PolarHBondContact O-OG1 3.02Å; L17-E21 PolarHBondContact O-N 3.03Å
18	A	39.1	Very low	53.8	Low	52 Å²	52	76.1 Å²	76.1	43%	0.43	45%	0.452	S	S	.	.	H	α-helix	trans	-64.6	-36.7	175	0	0	0	0	0	112.1	S14 A15 T22	S14-A18 VanDerWaalsContact O-CB 3.28Å; S14-A18 WeakPolarHBondContact O-CB 3.36Å; S14-A18 PolarHBondContact O-N 3.02Å; A15-A18 PolarHBondContact O-N 2.88Å; A18-T22 VanDerWaalsContact O-CG2 3.29Å; A18-T22 WeakPolarHBondContact O-CG2 3.22Å; A18-T22 PolarHBondContact O-N 3.19Å; A18-T22 PolarHBondContact O-OG1 3.36Å; A18-T22 VanDerWaalsContact O-OG1 3.11Å
19	L	38.8	Very low	56	Low	90 Å²	90	71.5 Å²	71.5	47%	0.471	42%	0.423	S	S	.	.	H	α-helix	trans	-68.2	-35.8	172.4	-90.1	146.1	0	0	0	112.4	A15 A16 L17 T22	A15-L19 WeakPolarHBondContact O-CB 3.47Å; A15-L19 WeakPolarHBondContact O-CD1 3.24Å; A15-L19 PolarHBondContact O-N 2.91Å; A16-L19 PolarHBondContact O-N 2.9Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 2.8Å; L19-T22 PolarHBondContact O-OG1 2.93Å; L19-T22 VanDerWaalsContact O-OG1 3.09Å
20	T	40.5	Very low	58.2	Low	83 Å²	83	70.8 Å²	70.8	51%	0.509	41%	0.414	S	S	.	.	H	α-helix	trans	-74.1	-33.2	175.7	53.4	0	0	0	0	113.3	A16 L17	A16-T20 WeakPolarHBondContact O-CG2 3.49Å; A16-T20 PolarHBondContact O-N 2.85Å; A16-T20 PolarHBondContact O-OG1 2.89Å; L17-T20 VanDerWaalsContact CA-OG1 3.3Å; L17-T20 WeakPolarHBondContact CA-OG1 3.22Å; L17-T20 PolarHBondContact O-N 3.18Å; L17-T20 PolarHBondContact O-OG1 3.02Å
21	E	38.4	Very low	60.8	Low	167 Å²	167	66.4 Å²	66.4	78%	0.78	39%	0.39	S	S	*	.	H	α-helix	trans	-72.7	-28.1	176	-96.9	-173.3	159	0	0	112.7	L17	L17-E21 PolarHBondContact O-N 3.03Å
22	T	45.6	Very low	63	Low	89 Å²	89	64.6 Å²	64.6	55%	0.546	38%	0.377	S	S	.	.	H	α-helix	trans	-79.4	-17.9	179.7	50.4	0	0	0	0	114	A18 L19	A18-T22 VanDerWaalsContact O-CG2 3.29Å; A18-T22 WeakPolarHBondContact O-CG2 3.22Å; A18-T22 PolarHBondContact O-N 3.19Å; A18-T22 PolarHBondContact O-OG1 3.36Å; A18-T22 VanDerWaalsContact O-OG1 3.11Å; L19-T22 PolarHBondContact O-OG1 2.93Å; L19-T22 VanDerWaalsContact O-OG1 3.09Å
23	W	47.9	Very low	65.5	Low	47 Å²	47	58.8 Å²	58.8	18%	0.178	35%	0.347	C	S	.	.	H	α-helix	trans	-89.3	-37	-175	-78.2	42.5	0	0	0	113.2	G25 E236 E288	W23-G25 PolarHBondContact O-N 3.06Å; W23-E236 HydrophobicContact CH2-CB 3.98Å; W23-E236 HydrophobicContact CH2-CG 3.28Å; W23-E236 HydrophobicContact CZ2-CB 4.35Å; W23-E236 HydrophobicContact CZ2-CG 3.26Å; W23-E236 HydrophobicContact CZ3-CB 4.15Å; W23-E236 HydrophobicContact CZ3-CG 3.9Å; W23-E236 VanDerWaalsContact CZ3-O 3.27Å; W23-E236 WeakPolarHBondContact CZ3-O 3.28Å; W23-E288 HydrophobicContact CB-CG 4.49Å; W23-E288 HydrophobicContact CE3-CB 4.01Å; W23-E288 VanDerWaalsContact O-CD 3.26Å
24	A	56.4	Low	68.2	Low	62 Å²	62	55.9 Å²	55.9	51%	0.512	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	104.4	-175.5	0	0	0	0	0	111.8
25	G	77	Confident	70.9	Confident	22 Å²	22	52.9 Å²	52.9	23%	0.227	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	16.9	163.8	0	0	0	0	0	116.9	W23 G128 P129	W23-G25 PolarHBondContact O-N 3.06Å; G25-G128 CarbonylContact O-C 3.49Å; G25-P129 WeakPolarHBondContact O-CA 3.49Å; G25-P129 WeakPolarHBondContact O-CG 3.46Å
26	S	91.9	Very high	73.4	Confident	54 Å²	54	53.4 Å²	53.4	38%	0.378	31%	0.307	S	S	.	.			trans	-87.6	143.1	163.7	73	0	0	0	0	110.4	V127	S26-V127 VanDerWaalsContact CA-O 3.31Å; S26-V127 WeakPolarHBondContact CA-O 3.44Å
27	H	96.4	Very high	76	Confident	30 Å²	30	52.1 Å²	52.1	14%	0.139	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.2	-179.3	-66.1	-78.3	0	0	0	111.2	D53 D126 V127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.27Å; H27-D53 WeakPolarHBondContact CA-OD1 3.45Å; H27-D53 IonicContact CE1-OD2 3.74Å; H27-D53 IonicContact CG-OD2 3.87Å; H27-D53 IonicContact ND1-OD1 2.76Å; H27-D53 IonicContact ND1-OD2 2.71Å; H27-D53 PolarHBondContact ND1-OD2 3.05Å; H27-D126 CarbonylContact O-C 3.6Å; H27-D126 WeakPolarHBondContact O-CA 3.31Å; H27-V127 HydrophobicContact CB-CG2 4.01Å; H27-V127 PolarHBondContact N-O 3.44Å; H27-V127 PolarHBondContact O-N 2.97Å; H27-L192 HydrophobicContact CB-CD1 4.42Å; H27-L196 HydrophobicContact CB-CD1 3.72Å; H27-L196 HydrophobicContact CB-CD2 4.02Å; H27-L196 HydrophobicContact CB-CG 4.46Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.46Å
28	S	97.9	Very high	78.7	Confident	23 Å²	23	50.5 Å²	50.5	16%	0.161	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	148.1	178.7	65.7	0	0	0	0	111.8	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.57Å; S28-V52 VanDerWaalsContact O-CA 3.31Å; S28-V52 WeakPolarHBondContact O-CA 3.41Å; S28-D53 PolarHBondContact N-OD1 2.92Å; S28-D53 PolarHBondContact O-N 3.31Å; S28-D53 PolarHBondContact OG-OD1 3.28Å; S28-C125 WeakPolarHBondContact CA-O 3.37Å; S28-D126 WeakPolarHBondContact CB-OD1 3.47Å
29	M	98.6	Very high	81.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.7	166	-177	172.2	57.5	0	0	108.6	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.03Å; M29-Y31 HydrophobicContact CG-CE2 3.93Å; M29-Y31 HydrophobicContact SD-CE2 3.86Å; M29-Y51 CarbonylContact C-O 3.56Å; M29-Y51 WeakPolarHBondContact CA-O 3.33Å; M29-V52 HydrophobicContact CG-CG2 4.38Å; M29-F57 HydrophobicContact SD-CZ 4.3Å; M29-G124 CarbonylContact O-C 3.43Å; M29-G124 WeakPolarHBondContact O-CA 3.28Å; M29-C125 PolarHBondContact N-O 2.96Å; M29-C125 PolarHBondContact O-N 3.15Å; M29-C125 VanDerWaalsContact O-N 3.07Å; M29-C188 HydrophobicContact CE-CB 4.22Å; M29-C188 WeakPolarHBondContact CE-O 3.36Å; M29-C188 WeakPolarHBondContact CE-SG 3.06Å; M29-W191 HydrophobicContact CE-CB 4.06Å; M29-W191 HydrophobicContact SD-CB 4.47Å; M29-L192 HydrophobicContact CB-CB 4.08Å; M29-L192 HydrophobicContact CB-CD1 4.02Å; M29-L192 HydrophobicContact CB-CD2 4.14Å; M29-L192 HydrophobicContact CB-CG 4.3Å; M29-L192 HydrophobicContact CE-CB 4.35Å; M29-Y195 HydrophobicContact SD-CD2 3.77Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å
30	R	98.7	Very high	83.7	Confident	52 Å²	52	50.7 Å²	50.7	20%	0.196	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	134.6	-176.9	-57.7	-62.3	-176.9	73.8	4.7	111.3	F32 G50 Y51 D126 H137	R30-F32 HydrophobicContact CB-CE2 3.67Å; R30-F32 HydrophobicContact CB-CZ 3.97Å; R30-G50 WeakPolarHBondContact O-CA 3.34Å; R30-Y51 PolarHBondContact N-O 2.82Å; R30-Y51 PolarHBondContact O-N 2.94Å; R30-D126 IonicContact CZ-OD1 3.56Å; R30-D126 IonicContact NE-OD1 3.52Å; R30-D126 PolarHBondContact NE-OD1 3.43Å; R30-D126 VanDerWaalsContact NE-OD1 3.11Å; R30-D126 VanDerWaalsContact NH2-CG 3.27Å; R30-D126 IonicContact NH2-OD1 3.93Å; R30-D126 PolarHBondContact NH2-OD1 2.96Å; R30-D126 IonicContact NH2-OD2 3.02Å; R30-D126 PolarHBondContact NH2-OD2 3.48Å; R30-H137 PolarHBondContact NH2-NE2 2.94Å; R30-H137 VanDerWaalsContact NH2-NE2 3.12Å
31	Y	98.8	Very high	86.2	Confident	10 Å²	10	56.6 Å²	56.6	4%	0.039	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.6	170.7	-65.8	-84.8	0	0	0	109.9	M29 V49 F57 M58 M122 Y123	M29-Y31 HydrophobicContact CE-CE2 4.03Å; M29-Y31 HydrophobicContact CG-CE2 3.93Å; M29-Y31 HydrophobicContact SD-CE2 3.86Å; Y31-V49 WeakPolarHBondContact CA-O 3.49Å; Y31-F57 HydrophobicContact CE1-CZ 4.01Å; Y31-F57 AromaticContact CZ-CZ 3.97Å; Y31-M58 HydrophobicContact CD1-SD 4.43Å; Y31-M58 HydrophobicContact CE1-SD 3.6Å; Y31-M122 WeakPolarHBondContact O-CA 3.34Å; Y31-Y123 HydrophobicContact CD2-CD2 4.31Å; Y31-Y123 AromaticContact CD2-CE2 3.64Å; Y31-Y123 HydrophobicContact CD2-CE2 3.64Å; Y31-Y123 AromaticContact CD2-CZ 3.82Å; Y31-Y123 HydrophobicContact CE2-CE2 4.44Å; Y31-Y123 HydrophobicContact CG-CE1 4.32Å; Y31-Y123 HydrophobicContact CG-CE2 4.12Å; Y31-Y123 AromaticContact CG-CZ 3.81Å; Y31-Y123 PolarHBondContact N-O 2.64Å; Y31-Y123 PolarHBondContact O-N 3.28Å; Y31-Y123 VanDerWaalsContact O-N 3.11Å
32	F	98.9	Very high	88.7	Confident	81 Å²	81	51.4 Å²	51.4	36%	0.355	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.1	175.5	-57.2	-94.6	0	0	0	108.3	R30 T48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CE2 3.67Å; R30-F32 HydrophobicContact CB-CZ 3.97Å; F32-T48 WeakPolarHBondContact O-CA 3.23Å; F32-T48 WeakPolarHBondContact O-CB 3.48Å; F32-T48 PolarHBondContact O-OG1 3.41Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.27Å; F32-V49 HydrophobicContact CG-CG2 4.49Å; F32-V49 PolarHBondContact N-O 3.04Å; F32-V49 PolarHBondContact O-N 3.14Å; F32-Y51 HydrophobicContact CD2-CD2 4.08Å; F32-Y51 HydrophobicContact CE2-CD2 4.04Å; F32-R121 CarbonylContact C-O 3.58Å; F32-R121 WeakPolarHBondContact CA-O 3.31Å; F32-M122 HydrophobicContact CD1-CB 4.03Å; F32-M122 HydrophobicContact CD1-CG 3.7Å; F32-M122 HydrophobicContact CE1-CB 4.1Å; F32-M122 HydrophobicContact CE1-CG 3.35Å; F32-M122 HydrophobicContact CZ-CG 3.95Å
33	H	98.8	Very high	91.1	Very high	3 Å²	3	51.1 Å²	51.1	1%	0.014	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.9	177.7	-61.8	9.7	0	0	0	107.8	F46 I47 T48 Y98 Q120 R121 Y123	H33-F46 HydrophobicContact CB-CE2 3.95Å; H33-F46 HydrophobicContact CB-CZ 4.18Å; H33-F46 AromaticContact CD2-CZ 3.89Å; H33-I47 WeakPolarHBondContact CA-O 3.26Å; H33-T48 PolarHBondContact CE1-OG1 2.96Å; H33-T48 PolarHBondContact ND1-OG1 2.92Å; H33-Y98 HydrophobicContact CB-CE1 3.84Å; H33-Y98 WeakPolarHBondContact CB-OH 3.31Å; H33-Y98 AromaticContact CD2-CZ 3.86Å; H33-Y98 PolarHBondContact CD2-OH 2.81Å; H33-Q120 CarbonylContact O-C 3.56Å; H33-Q120 WeakPolarHBondContact O-CA 3.35Å; H33-R121 HydrophobicContact CB-CB 4.18Å; H33-R121 PolarHBondContact N-O 3.13Å; H33-R121 PolarHBondContact O-N 3.25Å; H33-Y123 AromaticContact CE1-CE1 3.46Å; H33-Y123 VanDerWaalsContact CE1-CE1 3.46Å; H33-Y123 WeakPolarHBondContact CE1-CE1 3.34Å; H33-Y123 AromaticContact CE1-CZ 3.96Å; H33-Y123 AromaticContact NE2-CE1 3.46Å; H33-Y123 WeakPolarHBondContact NE2-CE1 3.48Å; H33-Y123 AromaticContact NE2-CZ 3.97Å
34	T	98.8	Very high	93.4	Very high	38 Å²	38	49.9 Å²	49.9	23%	0.233	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	120.4	177.4	-57.9	0	0	0	0	108.6	M36 F46 I47 T118 Q120	T34-M36 HydrophobicContact CG2-CG 4.01Å; T34-M36 HydrophobicContact CG2-SD 4.33Å; T34-F46 WeakPolarHBondContact O-CA 3.32Å; T34-I47 PolarHBondContact N-O 3.04Å; T34-I47 PolarHBondContact O-N 3.38Å; T34-T118 HydrophobicContact CG2-CG2 3.93Å; T34-Q120 HydrophobicContact CG2-CG 4.23Å
35	A	98.6	Very high	95.4	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.008	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.7	168.1	0	0	0	0	0	110.2	R45 F46 Y98 L102 T118 W119	A35-R45 CarbonylContact C-O 3.59Å; A35-R45 VanDerWaalsContact CA-O 3.28Å; A35-R45 WeakPolarHBondContact CA-O 3.48Å; A35-F46 HydrophobicContact CB-CD2 4.21Å; A35-Y98 HydrophobicContact CB-CD1 3.66Å; A35-Y98 HydrophobicContact CB-CG 4.12Å; A35-L102 HydrophobicContact CB-CD1 3.81Å; A35-T118 CarbonylContact O-C 3.48Å; A35-T118 WeakPolarHBondContact O-CA 3.39Å; A35-W119 PolarHBondContact N-O 3.32Å; A35-W119 PolarHBondContact O-N 2.87Å
36	M	98.3	Very high	96.4	Very high	63 Å²	63	49.7 Å²	49.7	31%	0.31	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	116.4	-179.8	-63	167.3	-64.9	0	0	108.9	T34 P44 R45 I47 H117 T118	T34-M36 HydrophobicContact CG2-CG 4.01Å; T34-M36 HydrophobicContact CG2-SD 4.33Å; M36-P44 CarbonylContact O-C 3.51Å; M36-P44 WeakPolarHBondContact O-CA 3.37Å; M36-P44 WeakPolarHBondContact O-CB 3.27Å; M36-R45 HydrophobicContact CE-CB 4.27Å; M36-R45 HydrophobicContact CE-CG 4.34Å; M36-R45 PolarHBondContact N-O 2.87Å; M36-R45 PolarHBondContact O-N 2.94Å; M36-I47 HydrophobicContact CE-CD1 4.09Å; M36-H117 WeakPolarHBondContact CA-O 3.48Å; M36-T118 HydrophobicContact CG-CG2 4.04Å
37	S	97.4	Very high	96.7	Very high	19 Å²	19	48.8 Å²	48.8	13%	0.133	26%	0.264	C	S	.	.			trans	-68.5	150.5	170.3	72.6	0	0	0	0	109.8	S116 H117	S37-S116 PolarHBondContact O-OG 3.01Å; S37-H117 PolarHBondContact N-O 3.45Å; S37-H117 PolarHBondContact OG-N 2.82Å; S37-H117 PolarHBondContact OG-O 3.45Å
38	R	95.6	Very high	96.9	Very high	75 Å²	75	47.4 Å²	47.4	28%	0.283	26%	0.258	S	S	.	.			trans	-143	72.9	179.5	53	174.5	175.5	-159.9	-10.6	110.9	G40 R41 E43 D63	R38-G40 PolarHBondContact O-N 3.37Å; R38-R41 HydrophobicContact CB-CB 4.15Å; R38-R41 WeakPolarHBondContact CD-O 3.11Å; R38-R41 HydrophobicContact CG-CB 4.25Å; R38-R41 PolarHBondContact NE-O 3.43Å; R38-R41 PolarHBondContact O-N 2.9Å; R38-E43 VanDerWaalsContact CZ-O 3.25Å; R38-E43 PolarHBondContact NE-O 2.84Å; R38-E43 PolarHBondContact NH2-O 2.88Å; R38-D63 IonicContact CZ-OD1 3.6Å; R38-D63 IonicContact CZ-OD2 3.44Å; R38-D63 IonicContact NH1-OD1 3.68Å; R38-D63 PolarHBondContact NH1-OD1 2.94Å; R38-D63 IonicContact NH1-OD2 3.15Å; R38-D63 PolarHBondContact NH1-OD2 2.93Å; R38-D63 IonicContact NH2-OD1 3.33Å; R38-D63 PolarHBondContact NH2-OD1 3.02Å; R38-D63 IonicContact NH2-OD2 3.74Å
39	P	91.9	Very high	96.9	Very high	54 Å²	54	47.9 Å²	47.9	35%	0.351	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	131	-175.8	-26.9	34.9	0	0	0	112.4	R41 E113 G115	P39-R41 PolarHBondContact O-N 3.48Å; P39-E113 VanDerWaalsContact CB-O 3.31Å; P39-E113 WeakPolarHBondContact CB-O 3.39Å; P39-E113 WeakPolarHBondContact CG-O 3.47Å; P39-G115 WeakPolarHBondContact CG-O 3.47Å
40	G	91.1	Very high	96.9	Very high	91 Å²	91	47.9 Å²	47.9	94%	0.938	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	1.1	-178	0	0	0	0	0	115.8	R38	R38-G40 PolarHBondContact O-N 3.37Å
41	R	93.1	Very high	96.9	Very high	207 Å²	207	49 Å²	49	78%	0.781	26%	0.264	S	S	*	.	S	Bend	trans	-123.2	23.5	-179.9	-58.1	-174.9	-178.2	-177.3	0.8	113.4	R38 P39	R38-R41 HydrophobicContact CB-CB 4.15Å; R38-R41 WeakPolarHBondContact CD-O 3.11Å; R38-R41 HydrophobicContact CG-CB 4.25Å; R38-R41 PolarHBondContact NE-O 3.43Å; R38-R41 PolarHBondContact O-N 2.9Å; P39-R41 PolarHBondContact O-N 3.48Å
42	G	91.8	Very high	96.9	Very high	58 Å²	58	48.5 Å²	48.5	60%	0.598	26%	0.262	S	S	*	.	S	Bend	trans	98.4	-165.6	178.7	0	0	0	0	0	113.9
43	E	94.8	Very high	96.8	Very high	83 Å²	83	46 Å²	46	39%	0.388	25%	0.253	S	S	.	.	S	Bend	trans	-70.5	154.4	-177.7	-70.1	-64.7	161.5	0	0	112.4	R38 R45 R99	R38-E43 VanDerWaalsContact CZ-O 3.25Å; R38-E43 PolarHBondContact NE-O 2.84Å; R38-E43 PolarHBondContact NH2-O 2.88Å; E43-R45 PolarHBondContact O-N 2.86Å; E43-R99 VanDerWaalsContact CD-CZ 3.44Å; E43-R99 VanDerWaalsContact CG-NH2 3.33Å; E43-R99 WeakPolarHBondContact OE2-CD 3.26Å; E43-R99 IonicContact OE2-CZ 2.71Å; E43-R99 IonicContact OE2-NE 3.73Å; E43-R99 PolarHBondContact OE2-NE 3.44Å; E43-R99 IonicContact OE2-NH1 3.97Å; E43-R99 IonicContact OE2-NH2 3.11Å
44	P	96.8	Very high	96.7	Very high	21 Å²	21	48.8 Å²	48.8	14%	0.136	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-52.4	134.7	175.4	-26.2	34.9	0	0	0	112.2	M36 R99 L102	M36-P44 CarbonylContact O-C 3.51Å; M36-P44 WeakPolarHBondContact O-CA 3.37Å; M36-P44 WeakPolarHBondContact O-CB 3.27Å; P44-R99 HydrophobicContact CG-CB 4.41Å; P44-R99 HydrophobicContact CG-CG 4.15Å; P44-L102 HydrophobicContact CB-CD1 3.68Å; P44-L102 HydrophobicContact CG-CD1 3.95Å
45	R	98.1	Very high	96.6	Very high	79 Å²	79	47.8 Å²	47.8	30%	0.298	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	129.3	174.6	-176.5	-178.8	-175.3	178.7	-0.9	108.9	A35 M36 E43 I47 D61 S62 D63	A35-R45 CarbonylContact C-O 3.59Å; A35-R45 VanDerWaalsContact CA-O 3.28Å; A35-R45 WeakPolarHBondContact CA-O 3.48Å; M36-R45 HydrophobicContact CE-CB 4.27Å; M36-R45 HydrophobicContact CE-CG 4.34Å; M36-R45 PolarHBondContact N-O 2.87Å; M36-R45 PolarHBondContact O-N 2.94Å; E43-R45 PolarHBondContact O-N 2.86Å; R45-I47 HydrophobicContact CG-CG1 4.24Å; R45-D61 IonicContact CZ-OD1 3.58Å; R45-D61 IonicContact CZ-OD2 3.57Å; R45-D61 IonicContact NE-OD1 3.71Å; R45-D61 PolarHBondContact NE-OD1 3.19Å; R45-D61 IonicContact NE-OD2 2.72Å; R45-D61 IonicContact NH2-OD1 2.75Å; R45-D61 PolarHBondContact NH2-OD1 3.48Å; R45-D61 IonicContact NH2-OD2 3.56Å; R45-D61 PolarHBondContact NH2-OD2 3.17Å; R45-S62 WeakPolarHBondContact CA-OG 3.4Å; R45-D63 VanDerWaalsContact CD-OD2 3.23Å; R45-D63 WeakPolarHBondContact CD-OD2 3.38Å; R45-D63 HydrophobicContact CG-CB 4.36Å; R45-D63 IonicContact NE-OD2 3.51Å
46	F	98.6	Very high	96.5	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.8	176	178.7	-102.8	0	0	0	110.3	H33 T34 A35 T48 F60 S62 N94 T95 Y98	H33-F46 HydrophobicContact CB-CE2 3.95Å; H33-F46 HydrophobicContact CB-CZ 4.18Å; H33-F46 AromaticContact CD2-CZ 3.89Å; T34-F46 WeakPolarHBondContact O-CA 3.32Å; A35-F46 HydrophobicContact CB-CD2 4.21Å; F46-T48 HydrophobicContact CE1-CG2 3.71Å; F46-T48 HydrophobicContact CZ-CG2 4.14Å; F46-F60 AromaticContact CD1-CD1 3.91Å; F46-F60 HydrophobicContact CD1-CD1 3.91Å; F46-F60 AromaticContact CD1-CE1 3.9Å; F46-F60 HydrophobicContact CD1-CE1 3.9Å; F46-F60 HydrophobicContact CE1-CD1 4.23Å; F46-F60 HydrophobicContact CE1-CE1 4.49Å; F46-S62 PolarHBondContact N-OG 2.84Å; F46-S62 PolarHBondContact O-N 3.17Å; F46-S62 PolarHBondContact O-OG 2.67Å; F46-N94 HydrophobicContact CE1-CB 4Å; F46-N94 HydrophobicContact CE2-CB 4.31Å; F46-N94 HydrophobicContact CZ-CB 3.67Å; F46-T95 HydrophobicContact CB-CG2 3.99Å; F46-T95 VanDerWaalsContact CD1-OG1 3.27Å; F46-T95 WeakPolarHBondContact CD1-OG1 3.3Å; F46-Y98 HydrophobicContact CD2-CD1 4.08Å; F46-Y98 HydrophobicContact CD2-CD2 4.42Å; F46-Y98 AromaticContact CD2-CG 3.94Å; F46-Y98 HydrophobicContact CD2-CG 3.94Å; F46-Y98 AromaticContact CE2-CD1 3.83Å; F46-Y98 HydrophobicContact CE2-CD1 3.83Å; F46-Y98 AromaticContact CE2-CD2 3.86Å; F46-Y98 HydrophobicContact CE2-CD2 3.86Å; F46-Y98 HydrophobicContact CE2-CE1 4.07Å; F46-Y98 HydrophobicContact CE2-CE2 4.07Å; F46-Y98 AromaticContact CE2-CG 3.75Å; F46-Y98 HydrophobicContact CE2-CG 3.75Å
47	I	98.8	Very high	96.5	Very high	35 Å²	35	47.1 Å²	47.1	18%	0.179	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.3	175.9	-56.3	174.4	0	0	0	107.7	H33 T34 M36 R45 F60	H33-I47 WeakPolarHBondContact CA-O 3.26Å; T34-I47 PolarHBondContact N-O 3.04Å; T34-I47 PolarHBondContact O-N 3.38Å; M36-I47 HydrophobicContact CE-CD1 4.09Å; R45-I47 HydrophobicContact CG-CG1 4.24Å; I47-F60 WeakPolarHBondContact CA-O 3.42Å
48	T	98.8	Very high	96.5	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	140	166.8	168.6	0	0	0	0	110.9	F32 H33 F46 R59 F60	F32-T48 WeakPolarHBondContact O-CA 3.23Å; F32-T48 WeakPolarHBondContact O-CB 3.48Å; F32-T48 PolarHBondContact O-OG1 3.41Å; H33-T48 PolarHBondContact CE1-OG1 2.96Å; H33-T48 PolarHBondContact ND1-OG1 2.92Å; F46-T48 HydrophobicContact CE1-CG2 3.71Å; F46-T48 HydrophobicContact CZ-CG2 4.14Å; T48-R59 CarbonylContact O-C 3.54Å; T48-R59 WeakPolarHBondContact O-CA 3.29Å; T48-F60 HydrophobicContact CG2-CB 3.65Å; T48-F60 HydrophobicContact CG2-CD1 4.36Å; T48-F60 HydrophobicContact CG2-CG 4.36Å; T48-F60 PolarHBondContact N-O 3.49Å; T48-F60 PolarHBondContact O-N 3.22Å
49	V	98.8	Very high	96.7	Very high	33 Å²	33	46.7 Å²	46.7	20%	0.2	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.5	172.8	-67.6	0	0	0	0	109.7	Y31 F32 Y51 L56 M58 R59	Y31-V49 WeakPolarHBondContact CA-O 3.49Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.27Å; F32-V49 HydrophobicContact CG-CG2 4.49Å; F32-V49 PolarHBondContact N-O 3.04Å; F32-V49 PolarHBondContact O-N 3.14Å; V49-Y51 HydrophobicContact CB-CE2 4.15Å; V49-Y51 HydrophobicContact CG2-CD2 4.34Å; V49-Y51 HydrophobicContact CG2-CE2 3.84Å; V49-L56 HydrophobicContact CB-CD1 3.69Å; V49-L56 HydrophobicContact CG1-CD1 3.98Å; V49-M58 WeakPolarHBondContact CA-O 3.37Å; V49-R59 HydrophobicContact CG1-CB 4.23Å; V49-R59 HydrophobicContact CG1-CG 4.06Å
50	G	98.7	Very high	97	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.4	174.8	0	0	0	0	0	110.2	R30 F57 M58	R30-G50 WeakPolarHBondContact O-CA 3.34Å; G50-F57 WeakPolarHBondContact O-CD1 3.03Å; G50-F57 PolarHBondContact O-N 3.18Å; G50-M58 PolarHBondContact N-O 2.92Å
51	Y	98.6	Very high	97.3	Very high	75 Å²	75	40.9 Å²	40.9	29%	0.294	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.8	176.3	-76.9	-99.8	0	0	0	110.4	M29 R30 F32 V49 T55 L56	M29-Y51 CarbonylContact C-O 3.56Å; M29-Y51 WeakPolarHBondContact CA-O 3.33Å; R30-Y51 PolarHBondContact N-O 2.82Å; R30-Y51 PolarHBondContact O-N 2.94Å; F32-Y51 HydrophobicContact CD2-CD2 4.08Å; F32-Y51 HydrophobicContact CE2-CD2 4.04Å; V49-Y51 HydrophobicContact CB-CE2 4.15Å; V49-Y51 HydrophobicContact CG2-CD2 4.34Å; V49-Y51 HydrophobicContact CG2-CE2 3.84Å; Y51-T55 WeakPolarHBondContact CA-O 3.32Å; Y51-T55 VanDerWaalsContact CD1-C 3.44Å; Y51-L56 HydrophobicContact CD1-CB 4.17Å; Y51-L56 VanDerWaalsContact CD1-N 3.31Å; Y51-L56 HydrophobicContact CD2-CD1 4.15Å; Y51-L56 HydrophobicContact CE1-CB 3.6Å; Y51-L56 HydrophobicContact CE1-CD1 4.4Å; Y51-L56 HydrophobicContact CE2-CB 4.37Å; Y51-L56 HydrophobicContact CE2-CD1 3.6Å
52	V	98.3	Very high	97.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.2	155.9	177.3	0	0	0	0	105.9	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.57Å; S28-V52 VanDerWaalsContact O-CA 3.31Å; S28-V52 WeakPolarHBondContact O-CA 3.41Å; M29-V52 HydrophobicContact CG-CG2 4.38Å; V52-D54 PolarHBondContact O-N 3.27Å; V52-T55 PolarHBondContact N-O 2.88Å; V52-T55 WeakPolarHBondContact O-CA 3.34Å; V52-T55 WeakPolarHBondContact O-CB 3.4Å; V52-T55 PolarHBondContact O-N 3.42Å; V52-F57 HydrophobicContact CG2-CD1 4.05Å; V52-F57 HydrophobicContact CG2-CE1 4.03Å; V52-W75 HydrophobicContact CB-CH2 4.39Å; V52-W75 HydrophobicContact CB-CZ2 4.43Å; V52-W75 HydrophobicContact CG2-CH2 3.84Å; V52-W75 HydrophobicContact CG2-CZ2 4.37Å; V52-L192 HydrophobicContact CG1-CD1 3.62Å; V52-L192 HydrophobicContact CG2-CD1 4.3Å; V52-Y195 HydrophobicContact CG2-CD2 3.96Å; V52-L196 HydrophobicContact CG1-CD2 4.09Å; V52-L203 HydrophobicContact CB-CD1 4.3Å; V52-L203 HydrophobicContact CB-CD2 4.2Å; V52-L203 HydrophobicContact CG1-CD1 3.88Å; V52-L203 HydrophobicContact CG1-CD2 4.1Å
53	D	96.5	Very high	97.8	Very high	30 Å²	30	32.7 Å²	32.7	16%	0.16	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	-125.7	-166.1	-53.3	-40.5	0	0	0	110.3	H27 S28 T55	H27-D53 VanDerWaalsContact CA-OD1 3.27Å; H27-D53 WeakPolarHBondContact CA-OD1 3.45Å; H27-D53 IonicContact CE1-OD2 3.74Å; H27-D53 IonicContact CG-OD2 3.87Å; H27-D53 IonicContact ND1-OD1 2.76Å; H27-D53 IonicContact ND1-OD2 2.71Å; H27-D53 PolarHBondContact ND1-OD2 3.05Å; S28-D53 PolarHBondContact N-OD1 2.92Å; S28-D53 PolarHBondContact O-N 3.31Å; S28-D53 PolarHBondContact OG-OD1 3.28Å; D53-T55 VanDerWaalsContact C-N 3.33Å
54	D	96.5	Very high	98	Very high	61 Å²	61	30.4 Å²	30.4	33%	0.326	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	13.5	177.5	-60.5	-54.6	0	0	0	114	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 3.27Å; D54-Y233 HydrophobicContact CB-CE2 3.92Å; D54-P234 VanDerWaalsContact OD2-CB 3.23Å; D54-P234 WeakPolarHBondContact OD2-CB 3.31Å; D54-A235 HydrophobicContact CB-CB 4.32Å; D54-A235 WeakPolarHBondContact OD2-CB 3.39Å; D54-A235 PolarHBondContact OD2-N 2.92Å; D54-F265 HydrophobicContact CB-CE2 3.76Å; D54-F265 HydrophobicContact CB-CZ 3.75Å
55	T	96.9	Very high	97.9	Very high	16 Å²	16	36.8 Å²	36.8	10%	0.098	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112	-177.2	-59.9	0	0	0	0	111.7	Y51 V52 D53 F57 A73 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.32Å; Y51-T55 VanDerWaalsContact CD1-C 3.44Å; V52-T55 PolarHBondContact N-O 2.88Å; V52-T55 WeakPolarHBondContact O-CA 3.34Å; V52-T55 WeakPolarHBondContact O-CB 3.4Å; V52-T55 PolarHBondContact O-N 3.42Å; D53-T55 VanDerWaalsContact C-N 3.33Å; T55-F57 PolarHBondContact O-N 3.18Å; T55-A73 HydrophobicContact CG2-CB 4.47Å; T55-L203 HydrophobicContact CG2-CD2 4.16Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.45Å; T55-Y233 PolarHBondContact OG1-OH 3.24Å
56	L	97.7	Very high	97.8	Very high	51 Å²	51	36.5 Å²	36.5	27%	0.267	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	122.6	171.4	178.1	70.4	0	0	0	109.7	V49 Y51 M58 R72	V49-L56 HydrophobicContact CB-CD1 3.69Å; V49-L56 HydrophobicContact CG1-CD1 3.98Å; Y51-L56 HydrophobicContact CD1-CB 4.17Å; Y51-L56 VanDerWaalsContact CD1-N 3.31Å; Y51-L56 HydrophobicContact CD2-CD1 4.15Å; Y51-L56 HydrophobicContact CE1-CB 3.6Å; Y51-L56 HydrophobicContact CE1-CD1 4.4Å; Y51-L56 HydrophobicContact CE2-CB 4.37Å; Y51-L56 HydrophobicContact CE2-CD1 3.6Å; L56-M58 WeakPolarHBondContact CD1-O 3.38Å; L56-R72 HydrophobicContact CD2-CB 3.94Å; L56-R72 HydrophobicContact CD2-CG 3.94Å; L56-R72 HydrophobicContact CG-CB 3.79Å; L56-R72 HydrophobicContact CG-CG 4.1Å; L56-R72 CarbonylContact O-C 3.6Å
57	F	97.9	Very high	97.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	-17.2	-179.2	77.5	-82.9	0	0	0	114.3	M29 Y31 G50 V52 T55 R72 A73 W75 I76 Y195	M29-F57 HydrophobicContact SD-CZ 4.3Å; Y31-F57 HydrophobicContact CE1-CZ 4.01Å; Y31-F57 AromaticContact CZ-CZ 3.97Å; G50-F57 WeakPolarHBondContact O-CD1 3.03Å; G50-F57 PolarHBondContact O-N 3.18Å; V52-F57 HydrophobicContact CG2-CD1 4.05Å; V52-F57 HydrophobicContact CG2-CE1 4.03Å; T55-F57 PolarHBondContact O-N 3.18Å; F57-R72 PolarHBondContact O-N 2.9Å; F57-A73 HydrophobicContact CB-CB 4.01Å; F57-W75 HydrophobicContact CB-CH2 3.16Å; F57-W75 HydrophobicContact CB-CZ2 3.31Å; F57-W75 HydrophobicContact CB-CZ3 4.02Å; F57-W75 HydrophobicContact CD1-CH2 4.04Å; F57-W75 AromaticContact CD2-CH2 3.59Å; F57-W75 HydrophobicContact CD2-CH2 3.59Å; F57-W75 AromaticContact CD2-CZ3 3.88Å; F57-W75 HydrophobicContact CD2-CZ3 3.88Å; F57-W75 HydrophobicContact CE2-CH2 4.38Å; F57-W75 AromaticContact CG-CH2 3.37Å; F57-W75 HydrophobicContact CG-CH2 3.37Å; F57-W75 HydrophobicContact CG-CZ2 4.02Å; F57-W75 HydrophobicContact CG-CZ3 4.13Å; F57-I76 HydrophobicContact CD2-CB 4.31Å; F57-I76 HydrophobicContact CD2-CD1 3.95Å; F57-I76 HydrophobicContact CD2-CG1 3.96Å; F57-I76 HydrophobicContact CE2-CD1 4.14Å; F57-I76 VanDerWaalsContact O-CG2 3.24Å; F57-I76 WeakPolarHBondContact O-CG2 2.94Å; F57-Y195 HydrophobicContact CE2-CD2 4.11Å; F57-Y195 AromaticContact CE2-CE2 3.6Å; F57-Y195 HydrophobicContact CE2-CE2 3.6Å; F57-Y195 AromaticContact CE2-CZ 3.94Å; F57-Y195 HydrophobicContact CZ-CD2 4.23Å; F57-Y195 AromaticContact CZ-CE2 3.76Å; F57-Y195 HydrophobicContact CZ-CE2 3.76Å
58	M	97.8	Very high	97.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	155.7	176.7	56.5	167.9	62.6	0	0	113.6	Y31 V49 G50 L56 K69 E70 Y83	Y31-M58 HydrophobicContact CD1-SD 4.43Å; Y31-M58 HydrophobicContact CE1-SD 3.6Å; V49-M58 WeakPolarHBondContact CA-O 3.37Å; G50-M58 PolarHBondContact N-O 2.92Å; L56-M58 WeakPolarHBondContact CD1-O 3.38Å; M58-K69 HydrophobicContact CB-CG 4.45Å; M58-K69 HydrophobicContact SD-CD 4.26Å; M58-K69 WeakPolarHBondContact SD-CE 3.33Å; M58-K69 HydrophobicContact SD-CG 4.34Å; M58-E70 VanDerWaalsContact CA-O 3.25Å; M58-E70 WeakPolarHBondContact CA-O 3.27Å; M58-Y83 HydrophobicContact CE-CE1 4.26Å; M58-Y83 WeakPolarHBondContact CE-OH 3.33Å
59	R	98.4	Very high	97.7	Very high	85 Å²	85	43.8 Å²	43.8	32%	0.321	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	150.6	175.8	178.2	176.2	170.8	172.7	-3	111.6	T48 V49 D61 K69 E70 R72	T48-R59 CarbonylContact O-C 3.54Å; T48-R59 WeakPolarHBondContact O-CA 3.29Å; V49-R59 HydrophobicContact CG1-CB 4.23Å; V49-R59 HydrophobicContact CG1-CG 4.06Å; R59-D61 IonicContact CZ-OD2 3.25Å; R59-D61 IonicContact NH2-OD2 2.88Å; R59-D61 PolarHBondContact NH2-OD2 3.27Å; R59-K69 WeakPolarHBondContact O-CA 3.18Å; R59-E70 PolarHBondContact N-O 2.81Å; R59-E70 PolarHBondContact O-N 2.81Å; R59-R72 HydrophobicContact CB-CG 4.1Å
60	F	98.8	Very high	97.6	Very high	3 Å²	3	45.8 Å²	45.8	1%	0.013	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.2	162.4	173	-82	0	0	0	109.2	F46 I47 T48 P67 R68 K69 S91 K92	F46-F60 AromaticContact CD1-CD1 3.91Å; F46-F60 HydrophobicContact CD1-CD1 3.91Å; F46-F60 AromaticContact CD1-CE1 3.9Å; F46-F60 HydrophobicContact CD1-CE1 3.9Å; F46-F60 HydrophobicContact CE1-CD1 4.23Å; F46-F60 HydrophobicContact CE1-CE1 4.49Å; I47-F60 WeakPolarHBondContact CA-O 3.42Å; T48-F60 HydrophobicContact CG2-CB 3.65Å; T48-F60 HydrophobicContact CG2-CD1 4.36Å; T48-F60 HydrophobicContact CG2-CG 4.36Å; T48-F60 PolarHBondContact N-O 3.49Å; T48-F60 PolarHBondContact O-N 3.22Å; F60-P67 HydrophobicContact CE2-CB 3.74Å; F60-P67 HydrophobicContact CZ-CB 3.66Å; F60-R68 WeakPolarHBondContact CD2-O 3.42Å; F60-K69 HydrophobicContact CB-CD 3.83Å; F60-S91 VanDerWaalsContact CD2-CB 3.49Å; F60-K92 HydrophobicContact CE2-CG 4.25Å; F60-K92 HydrophobicContact CZ-CG 4.21Å
61	D	98.6	Very high	97.6	Very high	19 Å²	19	48.1 Å²	48.1	10%	0.102	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	120	177.2	-161.4	-30.6	0	0	0	109.4	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 3.58Å; R45-D61 IonicContact CZ-OD2 3.57Å; R45-D61 IonicContact NE-OD1 3.71Å; R45-D61 PolarHBondContact NE-OD1 3.19Å; R45-D61 IonicContact NE-OD2 2.72Å; R45-D61 IonicContact NH2-OD1 2.75Å; R45-D61 PolarHBondContact NH2-OD1 3.48Å; R45-D61 IonicContact NH2-OD2 3.56Å; R45-D61 PolarHBondContact NH2-OD2 3.17Å; R59-D61 IonicContact CZ-OD2 3.25Å; R59-D61 IonicContact NH2-OD2 2.88Å; R59-D61 PolarHBondContact NH2-OD2 3.27Å; D61-D63 PolarHBondContact O-N 3.11Å; D61-D63 PolarHBondContact OD1-N 2.92Å; D61-A64 HydrophobicContact CB-CB 4.5Å; D61-A64 WeakPolarHBondContact O-CB 3.47Å; D61-A64 PolarHBondContact O-N 3.09Å
62	S	98.3	Very high	97.5	Very high	26 Å²	26	50.2 Å²	50.2	18%	0.182	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.7	-178.4	68.2	0	0	0	0	113.3	R45 F46	R45-S62 WeakPolarHBondContact CA-OG 3.4Å; F46-S62 PolarHBondContact N-OG 2.84Å; F46-S62 PolarHBondContact O-N 3.17Å; F46-S62 PolarHBondContact O-OG 2.67Å
63	D	97.3	Very high	97.4	Very high	67 Å²	67	50.4 Å²	50.4	36%	0.358	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-3.4	-180	-79.1	5.6	0	0	0	112.9	R38 R45 D61	R38-D63 IonicContact CZ-OD1 3.6Å; R38-D63 IonicContact CZ-OD2 3.44Å; R38-D63 IonicContact NH1-OD1 3.68Å; R38-D63 PolarHBondContact NH1-OD1 2.94Å; R38-D63 IonicContact NH1-OD2 3.15Å; R38-D63 PolarHBondContact NH1-OD2 2.93Å; R38-D63 IonicContact NH2-OD1 3.33Å; R38-D63 PolarHBondContact NH2-OD1 3.02Å; R38-D63 IonicContact NH2-OD2 3.74Å; R45-D63 VanDerWaalsContact CD-OD2 3.23Å; R45-D63 WeakPolarHBondContact CD-OD2 3.38Å; R45-D63 HydrophobicContact CG-CB 4.36Å; R45-D63 IonicContact NE-OD2 3.51Å; D61-D63 PolarHBondContact O-N 3.11Å; D61-D63 PolarHBondContact OD1-N 2.92Å
64	A	97	Very high	97.4	Very high	35 Å²	35	54 Å²	54	29%	0.289	29%	0.289	S	S	.	.	S	Bend	trans	-63.2	149.1	174.2	0	0	0	0	0	111	D61 S66 P67	D61-A64 HydrophobicContact CB-CB 4.5Å; D61-A64 WeakPolarHBondContact O-CB 3.47Å; D61-A64 PolarHBondContact O-N 3.09Å; A64-S66 PolarHBondContact O-N 3Å; A64-S66 VanDerWaalsContact O-N 3.17Å; A64-P67 WeakPolarHBondContact O-CD 3.16Å; A64-P67 VanDerWaalsContact O-CG 3.24Å; A64-P67 WeakPolarHBondContact O-CG 3.42Å
65	T	95.8	Very high	97.4	Very high	156 Å²	156	51.9 Å²	51.9	96%	0.957	28%	0.277	S	S	*	.	S	Bend	trans	-57.2	-33.9	178.9	-50.8	0	0	0	0	112.7
66	S	96.1	Very high	97.4	Very high	72 Å²	72	51.1 Å²	51.1	50%	0.503	27%	0.272	S	S	.	.	S	Bend	trans	-133.1	85.6	174	-175.4	0	0	0	0	108.6	A64 R68	A64-S66 PolarHBondContact O-N 3Å; A64-S66 VanDerWaalsContact O-N 3.17Å; S66-R68 PolarHBondContact O-N 2.79Å
67	P	96.9	Very high	97.3	Very high	36 Å²	36	54.7 Å²	54.7	23%	0.234	29%	0.287	C	S	.	.			trans	-61.9	111.6	-174.4	-24.3	35	0	0	0	111.7	F60 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.74Å; F60-P67 HydrophobicContact CZ-CB 3.66Å; A64-P67 WeakPolarHBondContact O-CD 3.16Å; A64-P67 VanDerWaalsContact O-CG 3.24Å; A64-P67 WeakPolarHBondContact O-CG 3.42Å; P67-K92 VanDerWaalsContact O-CE 3.28Å; P67-K92 WeakPolarHBondContact O-CE 3.47Å
68	R	97.9	Very high	97.2	Very high	143 Å²	143	60.4 Å²	60.4	54%	0.54	31%	0.314	S	S	.	.			trans	-139.8	158.3	177.1	-65.7	-170.6	179.7	-154.8	-2.5	110.1	F60 S66 T88	F60-R68 WeakPolarHBondContact CD2-O 3.42Å; S66-R68 PolarHBondContact O-N 2.79Å; R68-T88 HydrophobicContact CB-CG2 4.35Å; R68-T88 HydrophobicContact CG-CG2 4.24Å
69	K	98.1	Very high	97.2	Very high	12 Å²	12	61 Å²	61	5%	0.052	32%	0.317	C	S	.	.			trans	-73.6	124.6	168.8	-158	74.5	160.9	-164.6	0	107.6	M58 R59 F60 W84 E87 T88	M58-K69 HydrophobicContact CB-CG 4.45Å; M58-K69 HydrophobicContact SD-CD 4.26Å; M58-K69 WeakPolarHBondContact SD-CE 3.33Å; M58-K69 HydrophobicContact SD-CG 4.34Å; R59-K69 WeakPolarHBondContact O-CA 3.18Å; F60-K69 HydrophobicContact CB-CD 3.83Å; K69-W84 HydrophobicContact CB-CE3 4.14Å; K69-W84 HydrophobicContact CB-CZ3 4.37Å; K69-W84 HydrophobicContact CG-CE3 4.32Å; K69-W84 HydrophobicContact CG-CZ3 4.11Å; K69-E87 HydrophobicContact CB-CB 4.1Å; K69-E87 HydrophobicContact CG-CB 3.94Å; K69-T88 PolarHBondContact N-OG1 2.74Å
70	E	97.9	Very high	97.1	Very high	74 Å²	74	58.5 Å²	58.5	35%	0.346	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	137.2	-174.9	-65.5	174.1	168.1	0	0	110.2	M58 R59 R72	M58-E70 VanDerWaalsContact CA-O 3.25Å; M58-E70 WeakPolarHBondContact CA-O 3.27Å; R59-E70 PolarHBondContact N-O 2.81Å; R59-E70 PolarHBondContact O-N 2.81Å; E70-R72 IonicContact OE2-CZ 3.36Å; E70-R72 IonicContact OE2-NH2 2.69Å; E70-R72 PolarHBondContact OE2-NH2 2.03Å
71	P	98.1	Very high	97	Very high	49 Å²	49	63 Å²	63	32%	0.318	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	146.8	172	28.8	-34	0	0	0	110.9	I76 E77 W84	P71-I76 HydrophobicContact CB-CG2 3.62Å; P71-E77 HydrophobicContact CB-CG 3.79Å; P71-E77 HydrophobicContact CG-CG 4.03Å; P71-W84 HydrophobicContact CB-CH2 3.62Å; P71-W84 HydrophobicContact CB-CZ2 3.82Å; P71-W84 HydrophobicContact CG-CH2 4.28Å; P71-W84 HydrophobicContact CG-CZ2 4.3Å
72	R	97.4	Very high	97	Very high	119 Å²	119	70 Å²	70	45%	0.449	38%	0.38	S	S	.	.			trans	-131.3	-0.1	175.6	-61.6	-65.4	173.3	178	-1.8	113.3	L56 F57 R59 E70	L56-R72 HydrophobicContact CD2-CB 3.94Å; L56-R72 HydrophobicContact CD2-CG 3.94Å; L56-R72 HydrophobicContact CG-CB 3.79Å; L56-R72 HydrophobicContact CG-CG 4.1Å; L56-R72 CarbonylContact O-C 3.6Å; F57-R72 PolarHBondContact O-N 2.9Å; R59-R72 HydrophobicContact CB-CG 4.1Å; E70-R72 IonicContact OE2-CZ 3.36Å; E70-R72 IonicContact OE2-NH2 2.69Å; E70-R72 PolarHBondContact OE2-NH2 2.03Å
73	A	96	Very high	97	Very high	4 Å²	4	69.3 Å²	69.3	3%	0.033	37%	0.373	C	S	.	.	S	Bend	trans	-135.1	145.2	172.6	0	0	0	0	0	110.3	T55 F57 W75 I76	T55-A73 HydrophobicContact CG2-CB 4.47Å; F57-A73 HydrophobicContact CB-CB 4.01Å; A73-W75 VanDerWaalsContact C-N 3.31Å; A73-W75 HydrophobicContact CB-CD2 4.17Å; A73-W75 HydrophobicContact CB-CG 4.38Å; A73-W75 HydrophobicContact CB-CZ2 4.02Å; A73-W75 PolarHBondContact O-N 2.9Å; A73-I76 WeakPolarHBondContact O-CG2 3.29Å; A73-I76 PolarHBondContact O-N 3.3Å
74	P	96.1	Very high	97	Very high	105 Å²	105	68 Å²	68	68%	0.682	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-59.2	-38.4	-177.4	-26.3	35	0	0	0	113.8	I76 E77	P74-I76 PolarHBondContact O-N 3.14Å; P74-E77 WeakPolarHBondContact O-CB 3.29Å; P74-E77 PolarHBondContact O-N 2.76Å; P74-E77 VanDerWaalsContact O-N 3.11Å
75	W	96	Very high	97.1	Very high	18 Å²	18	71 Å²	71	7%	0.068	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-69.5	-14.3	-175.9	53.5	-107.3	0	0	0	114.4	V52 F57 A73 Q78 Y195 N198 L203	V52-W75 HydrophobicContact CB-CH2 4.39Å; V52-W75 HydrophobicContact CB-CZ2 4.43Å; V52-W75 HydrophobicContact CG2-CH2 3.84Å; V52-W75 HydrophobicContact CG2-CZ2 4.37Å; F57-W75 HydrophobicContact CB-CH2 3.16Å; F57-W75 HydrophobicContact CB-CZ2 3.31Å; F57-W75 HydrophobicContact CB-CZ3 4.02Å; F57-W75 HydrophobicContact CD1-CH2 4.04Å; F57-W75 AromaticContact CD2-CH2 3.59Å; F57-W75 HydrophobicContact CD2-CH2 3.59Å; F57-W75 AromaticContact CD2-CZ3 3.88Å; F57-W75 HydrophobicContact CD2-CZ3 3.88Å; F57-W75 HydrophobicContact CE2-CH2 4.38Å; F57-W75 AromaticContact CG-CH2 3.37Å; F57-W75 HydrophobicContact CG-CH2 3.37Å; F57-W75 HydrophobicContact CG-CZ2 4.02Å; F57-W75 HydrophobicContact CG-CZ3 4.13Å; A73-W75 VanDerWaalsContact C-N 3.31Å; A73-W75 HydrophobicContact CB-CD2 4.17Å; A73-W75 HydrophobicContact CB-CG 4.38Å; A73-W75 HydrophobicContact CB-CZ2 4.02Å; A73-W75 PolarHBondContact O-N 2.9Å; W75-Q78 WeakPolarHBondContact O-CG 3.32Å; W75-Y195 HydrophobicContact CE3-CD1 4.43Å; W75-Y195 HydrophobicContact CH2-CD2 4.49Å; W75-Y195 HydrophobicContact CH2-CG 4.17Å; W75-Y195 AromaticContact CZ3-CD1 3.76Å; W75-Y195 HydrophobicContact CZ3-CD1 3.76Å; W75-Y195 HydrophobicContact CZ3-CD2 4.28Å; W75-Y195 AromaticContact CZ3-CG 3.62Å; W75-Y195 HydrophobicContact CZ3-CG 3.62Å; W75-N198 HydrophobicContact CB-CB 4.48Å; W75-N198 WeakPolarHBondContact CB-O 3.03Å; W75-L203 HydrophobicContact CD2-CD1 4.46Å; W75-L203 HydrophobicContact CH2-CD1 4.42Å; W75-L203 HydrophobicContact CZ2-CD1 3.88Å; W75-L203 HydrophobicContact CZ2-CD2 4.21Å; W75-L203 HydrophobicContact CZ2-CG 4.47Å
76	I	97.4	Very high	97.2	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-89.5	-19.1	173.9	-162.8	71.3	0	0	0	111.8	F57 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-I76 HydrophobicContact CD2-CB 4.31Å; F57-I76 HydrophobicContact CD2-CD1 3.95Å; F57-I76 HydrophobicContact CD2-CG1 3.96Å; F57-I76 HydrophobicContact CE2-CD1 4.14Å; F57-I76 VanDerWaalsContact O-CG2 3.24Å; F57-I76 WeakPolarHBondContact O-CG2 2.94Å; P71-I76 HydrophobicContact CB-CG2 3.62Å; A73-I76 WeakPolarHBondContact O-CG2 3.29Å; A73-I76 PolarHBondContact O-N 3.3Å; P74-I76 PolarHBondContact O-N 3.14Å; I76-Q78 PolarHBondContact O-N 2.71Å; I76-Q78 VanDerWaalsContact O-N 3.16Å; I76-E79 HydrophobicContact CD1-CG 3.67Å; I76-E79 HydrophobicContact CG1-CG 4.21Å; I76-E79 WeakPolarHBondContact O-CB 3.23Å; I76-E79 WeakPolarHBondContact O-CG 3.11Å; I76-E79 PolarHBondContact O-N 2.89Å; I76-Y83 HydrophobicContact CD1-CE1 4.3Å; I76-Y83 HydrophobicContact CG1-CE1 4.37Å; I76-W84 HydrophobicContact CB-CH2 4.45Å; I76-W84 HydrophobicContact CB-CZ2 4.49Å; I76-W84 HydrophobicContact CG1-CH2 3.72Å; I76-W84 HydrophobicContact CG1-CZ2 3.87Å; I76-W84 HydrophobicContact CG2-CH2 3.99Å; I76-W84 HydrophobicContact CG2-CZ2 4.22Å; I76-W84 WeakPolarHBondContact O-CZ2 3.17Å; I76-Y195 HydrophobicContact CD1-CD1 3.77Å; I76-Y195 HydrophobicContact CD1-CE1 3.29Å
77	E	96	Very high	97.3	Very high	125 Å²	125	66.6 Å²	66.6	58%	0.584	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.9	-176.9	-65	-178	-176.7	0	0	113.1	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.79Å; P71-E77 HydrophobicContact CG-CG 4.03Å; P74-E77 WeakPolarHBondContact O-CB 3.29Å; P74-E77 PolarHBondContact O-N 2.76Å; P74-E77 VanDerWaalsContact O-N 3.11Å; E77-E79 PolarHBondContact O-N 3.46Å
78	Q	95.3	Very high	97.3	Very high	121 Å²	121	65.3 Å²	65.3	57%	0.565	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-12.6	175.7	68.7	-178.9	16.6	0	0	114	W75 I76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.32Å; I76-Q78 PolarHBondContact O-N 2.71Å; I76-Q78 VanDerWaalsContact O-N 3.16Å; Q78-N198 PolarHBondContact NE2-ND2 3.08Å; Q78-N198 PolarHBondContact NE2-OD1 2.88Å
79	E	97.2	Very high	97.4	Very high	11 Å²	11	63.9 Å²	63.9	5%	0.051	32%	0.321	C	S	.	.	S	Bend	trans	-64.9	136.2	174.5	-66.9	-60.9	159.8	0	0	110.8	I76 E77 Y83 W84 R194 N198	I76-E79 HydrophobicContact CD1-CG 3.67Å; I76-E79 HydrophobicContact CG1-CG 4.21Å; I76-E79 WeakPolarHBondContact O-CB 3.23Å; I76-E79 WeakPolarHBondContact O-CG 3.11Å; I76-E79 PolarHBondContact O-N 2.89Å; E77-E79 PolarHBondContact O-N 3.46Å; E79-Y83 HydrophobicContact CB-CD1 3.6Å; E79-Y83 HydrophobicContact CB-CD2 4.48Å; E79-Y83 HydrophobicContact CB-CE1 4.14Å; E79-Y83 HydrophobicContact CB-CG 3.8Å; E79-Y83 HydrophobicContact CG-CD1 4.11Å; E79-Y83 HydrophobicContact CG-CD2 4.43Å; E79-Y83 HydrophobicContact CG-CE1 4.23Å; E79-Y83 HydrophobicContact CG-CG 4.21Å; E79-W84 PolarHBondContact O-NE1 2.95Å; E79-R194 VanDerWaalsContact CD-NH2 3.34Å; E79-R194 IonicContact OE1-CZ 3.68Å; E79-R194 IonicContact OE1-NE 3.21Å; E79-R194 PolarHBondContact OE1-NE 2.84Å; E79-R194 IonicContact OE1-NH2 3.73Å; E79-R194 PolarHBondContact OE1-NH2 3.21Å; E79-R194 VanDerWaalsContact OE1-NH2 3.15Å; E79-R194 IonicContact OE2-CZ 3.03Å; E79-R194 IonicContact OE2-NE 3.5Å; E79-R194 IonicContact OE2-NH2 2.75Å; E79-R194 PolarHBondContact OE2-NH2 3.07Å; E79-N198 PolarHBondContact OE1-ND2 3.05Å
80	G	96.5	Very high	97.4	Very high	34 Å²	34	66.7 Å²	66.7	35%	0.351	34%	0.336	S	S	.	.			trans	-69.7	168.8	-174.2	0	0	0	0	0	114.2	E82 Y83 W84	G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 2.81Å; G80-Y83 WeakPolarHBondContact O-CB 3.39Å; G80-Y83 PolarHBondContact O-N 2.9Å; G80-Y83 VanDerWaalsContact O-N 3.09Å; G80-W84 VanDerWaalsContact O-CD1 3.31Å; G80-W84 PolarHBondContact O-N 2.8Å
81	P	97.3	Very high	97.4	Very high	97 Å²	97	63.2 Å²	63.2	63%	0.63	32%	0.32	S	S	*	.	H	α-helix	trans	-58.4	-35.3	-178.7	23.2	-33.7	0	0	0	113.2	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.27Å; P81-Y83 PolarHBondContact O-N 2.93Å; P81-W84 PolarHBondContact O-N 3.41Å; P81-D85 WeakPolarHBondContact O-CB 3.34Å; P81-D85 PolarHBondContact O-N 3.32Å
82	E	97.8	Very high	97.4	Very high	167 Å²	167	65.2 Å²	65.2	78%	0.78	32%	0.323	S	S	*	.	H	α-helix	trans	-59.5	-37	177.9	-63.6	-178.5	177.9	0	0	112.7	G80 R86	G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 2.81Å; E82-R86 VanDerWaalsContact O-CB 3.26Å; E82-R86 WeakPolarHBondContact O-CB 3.4Å; E82-R86 PolarHBondContact O-N 2.96Å
83	Y	97.8	Very high	97.4	Very high	11 Å²	11	63 Å²	63	4%	0.043	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-52.8	174.8	172.5	-89.4	0	0	0	110.3	M58 I76 E79 G80 P81 D85 R86 E87 W191 Y195	M58-Y83 HydrophobicContact CE-CE1 4.26Å; M58-Y83 WeakPolarHBondContact CE-OH 3.33Å; I76-Y83 HydrophobicContact CD1-CE1 4.3Å; I76-Y83 HydrophobicContact CG1-CE1 4.37Å; E79-Y83 HydrophobicContact CB-CD1 3.6Å; E79-Y83 HydrophobicContact CB-CD2 4.48Å; E79-Y83 HydrophobicContact CB-CE1 4.14Å; E79-Y83 HydrophobicContact CB-CG 3.8Å; E79-Y83 HydrophobicContact CG-CD1 4.11Å; E79-Y83 HydrophobicContact CG-CD2 4.43Å; E79-Y83 HydrophobicContact CG-CE1 4.23Å; E79-Y83 HydrophobicContact CG-CG 4.21Å; G80-Y83 WeakPolarHBondContact O-CB 3.39Å; G80-Y83 PolarHBondContact O-N 2.9Å; G80-Y83 VanDerWaalsContact O-N 3.09Å; P81-Y83 VanDerWaalsContact C-N 3.27Å; P81-Y83 PolarHBondContact O-N 2.93Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.9Å; Y83-R86 PolarHBondContact O-N 3.28Å; Y83-E87 HydrophobicContact CD1-CG 4.22Å; Y83-E87 HydrophobicContact CD2-CG 4.36Å; Y83-E87 HydrophobicContact CE1-CG 3.87Å; Y83-E87 HydrophobicContact CE2-CG 4.05Å; Y83-E87 HydrophobicContact CG-CG 4.44Å; Y83-E87 WeakPolarHBondContact O-CG 3.35Å; Y83-E87 PolarHBondContact O-N 2.96Å; Y83-W191 AromaticContact CD2-CH2 3.55Å; Y83-W191 HydrophobicContact CD2-CH2 3.55Å; Y83-W191 HydrophobicContact CD2-CZ2 4.23Å; Y83-W191 AromaticContact CD2-CZ3 3.85Å; Y83-W191 HydrophobicContact CD2-CZ3 3.85Å; Y83-W191 HydrophobicContact CE2-CE3 4.16Å; Y83-W191 AromaticContact CE2-CH2 3.73Å; Y83-W191 HydrophobicContact CE2-CH2 3.73Å; Y83-W191 HydrophobicContact CE2-CZ2 4.3Å; Y83-W191 AromaticContact CE2-CZ3 3.63Å; Y83-W191 HydrophobicContact CE2-CZ3 3.63Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.48Å; Y83-Y195 PolarHBondContact OH-OH 2.91Å
84	W	98.3	Very high	97.5	Very high	38 Å²	38	64.2 Å²	64.2	14%	0.144	33%	0.329	C	S	.	.	H	α-helix	trans	-64	-38.1	-177.4	-67.5	112.6	0	0	0	113.1	K69 P71 I76 E79 G80 P81 T88	K69-W84 HydrophobicContact CB-CE3 4.14Å; K69-W84 HydrophobicContact CB-CZ3 4.37Å; K69-W84 HydrophobicContact CG-CE3 4.32Å; K69-W84 HydrophobicContact CG-CZ3 4.11Å; P71-W84 HydrophobicContact CB-CH2 3.62Å; P71-W84 HydrophobicContact CB-CZ2 3.82Å; P71-W84 HydrophobicContact CG-CH2 4.28Å; P71-W84 HydrophobicContact CG-CZ2 4.3Å; I76-W84 HydrophobicContact CB-CH2 4.45Å; I76-W84 HydrophobicContact CB-CZ2 4.49Å; I76-W84 HydrophobicContact CG1-CH2 3.72Å; I76-W84 HydrophobicContact CG1-CZ2 3.87Å; I76-W84 HydrophobicContact CG2-CH2 3.99Å; I76-W84 HydrophobicContact CG2-CZ2 4.22Å; I76-W84 WeakPolarHBondContact O-CZ2 3.17Å; E79-W84 PolarHBondContact O-NE1 2.95Å; G80-W84 VanDerWaalsContact O-CD1 3.31Å; G80-W84 PolarHBondContact O-N 2.8Å; P81-W84 PolarHBondContact O-N 3.41Å; W84-T88 WeakPolarHBondContact O-CB 3.34Å; W84-T88 PolarHBondContact O-N 3.24Å; W84-T88 PolarHBondContact O-OG1 3.08Å
85	D	98.3	Very high	97.6	Very high	98 Å²	98	59.9 Å²	59.9	52%	0.524	30%	0.301	S	S	.	.	H	α-helix	trans	-66.3	-43.6	175.8	-75.7	-21.6	0	0	0	111	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.34Å; P81-D85 PolarHBondContact O-N 3.32Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.9Å; D85-T88 PolarHBondContact O-N 3.27Å; D85-Q89 WeakPolarHBondContact O-CB 3.43Å; D85-Q89 PolarHBondContact O-N 3.17Å
86	R	98	Very high	97.7	Very high	112 Å²	112	63.2 Å²	63.2	42%	0.423	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-50.8	175.8	-172.4	-176.1	70.8	-158.7	-2.5	111.8	E82 Y83 T88 Q89 I90	E82-R86 VanDerWaalsContact O-CB 3.26Å; E82-R86 WeakPolarHBondContact O-CB 3.4Å; E82-R86 PolarHBondContact O-N 2.96Å; Y83-R86 PolarHBondContact O-N 3.28Å; R86-T88 VanDerWaalsContact C-N 3.29Å; R86-T88 PolarHBondContact O-N 3Å; R86-Q89 PolarHBondContact O-N 2.76Å; R86-Q89 VanDerWaalsContact O-N 3.15Å; R86-I90 HydrophobicContact CG-CD1 4.03Å; R86-I90 WeakPolarHBondContact O-CG1 3.13Å; R86-I90 PolarHBondContact O-N 2.71Å
87	E	98.2	Very high	97.7	Very high	24 Å²	24	66.2 Å²	66.2	11%	0.112	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-33.8	-179.3	-65	-48	129.1	0	0	112.3	K69 Y83 S91	K69-E87 HydrophobicContact CB-CB 4.1Å; K69-E87 HydrophobicContact CG-CB 3.94Å; Y83-E87 HydrophobicContact CD1-CG 4.22Å; Y83-E87 HydrophobicContact CD2-CG 4.36Å; Y83-E87 HydrophobicContact CE1-CG 3.87Å; Y83-E87 HydrophobicContact CE2-CG 4.05Å; Y83-E87 HydrophobicContact CG-CG 4.44Å; Y83-E87 WeakPolarHBondContact O-CG 3.35Å; Y83-E87 PolarHBondContact O-N 2.96Å; E87-S91 WeakPolarHBondContact O-CB 3.33Å; E87-S91 PolarHBondContact O-N 2.85Å; E87-S91 PolarHBondContact O-OG 2.73Å
88	T	98.5	Very high	97.7	Very high	10 Å²	10	60.7 Å²	60.7	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-46.4	171.7	-66.8	0	0	0	0	110.9	R68 K69 W84 D85 R86 S91 K92	R68-T88 HydrophobicContact CB-CG2 4.35Å; R68-T88 HydrophobicContact CG-CG2 4.24Å; K69-T88 PolarHBondContact N-OG1 2.74Å; W84-T88 WeakPolarHBondContact O-CB 3.34Å; W84-T88 PolarHBondContact O-N 3.24Å; W84-T88 PolarHBondContact O-OG1 3.08Å; D85-T88 PolarHBondContact O-N 3.27Å; R86-T88 VanDerWaalsContact C-N 3.29Å; R86-T88 PolarHBondContact O-N 3Å; T88-S91 PolarHBondContact O-N 2.81Å; T88-K92 HydrophobicContact CG2-CD 4.18Å; T88-K92 WeakPolarHBondContact O-CG 3.49Å; T88-K92 PolarHBondContact O-N 2.77Å
89	Q	98.4	Very high	97.8	Very high	113 Å²	113	57.1 Å²	57.1	53%	0.528	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-41.6	179.8	-172.5	59.6	20.3	0	0	111.7	D85 R86 S91 K92 T93	D85-Q89 WeakPolarHBondContact O-CB 3.43Å; D85-Q89 PolarHBondContact O-N 3.17Å; R86-Q89 PolarHBondContact O-N 2.76Å; R86-Q89 VanDerWaalsContact O-N 3.15Å; Q89-S91 VanDerWaalsContact C-N 3.31Å; Q89-S91 PolarHBondContact O-N 2.85Å; Q89-K92 PolarHBondContact O-N 2.66Å; Q89-T93 PolarHBondContact O-N 3.49Å; Q89-T93 PolarHBondContact O-OG1 3.11Å; Q89-T93 VanDerWaalsContact O-OG1 3.12Å
90	I	97.9	Very high	97.8	Very high	70 Å²	70	62 Å²	62	36%	0.359	31%	0.314	S	S	.	.	H	α-helix	trans	-56.8	-46.6	172.6	-69.3	166.3	0	0	0	110.4	R86 K92 T93 N94	R86-I90 HydrophobicContact CG-CD1 4.03Å; R86-I90 WeakPolarHBondContact O-CG1 3.13Å; R86-I90 PolarHBondContact O-N 2.71Å; I90-K92 PolarHBondContact O-N 2.81Å; I90-T93 PolarHBondContact O-N 3.16Å; I90-N94 WeakPolarHBondContact O-CB 3.23Å; I90-N94 PolarHBondContact O-N 2.97Å
91	S	98.3	Very high	97.9	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-35.8	-179.8	-57.3	0	0	0	0	112.7	F60 E87 T88 Q89 N94 T95	F60-S91 VanDerWaalsContact CD2-CB 3.49Å; E87-S91 WeakPolarHBondContact O-CB 3.33Å; E87-S91 PolarHBondContact O-N 2.85Å; E87-S91 PolarHBondContact O-OG 2.73Å; T88-S91 PolarHBondContact O-N 2.81Å; Q89-S91 VanDerWaalsContact C-N 3.31Å; Q89-S91 PolarHBondContact O-N 2.85Å; S91-N94 PolarHBondContact O-N 3.35Å; S91-T95 PolarHBondContact O-N 3.4Å; S91-T95 PolarHBondContact O-OG1 3.5Å
92	K	98.1	Very high	97.9	Very high	91 Å²	91	57.6 Å²	57.6	40%	0.396	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-42.6	173.5	-74	177.6	177.6	177.5	0	112.2	F60 P67 T88 Q89 I90 T95 Q96	F60-K92 HydrophobicContact CE2-CG 4.25Å; F60-K92 HydrophobicContact CZ-CG 4.21Å; P67-K92 VanDerWaalsContact O-CE 3.28Å; P67-K92 WeakPolarHBondContact O-CE 3.47Å; T88-K92 HydrophobicContact CG2-CD 4.18Å; T88-K92 WeakPolarHBondContact O-CG 3.49Å; T88-K92 PolarHBondContact O-N 2.77Å; Q89-K92 PolarHBondContact O-N 2.66Å; I90-K92 PolarHBondContact O-N 2.81Å; K92-T95 WeakPolarHBondContact O-CB 3.34Å; K92-T95 PolarHBondContact O-N 3.46Å; K92-Q96 PolarHBondContact O-N 3.42Å
93	T	98.3	Very high	97.8	Very high	73 Å²	73	56.1 Å²	56.1	45%	0.448	27%	0.266	S	S	.	.	H	α-helix	trans	-60.8	-47.5	173.3	-60.7	0	0	0	0	110.6	Q89 I90 T95 Q96 T97	Q89-T93 PolarHBondContact O-N 3.49Å; Q89-T93 PolarHBondContact O-OG1 3.11Å; Q89-T93 VanDerWaalsContact O-OG1 3.12Å; I90-T93 PolarHBondContact O-N 3.16Å; T93-T95 VanDerWaalsContact C-N 3.26Å; T93-T95 PolarHBondContact O-N 3.05Å; T93-Q96 PolarHBondContact O-N 3.06Å; T93-T97 PolarHBondContact O-N 3.36Å; T93-T97 PolarHBondContact O-OG1 3.26Å
94	N	97.9	Very high	97.8	Very high	30 Å²	30	59.5 Å²	59.5	16%	0.16	29%	0.285	C	S	.	.	H	α-helix	trans	-59.3	-36	176.8	-74.5	-19.3	0	0	0	112.5	F46 I90 S91 Q96 T97 Y98	F46-N94 HydrophobicContact CE1-CB 4Å; F46-N94 HydrophobicContact CE2-CB 4.31Å; F46-N94 HydrophobicContact CZ-CB 3.67Å; I90-N94 WeakPolarHBondContact O-CB 3.23Å; I90-N94 PolarHBondContact O-N 2.97Å; S91-N94 PolarHBondContact O-N 3.35Å; N94-Q96 VanDerWaalsContact C-N 3.26Å; N94-Q96 PolarHBondContact O-N 2.96Å; N94-T97 PolarHBondContact O-N 2.91Å; N94-Y98 HydrophobicContact CB-CD2 4.35Å; N94-Y98 HydrophobicContact CB-CE2 4.42Å; N94-Y98 WeakPolarHBondContact O-CB 3.2Å; N94-Y98 WeakPolarHBondContact O-CD2 3.47Å; N94-Y98 PolarHBondContact O-N 2.94Å
95	T	97.9	Very high	97.8	Very high	14 Å²	14	58 Å²	58	9%	0.086	28%	0.28	C	S	.	.	H	α-helix	trans	-57.1	-40.3	174.9	-58.5	0	0	0	0	111.7	F46 S91 K92 T93 R99	F46-T95 HydrophobicContact CB-CG2 3.99Å; F46-T95 VanDerWaalsContact CD1-OG1 3.27Å; F46-T95 WeakPolarHBondContact CD1-OG1 3.3Å; S91-T95 PolarHBondContact O-N 3.4Å; S91-T95 PolarHBondContact O-OG1 3.5Å; K92-T95 WeakPolarHBondContact O-CB 3.34Å; K92-T95 PolarHBondContact O-N 3.46Å; T93-T95 VanDerWaalsContact C-N 3.26Å; T93-T95 PolarHBondContact O-N 3.05Å; T95-R99 WeakPolarHBondContact O-CB 3.47Å; T95-R99 PolarHBondContact O-N 2.87Å
96	Q	97.5	Very high	97.7	Very high	88 Å²	88	56.2 Å²	56.2	41%	0.411	27%	0.266	S	S	.	.	H	α-helix	trans	-73.8	-45.6	176.7	-58.1	-52.6	-44.8	0	0	111.8	K92 T93 N94 Y98 R99 E100	K92-Q96 PolarHBondContact O-N 3.42Å; T93-Q96 PolarHBondContact O-N 3.06Å; N94-Q96 VanDerWaalsContact C-N 3.26Å; N94-Q96 PolarHBondContact O-N 2.96Å; Q96-Y98 VanDerWaalsContact C-N 3.32Å; Q96-Y98 PolarHBondContact O-N 2.99Å; Q96-R99 WeakPolarHBondContact O-CB 3.33Å; Q96-R99 PolarHBondContact O-N 3.15Å; Q96-E100 PolarHBondContact O-N 3.3Å; Q96-E100 VanDerWaalsContact O-N 3.07Å
97	T	97.6	Very high	97.6	Very high	63 Å²	63	52.9 Å²	52.9	39%	0.387	27%	0.267	S	S	.	.	H	α-helix	trans	-58.2	-43.6	178.1	-57	0	0	0	0	111.9	T93 N94 R99 E100 S101	T93-T97 PolarHBondContact O-N 3.36Å; T93-T97 PolarHBondContact O-OG1 3.26Å; N94-T97 PolarHBondContact O-N 2.91Å; T97-R99 VanDerWaalsContact C-N 3.34Å; T97-R99 PolarHBondContact O-N 3.4Å; T97-E100 PolarHBondContact O-N 2.96Å; T97-S101 PolarHBondContact O-N 3.17Å; T97-S101 PolarHBondContact O-OG 2.95Å; T97-S101 VanDerWaalsContact O-OG 3.08Å
98	Y	97.8	Very high	97.6	Very high	8 Å²	8	54.6 Å²	54.6	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-70.2	-31.7	-179.6	-83.2	-117.9	0	0	0	112.3	H33 A35 F46 N94 Q96 S101 L102 W119 R121	H33-Y98 HydrophobicContact CB-CE1 3.84Å; H33-Y98 WeakPolarHBondContact CB-OH 3.31Å; H33-Y98 AromaticContact CD2-CZ 3.86Å; H33-Y98 PolarHBondContact CD2-OH 2.81Å; A35-Y98 HydrophobicContact CB-CD1 3.66Å; A35-Y98 HydrophobicContact CB-CG 4.12Å; F46-Y98 HydrophobicContact CD2-CD1 4.08Å; F46-Y98 HydrophobicContact CD2-CD2 4.42Å; F46-Y98 AromaticContact CD2-CG 3.94Å; F46-Y98 HydrophobicContact CD2-CG 3.94Å; F46-Y98 AromaticContact CE2-CD1 3.83Å; F46-Y98 HydrophobicContact CE2-CD1 3.83Å; F46-Y98 AromaticContact CE2-CD2 3.86Å; F46-Y98 HydrophobicContact CE2-CD2 3.86Å; F46-Y98 HydrophobicContact CE2-CE1 4.07Å; F46-Y98 HydrophobicContact CE2-CE2 4.07Å; F46-Y98 AromaticContact CE2-CG 3.75Å; F46-Y98 HydrophobicContact CE2-CG 3.75Å; N94-Y98 HydrophobicContact CB-CD2 4.35Å; N94-Y98 HydrophobicContact CB-CE2 4.42Å; N94-Y98 WeakPolarHBondContact O-CB 3.2Å; N94-Y98 WeakPolarHBondContact O-CD2 3.47Å; N94-Y98 PolarHBondContact O-N 2.94Å; Q96-Y98 VanDerWaalsContact C-N 3.32Å; Q96-Y98 PolarHBondContact O-N 2.99Å; Y98-S101 PolarHBondContact O-N 2.8Å; Y98-L102 WeakPolarHBondContact O-CG 3.18Å; Y98-L102 PolarHBondContact O-N 3.26Å; Y98-W119 AromaticContact CD1-CD1 3.28Å; Y98-W119 HydrophobicContact CD1-CG 4.26Å; Y98-W119 AromaticContact CD1-NE1 3.98Å; Y98-W119 AromaticContact CE1-CD1 3.49Å; Y98-W119 VanDerWaalsContact CE1-CD1 3.49Å; Y98-W119 HydrophobicContact CE1-CG 4.44Å; Y98-W119 AromaticContact CE1-NE1 3.81Å; Y98-R121 HydrophobicContact CE1-CB 4.48Å; Y98-R121 WeakPolarHBondContact OH-CB 3.32Å; Y98-R121 WeakPolarHBondContact OH-CD 3.29Å
99	R	97.3	Very high	97.5	Very high	47 Å²	47	57.4 Å²	57.4	18%	0.177	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-45	171.6	175.9	-168.8	-59.1	-175	-10.4	111.2	E43 P44 T95 Q96 T97 L102 R103	E43-R99 VanDerWaalsContact CD-CZ 3.44Å; E43-R99 VanDerWaalsContact CG-NH2 3.33Å; E43-R99 WeakPolarHBondContact OE2-CD 3.26Å; E43-R99 IonicContact OE2-CZ 2.71Å; E43-R99 IonicContact OE2-NE 3.73Å; E43-R99 PolarHBondContact OE2-NE 3.44Å; E43-R99 IonicContact OE2-NH1 3.97Å; E43-R99 IonicContact OE2-NH2 3.11Å; P44-R99 HydrophobicContact CG-CB 4.41Å; P44-R99 HydrophobicContact CG-CG 4.15Å; T95-R99 WeakPolarHBondContact O-CB 3.47Å; T95-R99 PolarHBondContact O-N 2.87Å; Q96-R99 WeakPolarHBondContact O-CB 3.33Å; Q96-R99 PolarHBondContact O-N 3.15Å; T97-R99 VanDerWaalsContact C-N 3.34Å; T97-R99 PolarHBondContact O-N 3.4Å; R99-L102 PolarHBondContact O-N 3.05Å; R99-R103 PolarHBondContact O-N 2.9Å
100	E	97.3	Very high	97.4	Very high	114 Å²	114	59.2 Å²	59.2	53%	0.533	30%	0.296	S	S	.	.	H	α-helix	trans	-65.8	-43.2	175.4	-69.3	177.7	-178.3	0	0	111.7	Q96 T97 L102 R103 N104	Q96-E100 PolarHBondContact O-N 3.3Å; Q96-E100 VanDerWaalsContact O-N 3.07Å; T97-E100 PolarHBondContact O-N 2.96Å; E100-L102 VanDerWaalsContact C-N 3.34Å; E100-L102 PolarHBondContact O-N 3.29Å; E100-R103 WeakPolarHBondContact O-CB 3.48Å; E100-R103 PolarHBondContact O-N 3.4Å; E100-R103 VanDerWaalsContact O-N 3.1Å; E100-N104 PolarHBondContact O-N 2.83Å; E100-N104 PolarHBondContact O-ND2 2.88Å
101	S	97.6	Very high	97.3	Very high	30 Å²	30	58.9 Å²	58.9	21%	0.21	29%	0.293	C	S	.	.	H	α-helix	trans	-56.8	-45	175.1	-64.3	0	0	0	0	112.2	T97 Y98 R103 N104 L105	T97-S101 PolarHBondContact O-N 3.17Å; T97-S101 PolarHBondContact O-OG 2.95Å; T97-S101 VanDerWaalsContact O-OG 3.08Å; Y98-S101 PolarHBondContact O-N 2.8Å; S101-R103 VanDerWaalsContact C-N 3.3Å; S101-R103 PolarHBondContact O-N 3.23Å; S101-N104 PolarHBondContact O-N 3.03Å; S101-L105 WeakPolarHBondContact O-CB 3.23Å; S101-L105 WeakPolarHBondContact O-CD1 3.17Å; S101-L105 VanDerWaalsContact O-CG 3.23Å; S101-L105 WeakPolarHBondContact O-CG 3.4Å; S101-L105 PolarHBondContact O-N 3.17Å
102	L	98	Very high	97.2	Very high	8 Å²	8	62.5 Å²	62.5	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-60	-38.2	176.3	-78.3	167.4	0	0	0	112.6	A35 P44 Y98 R99 E100 R106 H117 W119 Y142	A35-L102 HydrophobicContact CB-CD1 3.81Å; P44-L102 HydrophobicContact CB-CD1 3.68Å; P44-L102 HydrophobicContact CG-CD1 3.95Å; Y98-L102 WeakPolarHBondContact O-CG 3.18Å; Y98-L102 PolarHBondContact O-N 3.26Å; R99-L102 PolarHBondContact O-N 3.05Å; E100-L102 VanDerWaalsContact C-N 3.34Å; E100-L102 PolarHBondContact O-N 3.29Å; L102-R106 WeakPolarHBondContact O-CB 3.38Å; L102-R106 PolarHBondContact O-N 2.97Å; L102-R106 VanDerWaalsContact O-N 3.17Å; L102-H117 HydrophobicContact CD2-CB 4.21Å; L102-W119 HydrophobicContact CD2-CB 3.67Å; L102-W119 HydrophobicContact CG-CB 4.06Å; L102-Y142 HydrophobicContact CD2-CE2 4.16Å
103	R	96	Very high	96.8	Very high	135 Å²	135	64.6 Å²	64.6	51%	0.509	33%	0.329	S	S	.	.	H	α-helix	trans	-67.2	-43.3	175.4	-67.6	175.7	-174.6	165.6	1.3	111.6	R99 E100 S101 G107	R99-R103 PolarHBondContact O-N 2.9Å; E100-R103 WeakPolarHBondContact O-CB 3.48Å; E100-R103 PolarHBondContact O-N 3.4Å; E100-R103 VanDerWaalsContact O-N 3.1Å; S101-R103 VanDerWaalsContact C-N 3.3Å; S101-R103 PolarHBondContact O-N 3.23Å; R103-G107 PolarHBondContact O-N 3.28Å
104	N	96.8	Very high	96.5	Very high	83 Å²	83	65.2 Å²	65.2	44%	0.444	34%	0.342	S	S	.	.	H	α-helix	trans	-64.7	-47.2	178.8	-71.2	-25.9	0	0	0	112	E100 S101 R106 G107 Y108	E100-N104 PolarHBondContact O-N 2.83Å; E100-N104 PolarHBondContact O-ND2 2.88Å; S101-N104 PolarHBondContact O-N 3.03Å; N104-R106 PolarHBondContact O-N 2.66Å; N104-G107 WeakPolarHBondContact O-CA 3.31Å; N104-G107 PolarHBondContact O-N 2.82Å; N104-G107 VanDerWaalsContact O-N 3.09Å; N104-Y108 WeakPolarHBondContact O-CD1 3.34Å; N104-Y108 PolarHBondContact O-N 3.11Å
105	L	97.7	Very high	96.2	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-60.9	-46.4	-179.9	-71.7	163.7	0	0	0	111.1	S101 G107 Y108 Y109 W119 Y142 Y147	S101-L105 WeakPolarHBondContact O-CB 3.23Å; S101-L105 WeakPolarHBondContact O-CD1 3.17Å; S101-L105 VanDerWaalsContact O-CG 3.23Å; S101-L105 WeakPolarHBondContact O-CG 3.4Å; S101-L105 PolarHBondContact O-N 3.17Å; L105-G107 PolarHBondContact O-N 3.08Å; L105-Y108 PolarHBondContact O-N 3.03Å; L105-Y109 HydrophobicContact CD2-CE2 4.42Å; L105-Y109 VanDerWaalsContact O-CD2 3.27Å; L105-Y109 WeakPolarHBondContact O-CD2 3.33Å; L105-Y109 PolarHBondContact O-N 2.75Å; L105-W119 HydrophobicContact CD1-CB 4.34Å; L105-W119 HydrophobicContact CD1-CD2 3.47Å; L105-W119 VanDerWaalsContact CD1-CD2 3.47Å; L105-W119 HydrophobicContact CD1-CE3 3.3Å; L105-W119 HydrophobicContact CD1-CG 3.95Å; L105-W119 HydrophobicContact CD1-CH2 4.18Å; L105-W119 HydrophobicContact CD1-CZ2 4.35Å; L105-W119 HydrophobicContact CD1-CZ3 3.69Å; L105-W119 HydrophobicContact CD2-CH2 4.5Å; L105-W119 HydrophobicContact CD2-CZ3 4.22Å; L105-Y142 HydrophobicContact CB-CD1 4.49Å; L105-Y142 HydrophobicContact CB-CD2 4.17Å; L105-Y142 HydrophobicContact CB-CE1 4.12Å; L105-Y142 HydrophobicContact CB-CE2 3.8Å; L105-Y142 HydrophobicContact CD1-CD2 3.68Å; L105-Y142 HydrophobicContact CD1-CE2 3.97Å; L105-Y142 HydrophobicContact CD1-CG 4.24Å; L105-Y142 HydrophobicContact CG-CD2 4.41Å; L105-Y142 HydrophobicContact CG-CE2 4.48Å; L105-Y147 HydrophobicContact CD2-CD2 4.1Å; L105-Y147 HydrophobicContact CD2-CE1 4.06Å; L105-Y147 HydrophobicContact CD2-CE2 3.46Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.46Å; L105-Y147 VanDerWaalsContact CD2-CZ 3.41Å
106	R	96.4	Very high	96.2	Very high	61 Å²	61	68.1 Å²	68.1	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-53.9	-41.1	173.9	-172.3	-175.9	65.5	176.3	9.7	111.8	L102 N104 N110 Q111 E113	L102-R106 WeakPolarHBondContact O-CB 3.38Å; L102-R106 PolarHBondContact O-N 2.97Å; L102-R106 VanDerWaalsContact O-N 3.17Å; N104-R106 PolarHBondContact O-N 2.66Å; R106-N110 PolarHBondContact O-N 3.12Å; R106-N110 VanDerWaalsContact O-N 3.14Å; R106-Q111 HydrophobicContact CG-CB 3.77Å; R106-Q111 WeakPolarHBondContact CG-O 3.48Å; R106-Q111 PolarHBondContact O-N 3.16Å; R106-E113 IonicContact CZ-OE1 2.78Å; R106-E113 IonicContact NH1-OE1 2.77Å; R106-E113 PolarHBondContact NH1-OE1 2.86Å; R106-E113 IonicContact NH2-OE1 3.86Å; R106-E113 PolarHBondContact NH2-OE1 2.83Å
107	G	96.3	Very high	96.2	Very high	43 Å²	43	64.7 Å²	64.7	44%	0.443	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-44	174.6	0	0	0	0	0	113.3	R103 N104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 3.28Å; N104-G107 WeakPolarHBondContact O-CA 3.31Å; N104-G107 PolarHBondContact O-N 2.82Å; N104-G107 VanDerWaalsContact O-N 3.09Å; L105-G107 PolarHBondContact O-N 3.08Å; G107-Y109 VanDerWaalsContact C-N 3.27Å; G107-Y109 PolarHBondContact O-N 3.42Å; G107-N110 PolarHBondContact O-N 3.07Å; G107-N110 VanDerWaalsContact O-N 3.16Å; G107-N110 PolarHBondContact O-OD1 3.49Å
108	Y	97.6	Very high	96.2	Very high	60 Å²	60	63.5 Å²	63.5	24%	0.235	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-33.5	179.5	-63.3	-10	0	0	0	112.7	N104 L105 I166 K170	N104-Y108 WeakPolarHBondContact O-CD1 3.34Å; N104-Y108 PolarHBondContact O-N 3.11Å; L105-Y108 PolarHBondContact O-N 3.03Å; Y108-I166 HydrophobicContact CD1-CD1 4.26Å; Y108-I166 HydrophobicContact CD2-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.32Å; Y108-I166 HydrophobicContact CE2-CB 4.31Å; Y108-I166 HydrophobicContact CE2-CG2 4.04Å; Y108-I166 HydrophobicContact CG-CD1 4.18Å; Y108-K170 PolarHBondContact OH-NZ 2.97Å
109	Y	97.6	Very high	96.3	Very high	68 Å²	68	63.5 Å²	63.5	27%	0.267	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	4.5	177.6	-69.2	-74.3	0	0	0	114.2	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.42Å; L105-Y109 VanDerWaalsContact O-CD2 3.27Å; L105-Y109 WeakPolarHBondContact O-CD2 3.33Å; L105-Y109 PolarHBondContact O-N 2.75Å; G107-Y109 VanDerWaalsContact C-N 3.27Å; G107-Y109 PolarHBondContact O-N 3.42Å; Y109-Q111 PolarHBondContact O-N 2.87Å; Y109-Y142 AromaticContact CD2-CD1 3.67Å; Y109-Y142 HydrophobicContact CD2-CD1 3.67Å; Y109-Y142 AromaticContact CD2-CE1 3.46Å; Y109-Y142 HydrophobicContact CD2-CE1 3.46Å; Y109-Y142 VanDerWaalsContact CD2-CE1 3.46Å; Y109-Y142 AromaticContact CE2-CD1 3.44Å; Y109-Y142 HydrophobicContact CE2-CD1 3.44Å; Y109-Y142 VanDerWaalsContact CE2-CD1 3.44Å; Y109-Y142 AromaticContact CE2-CE1 3.78Å; Y109-Y142 HydrophobicContact CE2-CE1 3.78Å; Y109-Y142 HydrophobicContact CE2-CG 4.43Å; Y109-Y142 HydrophobicContact CG-CE1 4.34Å; Y109-Y147 HydrophobicContact CE2-CD2 4.26Å; Y109-Y147 AromaticContact CE2-CE2 3.93Å; Y109-Y147 HydrophobicContact CE2-CE2 3.93Å; Y109-Y147 VanDerWaalsContact OH-CD2 3.26Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.19Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.2Å; Y109-D161 VanDerWaalsContact CE1-OD2 3.23Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.4Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 2.92Å; Y109-D161 PolarHBondContact OH-OD2 3.41Å; Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.4Å; Y109-A163 HydrophobicContact CE1-CB 3.63Å; Y109-A163 HydrophobicContact CE2-CB 3.89Å; Y109-A163 VanDerWaalsContact CZ-CB 3.48Å
110	N	96.3	Very high	96.3	Very high	152 Å²	152	64.7 Å²	64.7	81%	0.813	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	39.7	-177.4	-58.6	-54.8	0	0	0	113.5	R106 G107	R106-N110 PolarHBondContact O-N 3.12Å; R106-N110 VanDerWaalsContact O-N 3.14Å; G107-N110 PolarHBondContact O-N 3.07Å; G107-N110 VanDerWaalsContact O-N 3.16Å; G107-N110 PolarHBondContact O-OD1 3.49Å
111	Q	96.3	Very high	96.4	Very high	62 Å²	62	61 Å²	61	29%	0.29	33%	0.334	S	S	.	.			trans	-88.4	154.4	-176.1	-71.7	166.2	-30.6	0	0	112.1	R106 Y109 H117 Y142	R106-Q111 HydrophobicContact CG-CB 3.77Å; R106-Q111 WeakPolarHBondContact CG-O 3.48Å; R106-Q111 PolarHBondContact O-N 3.16Å; Y109-Q111 PolarHBondContact O-N 2.87Å; Q111-H117 PolarHBondContact NE2-CE1 3Å; Q111-H117 PolarHBondContact OE1-CE1 3.32Å; Q111-Y142 PolarHBondContact OE1-OH 2.89Å
112	S	94.3	Very high	96.5	Very high	78 Å²	78	60.5 Å²	60.5	55%	0.545	33%	0.328	S	S	.	.			trans	-74.7	156.7	-178.4	77	0	0	0	0	112.5	A114 G115	S112-A114 PolarHBondContact O-N 3.2Å; S112-G115 PolarHBondContact O-N 3.5Å
113	E	90.9	Very high	96.5	Very high	134 Å²	134	61.3 Å²	61.3	63%	0.626	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-17.5	178.6	-54.8	-152.1	124.8	0	0	114.2	P39 R106 G115	P39-E113 VanDerWaalsContact CB-O 3.31Å; P39-E113 WeakPolarHBondContact CB-O 3.39Å; P39-E113 WeakPolarHBondContact CG-O 3.47Å; R106-E113 IonicContact CZ-OE1 2.78Å; R106-E113 IonicContact NH1-OE1 2.77Å; R106-E113 PolarHBondContact NH1-OE1 2.86Å; R106-E113 IonicContact NH2-OE1 3.86Å; R106-E113 PolarHBondContact NH2-OE1 2.83Å; E113-G115 VanDerWaalsContact C-N 3.3Å
114	A	91.8	Very high	96.6	Very high	87 Å²	87	54.9 Å²	54.9	72%	0.719	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-16	179.8	0	0	0	0	0	112.8	S112	S112-A114 PolarHBondContact O-N 3.2Å
115	G	92.3	Very high	96.7	Very high	21 Å²	21	51 Å²	51	22%	0.216	29%	0.286	C	S	.	.			trans	-72.9	133.4	-179.7	0	0	0	0	0	113.3	P39 S112 E113 H117	P39-G115 WeakPolarHBondContact CG-O 3.47Å; S112-G115 PolarHBondContact O-N 3.5Å; E113-G115 VanDerWaalsContact C-N 3.3Å; G115-H117 PolarHBondContact O-CD2 2.92Å
116	S	96.4	Very high	96.7	Very high	83 Å²	83	52 Å²	52	58%	0.58	29%	0.292	S	S	*	.			trans	-83.3	130	165.6	-173.5	0	0	0	0	108.7	S37	S37-S116 PolarHBondContact O-OG 3.01Å
117	H	98.1	Very high	96.8	Very high	17 Å²	17	49.2 Å²	49.2	8%	0.079	28%	0.281	C	S	.	.			trans	-131.6	152.5	-174.6	-63.7	-73.4	0	0	0	110.9	M36 S37 L102 Q111 G115 Y142 D143	M36-H117 WeakPolarHBondContact CA-O 3.48Å; S37-H117 PolarHBondContact N-O 3.45Å; S37-H117 PolarHBondContact OG-N 2.82Å; S37-H117 PolarHBondContact OG-O 3.45Å; L102-H117 HydrophobicContact CD2-CB 4.21Å; Q111-H117 PolarHBondContact NE2-CE1 3Å; Q111-H117 PolarHBondContact OE1-CE1 3.32Å; G115-H117 PolarHBondContact O-CD2 2.92Å; H117-Y142 HydrophobicContact CB-CE2 3.84Å; H117-Y142 WeakPolarHBondContact CB-OH 3.49Å; H117-Y142 VanDerWaalsContact CG-OH 3.23Å; H117-Y142 AromaticContact ND1-CZ 3.91Å; H117-Y142 PolarHBondContact ND1-OH 2.9Å; H117-D143 WeakPolarHBondContact CA-OD1 3.34Å; H117-D143 WeakPolarHBondContact CB-OD1 3.41Å; H117-D143 IonicContact CE1-OD2 2.93Å; H117-D143 IonicContact CG-OD1 3.6Å; H117-D143 IonicContact CG-OD2 3.58Å; H117-D143 IonicContact ND1-OD1 3.37Å; H117-D143 IonicContact ND1-OD2 2.94Å; H117-D143 PolarHBondContact ND1-OD2 3.01Å
118	T	98.5	Very high	96.7	Very high	37 Å²	37	47.4 Å²	47.4	23%	0.227	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.7	-177.2	-49.8	0	0	0	0	110.7	T34 A35 M36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 3.93Å; A35-T118 CarbonylContact O-C 3.48Å; A35-T118 WeakPolarHBondContact O-CA 3.39Å; M36-T118 HydrophobicContact CG-CG2 4.04Å; T118-Q120 HydrophobicContact CG2-CG 3.81Å; T118-Y142 WeakPolarHBondContact O-CA 3.27Å; T118-Y142 WeakPolarHBondContact O-CD2 3.4Å; T118-D143 PolarHBondContact N-OD1 3.2Å; T118-D143 PolarHBondContact O-N 3.33Å
119	W	98.6	Very high	96.4	Very high	9 Å²	9	49.6 Å²	49.6	3%	0.034	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.6	173.7	-179.7	-124.9	0	0	0	109.7	A35 Y98 L102 L105 Y140 Y142 Y147	A35-W119 PolarHBondContact N-O 3.32Å; A35-W119 PolarHBondContact O-N 2.87Å; Y98-W119 AromaticContact CD1-CD1 3.28Å; Y98-W119 HydrophobicContact CD1-CG 4.26Å; Y98-W119 AromaticContact CD1-NE1 3.98Å; Y98-W119 AromaticContact CE1-CD1 3.49Å; Y98-W119 VanDerWaalsContact CE1-CD1 3.49Å; Y98-W119 HydrophobicContact CE1-CG 4.44Å; Y98-W119 AromaticContact CE1-NE1 3.81Å; L102-W119 HydrophobicContact CD2-CB 3.67Å; L102-W119 HydrophobicContact CG-CB 4.06Å; L105-W119 HydrophobicContact CD1-CB 4.34Å; L105-W119 HydrophobicContact CD1-CD2 3.47Å; L105-W119 VanDerWaalsContact CD1-CD2 3.47Å; L105-W119 HydrophobicContact CD1-CE3 3.3Å; L105-W119 HydrophobicContact CD1-CG 3.95Å; L105-W119 HydrophobicContact CD1-CH2 4.18Å; L105-W119 HydrophobicContact CD1-CZ2 4.35Å; L105-W119 HydrophobicContact CD1-CZ3 3.69Å; L105-W119 HydrophobicContact CD2-CH2 4.5Å; L105-W119 HydrophobicContact CD2-CZ3 4.22Å; W119-Y140 AromaticContact CE2-CD1 3.62Å; W119-Y140 AromaticContact CH2-CD1 3.86Å; W119-Y140 HydrophobicContact CH2-CD1 3.86Å; W119-Y140 AromaticContact CH2-CG 3.89Å; W119-Y140 HydrophobicContact CH2-CG 3.89Å; W119-Y140 AromaticContact CZ2-CD1 3.16Å; W119-Y140 HydrophobicContact CZ2-CD1 3.16Å; W119-Y140 AromaticContact CZ2-CE1 3.95Å; W119-Y140 HydrophobicContact CZ2-CE1 3.95Å; W119-Y140 AromaticContact CZ2-CG 3.68Å; W119-Y140 HydrophobicContact CZ2-CG 3.68Å; W119-Y140 AromaticContact NE1-CD1 3.94Å; W119-Y142 HydrophobicContact CE3-CD2 4.05Å; W119-Y142 HydrophobicContact CE3-CG 4.37Å; W119-Y147 AromaticContact CH2-CD1 3.35Å; W119-Y147 HydrophobicContact CH2-CD1 3.35Å; W119-Y147 AromaticContact CH2-CE1 3.82Å; W119-Y147 HydrophobicContact CH2-CE1 3.82Å; W119-Y147 AromaticContact CH2-CG 3.85Å; W119-Y147 HydrophobicContact CH2-CG 3.85Å; W119-Y147 AromaticContact CZ3-CD1 3.7Å; W119-Y147 HydrophobicContact CZ3-CD1 3.7Å; W119-Y147 HydrophobicContact CZ3-CD2 4.36Å; W119-Y147 HydrophobicContact CZ3-CE1 4.33Å; W119-Y147 AromaticContact CZ3-CG 3.68Å; W119-Y147 HydrophobicContact CZ3-CG 3.68Å
120	Q	98.8	Very high	96.1	Very high	71 Å²	71	50.8 Å²	50.8	33%	0.332	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.7	-173.4	-59.3	175.9	-94.8	0	0	110.6	H33 T34 T118 Y140 A141	H33-Q120 CarbonylContact O-C 3.56Å; H33-Q120 WeakPolarHBondContact O-CA 3.35Å; T34-Q120 HydrophobicContact CG2-CG 4.23Å; T118-Q120 HydrophobicContact CG2-CG 3.81Å; Q120-Y140 CarbonylContact O-C 3.49Å; Q120-Y140 WeakPolarHBondContact O-CA 3.38Å; Q120-A141 HydrophobicContact CB-CB 4.35Å; Q120-A141 PolarHBondContact N-O 3.5Å; Q120-A141 PolarHBondContact O-N 3.35Å
121	R	98.6	Very high	95.9	Very high	36 Å²	36	44.1 Å²	44.1	14%	0.136	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.2	170.8	-174.5	-168.1	-176.8	-175.1	7.9	109.7	F32 H33 Y98 Y123 N138 Q139 Y140 D180	F32-R121 CarbonylContact C-O 3.58Å; F32-R121 WeakPolarHBondContact CA-O 3.31Å; H33-R121 HydrophobicContact CB-CB 4.18Å; H33-R121 PolarHBondContact N-O 3.13Å; H33-R121 PolarHBondContact O-N 3.25Å; Y98-R121 HydrophobicContact CE1-CB 4.48Å; Y98-R121 WeakPolarHBondContact OH-CB 3.32Å; Y98-R121 WeakPolarHBondContact OH-CD 3.29Å; R121-Y123 HydrophobicContact CG-CD1 4.04Å; R121-N138 PolarHBondContact NE-OD1 2.91Å; R121-N138 PolarHBondContact NH2-ND2 3.31Å; R121-N138 PolarHBondContact NH2-OD1 3.44Å; R121-Q139 CarbonylContact C-O 3.49Å; R121-Q139 VanDerWaalsContact CA-O 3.29Å; R121-Q139 WeakPolarHBondContact CA-O 3.14Å; R121-Y140 HydrophobicContact CB-CD1 3.66Å; R121-Y140 HydrophobicContact CB-CE1 3.72Å; R121-Y140 HydrophobicContact CB-CG 4.37Å; R121-Y140 VanDerWaalsContact CD-CE1 3.44Å; R121-Y140 VanDerWaalsContact CD-CZ 3.45Å; R121-Y140 WeakPolarHBondContact CD-OH 3.44Å; R121-Y140 HydrophobicContact CG-CD1 3.73Å; R121-Y140 HydrophobicContact CG-CD2 4.36Å; R121-Y140 HydrophobicContact CG-CE1 3.45Å; R121-Y140 VanDerWaalsContact CG-CE1 3.45Å; R121-Y140 HydrophobicContact CG-CE2 4.07Å; R121-Y140 HydrophobicContact CG-CG 4.21Å; R121-Y140 VanDerWaalsContact CZ-OH 3.22Å; R121-Y140 PolarHBondContact NE-OH 3.29Å; R121-D180 IonicContact NH2-OD1 2.66Å
122	M	98.7	Very high	95.8	Very high	20 Å²	20	49.4 Å²	49.4	10%	0.099	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.9	162.9	-174	-77	-70.4	0	0	108.2	Y31 F32 H137 N138 Q139	Y31-M122 WeakPolarHBondContact O-CA 3.34Å; F32-M122 HydrophobicContact CD1-CB 4.03Å; F32-M122 HydrophobicContact CD1-CG 3.7Å; F32-M122 HydrophobicContact CE1-CB 4.1Å; F32-M122 HydrophobicContact CE1-CG 3.35Å; F32-M122 HydrophobicContact CZ-CG 3.95Å; M122-H137 HydrophobicContact CE-CB 3.86Å; M122-H137 HydrophobicContact SD-CB 4.08Å; M122-N138 WeakPolarHBondContact O-CA 3.4Å; M122-Q139 HydrophobicContact CB-CG 4.07Å; M122-Q139 VanDerWaalsContact CE-CD 3.48Å; M122-Q139 HydrophobicContact CE-CG 3.96Å; M122-Q139 PolarHBondContact N-O 3.31Å; M122-Q139 PolarHBondContact O-N 3.48Å
123	Y	98.7	Very high	96	Very high	26 Å²	26	48.1 Å²	48.1	10%	0.102	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	157.9	171.8	69.5	-81.3	0	0	0	110.9	Y31 H33 R121 H137 Y183	Y31-Y123 HydrophobicContact CD2-CD2 4.31Å; Y31-Y123 AromaticContact CD2-CE2 3.64Å; Y31-Y123 HydrophobicContact CD2-CE2 3.64Å; Y31-Y123 AromaticContact CD2-CZ 3.82Å; Y31-Y123 HydrophobicContact CE2-CE2 4.44Å; Y31-Y123 HydrophobicContact CG-CE1 4.32Å; Y31-Y123 HydrophobicContact CG-CE2 4.12Å; Y31-Y123 AromaticContact CG-CZ 3.81Å; Y31-Y123 PolarHBondContact N-O 2.64Å; Y31-Y123 PolarHBondContact O-N 3.28Å; Y31-Y123 VanDerWaalsContact O-N 3.11Å; H33-Y123 AromaticContact CE1-CE1 3.46Å; H33-Y123 VanDerWaalsContact CE1-CE1 3.46Å; H33-Y123 WeakPolarHBondContact CE1-CE1 3.34Å; H33-Y123 AromaticContact CE1-CZ 3.96Å; H33-Y123 AromaticContact NE2-CE1 3.46Å; H33-Y123 WeakPolarHBondContact NE2-CE1 3.48Å; H33-Y123 AromaticContact NE2-CZ 3.97Å; R121-Y123 HydrophobicContact CG-CD1 4.04Å; Y123-H137 CarbonylContact C-O 3.54Å; Y123-H137 WeakPolarHBondContact CA-O 3.22Å; Y123-H137 VanDerWaalsContact CB-O 3.24Å; Y123-H137 WeakPolarHBondContact CB-O 3.49Å; Y123-Y183 AromaticContact CD2-CE1 3.9Å; Y123-Y183 HydrophobicContact CD2-CE1 3.9Å; Y123-Y183 AromaticContact CE2-CE1 3.84Å; Y123-Y183 HydrophobicContact CE2-CE1 3.84Å
124	G	98.6	Very high	96.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.7	-178.5	-177.5	0	0	0	0	0	113.6	M29 H137 L184	M29-G124 CarbonylContact O-C 3.43Å; M29-G124 WeakPolarHBondContact O-CA 3.28Å; G124-H137 PolarHBondContact N-O 3.49Å; G124-H137 PolarHBondContact O-N 2.86Å; G124-L184 WeakPolarHBondContact O-CD2 3.29Å
125	C	98.6	Very high	96.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	146	-175.8	50.8	0	0	0	0	110.6	S28 M29 L133 R135 C188 V189	S28-C125 WeakPolarHBondContact CA-O 3.37Å; M29-C125 PolarHBondContact N-O 2.96Å; M29-C125 PolarHBondContact O-N 3.15Å; M29-C125 VanDerWaalsContact O-N 3.07Å; C125-L133 HydrophobicContact CB-CD1 3.58Å; C125-R135 CarbonylContact C-O 3.56Å; C125-R135 WeakPolarHBondContact CA-O 3.47Å; C125-C188 HydrophobicContact CB-CB 3.91Å; C125-C188 WeakPolarHBondContact CB-SG 3.4Å; C125-C188 PolarHBondContact N-SG 2.99Å; C125-C188 WeakPolarHBondContact SG-CB 3.42Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.89Å; C125-V189 HydrophobicContact CB-CG2 4.38Å
126	D	98.3	Very high	96.8	Very high	28 Å²	28	47.4 Å²	47.4	15%	0.15	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.3	172.1	-53	-23.6	0	0	0	108.1	H27 S28 R30 L134 R135 H137	H27-D126 CarbonylContact O-C 3.6Å; H27-D126 WeakPolarHBondContact O-CA 3.31Å; S28-D126 WeakPolarHBondContact CB-OD1 3.47Å; R30-D126 IonicContact CZ-OD1 3.56Å; R30-D126 IonicContact NE-OD1 3.52Å; R30-D126 PolarHBondContact NE-OD1 3.43Å; R30-D126 VanDerWaalsContact NE-OD1 3.11Å; R30-D126 VanDerWaalsContact NH2-CG 3.27Å; R30-D126 IonicContact NH2-OD1 3.93Å; R30-D126 PolarHBondContact NH2-OD1 2.96Å; R30-D126 IonicContact NH2-OD2 3.02Å; R30-D126 PolarHBondContact NH2-OD2 3.48Å; D126-L134 PolarHBondContact O-N 2.89Å; D126-R135 HydrophobicContact CB-CB 4.32Å; D126-R135 PolarHBondContact N-O 2.94Å; D126-R135 PolarHBondContact O-N 3.35Å; D126-H137 IonicContact OD1-CD2 3.4Å; D126-H137 IonicContact OD1-NE2 2.73Å; D126-H137 IonicContact OD2-CD2 3.92Å; D126-H137 IonicContact OD2-CE1 3.55Å; D126-H137 IonicContact OD2-NE2 3.67Å; D126-H137 PolarHBondContact OD2-NE2 3.32Å
127	V	97.4	Very high	96.9	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.3	179.5	-60.4	0	0	0	0	111	S26 H27 R132 V189 L192	S26-V127 VanDerWaalsContact CA-O 3.31Å; S26-V127 WeakPolarHBondContact CA-O 3.44Å; H27-V127 HydrophobicContact CB-CG2 4.01Å; H27-V127 PolarHBondContact N-O 3.44Å; H27-V127 PolarHBondContact O-N 2.97Å; V127-R132 WeakPolarHBondContact CA-O 3.1Å; V127-R132 WeakPolarHBondContact CB-O 3.4Å; V127-V189 HydrophobicContact CG1-CB 4.41Å; V127-V189 HydrophobicContact CG1-CG1 4Å; V127-V189 HydrophobicContact CG1-CG2 3.97Å; V127-L192 HydrophobicContact CB-CD2 4.33Å; V127-L192 HydrophobicContact CG1-CD2 3.92Å; V127-L192 HydrophobicContact CG2-CD2 3.57Å; V127-L192 HydrophobicContact CG2-CG 4.2Å
128	G	94.8	Very high	96.9	Very high	4 Å²	4	43.8 Å²	43.8	4%	0.041	22%	0.216	C	C	.	.			trans	-81	-178.7	173.6	0	0	0	0	0	112.3	G25 D130 G131 R132	G25-G128 CarbonylContact O-C 3.49Å; G128-D130 PolarHBondContact O-N 2.96Å; G128-G131 WeakPolarHBondContact O-CA 3.36Å; G128-G131 PolarHBondContact O-N 3.46Å; G128-R132 PolarHBondContact N-O 3.34Å
129	P	91.6	Very high	96.9	Very high	106 Å²	106	46 Å²	46	69%	0.688	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-24.7	177.2	-23.4	32.7	0	0	0	114.2	G25 G131	G25-P129 WeakPolarHBondContact O-CA 3.49Å; G25-P129 WeakPolarHBondContact O-CG 3.46Å; P129-G131 PolarHBondContact O-N 2.94Å
130	D	91.1	Very high	96.9	Very high	94 Å²	94	46.7 Å²	46.7	50%	0.503	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	3.1	173.8	70.7	-11	0	0	0	113.1	G128 R132	G128-D130 PolarHBondContact O-N 2.96Å; D130-R132 PolarHBondContact O-N 3.29Å; D130-R132 WeakPolarHBondContact OD1-CB 3.42Å; D130-R132 PolarHBondContact OD1-N 3.38Å; D130-R132 WeakPolarHBondContact OD2-CD 3.48Å; D130-R132 WeakPolarHBondContact OD2-CG 3.4Å; D130-R132 IonicContact OD2-CZ 2.66Å; D130-R132 IonicContact OD2-NE 3.65Å; D130-R132 IonicContact OD2-NH1 3.71Å
131	G	90.9	Very high	96.9	Very high	12 Å²	12	44.1 Å²	44.1	12%	0.124	22%	0.217	C	C	.	.			trans	71.3	5	-177.5	0	0	0	0	0	114.2	G128 P129 V189 R193	G128-G131 WeakPolarHBondContact O-CA 3.36Å; G128-G131 PolarHBondContact O-N 3.46Å; P129-G131 PolarHBondContact O-N 2.94Å; G131-V189 WeakPolarHBondContact O-CG1 3.38Å; G131-R193 VanDerWaalsContact C-NH2 3.28Å; G131-R193 PolarHBondContact O-NE 3.16Å; G131-R193 PolarHBondContact O-NH2 2.8Å
132	R	95	Very high	96.9	Very high	173 Å²	173	42.9 Å²	42.9	65%	0.653	21%	0.213	S	C	*	.			trans	-79.8	149.8	-179.7	-64.7	-174	-178.1	157.6	-4.4	111.3	V127 G128 D130 L134	V127-R132 WeakPolarHBondContact CA-O 3.1Å; V127-R132 WeakPolarHBondContact CB-O 3.4Å; G128-R132 PolarHBondContact N-O 3.34Å; D130-R132 PolarHBondContact O-N 3.29Å; D130-R132 WeakPolarHBondContact OD1-CB 3.42Å; D130-R132 PolarHBondContact OD1-N 3.38Å; D130-R132 WeakPolarHBondContact OD2-CD 3.48Å; D130-R132 WeakPolarHBondContact OD2-CG 3.4Å; D130-R132 IonicContact OD2-CZ 2.66Å; D130-R132 IonicContact OD2-NE 3.65Å; D130-R132 IonicContact OD2-NH1 3.71Å; R132-L134 PolarHBondContact O-N 3.45Å
133	L	97.3	Very high	96.9	Very high	51 Å²	51	44.9 Å²	44.9	27%	0.267	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	122.4	175.5	-175	72.6	0	0	0	110	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.58Å; L133-R135 WeakPolarHBondContact CD1-O 3.38Å; L133-L154 HydrophobicContact CD2-CD1 4.17Å; L133-E185 HydrophobicContact CD2-CB 4.39Å; L133-E185 HydrophobicContact CD2-CG 3.68Å; L133-V189 HydrophobicContact CB-CG2 4.02Å; L133-V189 HydrophobicContact CD1-CG2 3.89Å
134	L	97.1	Very high	96.8	Very high	115 Å²	115	46.4 Å²	46.4	60%	0.602	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	-45.4	167.7	-64	178.5	0	0	0	110.5	D126 R132	D126-L134 PolarHBondContact O-N 2.89Å; R132-L134 PolarHBondContact O-N 3.45Å
135	R	97.1	Very high	96.8	Very high	106 Å²	106	54.1 Å²	54.1	40%	0.4	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	137.2	-175.1	-171.6	172.8	175.9	135.2	8.6	111.7	C125 D126 L133 H137 E152	C125-R135 CarbonylContact C-O 3.56Å; C125-R135 WeakPolarHBondContact CA-O 3.47Å; D126-R135 HydrophobicContact CB-CB 4.32Å; D126-R135 PolarHBondContact N-O 2.94Å; D126-R135 PolarHBondContact O-N 3.35Å; L133-R135 WeakPolarHBondContact CD1-O 3.38Å; R135-H137 WeakPolarHBondContact CD-CE1 3.37Å; R135-H137 PolarHBondContact NE-CE1 3.43Å; R135-E152 IonicContact CZ-OE1 3.48Å; R135-E152 IonicContact NH1-OE1 3.79Å; R135-E152 PolarHBondContact NH1-OE1 3.36Å; R135-E152 IonicContact NH2-OE1 3.4Å; R135-E152 PolarHBondContact NH2-OE1 2.88Å
136	G	98.1	Very high	96.8	Very high	6 Å²	6	60.4 Å²	60.4	6%	0.062	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	147.5	168.2	0	0	0	0	0	110.9
137	H	98.1	Very high	96.8	Very high	21 Å²	21	59.1 Å²	59.1	10%	0.097	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.4	-179.7	-55.7	-95.1	0	0	0	110	R30 M122 Y123 G124 D126 R135	R30-H137 PolarHBondContact NH2-NE2 2.94Å; R30-H137 VanDerWaalsContact NH2-NE2 3.12Å; M122-H137 HydrophobicContact CE-CB 3.86Å; M122-H137 HydrophobicContact SD-CB 4.08Å; Y123-H137 CarbonylContact C-O 3.54Å; Y123-H137 WeakPolarHBondContact CA-O 3.22Å; Y123-H137 VanDerWaalsContact CB-O 3.24Å; Y123-H137 WeakPolarHBondContact CB-O 3.49Å; G124-H137 PolarHBondContact N-O 3.49Å; G124-H137 PolarHBondContact O-N 2.86Å; D126-H137 IonicContact OD1-CD2 3.4Å; D126-H137 IonicContact OD1-NE2 2.73Å; D126-H137 IonicContact OD2-CD2 3.92Å; D126-H137 IonicContact OD2-CE1 3.55Å; D126-H137 IonicContact OD2-NE2 3.67Å; D126-H137 PolarHBondContact OD2-NE2 3.32Å; R135-H137 WeakPolarHBondContact CD-CE1 3.37Å; R135-H137 PolarHBondContact NE-CE1 3.43Å
138	N	98.5	Very high	96.9	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.016	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	102.7	163.5	-174.2	14.2	0	0	0	109.5	R121 M122 Y140 L150 D180	R121-N138 PolarHBondContact NE-OD1 2.91Å; R121-N138 PolarHBondContact NH2-ND2 3.31Å; R121-N138 PolarHBondContact NH2-OD1 3.44Å; M122-N138 WeakPolarHBondContact O-CA 3.4Å; N138-Y140 WeakPolarHBondContact OD1-CE2 3.22Å; N138-L150 HydrophobicContact CB-CB 3.98Å; N138-L150 HydrophobicContact CB-CD2 4.14Å; N138-L150 WeakPolarHBondContact O-CB 3.38Å; N138-L150 PolarHBondContact O-N 2.69Å; N138-D180 PolarHBondContact ND2-OD1 2.58Å; N138-D180 PolarHBondContact ND2-OD2 2.83Å
139	Q	98.6	Very high	97.1	Very high	83 Å²	83	60.5 Å²	60.5	39%	0.388	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	147.9	-175	67.3	-167.5	40.9	0	0	111.6	R121 M122 A149	R121-Q139 CarbonylContact C-O 3.49Å; R121-Q139 VanDerWaalsContact CA-O 3.29Å; R121-Q139 WeakPolarHBondContact CA-O 3.14Å; M122-Q139 HydrophobicContact CB-CG 4.07Å; M122-Q139 VanDerWaalsContact CE-CD 3.48Å; M122-Q139 HydrophobicContact CE-CG 3.96Å; M122-Q139 PolarHBondContact N-O 3.31Å; M122-Q139 PolarHBondContact O-N 3.48Å; Q139-A149 HydrophobicContact CB-CB 3.92Å
140	Y	98.8	Very high	97.4	Very high	24 Å²	24	56.1 Å²	56.1	9%	0.094	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146.2	-176.6	-61	-104.2	0	0	0	111.4	W119 Q120 R121 N138 Y147 I148 W171	W119-Y140 AromaticContact CE2-CD1 3.62Å; W119-Y140 AromaticContact CH2-CD1 3.86Å; W119-Y140 HydrophobicContact CH2-CD1 3.86Å; W119-Y140 AromaticContact CH2-CG 3.89Å; W119-Y140 HydrophobicContact CH2-CG 3.89Å; W119-Y140 AromaticContact CZ2-CD1 3.16Å; W119-Y140 HydrophobicContact CZ2-CD1 3.16Å; W119-Y140 AromaticContact CZ2-CE1 3.95Å; W119-Y140 HydrophobicContact CZ2-CE1 3.95Å; W119-Y140 AromaticContact CZ2-CG 3.68Å; W119-Y140 HydrophobicContact CZ2-CG 3.68Å; W119-Y140 AromaticContact NE1-CD1 3.94Å; Q120-Y140 CarbonylContact O-C 3.49Å; Q120-Y140 WeakPolarHBondContact O-CA 3.38Å; R121-Y140 HydrophobicContact CB-CD1 3.66Å; R121-Y140 HydrophobicContact CB-CE1 3.72Å; R121-Y140 HydrophobicContact CB-CG 4.37Å; R121-Y140 VanDerWaalsContact CD-CE1 3.44Å; R121-Y140 VanDerWaalsContact CD-CZ 3.45Å; R121-Y140 WeakPolarHBondContact CD-OH 3.44Å; R121-Y140 HydrophobicContact CG-CD1 3.73Å; R121-Y140 HydrophobicContact CG-CD2 4.36Å; R121-Y140 HydrophobicContact CG-CE1 3.45Å; R121-Y140 VanDerWaalsContact CG-CE1 3.45Å; R121-Y140 HydrophobicContact CG-CE2 4.07Å; R121-Y140 HydrophobicContact CG-CG 4.21Å; R121-Y140 VanDerWaalsContact CZ-OH 3.22Å; R121-Y140 PolarHBondContact NE-OH 3.29Å; N138-Y140 WeakPolarHBondContact OD1-CE2 3.22Å; Y140-Y147 PolarHBondContact O-N 2.96Å; Y140-I148 HydrophobicContact CD2-CG2 3.89Å; Y140-I148 HydrophobicContact CG-CG2 4.33Å; Y140-I148 PolarHBondContact N-O 2.9Å; Y140-I148 PolarHBondContact O-N 3.5Å; Y140-W171 AromaticContact CD2-CH2 3.84Å; Y140-W171 HydrophobicContact CD2-CH2 3.84Å; Y140-W171 HydrophobicContact CD2-CZ3 4.15Å; Y140-W171 HydrophobicContact CE1-CH2 4.26Å; Y140-W171 AromaticContact CE2-CH2 3.38Å; Y140-W171 HydrophobicContact CE2-CH2 3.38Å; Y140-W171 AromaticContact CE2-CZ3 3.75Å; Y140-W171 HydrophobicContact CE2-CZ3 3.75Å; Y140-W171 HydrophobicContact CG-CH2 4.48Å; Y140-W171 AromaticContact CZ-CH2 3.59Å
141	A	98.8	Very high	97.8	Very high	16 Å²	16	53.7 Å²	53.7	13%	0.132	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	142.7	176.3	0	0	0	0	0	111.1	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.35Å; Q120-A141 PolarHBondContact N-O 3.5Å; Q120-A141 PolarHBondContact O-N 3.35Å; A141-K145 CarbonylContact C-O 3.57Å; A141-K145 WeakPolarHBondContact CA-O 3.41Å; A141-K145 VanDerWaalsContact CB-O 3.25Å; A141-K145 WeakPolarHBondContact CB-O 3.42Å
142	Y	98.7	Very high	98.1	Very high	11 Å²	11	59.6 Å²	59.6	4%	0.043	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.2	175.2	-172	-125	0	0	0	110	L102 L105 Y109 Q111 H117 T118 W119 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4.16Å; L105-Y142 HydrophobicContact CB-CD1 4.49Å; L105-Y142 HydrophobicContact CB-CD2 4.17Å; L105-Y142 HydrophobicContact CB-CE1 4.12Å; L105-Y142 HydrophobicContact CB-CE2 3.8Å; L105-Y142 HydrophobicContact CD1-CD2 3.68Å; L105-Y142 HydrophobicContact CD1-CE2 3.97Å; L105-Y142 HydrophobicContact CD1-CG 4.24Å; L105-Y142 HydrophobicContact CG-CD2 4.41Å; L105-Y142 HydrophobicContact CG-CE2 4.48Å; Y109-Y142 AromaticContact CD2-CD1 3.67Å; Y109-Y142 HydrophobicContact CD2-CD1 3.67Å; Y109-Y142 AromaticContact CD2-CE1 3.46Å; Y109-Y142 HydrophobicContact CD2-CE1 3.46Å; Y109-Y142 VanDerWaalsContact CD2-CE1 3.46Å; Y109-Y142 AromaticContact CE2-CD1 3.44Å; Y109-Y142 HydrophobicContact CE2-CD1 3.44Å; Y109-Y142 VanDerWaalsContact CE2-CD1 3.44Å; Y109-Y142 AromaticContact CE2-CE1 3.78Å; Y109-Y142 HydrophobicContact CE2-CE1 3.78Å; Y109-Y142 HydrophobicContact CE2-CG 4.43Å; Y109-Y142 HydrophobicContact CG-CE1 4.34Å; Q111-Y142 PolarHBondContact OE1-OH 2.89Å; H117-Y142 HydrophobicContact CB-CE2 3.84Å; H117-Y142 WeakPolarHBondContact CB-OH 3.49Å; H117-Y142 VanDerWaalsContact CG-OH 3.23Å; H117-Y142 AromaticContact ND1-CZ 3.91Å; H117-Y142 PolarHBondContact ND1-OH 2.9Å; T118-Y142 WeakPolarHBondContact O-CA 3.27Å; T118-Y142 WeakPolarHBondContact O-CD2 3.4Å; W119-Y142 HydrophobicContact CE3-CD2 4.05Å; W119-Y142 HydrophobicContact CE3-CG 4.37Å; Y142-G144 PolarHBondContact O-N 3.47Å; Y142-K145 PolarHBondContact N-O 3.42Å; Y142-K145 PolarHBondContact O-N 3.37Å
143	D	98.1	Very high	98.2	Very high	61 Å²	61	55.1 Å²	55.1	33%	0.326	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	39.9	-176.3	-66.2	-20.8	0	0	0	113.4	H117 T118 K145	H117-D143 WeakPolarHBondContact CA-OD1 3.34Å; H117-D143 WeakPolarHBondContact CB-OD1 3.41Å; H117-D143 IonicContact CE1-OD2 2.93Å; H117-D143 IonicContact CG-OD1 3.6Å; H117-D143 IonicContact CG-OD2 3.58Å; H117-D143 IonicContact ND1-OD1 3.37Å; H117-D143 IonicContact ND1-OD2 2.94Å; H117-D143 PolarHBondContact ND1-OD2 3.01Å; T118-D143 PolarHBondContact N-OD1 3.2Å; T118-D143 PolarHBondContact O-N 3.33Å; D143-K145 VanDerWaalsContact C-N 3.29Å; D143-K145 PolarHBondContact O-N 3Å
144	G	97.4	Very high	98.2	Very high	59 Å²	59	53 Å²	53	61%	0.608	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	7.1	178.2	0	0	0	0	0	115.2	Y142	Y142-G144 PolarHBondContact O-N 3.47Å
145	K	98.4	Very high	98.2	Very high	162 Å²	162	55.4 Å²	55.4	70%	0.704	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.8	176.2	-62.8	-179.9	-178.6	178.6	0	110.8	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.57Å; A141-K145 WeakPolarHBondContact CA-O 3.41Å; A141-K145 VanDerWaalsContact CB-O 3.25Å; A141-K145 WeakPolarHBondContact CB-O 3.42Å; Y142-K145 PolarHBondContact N-O 3.42Å; Y142-K145 PolarHBondContact O-N 3.37Å; D143-K145 VanDerWaalsContact C-N 3.29Å; D143-K145 PolarHBondContact O-N 3Å; K145-Y147 PolarHBondContact O-N 2.97Å
146	D	98.7	Very high	98.3	Very high	131 Å²	131	52.3 Å²	52.3	70%	0.701	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54	137.7	174.7	-67.3	-21.2	0	0	0	110.8	A160	D146-A160 HydrophobicContact CB-CB 4.41Å; D146-A160 WeakPolarHBondContact O-CB 3.13Å
147	Y	98.8	Very high	98.3	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	-62.6	179.6	-179.3	-95.7	0	0	0	110.9	L105 Y109 W119 Y140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD2 4.1Å; L105-Y147 HydrophobicContact CD2-CE1 4.06Å; L105-Y147 HydrophobicContact CD2-CE2 3.46Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.46Å; L105-Y147 VanDerWaalsContact CD2-CZ 3.41Å; Y109-Y147 HydrophobicContact CE2-CD2 4.26Å; Y109-Y147 AromaticContact CE2-CE2 3.93Å; Y109-Y147 HydrophobicContact CE2-CE2 3.93Å; Y109-Y147 VanDerWaalsContact OH-CD2 3.26Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.19Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.2Å; W119-Y147 AromaticContact CH2-CD1 3.35Å; W119-Y147 HydrophobicContact CH2-CD1 3.35Å; W119-Y147 AromaticContact CH2-CE1 3.82Å; W119-Y147 HydrophobicContact CH2-CE1 3.82Å; W119-Y147 AromaticContact CH2-CG 3.85Å; W119-Y147 HydrophobicContact CH2-CG 3.85Å; W119-Y147 AromaticContact CZ3-CD1 3.7Å; W119-Y147 HydrophobicContact CZ3-CD1 3.7Å; W119-Y147 HydrophobicContact CZ3-CD2 4.36Å; W119-Y147 HydrophobicContact CZ3-CE1 4.33Å; W119-Y147 AromaticContact CZ3-CG 3.68Å; W119-Y147 HydrophobicContact CZ3-CG 3.68Å; Y140-Y147 PolarHBondContact O-N 2.96Å; K145-Y147 PolarHBondContact O-N 2.97Å; Y147-A160 WeakPolarHBondContact O-CB 3.04Å; Y147-A160 PolarHBondContact O-N 3.11Å; Y147-A163 HydrophobicContact CE2-CB 4.42Å; Y147-A163 PolarHBondContact OH-O 3.08Å; Y147-A163 VanDerWaalsContact OH-O 3.06Å; Y147-A164 HydrophobicContact CD1-CB 4.13Å; Y147-A164 HydrophobicContact CD2-CB 3.93Å; Y147-A164 HydrophobicContact CE1-CB 4.07Å; Y147-A164 HydrophobicContact CE2-CB 3.81Å; Y147-A164 HydrophobicContact CG-CB 4.11Å; Y147-A164 VanDerWaalsContact CZ-CA 3.44Å; Y147-A164 WeakPolarHBondContact O-CB 3.4Å; Y147-T167 HydrophobicContact CE1-CG2 4.15Å; Y147-T167 PolarHBondContact OH-OG1 2.83Å
148	I	98.8	Very high	98.3	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	140.4	178.3	-158.9	175.1	0	0	0	110.4	Y140 W157 T158 T167 Q168 W171	Y140-I148 HydrophobicContact CD2-CG2 3.89Å; Y140-I148 HydrophobicContact CG-CG2 4.33Å; Y140-I148 PolarHBondContact N-O 2.9Å; Y140-I148 PolarHBondContact O-N 3.5Å; I148-W157 HydrophobicContact CD1-CB 4.13Å; I148-W157 HydrophobicContact CD1-CD2 4.32Å; I148-W157 HydrophobicContact CD1-CE3 4.12Å; I148-W157 HydrophobicContact CD1-CG 4.35Å; I148-W157 HydrophobicContact CG1-CB 4.25Å; I148-W157 HydrophobicContact CG1-CE3 4Å; I148-T158 WeakPolarHBondContact CA-O 3.47Å; I148-T158 WeakPolarHBondContact CG1-O 3.24Å; I148-T167 HydrophobicContact CD1-CG2 4.27Å; I148-Q168 HydrophobicContact CD1-CB 3.86Å; I148-W171 HydrophobicContact CD1-CE3 4.15Å; I148-W171 HydrophobicContact CD1-CZ3 4.33Å; I148-W171 HydrophobicContact CG2-CE3 4.46Å; I148-W171 HydrophobicContact CG2-CH2 3.96Å; I148-W171 HydrophobicContact CG2-CZ3 3.64Å
149	A	98.8	Very high	98.3	Very high	30 Å²	30	56.1 Å²	56.1	25%	0.248	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.9	178.5	0	0	0	0	0	111.6	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.92Å; A149-W157 VanDerWaalsContact C-CE3 3.49Å; A149-W157 CarbonylContact O-C 3.56Å; A149-W157 WeakPolarHBondContact O-CA 3.46Å; A149-T158 PolarHBondContact N-O 2.81Å; A149-T158 PolarHBondContact O-N 3.07Å
150	L	98.8	Very high	98.3	Very high	14 Å²	14	55 Å²	55	7%	0.073	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	127.8	168.9	-175.7	66.4	0	0	0	108.3	N138 L154 W157 A177 D180 L184	N138-L150 HydrophobicContact CB-CB 3.98Å; N138-L150 HydrophobicContact CB-CD2 4.14Å; N138-L150 WeakPolarHBondContact O-CB 3.38Å; N138-L150 PolarHBondContact O-N 2.69Å; L150-L154 HydrophobicContact CD2-CD2 3.75Å; L150-L154 HydrophobicContact CG-CD2 4.26Å; L150-W157 HydrophobicContact CB-CE3 4.02Å; L150-W157 HydrophobicContact CB-CH2 3.99Å; L150-W157 HydrophobicContact CB-CZ3 3.65Å; L150-W157 HydrophobicContact CD1-CD2 4.2Å; L150-W157 HydrophobicContact CD1-CE3 4.4Å; L150-W157 HydrophobicContact CD1-CH2 4.09Å; L150-W157 HydrophobicContact CD1-CZ2 3.88Å; L150-W157 HydrophobicContact CD1-CZ3 4.34Å; L150-A177 HydrophobicContact CD1-CB 3.92Å; L150-D180 HydrophobicContact CD2-CB 4.05Å; L150-L184 HydrophobicContact CD2-CD1 3.93Å
151	N	98.6	Very high	98.3	Very high	44 Å²	44	56.4 Å²	56.4	24%	0.235	31%	0.314	C	S	.	.			trans	-72.2	163.3	-179.7	-67.3	-28.5	0	0	0	111.3	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 2.78Å; N151-D153 VanDerWaalsContact O-N 3.08Å; N151-L154 PolarHBondContact O-N 3.19Å; N151-S156 WeakPolarHBondContact CB-O 3.33Å; N151-S156 WeakPolarHBondContact CB-OG 3.35Å; N151-S156 PolarHBondContact N-O 2.92Å; N151-S156 PolarHBondContact ND2-OG 2.83Å; N151-T158 PolarHBondContact ND2-OG1 3.21Å; N151-T158 WeakPolarHBondContact OD1-CB 3.44Å; N151-T158 PolarHBondContact OD1-OG1 2.71Å
152	E	97.3	Very high	98.3	Very high	135 Å²	135	60.8 Å²	60.8	63%	0.631	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.3	-179.5	-66	-179.2	-175.8	0	0	113.4	R135 L154	R135-E152 IonicContact CZ-OE1 3.48Å; R135-E152 IonicContact NH1-OE1 3.79Å; R135-E152 PolarHBondContact NH1-OE1 3.36Å; R135-E152 IonicContact NH2-OE1 3.4Å; R135-E152 PolarHBondContact NH2-OE1 2.88Å; E152-L154 PolarHBondContact O-N 3.03Å
153	D	97.4	Very high	98.3	Very high	79 Å²	79	60.5 Å²	60.5	42%	0.422	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-8.5	173.8	70.4	4.2	0	0	0	113.9	N151 R155 S156	N151-D153 PolarHBondContact O-N 2.78Å; N151-D153 VanDerWaalsContact O-N 3.08Å; D153-R155 WeakPolarHBondContact O-CG 3.38Å; D153-R155 PolarHBondContact O-N 2.86Å; D153-R155 VanDerWaalsContact O-N 3.17Å; D153-R155 PolarHBondContact OD1-N 2.78Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 3.39Å; D153-S156 PolarHBondContact OD1-OG 2.77Å; D153-S156 VanDerWaalsContact OD1-OG 3.11Å; D153-S156 WeakPolarHBondContact OD2-CB 3.31Å; D153-S156 PolarHBondContact OD2-OG 3.32Å
154	L	97.9	Very high	98.3	Very high	8 Å²	8	57.6 Å²	57.6	4%	0.042	32%	0.324	C	S	.	.	S	Bend	trans	53.1	27.9	-175.2	-53.8	-179	0	0	0	113.7	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.17Å; L150-L154 HydrophobicContact CD2-CD2 3.75Å; L150-L154 HydrophobicContact CG-CD2 4.26Å; N151-L154 PolarHBondContact O-N 3.19Å; E152-L154 PolarHBondContact O-N 3.03Å; L154-R181 HydrophobicContact CB-CB 4.02Å; L154-R181 HydrophobicContact CB-CG 3.81Å; L154-R181 HydrophobicContact CD1-CG 4.17Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; L154-E185 HydrophobicContact CD1-CG 4.2Å
155	R	97.6	Very high	98.3	Very high	164 Å²	164	58.4 Å²	58.4	62%	0.619	31%	0.311	S	S	*	.	S	Bend	trans	-134.4	-30.8	-174	-71.1	168.8	-174.6	-98	12	112.7	D153 A177 R181	D153-R155 WeakPolarHBondContact O-CG 3.38Å; D153-R155 PolarHBondContact O-N 2.86Å; D153-R155 VanDerWaalsContact O-N 3.17Å; D153-R155 PolarHBondContact OD1-N 2.78Å; R155-A177 WeakPolarHBondContact O-CB 3.38Å; R155-R181 VanDerWaalsContact CZ-NH1 3.3Å
156	S	97.9	Very high	98.3	Very high	41 Å²	41	53.6 Å²	53.6	29%	0.287	29%	0.293	S	S	.	.			trans	-117.2	162	-177.2	63.8	0	0	0	0	112.1	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.33Å; N151-S156 WeakPolarHBondContact CB-OG 3.35Å; N151-S156 PolarHBondContact N-O 2.92Å; N151-S156 PolarHBondContact ND2-OG 2.83Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 3.39Å; D153-S156 PolarHBondContact OD1-OG 2.77Å; D153-S156 VanDerWaalsContact OD1-OG 3.11Å; D153-S156 WeakPolarHBondContact OD2-CB 3.31Å; D153-S156 PolarHBondContact OD2-OG 3.32Å
157	W	98.7	Very high	98.3	Very high	9 Å²	9	48 Å²	48	3%	0.034	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	145.2	-178.2	-62.7	91.3	0	0	0	111	I148 A149 L150 Q168 W171 V176 A177 D180	I148-W157 HydrophobicContact CD1-CB 4.13Å; I148-W157 HydrophobicContact CD1-CD2 4.32Å; I148-W157 HydrophobicContact CD1-CE3 4.12Å; I148-W157 HydrophobicContact CD1-CG 4.35Å; I148-W157 HydrophobicContact CG1-CB 4.25Å; I148-W157 HydrophobicContact CG1-CE3 4Å; A149-W157 VanDerWaalsContact C-CE3 3.49Å; A149-W157 CarbonylContact O-C 3.56Å; A149-W157 WeakPolarHBondContact O-CA 3.46Å; L150-W157 HydrophobicContact CB-CE3 4.02Å; L150-W157 HydrophobicContact CB-CH2 3.99Å; L150-W157 HydrophobicContact CB-CZ3 3.65Å; L150-W157 HydrophobicContact CD1-CD2 4.2Å; L150-W157 HydrophobicContact CD1-CE3 4.4Å; L150-W157 HydrophobicContact CD1-CH2 4.09Å; L150-W157 HydrophobicContact CD1-CZ2 3.88Å; L150-W157 HydrophobicContact CD1-CZ3 4.34Å; W157-Q168 HydrophobicContact CB-CG 4.14Å; W157-Q168 PolarHBondContact O-NE2 3.34Å; W157-W171 AromaticContact CD2-CE3 3.97Å; W157-W171 HydrophobicContact CD2-CE3 3.97Å; W157-W171 HydrophobicContact CD2-CZ3 4.47Å; W157-W171 AromaticContact CE2-CE3 3.77Å; W157-W171 AromaticContact CE3-CE3 3.89Å; W157-W171 HydrophobicContact CE3-CE3 3.89Å; W157-W171 AromaticContact CE3-CZ3 3.92Å; W157-W171 HydrophobicContact CE3-CZ3 3.92Å; W157-W171 AromaticContact CH2-CE3 3.46Å; W157-W171 HydrophobicContact CH2-CE3 3.46Å; W157-W171 VanDerWaalsContact CH2-CE3 3.46Å; W157-W171 AromaticContact CH2-CZ3 3.43Å; W157-W171 HydrophobicContact CH2-CZ3 3.43Å; W157-W171 VanDerWaalsContact CH2-CZ3 3.43Å; W157-W171 HydrophobicContact CZ2-CD2 4.49Å; W157-W171 AromaticContact CZ2-CE3 3.53Å; W157-W171 HydrophobicContact CZ2-CE3 3.53Å; W157-W171 HydrophobicContact CZ2-CZ3 4.02Å; W157-W171 AromaticContact CZ3-CE3 3.65Å; W157-W171 HydrophobicContact CZ3-CE3 3.65Å; W157-W171 AromaticContact CZ3-CZ3 3.37Å; W157-W171 HydrophobicContact CZ3-CZ3 3.37Å; W157-V176 HydrophobicContact CZ2-CB 4.4Å; W157-V176 HydrophobicContact CZ2-CG1 4.09Å; W157-A177 HydrophobicContact CZ2-CB 4.35Å; W157-D180 WeakPolarHBondContact CH2-OD2 3.23Å
158	T	98.7	Very high	98.3	Very high	78 Å²	78	49.9 Å²	49.9	48%	0.479	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	117.4	166.4	-65.8	0	0	0	0	109	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.47Å; I148-T158 WeakPolarHBondContact CG1-O 3.24Å; A149-T158 PolarHBondContact N-O 2.81Å; A149-T158 PolarHBondContact O-N 3.07Å; N151-T158 PolarHBondContact ND2-OG1 3.21Å; N151-T158 WeakPolarHBondContact OD1-CB 3.44Å; N151-T158 PolarHBondContact OD1-OG1 2.71Å
159	A	98.7	Very high	98.3	Very high	23 Å²	23	57.2 Å²	57.2	19%	0.19	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	132	175.3	0	0	0	0	0	110.6	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.73Å; A159-Q165 HydrophobicContact CB-CG 3.97Å; A159-Q168 HydrophobicContact CB-CB 4.44Å
160	A	98.5	Very high	98.3	Very high	61 Å²	61	61.1 Å²	61.1	50%	0.504	31%	0.311	S	S	.	.	S	Bend	trans	-75.5	-30.8	-176.7	0	0	0	0	0	113.3	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.41Å; D146-A160 WeakPolarHBondContact O-CB 3.13Å; Y147-A160 WeakPolarHBondContact O-CB 3.04Å; Y147-A160 PolarHBondContact O-N 3.11Å
161	D	98.3	Very high	98.2	Very high	52 Å²	52	63 Å²	63	28%	0.278	32%	0.317	S	S	.	.	S	Bend	trans	-149.9	-176.8	-179	67.1	28.5	0	0	0	113.2	Y109 A163 A164 Q165	Y109-D161 VanDerWaalsContact CE1-OD2 3.23Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.4Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 2.92Å; Y109-D161 PolarHBondContact OH-OD2 3.41Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.74Å; D161-A163 WeakPolarHBondContact OD1-CA 3.35Å; D161-A163 WeakPolarHBondContact OD1-CB 3.43Å; D161-A163 PolarHBondContact OD1-N 2.86Å; D161-A164 PolarHBondContact O-N 2.96Å; D161-A164 PolarHBondContact OD1-N 3.36Å; D161-Q165 WeakPolarHBondContact O-CG 3.24Å; D161-Q165 PolarHBondContact O-N 2.9Å
162	T	98.1	Very high	98.2	Very high	109 Å²	109	65.4 Å²	65.4	67%	0.669	33%	0.327	S	S	*	.	H	α-helix	trans	-66.3	-28.3	-178.9	52.4	0	0	0	0	113.5
163	A	98	Very high	98.3	Very high	5 Å²	5	63.2 Å²	63.2	4%	0.041	33%	0.332	C	S	.	.	H	α-helix	trans	-72.8	-39.6	174.6	0	0	0	0	0	110.6	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.4Å; Y109-A163 HydrophobicContact CE1-CB 3.63Å; Y109-A163 HydrophobicContact CE2-CB 3.89Å; Y109-A163 VanDerWaalsContact CZ-CB 3.48Å; Y147-A163 HydrophobicContact CE2-CB 4.42Å; Y147-A163 PolarHBondContact OH-O 3.08Å; Y147-A163 VanDerWaalsContact OH-O 3.06Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.74Å; D161-A163 WeakPolarHBondContact OD1-CA 3.35Å; D161-A163 WeakPolarHBondContact OD1-CB 3.43Å; D161-A163 PolarHBondContact OD1-N 2.86Å; A163-Q165 VanDerWaalsContact C-N 3.31Å; A163-Q165 PolarHBondContact O-N 2.8Å; A163-I166 WeakPolarHBondContact O-CB 3.33Å; A163-I166 PolarHBondContact O-N 3.4Å
164	A	98.4	Very high	98.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-33.3	173.1	0	0	0	0	0	113.2	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD1-CB 4.13Å; Y147-A164 HydrophobicContact CD2-CB 3.93Å; Y147-A164 HydrophobicContact CE1-CB 4.07Å; Y147-A164 HydrophobicContact CE2-CB 3.81Å; Y147-A164 HydrophobicContact CG-CB 4.11Å; Y147-A164 VanDerWaalsContact CZ-CA 3.44Å; Y147-A164 WeakPolarHBondContact O-CB 3.4Å; A159-A164 HydrophobicContact CB-CB 3.73Å; D161-A164 PolarHBondContact O-N 2.96Å; D161-A164 PolarHBondContact OD1-N 3.36Å; A164-I166 PolarHBondContact O-N 3.02Å; A164-T167 WeakPolarHBondContact O-CB 3.47Å; A164-T167 PolarHBondContact O-N 2.79Å; A164-Q168 PolarHBondContact O-N 3.4Å
165	Q	98.6	Very high	98.3	Very high	75 Å²	75	69.1 Å²	69.1	35%	0.35	36%	0.36	S	S	.	.	H	α-helix	trans	-60.6	-28.2	173.7	-71.9	174	12.1	0	0	113.1	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 3.97Å; D161-Q165 WeakPolarHBondContact O-CG 3.24Å; D161-Q165 PolarHBondContact O-N 2.9Å; A163-Q165 VanDerWaalsContact C-N 3.31Å; A163-Q165 PolarHBondContact O-N 2.8Å; Q165-R169 WeakPolarHBondContact O-CG 3.39Å; Q165-R169 PolarHBondContact O-N 3.44Å; Q165-R169 VanDerWaalsContact O-N 3.1Å
166	I	98.3	Very high	98.4	Very high	61 Å²	61	62.6 Å²	62.6	31%	0.313	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-45.5	174.1	-58.4	171	0	0	0	109.7	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.26Å; Y108-I166 HydrophobicContact CD2-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.32Å; Y108-I166 HydrophobicContact CE2-CB 4.31Å; Y108-I166 HydrophobicContact CE2-CG2 4.04Å; Y108-I166 HydrophobicContact CG-CD1 4.18Å; A163-I166 WeakPolarHBondContact O-CB 3.33Å; A163-I166 PolarHBondContact O-N 3.4Å; A164-I166 PolarHBondContact O-N 3.02Å; I166-K170 WeakPolarHBondContact O-CG 3.46Å; I166-K170 PolarHBondContact O-N 3.27Å
167	T	98.3	Very high	98.4	Very high	15 Å²	15	61 Å²	61	9%	0.092	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-44.4	176.9	-64.9	0	0	0	0	111.1	Y147 I148 A164 R169 K170 W171	Y147-T167 HydrophobicContact CE1-CG2 4.15Å; Y147-T167 PolarHBondContact OH-OG1 2.83Å; I148-T167 HydrophobicContact CD1-CG2 4.27Å; A164-T167 WeakPolarHBondContact O-CB 3.47Å; A164-T167 PolarHBondContact O-N 2.79Å; T167-R169 PolarHBondContact O-N 3.45Å; T167-K170 WeakPolarHBondContact O-CB 3.36Å; T167-K170 PolarHBondContact O-N 3.4Å; T167-K170 VanDerWaalsContact O-N 3.14Å; T167-W171 HydrophobicContact CG2-CD2 3.74Å; T167-W171 VanDerWaalsContact CG2-CE2 3.46Å; T167-W171 HydrophobicContact CG2-CE3 4.22Å; T167-W171 HydrophobicContact CG2-CG 4.16Å; T167-W171 HydrophobicContact CG2-CH2 4.18Å; T167-W171 HydrophobicContact CG2-CZ2 3.72Å; T167-W171 HydrophobicContact CG2-CZ3 4.42Å; T167-W171 WeakPolarHBondContact O-CB 3.49Å; T167-W171 PolarHBondContact O-N 2.84Å
168	Q	98.6	Very high	98.4	Very high	40 Å²	40	65.9 Å²	65.9	19%	0.187	35%	0.351	C	S	.	.	H	α-helix	trans	-51.8	-53.5	176.1	177.6	173.7	11.6	0	0	111.8	I148 W157 A159 A164 K170 W171 E172	I148-Q168 HydrophobicContact CD1-CB 3.86Å; W157-Q168 HydrophobicContact CB-CG 4.14Å; W157-Q168 PolarHBondContact O-NE2 3.34Å; A159-Q168 HydrophobicContact CB-CB 4.44Å; A164-Q168 PolarHBondContact O-N 3.4Å; Q168-K170 VanDerWaalsContact C-N 3.29Å; Q168-K170 PolarHBondContact O-N 2.88Å; Q168-W171 PolarHBondContact O-N 2.85Å; Q168-W171 VanDerWaalsContact O-N 3.12Å; Q168-E172 HydrophobicContact CG-CG 4.3Å; Q168-E172 VanDerWaalsContact CG-OE1 3.24Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.49Å; Q168-E172 PolarHBondContact NE2-OE1 2.92Å; Q168-E172 WeakPolarHBondContact O-CB 3.48Å; Q168-E172 WeakPolarHBondContact O-CG 3.29Å; Q168-E172 PolarHBondContact O-N 2.86Å
169	R	98.6	Very high	98.3	Very high	158 Å²	158	68.4 Å²	68.4	60%	0.596	36%	0.357	S	S	*	.	H	α-helix	trans	-59.8	-38.8	-179.7	-68.4	170.8	-165.5	156.9	8.2	112.4	Q165 T167 A173	Q165-R169 WeakPolarHBondContact O-CG 3.39Å; Q165-R169 PolarHBondContact O-N 3.44Å; Q165-R169 VanDerWaalsContact O-N 3.1Å; T167-R169 PolarHBondContact O-N 3.45Å; R169-A173 VanDerWaalsContact O-CB 3.32Å; R169-A173 WeakPolarHBondContact O-CB 3.43Å; R169-A173 PolarHBondContact O-N 2.85Å
170	K	98.2	Very high	98.3	Very high	113 Å²	113	68.4 Å²	68.4	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-65.8	-43.2	176.5	-72.3	177.7	176.9	-175	0	111.5	Y108 I166 T167 Q168 A173 A174	Y108-K170 PolarHBondContact OH-NZ 2.97Å; I166-K170 WeakPolarHBondContact O-CG 3.46Å; I166-K170 PolarHBondContact O-N 3.27Å; T167-K170 WeakPolarHBondContact O-CB 3.36Å; T167-K170 PolarHBondContact O-N 3.4Å; T167-K170 VanDerWaalsContact O-N 3.14Å; Q168-K170 VanDerWaalsContact C-N 3.29Å; Q168-K170 PolarHBondContact O-N 2.88Å; K170-A173 PolarHBondContact O-N 2.95Å; K170-A174 VanDerWaalsContact O-CB 3.31Å; K170-A174 WeakPolarHBondContact O-CB 3.45Å; K170-A174 PolarHBondContact O-N 2.61Å
171	W	98.4	Very high	98.3	Very high	52 Å²	52	68.7 Å²	68.7	20%	0.197	34%	0.342	C	S	.	.	H	α-helix	trans	-72.3	-35.9	-178.5	-75	8.2	0	0	0	112.7	Y140 I148 W157 T167 Q168 A174 R175 V176	Y140-W171 AromaticContact CD2-CH2 3.84Å; Y140-W171 HydrophobicContact CD2-CH2 3.84Å; Y140-W171 HydrophobicContact CD2-CZ3 4.15Å; Y140-W171 HydrophobicContact CE1-CH2 4.26Å; Y140-W171 AromaticContact CE2-CH2 3.38Å; Y140-W171 HydrophobicContact CE2-CH2 3.38Å; Y140-W171 AromaticContact CE2-CZ3 3.75Å; Y140-W171 HydrophobicContact CE2-CZ3 3.75Å; Y140-W171 HydrophobicContact CG-CH2 4.48Å; Y140-W171 AromaticContact CZ-CH2 3.59Å; I148-W171 HydrophobicContact CD1-CE3 4.15Å; I148-W171 HydrophobicContact CD1-CZ3 4.33Å; I148-W171 HydrophobicContact CG2-CE3 4.46Å; I148-W171 HydrophobicContact CG2-CH2 3.96Å; I148-W171 HydrophobicContact CG2-CZ3 3.64Å; W157-W171 AromaticContact CD2-CE3 3.97Å; W157-W171 HydrophobicContact CD2-CE3 3.97Å; W157-W171 HydrophobicContact CD2-CZ3 4.47Å; W157-W171 AromaticContact CE2-CE3 3.77Å; W157-W171 AromaticContact CE3-CE3 3.89Å; W157-W171 HydrophobicContact CE3-CE3 3.89Å; W157-W171 AromaticContact CE3-CZ3 3.92Å; W157-W171 HydrophobicContact CE3-CZ3 3.92Å; W157-W171 AromaticContact CH2-CE3 3.46Å; W157-W171 HydrophobicContact CH2-CE3 3.46Å; W157-W171 VanDerWaalsContact CH2-CE3 3.46Å; W157-W171 AromaticContact CH2-CZ3 3.43Å; W157-W171 HydrophobicContact CH2-CZ3 3.43Å; W157-W171 VanDerWaalsContact CH2-CZ3 3.43Å; W157-W171 HydrophobicContact CZ2-CD2 4.49Å; W157-W171 AromaticContact CZ2-CE3 3.53Å; W157-W171 HydrophobicContact CZ2-CE3 3.53Å; W157-W171 HydrophobicContact CZ2-CZ3 4.02Å; W157-W171 AromaticContact CZ3-CE3 3.65Å; W157-W171 HydrophobicContact CZ3-CE3 3.65Å; W157-W171 AromaticContact CZ3-CZ3 3.37Å; W157-W171 HydrophobicContact CZ3-CZ3 3.37Å; T167-W171 HydrophobicContact CG2-CD2 3.74Å; T167-W171 VanDerWaalsContact CG2-CE2 3.46Å; T167-W171 HydrophobicContact CG2-CE3 4.22Å; T167-W171 HydrophobicContact CG2-CG 4.16Å; T167-W171 HydrophobicContact CG2-CH2 4.18Å; T167-W171 HydrophobicContact CG2-CZ2 3.72Å; T167-W171 HydrophobicContact CG2-CZ3 4.42Å; T167-W171 WeakPolarHBondContact O-CB 3.49Å; T167-W171 PolarHBondContact O-N 2.84Å; Q168-W171 PolarHBondContact O-N 2.85Å; Q168-W171 VanDerWaalsContact O-N 3.12Å; W171-A174 CarbonylContact O-C 3.56Å; W171-A174 PolarHBondContact O-N 2.9Å; W171-R175 WeakPolarHBondContact O-CA 2.98Å; W171-R175 PolarHBondContact O-N 3.04Å; W171-V176 HydrophobicContact CB-CB 3.95Å; W171-V176 HydrophobicContact CB-CG2 3.86Å; W171-V176 HydrophobicContact CD2-CG1 4.33Å; W171-V176 HydrophobicContact CG-CB 4.11Å; W171-V176 HydrophobicContact CG-CG1 4.43Å; W171-V176 HydrophobicContact CG-CG2 3.83Å; W171-V176 PolarHBondContact O-N 3.38Å
172	E	98.5	Very high	98.3	Very high	96 Å²	96	69.3 Å²	69.3	45%	0.449	35%	0.354	S	S	.	.	H	α-helix	trans	-63.9	-47.6	171.2	-73.1	169.9	173.8	0	0	110.9	Q168 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.3Å; Q168-E172 VanDerWaalsContact CG-OE1 3.24Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.49Å; Q168-E172 PolarHBondContact NE2-OE1 2.92Å; Q168-E172 WeakPolarHBondContact O-CB 3.48Å; Q168-E172 WeakPolarHBondContact O-CG 3.29Å; Q168-E172 PolarHBondContact O-N 2.86Å; E172-A174 VanDerWaalsContact C-N 3.27Å; E172-A174 PolarHBondContact O-N 2.88Å; E172-R175 PolarHBondContact O-N 2.88Å
173	A	98.4	Very high	98.3	Very high	88 Å²	88	67.1 Å²	67.1	73%	0.727	33%	0.334	S	S	*	.	H	α-helix	trans	-61	-35.9	176.7	0	0	0	0	0	112.7	R169 K170	R169-A173 VanDerWaalsContact O-CB 3.32Å; R169-A173 WeakPolarHBondContact O-CB 3.43Å; R169-A173 PolarHBondContact O-N 2.85Å; K170-A173 PolarHBondContact O-N 2.95Å
174	A	98.2	Very high	98.3	Very high	58 Å²	58	67 Å²	67	48%	0.479	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	1.3	177.2	0	0	0	0	0	114.1	K170 W171 E172 V176	K170-A174 VanDerWaalsContact O-CB 3.31Å; K170-A174 WeakPolarHBondContact O-CB 3.45Å; K170-A174 PolarHBondContact O-N 2.61Å; W171-A174 CarbonylContact O-C 3.56Å; W171-A174 PolarHBondContact O-N 2.9Å; E172-A174 VanDerWaalsContact C-N 3.27Å; E172-A174 PolarHBondContact O-N 2.88Å; A174-V176 VanDerWaalsContact C-N 3.27Å; A174-V176 HydrophobicContact CB-CG2 4.06Å; A174-V176 PolarHBondContact O-N 3.46Å
175	R	98	Very high	98.3	Very high	154 Å²	154	71.2 Å²	71.2	58%	0.581	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	39.9	-178.3	-59.2	176.4	172.6	-138.8	7.7	114.1	W171 E172 A177 E178	W171-R175 WeakPolarHBondContact O-CA 2.98Å; W171-R175 PolarHBondContact O-N 3.04Å; E172-R175 PolarHBondContact O-N 2.88Å; R175-A177 PolarHBondContact O-N 2.89Å; R175-E178 HydrophobicContact CB-CG 4.23Å; R175-E178 WeakPolarHBondContact CD-OE1 3.42Å; R175-E178 IonicContact CZ-OE1 3.39Å; R175-E178 IonicContact NE-OE1 3.44Å; R175-E178 IonicContact NH1-OE1 2.71Å; R175-E178 PolarHBondContact NH1-OE1 3.26Å; R175-E178 IonicContact NH1-OE2 3.56Å; R175-E178 WeakPolarHBondContact O-CB 3.37Å; R175-E178 PolarHBondContact O-N 3.45Å; R175-E178 VanDerWaalsContact O-N 3.08Å
176	V	98.3	Very high	98.3	Very high	26 Å²	26	68.6 Å²	68.6	16%	0.158	35%	0.346	C	S	.	.	H	α-helix	trans	-59.7	-35.6	-177.6	177.3	0	0	0	0	111.8	W157 W171 A174 E178 Q179 D180	W157-V176 HydrophobicContact CZ2-CB 4.4Å; W157-V176 HydrophobicContact CZ2-CG1 4.09Å; W171-V176 HydrophobicContact CB-CB 3.95Å; W171-V176 HydrophobicContact CB-CG2 3.86Å; W171-V176 HydrophobicContact CD2-CG1 4.33Å; W171-V176 HydrophobicContact CG-CB 4.11Å; W171-V176 HydrophobicContact CG-CG1 4.43Å; W171-V176 HydrophobicContact CG-CG2 3.83Å; W171-V176 PolarHBondContact O-N 3.38Å; A174-V176 VanDerWaalsContact C-N 3.27Å; A174-V176 HydrophobicContact CB-CG2 4.06Å; A174-V176 PolarHBondContact O-N 3.46Å; V176-E178 VanDerWaalsContact C-N 3.26Å; V176-E178 PolarHBondContact O-N 2.82Å; V176-Q179 WeakPolarHBondContact O-CB 3.37Å; V176-Q179 PolarHBondContact O-N 2.91Å; V176-Q179 VanDerWaalsContact O-N 3.08Å; V176-D180 PolarHBondContact O-N 3.17Å
177	A	98.4	Very high	98.3	Very high	8 Å²	8	68.5 Å²	68.5	7%	0.066	35%	0.348	C	S	.	.	H	α-helix	trans	-59.2	-34.4	177.2	0	0	0	0	0	113	L150 R155 W157 R175 Q179 R181	L150-A177 HydrophobicContact CD1-CB 3.92Å; R155-A177 WeakPolarHBondContact O-CB 3.38Å; W157-A177 HydrophobicContact CZ2-CB 4.35Å; R175-A177 PolarHBondContact O-N 2.89Å; A177-Q179 VanDerWaalsContact C-N 3.32Å; A177-Q179 PolarHBondContact O-N 3.4Å; A177-R181 WeakPolarHBondContact O-CB 3.09Å; A177-R181 PolarHBondContact O-N 3.41Å
178	E	98.1	Very high	98.3	Very high	111 Å²	111	67.8 Å²	67.8	52%	0.519	34%	0.344	S	S	.	.	H	α-helix	trans	-65.6	-37.2	177.4	-63.8	178.4	-169.5	0	0	111.3	R175 V176 A182	R175-E178 HydrophobicContact CB-CG 4.23Å; R175-E178 WeakPolarHBondContact CD-OE1 3.42Å; R175-E178 IonicContact CZ-OE1 3.39Å; R175-E178 IonicContact NE-OE1 3.44Å; R175-E178 IonicContact NH1-OE1 2.71Å; R175-E178 PolarHBondContact NH1-OE1 3.26Å; R175-E178 IonicContact NH1-OE2 3.56Å; R175-E178 WeakPolarHBondContact O-CB 3.37Å; R175-E178 PolarHBondContact O-N 3.45Å; R175-E178 VanDerWaalsContact O-N 3.08Å; V176-E178 VanDerWaalsContact C-N 3.26Å; V176-E178 PolarHBondContact O-N 2.82Å; E178-A182 WeakPolarHBondContact O-CB 3.32Å; E178-A182 PolarHBondContact O-N 3.02Å
179	Q	97.5	Very high	98.3	Very high	132 Å²	132	66.1 Å²	66.1	62%	0.617	34%	0.337	S	S	*	.	H	α-helix	trans	-71.4	-46.6	177.9	-59.1	176.6	20.5	0	0	111.4	V176 A177 R181 A182 Y183	V176-Q179 WeakPolarHBondContact O-CB 3.37Å; V176-Q179 PolarHBondContact O-N 2.91Å; V176-Q179 VanDerWaalsContact O-N 3.08Å; A177-Q179 VanDerWaalsContact C-N 3.32Å; A177-Q179 PolarHBondContact O-N 3.4Å; Q179-R181 VanDerWaalsContact C-N 3.32Å; Q179-R181 PolarHBondContact O-N 3.04Å; Q179-A182 PolarHBondContact O-N 3.13Å; Q179-Y183 PolarHBondContact O-N 3Å
180	D	97.9	Very high	98.3	Very high	22 Å²	22	64.6 Å²	64.6	12%	0.118	34%	0.336	C	S	.	.	H	α-helix	trans	-61.6	-43.2	176.9	-76.8	-30.5	0	0	0	110.8	R121 N138 L150 W157 V176 A182 Y183 L184	R121-D180 IonicContact NH2-OD1 2.66Å; N138-D180 PolarHBondContact ND2-OD1 2.58Å; N138-D180 PolarHBondContact ND2-OD2 2.83Å; L150-D180 HydrophobicContact CD2-CB 4.05Å; W157-D180 WeakPolarHBondContact CH2-OD2 3.23Å; V176-D180 PolarHBondContact O-N 3.17Å; D180-A182 PolarHBondContact O-N 3.5Å; D180-Y183 PolarHBondContact O-N 3.45Å; D180-L184 WeakPolarHBondContact O-CB 3.48Å; D180-L184 WeakPolarHBondContact O-CG 3.45Å; D180-L184 PolarHBondContact O-N 3.21Å
181	R	98.4	Very high	98.3	Very high	68 Å²	68	61.5 Å²	61.5	26%	0.257	32%	0.321	S	S	.	.	H	α-helix	trans	-60.1	-46.2	175.7	-176.5	172.8	178.9	-127.3	-14.1	112.2	L154 R155 A177 Q179 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.02Å; L154-R181 HydrophobicContact CB-CG 3.81Å; L154-R181 HydrophobicContact CD1-CG 4.17Å; R155-R181 VanDerWaalsContact CZ-NH1 3.3Å; A177-R181 WeakPolarHBondContact O-CB 3.09Å; A177-R181 PolarHBondContact O-N 3.41Å; Q179-R181 VanDerWaalsContact C-N 3.32Å; Q179-R181 PolarHBondContact O-N 3.04Å; R181-Y183 VanDerWaalsContact C-N 3.29Å; R181-Y183 PolarHBondContact O-N 3.09Å; R181-L184 PolarHBondContact O-N 3.49Å; R181-E185 HydrophobicContact CG-CG 4.1Å; R181-E185 IonicContact CZ-OE1 3.47Å; R181-E185 VanDerWaalsContact CZ-OE1 3.25Å; R181-E185 IonicContact CZ-OE2 3.69Å; R181-E185 VanDerWaalsContact NE-CD 3.33Å; R181-E185 IonicContact NE-OE1 3Å; R181-E185 PolarHBondContact NE-OE1 2.99Å; R181-E185 IonicContact NE-OE2 3.85Å; R181-E185 PolarHBondContact NE-OE2 3.04Å; R181-E185 IonicContact NH2-OE1 3.99Å; R181-E185 PolarHBondContact NH2-OE1 3.43Å; R181-E185 IonicContact NH2-OE2 2.81Å; R181-E185 PolarHBondContact NH2-OE2 3.42Å; R181-E185 WeakPolarHBondContact O-CB 3.48Å; R181-E185 PolarHBondContact O-N 3.41Å
182	A	98.4	Very high	98.3	Very high	65 Å²	65	59 Å²	59	54%	0.537	31%	0.312	S	S	.	.	H	α-helix	trans	-60.3	-39.7	177.9	0	0	0	0	0	112.1	E178 Q179 D180 G186	E178-A182 WeakPolarHBondContact O-CB 3.32Å; E178-A182 PolarHBondContact O-N 3.02Å; Q179-A182 PolarHBondContact O-N 3.13Å; D180-A182 PolarHBondContact O-N 3.5Å; A182-G186 PolarHBondContact O-N 3.41Å; A182-G186 VanDerWaalsContact O-N 3.15Å
183	Y	98.4	Very high	98.2	Very high	62 Å²	62	60 Å²	60	24%	0.243	31%	0.312	C	S	.	.	I	π-helix	trans	-66.3	-47.6	173.8	171.4	-95.8	0	0	0	112.2	Y123 Q179 D180 R181 G186 T187 C188	Y123-Y183 AromaticContact CD2-CE1 3.9Å; Y123-Y183 HydrophobicContact CD2-CE1 3.9Å; Y123-Y183 AromaticContact CE2-CE1 3.84Å; Y123-Y183 HydrophobicContact CE2-CE1 3.84Å; Q179-Y183 PolarHBondContact O-N 3Å; D180-Y183 PolarHBondContact O-N 3.45Å; R181-Y183 VanDerWaalsContact C-N 3.29Å; R181-Y183 PolarHBondContact O-N 3.09Å; Y183-G186 CarbonylContact O-C 3.58Å; Y183-G186 PolarHBondContact O-N 2.9Å; Y183-T187 HydrophobicContact CD2-CG2 3.98Å; Y183-T187 HydrophobicContact CE2-CG2 3.86Å; Y183-T187 PolarHBondContact O-N 3.43Å; Y183-C188 HydrophobicContact CD1-CB 4.2Å; Y183-C188 HydrophobicContact CE1-CB 3.77Å; Y183-C188 WeakPolarHBondContact O-CB 3.18Å; Y183-C188 PolarHBondContact O-N 3.4Å
184	L	98.6	Very high	98.1	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.01	30%	0.299	C	S	.	.	I	π-helix	trans	-68.7	-39.6	-174.9	-70.5	170	0	0	0	112.6	G124 L150 L154 D180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.29Å; L150-L184 HydrophobicContact CD2-CD1 3.93Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; D180-L184 WeakPolarHBondContact O-CB 3.48Å; D180-L184 WeakPolarHBondContact O-CG 3.45Å; D180-L184 PolarHBondContact O-N 3.21Å; R181-L184 PolarHBondContact O-N 3.49Å; L184-V189 WeakPolarHBondContact O-CG2 3.13Å
185	E	98.1	Very high	98.1	Very high	89 Å²	89	58.9 Å²	58.9	42%	0.416	28%	0.276	S	S	.	.	I	π-helix	trans	-78.8	-25	177.7	-69.3	-178.9	167.8	0	0	113.2	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.39Å; L133-E185 HydrophobicContact CD2-CG 3.68Å; L154-E185 HydrophobicContact CD1-CG 4.2Å; R181-E185 HydrophobicContact CG-CG 4.1Å; R181-E185 IonicContact CZ-OE1 3.47Å; R181-E185 VanDerWaalsContact CZ-OE1 3.25Å; R181-E185 IonicContact CZ-OE2 3.69Å; R181-E185 VanDerWaalsContact NE-CD 3.33Å; R181-E185 IonicContact NE-OE1 3Å; R181-E185 PolarHBondContact NE-OE1 2.99Å; R181-E185 IonicContact NE-OE2 3.85Å; R181-E185 PolarHBondContact NE-OE2 3.04Å; R181-E185 IonicContact NH2-OE1 3.99Å; R181-E185 PolarHBondContact NH2-OE1 3.43Å; R181-E185 IonicContact NH2-OE2 2.81Å; R181-E185 PolarHBondContact NH2-OE2 3.42Å; R181-E185 WeakPolarHBondContact O-CB 3.48Å; R181-E185 PolarHBondContact O-N 3.41Å
186	G	98.1	Very high	98	Very high	21 Å²	21	52.2 Å²	52.2	22%	0.216	25%	0.252	C	S	.	.	I	π-helix	trans	-110.4	-94.3	-177.8	0	0	0	0	0	112.5	A182 Y183 C188 V189 E190	A182-G186 PolarHBondContact O-N 3.41Å; A182-G186 VanDerWaalsContact O-N 3.15Å; Y183-G186 CarbonylContact O-C 3.58Å; Y183-G186 PolarHBondContact O-N 2.9Å; G186-C188 VanDerWaalsContact C-N 3.28Å; G186-C188 PolarHBondContact O-N 3.02Å; G186-C188 VanDerWaalsContact O-N 3.13Å; G186-V189 PolarHBondContact O-N 3.05Å; G186-E190 PolarHBondContact O-N 3.15Å
187	T	98.1	Very high	97.9	Very high	58 Å²	58	57 Å²	57	36%	0.356	27%	0.273	S	S	.	.	I	π-helix	trans	-49.6	-43.2	-170.9	-53.9	0	0	0	0	113.7	Y183 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.98Å; Y183-T187 HydrophobicContact CE2-CG2 3.86Å; Y183-T187 PolarHBondContact O-N 3.43Å; T187-E190 PolarHBondContact O-N 3.24Å; T187-W191 VanDerWaalsContact CG2-CD1 3.47Å; T187-W191 PolarHBondContact O-N 3.3Å
188	C	98.6	Very high	97.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-49.5	179.4	-172.3	0	0	0	0	111.6	M29 C125 Y183 G186 W191 L192	M29-C188 HydrophobicContact CE-CB 4.22Å; M29-C188 WeakPolarHBondContact CE-O 3.36Å; M29-C188 WeakPolarHBondContact CE-SG 3.06Å; C125-C188 HydrophobicContact CB-CB 3.91Å; C125-C188 WeakPolarHBondContact CB-SG 3.4Å; C125-C188 PolarHBondContact N-SG 2.99Å; C125-C188 WeakPolarHBondContact SG-CB 3.42Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.89Å; Y183-C188 HydrophobicContact CD1-CB 4.2Å; Y183-C188 HydrophobicContact CE1-CB 3.77Å; Y183-C188 WeakPolarHBondContact O-CB 3.18Å; Y183-C188 PolarHBondContact O-N 3.4Å; G186-C188 VanDerWaalsContact C-N 3.28Å; G186-C188 PolarHBondContact O-N 3.02Å; G186-C188 VanDerWaalsContact O-N 3.13Å; C188-W191 PolarHBondContact O-N 3.49Å; C188-L192 WeakPolarHBondContact O-CB 3.42Å; C188-L192 PolarHBondContact O-N 3.19Å
189	V	98.5	Very high	97.7	Very high	6 Å²	6	53.8 Å²	53.8	4%	0.036	26%	0.259	C	S	.	.	H	α-helix	trans	-65.1	-41.7	179.8	173.3	0	0	0	0	111	C125 V127 G131 L133 L184 G186 L192 R193	C125-V189 HydrophobicContact CB-CG2 4.38Å; V127-V189 HydrophobicContact CG1-CB 4.41Å; V127-V189 HydrophobicContact CG1-CG1 4Å; V127-V189 HydrophobicContact CG1-CG2 3.97Å; G131-V189 WeakPolarHBondContact O-CG1 3.38Å; L133-V189 HydrophobicContact CB-CG2 4.02Å; L133-V189 HydrophobicContact CD1-CG2 3.89Å; L184-V189 WeakPolarHBondContact O-CG2 3.13Å; G186-V189 PolarHBondContact O-N 3.05Å; V189-L192 PolarHBondContact O-N 3.49Å; V189-R193 WeakPolarHBondContact O-CG 3.35Å; V189-R193 PolarHBondContact O-N 3.27Å
190	E	98.3	Very high	97.4	Very high	126 Å²	126	52 Å²	52	59%	0.589	25%	0.249	S	C	*	.	H	α-helix	trans	-61.2	-46.8	177.6	-70.6	176.8	177.3	0	0	112.2	G186 T187 R193 R194	G186-E190 PolarHBondContact O-N 3.15Å; T187-E190 PolarHBondContact O-N 3.24Å; E190-R193 PolarHBondContact O-N 3.06Å; E190-R194 PolarHBondContact O-N 2.85Å; E190-R194 VanDerWaalsContact O-N 3.09Å
191	W	98.2	Very high	97.1	Very high	47 Å²	47	57.5 Å²	57.5	18%	0.178	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-41.5	177.1	-81.1	108.2	0	0	0	112.3	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.06Å; M29-W191 HydrophobicContact SD-CB 4.47Å; Y83-W191 AromaticContact CD2-CH2 3.55Å; Y83-W191 HydrophobicContact CD2-CH2 3.55Å; Y83-W191 HydrophobicContact CD2-CZ2 4.23Å; Y83-W191 AromaticContact CD2-CZ3 3.85Å; Y83-W191 HydrophobicContact CD2-CZ3 3.85Å; Y83-W191 HydrophobicContact CE2-CE3 4.16Å; Y83-W191 AromaticContact CE2-CH2 3.73Å; Y83-W191 HydrophobicContact CE2-CH2 3.73Å; Y83-W191 HydrophobicContact CE2-CZ2 4.3Å; Y83-W191 AromaticContact CE2-CZ3 3.63Å; Y83-W191 HydrophobicContact CE2-CZ3 3.63Å; T187-W191 VanDerWaalsContact CG2-CD1 3.47Å; T187-W191 PolarHBondContact O-N 3.3Å; C188-W191 PolarHBondContact O-N 3.49Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 2.04Å; W191-R194 PolarHBondContact O-N 2.73Å; W191-Y195 HydrophobicContact CB-CE2 4.01Å; W191-Y195 HydrophobicContact CE3-CD1 4.44Å; W191-Y195 AromaticContact CE3-CE1 3.5Å; W191-Y195 HydrophobicContact CE3-CE1 3.5Å; W191-Y195 VanDerWaalsContact CE3-CE1 3.5Å; W191-Y195 HydrophobicContact CE3-CE2 4.44Å; W191-Y195 AromaticContact CE3-CZ 3.48Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.48Å; W191-Y195 AromaticContact CZ3-CE1 3.98Å; W191-Y195 HydrophobicContact CZ3-CE1 3.98Å; W191-Y195 VanDerWaalsContact O-CD2 3.3Å; W191-Y195 WeakPolarHBondContact O-CD2 3.32Å; W191-Y195 PolarHBondContact O-N 2.83Å
192	L	98.4	Very high	96.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-47.2	176.7	174.4	52.8	0	0	0	111	H27 M29 V52 V127 C188 V189 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.42Å; M29-L192 HydrophobicContact CB-CB 4.08Å; M29-L192 HydrophobicContact CB-CD1 4.02Å; M29-L192 HydrophobicContact CB-CD2 4.14Å; M29-L192 HydrophobicContact CB-CG 4.3Å; M29-L192 HydrophobicContact CE-CB 4.35Å; V52-L192 HydrophobicContact CG1-CD1 3.62Å; V52-L192 HydrophobicContact CG2-CD1 4.3Å; V127-L192 HydrophobicContact CB-CD2 4.33Å; V127-L192 HydrophobicContact CG1-CD2 3.92Å; V127-L192 HydrophobicContact CG2-CD2 3.57Å; V127-L192 HydrophobicContact CG2-CG 4.2Å; C188-L192 WeakPolarHBondContact O-CB 3.42Å; C188-L192 PolarHBondContact O-N 3.19Å; V189-L192 PolarHBondContact O-N 3.49Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 2.61Å; L192-Y195 PolarHBondContact O-N 3.39Å; L192-Y195 VanDerWaalsContact O-N 3.16Å; L192-L196 HydrophobicContact CD1-CD1 3.92Å; L192-L196 HydrophobicContact CD1-CD2 4.4Å; L192-L196 HydrophobicContact CD1-CG 3.91Å; L192-L196 HydrophobicContact CG-CD1 4.04Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CG 3.49Å; L192-L196 PolarHBondContact O-N 3.08Å
193	R	97	Very high	96.4	Very high	118 Å²	118	53.5 Å²	53.5	45%	0.445	26%	0.255	S	S	.	.	H	α-helix	trans	-58.9	-43.6	175.7	-71.5	175.2	-174.5	174.3	0.7	112.5	G131 V189 E190 W191 Y195 L196 E197	G131-R193 VanDerWaalsContact C-NH2 3.28Å; G131-R193 PolarHBondContact O-NE 3.16Å; G131-R193 PolarHBondContact O-NH2 2.8Å; V189-R193 WeakPolarHBondContact O-CG 3.35Å; V189-R193 PolarHBondContact O-N 3.27Å; E190-R193 PolarHBondContact O-N 3.06Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 2.04Å; R193-Y195 VanDerWaalsContact C-N 3.34Å; R193-Y195 PolarHBondContact O-N 2.94Å; R193-L196 PolarHBondContact O-N 3.44Å; R193-E197 PolarHBondContact O-N 2.89Å
194	R	97.3	Very high	95.9	Very high	120 Å²	120	55.1 Å²	55.1	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-43.2	175.8	176.3	175.7	173.8	128.2	-4.2	111.5	E79 E190 W191 L192 E197 N198	E79-R194 VanDerWaalsContact CD-NH2 3.34Å; E79-R194 IonicContact OE1-CZ 3.68Å; E79-R194 IonicContact OE1-NE 3.21Å; E79-R194 PolarHBondContact OE1-NE 2.84Å; E79-R194 IonicContact OE1-NH2 3.73Å; E79-R194 PolarHBondContact OE1-NH2 3.21Å; E79-R194 VanDerWaalsContact OE1-NH2 3.15Å; E79-R194 IonicContact OE2-CZ 3.03Å; E79-R194 IonicContact OE2-NE 3.5Å; E79-R194 IonicContact OE2-NH2 2.75Å; E79-R194 PolarHBondContact OE2-NH2 3.07Å; E190-R194 PolarHBondContact O-N 2.85Å; E190-R194 VanDerWaalsContact O-N 3.09Å; W191-R194 PolarHBondContact O-N 2.73Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 2.61Å; R194-E197 PolarHBondContact O-N 3.47Å; R194-N198 VanDerWaalsContact O-CB 3.31Å; R194-N198 WeakPolarHBondContact O-CB 3.48Å; R194-N198 PolarHBondContact O-N 3.28Å; R194-N198 PolarHBondContact O-ND2 2.9Å; R194-N198 PolarHBondContact O-OD1 3.03Å
195	Y	97.5	Very high	95.6	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-68.3	-37.9	179.2	-61.6	-27.6	0	0	0	112.8	M29 V52 F57 W75 I76 Y83 W191 L192 R193 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.77Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å; V52-Y195 HydrophobicContact CG2-CD2 3.96Å; F57-Y195 HydrophobicContact CE2-CD2 4.11Å; F57-Y195 AromaticContact CE2-CE2 3.6Å; F57-Y195 HydrophobicContact CE2-CE2 3.6Å; F57-Y195 AromaticContact CE2-CZ 3.94Å; F57-Y195 HydrophobicContact CZ-CD2 4.23Å; F57-Y195 AromaticContact CZ-CE2 3.76Å; F57-Y195 HydrophobicContact CZ-CE2 3.76Å; W75-Y195 HydrophobicContact CE3-CD1 4.43Å; W75-Y195 HydrophobicContact CH2-CD2 4.49Å; W75-Y195 HydrophobicContact CH2-CG 4.17Å; W75-Y195 AromaticContact CZ3-CD1 3.76Å; W75-Y195 HydrophobicContact CZ3-CD1 3.76Å; W75-Y195 HydrophobicContact CZ3-CD2 4.28Å; W75-Y195 AromaticContact CZ3-CG 3.62Å; W75-Y195 HydrophobicContact CZ3-CG 3.62Å; I76-Y195 HydrophobicContact CD1-CD1 3.77Å; I76-Y195 HydrophobicContact CD1-CE1 3.29Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.48Å; Y83-Y195 PolarHBondContact OH-OH 2.91Å; W191-Y195 HydrophobicContact CB-CE2 4.01Å; W191-Y195 HydrophobicContact CE3-CD1 4.44Å; W191-Y195 AromaticContact CE3-CE1 3.5Å; W191-Y195 HydrophobicContact CE3-CE1 3.5Å; W191-Y195 VanDerWaalsContact CE3-CE1 3.5Å; W191-Y195 HydrophobicContact CE3-CE2 4.44Å; W191-Y195 AromaticContact CE3-CZ 3.48Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.48Å; W191-Y195 AromaticContact CZ3-CE1 3.98Å; W191-Y195 HydrophobicContact CZ3-CE1 3.98Å; W191-Y195 VanDerWaalsContact O-CD2 3.3Å; W191-Y195 WeakPolarHBondContact O-CD2 3.32Å; W191-Y195 PolarHBondContact O-N 2.83Å; L192-Y195 PolarHBondContact O-N 3.39Å; L192-Y195 VanDerWaalsContact O-N 3.16Å; R193-Y195 VanDerWaalsContact C-N 3.34Å; R193-Y195 PolarHBondContact O-N 2.94Å; Y195-N198 PolarHBondContact O-N 3.46Å; Y195-G199 WeakPolarHBondContact O-CA 3.37Å; Y195-G199 PolarHBondContact O-N 3.29Å; Y195-L203 WeakPolarHBondContact O-CD1 3.49Å
196	L	96.3	Very high	95.4	Very high	14 Å²	14	58 Å²	58	7%	0.073	28%	0.278	C	S	.	.	H	α-helix	trans	-61.2	-45	173.4	-69.5	168.9	0	0	0	111.3	H27 V52 L192 R193 G199 K200 L203	H27-L196 HydrophobicContact CB-CD1 3.72Å; H27-L196 HydrophobicContact CB-CD2 4.02Å; H27-L196 HydrophobicContact CB-CG 4.46Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.46Å; V52-L196 HydrophobicContact CG1-CD2 4.09Å; L192-L196 HydrophobicContact CD1-CD1 3.92Å; L192-L196 HydrophobicContact CD1-CD2 4.4Å; L192-L196 HydrophobicContact CD1-CG 3.91Å; L192-L196 HydrophobicContact CG-CD1 4.04Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CG 3.49Å; L192-L196 PolarHBondContact O-N 3.08Å; R193-L196 PolarHBondContact O-N 3.44Å; L196-G199 CarbonylContact O-C 3.52Å; L196-G199 PolarHBondContact O-N 3.27Å; L196-K200 WeakPolarHBondContact O-CA 3.18Å; L196-K200 PolarHBondContact O-N 3.25Å; L196-L203 HydrophobicContact CD2-CB 4.05Å; L196-L203 HydrophobicContact CD2-CD1 4.23Å
197	E	95.8	Very high	95.3	Very high	126 Å²	126	58.6 Å²	58.6	59%	0.589	28%	0.276	S	S	*	.	H	α-helix	trans	-64.6	-46.1	176.3	-173.1	62	-150.3	0	0	111.8	R193 R194 G199 K200	R193-E197 PolarHBondContact O-N 2.89Å; R194-E197 PolarHBondContact O-N 3.47Å; E197-G199 VanDerWaalsContact C-N 3.3Å; E197-G199 PolarHBondContact O-N 2.88Å; E197-K200 WeakPolarHBondContact O-CB 3.45Å; E197-K200 PolarHBondContact O-N 3.01Å
198	N	96.3	Very high	95.3	Very high	48 Å²	48	59 Å²	59	26%	0.257	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-37.7	178.6	-69	-8.4	0	0	0	112.6	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.48Å; W75-N198 WeakPolarHBondContact CB-O 3.03Å; Q78-N198 PolarHBondContact NE2-ND2 3.08Å; Q78-N198 PolarHBondContact NE2-OD1 2.88Å; E79-N198 PolarHBondContact OE1-ND2 3.05Å; R194-N198 VanDerWaalsContact O-CB 3.31Å; R194-N198 WeakPolarHBondContact O-CB 3.48Å; R194-N198 PolarHBondContact O-N 3.28Å; R194-N198 PolarHBondContact O-ND2 2.9Å; R194-N198 PolarHBondContact O-OD1 3.03Å; Y195-N198 PolarHBondContact O-N 3.46Å
199	G	95.3	Very high	95.3	Very high	3 Å²	3	59.4 Å²	59.4	3%	0.031	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	13.8	-174.5	0	0	0	0	0	114	Y195 L196 E197 D201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.37Å; Y195-G199 PolarHBondContact O-N 3.29Å; L196-G199 CarbonylContact O-C 3.52Å; L196-G199 PolarHBondContact O-N 3.27Å; E197-G199 VanDerWaalsContact C-N 3.3Å; E197-G199 PolarHBondContact O-N 2.88Å; G199-D201 PolarHBondContact O-N 3.33Å; G199-T202 CarbonylContact O-C 3.54Å; G199-T202 WeakPolarHBondContact O-CA 3.43Å; G199-T202 PolarHBondContact O-N 2.99Å; G199-T202 PolarHBondContact O-OG1 2.91Å; G199-L203 PolarHBondContact O-N 2.84Å
200	K	93	Very high	95.3	Very high	95 Å²	95	66.7 Å²	66.7	41%	0.413	31%	0.313	S	S	.	.	H	α-helix	trans	-47.9	-50.3	-167.5	-174.5	169.9	-169.6	160.9	0	114.7	L196 E197 T202 E204	L196-K200 WeakPolarHBondContact O-CA 3.18Å; L196-K200 PolarHBondContact O-N 3.25Å; E197-K200 WeakPolarHBondContact O-CB 3.45Å; E197-K200 PolarHBondContact O-N 3.01Å; K200-T202 PolarHBondContact O-N 3.42Å; K200-E204 VanDerWaalsContact CE-OE2 3.22Å; K200-E204 WeakPolarHBondContact CE-OE2 3.31Å; K200-E204 HydrophobicContact CG-CG 4.37Å; K200-E204 WeakPolarHBondContact CG-OE2 3.32Å; K200-E204 PolarHBondContact O-N 2.75Å
201	D	90.6	Very high	95.2	Very high	138 Å²	138	62.3 Å²	62.3	74%	0.738	30%	0.295	S	S	*	.	H	α-helix	trans	-60.5	-21	-179.6	-65.5	-21.4	0	0	0	113.4	G199	G199-D201 PolarHBondContact O-N 3.33Å
202	T	90.7	Very high	95.2	Very high	44 Å²	44	64 Å²	64	27%	0.27	31%	0.305	S	S	.	.	H	α-helix	trans	-100.3	-68.2	174.7	57.3	0	0	0	0	110.9	G199 K200 E204 R205 R263	G199-T202 CarbonylContact O-C 3.54Å; G199-T202 WeakPolarHBondContact O-CA 3.43Å; G199-T202 PolarHBondContact O-N 2.99Å; G199-T202 PolarHBondContact O-OG1 2.91Å; K200-T202 PolarHBondContact O-N 3.42Å; T202-E204 PolarHBondContact O-N 3.4Å; T202-R205 WeakPolarHBondContact O-CB 3.34Å; T202-R205 PolarHBondContact O-N 3.25Å; T202-R263 VanDerWaalsContact C-NH2 3.35Å; T202-R263 VanDerWaalsContact CA-NH1 3.31Å; T202-R263 VanDerWaalsContact CB-NH1 3.3Å; T202-R263 VanDerWaalsContact O-CZ 3.28Å; T202-R263 PolarHBondContact O-NH1 3.5Å; T202-R263 PolarHBondContact O-NH2 3.05Å
203	L	91	Very high	95.2	Very high	5 Å²	5	65.1 Å²	65.1	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-63.8	-35.1	-166.4	-62.8	171	0	0	0	113.9	V52 T55 W75 Y195 L196 G199 R205	V52-L203 HydrophobicContact CB-CD1 4.3Å; V52-L203 HydrophobicContact CB-CD2 4.2Å; V52-L203 HydrophobicContact CG1-CD1 3.88Å; V52-L203 HydrophobicContact CG1-CD2 4.1Å; T55-L203 HydrophobicContact CG2-CD2 4.16Å; W75-L203 HydrophobicContact CD2-CD1 4.46Å; W75-L203 HydrophobicContact CH2-CD1 4.42Å; W75-L203 HydrophobicContact CZ2-CD1 3.88Å; W75-L203 HydrophobicContact CZ2-CD2 4.21Å; W75-L203 HydrophobicContact CZ2-CG 4.47Å; Y195-L203 WeakPolarHBondContact O-CD1 3.49Å; L196-L203 HydrophobicContact CD2-CB 4.05Å; L196-L203 HydrophobicContact CD2-CD1 4.23Å; G199-L203 PolarHBondContact O-N 2.84Å; L203-R205 VanDerWaalsContact C-N 3.3Å
204	E	88.1	Confident	95.2	Very high	95 Å²	95	61 Å²	61	44%	0.444	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.8	178.3	-61.1	-174.7	179.1	0	0	112.8	K200 T202	K200-E204 VanDerWaalsContact CE-OE2 3.22Å; K200-E204 WeakPolarHBondContact CE-OE2 3.31Å; K200-E204 HydrophobicContact CG-CG 4.37Å; K200-E204 WeakPolarHBondContact CG-OE2 3.32Å; K200-E204 PolarHBondContact O-N 2.75Å; T202-E204 PolarHBondContact O-N 3.4Å
205	R	91.9	Very high	95.1	Very high	122 Å²	122	57.9 Å²	57.9	46%	0.46	29%	0.29	S	S	.	.			trans	-94.2	112.9	179.2	-167.2	-174.8	79.5	-153.5	1.3	110.7	T202 L203 D207 Y233 R263	T202-R205 WeakPolarHBondContact O-CB 3.34Å; T202-R205 PolarHBondContact O-N 3.25Å; L203-R205 VanDerWaalsContact C-N 3.3Å; R205-D207 IonicContact CZ-OD1 3.88Å; R205-D207 IonicContact CZ-OD2 3.64Å; R205-D207 IonicContact NE-OD1 3.62Å; R205-D207 PolarHBondContact NE-OD1 2.84Å; R205-D207 IonicContact NE-OD2 3.15Å; R205-D207 IonicContact NH2-OD1 2.87Å; R205-D207 PolarHBondContact NH2-OD1 3.11Å; R205-D207 IonicContact NH2-OD2 2.79Å; R205-D207 PolarHBondContact NH2-OD2 2.82Å; R205-Y233 WeakPolarHBondContact O-CD1 3.41Å; R205-R263 PolarHBondContact O-NH2 2.8Å
206	A	94.6	Very high	95	Very high	30 Å²	30	61.5 Å²	61.5	25%	0.248	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-82.8	125.2	166	0	0	0	0	0	110.6	Y233	A206-Y233 CarbonylContact C-O 3.54Å; A206-Y233 VanDerWaalsContact CA-O 3.26Å; A206-Y233 WeakPolarHBondContact CA-O 3.26Å
207	D	96.2	Very high	94.9	Very high	33 Å²	33	65.5 Å²	65.5	18%	0.176	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-98.2	116.7	174.7	-67.9	-32.9	0	0	0	108	R205 F232 Y233 H287	R205-D207 IonicContact CZ-OD1 3.88Å; R205-D207 IonicContact CZ-OD2 3.64Å; R205-D207 IonicContact NE-OD1 3.62Å; R205-D207 PolarHBondContact NE-OD1 2.84Å; R205-D207 IonicContact NE-OD2 3.15Å; R205-D207 IonicContact NH2-OD1 2.87Å; R205-D207 PolarHBondContact NH2-OD1 3.11Å; R205-D207 IonicContact NH2-OD2 2.79Å; R205-D207 PolarHBondContact NH2-OD2 2.82Å; D207-F232 CarbonylContact O-C 3.52Å; D207-F232 WeakPolarHBondContact O-CA 3.34Å; D207-F232 WeakPolarHBondContact O-CB 3.47Å; D207-Y233 PolarHBondContact N-O 3.35Å; D207-Y233 PolarHBondContact O-N 2.96Å; D207-H287 PolarHBondContact O-CE1 2.85Å; D207-H287 VanDerWaalsContact O-CE1 3.32Å
208	P	97.4	Very high	94.8	Very high	66 Å²	66	64.1 Å²	64.1	43%	0.429	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-70.5	149.6	-176.8	25.9	-33.2	0	0	0	112.3	K210 L290	P208-K210 PolarHBondContact O-N 3.34Å; P208-L290 HydrophobicContact CB-CD2 3.9Å; P208-L290 HydrophobicContact CB-CG 4.45Å
209	P	98.2	Very high	94.7	Very high	10 Å²	10	64.4 Å²	64.4	7%	0.065	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-67.5	134.9	179.5	28.2	-35	0	0	0	112.3	T211 A229 F232 I237 V285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.93Å; P209-T211 HydrophobicContact CG-CG2 4.12Å; P209-T211 PolarHBondContact O-N 3.14Å; P209-A229 HydrophobicContact CB-CB 3.88Å; P209-F232 HydrophobicContact CB-CB 3.84Å; P209-F232 HydrophobicContact CB-CD1 3.9Å; P209-F232 HydrophobicContact CB-CG 4.14Å; P209-I237 HydrophobicContact CB-CD1 4.05Å; P209-I237 HydrophobicContact CG-CD1 4.12Å; P209-V285 HydrophobicContact CG-CG1 3.93Å; P209-H287 HydrophobicContact CG-CB 4.1Å; P209-L290 HydrophobicContact CG-CD1 3.82Å; P209-L290 HydrophobicContact CG-CD2 4.47Å; P209-L290 HydrophobicContact CG-CG 4.21Å
210	K	98.3	Very high	94.4	Very high	158 Å²	158	71.3 Å²	71.3	69%	0.687	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	111.7	163.4	-63.7	173.6	-173.4	169.4	0	108.1	P208 L230	P208-K210 PolarHBondContact O-N 3.34Å; K210-L230 PolarHBondContact N-O 3.19Å; K210-L230 PolarHBondContact O-N 3.48Å
211	T	98.1	Very high	94.4	Very high	34 Å²	34	73.7 Å²	73.7	21%	0.209	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	142.7	-171.4	59.2	0	0	0	0	113.2	P209 W228 A229 V285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.93Å; P209-T211 HydrophobicContact CG-CG2 4.12Å; P209-T211 PolarHBondContact O-N 3.14Å; T211-W228 WeakPolarHBondContact CA-O 3.42Å; T211-A229 HydrophobicContact CG2-CB 4.33Å; 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 4.36Å; T211-L296 VanDerWaalsContact CB-CD1 3.43Å; T211-L296 HydrophobicContact CG2-CD1 4.17Å; T211-L296 WeakPolarHBondContact OG1-CD1 3.38Å
212	H	97.3	Very high	94.7	Very high	83 Å²	83	71.4 Å²	71.4	38%	0.384	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	161.4	172	63	-76.8	0	0	0	110.6	W228	H212-W228 VanDerWaalsContact CE1-CB 3.42Å; H212-W228 WeakPolarHBondContact CE1-CB 3.29Å; H212-W228 AromaticContact CE1-CD1 3.97Å; H212-W228 AromaticContact CE1-CG 3.7Å; H212-W228 PolarHBondContact N-O 2.92Å; H212-W228 AromaticContact NE2-CD1 3.52Å; H212-W228 AromaticContact NE2-CG 3.71Å; H212-W228 PolarHBondContact O-N 2.94Å
213	V	98.1	Very high	94.9	Very high	23 Å²	23	69.3 Å²	69.3	14%	0.139	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.6	176.6	-179.5	0	0	0	0	109.2	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.34Å; V213-L225 HydrophobicContact CG1-CD2 4.36Å; V213-R226 CarbonylContact C-O 3.55Å; V213-R226 WeakPolarHBondContact CA-O 3.47Å; V213-C227 HydrophobicContact CG2-CB 4.44Å; V213-W241 HydrophobicContact CG1-CH2 3.88Å; V213-W241 HydrophobicContact CG1-CZ2 4.31Å; V213-W241 HydrophobicContact CG2-CH2 4.3Å; V213-L296 HydrophobicContact CG2-CB 3.91Å; V213-W298 HydrophobicContact CB-CB 4.5Å; V213-W298 HydrophobicContact CG1-CB 3.86Å
214	T	96.8	Very high	95.3	Very high	33 Å²	33	70.1 Å²	70.1	20%	0.202	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	148.9	172	63.7	0	0	0	0	110.7	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-NE2 3.14Å; T214-L225 WeakPolarHBondContact O-CA 3.48Å; T214-R226 PolarHBondContact N-O 3.19Å; T214-R226 PolarHBondContact O-N 3.23Å; T214-W228 PolarHBondContact OG1-NE1 3.31Å
215	H	96.3	Very high	95.7	Very high	54 Å²	54	65.6 Å²	65.6	25%	0.25	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.7	179	170.9	-94.4	0	0	0	109.6	A223 T224 L225 E278 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.45Å; H215-T224 WeakPolarHBondContact CA-O 3.18Å; H215-L225 HydrophobicContact CB-CD2 4.01Å; H215-E278 IonicContact NE2-OE1 2.8Å; H215-W298 HydrophobicContact CB-CD2 4.13Å; H215-W298 HydrophobicContact CB-CG 4.18Å; H215-W298 HydrophobicContact CB-CZ2 4.02Å; H215-W298 VanDerWaalsContact CB-NE1 3.28Å; H215-W298 AromaticContact CG-CE2 3.79Å; H215-W298 AromaticContact CG-CZ2 3.81Å; H215-W298 AromaticContact ND1-CZ2 3.96Å
216	H	95.3	Very high	96	Very high	78 Å²	78	62.3 Å²	62.3	36%	0.361	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	103.9	-178.5	-55.9	-70.2	0	0	0	109.5	T214 I218 A223 T224 R226	T214-H216 PolarHBondContact OG1-NE2 3.14Å; H216-I218 PolarHBondContact O-N 3.29Å; H216-A223 CarbonylContact O-C 3.46Å; H216-A223 WeakPolarHBondContact O-CA 3.39Å; H216-T224 PolarHBondContact N-O 2.74Å; H216-T224 PolarHBondContact O-N 2.85Å; H216-R226 PolarHBondContact CD2-NH1 3.06Å; H216-R226 VanDerWaalsContact CD2-NH1 3.3Å; H216-R226 PolarHBondContact NE2-NH1 3.1Å; H216-R226 VanDerWaalsContact NE2-NH1 3.15Å
217	P	94.6	Very high	96.2	Very high	98 Å²	98	60.9 Å²	60.9	64%	0.636	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58	132.7	174.3	-21.2	31.3	0	0	0	111.1
218	I	93	Very high	96.3	Very high	97 Å²	97	61.6 Å²	61.6	50%	0.497	32%	0.316	S	S	.	.			trans	-101.1	-45.9	173.3	-56.5	167.4	0	0	0	109.3	H216 E222 T224 V272	H216-I218 PolarHBondContact O-N 3.29Å; I218-E222 PolarHBondContact N-O 2.88Å; I218-T224 WeakPolarHBondContact CD1-OG1 3.35Å; I218-V272 HydrophobicContact CD1-CG1 4.01Å; I218-V272 HydrophobicContact CD1-CG2 4.12Å
219	S	93.2	Very high	96.4	Very high	53 Å²	53	58.4 Å²	58.4	37%	0.371	30%	0.296	S	S	.	.	S	Bend	trans	-147.7	-179.4	179	72.4	0	0	0	0	110.2	H221 E222	S219-H221 PolarHBondContact O-N 3.39Å; S219-H221 PolarHBondContact OG-N 3.12Å; S219-E222 PolarHBondContact N-O 2.88Å; S219-E222 VanDerWaalsContact N-O 3.08Å; S219-E222 VanDerWaalsContact O-O 3.09Å; S219-E222 PolarHBondContact OG-N 2.9Å
220	D	90.3	Very high	96.4	Very high	148 Å²	148	60.6 Å²	60.6	79%	0.791	31%	0.306	S	S	*	.	S	Bend	trans	-63	-19.4	173.3	-64.7	-20.7	0	0	0	112.6	S275	D220-S275 PolarHBondContact O-OG 2.81Å
221	H	93.5	Very high	96.4	Very high	145 Å²	145	54.1 Å²	54.1	67%	0.671	29%	0.285	S	S	*	.	S	Bend	trans	-104.4	-17.6	-174.5	-54.7	-49.5	0	0	0	113.9	S219 P274 S275	S219-H221 PolarHBondContact O-N 3.39Å; S219-H221 PolarHBondContact OG-N 3.12Å; H221-P274 CarbonylContact O-C 3.55Å; H221-P274 WeakPolarHBondContact O-CA 3.36Å; H221-S275 PolarHBondContact O-N 2.95Å; H221-S275 PolarHBondContact O-OG 3.31Å
222	E	95.5	Very high	96.4	Very high	90 Å²	90	52.5 Å²	52.5	42%	0.421	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	147.6	-170.5	-65.8	-179.4	164.9	0	0	112.8	I218 S219 V272 V273 S275	I218-E222 PolarHBondContact N-O 2.88Å; S219-E222 PolarHBondContact N-O 2.88Å; S219-E222 VanDerWaalsContact N-O 3.08Å; S219-E222 VanDerWaalsContact O-O 3.09Å; S219-E222 PolarHBondContact OG-N 2.9Å; E222-V272 HydrophobicContact CB-CG1 4.07Å; E222-V272 HydrophobicContact CG-CG1 4.31Å; E222-V273 VanDerWaalsContact CA-O 3.32Å; E222-V273 WeakPolarHBondContact CA-O 3.37Å; E222-S275 PolarHBondContact N-OG 3.2Å
223	A	96.3	Very high	96.3	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	155.9	172.3	0	0	0	0	0	111.3	H215 H216 V272 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.45Å; H216-A223 CarbonylContact O-C 3.46Å; H216-A223 WeakPolarHBondContact O-CA 3.39Å; A223-V272 WeakPolarHBondContact O-CA 3.46Å; A223-V273 HydrophobicContact CB-CG2 4.5Å; A223-V273 PolarHBondContact N-O 3.35Å; A223-V273 PolarHBondContact O-N 3.14Å
224	T	97.7	Very high	96.2	Very high	22 Å²	22	48.6 Å²	48.6	14%	0.135	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.7	167.6	-51.4	0	0	0	0	109.9	H215 H216 I218 A270 V271	H215-T224 WeakPolarHBondContact CA-O 3.18Å; H216-T224 PolarHBondContact N-O 2.74Å; H216-T224 PolarHBondContact O-N 2.85Å; I218-T224 WeakPolarHBondContact CD1-OG1 3.35Å; T224-A270 HydrophobicContact CG2-CB 3.85Å; T224-V271 WeakPolarHBondContact CA-O 3.16Å
225	L	98.1	Very high	96.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.8	161.2	-63.7	-176.6	0	0	0	109.1	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.34Å; V213-L225 HydrophobicContact CG1-CD2 4.36Å; T214-L225 WeakPolarHBondContact O-CA 3.48Å; H215-L225 HydrophobicContact CB-CD2 4.01Å; L225-W241 HydrophobicContact CB-CH2 3.68Å; L225-W241 HydrophobicContact CB-CZ2 3.8Å; L225-W241 HydrophobicContact CB-CZ3 4.48Å; L225-W241 HydrophobicContact CD1-CH2 4.04Å; L225-W241 HydrophobicContact CD1-CZ3 4.2Å; L225-A270 CarbonylContact O-C 3.5Å; L225-A270 WeakPolarHBondContact O-CA 3.46Å; L225-V271 HydrophobicContact CB-CG2 4.17Å; L225-V271 PolarHBondContact N-O 3.05Å; L225-V271 PolarHBondContact O-N 3.16Å; L225-V273 HydrophobicContact CD1-CG1 4.02Å; L225-V273 HydrophobicContact CD1-CG2 4.08Å; L225-V273 HydrophobicContact CG-CG1 4.17Å; L225-V273 HydrophobicContact CG-CG2 3.86Å; L225-E278 HydrophobicContact CD1-CB 4.11Å; L225-E278 HydrophobicContact CD2-CG 4.38Å; L225-W298 HydrophobicContact CD1-CB 4.41Å; L225-W298 HydrophobicContact CD2-CB 3.81Å; L225-W298 HydrophobicContact CD2-CD2 4.38Å; L225-W298 HydrophobicContact CD2-CG 3.95Å
226	R	98.3	Very high	96.3	Very high	52 Å²	52	50.6 Å²	50.6	20%	0.196	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	117.6	176.5	-176.3	178.9	-65.6	113.2	0.6	110.3	V213 T214 H216 W228 W268 A270	V213-R226 CarbonylContact C-O 3.55Å; V213-R226 WeakPolarHBondContact CA-O 3.47Å; T214-R226 PolarHBondContact N-O 3.19Å; T214-R226 PolarHBondContact O-N 3.23Å; H216-R226 PolarHBondContact CD2-NH1 3.06Å; H216-R226 VanDerWaalsContact CD2-NH1 3.3Å; H216-R226 PolarHBondContact NE2-NH1 3.1Å; H216-R226 VanDerWaalsContact NE2-NH1 3.15Å; R226-W228 VanDerWaalsContact CD-CE2 3.4Å; R226-W228 VanDerWaalsContact CD-CZ2 3.41Å; R226-W228 HydrophobicContact CG-CZ2 4.44Å; R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.13Å; R226-W268 HydrophobicContact CG-CE3 3.9Å; R226-W268 HydrophobicContact CG-CG 4.22Å; R226-A270 HydrophobicContact CB-CB 4.1Å; R226-A270 HydrophobicContact CG-CB 4.17Å
227	C	98.3	Very high	96.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.7	174.8	-173	0	0	0	0	109.5	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.44Å; C227-W241 HydrophobicContact CB-CH2 4.5Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; C227-W268 CarbonylContact O-C 3.59Å; C227-W268 WeakPolarHBondContact O-CA 3.39Å; C227-W268 VanDerWaalsContact O-CB 3.23Å; C227-W268 WeakPolarHBondContact O-CB 3.2Å; C227-A269 PolarHBondContact N-O 2.85Å; C227-A269 PolarHBondContact O-N 3.46Å; C227-C283 HydrophobicContact CB-CB 3.52Å; C227-C283 WeakPolarHBondContact CB-SG 3.46Å; C227-C283 WeakPolarHBondContact SG-CB 3.5Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 2.8Å
228	W	98.5	Very high	96.5	Very high	48 Å²	48	45 Å²	45	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141.7	179.5	-70.4	89	0	0	0	110.7	T211 H212 T214 R226 L230 W268	T211-W228 WeakPolarHBondContact CA-O 3.42Å; H212-W228 VanDerWaalsContact CE1-CB 3.42Å; H212-W228 WeakPolarHBondContact CE1-CB 3.29Å; H212-W228 AromaticContact CE1-CD1 3.97Å; H212-W228 AromaticContact CE1-CG 3.7Å; H212-W228 PolarHBondContact N-O 2.92Å; H212-W228 AromaticContact NE2-CD1 3.52Å; H212-W228 AromaticContact NE2-CG 3.71Å; H212-W228 PolarHBondContact O-N 2.94Å; T214-W228 PolarHBondContact OG1-NE1 3.31Å; R226-W228 VanDerWaalsContact CD-CE2 3.4Å; R226-W228 VanDerWaalsContact CD-CZ2 3.41Å; R226-W228 HydrophobicContact CG-CZ2 4.44Å; W228-L230 HydrophobicContact CE3-CD2 3.84Å; W228-L230 HydrophobicContact CZ3-CD2 4.38Å; W228-W268 HydrophobicContact CD2-CB 3.95Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.89Å; W228-W268 AromaticContact CE3-CD1 3.89Å; W228-W268 HydrophobicContact CE3-CG 4.2Å; W228-W268 HydrophobicContact CG-CB 4.37Å; W228-W268 AromaticContact CH2-CD1 3.61Å; W228-W268 HydrophobicContact CH2-CG 4.27Å; W228-W268 HydrophobicContact CZ3-CB 4.31Å; W228-W268 AromaticContact CZ3-CD1 3.42Å; W228-W268 VanDerWaalsContact CZ3-CD1 3.42Å; W228-W268 HydrophobicContact CZ3-CG 4.12Å
229	A	98.6	Very high	96.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.7	162.1	0	0	0	0	0	107.9	P209 T211 F232 I237 L239 Q266 K267	P209-A229 HydrophobicContact CB-CB 3.88Å; T211-A229 HydrophobicContact CG2-CB 4.33Å; A229-F232 HydrophobicContact CB-CD1 4.06Å; A229-F232 HydrophobicContact CB-CE1 3.81Å; A229-F232 WeakPolarHBondContact O-CE1 3.25Å; A229-I237 HydrophobicContact CB-CD1 3.68Å; A229-L239 HydrophobicContact CB-CD1 4.02Å; A229-L239 HydrophobicContact CB-CD2 4.13Å; A229-Q266 VanDerWaalsContact O-CA 3.29Å; A229-Q266 WeakPolarHBondContact O-CA 3.42Å; A229-K267 PolarHBondContact N-O 2.86Å; A229-K267 PolarHBondContact O-N 3.19Å; A229-K267 VanDerWaalsContact O-O 3.09Å
230	L	98.4	Very high	96.9	Very high	55 Å²	55	40.1 Å²	40.1	29%	0.288	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	148.6	-174.8	-58.5	177.2	0	0	0	110.9	K210 W228 F232 Q266	K210-L230 PolarHBondContact N-O 3.19Å; K210-L230 PolarHBondContact O-N 3.48Å; W228-L230 HydrophobicContact CE3-CD2 3.84Å; W228-L230 HydrophobicContact CZ3-CD2 4.38Å; L230-F232 VanDerWaalsContact C-N 3.34Å; L230-F232 PolarHBondContact O-N 2.81Å; L230-Q266 HydrophobicContact CD2-CB 3.54Å
231	G	97.8	Very high	97.3	Very high	23 Å²	23	33.2 Å²	33.2	24%	0.237	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.7	28.3	167.2	0	0	0	0	0	114.1	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.22Å; G231-F265 PolarHBondContact N-O 3.36Å
232	F	97.9	Very high	97.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	155	-179.4	59.3	-89	0	0	0	112.9	D207 P209 A229 L230 P234 I237 T257 T264 F265 K267 H287	D207-F232 CarbonylContact O-C 3.52Å; D207-F232 WeakPolarHBondContact O-CA 3.34Å; D207-F232 WeakPolarHBondContact O-CB 3.47Å; P209-F232 HydrophobicContact CB-CB 3.84Å; P209-F232 HydrophobicContact CB-CD1 3.9Å; P209-F232 HydrophobicContact CB-CG 4.14Å; A229-F232 HydrophobicContact CB-CD1 4.06Å; A229-F232 HydrophobicContact CB-CE1 3.81Å; A229-F232 WeakPolarHBondContact O-CE1 3.25Å; L230-F232 VanDerWaalsContact C-N 3.34Å; L230-F232 PolarHBondContact O-N 2.81Å; F232-P234 WeakPolarHBondContact CD2-O 3.49Å; F232-I237 HydrophobicContact CD1-CD1 3.87Å; F232-I237 HydrophobicContact CD2-CB 4.27Å; F232-I237 HydrophobicContact CD2-CD1 3.94Å; F232-I237 HydrophobicContact CE1-CD1 3.77Å; F232-I237 HydrophobicContact CE1-CG2 4.49Å; F232-I237 HydrophobicContact CE2-CB 3.74Å; F232-I237 HydrophobicContact CE2-CD1 3.87Å; F232-I237 HydrophobicContact CE2-CG1 4.38Å; F232-I237 HydrophobicContact CE2-CG2 3.59Å; F232-I237 HydrophobicContact CG-CD1 3.96Å; F232-I237 HydrophobicContact CZ-CB 4.14Å; F232-I237 HydrophobicContact CZ-CD1 3.8Å; F232-I237 HydrophobicContact CZ-CG2 3.57Å; F232-T257 HydrophobicContact CE2-CG2 4.1Å; F232-T257 HydrophobicContact CZ-CG2 3.92Å; F232-T264 CarbonylContact O-C 3.56Å; F232-T264 WeakPolarHBondContact O-CA 3.11Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.21Å; F232-F265 HydrophobicContact CD2-CB 3.98Å; F232-F265 HydrophobicContact CE1-CB 4.29Å; F232-F265 WeakPolarHBondContact CE1-O 3.37Å; F232-F265 HydrophobicContact CE2-CB 3.5Å; F232-F265 HydrophobicContact CZ-CB 3.66Å; F232-F265 PolarHBondContact N-O 3.25Å; F232-F265 PolarHBondContact O-N 3.43Å; F232-K267 HydrophobicContact CE1-CB 4.4Å; F232-K267 HydrophobicContact CZ-CB 4.12Å; F232-H287 AromaticContact CD2-CD2 3.85Å; F232-H287 AromaticContact CD2-NE2 3.73Å
233	Y	96.8	Very high	97.6	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.016	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-150	136.5	172.4	178.2	-84.1	0	0	0	109.1	D54 T55 R205 A206 D207 R263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 3.92Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.45Å; T55-Y233 PolarHBondContact OG1-OH 3.24Å; R205-Y233 WeakPolarHBondContact O-CD1 3.41Å; A206-Y233 CarbonylContact C-O 3.54Å; A206-Y233 VanDerWaalsContact CA-O 3.26Å; A206-Y233 WeakPolarHBondContact CA-O 3.26Å; D207-Y233 PolarHBondContact N-O 3.35Å; D207-Y233 PolarHBondContact O-N 2.96Å; Y233-R263 HydrophobicContact CD2-CG 3.83Å; Y233-R263 HydrophobicContact CE2-CG 4.06Å; Y233-F265 HydrophobicContact CD2-CE2 4.12Å; Y233-H287 PolarHBondContact O-CE1 2.98Å
234	P	96.1	Very high	97.6	Very high	19 Å²	19	32.1 Å²	32.1	12%	0.123	17%	0.166	C	C	.	.	S	Bend	cis	-71.5	178.8	1.8	30	-36.2	0	0	0	113.3	D54 F232 E236 H287	D54-P234 VanDerWaalsContact OD2-CB 3.23Å; D54-P234 WeakPolarHBondContact OD2-CB 3.31Å; F232-P234 WeakPolarHBondContact CD2-O 3.49Å; P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 3.03Å; P234-H287 PolarHBondContact O-NE2 3.47Å
235	A	97.1	Very high	97.3	Very high	15 Å²	15	33.4 Å²	33.4	12%	0.124	18%	0.183	C	C	.	.	S	Bend	trans	-69.9	-26.7	-175.8	0	0	0	0	0	113.6	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.32Å; D54-A235 WeakPolarHBondContact OD2-CB 3.39Å; D54-A235 PolarHBondContact OD2-N 2.92Å; A235-I237 PolarHBondContact O-N 3.41Å; A235-T257 HydrophobicContact CB-CG2 4.33Å; A235-T257 WeakPolarHBondContact O-CG2 3.37Å; A235-F265 HydrophobicContact CB-CD1 3.71Å; A235-F265 HydrophobicContact CB-CD2 3.68Å; A235-F265 HydrophobicContact CB-CE1 3.66Å; A235-F265 HydrophobicContact CB-CE2 3.64Å; A235-F265 HydrophobicContact CB-CG 3.73Å; A235-F265 HydrophobicContact CB-CZ 3.65Å
236	E	96.5	Very high	97.1	Very high	115 Å²	115	40.3 Å²	40.3	54%	0.537	22%	0.215	S	C	.	.			trans	-64.5	120.8	179.5	-169.4	64	-151.6	0	0	109.7	W23 P234 H287	W23-E236 HydrophobicContact CH2-CB 3.98Å; W23-E236 HydrophobicContact CH2-CG 3.28Å; W23-E236 HydrophobicContact CZ2-CB 4.35Å; W23-E236 HydrophobicContact CZ2-CG 3.26Å; W23-E236 HydrophobicContact CZ3-CB 4.15Å; W23-E236 HydrophobicContact CZ3-CG 3.9Å; W23-E236 VanDerWaalsContact CZ3-O 3.27Å; W23-E236 WeakPolarHBondContact CZ3-O 3.28Å; P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 3.03Å; E236-H287 PolarHBondContact O-CD2 2.83Å
237	I	97.2	Very high	97	Very high	10 Å²	10	42.4 Å²	42.4	5%	0.051	23%	0.231	C	C	.	.			trans	-155.9	143.4	-176.9	-164.4	171.5	0	0	0	109.6	P209 A229 F232 A235 L239 K267 V285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.05Å; P209-I237 HydrophobicContact CG-CD1 4.12Å; A229-I237 HydrophobicContact CB-CD1 3.68Å; F232-I237 HydrophobicContact CD1-CD1 3.87Å; F232-I237 HydrophobicContact CD2-CB 4.27Å; F232-I237 HydrophobicContact CD2-CD1 3.94Å; F232-I237 HydrophobicContact CE1-CD1 3.77Å; F232-I237 HydrophobicContact CE1-CG2 4.49Å; F232-I237 HydrophobicContact CE2-CB 3.74Å; F232-I237 HydrophobicContact CE2-CD1 3.87Å; F232-I237 HydrophobicContact CE2-CG1 4.38Å; F232-I237 HydrophobicContact CE2-CG2 3.59Å; F232-I237 HydrophobicContact CG-CD1 3.96Å; F232-I237 HydrophobicContact CZ-CB 4.14Å; F232-I237 HydrophobicContact CZ-CD1 3.8Å; F232-I237 HydrophobicContact CZ-CG2 3.57Å; A235-I237 PolarHBondContact O-N 3.41Å; I237-L239 HydrophobicContact CB-CD1 4.46Å; I237-L239 HydrophobicContact CD1-CD1 3.62Å; I237-L239 HydrophobicContact CG1-CD1 3.63Å; I237-L239 HydrophobicContact CG2-CD1 4.09Å; I237-K267 HydrophobicContact CG2-CB 4.28Å; I237-K267 HydrophobicContact CG2-CD 3.6Å; I237-V285 HydrophobicContact CD1-CG1 4.04Å; I237-V285 HydrophobicContact CG1-CG1 4.37Å; I237-Q286 VanDerWaalsContact CG1-O 3.29Å; I237-Q286 WeakPolarHBondContact CG1-O 3.36Å; I237-H287 HydrophobicContact CD1-CB 4.37Å; I237-H287 HydrophobicContact CG1-CB 4.11Å
238	T	97.5	Very high	96.8	Very high	49 Å²	49	43.7 Å²	43.7	30%	0.301	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.2	174	-61.1	0	0	0	0	110.5	T240 V285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.03Å; T238-V285 WeakPolarHBondContact O-CA 3.3Å; T238-Q286 PolarHBondContact N-O 3.31Å; T238-Q286 PolarHBondContact O-N 3.28Å
239	L	97.8	Very high	96.3	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	122.4	172.8	-86.4	63.4	0	0	0	108.7	A229 I237 L254 K267 A269 H284 V285	A229-L239 HydrophobicContact CB-CD1 4.02Å; A229-L239 HydrophobicContact CB-CD2 4.13Å; I237-L239 HydrophobicContact CB-CD1 4.46Å; I237-L239 HydrophobicContact CD1-CD1 3.62Å; I237-L239 HydrophobicContact CG1-CD1 3.63Å; I237-L239 HydrophobicContact CG2-CD1 4.09Å; L239-L254 HydrophobicContact CB-CD1 4.17Å; L239-K267 HydrophobicContact CD1-CD 4.28Å; L239-K267 HydrophobicContact CD2-CB 4.35Å; L239-K267 HydrophobicContact CD2-CG 4.41Å; L239-A269 HydrophobicContact CB-CB 4.07Å; L239-A269 HydrophobicContact CD2-CB 4.34Å; L239-H284 WeakPolarHBondContact CA-O 3.47Å; L239-V285 HydrophobicContact CD1-CG1 4.1Å; L239-V285 HydrophobicContact CG-CG2 4.35Å
240	T	97.6	Very high	95.8	Very high	41 Å²	41	55.6 Å²	55.6	25%	0.252	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	149	176	58.7	0	0	0	0	111.6	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.03Å; T240-C283 CarbonylContact O-C 3.58Å; T240-C283 WeakPolarHBondContact O-CA 3.25Å; T240-H284 PolarHBondContact N-O 3Å; T240-H284 PolarHBondContact O-N 2.82Å
241	W	98.1	Very high	95.3	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.9	169.5	-82.5	103.7	0	0	0	110.2	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.88Å; V213-W241 HydrophobicContact CG1-CZ2 4.31Å; V213-W241 HydrophobicContact CG2-CH2 4.3Å; L225-W241 HydrophobicContact CB-CH2 3.68Å; L225-W241 HydrophobicContact CB-CZ2 3.8Å; L225-W241 HydrophobicContact CB-CZ3 4.48Å; L225-W241 HydrophobicContact CD1-CH2 4.04Å; L225-W241 HydrophobicContact CD1-CZ3 4.2Å; C227-W241 HydrophobicContact CB-CH2 4.5Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; W241-Q248 HydrophobicContact CB-CB 4.27Å; W241-Q248 PolarHBondContact O-N 3.04Å; W241-A269 PolarHBondContact NE1-O 3.39Å; W241-V271 HydrophobicContact CB-CG1 3.68Å; W241-V271 HydrophobicContact CB-CG2 4.45Å; W241-V271 HydrophobicContact CD2-CG1 4.32Å; W241-V271 HydrophobicContact CD2-CG2 3.63Å; W241-V271 HydrophobicContact CE3-CG2 4.01Å; W241-V271 HydrophobicContact CG-CB 4.38Å; W241-V271 HydrophobicContact CG-CG1 3.61Å; W241-V271 HydrophobicContact CG-CG2 3.84Å; W241-V271 HydrophobicContact CZ2-CG2 4.28Å; W241-V271 HydrophobicContact CZ3-CG2 4.5Å; W241-T282 WeakPolarHBondContact CA-O 3.1Å; W241-T282 VanDerWaalsContact CE3-C 3.41Å; W241-C283 HydrophobicContact CD2-CB 4.14Å; W241-C283 HydrophobicContact CE3-CB 4.09Å; W241-C283 HydrophobicContact CH2-CB 3.98Å; W241-C283 HydrophobicContact CZ2-CB 4.04Å; W241-C283 HydrophobicContact CZ3-CB 4.01Å
242	Q	97.9	Very high	95.2	Very high	41 Å²	41	58.5 Å²	58.5	19%	0.192	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.9	171.6	-69.2	-173.6	-8.3	0	0	110.3	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.53Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.46Å; Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.43Å; Q242-D247 PolarHBondContact NE2-OD1 2.98Å; Q242-Y281 CarbonylContact O-C 3.56Å; Q242-Y281 VanDerWaalsContact O-CA 3.26Å; Q242-Y281 WeakPolarHBondContact O-CA 3.04Å; Q242-T282 PolarHBondContact N-O 3.27Å; Q242-T282 PolarHBondContact O-N 3.49Å; Q242-H284 PolarHBondContact OE1-NE2 2.66Å
243	R	97.3	Very high	95.1	Very high	70 Å²	70	64 Å²	64	26%	0.264	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.7	168.7	-177.1	-172.8	-175.7	-179.7	-1.1	108	G245 E246 Q248 E277 R280 Y281	R243-G245 PolarHBondContact O-N 2.9Å; R243-E246 PolarHBondContact N-O 3.03Å; R243-E246 PolarHBondContact O-N 2.96Å; R243-Q248 HydrophobicContact CB-CG 4Å; R243-E277 IonicContact CZ-OE2 3.81Å; R243-E277 IonicContact NE-OE2 3.61Å; R243-E277 IonicContact NH2-OE1 2.7Å; R243-E277 IonicContact NH2-OE2 3.47Å; R243-E277 PolarHBondContact NH2-OE2 2.88Å; R243-R280 WeakPolarHBondContact CA-O 3.46Å; R243-R280 HydrophobicContact CG-CB 4.41Å; R243-Y281 HydrophobicContact CB-CD1 4.12Å; R243-Y281 HydrophobicContact CB-CE1 3.91Å; R243-Y281 WeakPolarHBondContact CD-OH 3.24Å; R243-Y281 HydrophobicContact CG-CD2 4.45Å; R243-Y281 HydrophobicContact CG-CE1 4.14Å; R243-Y281 HydrophobicContact CG-CE2 4.05Å
244	D	95.3	Very high	95.1	Very high	103 Å²	103	68 Å²	68	55%	0.551	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	28.5	-175.1	-54	-49.4	0	0	0	114.3	R280	D244-R280 PolarHBondContact N-O 2.81Å; D244-R280 IonicContact OD1-NE 3.7Å; D244-R280 PolarHBondContact OD1-NE 3.28Å; D244-R280 IonicContact OD2-CZ 3.59Å; D244-R280 IonicContact OD2-NE 2.9Å; D244-R280 PolarHBondContact OD2-NE 3.02Å; D244-R280 IonicContact OD2-NH2 3.7Å; D244-R280 PolarHBondContact OD2-NH2 3.08Å
245	G	91.4	Very high	95.1	Very high	48 Å²	48	68.6 Å²	68.6	50%	0.495	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	-0.8	-177.6	0	0	0	0	0	115.6	R243	R243-G245 PolarHBondContact O-N 2.9Å
246	E	95.3	Very high	95.1	Very high	145 Å²	145	76.1 Å²	76.1	68%	0.678	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	128	175.8	-62.9	-171.9	168.3	0	0	111.8	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.53Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.46Å; R243-E246 PolarHBondContact N-O 3.03Å; R243-E246 PolarHBondContact O-N 2.96Å; E246-Q248 PolarHBondContact O-NE2 3.34Å
247	D	95	Very high	95.2	Very high	97 Å²	97	72.8 Å²	72.8	52%	0.519	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	134.8	-178.9	-69.1	-28.5	0	0	0	112.3	Q242	Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.43Å; Q242-D247 PolarHBondContact NE2-OD1 2.98Å
248	Q	94.3	Very high	95.2	Very high	26 Å²	26	77 Å²	77	12%	0.121	40%	0.399	C	S	.	.			trans	-104.9	34.3	-177	-58.4	-60.9	-69.1	0	0	112.5	W241 R243 E246 Q250 D251 T252 V271 Y281	W241-Q248 HydrophobicContact CB-CB 4.27Å; W241-Q248 PolarHBondContact O-N 3.04Å; R243-Q248 HydrophobicContact CB-CG 4Å; E246-Q248 PolarHBondContact O-NE2 3.34Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 2.84Å; Q248-D251 PolarHBondContact O-N 3.02Å; Q248-D251 VanDerWaalsContact O-N 3.14Å; Q248-T252 WeakPolarHBondContact O-CB 3.43Å; Q248-T252 PolarHBondContact O-N 3.16Å; Q248-T252 PolarHBondContact O-OG1 2.81Å; Q248-V271 HydrophobicContact CB-CG1 4.41Å; Q248-Y281 HydrophobicContact CG-CE1 4.35Å
249	T	88.7	Confident	95.2	Very high	105 Å²	105	79.2 Å²	79.2	64%	0.644	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-36.6	-168.2	-48.9	0	0	0	0	114.3
250	Q	88.4	Confident	95.1	Very high	193 Å²	193	81.4 Å²	81.4	90%	0.902	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-31.7	-178.7	-66.5	-174.2	1.5	0	0	113.1	Q248 T252	Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 2.84Å; Q250-T252 VanDerWaalsContact C-N 3.35Å
251	D	87.4	Confident	94.9	Very high	117 Å²	117	83.1 Å²	83.1	63%	0.626	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	1.5	-178.1	-56.7	-52.7	0	0	0	112.3	Q248	Q248-D251 PolarHBondContact O-N 3.02Å; Q248-D251 VanDerWaalsContact O-N 3.14Å
252	T	94.8	Very high	94.6	Very high	23 Å²	23	88.1 Å²	88.1	14%	0.141	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.3	179.3	-61.7	0	0	0	0	110.7	Q248 Q250 L254 A269 A270 V271	Q248-T252 WeakPolarHBondContact O-CB 3.43Å; Q248-T252 PolarHBondContact O-N 3.16Å; Q248-T252 PolarHBondContact O-OG1 2.81Å; Q250-T252 VanDerWaalsContact C-N 3.35Å; T252-L254 HydrophobicContact CG2-CB 4.45Å; T252-L254 PolarHBondContact O-N 2.93Å; T252-A269 HydrophobicContact CG2-CB 3.93Å; T252-A270 CarbonylContact C-O 3.58Å; T252-A270 WeakPolarHBondContact CA-O 3.44Å; T252-V271 HydrophobicContact CG2-CG1 4.35Å; T252-V271 VanDerWaalsContact OG1-CG1 3.27Å; T252-V271 WeakPolarHBondContact OG1-CG1 3.39Å
253	E	96.8	Very high	94.4	Very high	114 Å²	114	89 Å²	89	53%	0.533	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	108.2	163.6	-173.7	-174.3	-171.8	0	0	109	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.24Å; E253-W268 HydrophobicContact CG-CH2 3.91Å; E253-W268 HydrophobicContact CG-CZ3 3.85Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.46Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.47Å; E253-A269 CarbonylContact O-C 3.55Å; E253-A269 WeakPolarHBondContact O-CA 3.2Å; E253-A270 HydrophobicContact CB-CB 4.42Å; E253-A270 PolarHBondContact N-O 3.09Å; E253-A270 PolarHBondContact O-N 3.5Å
254	L	96.8	Very high	94.3	Very high	89 Å²	89	86.5 Å²	86.5	47%	0.466	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.6	178.8	-173.9	68.9	0	0	0	110.1	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.17Å; T252-L254 HydrophobicContact CG2-CB 4.45Å; T252-L254 PolarHBondContact O-N 2.93Å; L254-K267 HydrophobicContact CD1-CD 4.46Å; L254-A269 HydrophobicContact CD1-CB 3.62Å
255	V	96.8	Very high	94.5	Very high	31 Å²	31	82.9 Å²	82.9	19%	0.188	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-83.8	154	175.6	-64.7	0	0	0	0	112.4	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.43Å; V255-K267 WeakPolarHBondContact O-CE 3.27Å; V255-K267 WeakPolarHBondContact O-CG 3.23Å; V255-K267 PolarHBondContact O-NZ 2.86Å; V255-W268 HydrophobicContact CB-CD2 4.49Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.27Å; V255-W268 HydrophobicContact CG1-CH2 3.57Å; V255-W268 HydrophobicContact CG1-CZ2 3.16Å; V255-W268 HydrophobicContact CG1-CZ3 4.08Å; V255-W268 HydrophobicContact CG2-CD2 3.76Å; V255-W268 HydrophobicContact CG2-CE3 4.49Å; V255-W268 HydrophobicContact CG2-CG 3.73Å; V255-W268 HydrophobicContact CG2-CZ2 4.41Å; V255-W268 WeakPolarHBondContact CG2-O 3.35Å; V255-W268 PolarHBondContact N-O 3.41Å
256	E	96.9	Very high	94.8	Very high	173 Å²	173	82.6 Å²	82.6	81%	0.808	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-57.6	147.1	167.5	-68.2	-173.7	170.1	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 3.17Å
257	T	98	Very high	95	Very high	46 Å²	46	76.7 Å²	76.7	28%	0.282	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-67.9	129.2	174.5	-55.9	0	0	0	0	108.6	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.1Å; F232-T257 HydrophobicContact CZ-CG2 3.92Å; A235-T257 HydrophobicContact CB-CG2 4.33Å; A235-T257 WeakPolarHBondContact O-CG2 3.37Å; T257-F265 HydrophobicContact CG2-CB 3.78Å; T257-F265 HydrophobicContact CG2-CD1 3.91Å; T257-F265 HydrophobicContact CG2-CG 4.12Å; T257-K267 WeakPolarHBondContact OG1-CD 3.1Å; T257-K267 PolarHBondContact OG1-NZ 3.03Å; T257-K267 VanDerWaalsContact OG1-NZ 3.15Å
258	R	97.5	Very high	95.1	Very high	99 Å²	99	73.3 Å²	73.3	37%	0.374	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.9	-174.4	69	-168.8	-178.8	-173.9	3.2	111.5	E256 F265 Q266	E256-R258 PolarHBondContact O-N 3.17Å; R258-F265 WeakPolarHBondContact O-CA 3.43Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 2.79Å; R258-Q266 WeakPolarHBondContact O-CG 3.46Å; R258-Q266 PolarHBondContact O-N 2.85Å
259	P	97.4	Very high	95.3	Very high	95 Å²	95	72 Å²	72	62%	0.617	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.3	145.2	178.7	29	-34.7	0	0	0	111.2	F265	P259-F265 HydrophobicContact CB-CD1 4.46Å; P259-F265 HydrophobicContact CB-CE1 4.24Å
260	A	96.4	Very high	95.8	Very high	51 Å²	51	67.1 Å²	67.1	42%	0.421	36%	0.361	S	S	.	.			trans	-89.1	-16.1	172.3	0	0	0	0	0	112.9	D262 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.49Å; A260-T264 WeakPolarHBondContact CB-O 3.18Å; A260-T264 WeakPolarHBondContact CB-OG1 3.38Å; A260-T264 PolarHBondContact N-O 2.85Å
261	G	92.9	Very high	96.2	Very high	78 Å²	78	58.1 Å²	58.1	80%	0.804	32%	0.319	S	S	*	.	S	Bend	trans	95.9	-5.1	179.4	0	0	0	0	0	114.6
262	D	92.3	Very high	96.7	Very high	107 Å²	107	56.2 Å²	56.2	57%	0.572	31%	0.311	S	S	*	.	S	Bend	trans	-116.6	34	-179.5	64.8	-5.7	0	0	0	111.8	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.49Å; D262-T264 PolarHBondContact O-N 3.01Å; D262-T264 WeakPolarHBondContact OD1-CB 3.46Å; D262-T264 PolarHBondContact OD1-N 3.22Å; D262-T264 VanDerWaalsContact OD1-N 3.14Å; D262-T264 PolarHBondContact OD1-OG1 3.19Å
263	R	91.7	Very high	96.8	Very high	60 Å²	60	55.1 Å²	55.1	23%	0.226	31%	0.305	C	S	.	.	S	Bend	trans	72.6	-22.6	-169.1	177.3	-173.9	167.2	-149.2	-11.2	114.9	T202 R205 Y233 F265	T202-R263 VanDerWaalsContact C-NH2 3.35Å; T202-R263 VanDerWaalsContact CA-NH1 3.31Å; T202-R263 VanDerWaalsContact CB-NH1 3.3Å; T202-R263 VanDerWaalsContact O-CZ 3.28Å; T202-R263 PolarHBondContact O-NH1 3.5Å; T202-R263 PolarHBondContact O-NH2 3.05Å; R205-R263 PolarHBondContact O-NH2 2.8Å; Y233-R263 HydrophobicContact CD2-CG 3.83Å; Y233-R263 HydrophobicContact CE2-CG 4.06Å; R263-F265 WeakPolarHBondContact O-CE2 3.46Å
264	T	96.9	Very high	96.8	Very high	16 Å²	16	51.9 Å²	51.9	10%	0.098	29%	0.293	C	S	.	.			trans	-84.3	168.5	-177.9	75.6	0	0	0	0	113.1	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.22Å; F232-T264 CarbonylContact O-C 3.56Å; F232-T264 WeakPolarHBondContact O-CA 3.11Å; A260-T264 WeakPolarHBondContact CB-O 3.18Å; A260-T264 WeakPolarHBondContact CB-OG1 3.38Å; A260-T264 PolarHBondContact N-O 2.85Å; D262-T264 PolarHBondContact O-N 3.01Å; D262-T264 WeakPolarHBondContact OD1-CB 3.46Å; D262-T264 PolarHBondContact OD1-N 3.22Å; D262-T264 VanDerWaalsContact OD1-N 3.14Å; D262-T264 PolarHBondContact OD1-OG1 3.19Å
265	F	98.4	Very high	96.6	Very high	27 Å²	27	50.3 Å²	50.3	12%	0.118	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	163.6	179.9	-64.9	-88.9	0	0	0	111.9	D54 G231 F232 Y233 A235 T257 R258 P259 R263	D54-F265 HydrophobicContact CB-CE2 3.76Å; D54-F265 HydrophobicContact CB-CZ 3.75Å; G231-F265 PolarHBondContact N-O 3.36Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.21Å; F232-F265 HydrophobicContact CD2-CB 3.98Å; F232-F265 HydrophobicContact CE1-CB 4.29Å; F232-F265 WeakPolarHBondContact CE1-O 3.37Å; F232-F265 HydrophobicContact CE2-CB 3.5Å; F232-F265 HydrophobicContact CZ-CB 3.66Å; F232-F265 PolarHBondContact N-O 3.25Å; F232-F265 PolarHBondContact O-N 3.43Å; Y233-F265 HydrophobicContact CD2-CE2 4.12Å; A235-F265 HydrophobicContact CB-CD1 3.71Å; A235-F265 HydrophobicContact CB-CD2 3.68Å; A235-F265 HydrophobicContact CB-CE1 3.66Å; A235-F265 HydrophobicContact CB-CE2 3.64Å; A235-F265 HydrophobicContact CB-CG 3.73Å; A235-F265 HydrophobicContact CB-CZ 3.65Å; T257-F265 HydrophobicContact CG2-CB 3.78Å; T257-F265 HydrophobicContact CG2-CD1 3.91Å; T257-F265 HydrophobicContact CG2-CG 4.12Å; R258-F265 WeakPolarHBondContact O-CA 3.43Å; P259-F265 HydrophobicContact CB-CD1 4.46Å; P259-F265 HydrophobicContact CB-CE1 4.24Å; R263-F265 WeakPolarHBondContact O-CE2 3.46Å
266	Q	98.3	Very high	96.4	Very high	43 Å²	43	52 Å²	52	20%	0.201	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	145.5	174.2	42.8	167	-18.9	0	0	110	A229 L230 R258	A229-Q266 VanDerWaalsContact O-CA 3.29Å; A229-Q266 WeakPolarHBondContact O-CA 3.42Å; L230-Q266 HydrophobicContact CD2-CB 3.54Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 2.79Å; R258-Q266 WeakPolarHBondContact O-CG 3.46Å; R258-Q266 PolarHBondContact O-N 2.85Å
267	K	98.6	Very high	96.3	Very high	21 Å²	21	46.3 Å²	46.3	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	153.8	176.9	-162.6	-176	-171.4	69.2	0	108.8	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 2.86Å; A229-K267 PolarHBondContact O-N 3.19Å; A229-K267 VanDerWaalsContact O-O 3.09Å; F232-K267 HydrophobicContact CE1-CB 4.4Å; F232-K267 HydrophobicContact CZ-CB 4.12Å; I237-K267 HydrophobicContact CG2-CB 4.28Å; I237-K267 HydrophobicContact CG2-CD 3.6Å; L239-K267 HydrophobicContact CD1-CD 4.28Å; L239-K267 HydrophobicContact CD2-CB 4.35Å; L239-K267 HydrophobicContact CD2-CG 4.41Å; L254-K267 HydrophobicContact CD1-CD 4.46Å; V255-K267 HydrophobicContact CG2-CG 4.43Å; V255-K267 WeakPolarHBondContact O-CE 3.27Å; V255-K267 WeakPolarHBondContact O-CG 3.23Å; V255-K267 PolarHBondContact O-NZ 2.86Å; T257-K267 WeakPolarHBondContact OG1-CD 3.1Å; T257-K267 PolarHBondContact OG1-NZ 3.03Å; T257-K267 VanDerWaalsContact OG1-NZ 3.15Å
268	W	98.4	Very high	96.2	Very high	25 Å²	25	45 Å²	45	10%	0.095	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.3	169.5	59.4	-99	0	0	0	111.6	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.13Å; R226-W268 HydrophobicContact CG-CE3 3.9Å; R226-W268 HydrophobicContact CG-CG 4.22Å; C227-W268 CarbonylContact O-C 3.59Å; C227-W268 WeakPolarHBondContact O-CA 3.39Å; C227-W268 VanDerWaalsContact O-CB 3.23Å; C227-W268 WeakPolarHBondContact O-CB 3.2Å; W228-W268 HydrophobicContact CD2-CB 3.95Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.89Å; W228-W268 AromaticContact CE3-CD1 3.89Å; W228-W268 HydrophobicContact CE3-CG 4.2Å; W228-W268 HydrophobicContact CG-CB 4.37Å; W228-W268 AromaticContact CH2-CD1 3.61Å; W228-W268 HydrophobicContact CH2-CG 4.27Å; W228-W268 HydrophobicContact CZ3-CB 4.31Å; W228-W268 AromaticContact CZ3-CD1 3.42Å; W228-W268 VanDerWaalsContact CZ3-CD1 3.42Å; W228-W268 HydrophobicContact CZ3-CG 4.12Å; E253-W268 HydrophobicContact CB-CZ3 4.24Å; E253-W268 HydrophobicContact CG-CH2 3.91Å; E253-W268 HydrophobicContact CG-CZ3 3.85Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.46Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.47Å; V255-W268 HydrophobicContact CB-CD2 4.49Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.27Å; V255-W268 HydrophobicContact CG1-CH2 3.57Å; V255-W268 HydrophobicContact CG1-CZ2 3.16Å; V255-W268 HydrophobicContact CG1-CZ3 4.08Å; V255-W268 HydrophobicContact CG2-CD2 3.76Å; V255-W268 HydrophobicContact CG2-CE3 4.49Å; V255-W268 HydrophobicContact CG2-CG 3.73Å; V255-W268 HydrophobicContact CG2-CZ2 4.41Å; V255-W268 WeakPolarHBondContact CG2-O 3.35Å; V255-W268 PolarHBondContact N-O 3.41Å; W268-A270 HydrophobicContact CE3-CB 3.94Å; W268-A270 HydrophobicContact CZ3-CB 3.65Å
269	A	98.3	Very high	96.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.3	174.5	0	0	0	0	0	108.6	C227 L239 W241 T252 E253 L254	C227-A269 PolarHBondContact N-O 2.85Å; C227-A269 PolarHBondContact O-N 3.46Å; L239-A269 HydrophobicContact CB-CB 4.07Å; L239-A269 HydrophobicContact CD2-CB 4.34Å; W241-A269 PolarHBondContact NE1-O 3.39Å; T252-A269 HydrophobicContact CG2-CB 3.93Å; E253-A269 CarbonylContact O-C 3.55Å; E253-A269 WeakPolarHBondContact O-CA 3.2Å; L254-A269 HydrophobicContact CD1-CB 3.62Å
270	A	98.1	Very high	96	Very high	2 Å²	2	44.5 Å²	44.5	2%	0.017	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.8	-179.3	0	0	0	0	0	112.4	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.85Å; L225-A270 CarbonylContact O-C 3.5Å; L225-A270 WeakPolarHBondContact O-CA 3.46Å; R226-A270 HydrophobicContact CB-CB 4.1Å; R226-A270 HydrophobicContact CG-CB 4.17Å; T252-A270 CarbonylContact C-O 3.58Å; T252-A270 WeakPolarHBondContact CA-O 3.44Å; E253-A270 HydrophobicContact CB-CB 4.42Å; E253-A270 PolarHBondContact N-O 3.09Å; E253-A270 PolarHBondContact O-N 3.5Å; W268-A270 HydrophobicContact CE3-CB 3.94Å; W268-A270 HydrophobicContact CZ3-CB 3.65Å
271	V	97.9	Very high	96.1	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.024	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145	174.2	-72.9	0	0	0	0	109.4	T224 L225 W241 Q248 T252 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.16Å; L225-V271 HydrophobicContact CB-CG2 4.17Å; L225-V271 PolarHBondContact N-O 3.05Å; L225-V271 PolarHBondContact O-N 3.16Å; W241-V271 HydrophobicContact CB-CG1 3.68Å; W241-V271 HydrophobicContact CB-CG2 4.45Å; W241-V271 HydrophobicContact CD2-CG1 4.32Å; W241-V271 HydrophobicContact CD2-CG2 3.63Å; W241-V271 HydrophobicContact CE3-CG2 4.01Å; W241-V271 HydrophobicContact CG-CB 4.38Å; W241-V271 HydrophobicContact CG-CG1 3.61Å; W241-V271 HydrophobicContact CG-CG2 3.84Å; W241-V271 HydrophobicContact CZ2-CG2 4.28Å; W241-V271 HydrophobicContact CZ3-CG2 4.5Å; Q248-V271 HydrophobicContact CB-CG1 4.41Å; T252-V271 HydrophobicContact CG2-CG1 4.35Å; T252-V271 VanDerWaalsContact OG1-CG1 3.27Å; T252-V271 WeakPolarHBondContact OG1-CG1 3.39Å; V271-V273 HydrophobicContact CB-CG1 4.41Å; V271-V273 HydrophobicContact CG2-CG1 3.79Å; V271-Y281 HydrophobicContact CG2-CD1 4.02Å; V271-Y281 HydrophobicContact CG2-CE1 4.42Å
272	V	97.6	Very high	96.3	Very high	76 Å²	76	39.4 Å²	39.4	46%	0.461	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129	168	-179.1	0	0	0	0	107.9	I218 E222 A223	I218-V272 HydrophobicContact CD1-CG1 4.01Å; I218-V272 HydrophobicContact CD1-CG2 4.12Å; E222-V272 HydrophobicContact CB-CG1 4.07Å; E222-V272 HydrophobicContact CG-CG1 4.31Å; A223-V272 WeakPolarHBondContact O-CA 3.46Å
273	V	96.6	Very high	96.6	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	144.5	-175.9	-52.5	0	0	0	0	110.2	E222 A223 L225 V271 E278 Y281	E222-V273 VanDerWaalsContact CA-O 3.32Å; E222-V273 WeakPolarHBondContact CA-O 3.37Å; A223-V273 HydrophobicContact CB-CG2 4.5Å; A223-V273 PolarHBondContact N-O 3.35Å; A223-V273 PolarHBondContact O-N 3.14Å; L225-V273 HydrophobicContact CD1-CG1 4.02Å; L225-V273 HydrophobicContact CD1-CG2 4.08Å; L225-V273 HydrophobicContact CG-CG1 4.17Å; L225-V273 HydrophobicContact CG-CG2 3.86Å; V271-V273 HydrophobicContact CB-CG1 4.41Å; V271-V273 HydrophobicContact CG2-CG1 3.79Å; V273-E278 HydrophobicContact CG2-CG 3.93Å; V273-Y281 HydrophobicContact CB-CD2 4.04Å; V273-Y281 HydrophobicContact CB-CE2 3.74Å; V273-Y281 HydrophobicContact CG1-CD1 3.72Å; V273-Y281 HydrophobicContact CG1-CD2 3.62Å; V273-Y281 HydrophobicContact CG1-CE1 3.64Å; V273-Y281 HydrophobicContact CG1-CE2 3.57Å; V273-Y281 HydrophobicContact CG1-CG 3.7Å
274	P	96.6	Very high	96.9	Very high	45 Å²	45	33 Å²	33	29%	0.292	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	141.4	171	-19.8	32	0	0	0	111.4	H221 G276 E277	H221-P274 CarbonylContact O-C 3.55Å; H221-P274 WeakPolarHBondContact O-CA 3.36Å; P274-G276 PolarHBondContact O-N 3.2Å; P274-E277 HydrophobicContact CB-CB 4.32Å; P274-E277 HydrophobicContact CB-CG 4.09Å; P274-E277 HydrophobicContact CG-CG 4.48Å; P274-E277 WeakPolarHBondContact O-CB 3.41Å; P274-E277 PolarHBondContact O-N 2.73Å
275	S	93	Very high	96.9	Very high	56 Å²	56	32.2 Å²	32.2	39%	0.392	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	127.5	175	-63.3	0	0	0	0	111	D220 H221 E222 E277	D220-S275 PolarHBondContact O-OG 2.81Å; H221-S275 PolarHBondContact O-N 2.95Å; H221-S275 PolarHBondContact O-OG 3.31Å; E222-S275 PolarHBondContact N-OG 3.2Å; S275-E277 VanDerWaalsContact C-N 3.35Å
276	G	91.9	Very high	96.9	Very high	67 Å²	67	34.5 Å²	34.5	69%	0.691	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.6	-5.8	-178.9	0	0	0	0	0	114.9	P274 E278	P274-G276 PolarHBondContact O-N 3.2Å; G276-E278 WeakPolarHBondContact CA-OE2 3.36Å; G276-E278 VanDerWaalsContact N-CD 3.31Å; G276-E278 PolarHBondContact N-OE1 2.82Å; G276-E278 PolarHBondContact N-OE2 2.79Å
277	E	95.6	Very high	96.8	Very high	53 Å²	53	33 Å²	33	25%	0.248	18%	0.183	C	C	.	.			trans	-100.3	3.3	176	-65.4	-158.8	-159.2	0	0	113.7	R243 P274 S275 Q279 R280 Y281	R243-E277 IonicContact CZ-OE2 3.81Å; R243-E277 IonicContact NE-OE2 3.61Å; R243-E277 IonicContact NH2-OE1 2.7Å; R243-E277 IonicContact NH2-OE2 3.47Å; R243-E277 PolarHBondContact NH2-OE2 2.88Å; P274-E277 HydrophobicContact CB-CB 4.32Å; P274-E277 HydrophobicContact CB-CG 4.09Å; P274-E277 HydrophobicContact CG-CG 4.48Å; P274-E277 WeakPolarHBondContact O-CB 3.41Å; P274-E277 PolarHBondContact O-N 2.73Å; S275-E277 VanDerWaalsContact C-N 3.35Å; E277-Q279 PolarHBondContact O-N 3.15Å; E277-R280 VanDerWaalsContact CD-NH1 3.34Å; E277-R280 WeakPolarHBondContact O-CB 2.89Å; E277-R280 PolarHBondContact O-N 3.16Å; E277-R280 IonicContact OE1-NH1 2.62Å; E277-R280 IonicContact OE2-CZ 3.43Å; E277-R280 IonicContact OE2-NE 2.8Å; E277-R280 IonicContact OE2-NH1 3.11Å; E277-R280 PolarHBondContact OE2-NH1 3.04Å; E277-Y281 HydrophobicContact CB-CE2 4.42Å; E277-Y281 WeakPolarHBondContact O-CD2 3.03Å
278	E	95.1	Very high	96.6	Very high	20 Å²	20	35.6 Å²	35.6	9%	0.093	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-57.2	-33	-170.9	-56.5	82.1	-179.7	0	0	112.5	H215 L225 V273 G276 R280 Y281 W298	H215-E278 IonicContact NE2-OE1 2.8Å; L225-E278 HydrophobicContact CD1-CB 4.11Å; L225-E278 HydrophobicContact CD2-CG 4.38Å; V273-E278 HydrophobicContact CG2-CG 3.93Å; G276-E278 WeakPolarHBondContact CA-OE2 3.36Å; G276-E278 VanDerWaalsContact N-CD 3.31Å; G276-E278 PolarHBondContact N-OE1 2.82Å; G276-E278 PolarHBondContact N-OE2 2.79Å; E278-R280 VanDerWaalsContact C-N 3.26Å; E278-R280 PolarHBondContact O-N 3.11Å; E278-Y281 PolarHBondContact O-N 3.21Å; E278-W298 HydrophobicContact CB-CD2 4.42Å; E278-W298 HydrophobicContact CB-CE3 3.4Å; E278-W298 VanDerWaalsContact CB-CE3 3.4Å; E278-W298 HydrophobicContact CB-CZ3 3.81Å; E278-W298 HydrophobicContact CG-CE3 3.71Å; E278-W298 HydrophobicContact CG-CZ3 3.73Å
279	Q	95.2	Very high	96.3	Very high	87 Å²	87	35.3 Å²	35.3	41%	0.407	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-72.9	-15.3	-179.6	-63.4	-57	-46.5	0	0	114.2	E277 Y281 W298	E277-Q279 PolarHBondContact O-N 3.15Å; Q279-Y281 VanDerWaalsContact C-N 3.26Å; Q279-W298 PolarHBondContact NE2-O 3.47Å
280	R	96.6	Very high	96.2	Very high	95 Å²	95	36.6 Å²	36.6	36%	0.358	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-76.9	-17.2	172.8	-64.2	173.2	66.1	-179.9	5.6	112	R243 D244 E277 E278	R243-R280 WeakPolarHBondContact CA-O 3.46Å; R243-R280 HydrophobicContact CG-CB 4.41Å; D244-R280 PolarHBondContact N-O 2.81Å; D244-R280 IonicContact OD1-NE 3.7Å; D244-R280 PolarHBondContact OD1-NE 3.28Å; D244-R280 IonicContact OD2-CZ 3.59Å; D244-R280 IonicContact OD2-NE 2.9Å; D244-R280 PolarHBondContact OD2-NE 3.02Å; D244-R280 IonicContact OD2-NH2 3.7Å; D244-R280 PolarHBondContact OD2-NH2 3.08Å; E277-R280 VanDerWaalsContact CD-NH1 3.34Å; E277-R280 WeakPolarHBondContact O-CB 2.89Å; E277-R280 PolarHBondContact O-N 3.16Å; E277-R280 IonicContact OE1-NH1 2.62Å; E277-R280 IonicContact OE2-CZ 3.43Å; E277-R280 IonicContact OE2-NE 2.8Å; E277-R280 IonicContact OE2-NH1 3.11Å; E277-R280 PolarHBondContact OE2-NH1 3.04Å; E278-R280 VanDerWaalsContact C-N 3.26Å; E278-R280 PolarHBondContact O-N 3.11Å
281	Y	97.6	Very high	95.9	Very high	9 Å²	9	42.8 Å²	42.8	4%	0.035	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.8	-177.7	-69.9	-100.7	0	0	0	111.3	Q242 R243 Q248 V271 V273 E277 E278 Q279	Q242-Y281 CarbonylContact O-C 3.56Å; Q242-Y281 VanDerWaalsContact O-CA 3.26Å; Q242-Y281 WeakPolarHBondContact O-CA 3.04Å; R243-Y281 HydrophobicContact CB-CD1 4.12Å; R243-Y281 HydrophobicContact CB-CE1 3.91Å; R243-Y281 WeakPolarHBondContact CD-OH 3.24Å; R243-Y281 HydrophobicContact CG-CD2 4.45Å; R243-Y281 HydrophobicContact CG-CE1 4.14Å; R243-Y281 HydrophobicContact CG-CE2 4.05Å; Q248-Y281 HydrophobicContact CG-CE1 4.35Å; V271-Y281 HydrophobicContact CG2-CD1 4.02Å; V271-Y281 HydrophobicContact CG2-CE1 4.42Å; V273-Y281 HydrophobicContact CB-CD2 4.04Å; V273-Y281 HydrophobicContact CB-CE2 3.74Å; V273-Y281 HydrophobicContact CG1-CD1 3.72Å; V273-Y281 HydrophobicContact CG1-CD2 3.62Å; V273-Y281 HydrophobicContact CG1-CE1 3.64Å; V273-Y281 HydrophobicContact CG1-CE2 3.57Å; V273-Y281 HydrophobicContact CG1-CG 3.7Å; E277-Y281 HydrophobicContact CB-CE2 4.42Å; E277-Y281 WeakPolarHBondContact O-CD2 3.03Å; E278-Y281 PolarHBondContact O-N 3.21Å; Q279-Y281 VanDerWaalsContact C-N 3.26Å
282	T	97.9	Very high	95.7	Very high	13 Å²	13	50.3 Å²	50.3	8%	0.08	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.4	175.8	47.3	0	0	0	0	110.6	W241 Q242 H284 T295 L296 R297	W241-T282 WeakPolarHBondContact CA-O 3.1Å; W241-T282 VanDerWaalsContact CE3-C 3.41Å; Q242-T282 PolarHBondContact N-O 3.27Å; Q242-T282 PolarHBondContact O-N 3.49Å; T282-H284 PolarHBondContact O-CD2 2.82Å; T282-H284 PolarHBondContact OG1-NE2 3.3Å; T282-T295 HydrophobicContact CG2-CG2 3.95Å; T282-L296 CarbonylContact C-O 3.59Å; T282-L296 WeakPolarHBondContact CA-O 3.47Å; T282-R297 HydrophobicContact CG2-CG 3.63Å; T282-R297 VanDerWaalsContact CG2-NE 3.28Å
283	C	98.1	Very high	95.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.3	169.6	174.4	0	0	0	0	109.7	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.52Å; C227-C283 WeakPolarHBondContact CB-SG 3.46Å; C227-C283 WeakPolarHBondContact SG-CB 3.5Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 2.8Å; T240-C283 CarbonylContact O-C 3.58Å; T240-C283 WeakPolarHBondContact O-CA 3.25Å; W241-C283 HydrophobicContact CD2-CB 4.14Å; W241-C283 HydrophobicContact CE3-CB 4.09Å; W241-C283 HydrophobicContact CH2-CB 3.98Å; W241-C283 HydrophobicContact CZ2-CB 4.04Å; W241-C283 HydrophobicContact CZ3-CB 4.01Å; C283-T295 CarbonylContact O-C 3.57Å; C283-T295 WeakPolarHBondContact O-CA 3.32Å; C283-L296 HydrophobicContact CB-CB 4.29Å; C283-L296 PolarHBondContact N-O 3.07Å; C283-L296 PolarHBondContact O-N 3.29Å
284	H	97.8	Very high	95.6	Very high	32 Å²	32	53.2 Å²	53.2	15%	0.148	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.7	177.2	-63.3	-107.3	0	0	0	109.6	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.47Å; T240-H284 PolarHBondContact N-O 3Å; T240-H284 PolarHBondContact O-N 2.82Å; Q242-H284 PolarHBondContact OE1-NE2 2.66Å; T282-H284 PolarHBondContact O-CD2 2.82Å; T282-H284 PolarHBondContact OG1-NE2 3.3Å; H284-L294 VanDerWaalsContact CA-O 3.32Å; H284-L294 WeakPolarHBondContact CA-O 3.41Å; H284-T295 PolarHBondContact ND1-OG1 3.27Å
285	V	98.1	Very high	95.7	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122.8	-178.3	-174	0	0	0	0	109.3	P209 T211 I237 T238 L239 L290 P293 L294 L296	P209-V285 HydrophobicContact CG-CG1 3.93Å; 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 4.04Å; I237-V285 HydrophobicContact CG1-CG1 4.37Å; T238-V285 WeakPolarHBondContact O-CA 3.3Å; L239-V285 HydrophobicContact CD1-CG1 4.1Å; L239-V285 HydrophobicContact CG-CG2 4.35Å; V285-L290 HydrophobicContact CG1-CD1 4.2Å; V285-P293 WeakPolarHBondContact O-CA 3.27Å; V285-L294 HydrophobicContact CB-CB 4.34Å; V285-L294 PolarHBondContact N-O 3.39Å; V285-L294 PolarHBondContact O-N 3.1Å; V285-L296 HydrophobicContact CG2-CD1 4Å
286	Q	97.6	Very high	95.9	Very high	75 Å²	75	54.1 Å²	54.1	35%	0.35	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.3	173.9	-52.1	-177	18.2	0	0	109.5	I237 T238 P293	I237-Q286 VanDerWaalsContact CG1-O 3.29Å; I237-Q286 WeakPolarHBondContact CG1-O 3.36Å; T238-Q286 PolarHBondContact N-O 3.31Å; T238-Q286 PolarHBondContact O-N 3.28Å; Q286-P293 HydrophobicContact CG-CB 4.02Å; Q286-P293 HydrophobicContact CG-CG 4.06Å
287	H	96.3	Very high	96.1	Very high	11 Å²	11	57.6 Å²	57.6	5%	0.051	29%	0.29	C	S	.	.			trans	-157.9	147.7	-178.4	-174.3	-97.9	0	0	0	109.1	D207 P209 F232 Y233 P234 E236 I237 G289 L290	D207-H287 PolarHBondContact O-CE1 2.85Å; D207-H287 VanDerWaalsContact O-CE1 3.32Å; P209-H287 HydrophobicContact CG-CB 4.1Å; F232-H287 AromaticContact CD2-CD2 3.85Å; F232-H287 AromaticContact CD2-NE2 3.73Å; Y233-H287 PolarHBondContact O-CE1 2.98Å; P234-H287 PolarHBondContact O-NE2 3.47Å; E236-H287 PolarHBondContact O-CD2 2.83Å; I237-H287 HydrophobicContact CD1-CB 4.37Å; I237-H287 HydrophobicContact CG1-CB 4.11Å; H287-G289 PolarHBondContact ND1-N 2.89Å; H287-G289 PolarHBondContact O-N 2.85Å; H287-L290 HydrophobicContact CB-CD1 3.98Å; H287-L290 HydrophobicContact CB-CG 4.17Å; H287-L290 WeakPolarHBondContact O-CB 3.16Å; H287-L290 PolarHBondContact O-N 3.05Å
288	E	93.5	Very high	96.1	Very high	77 Å²	77	57.2 Å²	57.2	36%	0.36	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-35.9	-179.7	-165.8	178.8	156.7	0	0	113.2	W23 L290	W23-E288 HydrophobicContact CB-CG 4.49Å; W23-E288 HydrophobicContact CE3-CB 4.01Å; W23-E288 VanDerWaalsContact O-CD 3.26Å; E288-L290 PolarHBondContact O-N 3.08Å
289	G	93.7	Very high	95.8	Very high	19 Å²	19	64.1 Å²	64.1	20%	0.196	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-10	178.2	0	0	0	0	0	113.5	H287	H287-G289 PolarHBondContact ND1-N 2.89Å; H287-G289 PolarHBondContact O-N 2.85Å
290	L	95.2	Very high	95.1	Very high	26 Å²	26	63.9 Å²	63.9	14%	0.136	32%	0.324	C	S	.	.			trans	-97.9	122.6	177.8	-64.6	171.5	0	0	0	110.5	P208 P209 V285 H287 E288 K292 L294	P208-L290 HydrophobicContact CB-CD2 3.9Å; P208-L290 HydrophobicContact CB-CG 4.45Å; P209-L290 HydrophobicContact CG-CD1 3.82Å; P209-L290 HydrophobicContact CG-CD2 4.47Å; P209-L290 HydrophobicContact CG-CG 4.21Å; V285-L290 HydrophobicContact CG1-CD1 4.2Å; H287-L290 HydrophobicContact CB-CD1 3.98Å; H287-L290 HydrophobicContact CB-CG 4.17Å; H287-L290 WeakPolarHBondContact O-CB 3.16Å; H287-L290 PolarHBondContact O-N 3.05Å; E288-L290 PolarHBondContact O-N 3.08Å; L290-K292 WeakPolarHBondContact CB-O 3.39Å; L290-K292 PolarHBondContact O-N 3.42Å; L290-L294 HydrophobicContact CD1-CD1 3.91Å; L290-L294 HydrophobicContact CD1-CG 3.85Å; L290-L294 HydrophobicContact CD2-CD1 3.7Å; L290-L294 HydrophobicContact CD2-CG 3.97Å; L290-L294 HydrophobicContact CG-CD1 4.48Å
291	P	92.9	Very high	93.6	Very high	133 Å²	133	64.4 Å²	64.4	86%	0.864	34%	0.342	S	S	*	.	S	Bend	trans	-66	-22.2	177.6	27.7	-35.2	0	0	0	112.6
292	K	93.4	Very high	91.2	Very high	162 Å²	162	69.3 Å²	69.3	70%	0.704	38%	0.378	S	S	*	.	S	Bend	trans	-145.6	148.5	173.5	-65.1	-176.4	-177.7	177	0	109.2	L290 L294	L290-K292 WeakPolarHBondContact CB-O 3.39Å; L290-K292 PolarHBondContact O-N 3.42Å; K292-L294 PolarHBondContact O-N 2.95Å
293	P	95.6	Very high	88.7	Confident	77 Å²	77	76.7 Å²	76.7	50%	0.5	41%	0.411	S	S	.	.			trans	-51.5	139.7	170.8	-28.1	36.4	0	0	0	112	V285 Q286	V285-P293 WeakPolarHBondContact O-CA 3.27Å; Q286-P293 HydrophobicContact CG-CB 4.02Å; Q286-P293 HydrophobicContact CG-CG 4.06Å
294	L	96.7	Very high	86	Confident	60 Å²	60	80.9 Å²	80.9	31%	0.314	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	145.3	173.5	-63.4	177.4	0	0	0	110.1	T211 H284 V285 L290 K292	T211-L294 HydrophobicContact CG2-CD1 4.36Å; H284-L294 VanDerWaalsContact CA-O 3.32Å; H284-L294 WeakPolarHBondContact CA-O 3.41Å; V285-L294 HydrophobicContact CB-CB 4.34Å; V285-L294 PolarHBondContact N-O 3.39Å; V285-L294 PolarHBondContact O-N 3.1Å; L290-L294 HydrophobicContact CD1-CD1 3.91Å; L290-L294 HydrophobicContact CD1-CG 3.85Å; L290-L294 HydrophobicContact CD2-CD1 3.7Å; L290-L294 HydrophobicContact CD2-CG 3.97Å; L290-L294 HydrophobicContact CG-CD1 4.48Å; K292-L294 PolarHBondContact O-N 2.95Å
295	T	97.7	Very high	83.7	Confident	84 Å²	84	85.3 Å²	85.3	52%	0.515	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.3	171.1	-56.7	0	0	0	0	108.4	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 3.95Å; C283-T295 CarbonylContact O-C 3.57Å; C283-T295 WeakPolarHBondContact O-CA 3.32Å; H284-T295 PolarHBondContact ND1-OG1 3.27Å
296	L	96.8	Very high	81.5	Confident	36 Å²	36	88.8 Å²	88.8	19%	0.188	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	142.6	-173.8	-60.5	154.7	0	0	0	109.4	T211 V213 T282 C283 V285	T211-L296 VanDerWaalsContact CB-CD1 3.43Å; T211-L296 HydrophobicContact CG2-CD1 4.17Å; T211-L296 WeakPolarHBondContact OG1-CD1 3.38Å; V213-L296 HydrophobicContact CG2-CB 3.91Å; T282-L296 CarbonylContact C-O 3.59Å; T282-L296 WeakPolarHBondContact CA-O 3.47Å; C283-L296 HydrophobicContact CB-CB 4.29Å; C283-L296 PolarHBondContact N-O 3.07Å; C283-L296 PolarHBondContact O-N 3.29Å; V285-L296 HydrophobicContact CG2-CD1 4Å
297	R	96	Very high	79.5	Confident	141 Å²	141	89.1 Å²	89.1	53%	0.532	50%	0.5	S	S	.	.			trans	-117.5	161.4	166.5	-71.3	-174.8	175	165.9	-2.1	108.9	T282 E299	T282-R297 HydrophobicContact CG2-CG 3.63Å; T282-R297 VanDerWaalsContact CG2-NE 3.28Å; R297-E299 PolarHBondContact O-N 3.3Å
298	W	95.6	Very high	77.8	Confident	44 Å²	44	94.5 Å²	94.5	17%	0.167	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-68.1	120.7	166.7	171.1	56.5	0	0	0	109.5	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.5Å; V213-W298 HydrophobicContact CG1-CB 3.86Å; H215-W298 HydrophobicContact CB-CD2 4.13Å; H215-W298 HydrophobicContact CB-CG 4.18Å; H215-W298 HydrophobicContact CB-CZ2 4.02Å; H215-W298 VanDerWaalsContact CB-NE1 3.28Å; H215-W298 AromaticContact CG-CE2 3.79Å; H215-W298 AromaticContact CG-CZ2 3.81Å; H215-W298 AromaticContact ND1-CZ2 3.96Å; L225-W298 HydrophobicContact CD1-CB 4.41Å; L225-W298 HydrophobicContact CD2-CB 3.81Å; L225-W298 HydrophobicContact CD2-CD2 4.38Å; L225-W298 HydrophobicContact CD2-CG 3.95Å; E278-W298 HydrophobicContact CB-CD2 4.42Å; E278-W298 HydrophobicContact CB-CE3 3.4Å; E278-W298 VanDerWaalsContact CB-CE3 3.4Å; E278-W298 HydrophobicContact CB-CZ3 3.81Å; E278-W298 HydrophobicContact CG-CE3 3.71Å; E278-W298 HydrophobicContact CG-CZ3 3.73Å; Q279-W298 PolarHBondContact NE2-O 3.47Å; W298-P300 HydrophobicContact CE3-CG 4.33Å; W298-P300 HydrophobicContact CH2-CB 4.23Å; W298-P300 HydrophobicContact CH2-CG 3.91Å; W298-P300 HydrophobicContact CZ2-CB 4Å; W298-P300 HydrophobicContact CZ2-CG 4.02Å; W298-P300 HydrophobicContact CZ3-CG 4.05Å
299	E	89.6	Confident	76.3	Confident	166 Å²	166	96.6 Å²	96.6	78%	0.776	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-98	117.6	168.2	-71.3	-178.4	174.8	0	0	108.1	R297 S301	R297-E299 PolarHBondContact O-N 3.3Å; E299-S301 PolarHBondContact O-N 2.94Å; E299-S301 VanDerWaalsContact O-N 3.14Å
300	P	81.1	Confident	75	Confident	81 Å²	81	97.8 Å²	97.8	53%	0.526	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-55.7	123.5	170	-20	30.6	0	0	0	107.6	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.33Å; W298-P300 HydrophobicContact CH2-CB 4.23Å; W298-P300 HydrophobicContact CH2-CG 3.91Å; W298-P300 HydrophobicContact CZ2-CB 4Å; W298-P300 HydrophobicContact CZ2-CG 4.02Å; W298-P300 HydrophobicContact CZ3-CG 4.05Å; P300-S302 PolarHBondContact O-N 3.18Å
301	S	63.6	Low	74	Confident	106 Å²	106	101.2 Å²	101.2	74%	0.741	58%	0.575	S	S	*	*			trans	-53.1	113.3	179.4	28.4	0	0	0	0	108.5	E299 Q303	E299-S301 PolarHBondContact O-N 2.94Å; E299-S301 VanDerWaalsContact O-N 3.14Å; S301-Q303 PolarHBondContact O-N 3.35Å
302	S	47.8	Very low	73.2	Confident	112 Å²	112	99.2 Å²	99.2	78%	0.783	56%	0.56	S	S	*	*			trans	-69.1	76.2	161.9	63	0	0	0	0	106.2	P300 S304	P300-S302 PolarHBondContact O-N 3.18Å; S302-S304 PolarHBondContact O-N 2.9Å
303	Q	45.3	Very low	72.5	Confident	168 Å²	168	94 Å²	94	79%	0.785	55%	0.547	S	S	*	.			trans	-59.5	85.5	145.2	-83.5	-173.2	-11.7	0	0	104.3	S301 T305	S301-Q303 PolarHBondContact O-N 3.35Å; Q303-T305 PolarHBondContact O-N 2.86Å; Q303-T305 PolarHBondContact O-OG1 3.43Å
304	S	41.8	Very low	71.8	Confident	89 Å²	89	92.1 Å²	92.1	62%	0.622	54%	0.542	S	S	*	.			trans	-55.7	96.4	164.2	-174.8	0	0	0	0	103.5	S302 V306	S302-S304 PolarHBondContact O-N 2.9Å; S304-V306 PolarHBondContact O-N 2.9Å; S304-V306 VanDerWaalsContact OG-CG2 3.29Å; S304-V306 WeakPolarHBondContact OG-CG2 3.45Å
305	T	48.5	Very low	71.3	Confident	124 Å²	124	94.5 Å²	94.5	76%	0.761	55%	0.554	S	S	*	*			trans	-70.1	69.1	160.7	-48.3	0	0	0	0	103.4	Q303 P307	Q303-T305 PolarHBondContact O-N 2.86Å; Q303-T305 PolarHBondContact O-OG1 3.43Å; T305-P307 WeakPolarHBondContact O-CD 3.28Å; T305-P307 VanDerWaalsContact O-N 3.08Å
306	V	52.9	Low	70.6	Confident	74 Å²	74	93 Å²	93	45%	0.448	55%	0.551	S	S	.	*			trans	-49.5	120.3	155.9	-179.7	0	0	0	0	102.5	S304 I308 I311	S304-V306 PolarHBondContact O-N 2.9Å; S304-V306 VanDerWaalsContact OG-CG2 3.29Å; S304-V306 WeakPolarHBondContact OG-CG2 3.45Å; V306-I308 PolarHBondContact O-N 2.87Å; V306-I311 HydrophobicContact CG1-CD1 4.02Å
307	P	56.3	Low	70.1	Confident	81 Å²	81	95.9 Å²	95.9	53%	0.526	57%	0.569	S	S	.	*			trans	-72.6	80.5	-175.7	29.7	-32.5	0	0	0	106.4	T305 V309 G310 I311	T305-P307 WeakPolarHBondContact O-CD 3.28Å; T305-P307 VanDerWaalsContact O-N 3.08Å; P307-V309 PolarHBondContact O-N 3.24Å; P307-V309 VanDerWaalsContact O-N 3.16Å; P307-G310 WeakPolarHBondContact O-CA 3.37Å; P307-G310 PolarHBondContact O-N 2.94Å; P307-I311 PolarHBondContact O-N 3.29Å; P307-I311 VanDerWaalsContact O-N 3.11Å
308	I	60.4	Low	69.6	Low	124 Å²	124	94.3 Å²	94.3	64%	0.636	57%	0.571	S	S	*	*	H	α-helix	trans	-54.4	-34.6	175.4	-66.5	169.2	0	0	0	108	V306 G310 I311 V312	V306-I308 PolarHBondContact O-N 2.87Å; I308-G310 PolarHBondContact O-N 2.71Å; I308-I311 PolarHBondContact O-N 3.44Å; I308-V312 HydrophobicContact CG2-CG2 4.25Å; I308-V312 WeakPolarHBondContact O-CB 3.14Å; I308-V312 WeakPolarHBondContact O-CG2 3.43Å; I308-V312 PolarHBondContact O-N 3.49Å
309	V	61.1	Low	69.1	Low	122 Å²	122	94.5 Å²	94.5	74%	0.739	58%	0.582	S	S	*	*	H	α-helix	trans	-60.3	-41.5	171.8	-177.5	0	0	0	0	112.5	P307 A313	P307-V309 PolarHBondContact O-N 3.24Å; P307-V309 VanDerWaalsContact O-N 3.16Å; V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.17Å; V309-A313 PolarHBondContact O-N 3.34Å
310	G	67.3	Low	68.9	Low	43 Å²	43	91.6 Å²	91.6	44%	0.443	58%	0.575	S	S	.	*	H	α-helix	trans	-68.7	-38	178.8	0	0	0	0	0	113	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.37Å; P307-G310 PolarHBondContact O-N 2.94Å; I308-G310 PolarHBondContact O-N 2.71Å; G310-G314 PolarHBondContact O-N 3.43Å
311	I	74.3	Confident	69.2	Low	98 Å²	98	92.2 Å²	92.2	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-69.5	-44.3	176.2	-61.8	173.5	0	0	0	110.5	V306 P307 I308 G314 L315	V306-I311 HydrophobicContact CG1-CD1 4.02Å; P307-I311 PolarHBondContact O-N 3.29Å; P307-I311 VanDerWaalsContact O-N 3.11Å; I308-I311 PolarHBondContact O-N 3.44Å; I311-G314 PolarHBondContact O-N 3.31Å; I311-L315 HydrophobicContact CG2-CD1 4.03Å; I311-L315 WeakPolarHBondContact O-CB 3.2Å; I311-L315 WeakPolarHBondContact O-CG 3.26Å; I311-L315 PolarHBondContact O-N 2.88Å
312	V	76.3	Confident	70.3	Confident	92 Å²	92	91.1 Å²	91.1	56%	0.558	57%	0.566	S	S	*	*	H	α-helix	trans	-65.2	-43.4	178.5	173.6	0	0	0	0	111	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.25Å; I308-V312 WeakPolarHBondContact O-CB 3.14Å; I308-V312 WeakPolarHBondContact O-CG2 3.43Å; I308-V312 PolarHBondContact O-N 3.49Å; V312-L315 PolarHBondContact O-N 3.06Å; V312-A316 WeakPolarHBondContact O-CB 3.47Å; V312-A316 PolarHBondContact O-N 3.42Å
313	A	77.3	Confident	72	Confident	52 Å²	52	91 Å²	91	43%	0.43	56%	0.555	S	S	.	*	H	α-helix	trans	-62.9	-43.3	175.1	0	0	0	0	0	111.7	V309 L315 A316 V317	V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.17Å; V309-A313 PolarHBondContact O-N 3.34Å; A313-L315 PolarHBondContact O-N 3.02Å; A313-A316 PolarHBondContact O-N 3.18Å; A313-V317 WeakPolarHBondContact O-CG2 3.35Å; A313-V317 PolarHBondContact O-N 3.21Å
314	G	82.3	Confident	73.8	Confident	37 Å²	37	85 Å²	85	38%	0.381	54%	0.539	S	S	.	.	H	α-helix	trans	-60.6	-44.6	176.4	0	0	0	0	0	113	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 3.43Å; I311-G314 PolarHBondContact O-N 3.31Å; G314-V317 PolarHBondContact O-N 3.36Å; G314-L318 PolarHBondContact O-N 3.09Å
315	L	85.4	Confident	75.7	Confident	111 Å²	111	83.5 Å²	83.5	58%	0.581	53%	0.532	S	S	*	.	H	α-helix	trans	-66.8	-38.7	177.4	-72.5	171.9	0	0	0	112.5	I311 V312 A313 L318 A319	I311-L315 HydrophobicContact CG2-CD1 4.03Å; I311-L315 WeakPolarHBondContact O-CB 3.2Å; I311-L315 WeakPolarHBondContact O-CG 3.26Å; I311-L315 PolarHBondContact O-N 2.88Å; V312-L315 PolarHBondContact O-N 3.06Å; A313-L315 PolarHBondContact O-N 3.02Å; L315-L318 PolarHBondContact O-N 3.15Å; L315-A319 WeakPolarHBondContact O-CB 3.31Å; L315-A319 PolarHBondContact O-N 3.47Å
316	A	83.8	Confident	77.4	Confident	53 Å²	53	81.7 Å²	81.7	44%	0.438	52%	0.52	S	S	.	.	H	α-helix	trans	-63.7	-43.6	176.5	0	0	0	0	0	111.8	V312 A313 A319 V320	V312-A316 WeakPolarHBondContact O-CB 3.47Å; V312-A316 PolarHBondContact O-N 3.42Å; A313-A316 PolarHBondContact O-N 3.18Å; A316-A319 PolarHBondContact O-N 2.74Å; A316-V320 WeakPolarHBondContact O-CG2 3.45Å; A316-V320 PolarHBondContact O-N 3.3Å; A316-V320 VanDerWaalsContact O-N 3.08Å
317	V	85.9	Confident	78.7	Confident	95 Å²	95	81.9 Å²	81.9	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-63.2	-44.5	176.3	173.6	0	0	0	0	110.9	A313 G314 A319 V320 V321	A313-V317 WeakPolarHBondContact O-CG2 3.35Å; A313-V317 PolarHBondContact O-N 3.21Å; G314-V317 PolarHBondContact O-N 3.36Å; V317-A319 VanDerWaalsContact C-N 3.34Å; V317-A319 PolarHBondContact O-N 3.4Å; V317-V320 PolarHBondContact O-N 2.89Å; V317-V321 HydrophobicContact CG1-CG2 4.45Å; V317-V321 WeakPolarHBondContact O-CG2 3.45Å; V317-V321 PolarHBondContact O-N 2.9Å
318	L	86.2	Confident	79.7	Confident	108 Å²	108	80.5 Å²	80.5	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-58.6	-44.3	176	-107.3	155	0	0	0	112.2	G314 L315 V320 V321 V322	G314-L318 PolarHBondContact O-N 3.09Å; L315-L318 PolarHBondContact O-N 3.15Å; L318-V320 PolarHBondContact O-N 3.39Å; L318-V321 PolarHBondContact O-N 3.22Å; L318-V322 VanDerWaalsContact O-CG2 3.28Å; L318-V322 WeakPolarHBondContact O-CG2 3.4Å; L318-V322 PolarHBondContact O-N 2.93Å
319	A	84.7	Confident	80.4	Confident	49 Å²	49	77.2 Å²	77.2	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-61.4	-43.5	177.4	0	0	0	0	0	112.1	L315 A316 V317 V321 V322 I323	L315-A319 WeakPolarHBondContact O-CB 3.31Å; L315-A319 PolarHBondContact O-N 3.47Å; A316-A319 PolarHBondContact O-N 2.74Å; V317-A319 VanDerWaalsContact C-N 3.34Å; V317-A319 PolarHBondContact O-N 3.4Å; A319-V321 PolarHBondContact O-N 3.12Å; A319-V322 PolarHBondContact O-N 3.26Å; A319-I323 WeakPolarHBondContact O-CB 3.33Å; A319-I323 WeakPolarHBondContact O-CD1 3.42Å; A319-I323 VanDerWaalsContact O-CG1 3.22Å; A319-I323 WeakPolarHBondContact O-CG1 3.16Å; A319-I323 PolarHBondContact O-N 3.02Å
320	V	85.8	Confident	81.1	Confident	104 Å²	104	75.4 Å²	75.4	63%	0.63	50%	0.497	S	S	*	.	H	α-helix	trans	-63.3	-42.5	177.3	173.4	0	0	0	0	111.4	A316 V317 L318 I323 G324	A316-V320 WeakPolarHBondContact O-CG2 3.45Å; A316-V320 PolarHBondContact O-N 3.3Å; A316-V320 VanDerWaalsContact O-N 3.08Å; V317-V320 PolarHBondContact O-N 2.89Å; L318-V320 PolarHBondContact O-N 3.39Å; V320-I323 PolarHBondContact O-N 2.87Å; V320-G324 PolarHBondContact O-N 2.95Å
321	V	87.1	Confident	81.4	Confident	94 Å²	94	79.6 Å²	79.6	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-63.5	-44.2	177.8	172.2	0	0	0	0	111.2	V317 L318 A319 G324 A325	V317-V321 HydrophobicContact CG1-CG2 4.45Å; V317-V321 WeakPolarHBondContact O-CG2 3.45Å; V317-V321 PolarHBondContact O-N 2.9Å; L318-V321 PolarHBondContact O-N 3.22Å; A319-V321 PolarHBondContact O-N 3.12Å; V321-G324 PolarHBondContact O-N 2.91Å; V321-A325 WeakPolarHBondContact O-CB 3.42Å; V321-A325 PolarHBondContact O-N 3.44Å
322	V	85.3	Confident	81	Confident	83 Å²	83	79.3 Å²	79.3	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-45.4	178.4	172.4	0	0	0	0	110.9	L318 A319 G324 A325 V326	L318-V322 VanDerWaalsContact O-CG2 3.28Å; L318-V322 WeakPolarHBondContact O-CG2 3.4Å; L318-V322 PolarHBondContact O-N 2.93Å; A319-V322 PolarHBondContact O-N 3.26Å; V322-G324 VanDerWaalsContact C-N 3.34Å; V322-G324 PolarHBondContact O-N 2.93Å; V322-A325 PolarHBondContact O-N 3.42Å; V322-V326 HydrophobicContact CG1-CG2 4.46Å; V322-V326 VanDerWaalsContact O-CG2 3.29Å; V322-V326 WeakPolarHBondContact O-CG2 3.36Å; V322-V326 PolarHBondContact O-N 3.22Å
323	I	84.1	Confident	80.5	Confident	110 Å²	110	84.4 Å²	84.4	56%	0.564	52%	0.522	S	S	*	.	H	α-helix	trans	-61.2	-45.1	176.7	-67.3	165.3	0	0	0	110.3	A319 V320 A325 V326 V327	A319-I323 WeakPolarHBondContact O-CB 3.33Å; A319-I323 WeakPolarHBondContact O-CD1 3.42Å; A319-I323 VanDerWaalsContact O-CG1 3.22Å; A319-I323 WeakPolarHBondContact O-CG1 3.16Å; A319-I323 PolarHBondContact O-N 3.02Å; V320-I323 PolarHBondContact O-N 2.87Å; I323-A325 PolarHBondContact O-N 3.01Å; I323-V326 PolarHBondContact O-N 3.43Å; I323-V327 HydrophobicContact CG2-CG2 4.4Å; I323-V327 VanDerWaalsContact O-CG2 3.31Å; I323-V327 WeakPolarHBondContact O-CG2 3.36Å; I323-V327 PolarHBondContact O-N 3.27Å
324	G	83.8	Confident	79.6	Confident	42 Å²	42	91.6 Å²	91.6	43%	0.433	54%	0.538	S	S	.	.	H	α-helix	trans	-58.9	-44.2	176.2	0	0	0	0	0	112.9	V320 V321 V322 V327 A328	V320-G324 PolarHBondContact O-N 2.95Å; V321-G324 PolarHBondContact O-N 2.91Å; V322-G324 VanDerWaalsContact C-N 3.34Å; V322-G324 PolarHBondContact O-N 2.93Å; G324-V327 PolarHBondContact O-N 2.97Å; G324-A328 WeakPolarHBondContact O-CB 3.17Å; G324-A328 PolarHBondContact O-N 3.24Å
325	A	82	Confident	78.1	Confident	58 Å²	58	99 Å²	99	48%	0.479	56%	0.559	S	S	.	*	H	α-helix	trans	-64.9	-41.2	177.7	0	0	0	0	0	112.4	V321 V322 I323 A328 A329	V321-A325 WeakPolarHBondContact O-CB 3.42Å; V321-A325 PolarHBondContact O-N 3.44Å; V322-A325 PolarHBondContact O-N 3.42Å; I323-A325 PolarHBondContact O-N 3.01Å; A325-A328 PolarHBondContact O-N 3.21Å; A325-A329 WeakPolarHBondContact O-CB 3.43Å; A325-A329 PolarHBondContact O-N 3.01Å
326	V	83.1	Confident	76.6	Confident	86 Å²	86	98.2 Å²	98.2	52%	0.521	56%	0.564	S	S	.	*	H	α-helix	trans	-64.7	-45.4	176.5	171.9	0	0	0	0	110.8	V322 I323 A328 A329 V330	V322-V326 HydrophobicContact CG1-CG2 4.46Å; V322-V326 VanDerWaalsContact O-CG2 3.29Å; V322-V326 WeakPolarHBondContact O-CG2 3.36Å; V322-V326 PolarHBondContact O-N 3.22Å; I323-V326 PolarHBondContact O-N 3.43Å; V326-A328 PolarHBondContact O-N 2.66Å; V326-A329 PolarHBondContact O-N 3.37Å; V326-V330 HydrophobicContact CG1-CG2 4.4Å; V326-V330 WeakPolarHBondContact O-CB 3.48Å; V326-V330 VanDerWaalsContact O-CG2 3.29Å; V326-V330 WeakPolarHBondContact O-CG2 3.48Å; V326-V330 PolarHBondContact O-N 3.27Å
327	V	81.5	Confident	75	Confident	77 Å²	77	100.3 Å²	100.3	47%	0.467	58%	0.575	S	S	.	*	H	α-helix	trans	-61.9	-44.8	177.2	172.5	0	0	0	0	110.9	I323 G324 A329 V330 M331	I323-V327 HydrophobicContact CG2-CG2 4.4Å; I323-V327 VanDerWaalsContact O-CG2 3.31Å; I323-V327 WeakPolarHBondContact O-CG2 3.36Å; I323-V327 PolarHBondContact O-N 3.27Å; G324-V327 PolarHBondContact O-N 2.97Å; V327-A329 PolarHBondContact O-N 2.69Å; V327-V330 PolarHBondContact O-N 3.49Å; V327-M331 HydrophobicContact CG1-CG 4.48Å; V327-M331 HydrophobicContact CG1-SD 4.18Å; V327-M331 WeakPolarHBondContact O-CB 3.28Å; V327-M331 WeakPolarHBondContact O-CG 3.23Å; V327-M331 PolarHBondContact O-N 2.87Å
328	A	76.6	Confident	73.1	Confident	52 Å²	52	99.3 Å²	99.3	43%	0.43	58%	0.584	S	S	.	*	H	α-helix	trans	-60.8	-44.5	176.1	0	0	0	0	0	112	G324 A325 V326 V330 M331 C332	G324-A328 WeakPolarHBondContact O-CB 3.17Å; G324-A328 PolarHBondContact O-N 3.24Å; A325-A328 PolarHBondContact O-N 3.21Å; V326-A328 PolarHBondContact O-N 2.66Å; A328-V330 PolarHBondContact O-N 2.93Å; A328-M331 PolarHBondContact O-N 2.88Å; A328-C332 WeakPolarHBondContact O-CB 3.33Å; A328-C332 PolarHBondContact O-N 3.21Å; A328-C332 PolarHBondContact O-SG 2.94Å
329	A	75.8	Confident	71.2	Confident	56 Å²	56	97.4 Å²	97.4	46%	0.463	59%	0.59	S	S	.	*	H	α-helix	trans	-63.6	-41	177.2	0	0	0	0	0	112.5	A325 V326 V327 C332 R333	A325-A329 WeakPolarHBondContact O-CB 3.43Å; A325-A329 PolarHBondContact O-N 3.01Å; V326-A329 PolarHBondContact O-N 3.37Å; V327-A329 PolarHBondContact O-N 2.69Å; A329-C332 PolarHBondContact O-N 3.38Å; A329-R333 WeakPolarHBondContact O-CB 3.4Å; A329-R333 PolarHBondContact O-N 2.96Å
330	V	75.1	Confident	68.9	Low	83 Å²	83	105.3 Å²	105.3	50%	0.503	62%	0.615	S	S	.	*	H	α-helix	trans	-66.2	-41.6	176.1	170.6	0	0	0	0	111.1	V326 V327 A328 R333 R334	V326-V330 HydrophobicContact CG1-CG2 4.4Å; V326-V330 WeakPolarHBondContact O-CB 3.48Å; V326-V330 VanDerWaalsContact O-CG2 3.29Å; V326-V330 WeakPolarHBondContact O-CG2 3.48Å; V326-V330 PolarHBondContact O-N 3.27Å; V327-V330 PolarHBondContact O-N 3.49Å; A328-V330 PolarHBondContact O-N 2.93Å; V330-R333 PolarHBondContact O-N 2.91Å; V330-R334 PolarHBondContact O-N 2.73Å
331	M	73	Confident	66.6	Low	132 Å²	132	104.1 Å²	104.1	65%	0.65	63%	0.625	S	S	*	*	H	α-helix	trans	-65.2	-41.4	175.5	-74	-174.8	67.9	0	0	112.2	V327 A328 R334 K335	V327-M331 HydrophobicContact CG1-CG 4.48Å; V327-M331 HydrophobicContact CG1-SD 4.18Å; V327-M331 WeakPolarHBondContact O-CB 3.28Å; V327-M331 WeakPolarHBondContact O-CG 3.23Å; V327-M331 PolarHBondContact O-N 2.87Å; A328-M331 PolarHBondContact O-N 2.88Å; M331-R334 PolarHBondContact O-N 2.75Å; M331-K335 WeakPolarHBondContact O-CB 3.18Å; M331-K335 PolarHBondContact O-N 3.24Å
332	C	67	Low	64.1	Low	91 Å²	91	103.6 Å²	103.6	62%	0.615	64%	0.638	S	S	*	*	H	α-helix	trans	-61	-43.4	172.7	-78.7	0	0	0	0	111.6	A328 A329 K335 S336	A328-C332 WeakPolarHBondContact O-CB 3.33Å; A328-C332 PolarHBondContact O-N 3.21Å; A328-C332 PolarHBondContact O-SG 2.94Å; A329-C332 PolarHBondContact O-N 3.38Å; C332-K335 PolarHBondContact O-N 2.72Å; C332-S336 PolarHBondContact O-N 3.44Å; C332-S336 VanDerWaalsContact O-N 3.13Å; C332-S336 PolarHBondContact O-OG 2.91Å
333	R	64.5	Low	61.5	Low	199 Å²	199	105.5 Å²	105.5	75%	0.751	66%	0.655	S	S	*	*	H	α-helix	trans	-64.7	-40	176.1	-82.5	-171.1	167.2	-173.9	-2.3	113.1	A329 V330 K335 S336 S337	A329-R333 WeakPolarHBondContact O-CB 3.4Å; A329-R333 PolarHBondContact O-N 2.96Å; V330-R333 PolarHBondContact O-N 2.91Å; R333-K335 VanDerWaalsContact C-N 3.29Å; R333-K335 PolarHBondContact O-N 3.3Å; R333-S336 WeakPolarHBondContact CA-OG 3.24Å; R333-S336 PolarHBondContact O-N 2.87Å; R333-S336 PolarHBondContact O-OG 3.04Å; R333-S337 PolarHBondContact O-N 3.25Å
334	R	57.9	Low	59.2	Low	203 Å²	203	109.9 Å²	109.9	77%	0.766	67%	0.666	S	S	*	*	H	α-helix	trans	-65.4	-31.2	174.6	-107.1	-175.7	171.4	-179.9	-1.7	112.7	V330 M331 S337	V330-R334 PolarHBondContact O-N 2.73Å; M331-R334 PolarHBondContact O-N 2.75Å; R334-S337 PolarHBondContact O-OG 3.17Å
335	K	52.4	Low	56.8	Low	192 Å²	192	114.1 Å²	114.1	84%	0.835	69%	0.689	S	S	*	*	H	α-helix	trans	-77.1	-24.6	176.9	-159.7	169	-178.6	177.8	0	112.8	M331 C332 R333	M331-K335 WeakPolarHBondContact O-CB 3.18Å; M331-K335 PolarHBondContact O-N 3.24Å; C332-K335 PolarHBondContact O-N 2.72Å; R333-K335 VanDerWaalsContact C-N 3.29Å; R333-K335 PolarHBondContact O-N 3.3Å
336	S	53	Low	54.7	Low	96 Å²	96	119.8 Å²	119.8	67%	0.671	71%	0.706	S	S	*	*	H	α-helix	trans	-86.8	-12.2	175	51.5	0	0	0	0	115.3	C332 R333	C332-S336 PolarHBondContact O-N 3.44Å; C332-S336 VanDerWaalsContact O-N 3.13Å; C332-S336 PolarHBondContact O-OG 2.91Å; R333-S336 WeakPolarHBondContact CA-OG 3.24Å; R333-S336 PolarHBondContact O-N 2.87Å; R333-S336 PolarHBondContact O-OG 3.04Å
337	S	50.4	Low	52.3	Low	96 Å²	96	120 Å²	120	67%	0.671	72%	0.716	S	S	*	*	S	Bend	trans	-97.2	8.2	-177.5	69.1	0	0	0	0	114.7	R333 R334	R333-S337 PolarHBondContact O-N 3.25Å; R334-S337 PolarHBondContact O-OG 3.17Å
338	G	46.7	Very low	50.1	Low	75 Å²	75	121 Å²	121	77%	0.773	73%	0.733	S	S	*	*	S	Bend	trans	-103.6	69.9	176.6	0	0	0	0	0	112.6
339	G	46	Very low	47.9	Very low	67 Å²	67	123.9 Å²	123.9	69%	0.691	75%	0.749	S	S	*	*			trans	158	96.6	165.1	0	0	0	0	0	117.3
340	K	36.8	Very low	46	Very low	215 Å²	215	127 Å²	127	94%	0.935	77%	0.766	S	S	*	*			trans	150.3	118.8	146.7	-90.8	165.6	172.2	172.5	0	108.2
341	G	37	Very low	44.1	Very low	80 Å²	80	130 Å²	130	83%	0.825	78%	0.78	S	S	*	*			cis	92.2	96.8	36.8	0	0	0	0	0	108.3
342	G	34.1	Very low	42.7	Very low	83 Å²	83	129.9 Å²	129.9	86%	0.856	79%	0.792	S	S	*	*			trans	-79.2	179.2	-160.1	0	0	0	0	0	118.4
343	S	31.3	Very low	41.3	Very low	123 Å²	123	130 Å²	130	86%	0.86	80%	0.8	S	S	*	*			trans	178.1	152.3	133.8	-169.4	0	0	0	0	111.1
344	Y	34.8	Very low	40.1	Very low	202 Å²	202	130.2 Å²	130.2	79%	0.792	81%	0.809	S	S	*	*			trans	-59.3	155.1	-177.8	-89.8	-109.9	0	0	0	116.1
345	S	34.6	Very low	39	Very low	131 Å²	131	123.7 Å²	123.7	92%	0.916	81%	0.805	S	S	*	*			trans	-159.2	132.9	135.8	-67.4	0	0	0	0	110.6
346	Q	36.3	Very low	38.3	Very low	177 Å²	177	119.9 Å²	119.9	83%	0.827	80%	0.802	S	S	*	*			trans	-112.3	137.5	-175.6	176.3	-178.6	2.5	0	0	109.7
347	A	33.6	Very low	37.6	Very low	90 Å²	90	122.6 Å²	122.6	74%	0.744	81%	0.809	S	S	*	*			trans	179.5	109.6	148.5	0	0	0	0	0	106.9
348	A	34.5	Very low	37.2	Very low	99 Å²	99	124 Å²	124	82%	0.818	81%	0.814	S	S	*	*				54.1	129.9	78.7	0	0	0	0	0	112.1
349	C	31.2	Very low	36.9	Very low	112 Å²	112	124.9 Å²	124.9	76%	0.757	81%	0.808	S	S	*	*			cis	-171.5	149.2	7.6	-172.7	0	0	0	0	106.8
350	S	35.5	Very low	36.6	Very low	120 Å²	120	129.1 Å²	129.1	84%	0.839	81%	0.814	S	S	*	*				166.7	136.8	123.4	42.4	0	0	0	0	113.4
351	D	36.5	Very low	36.7	Very low	148 Å²	148	124.8 Å²	124.8	79%	0.791	81%	0.805	S	S	*	*			trans	-63.5	153.3	-175.7	-65.6	-56.8	0	0	0	115.5
352	S	42	Very low	36.7	Very low	129 Å²	129	129.1 Å²	129.1	90%	0.902	83%	0.834	S	S	*	*				-160.7	137.6	123.5	-5.4	0	0	0	0	111.3
353	A	38.1	Very low	36.8	Very low	94 Å²	94	131.5 Å²	131.5	78%	0.777	83%	0.833	S	S	*	*			trans	-85.8	155.4	-174.9	0	0	0	0	0	113.9
354	Q	39.6	Very low	37.1	Very low	203 Å²	203	131.9 Å²	131.9	95%	0.949	83%	0.831	S	S	*	*			trans	140.7	133.9	155.8	-86.9	172.9	-7.7	0	0	107.1
355	G	34	Very low	37.3	Very low	65 Å²	65	128 Å²	128	67%	0.67	83%	0.834	S	S	*	*			cis	173.3	144.3	6.5	0	0	0	0	0	106.8
356	S	37.4	Very low	37.4	Very low	112 Å²	112	127.8 Å²	127.8	78%	0.783	83%	0.829	S	S	*	*			trans	48.9	116.9	145.4	-41.3	0	0	0	0	122.3
357	D	39.6	Very low	37.5	Very low	153 Å²	153	124.8 Å²	124.8	82%	0.818	83%	0.829	S	S	*	*				78.3	146.3	123.2	-70.5	-31.1	0	0	0	124.9
358	V	41	Very low	37.8	Very low	126 Å²	126	127.1 Å²	127.1	76%	0.764	83%	0.834	S	S	*	*			trans	103.7	86.8	151.8	-164.3	0	0	0	0	118.1
359	S	41.6	Very low	38	Very low	93 Å²	93	129.1 Å²	129.1	65%	0.65	84%	0.836	S	S	*	*				30.3	138.1	109.9	-41.3	0	0	0	0	122.6
360	L	40	Very low	38.5	Very low	157 Å²	157	130.4 Å²	130.4	82%	0.822	84%	0.842	S	S	*	*			trans	72	141.7	147.3	-64	156.3	0	0	0	116
361	T	37.6	Very low	38.8	Very low	123 Å²	123	131.3 Å²	131.3	76%	0.755	84%	0.842	S	S	*	*			cis	-172.6	155.7	7.8	2.4	0	0	0	0	107.1
362	A	37.8	Very low	39	Very low	172 Å²	172	129.7 Å²	129.7	100%	1.421	85%	0.846	S	S	*	*			trans	-134.7	0	137.3	0	0	0	0	0	107.5

Retrieved 362 of 362 residues in 83.4 ms (Link to these results)

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