A0A096MSC0_PAPAN Loading...

Nyctalopin

AlphaFold DB , UniProt , Accession A0A096MSC0, Species PAPAN (Papio anubis, Olive baboon), Gene NYX, Length 481 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	43.2	Very low	37	Very low	242 Å²	242	159.5 Å²	159.5	100%	1.192	85%	0.853	S	S	*	*				0	108.3	0	-70.3	164.6	86.9	0	0	109.6
2	K	36.8	Very low	36.9	Very low	222 Å²	222	160.1 Å²	160.1	97%	0.965	85%	0.846	S	S	*	*			trans	-175.2	124.3	143.3	-106.6	171.6	-178.8	178.6	0	107.7
3	G	36	Very low	37.1	Very low	79 Å²	79	156.2 Å²	156.2	81%	0.814	83%	0.832	S	S	*	*			trans	-76.8	154.8	-158.3	0	0	0	0	0	115.1
4	R	42.5	Very low	37.2	Very low	261 Å²	261	153.4 Å²	153.4	99%	0.985	82%	0.823	S	S	*	*			trans	-69.4	118.8	169.6	-72	171.8	160.2	175	-6.8	109.5
5	G	34.8	Very low	37.4	Very low	81 Å²	81	151.3 Å²	151.3	84%	0.835	82%	0.818	S	S	*	*			trans	-103.5	103.8	167.1	0	0	0	0	0	109.8
6	M	35.8	Very low	37.5	Very low	173 Å²	173	151.6 Å²	151.6	85%	0.852	82%	0.817	S	S	*	*			trans	-83.9	113	172.6	-174.9	160.4	67.4	0	0	108.2	V8	M6-V8 PolarHBondContact O-N 2.93Å
7	L	33.4	Very low	37.5	Very low	159 Å²	159	146.6 Å²	146.6	83%	0.832	81%	0.81	S	S	*	*			trans	-78	105.1	178.1	-160.4	83.1	0	0	0	108.9
8	V	37.4	Very low	37.7	Very low	107 Å²	107	147.3 Å²	147.3	65%	0.648	81%	0.811	S	S	*	*			trans	-87	111.3	173.8	176.5	0	0	0	0	108.4	M6 L10	M6-V8 PolarHBondContact O-N 2.93Å; V8-L10 PolarHBondContact O-N 3.12Å
9	L	35.9	Very low	37.8	Very low	143 Å²	143	145.8 Å²	145.8	75%	0.749	81%	0.809	S	S	*	*			trans	-74.5	105.4	169.9	-124.9	92.8	0	0	0	108.6	L11	L9-L11 PolarHBondContact O-N 3.42Å
10	L	35.8	Very low	37.9	Very low	146 Å²	146	150.7 Å²	150.7	76%	0.764	82%	0.815	S	S	*	*			trans	-78.7	99.6	170.7	-85.6	156.7	0	0	0	109.3	V8 H12	V8-L10 PolarHBondContact O-N 3.12Å; L10-H12 PolarHBondContact O-N 3.04Å
11	L	35.4	Very low	38.1	Very low	142 Å²	142	148 Å²	148	74%	0.743	81%	0.813	S	S	*	*			trans	-68.8	107.3	167.6	-129.1	95.6	0	0	0	108.5	L9 V13	L9-L11 PolarHBondContact O-N 3.42Å; L11-V13 PolarHBondContact O-N 2.8Å
12	H	35.6	Very low	38.2	Very low	166 Å²	166	147.4 Å²	147.4	77%	0.769	80%	0.798	S	S	*	*			trans	-72.8	94.8	168.1	-83.9	14.5	0	0	0	109.5	L10 V14	L10-H12 PolarHBondContact O-N 3.04Å; H12-V14 PolarHBondContact O-N 3.36Å; H12-V14 VanDerWaalsContact O-N 3.11Å
13	V	39.3	Very low	38.6	Very low	109 Å²	109	140.3 Å²	140.3	66%	0.661	78%	0.781	S	S	*	*			trans	-72.1	99	165.4	179.3	0	0	0	0	107.6	L11 V15	L11-V13 PolarHBondContact O-N 2.8Å; V13-V15 HydrophobicContact CG1-CG2 3.94Å; V13-V15 PolarHBondContact O-N 2.62Å
14	V	38.5	Very low	39.3	Very low	118 Å²	118	144.1 Å²	144.1	72%	0.715	79%	0.787	S	S	*	*			trans	-69.5	97.2	165.3	178.6	0	0	0	0	107.1	H12 L16	H12-V14 PolarHBondContact O-N 3.36Å; H12-V14 VanDerWaalsContact O-N 3.11Å; V14-L16 VanDerWaalsContact C-N 3.3Å; V14-L16 HydrophobicContact CG1-CG 4.31Å; V14-L16 PolarHBondContact O-N 2.86Å
15	V	40.8	Very low	40	Very low	122 Å²	122	133.2 Å²	133.2	74%	0.739	76%	0.757	S	S	*	*			trans	-72.6	90.5	168.5	-179.3	0	0	0	0	107.1	V13 G17	V13-V15 HydrophobicContact CG1-CG2 3.94Å; V13-V15 PolarHBondContact O-N 2.62Å; V15-G17 PolarHBondContact O-N 3.35Å
16	L	39.7	Very low	41.6	Very low	155 Å²	155	133.3 Å²	133.3	81%	0.812	75%	0.745	S	S	*	*			trans	-60.5	102.6	162.6	-80.4	160.8	0	0	0	107.2	V14 L18	V14-L16 VanDerWaalsContact C-N 3.3Å; V14-L16 HydrophobicContact CG1-CG 4.31Å; V14-L16 PolarHBondContact O-N 2.86Å; L16-L18 PolarHBondContact O-N 3.35Å
17	G	37.5	Very low	43.5	Very low	68 Å²	68	126.4 Å²	126.4	70%	0.701	71%	0.713	S	S	*	*			trans	-61.4	99.1	174.2	0	0	0	0	0	109.6	V15	V15-G17 PolarHBondContact O-N 3.35Å
18	L	40.1	Very low	45.5	Very low	158 Å²	158	120 Å²	120	83%	0.827	68%	0.683	S	S	*	*			trans	-54.3	132.1	161.6	-77	159.4	0	0	0	107.3	L16 R20	L16-L18 PolarHBondContact O-N 3.35Å; L18-R20 PolarHBondContact O-N 3.35Å; L18-R20 VanDerWaalsContact O-N 3.11Å
19	P	40.5	Very low	47.3	Very low	119 Å²	119	125.6 Å²	125.6	77%	0.773	69%	0.693	S	S	*	*			trans	-55.3	127.3	171.5	23.6	-30.5	0	0	0	106.7	A21	P19-A21 VanDerWaalsContact C-N 3.28Å; P19-A21 PolarHBondContact O-N 3.46Å
20	R	40	Very low	49.7	Very low	244 Å²	244	120.8 Å²	120.8	92%	0.921	67%	0.673	S	S	*	*			trans	-51.6	98.8	172.2	-86.1	179.9	168.4	170.2	-2.7	107.3	L18 R22	L18-R20 PolarHBondContact O-N 3.35Å; L18-R20 VanDerWaalsContact O-N 3.11Å; R20-R22 VanDerWaalsContact C-N 3.33Å; R20-R22 PolarHBondContact O-N 2.68Å
21	A	41	Very low	52.3	Low	95 Å²	95	116.5 Å²	116.5	79%	0.785	66%	0.655	S	S	*	*			trans	-59.3	104.7	165.4	0	0	0	0	0	104.9	P19 A23	P19-A21 VanDerWaalsContact C-N 3.28Å; P19-A21 PolarHBondContact O-N 3.46Å; A21-A23 PolarHBondContact O-N 3.06Å
22	R	45	Very low	55.1	Low	229 Å²	229	110.4 Å²	110.4	86%	0.864	62%	0.624	S	S	*	*			trans	-53.6	119.6	170.3	-78.5	-177.6	174.2	169	-1.1	105.5	R20 V24	R20-R22 VanDerWaalsContact C-N 3.33Å; R20-R22 PolarHBondContact O-N 2.68Å; R22-V24 PolarHBondContact O-N 2.87Å
23	A	46.4	Very low	57.8	Low	73 Å²	73	108 Å²	108	60%	0.603	63%	0.633	S	S	*	*			trans	-52.5	120.5	173	0	0	0	0	0	107.6	A21 G25 S26	A21-A23 PolarHBondContact O-N 3.06Å; A23-G25 PolarHBondContact O-N 3.48Å; A23-S26 PolarHBondContact O-N 3.15Å; A23-S26 VanDerWaalsContact O-N 3.07Å
24	V	49.1	Very low	60.4	Low	158 Å²	158	105.4 Å²	105.4	96%	0.958	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	113	178.1	176.8	0	0	0	0	107.6	R22	R22-V24 PolarHBondContact O-N 2.87Å
25	G	58.1	Low	63.1	Low	33 Å²	33	100.8 Å²	100.8	34%	0.34	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	98.9	17.1	-179.4	0	0	0	0	0	117	A23 T84	A23-G25 PolarHBondContact O-N 3.48Å; G25-T84 VanDerWaalsContact O-CB 3.27Å; G25-T84 WeakPolarHBondContact O-CB 2.96Å; G25-T84 PolarHBondContact O-N 3.19Å; G25-T84 VanDerWaalsContact O-N 3.17Å; G25-T84 PolarHBondContact O-OG1 3Å
26	S	67.8	Low	65.7	Low	83 Å²	83	97.5 Å²	97.5	58%	0.58	58%	0.581	S	S	*	*	B	Isolated β-bridge	trans	-79.2	137.4	167.3	-167.3	0	0	0	0	111.2	A23	A23-S26 PolarHBondContact O-N 3.15Å; A23-S26 VanDerWaalsContact O-N 3.07Å
27	C	76.8	Confident	68.3	Low	27 Å²	27	92.2 Å²	92.2	18%	0.182	56%	0.557	C	S	.	*	P	Polyproline II helix	trans	-62.1	147.9	175.3	51.3	0	0	0	0	111.9	C62 T84 L85	C27-C62 VanDerWaalsContact C-SG 3.5Å; C27-C62 HydrophobicContact CB-CB 3.99Å; C27-C62 WeakPolarHBondContact CB-SG 3.44Å; C27-C62 PolarHBondContact O-SG 2.9Å; C27-C62 WeakPolarHBondContact SG-CA 3.09Å; C27-C62 WeakPolarHBondContact SG-CB 3.26Å; C27-C62 CovalentContact SG-SG 2.03Å; C27-C62 PolarHBondContact SG-SG 2.87Å; C27-T84 WeakPolarHBondContact CB-O 3.48Å; C27-L85 HydrophobicContact CB-CD2 3.86Å
28	A	74.8	Confident	70.9	Confident	26 Å²	26	91.6 Å²	91.6	22%	0.215	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-100.7	144.2	175.8	0	0	0	0	0	109.9	A30 D59 F60 P61	A28-A30 HydrophobicContact CB-CB 4.35Å; A28-A30 PolarHBondContact O-N 3.41Å; A28-D59 HydrophobicContact CB-CB 3.98Å; A28-F60 PolarHBondContact N-O 3.18Å; A28-F60 CarbonylContact O-C 3.27Å; A28-F60 VanDerWaalsContact O-C 3.27Å; A28-P61 WeakPolarHBondContact O-CA 2.98Å
29	R	75.1	Confident	73.1	Confident	223 Å²	223	89.3 Å²	89.3	84%	0.842	54%	0.535	S	S	*	.	S	Bend	trans	-77.4	50.9	170.9	-70.5	-174.3	176.7	164.4	-1.6	111.4
30	A	86.1	Confident	74.7	Confident	42 Å²	42	88.2 Å²	88.2	35%	0.347	53%	0.526	S	S	.	.			trans	-131.7	136	-176.7	0	0	0	0	0	110	A28 P61	A28-A30 HydrophobicContact CB-CB 4.35Å; A28-A30 PolarHBondContact O-N 3.41Å; A30-P61 WeakPolarHBondContact O-CD 3.17Å; A30-P61 WeakPolarHBondContact O-CG 3.07Å
31	C	91.5	Very high	76.1	Confident	57 Å²	57	86.1 Å²	86.1	39%	0.385	53%	0.526	S	S	.	.			trans	-78.2	132.1	168.9	-167.2	0	0	0	0	109.2	A33 C35 C37	C31-A33 PolarHBondContact O-N 3.16Å; C31-C35 PolarHBondContact SG-O 2.79Å; C31-C37 WeakPolarHBondContact CA-SG 3.44Å; C31-C37 HydrophobicContact CB-CB 3.72Å; C31-C37 WeakPolarHBondContact CB-SG 3.41Å; C31-C37 WeakPolarHBondContact SG-CB 3.43Å; C31-C37 PolarHBondContact SG-N 3.11Å; C31-C37 CovalentContact SG-SG 2.03Å; C31-C37 PolarHBondContact SG-SG 3.01Å
32	P	93.8	Very high	77.5	Confident	13 Å²	13	92.7 Å²	92.7	8%	0.084	53%	0.531	C	S	.	.			trans	-59.4	138.2	174.1	-1.5	2.8	0	0	0	111.3	A34 C35 V46 P57 D59 F60	P32-A34 PolarHBondContact O-N 2.83Å; P32-A34 VanDerWaalsContact O-N 3.14Å; P32-C35 HydrophobicContact CB-CB 4.14Å; P32-C35 HydrophobicContact CG-CB 3.97Å; P32-C35 WeakPolarHBondContact O-CA 3.43Å; P32-C35 WeakPolarHBondContact O-CB 3.43Å; P32-C35 PolarHBondContact O-N 2.79Å; P32-V46 HydrophobicContact CG-CG1 4.34Å; P32-P57 HydrophobicContact CB-CB 3.71Å; P32-P57 HydrophobicContact CB-CG 4.06Å; P32-P57 HydrophobicContact CG-CB 4.07Å; P32-P57 HydrophobicContact CG-CG 4.36Å; P32-D59 VanDerWaalsContact CG-O 3.3Å; P32-D59 WeakPolarHBondContact CG-O 2.99Å; P32-F60 HydrophobicContact CG-CD1 3.92Å; P32-F60 HydrophobicContact CG-CE1 4Å
33	A	92.3	Very high	79.3	Confident	115 Å²	115	83 Å²	83	95%	0.95	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.4	-171.9	0	0	0	0	0	114.5	C31 C35	C31-A33 PolarHBondContact O-N 3.16Å; A33-C35 VanDerWaalsContact C-N 3.25Å; A33-C35 PolarHBondContact O-N 3.26Å
34	A	93.9	Very high	81.5	Confident	56 Å²	56	79.7 Å²	79.7	46%	0.463	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	6.3	177.8	0	0	0	0	0	113.4	P32 A51 L53	P32-A34 PolarHBondContact O-N 2.83Å; P32-A34 VanDerWaalsContact O-N 3.14Å; A34-A51 HydrophobicContact CB-CB 4.38Å; A34-A51 WeakPolarHBondContact O-CB 3.32Å; A34-L53 HydrophobicContact CB-CD2 3.9Å
35	C	95.7	Very high	83.7	Confident	21 Å²	21	74 Å²	74	14%	0.142	44%	0.442	C	S	.	.	S	Bend	trans	-126.9	155.2	-171.3	-55.1	0	0	0	0	111.8	C31 P32 A33 V46 R47 C48	C31-C35 PolarHBondContact SG-O 2.79Å; P32-C35 HydrophobicContact CB-CB 4.14Å; P32-C35 HydrophobicContact CG-CB 3.97Å; P32-C35 WeakPolarHBondContact O-CA 3.43Å; P32-C35 WeakPolarHBondContact O-CB 3.43Å; P32-C35 PolarHBondContact O-N 2.79Å; A33-C35 VanDerWaalsContact C-N 3.25Å; A33-C35 PolarHBondContact O-N 3.26Å; C35-V46 HydrophobicContact CB-CG1 4.06Å; C35-R47 CarbonylContact C-O 3.5Å; C35-R47 VanDerWaalsContact CA-O 3.28Å; C35-R47 WeakPolarHBondContact CA-O 3.29Å; C35-R47 WeakPolarHBondContact CB-O 3.37Å; C35-C48 HydrophobicContact CB-CB 4.05Å; C35-C48 WeakPolarHBondContact CB-SG 3.49Å; C35-C48 WeakPolarHBondContact SG-CB 3.46Å; C35-C48 CovalentContact SG-SG 2.02Å; C35-C48 PolarHBondContact SG-SG 3.03Å
36	A	95.5	Very high	85.5	Confident	52 Å²	52	72.4 Å²	72.4	43%	0.43	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.8	170.8	0	0	0	0	0	109.9	R47	A36-R47 PolarHBondContact N-O 3.29Å; A36-R47 PolarHBondContact O-N 2.91Å
37	C	94.3	Very high	87	Confident	45 Å²	45	75.4 Å²	75.4	30%	0.304	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.1	175.4	-59.9	0	0	0	0	110.1	C31 S45	C31-C37 WeakPolarHBondContact CA-SG 3.44Å; C31-C37 HydrophobicContact CB-CB 3.72Å; C31-C37 WeakPolarHBondContact CB-SG 3.41Å; C31-C37 WeakPolarHBondContact SG-CB 3.43Å; C31-C37 PolarHBondContact SG-N 3.11Å; C31-C37 CovalentContact SG-SG 2.03Å; C31-C37 PolarHBondContact SG-SG 3.01Å; C37-S45 WeakPolarHBondContact CA-O 3.2Å
38	S	91.8	Very high	87.9	Confident	54 Å²	54	74.2 Å²	74.2	38%	0.378	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.3	174.8	178.2	0	0	0	0	109.3	C44 S45	S38-C44 CarbonylContact O-C 3.6Å; S38-C44 WeakPolarHBondContact O-CA 3.34Å; S38-S45 PolarHBondContact N-O 3.24Å; S38-S45 PolarHBondContact O-N 3.48Å
39	T	85.1	Confident	89	Confident	111 Å²	111	75.3 Å²	75.3	68%	0.681	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	113.8	171.9	48.6	0	0	0	0	108.9	C44	T39-C44 HydrophobicContact CG2-CB 4.26Å
40	V	75.1	Confident	90.1	Very high	96 Å²	96	71.9 Å²	71.9	58%	0.582	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	164.2	173.5	-169.1	0	0	0	0	107.7	R42 G43	V40-R42 PolarHBondContact O-N 3.05Å; V40-G43 PolarHBondContact N-O 3.37Å; V40-G43 VanDerWaalsContact N-O 3.12Å; V40-G43 PolarHBondContact O-N 2.8Å
41	E	68.1	Low	90.6	Very high	200 Å²	200	71.8 Å²	71.8	94%	0.935	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-22.9	178.1	-63.8	-179	168.6	0	0	114.6
42	R	70.8	Confident	90.9	Very high	232 Å²	232	71.9 Å²	71.9	88%	0.875	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	13	-178.6	-63.5	-177.6	178.6	164.4	0.4	114.9	V40	V40-R42 PolarHBondContact O-N 3.05Å
43	G	83.9	Confident	91	Very high	27 Å²	27	72.4 Å²	72.4	28%	0.278	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	116.5	-177.6	176.5	0	0	0	0	0	114	V40	V40-G43 PolarHBondContact N-O 3.37Å; V40-G43 VanDerWaalsContact N-O 3.12Å; V40-G43 PolarHBondContact O-N 2.8Å
44	C	92.4	Very high	91.2	Very high	3 Å²	3	73.2 Å²	73.2	2%	0.02	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	130.6	-177.9	-178.2	0	0	0	0	111.4	S38 T39 E63 A64 V65 S66	S38-C44 CarbonylContact O-C 3.6Å; S38-C44 WeakPolarHBondContact O-CA 3.34Å; T39-C44 HydrophobicContact CG2-CB 4.26Å; C44-E63 HydrophobicContact CB-CB 4.46Å; C44-E63 HydrophobicContact CB-CG 3.68Å; C44-E63 PolarHBondContact N-O 3.2Å; C44-E63 VanDerWaalsContact N-O 3.13Å; C44-A64 CarbonylContact O-C 3.57Å; C44-A64 WeakPolarHBondContact O-CA 3.45Å; C44-V65 PolarHBondContact O-N 2.84Å; C44-S66 PolarHBondContact O-N 2.91Å
45	S	95.5	Very high	91.3	Very high	38 Å²	38	80.1 Å²	80.1	27%	0.266	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.2	169.2	-166.8	0	0	0	0	109.6	C37 S38 S66	C37-S45 WeakPolarHBondContact CA-O 3.2Å; S38-S45 PolarHBondContact N-O 3.24Å; S38-S45 PolarHBondContact O-N 3.48Å; S45-S66 PolarHBondContact OG-OG 3.45Å
46	V	96.3	Very high	91.3	Very high	0 Å²	0	80.3 Å²	80.3	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	116.1	179.1	-173.8	0	0	0	0	108.5	P32 C35 F60 P61 A64 S66 I67 D68	P32-V46 HydrophobicContact CG-CG1 4.34Å; C35-V46 HydrophobicContact CB-CG1 4.06Å; V46-F60 HydrophobicContact CG1-CD1 4.18Å; V46-F60 HydrophobicContact CG1-CE1 4.31Å; V46-P61 HydrophobicContact CG2-CG 4.24Å; V46-A64 HydrophobicContact CG2-CB 3.94Å; V46-S66 PolarHBondContact N-O 3.03Å; V46-I67 HydrophobicContact CB-CG1 4.03Å; V46-I67 HydrophobicContact CG2-CG1 4.19Å; V46-I67 WeakPolarHBondContact O-CA 3.49Å; V46-D68 PolarHBondContact O-N 3.01Å
47	R	97.4	Very high	91.2	Very high	145 Å²	145	78.8 Å²	78.8	55%	0.547	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	118.8	175.7	-67.2	-171.9	-68.9	170.5	-2.1	109.9	C35 A36	C35-R47 CarbonylContact C-O 3.5Å; C35-R47 VanDerWaalsContact CA-O 3.28Å; C35-R47 WeakPolarHBondContact CA-O 3.29Å; C35-R47 WeakPolarHBondContact CB-O 3.37Å; A36-R47 PolarHBondContact N-O 3.29Å; A36-R47 PolarHBondContact O-N 2.91Å
48	C	96.9	Very high	90.8	Very high	2 Å²	2	81.4 Å²	81.4	1%	0.014	43%	0.43	C	S	.	.			trans	-128.1	21.8	177.8	-54.3	0	0	0	0	110.4	C35 A51 L53 D68 L69 N72	C35-C48 HydrophobicContact CB-CB 4.05Å; C35-C48 WeakPolarHBondContact CB-SG 3.49Å; C35-C48 WeakPolarHBondContact SG-CB 3.46Å; C35-C48 CovalentContact SG-SG 2.02Å; C35-C48 PolarHBondContact SG-SG 3.03Å; C48-A51 WeakPolarHBondContact O-CB 3.31Å; C48-L53 HydrophobicContact CB-CD1 3.88Å; C48-D68 CarbonylContact C-O 3.46Å; C48-D68 WeakPolarHBondContact CA-O 3.23Å; C48-D68 VanDerWaalsContact CB-O 3.28Å; C48-D68 WeakPolarHBondContact CB-O 3.06Å; C48-D68 PolarHBondContact N-O 3.33Å; C48-L69 HydrophobicContact CB-CD2 3.57Å; C48-L69 HydrophobicContact CB-CG 4.34Å; C48-N72 PolarHBondContact O-ND2 2.86Å
49	D	97.5	Very high	90.5	Very high	50 Å²	50	82.8 Å²	82.8	27%	0.267	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	141.7	-175.7	69.8	-72.6	0	0	0	110.9	A51 D70	D49-A51 PolarHBondContact O-N 3.25Å; D49-D70 WeakPolarHBondContact CA-O 3.29Å; D49-D70 HydrophobicContact CB-CB 4.44Å
50	R	97.4	Very high	90.9	Very high	150 Å²	150	77.8 Å²	77.8	57%	0.566	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	22	-179.8	-53.9	176.3	-179.3	87.4	-11.5	114.9	G52 D70 R71	R50-G52 PolarHBondContact O-N 3.34Å; R50-D70 PolarHBondContact N-O 3.09Å; R50-D70 VanDerWaalsContact N-O 3.07Å; R50-R71 WeakPolarHBondContact CA-O 3.37Å; R50-R71 HydrophobicContact CG-CB 3.73Å; R50-R71 HydrophobicContact CG-CG 4.48Å; R50-R71 VanDerWaalsContact CZ-CD 3.47Å
51	A	97.1	Very high	91.7	Very high	40 Å²	40	73.4 Å²	73.4	33%	0.331	38%	0.376	S	S	.	.	S	Bend	trans	-80.9	5.2	-178.5	0	0	0	0	0	114.2	A34 C48 D49 L53 N72	A34-A51 HydrophobicContact CB-CB 4.38Å; A34-A51 WeakPolarHBondContact O-CB 3.32Å; C48-A51 WeakPolarHBondContact O-CB 3.31Å; D49-A51 PolarHBondContact O-N 3.25Å; A51-L53 VanDerWaalsContact C-N 3.27Å; A51-L53 HydrophobicContact CB-CD1 4.24Å; A51-L53 HydrophobicContact CB-CG 3.94Å; A51-L53 PolarHBondContact O-N 2.81Å; A51-N72 PolarHBondContact N-OD1 2.76Å; A51-N72 VanDerWaalsContact N-OD1 3.15Å
52	G	97.1	Very high	92.8	Very high	60 Å²	60	65.3 Å²	65.3	62%	0.619	34%	0.341	S	S	*	.			trans	69.2	21.9	-179.9	0	0	0	0	0	113.9	R50 L54 N72	R50-G52 PolarHBondContact O-N 3.34Å; G52-L54 PolarHBondContact O-N 2.97Å; G52-N72 PolarHBondContact N-OD1 3.37Å; G52-N72 VanDerWaalsContact N-OD1 3.09Å
53	L	97.3	Very high	93.8	Very high	24 Å²	24	58 Å²	58	13%	0.126	32%	0.317	C	S	.	.			trans	-70.5	127.9	-174.6	-61.7	173.2	0	0	0	111.6	A34 C48 A51 P57 L69 N72 G73 L74	A34-L53 HydrophobicContact CB-CD2 3.9Å; C48-L53 HydrophobicContact CB-CD1 3.88Å; A51-L53 VanDerWaalsContact C-N 3.27Å; A51-L53 HydrophobicContact CB-CD1 4.24Å; A51-L53 HydrophobicContact CB-CG 3.94Å; A51-L53 PolarHBondContact O-N 2.81Å; L53-P57 HydrophobicContact CD1-CG 4.12Å; L53-L69 HydrophobicContact CD1-CD2 3.54Å; L53-N72 HydrophobicContact CB-CB 4.1Å; L53-N72 WeakPolarHBondContact CB-OD1 3.13Å; L53-N72 PolarHBondContact N-OD1 3.05Å; L53-G73 CarbonylContact O-C 3.17Å; L53-G73 VanDerWaalsContact O-C 3.31Å; L53-G73 WeakPolarHBondContact O-CA 3.26Å; L53-G73 PolarHBondContact O-N 2.98Å; L53-L74 HydrophobicContact CB-CD2 4.25Å; L53-L74 PolarHBondContact O-N 2.02Å
54	L	96.6	Very high	94.4	Very high	132 Å²	132	56.7 Å²	56.7	69%	0.691	30%	0.303	S	S	*	.	S	Bend	trans	-97.4	-15.2	173.6	-60.1	-179.9	0	0	0	113	G52	G52-L54 PolarHBondContact O-N 2.97Å
55	R	95.8	Very high	94.6	Very high	201 Å²	201	57.6 Å²	57.6	76%	0.758	31%	0.309	S	S	*	.	S	Bend	trans	-141.9	156.1	178.5	67.1	-175.4	81.1	156.3	4.1	109.7	L74	R55-L74 WeakPolarHBondContact O-CD2 3.48Å
56	V	96.3	Very high	94.6	Very high	24 Å²	24	56.5 Å²	56.5	15%	0.145	30%	0.301	C	S	.	.			trans	-65.9	132.3	173.1	-178.7	0	0	0	0	108.8	F60 L74 L77 A81 F82	V56-F60 HydrophobicContact CG1-CE2 3.67Å; V56-F60 HydrophobicContact CG1-CZ 3.93Å; V56-L74 HydrophobicContact CG2-CD1 4.24Å; V56-L74 HydrophobicContact CG2-CD2 4.48Å; V56-L77 HydrophobicContact CG2-CD2 3.59Å; V56-A81 WeakPolarHBondContact CG1-O 3.49Å; V56-F82 HydrophobicContact CG1-CD1 3.73Å; V56-F82 HydrophobicContact CG1-CE1 3.58Å; V56-F82 HydrophobicContact CG1-CZ 4.31Å; V56-F82 HydrophobicContact CG2-CE1 4.06Å; V56-F82 HydrophobicContact CG2-CZ 4.03Å
57	P	93.6	Very high	94.7	Very high	21 Å²	21	56.7 Å²	56.7	14%	0.136	30%	0.302	C	S	.	.			trans	-55.4	144.9	173	-25.6	32.7	0	0	0	112.8	P32 L53 F60	P32-P57 HydrophobicContact CB-CB 3.71Å; P32-P57 HydrophobicContact CB-CG 4.06Å; P32-P57 HydrophobicContact CG-CB 4.07Å; P32-P57 HydrophobicContact CG-CG 4.36Å; L53-P57 HydrophobicContact CD1-CG 4.12Å; P57-F60 HydrophobicContact CB-CE2 4.4Å; P57-F60 HydrophobicContact CB-CZ 4.11Å; P57-F60 HydrophobicContact CG-CE1 4.48Å; P57-F60 HydrophobicContact CG-CZ 4.09Å; P57-F60 WeakPolarHBondContact O-CE2 3.22Å
58	A	85.8	Confident	94.7	Very high	99 Å²	99	52 Å²	52	82%	0.818	29%	0.288	S	S	*	.	S	Bend	trans	-70.6	-32.3	-176.4	0	0	0	0	0	113.2
59	D	85.6	Confident	94.8	Very high	84 Å²	84	51.9 Å²	51.9	45%	0.449	29%	0.287	S	S	.	.			trans	-121.4	129.4	-170.9	-67.4	-49.9	0	0	0	110.8	A28 P32	A28-D59 HydrophobicContact CB-CB 3.98Å; P32-D59 VanDerWaalsContact CG-O 3.3Å; P32-D59 WeakPolarHBondContact CG-O 2.99Å
60	F	93.1	Very high	94.9	Very high	5 Å²	5	50.5 Å²	50.5	2%	0.022	28%	0.28	C	S	.	.			trans	-131.8	146.6	171.1	-68.9	-80.9	0	0	0	110.3	A28 P32 V46 V56 P57 C62 I67 L69 F82 L85	A28-F60 PolarHBondContact N-O 3.18Å; A28-F60 CarbonylContact O-C 3.27Å; A28-F60 VanDerWaalsContact O-C 3.27Å; P32-F60 HydrophobicContact CG-CD1 3.92Å; P32-F60 HydrophobicContact CG-CE1 4Å; V46-F60 HydrophobicContact CG1-CD1 4.18Å; V46-F60 HydrophobicContact CG1-CE1 4.31Å; V56-F60 HydrophobicContact CG1-CE2 3.67Å; V56-F60 HydrophobicContact CG1-CZ 3.93Å; P57-F60 HydrophobicContact CB-CE2 4.4Å; P57-F60 HydrophobicContact CB-CZ 4.11Å; P57-F60 HydrophobicContact CG-CE1 4.48Å; P57-F60 HydrophobicContact CG-CZ 4.09Å; P57-F60 WeakPolarHBondContact O-CE2 3.22Å; F60-C62 PolarHBondContact O-N 2.85Å; F60-I67 HydrophobicContact CB-CD1 4.3Å; F60-I67 HydrophobicContact CD1-CD1 3.63Å; F60-I67 HydrophobicContact CD1-CG1 4.13Å; F60-I67 HydrophobicContact CD2-CD1 4.34Å; F60-I67 HydrophobicContact CE1-CD1 3.93Å; F60-I67 HydrophobicContact CE1-CG1 4.31Å; F60-I67 HydrophobicContact CE1-CG2 3.85Å; F60-I67 HydrophobicContact CG-CD1 3.85Å; F60-I67 HydrophobicContact CZ-CD1 4.39Å; F60-I67 HydrophobicContact CZ-CG2 4.31Å; F60-L69 HydrophobicContact CZ-CD1 4.35Å; F60-F82 HydrophobicContact CE2-CD1 4.11Å; F60-F82 HydrophobicContact CZ-CD1 4.49Å; F60-L85 HydrophobicContact CB-CD1 4.29Å; F60-L85 HydrophobicContact CB-CD2 3.87Å; F60-L85 HydrophobicContact CD2-CD1 4.46Å
61	P	92.4	Very high	94.9	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.032	28%	0.276	C	S	.	.			trans	-54.6	134.6	174.8	-23.8	33.9	0	0	0	112.5	A28 A30 V46 E63 A64	A28-P61 WeakPolarHBondContact O-CA 2.98Å; A30-P61 WeakPolarHBondContact O-CD 3.17Å; A30-P61 WeakPolarHBondContact O-CG 3.07Å; V46-P61 HydrophobicContact CG2-CG 4.24Å; P61-E63 HydrophobicContact CB-CG 4.23Å; P61-E63 PolarHBondContact O-N 3.01Å; P61-A64 HydrophobicContact CB-CB 4.44Å; P61-A64 WeakPolarHBondContact O-CB 3.42Å; P61-A64 PolarHBondContact O-N 3.36Å
62	C	90.9	Very high	95	Very high	30 Å²	30	48.2 Å²	48.2	20%	0.203	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-31.2	178.3	-69.2	0	0	0	0	113.7	C27 F60 A64	C27-C62 VanDerWaalsContact C-SG 3.5Å; C27-C62 HydrophobicContact CB-CB 3.99Å; C27-C62 WeakPolarHBondContact CB-SG 3.44Å; C27-C62 PolarHBondContact O-SG 2.9Å; C27-C62 WeakPolarHBondContact SG-CA 3.09Å; C27-C62 WeakPolarHBondContact SG-CB 3.26Å; C27-C62 CovalentContact SG-SG 2.03Å; C27-C62 PolarHBondContact SG-SG 2.87Å; F60-C62 PolarHBondContact O-N 2.85Å; C62-A64 VanDerWaalsContact C-N 3.26Å
63	E	91.8	Very high	95	Very high	77 Å²	77	46.4 Å²	46.4	36%	0.36	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	2.3	176.4	60.8	-89.8	-156.8	0	0	113.4	C44 P61 V65	C44-E63 HydrophobicContact CB-CB 4.46Å; C44-E63 HydrophobicContact CB-CG 3.68Å; C44-E63 PolarHBondContact N-O 3.2Å; C44-E63 VanDerWaalsContact N-O 3.13Å; P61-E63 HydrophobicContact CB-CG 4.23Å; P61-E63 PolarHBondContact O-N 3.01Å; E63-V65 PolarHBondContact O-N 3.31Å
64	A	94.9	Very high	95	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	120.1	176.1	0	0	0	0	0	110.6	C44 V46 P61 C62 I67 S87 L88	C44-A64 CarbonylContact O-C 3.57Å; C44-A64 WeakPolarHBondContact O-CA 3.45Å; V46-A64 HydrophobicContact CG2-CB 3.94Å; P61-A64 HydrophobicContact CB-CB 4.44Å; P61-A64 WeakPolarHBondContact O-CB 3.42Å; P61-A64 PolarHBondContact O-N 3.36Å; C62-A64 VanDerWaalsContact C-N 3.26Å; A64-I67 HydrophobicContact CB-CG1 4.36Å; A64-S87 CarbonylContact O-C 3.27Å; A64-S87 VanDerWaalsContact O-C 3.27Å; A64-L88 VanDerWaalsContact O-CA 3.26Å; A64-L88 WeakPolarHBondContact O-CA 3.43Å; A64-L88 PolarHBondContact O-N 3.22Å; A64-L88 VanDerWaalsContact O-N 3.16Å
65	V	96.5	Very high	95	Very high	22 Å²	22	46.9 Å²	46.9	13%	0.133	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-30.4	176.2	176.9	0	0	0	0	110.7	C44 E63 R89 R90	C44-V65 PolarHBondContact O-N 2.84Å; E63-V65 PolarHBondContact O-N 3.31Å; V65-R89 HydrophobicContact CG1-CB 4.15Å; V65-R89 HydrophobicContact CG1-CG 4.11Å; V65-R89 PolarHBondContact O-N 2.83Å; V65-R90 PolarHBondContact O-N 3.05Å; V65-R90 VanDerWaalsContact O-N 3.11Å
66	S	97.3	Very high	95	Very high	16 Å²	16	43 Å²	43	11%	0.112	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139.4	172.1	41.5	0	0	0	0	112.3	C44 S45 V46 R90	C44-S66 PolarHBondContact O-N 2.91Å; S45-S66 PolarHBondContact OG-OG 3.45Å; V46-S66 PolarHBondContact N-O 3.03Å; S66-R90 WeakPolarHBondContact CA-O 3.4Å; S66-R90 PolarHBondContact OG-NH2 3.27Å
67	I	97.6	Very high	95.1	Very high	3 Å²	3	42 Å²	42	2%	0.015	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125	171	-66.3	167.7	0	0	0	107.9	V46 F60 A64 L69 L85 L88 R90 L91 S92	V46-I67 HydrophobicContact CB-CG1 4.03Å; V46-I67 HydrophobicContact CG2-CG1 4.19Å; V46-I67 WeakPolarHBondContact O-CA 3.49Å; F60-I67 HydrophobicContact CB-CD1 4.3Å; F60-I67 HydrophobicContact CD1-CD1 3.63Å; F60-I67 HydrophobicContact CD1-CG1 4.13Å; F60-I67 HydrophobicContact CD2-CD1 4.34Å; F60-I67 HydrophobicContact CE1-CD1 3.93Å; F60-I67 HydrophobicContact CE1-CG1 4.31Å; F60-I67 HydrophobicContact CE1-CG2 3.85Å; F60-I67 HydrophobicContact CG-CD1 3.85Å; F60-I67 HydrophobicContact CZ-CD1 4.39Å; F60-I67 HydrophobicContact CZ-CG2 4.31Å; A64-I67 HydrophobicContact CB-CG1 4.36Å; I67-L69 HydrophobicContact CG2-CD1 3.78Å; I67-L69 HydrophobicContact CG2-CG 3.84Å; I67-L85 HydrophobicContact CD1-CD1 3.53Å; I67-L88 HydrophobicContact CB-CD1 4.19Å; I67-L88 HydrophobicContact CD1-CD1 3.69Å; I67-L88 HydrophobicContact CD1-CD2 4.1Å; I67-L88 HydrophobicContact CG1-CD1 3.65Å; I67-R90 PolarHBondContact N-O 3.3Å; I67-L91 HydrophobicContact CB-CD1 3.95Å; I67-L91 HydrophobicContact CG2-CD1 3.92Å; I67-L91 WeakPolarHBondContact O-CA 3.33Å; I67-S92 PolarHBondContact O-N 2.87Å
68	D	98.3	Very high	95.2	Very high	47 Å²	47	41.8 Å²	41.8	25%	0.251	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	113.4	173.2	-171.1	-10.1	0	0	0	109.6	V46 C48 D70	V46-D68 PolarHBondContact O-N 3.01Å; C48-D68 CarbonylContact C-O 3.46Å; C48-D68 WeakPolarHBondContact CA-O 3.23Å; C48-D68 VanDerWaalsContact CB-O 3.28Å; C48-D68 WeakPolarHBondContact CB-O 3.06Å; C48-D68 PolarHBondContact N-O 3.33Å; D68-D70 WeakPolarHBondContact OD1-CB 3.46Å; D68-D70 PolarHBondContact OD1-N 3.23Å
69	L	98.4	Very high	95.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.206	C	C	.	.			trans	-117.3	24.6	176.1	-73.1	160	0	0	0	110.8	C48 L53 F60 I67 N72 L74 F82 L91 S92 L93 N96	C48-L69 HydrophobicContact CB-CD2 3.57Å; C48-L69 HydrophobicContact CB-CG 4.34Å; L53-L69 HydrophobicContact CD1-CD2 3.54Å; F60-L69 HydrophobicContact CZ-CD1 4.35Å; I67-L69 HydrophobicContact CG2-CD1 3.78Å; I67-L69 HydrophobicContact CG2-CG 3.84Å; L69-N72 VanDerWaalsContact C-ND2 3.34Å; L69-N72 PolarHBondContact O-ND2 3.35Å; L69-L74 HydrophobicContact CB-CD1 4.35Å; L69-F82 HydrophobicContact CD1-CE1 3.63Å; L69-F82 HydrophobicContact CD1-CZ 4.38Å; L69-L91 HydrophobicContact CD1-CD1 4.36Å; L69-S92 WeakPolarHBondContact CB-O 3.36Å; L69-S92 PolarHBondContact N-O 2.94Å; L69-L93 HydrophobicContact CB-CD2 3.84Å; L69-L93 HydrophobicContact CD1-CD2 3.84Å; L69-N96 PolarHBondContact O-ND2 3.44Å
70	D	98.5	Very high	95.9	Very high	20 Å²	20	44.2 Å²	44.2	11%	0.107	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	152.5	-177.1	-73.1	1.6	0	0	0	112.3	D49 R50 D68 N72 S92 L93 R94	D49-D70 WeakPolarHBondContact CA-O 3.29Å; D49-D70 HydrophobicContact CB-CB 4.44Å; R50-D70 PolarHBondContact N-O 3.09Å; R50-D70 VanDerWaalsContact N-O 3.07Å; D68-D70 WeakPolarHBondContact OD1-CB 3.46Å; D68-D70 PolarHBondContact OD1-N 3.23Å; D70-N72 VanDerWaalsContact C-N 3.32Å; D70-N72 PolarHBondContact O-N 3.38Å; D70-N72 PolarHBondContact O-ND2 2.96Å; D70-S92 VanDerWaalsContact CG-OG 3.23Å; D70-S92 WeakPolarHBondContact OD1-CB 3.26Å; D70-S92 PolarHBondContact OD1-OG 3.02Å; D70-S92 PolarHBondContact OD2-OG 3.13Å; D70-L93 PolarHBondContact OD1-N 3.16Å; D70-R94 CarbonylContact C-O 3.32Å; D70-R94 VanDerWaalsContact CA-O 3.24Å; D70-R94 WeakPolarHBondContact CA-O 3.3Å; D70-R94 HydrophobicContact CB-CB 4.47Å; D70-R94 WeakPolarHBondContact OD1-CB 3.24Å; D70-R94 PolarHBondContact OD1-N 2.96Å
71	R	98.4	Very high	96	Very high	129 Å²	129	45.2 Å²	45.2	49%	0.487	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	43.5	172.6	-58.2	173.2	-178.6	-108.8	2.5	113.1	R50 R94 H95	R50-R71 WeakPolarHBondContact CA-O 3.37Å; R50-R71 HydrophobicContact CG-CB 3.73Å; R50-R71 HydrophobicContact CG-CG 4.48Å; R50-R71 VanDerWaalsContact CZ-CD 3.47Å; R71-R94 PolarHBondContact N-O 2.99Å; R71-H95 VanDerWaalsContact CA-O 3.26Å; R71-H95 WeakPolarHBondContact CA-O 3.45Å; R71-H95 HydrophobicContact CB-CB 4.49Å; R71-H95 HydrophobicContact CG-CB 3.8Å
72	N	98.4	Very high	96.1	Very high	14 Å²	14	45.4 Å²	45.4	8%	0.075	22%	0.216	C	C	.	.	S	Bend	trans	-111.7	-176.7	173.1	-78.6	-67.5	0	0	0	110.8	C48 A51 G52 L53 L69 D70 L74 N96	C48-N72 PolarHBondContact O-ND2 2.86Å; A51-N72 PolarHBondContact N-OD1 2.76Å; A51-N72 VanDerWaalsContact N-OD1 3.15Å; G52-N72 PolarHBondContact N-OD1 3.37Å; G52-N72 VanDerWaalsContact N-OD1 3.09Å; L53-N72 HydrophobicContact CB-CB 4.1Å; L53-N72 WeakPolarHBondContact CB-OD1 3.13Å; L53-N72 PolarHBondContact N-OD1 3.05Å; L69-N72 VanDerWaalsContact C-ND2 3.34Å; L69-N72 PolarHBondContact O-ND2 3.35Å; D70-N72 VanDerWaalsContact C-N 3.32Å; D70-N72 PolarHBondContact O-N 3.38Å; D70-N72 PolarHBondContact O-ND2 2.96Å; N72-L74 HydrophobicContact CB-CG 4.26Å; N72-N96 WeakPolarHBondContact CA-OD1 3.28Å; N72-N96 WeakPolarHBondContact CB-OD1 3.38Å; N72-N96 PolarHBondContact N-OD1 3.38Å; N72-N96 PolarHBondContact O-OD1 2.85Å; N72-N96 VanDerWaalsContact O-OD1 3.11Å
73	G	97.4	Very high	96.2	Very high	22 Å²	22	44.9 Å²	44.9	23%	0.227	22%	0.216	C	C	.	.			trans	-102.1	25.9	179	0	0	0	0	0	113.7	L53 R75	L53-G73 CarbonylContact O-C 3.17Å; L53-G73 VanDerWaalsContact O-C 3.31Å; L53-G73 WeakPolarHBondContact O-CA 3.26Å; L53-G73 PolarHBondContact O-N 2.98Å; G73-R75 PolarHBondContact O-N 3.25Å
74	L	97.7	Very high	96.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.218	C	C	.	.			trans	-64.1	126.6	-177.1	-57.6	178.5	0	0	0	110.2	L53 R55 V56 L69 N72 L93 N96 N97 L98	L53-L74 HydrophobicContact CB-CD2 4.25Å; L53-L74 PolarHBondContact O-N 2.02Å; R55-L74 WeakPolarHBondContact O-CD2 3.48Å; V56-L74 HydrophobicContact CG2-CD1 4.24Å; V56-L74 HydrophobicContact CG2-CD2 4.48Å; L69-L74 HydrophobicContact CB-CD1 4.35Å; N72-L74 HydrophobicContact CB-CG 4.26Å; L74-L93 HydrophobicContact CD1-CD2 3.59Å; L74-N96 HydrophobicContact CB-CB 4.2Å; L74-N96 VanDerWaalsContact CB-OD1 3.28Å; L74-N96 WeakPolarHBondContact CB-OD1 3.21Å; L74-N96 VanDerWaalsContact CG-OD1 3.23Å; L74-N96 WeakPolarHBondContact CG-OD1 3.33Å; L74-N96 PolarHBondContact N-OD1 3.35Å; L74-N96 VanDerWaalsContact N-OD1 3.11Å; L74-N97 CarbonylContact O-C 3.16Å; L74-N97 WeakPolarHBondContact O-CA 3.44Å; L74-N97 PolarHBondContact O-N 2.89Å; L74-L98 HydrophobicContact CB-CD2 3.92Å; L74-L98 PolarHBondContact O-N 3.48Å
75	R	96.5	Very high	96.2	Very high	166 Å²	166	44.4 Å²	44.4	63%	0.626	22%	0.218	S	C	*	.			trans	-106.7	-32.1	-179.7	-67.3	-177.2	177.6	-177.3	-0.9	114.4	G73 N97 L98 S99	G73-R75 PolarHBondContact O-N 3.25Å; R75-N97 WeakPolarHBondContact CA-O 3.32Å; R75-N97 HydrophobicContact CG-CB 4.23Å; R75-L98 WeakPolarHBondContact O-CA 3.13Å; R75-S99 PolarHBondContact O-N 3.33Å; R75-S99 PolarHBondContact O-OG 3.42Å
76	F	96.6	Very high	96	Very high	120 Å²	120	45.9 Å²	45.9	53%	0.526	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	140.5	-171.3	157.7	-96.6	0	0	0	110.2	G78 F100 T102	F76-G78 VanDerWaalsContact CE1-CA 3.44Å; F76-G78 VanDerWaalsContact CE1-N 3.27Å; F76-F100 WeakPolarHBondContact CA-O 3.17Å; F76-F100 AromaticContact CD2-CD1 3.98Å; F76-F100 HydrophobicContact CD2-CD1 3.98Å; F76-F100 HydrophobicContact CE2-CD1 4.11Å; F76-T102 WeakPolarHBondContact CE2-OG1 3.41Å
77	L	97.2	Very high	95.9	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.5	165.8	-58.9	-179.7	0	0	0	109.8	V56 A81 F82 L93 L98 F100 I101 T102 A105 F106	V56-L77 HydrophobicContact CG2-CD2 3.59Å; L77-A81 HydrophobicContact CB-CB 4.25Å; L77-A81 HydrophobicContact CD2-CB 4.34Å; L77-F82 HydrophobicContact CD1-CE2 4.41Å; L77-F82 HydrophobicContact CD2-CE2 4.48Å; L77-F82 HydrophobicContact CD2-CZ 4.31Å; L77-L93 HydrophobicContact CD1-CD1 3.98Å; L77-L98 HydrophobicContact CD1-CD1 4.18Å; L77-L98 HydrophobicContact CD1-CD2 4.45Å; L77-L98 HydrophobicContact CD2-CD2 4.17Å; L77-L98 HydrophobicContact CG-CD1 4.48Å; L77-L98 HydrophobicContact CG-CD2 3.86Å; L77-F100 PolarHBondContact N-O 3.32Å; L77-F100 VanDerWaalsContact N-O 3.17Å; L77-I101 HydrophobicContact CB-CG2 4.2Å; L77-I101 HydrophobicContact CD1-CD1 4.36Å; L77-I101 HydrophobicContact CD1-CG1 4.13Å; L77-I101 HydrophobicContact CD1-CG2 4.19Å; L77-I101 HydrophobicContact CG-CG1 4.49Å; L77-T102 VanDerWaalsContact O-CB 3.24Å; L77-T102 WeakPolarHBondContact O-CB 3.31Å; L77-T102 PolarHBondContact O-N 3.1Å; L77-T102 PolarHBondContact O-OG1 3.37Å; L77-A105 HydrophobicContact CB-CB 3.93Å; L77-F106 HydrophobicContact CD1-CE1 4.04Å; L77-F106 HydrophobicContact CD1-CZ 3.87Å
78	G	95.2	Very high	95.9	Very high	17 Å²	17	46.6 Å²	46.6	18%	0.175	23%	0.234	C	C	.	.			trans	-76.9	173.2	174.1	0	0	0	0	0	113	F76 R80 A81 A105	F76-G78 VanDerWaalsContact CE1-CA 3.44Å; F76-G78 VanDerWaalsContact CE1-N 3.27Å; G78-R80 PolarHBondContact O-N 2.95Å; G78-A81 WeakPolarHBondContact O-CB 3.5Å; G78-A81 PolarHBondContact O-N 3.06Å; G78-A105 WeakPolarHBondContact O-CA 3.37Å; G78-A105 VanDerWaalsContact O-CB 3.28Å; G78-A105 WeakPolarHBondContact O-CB 3.08Å
79	E	93.9	Very high	95.8	Very high	113 Å²	113	51 Å²	51	53%	0.528	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	135.6	172	-170.2	-173.1	165.6	0	0	110.1	A81	E79-A81 PolarHBondContact O-N 2.94Å
80	R	93.3	Very high	95.8	Very high	122 Å²	122	56.2 Å²	56.2	46%	0.46	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	42.1	-176.3	-64.3	177.6	174.5	120.8	-12.5	113	G78 F82 G83 G104 K107	G78-R80 PolarHBondContact O-N 2.95Å; R80-F82 PolarHBondContact O-N 3.38Å; R80-G83 PolarHBondContact O-N 2.8Å; R80-G104 PolarHBondContact N-O 2.02Å; R80-K107 HydrophobicContact CG-CB 4.01Å; R80-K107 HydrophobicContact CG-CD 4.35Å; R80-K107 HydrophobicContact CG-CG 4.35Å
81	A	95.3	Very high	95.8	Very high	26 Å²	26	55.3 Å²	55.3	22%	0.215	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-23.8	-176.6	0	0	0	0	0	114.6	V56 L77 G78 E79 A105	V56-A81 WeakPolarHBondContact CG1-O 3.49Å; L77-A81 HydrophobicContact CB-CB 4.25Å; L77-A81 HydrophobicContact CD2-CB 4.34Å; G78-A81 WeakPolarHBondContact O-CB 3.5Å; G78-A81 PolarHBondContact O-N 3.06Å; E79-A81 PolarHBondContact O-N 2.94Å; A81-A105 PolarHBondContact N-O 3.27Å; A81-A105 VanDerWaalsContact N-O 3.09Å
82	F	94.7	Very high	95.9	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.035	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	6.1	-179.1	-58.4	-82.9	0	0	0	113.6	V56 F60 L69 L77 R80 L85 L91 L93 F106 L109	V56-F82 HydrophobicContact CG1-CD1 3.73Å; V56-F82 HydrophobicContact CG1-CE1 3.58Å; V56-F82 HydrophobicContact CG1-CZ 4.31Å; V56-F82 HydrophobicContact CG2-CE1 4.06Å; V56-F82 HydrophobicContact CG2-CZ 4.03Å; F60-F82 HydrophobicContact CE2-CD1 4.11Å; F60-F82 HydrophobicContact CZ-CD1 4.49Å; L69-F82 HydrophobicContact CD1-CE1 3.63Å; L69-F82 HydrophobicContact CD1-CZ 4.38Å; L77-F82 HydrophobicContact CD1-CE2 4.41Å; L77-F82 HydrophobicContact CD2-CE2 4.48Å; L77-F82 HydrophobicContact CD2-CZ 4.31Å; R80-F82 PolarHBondContact O-N 3.38Å; F82-L85 HydrophobicContact CB-CD1 4.16Å; F82-L85 WeakPolarHBondContact O-CG 2.94Å; F82-L91 HydrophobicContact CD1-CD1 4.35Å; F82-L91 HydrophobicContact CD1-CD2 4.38Å; F82-L91 HydrophobicContact CD2-CD2 4.05Å; F82-L91 HydrophobicContact CE1-CD1 3.85Å; F82-L91 HydrophobicContact CE1-CD2 4.07Å; F82-L91 HydrophobicContact CE2-CD2 3.72Å; F82-L91 HydrophobicContact CG-CD2 4.39Å; F82-L91 HydrophobicContact CZ-CD1 4.17Å; F82-L91 HydrophobicContact CZ-CD2 3.74Å; F82-L91 HydrophobicContact CZ-CG 4.5Å; F82-L93 HydrophobicContact CE2-CD1 4.48Å; F82-L93 HydrophobicContact CZ-CD1 3.99Å; F82-L93 HydrophobicContact CZ-CD2 4.06Å; F82-L93 HydrophobicContact CZ-CG 4.48Å; F82-F106 HydrophobicContact CD2-CD1 4.25Å; F82-F106 AromaticContact CE2-CD1 4Å; F82-F106 HydrophobicContact CE2-CD1 4Å; F82-F106 AromaticContact CE2-CE1 3.91Å; F82-F106 HydrophobicContact CE2-CE1 3.91Å; F82-L109 HydrophobicContact CB-CD1 4.44Å; F82-L109 HydrophobicContact CB-CD2 4.16Å; F82-L109 HydrophobicContact CD2-CD1 4.33Å
83	G	91.9	Very high	95.9	Very high	20 Å²	20	48.9 Å²	48.9	21%	0.206	24%	0.238	C	C	.	.			trans	60.3	-147.8	-172.6	0	0	0	0	0	112.8	R80	R80-G83 PolarHBondContact O-N 2.8Å
84	T	93.1	Very high	95.9	Very high	63 Å²	63	51.5 Å²	51.5	39%	0.387	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-104.2	110.9	176.8	-50.5	0	0	0	0	110.4	G25 C27 G108	G25-T84 VanDerWaalsContact O-CB 3.27Å; G25-T84 WeakPolarHBondContact O-CB 2.96Å; G25-T84 PolarHBondContact O-N 3.19Å; G25-T84 VanDerWaalsContact O-N 3.17Å; G25-T84 PolarHBondContact O-OG1 3Å; C27-T84 WeakPolarHBondContact CB-O 3.48Å; T84-G108 WeakPolarHBondContact CA-O 3.45Å
85	L	94.6	Very high	95.9	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.016	26%	0.256	C	S	.	.			trans	-118.2	93.6	178.2	-60.5	170.9	0	0	0	109.8	C27 F60 I67 F82 S87 L88 G108 L109	C27-L85 HydrophobicContact CB-CD2 3.86Å; F60-L85 HydrophobicContact CB-CD1 4.29Å; F60-L85 HydrophobicContact CB-CD2 3.87Å; F60-L85 HydrophobicContact CD2-CD1 4.46Å; I67-L85 HydrophobicContact CD1-CD1 3.53Å; F82-L85 HydrophobicContact CB-CD1 4.16Å; F82-L85 WeakPolarHBondContact O-CG 2.94Å; L85-S87 PolarHBondContact O-N 3.14Å; L85-L88 HydrophobicContact CB-CB 3.8Å; L85-L88 HydrophobicContact CB-CD2 4.49Å; L85-L88 HydrophobicContact CD1-CD2 3.93Å; L85-L88 PolarHBondContact O-N 3.02Å; L85-G108 PolarHBondContact N-O 2.93Å; L85-L109 HydrophobicContact CB-CD2 3.73Å; L85-L109 HydrophobicContact CD1-CD2 4.06Å; L85-L109 HydrophobicContact CG-CD2 4.17Å
86	P	92.8	Very high	96	Very high	53 Å²	53	47.3 Å²	47.3	34%	0.344	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-18	-169.5	28.9	-35.8	0	0	0	113.7	R111	P86-R111 WeakPolarHBondContact O-CD 3.35Å; P86-R111 WeakPolarHBondContact O-CG 3.08Å; P86-R111 PolarHBondContact O-NH1 2.8Å
87	S	94.4	Very high	96	Very high	35 Å²	35	44.7 Å²	44.7	25%	0.245	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-9.8	-176.9	-60.9	0	0	0	0	113.6	A64 L85 R89	A64-S87 CarbonylContact O-C 3.27Å; A64-S87 VanDerWaalsContact O-C 3.27Å; L85-S87 PolarHBondContact O-N 3.14Å; S87-R89 PolarHBondContact O-N 2.94Å
88	L	96.8	Very high	96.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.22	C	C	.	.			trans	-66.4	127.3	-172.6	-167.7	72.1	0	0	0	111	A64 I67 L85 L91 L109 R111 L112	A64-L88 VanDerWaalsContact O-CA 3.26Å; A64-L88 WeakPolarHBondContact O-CA 3.43Å; A64-L88 PolarHBondContact O-N 3.22Å; A64-L88 VanDerWaalsContact O-N 3.16Å; I67-L88 HydrophobicContact CB-CD1 4.19Å; I67-L88 HydrophobicContact CD1-CD1 3.69Å; I67-L88 HydrophobicContact CD1-CD2 4.1Å; I67-L88 HydrophobicContact CG1-CD1 3.65Å; L85-L88 HydrophobicContact CB-CB 3.8Å; L85-L88 HydrophobicContact CB-CD2 4.49Å; L85-L88 HydrophobicContact CD1-CD2 3.93Å; L85-L88 PolarHBondContact O-N 3.02Å; L88-L91 HydrophobicContact CD2-CB 4.29Å; L88-L109 HydrophobicContact CD2-CD1 4.19Å; L88-L109 HydrophobicContact CD2-CD2 3.83Å; L88-R111 CarbonylContact O-C 3.1Å; L88-L112 HydrophobicContact CD2-CD1 4.01Å; L88-L112 HydrophobicContact CG-CD1 4.09Å; L88-L112 WeakPolarHBondContact O-CA 3.35Å; L88-L112 PolarHBondContact O-N 2.95Å
89	R	97.8	Very high	96.1	Very high	139 Å²	139	46.7 Å²	46.7	53%	0.525	23%	0.232	S	C	.	.			trans	-116.8	-31.3	179.5	-64.1	-174.3	-176.5	-152.9	1.9	112.8	V65 S87 A113 E114	V65-R89 HydrophobicContact CG1-CB 4.15Å; V65-R89 HydrophobicContact CG1-CG 4.11Å; V65-R89 PolarHBondContact O-N 2.83Å; S87-R89 PolarHBondContact O-N 2.94Å; R89-A113 WeakPolarHBondContact O-CA 3.43Å; R89-A113 PolarHBondContact O-N 3.17Å; R89-E114 PolarHBondContact O-N 3.16Å
90	R	98.5	Very high	96.2	Very high	109 Å²	109	46.2 Å²	46.2	41%	0.411	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.2	-178.8	-58.6	-176	-68.8	-81.2	-7.9	110.4	V65 S66 I67 E114	V65-R90 PolarHBondContact O-N 3.05Å; V65-R90 VanDerWaalsContact O-N 3.11Å; S66-R90 WeakPolarHBondContact CA-O 3.4Å; S66-R90 PolarHBondContact OG-NH2 3.27Å; I67-R90 PolarHBondContact N-O 3.3Å; R90-E114 WeakPolarHBondContact CA-O 3.07Å; R90-E114 WeakPolarHBondContact CD-OE2 3.24Å; R90-E114 HydrophobicContact CG-CB 4.1Å
91	L	98.6	Very high	96.3	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.2	173.9	176.7	59.7	0	0	0	108.9	I67 L69 F82 L88 L93 F106 L109 L112 E114 L115 R116	I67-L91 HydrophobicContact CB-CD1 3.95Å; I67-L91 HydrophobicContact CG2-CD1 3.92Å; I67-L91 WeakPolarHBondContact O-CA 3.33Å; L69-L91 HydrophobicContact CD1-CD1 4.36Å; F82-L91 HydrophobicContact CD1-CD1 4.35Å; F82-L91 HydrophobicContact CD1-CD2 4.38Å; F82-L91 HydrophobicContact CD2-CD2 4.05Å; F82-L91 HydrophobicContact CE1-CD1 3.85Å; F82-L91 HydrophobicContact CE1-CD2 4.07Å; F82-L91 HydrophobicContact CE2-CD2 3.72Å; F82-L91 HydrophobicContact CG-CD2 4.39Å; F82-L91 HydrophobicContact CZ-CD1 4.17Å; F82-L91 HydrophobicContact CZ-CD2 3.74Å; F82-L91 HydrophobicContact CZ-CG 4.5Å; L88-L91 HydrophobicContact CD2-CB 4.29Å; L91-L93 HydrophobicContact CD1-CG 4.44Å; L91-L93 HydrophobicContact CD2-CD1 4.19Å; L91-L93 HydrophobicContact CG-CD1 4.25Å; L91-L93 HydrophobicContact CG-CG 4.35Å; L91-F106 HydrophobicContact CD2-CD1 4.08Å; L91-F106 HydrophobicContact CD2-CE1 4.05Å; L91-L109 HydrophobicContact CD2-CD1 4.2Å; L91-L112 HydrophobicContact CB-CD1 3.81Å; L91-E114 PolarHBondContact N-O 2.93Å; L91-L115 HydrophobicContact CB-CD1 4.11Å; L91-L115 HydrophobicContact CD2-CD1 3.94Å; L91-L115 HydrophobicContact CG-CD1 4.03Å; L91-L115 WeakPolarHBondContact O-CA 3.46Å; L91-R116 PolarHBondContact O-N 2.69Å
92	S	98.7	Very high	96.4	Very high	8 Å²	8	40.9 Å²	40.9	6%	0.056	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.9	176.5	-155.1	0	0	0	0	110.4	I67 L69 D70	I67-S92 PolarHBondContact O-N 2.87Å; L69-S92 WeakPolarHBondContact CB-O 3.36Å; L69-S92 PolarHBondContact N-O 2.94Å; D70-S92 VanDerWaalsContact CG-OG 3.23Å; D70-S92 WeakPolarHBondContact OD1-CB 3.26Å; D70-S92 PolarHBondContact OD1-OG 3.02Å; D70-S92 PolarHBondContact OD2-OG 3.13Å
93	L	98.4	Very high	96.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.218	C	C	.	.			trans	-133.3	28.5	-179.6	-69.9	160.1	0	0	0	109.8	L69 D70 L74 L77 F82 L91 N96 L98 F106 L115 R116 L117 N120	L69-L93 HydrophobicContact CB-CD2 3.84Å; L69-L93 HydrophobicContact CD1-CD2 3.84Å; D70-L93 PolarHBondContact OD1-N 3.16Å; L74-L93 HydrophobicContact CD1-CD2 3.59Å; L77-L93 HydrophobicContact CD1-CD1 3.98Å; F82-L93 HydrophobicContact CE2-CD1 4.48Å; F82-L93 HydrophobicContact CZ-CD1 3.99Å; F82-L93 HydrophobicContact CZ-CD2 4.06Å; F82-L93 HydrophobicContact CZ-CG 4.48Å; L91-L93 HydrophobicContact CD1-CG 4.44Å; L91-L93 HydrophobicContact CD2-CD1 4.19Å; L91-L93 HydrophobicContact CG-CD1 4.25Å; L91-L93 HydrophobicContact CG-CG 4.35Å; L93-N96 VanDerWaalsContact C-ND2 3.32Å; L93-N96 PolarHBondContact O-ND2 2.91Å; L93-L98 HydrophobicContact CB-CD1 4.43Å; L93-F106 HydrophobicContact CD1-CE1 4.09Å; L93-F106 HydrophobicContact CD1-CZ 4.5Å; L93-L115 HydrophobicContact CD1-CD1 4.44Å; L93-R116 PolarHBondContact N-O 3.19Å; L93-L117 HydrophobicContact CB-CD2 4Å; L93-L117 HydrophobicContact CD1-CD2 3.72Å; L93-N120 PolarHBondContact O-ND2 3.04Å
94	R	98.6	Very high	96.4	Very high	76 Å²	76	42.2 Å²	42.2	29%	0.287	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	155.1	-174	-57.7	175.4	65	-169.1	0.5	111	D70 R71 N96 R116 A118	D70-R94 CarbonylContact C-O 3.32Å; D70-R94 VanDerWaalsContact CA-O 3.24Å; D70-R94 WeakPolarHBondContact CA-O 3.3Å; D70-R94 HydrophobicContact CB-CB 4.47Å; D70-R94 WeakPolarHBondContact OD1-CB 3.24Å; D70-R94 PolarHBondContact OD1-N 2.96Å; R71-R94 PolarHBondContact N-O 2.99Å; R94-N96 PolarHBondContact O-N 3.33Å; R94-N96 PolarHBondContact O-ND2 3.24Å; R94-R116 HydrophobicContact CG-CB 3.75Å; R94-A118 CarbonylContact C-O 3.53Å; R94-A118 WeakPolarHBondContact CA-O 3.23Å; R94-A118 HydrophobicContact CG-CB 4.21Å
95	H	98.3	Very high	96.6	Very high	67 Å²	67	39.2 Å²	39.2	31%	0.31	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	42.9	176.5	-61.7	-81.4	0	0	0	112.6	R71 A118 H119	R71-H95 VanDerWaalsContact CA-O 3.26Å; R71-H95 WeakPolarHBondContact CA-O 3.45Å; R71-H95 HydrophobicContact CB-CB 4.49Å; R71-H95 HydrophobicContact CG-CB 3.8Å; H95-A118 PolarHBondContact N-O 3.09Å; H95-H119 AromaticContact CD2-CD2 4Å; H95-H119 AromaticContact CE1-CD2 3.23Å; H95-H119 PolarHBondContact CE1-CD2 2.93Å; H95-H119 AromaticContact CE1-CE1 3.99Å; H95-H119 AromaticContact CE1-CG 3.28Å; H95-H119 AromaticContact CE1-ND1 3.76Å; H95-H119 AromaticContact CE1-NE2 3.71Å; H95-H119 WeakPolarHBondContact ND1-CB 3.09Å; H95-H119 AromaticContact ND1-CD2 3.92Å; H95-H119 AromaticContact ND1-CG 3.62Å; H95-H119 AromaticContact NE2-CD2 3.27Å; H95-H119 PolarHBondContact NE2-CD2 3.03Å; H95-H119 VanDerWaalsContact NE2-CD2 3.27Å; H95-H119 AromaticContact NE2-CG 3.78Å; H95-H119 AromaticContact NE2-NE2 3.81Å
96	N	98.3	Very high	96.7	Very high	11 Å²	11	39.1 Å²	39.1	6%	0.059	20%	0.195	C	C	.	.			trans	-103.7	-176.1	169.2	-84.4	-83.3	0	0	0	109.6	L69 N72 L74 L93 R94 L98 N120	L69-N96 PolarHBondContact O-ND2 3.44Å; N72-N96 WeakPolarHBondContact CA-OD1 3.28Å; N72-N96 WeakPolarHBondContact CB-OD1 3.38Å; N72-N96 PolarHBondContact N-OD1 3.38Å; N72-N96 PolarHBondContact O-OD1 2.85Å; N72-N96 VanDerWaalsContact O-OD1 3.11Å; L74-N96 HydrophobicContact CB-CB 4.2Å; L74-N96 VanDerWaalsContact CB-OD1 3.28Å; L74-N96 WeakPolarHBondContact CB-OD1 3.21Å; L74-N96 VanDerWaalsContact CG-OD1 3.23Å; L74-N96 WeakPolarHBondContact CG-OD1 3.33Å; L74-N96 PolarHBondContact N-OD1 3.35Å; L74-N96 VanDerWaalsContact N-OD1 3.11Å; L93-N96 VanDerWaalsContact C-ND2 3.32Å; L93-N96 PolarHBondContact O-ND2 2.91Å; R94-N96 PolarHBondContact O-N 3.33Å; R94-N96 PolarHBondContact O-ND2 3.24Å; N96-L98 HydrophobicContact CB-CG 4.19Å; N96-N120 WeakPolarHBondContact CA-OD1 3.24Å; N96-N120 WeakPolarHBondContact CB-OD1 2.96Å; N96-N120 PolarHBondContact O-OD1 3.37Å; N96-N120 VanDerWaalsContact O-OD1 3.12Å
97	N	96.8	Very high	96.8	Very high	65 Å²	65	40.8 Å²	40.8	35%	0.348	20%	0.197	S	C	.	.			trans	-110.4	35.3	178	-156.3	80.5	0	0	0	111.6	L74 R75 S99 D122	L74-N97 CarbonylContact O-C 3.16Å; L74-N97 WeakPolarHBondContact O-CA 3.44Å; L74-N97 PolarHBondContact O-N 2.89Å; R75-N97 WeakPolarHBondContact CA-O 3.32Å; R75-N97 HydrophobicContact CG-CB 4.23Å; N97-S99 PolarHBondContact O-N 3.19Å; N97-S99 VanDerWaalsContact O-N 3.16Å; N97-D122 VanDerWaalsContact CG-OD2 3.29Å; N97-D122 PolarHBondContact ND2-OD2 2.85Å; N97-D122 PolarHBondContact OD1-OD2 2.81Å
98	L	97.5	Very high	96.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.			trans	-64.3	119.3	-174.9	-65.6	174.5	0	0	0	109.6	L74 R75 L77 L93 N96 I101 L117 N120 D122 L123	L74-L98 HydrophobicContact CB-CD2 3.92Å; L74-L98 PolarHBondContact O-N 3.48Å; R75-L98 WeakPolarHBondContact O-CA 3.13Å; L77-L98 HydrophobicContact CD1-CD1 4.18Å; L77-L98 HydrophobicContact CD1-CD2 4.45Å; L77-L98 HydrophobicContact CD2-CD2 4.17Å; L77-L98 HydrophobicContact CG-CD1 4.48Å; L77-L98 HydrophobicContact CG-CD2 3.86Å; L93-L98 HydrophobicContact CB-CD1 4.43Å; N96-L98 HydrophobicContact CB-CG 4.19Å; L98-I101 HydrophobicContact CD1-CD1 4.41Å; L98-L117 HydrophobicContact CD1-CD2 3.96Å; L98-N120 HydrophobicContact CB-CB 4.07Å; L98-N120 WeakPolarHBondContact CB-OD1 3.47Å; L98-N120 VanDerWaalsContact CG-OD1 3.25Å; L98-N120 WeakPolarHBondContact CG-OD1 3.45Å; L98-N120 PolarHBondContact N-OD1 3.42Å; L98-D122 CarbonylContact O-C 3.5Å; L98-L123 VanDerWaalsContact O-CA 3.25Å; L98-L123 WeakPolarHBondContact O-CA 3.47Å; L98-L123 WeakPolarHBondContact O-CB 3.41Å; L98-L123 PolarHBondContact O-N 2.57Å
99	S	95.8	Very high	96.7	Very high	61 Å²	61	40.3 Å²	40.3	43%	0.427	20%	0.197	S	C	.	.			trans	-105.7	-23.1	174.1	61.5	0	0	0	0	112.3	R75 N97	R75-S99 PolarHBondContact O-N 3.33Å; R75-S99 PolarHBondContact O-OG 3.42Å; N97-S99 PolarHBondContact O-N 3.19Å; N97-S99 VanDerWaalsContact O-N 3.16Å
100	F	95.8	Very high	96.6	Very high	103 Å²	103	37 Å²	37	45%	0.452	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	134.4	-179.2	-170.4	-99.9	0	0	0	112.4	F76 L77	F76-F100 WeakPolarHBondContact CA-O 3.17Å; F76-F100 AromaticContact CD2-CD1 3.98Å; F76-F100 HydrophobicContact CD2-CD1 3.98Å; F76-F100 HydrophobicContact CE2-CD1 4.11Å; L77-F100 PolarHBondContact N-O 3.32Å; L77-F100 VanDerWaalsContact N-O 3.17Å
101	I	96.8	Very high	96.5	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.026	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	112.4	173.3	-56.5	174.9	0	0	0	108	L77 L98 A105 F106 L117 L123 L126 T130	L77-I101 HydrophobicContact CB-CG2 4.2Å; L77-I101 HydrophobicContact CD1-CD1 4.36Å; L77-I101 HydrophobicContact CD1-CG1 4.13Å; L77-I101 HydrophobicContact CD1-CG2 4.19Å; L77-I101 HydrophobicContact CG-CG1 4.49Å; L98-I101 HydrophobicContact CD1-CD1 4.41Å; I101-A105 HydrophobicContact CG2-CB 3.65Å; I101-F106 HydrophobicContact CD1-CZ 4.47Å; I101-F106 HydrophobicContact CG2-CE2 3.84Å; I101-F106 HydrophobicContact CG2-CZ 4.2Å; I101-L117 HydrophobicContact CD1-CD1 4.13Å; I101-L117 HydrophobicContact CD1-CD2 4.11Å; I101-L123 HydrophobicContact CD1-CD1 3.95Å; I101-L123 HydrophobicContact CD1-CD2 4Å; I101-L123 HydrophobicContact CG1-CD1 3.84Å; I101-L126 HydrophobicContact CD1-CD2 4.16Å; I101-T130 HydrophobicContact CB-CG2 4.03Å; I101-T130 HydrophobicContact CG2-CG2 3.51Å
102	T	95.5	Very high	96.5	Very high	31 Å²	31	37.3 Å²	37.3	19%	0.19	20%	0.195	C	C	.	.			trans	-62.3	140.6	179.8	-51.2	0	0	0	0	110.5	F76 L77 G104 A105	F76-T102 WeakPolarHBondContact CE2-OG1 3.41Å; L77-T102 VanDerWaalsContact O-CB 3.24Å; L77-T102 WeakPolarHBondContact O-CB 3.31Å; L77-T102 PolarHBondContact O-N 3.1Å; L77-T102 PolarHBondContact O-OG1 3.37Å; T102-G104 PolarHBondContact O-N 3.13Å; T102-A105 VanDerWaalsContact O-CB 3.25Å; T102-A105 WeakPolarHBondContact O-CB 3.42Å; T102-A105 PolarHBondContact O-N 3.06Å
103	P	95.1	Very high	96.5	Very high	42 Å²	42	38.3 Å²	38.3	27%	0.273	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	129	170	-26.8	36.3	0	0	0	111.3	H127 R129	P103-H127 HydrophobicContact CG-CB 4.06Å; P103-R129 HydrophobicContact CB-CB 4.28Å
104	G	92.9	Very high	96.5	Very high	13 Å²	13	39.7 Å²	39.7	13%	0.134	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	11.8	-176.1	0	0	0	0	0	115.3	R80 T102 F106 K107	R80-G104 PolarHBondContact N-O 2.02Å; T102-G104 PolarHBondContact O-N 3.13Å; G104-F106 PolarHBondContact O-N 2.87Å; G104-K107 WeakPolarHBondContact O-CB 3.44Å; G104-K107 PolarHBondContact O-N 3.31Å
105	A	96.5	Very high	96.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-32.8	173.8	0	0	0	0	0	113.8	L77 G78 A81 I101 T102	L77-A105 HydrophobicContact CB-CB 3.93Å; G78-A105 WeakPolarHBondContact O-CA 3.37Å; G78-A105 VanDerWaalsContact O-CB 3.28Å; G78-A105 WeakPolarHBondContact O-CB 3.08Å; A81-A105 PolarHBondContact N-O 3.27Å; A81-A105 VanDerWaalsContact N-O 3.09Å; I101-A105 HydrophobicContact CG2-CB 3.65Å; T102-A105 VanDerWaalsContact O-CB 3.25Å; T102-A105 WeakPolarHBondContact O-CB 3.42Å; T102-A105 PolarHBondContact O-N 3.06Å
106	F	96.5	Very high	96.5	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.009	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	11.1	179.3	-52.5	-70.4	0	0	0	113.8	L77 F82 L91 L93 I101 G104 L109 L115 L117 T130 F131 L134	L77-F106 HydrophobicContact CD1-CE1 4.04Å; L77-F106 HydrophobicContact CD1-CZ 3.87Å; F82-F106 HydrophobicContact CD2-CD1 4.25Å; F82-F106 AromaticContact CE2-CD1 4Å; F82-F106 HydrophobicContact CE2-CD1 4Å; F82-F106 AromaticContact CE2-CE1 3.91Å; F82-F106 HydrophobicContact CE2-CE1 3.91Å; L91-F106 HydrophobicContact CD2-CD1 4.08Å; L91-F106 HydrophobicContact CD2-CE1 4.05Å; L93-F106 HydrophobicContact CD1-CE1 4.09Å; L93-F106 HydrophobicContact CD1-CZ 4.5Å; I101-F106 HydrophobicContact CD1-CZ 4.47Å; I101-F106 HydrophobicContact CG2-CE2 3.84Å; I101-F106 HydrophobicContact CG2-CZ 4.2Å; G104-F106 PolarHBondContact O-N 2.87Å; F106-L109 HydrophobicContact CB-CD1 4.15Å; F106-L109 HydrophobicContact CD1-CD1 4.29Å; F106-L109 WeakPolarHBondContact O-CB 3.31Å; F106-L109 WeakPolarHBondContact O-CG 3.33Å; F106-L109 PolarHBondContact O-N 2.9Å; F106-L115 HydrophobicContact CD1-CD1 4.49Å; F106-L115 HydrophobicContact CD1-CD2 4.43Å; F106-L115 HydrophobicContact CD2-CD2 4.3Å; F106-L115 HydrophobicContact CE1-CD1 3.93Å; F106-L115 HydrophobicContact CE1-CD2 4.13Å; F106-L115 HydrophobicContact CE2-CD2 3.99Å; F106-L115 HydrophobicContact CZ-CD1 4.28Å; F106-L115 HydrophobicContact CZ-CD2 3.9Å; F106-L117 HydrophobicContact CZ-CD1 4.46Å; F106-L117 HydrophobicContact CZ-CD2 4.35Å; F106-T130 HydrophobicContact CD2-CG2 4.47Å; F106-T130 WeakPolarHBondContact CD2-O 3.08Å; F106-T130 HydrophobicContact CE2-CG2 4Å; F106-F131 AromaticContact CD2-CD1 3.95Å; F106-F131 HydrophobicContact CD2-CD1 3.95Å; F106-F131 HydrophobicContact CD2-CE1 4.26Å; F106-F131 AromaticContact CE2-CD1 3.88Å; F106-F131 HydrophobicContact CE2-CD1 3.88Å; F106-F131 AromaticContact CE2-CE1 3.72Å; F106-F131 HydrophobicContact CE2-CE1 3.72Å; F106-L134 HydrophobicContact CB-CD1 3.98Å; F106-L134 HydrophobicContact CB-CD2 3.96Å; F106-L134 HydrophobicContact CB-CG 4.24Å; F106-L134 HydrophobicContact CD2-CD1 4.36Å; F106-L134 HydrophobicContact CG-CD1 4.29Å
107	K	94.7	Very high	96.5	Very high	88 Å²	88	36.2 Å²	36.2	38%	0.383	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	138.2	175.4	-173.4	177.3	-176.8	179.1	0	109.5	R80 G104	R80-K107 HydrophobicContact CG-CB 4.01Å; R80-K107 HydrophobicContact CG-CD 4.35Å; R80-K107 HydrophobicContact CG-CG 4.35Å; G104-K107 WeakPolarHBondContact O-CB 3.44Å; G104-K107 PolarHBondContact O-N 3.31Å
108	G	93.9	Very high	96.6	Very high	21 Å²	21	33.2 Å²	33.2	22%	0.216	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.7	4.4	-175	0	0	0	0	0	114.4	T84 L85 P110	T84-G108 WeakPolarHBondContact CA-O 3.45Å; L85-G108 PolarHBondContact N-O 2.93Å; G108-P110 WeakPolarHBondContact O-CD 3.44Å
109	L	96.4	Very high	96.6	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.016	19%	0.192	C	C	.	.			trans	-111.7	62.6	179.6	-51.7	-177.6	0	0	0	112.4	F82 L85 L88 L91 F106 R111 L112 L134	F82-L109 HydrophobicContact CB-CD1 4.44Å; F82-L109 HydrophobicContact CB-CD2 4.16Å; F82-L109 HydrophobicContact CD2-CD1 4.33Å; L85-L109 HydrophobicContact CB-CD2 3.73Å; L85-L109 HydrophobicContact CD1-CD2 4.06Å; L85-L109 HydrophobicContact CG-CD2 4.17Å; L88-L109 HydrophobicContact CD2-CD1 4.19Å; L88-L109 HydrophobicContact CD2-CD2 3.83Å; L91-L109 HydrophobicContact CD2-CD1 4.2Å; F106-L109 HydrophobicContact CB-CD1 4.15Å; F106-L109 HydrophobicContact CD1-CD1 4.29Å; F106-L109 WeakPolarHBondContact O-CB 3.31Å; F106-L109 WeakPolarHBondContact O-CG 3.33Å; F106-L109 PolarHBondContact O-N 2.9Å; L109-R111 PolarHBondContact O-N 3.39Å; L109-R111 VanDerWaalsContact O-N 3.1Å; L109-L112 HydrophobicContact CB-CB 4.09Å; L109-L112 HydrophobicContact CD1-CD2 4.12Å; L109-L112 PolarHBondContact O-N 3.38Å; L109-L134 HydrophobicContact CB-CD2 4.31Å
110	P	95.3	Very high	96.7	Very high	70 Å²	70	33.5 Å²	33.5	46%	0.455	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.1	-167.4	29.7	-38.1	0	0	0	114.7	G108 R136	G108-P110 WeakPolarHBondContact O-CD 3.44Å; P110-R136 WeakPolarHBondContact O-CD 3.15Å
111	R	96.9	Very high	96.6	Very high	117 Å²	117	29.6 Å²	29.6	44%	0.442	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	6.4	-178.2	-63.2	-165.9	-177.9	147.6	-10.5	113.7	P86 L88 L109 A113	P86-R111 WeakPolarHBondContact O-CD 3.35Å; P86-R111 WeakPolarHBondContact O-CG 3.08Å; P86-R111 PolarHBondContact O-NH1 2.8Å; L88-R111 CarbonylContact O-C 3.1Å; L109-R111 PolarHBondContact O-N 3.39Å; L109-R111 VanDerWaalsContact O-N 3.1Å; R111-A113 PolarHBondContact O-N 3Å; R111-A113 VanDerWaalsContact O-N 3.16Å
112	L	98.2	Very high	96.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	17%	0.173	C	C	.	.			trans	-61	121.3	-178.8	-164.6	70.6	0	0	0	109.6	L88 L91 L109 L115 L134 R136 L137	L88-L112 HydrophobicContact CD2-CD1 4.01Å; L88-L112 HydrophobicContact CG-CD1 4.09Å; L88-L112 WeakPolarHBondContact O-CA 3.35Å; L88-L112 PolarHBondContact O-N 2.95Å; L91-L112 HydrophobicContact CB-CD1 3.81Å; L109-L112 HydrophobicContact CB-CB 4.09Å; L109-L112 HydrophobicContact CD1-CD2 4.12Å; L109-L112 PolarHBondContact O-N 3.38Å; L112-L115 HydrophobicContact CD2-CB 4.18Å; L112-L134 HydrophobicContact CB-CD2 4.24Å; L112-L134 HydrophobicContact CD2-CD1 4.2Å; L112-L134 HydrophobicContact CD2-CD2 3.99Å; L112-R136 CarbonylContact O-C 3.53Å; L112-L137 HydrophobicContact CD2-CD1 4.13Å; L112-L137 HydrophobicContact CG-CD1 4.05Å; L112-L137 WeakPolarHBondContact O-CA 3.49Å; L112-L137 PolarHBondContact O-N 3.25Å
113	A	98.4	Very high	96.4	Very high	29 Å²	29	30.8 Å²	30.8	24%	0.24	17%	0.165	C	C	.	.			trans	-109.2	-23.5	-177.4	0	0	0	0	0	111.7	R89 R111 R138 R139	R89-A113 WeakPolarHBondContact O-CA 3.43Å; R89-A113 PolarHBondContact O-N 3.17Å; R111-A113 PolarHBondContact O-N 3Å; R111-A113 VanDerWaalsContact O-N 3.16Å; A113-R138 WeakPolarHBondContact O-CA 3.21Å; A113-R138 PolarHBondContact O-N 3.23Å; A113-R139 PolarHBondContact O-N 3.17Å
114	E	98.8	Very high	96.2	Very high	29 Å²	29	36 Å²	36	14%	0.136	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	129.6	-179	177.7	168.6	-153	0	0	110.9	R89 R90 L91 R116 R139	R89-E114 PolarHBondContact O-N 3.16Å; R90-E114 WeakPolarHBondContact CA-O 3.07Å; R90-E114 WeakPolarHBondContact CD-OE2 3.24Å; R90-E114 HydrophobicContact CG-CB 4.1Å; L91-E114 PolarHBondContact N-O 2.93Å; E114-R116 HydrophobicContact CG-CG 4.31Å; E114-R116 IonicContact OE1-CZ 2.92Å; E114-R116 IonicContact OE1-NE 3.07Å; E114-R116 PolarHBondContact OE1-NE 3.21Å; E114-R116 VanDerWaalsContact OE1-NE 3.07Å; E114-R116 IonicContact OE1-NH1 3.78Å; E114-R116 IonicContact OE1-NH2 2.61Å; E114-R116 PolarHBondContact OE1-NH2 3.03Å; E114-R116 IonicContact OE2-NH2 3.74Å; E114-R139 WeakPolarHBondContact CA-O 3.26Å; E114-R139 HydrophobicContact CB-CB 4.24Å; E114-R139 HydrophobicContact CG-CB 4.04Å
115	L	98.7	Very high	96.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.9	176.4	177	59.7	0	0	0	109.1	L91 L93 F106 L112 L117 F131 L134 L137 R139 L140 D141	L91-L115 HydrophobicContact CB-CD1 4.11Å; L91-L115 HydrophobicContact CD2-CD1 3.94Å; L91-L115 HydrophobicContact CG-CD1 4.03Å; L91-L115 WeakPolarHBondContact O-CA 3.46Å; L93-L115 HydrophobicContact CD1-CD1 4.44Å; F106-L115 HydrophobicContact CD1-CD1 4.49Å; F106-L115 HydrophobicContact CD1-CD2 4.43Å; F106-L115 HydrophobicContact CD2-CD2 4.3Å; F106-L115 HydrophobicContact CE1-CD1 3.93Å; F106-L115 HydrophobicContact CE1-CD2 4.13Å; F106-L115 HydrophobicContact CE2-CD2 3.99Å; F106-L115 HydrophobicContact CZ-CD1 4.28Å; F106-L115 HydrophobicContact CZ-CD2 3.9Å; L112-L115 HydrophobicContact CD2-CB 4.18Å; L115-L117 HydrophobicContact CD1-CG 4.37Å; L115-L117 HydrophobicContact CD2-CD1 4.1Å; L115-L117 HydrophobicContact CG-CD1 4.28Å; L115-L117 HydrophobicContact CG-CG 4.19Å; L115-F131 HydrophobicContact CD2-CD1 3.88Å; L115-F131 HydrophobicContact CD2-CE1 3.63Å; L115-L134 HydrophobicContact CD2-CD1 4.19Å; L115-L137 HydrophobicContact CB-CD1 3.81Å; L115-L137 HydrophobicContact CB-CD2 4.4Å; L115-R139 PolarHBondContact N-O 2.66Å; L115-L140 HydrophobicContact CB-CD1 4.2Å; L115-L140 HydrophobicContact CD2-CD1 4.11Å; L115-L140 HydrophobicContact CG-CD1 4.22Å; L115-D141 PolarHBondContact O-N 3.16Å
116	R	98.8	Very high	96.1	Very high	81 Å²	81	40.8 Å²	40.8	31%	0.306	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	118.4	176.5	-56.3	-170.5	179.1	115.8	-5.9	111.3	L91 L93 R94 E114 D141	L91-R116 PolarHBondContact O-N 2.69Å; L93-R116 PolarHBondContact N-O 3.19Å; R94-R116 HydrophobicContact CG-CB 3.75Å; E114-R116 HydrophobicContact CG-CG 4.31Å; E114-R116 IonicContact OE1-CZ 2.92Å; E114-R116 IonicContact OE1-NE 3.07Å; E114-R116 PolarHBondContact OE1-NE 3.21Å; E114-R116 VanDerWaalsContact OE1-NE 3.07Å; E114-R116 IonicContact OE1-NH1 3.78Å; E114-R116 IonicContact OE1-NH2 2.61Å; E114-R116 PolarHBondContact OE1-NH2 3.03Å; E114-R116 IonicContact OE2-NH2 3.74Å; R116-D141 HydrophobicContact CB-CB 4.31Å; R116-D141 HydrophobicContact CG-CB 4.19Å
117	L	98.2	Very high	96	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.208	C	C	.	.			trans	-118.5	9.6	178.1	-68.2	167.2	0	0	0	111.9	L93 L98 I101 F106 L115 N120 F131 D141 L142 C145	L93-L117 HydrophobicContact CB-CD2 4Å; L93-L117 HydrophobicContact CD1-CD2 3.72Å; L98-L117 HydrophobicContact CD1-CD2 3.96Å; I101-L117 HydrophobicContact CD1-CD1 4.13Å; I101-L117 HydrophobicContact CD1-CD2 4.11Å; F106-L117 HydrophobicContact CZ-CD1 4.46Å; F106-L117 HydrophobicContact CZ-CD2 4.35Å; L115-L117 HydrophobicContact CD1-CG 4.37Å; L115-L117 HydrophobicContact CD2-CD1 4.1Å; L115-L117 HydrophobicContact CG-CD1 4.28Å; L115-L117 HydrophobicContact CG-CG 4.19Å; L117-N120 PolarHBondContact O-ND2 3.06Å; L117-F131 HydrophobicContact CD1-CE1 3.76Å; L117-F131 HydrophobicContact CD1-CZ 3.79Å; L117-D141 WeakPolarHBondContact CA-O 3.17Å; L117-D141 WeakPolarHBondContact CB-O 3.36Å; L117-D141 PolarHBondContact N-O 3.11Å; L117-L142 HydrophobicContact CB-CD2 4.19Å; L117-L142 HydrophobicContact CD1-CD2 3.83Å; L117-C145 PolarHBondContact O-SG 3.28Å
118	A	98.1	Very high	96	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.008	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	151.4	-174.1	0	0	0	0	0	114	R94 H95 N120 D141 A143	R94-A118 CarbonylContact C-O 3.53Å; R94-A118 WeakPolarHBondContact CA-O 3.23Å; R94-A118 HydrophobicContact CG-CB 4.21Å; H95-A118 PolarHBondContact N-O 3.09Å; A118-N120 VanDerWaalsContact C-N 3.32Å; A118-N120 PolarHBondContact O-N 2.87Å; A118-D141 WeakPolarHBondContact CB-OD2 3.19Å; A118-D141 PolarHBondContact N-O 3.16Å; A118-A143 CarbonylContact C-O 3.42Å; A118-A143 WeakPolarHBondContact CA-O 3.35Å; A118-A143 HydrophobicContact CB-CB 4.03Å
119	H	97.8	Very high	95.9	Very high	68 Å²	68	47.6 Å²	47.6	32%	0.315	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	37.7	179.4	-55.3	-82.4	0	0	0	114	H95 A143 A144	H95-H119 AromaticContact CD2-CD2 4Å; H95-H119 AromaticContact CE1-CD2 3.23Å; H95-H119 PolarHBondContact CE1-CD2 2.93Å; H95-H119 AromaticContact CE1-CE1 3.99Å; H95-H119 AromaticContact CE1-CG 3.28Å; H95-H119 AromaticContact CE1-ND1 3.76Å; H95-H119 AromaticContact CE1-NE2 3.71Å; H95-H119 WeakPolarHBondContact ND1-CB 3.09Å; H95-H119 AromaticContact ND1-CD2 3.92Å; H95-H119 AromaticContact ND1-CG 3.62Å; H95-H119 AromaticContact NE2-CD2 3.27Å; H95-H119 PolarHBondContact NE2-CD2 3.03Å; H95-H119 VanDerWaalsContact NE2-CD2 3.27Å; H95-H119 AromaticContact NE2-CG 3.78Å; H95-H119 AromaticContact NE2-NE2 3.81Å; H119-A143 PolarHBondContact N-O 2.98Å; H119-A144 WeakPolarHBondContact CA-O 3.34Å; H119-A144 WeakPolarHBondContact ND1-CB 3.44Å
120	N	97.8	Very high	95.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.219	C	C	.	.			trans	-101.9	77.4	165	-79.1	-79.2	0	0	0	109.3	L93 N96 L98 L117 A118 D122 L123 C145	L93-N120 PolarHBondContact O-ND2 3.04Å; N96-N120 WeakPolarHBondContact CA-OD1 3.24Å; N96-N120 WeakPolarHBondContact CB-OD1 2.96Å; N96-N120 PolarHBondContact O-OD1 3.37Å; N96-N120 VanDerWaalsContact O-OD1 3.12Å; L98-N120 HydrophobicContact CB-CB 4.07Å; L98-N120 WeakPolarHBondContact CB-OD1 3.47Å; L98-N120 VanDerWaalsContact CG-OD1 3.25Å; L98-N120 WeakPolarHBondContact CG-OD1 3.45Å; L98-N120 PolarHBondContact N-OD1 3.42Å; L117-N120 PolarHBondContact O-ND2 3.06Å; A118-N120 VanDerWaalsContact C-N 3.32Å; A118-N120 PolarHBondContact O-N 2.87Å; N120-D122 PolarHBondContact O-N 3.46Å; N120-D122 VanDerWaalsContact O-N 3.11Å; N120-L123 HydrophobicContact CB-CB 4.39Å; N120-L123 WeakPolarHBondContact O-CB 3.4Å; N120-L123 PolarHBondContact O-N 3.03Å; N120-L123 VanDerWaalsContact O-N 3.17Å; N120-C145 WeakPolarHBondContact O-CA 3.08Å
121	G	93.9	Very high	95.8	Very high	21 Å²	21	44.2 Å²	44.2	22%	0.216	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.7	-169.1	0	0	0	0	0	115.7	R146	G121-R146 WeakPolarHBondContact O-CD 3.49Å
122	D	94.5	Very high	95.5	Very high	56 Å²	56	39.9 Å²	39.9	30%	0.299	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-8.7	178.6	-73.7	-20.8	0	0	0	113.5	N97 L98 N120 R124	N97-D122 VanDerWaalsContact CG-OD2 3.29Å; N97-D122 PolarHBondContact ND2-OD2 2.85Å; N97-D122 PolarHBondContact OD1-OD2 2.81Å; L98-D122 CarbonylContact O-C 3.5Å; N120-D122 PolarHBondContact O-N 3.46Å; N120-D122 VanDerWaalsContact O-N 3.11Å; D122-R124 PolarHBondContact O-N 2.85Å
123	L	93.6	Very high	94.9	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	22%	0.215	C	C	.	.			trans	-64.5	-44.8	-169.9	-172.9	55.3	0	0	0	112	L98 I101 N120 Y125 L126	L98-L123 VanDerWaalsContact O-CA 3.25Å; L98-L123 WeakPolarHBondContact O-CA 3.47Å; L98-L123 WeakPolarHBondContact O-CB 3.41Å; L98-L123 PolarHBondContact O-N 2.57Å; I101-L123 HydrophobicContact CD1-CD1 3.95Å; I101-L123 HydrophobicContact CD1-CD2 4Å; I101-L123 HydrophobicContact CG1-CD1 3.84Å; N120-L123 HydrophobicContact CB-CB 4.39Å; N120-L123 WeakPolarHBondContact O-CB 3.4Å; N120-L123 PolarHBondContact O-N 3.03Å; N120-L123 VanDerWaalsContact O-N 3.17Å; L123-Y125 PolarHBondContact O-N 3.1Å; L123-L126 HydrophobicContact CD1-CD2 4.31Å; L123-L126 HydrophobicContact CD2-CD2 3.83Å; L123-L126 HydrophobicContact CD2-CG 4.28Å; L123-L126 HydrophobicContact CG-CD2 4.23Å
124	R	91.1	Very high	94.8	Very high	153 Å²	153	42 Å²	42	58%	0.577	21%	0.205	S	C	*	.			trans	53.7	-36.9	175	-60.7	-176.4	-171.5	-172.6	4.3	117.6	D122 F148	D122-R124 PolarHBondContact O-N 2.85Å; R124-F148 VanDerWaalsContact O-CD1 3.24Å; R124-F148 WeakPolarHBondContact O-CD1 3.17Å; R124-F148 VanDerWaalsContact O-CE1 3.25Å; R124-F148 WeakPolarHBondContact O-CE1 3.47Å
125	Y	92.4	Very high	94.5	Very high	109 Å²	109	42.5 Å²	42.5	43%	0.427	22%	0.217	S	C	.	.			trans	-140.7	144.3	-176.3	176	-100.9	0	0	0	110.6	L123 H127 F148 P151	L123-Y125 PolarHBondContact O-N 3.1Å; Y125-H127 HydrophobicContact CE1-CB 4.22Å; Y125-F148 HydrophobicContact CD2-CZ 4.46Å; Y125-P151 HydrophobicContact CE2-CG 4.36Å
126	L	94.2	Very high	94.4	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.016	25%	0.245	C	C	.	.			trans	-123.1	132.6	172.3	-75.9	169.5	0	0	0	108.6	I101 L123 T130 F131 L142 L147 P151 L154	I101-L126 HydrophobicContact CD1-CD2 4.16Å; L123-L126 HydrophobicContact CD1-CD2 4.31Å; L123-L126 HydrophobicContact CD2-CD2 3.83Å; L123-L126 HydrophobicContact CD2-CG 4.28Å; L123-L126 HydrophobicContact CG-CD2 4.23Å; L126-T130 HydrophobicContact CD2-CG2 4Å; L126-F131 HydrophobicContact CD1-CE2 4.12Å; L126-F131 HydrophobicContact CD1-CZ 4.11Å; L126-F131 HydrophobicContact CD2-CZ 4.35Å; L126-L142 HydrophobicContact CD1-CD1 3.93Å; L126-L142 HydrophobicContact CD1-CD2 4.01Å; L126-L147 HydrophobicContact CD1-CD1 4.04Å; L126-L147 HydrophobicContact CD1-CD2 4.37Å; L126-L147 HydrophobicContact CG-CD2 4.28Å; L126-P151 VanDerWaalsContact O-CG 3.22Å; L126-P151 WeakPolarHBondContact O-CG 3.49Å; L126-L154 HydrophobicContact CB-CD2 3.9Å; L126-L154 HydrophobicContact CD1-CD2 3.92Å
127	H	94.4	Very high	94.4	Very high	65 Å²	65	46 Å²	46	30%	0.301	23%	0.23	S	C	.	.			trans	-74.6	142.8	176.1	-174.7	-84.1	0	0	0	110.3	P103 Y125 R129 T130 L154	P103-H127 HydrophobicContact CG-CB 4.06Å; Y125-H127 HydrophobicContact CE1-CB 4.22Å; H127-R129 PolarHBondContact ND1-N 3.43Å; H127-R129 PolarHBondContact O-N 3.32Å; H127-T130 PolarHBondContact N-OG1 3.14Å; H127-T130 VanDerWaalsContact O-CB 3.29Å; H127-T130 WeakPolarHBondContact O-CB 3.21Å; H127-T130 PolarHBondContact O-N 3.21Å; H127-T130 PolarHBondContact O-OG1 3.4Å; H127-L154 WeakPolarHBondContact O-CD1 3.34Å
128	A	93.9	Very high	94.4	Very high	26 Å²	26	51.9 Å²	51.9	22%	0.215	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-17.2	-175.6	0	0	0	0	0	116.1	P151 R153	A128-P151 HydrophobicContact CB-CB 4.08Å; A128-R153 HydrophobicContact CB-CB 4.24Å
129	R	93	Very high	94.5	Very high	164 Å²	164	56.2 Å²	56.2	62%	0.619	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	10.8	178	-63.5	-168.7	-69.6	-168.3	-3.5	113.6	P103 H127 F131 A132	P103-R129 HydrophobicContact CB-CB 4.28Å; H127-R129 PolarHBondContact ND1-N 3.43Å; H127-R129 PolarHBondContact O-N 3.32Å; R129-F131 VanDerWaalsContact C-N 3.29Å; R129-F131 PolarHBondContact O-N 3.21Å; R129-A132 HydrophobicContact CB-CB 4.17Å; R129-A132 VanDerWaalsContact O-CB 3.25Å; R129-A132 WeakPolarHBondContact O-CB 3.25Å; R129-A132 PolarHBondContact O-N 3.1Å
130	T	94.8	Very high	94.5	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-42.3	-178.8	-68.2	0	0	0	0	111.3	I101 F106 L126 H127	I101-T130 HydrophobicContact CB-CG2 4.03Å; I101-T130 HydrophobicContact CG2-CG2 3.51Å; F106-T130 HydrophobicContact CD2-CG2 4.47Å; F106-T130 WeakPolarHBondContact CD2-O 3.08Å; F106-T130 HydrophobicContact CE2-CG2 4Å; L126-T130 HydrophobicContact CD2-CG2 4Å; H127-T130 PolarHBondContact N-OG1 3.14Å; H127-T130 VanDerWaalsContact O-CB 3.29Å; H127-T130 WeakPolarHBondContact O-CB 3.21Å; H127-T130 PolarHBondContact O-N 3.21Å; H127-T130 PolarHBondContact O-OG1 3.4Å
131	F	94.3	Very high	94.5	Very high	1 Å²	1	54.2 Å²	54.2	0%	0.004	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	17.4	178.4	-52.4	-49	0	0	0	114	F106 L115 L117 L126 R129 L134 L140 L142 L154 L158	F106-F131 AromaticContact CD2-CD1 3.95Å; F106-F131 HydrophobicContact CD2-CD1 3.95Å; F106-F131 HydrophobicContact CD2-CE1 4.26Å; F106-F131 AromaticContact CE2-CD1 3.88Å; F106-F131 HydrophobicContact CE2-CD1 3.88Å; F106-F131 AromaticContact CE2-CE1 3.72Å; F106-F131 HydrophobicContact CE2-CE1 3.72Å; L115-F131 HydrophobicContact CD2-CD1 3.88Å; L115-F131 HydrophobicContact CD2-CE1 3.63Å; L117-F131 HydrophobicContact CD1-CE1 3.76Å; L117-F131 HydrophobicContact CD1-CZ 3.79Å; L126-F131 HydrophobicContact CD1-CE2 4.12Å; L126-F131 HydrophobicContact CD1-CZ 4.11Å; L126-F131 HydrophobicContact CD2-CZ 4.35Å; R129-F131 VanDerWaalsContact C-N 3.29Å; R129-F131 PolarHBondContact O-N 3.21Å; F131-L134 HydrophobicContact CB-CD1 4.08Å; F131-L134 HydrophobicContact CD1-CD1 4.1Å; F131-L134 WeakPolarHBondContact O-CB 3.14Å; F131-L134 PolarHBondContact O-N 2.98Å; F131-L140 HydrophobicContact CD2-CD2 3.97Å; F131-L140 HydrophobicContact CE1-CD1 4.3Å; F131-L140 HydrophobicContact CE2-CD1 4.24Å; F131-L140 HydrophobicContact CE2-CD2 3.7Å; F131-L140 HydrophobicContact CZ-CD1 4.02Å; F131-L140 HydrophobicContact CZ-CD2 4.31Å; F131-L142 HydrophobicContact CE2-CD1 4.46Å; F131-L142 HydrophobicContact CE2-CD2 4.37Å; F131-L142 HydrophobicContact CZ-CD2 3.94Å; F131-L154 HydrophobicContact CD2-CD1 3.71Å; F131-L154 HydrophobicContact CD2-CD2 4.03Å; F131-L154 HydrophobicContact CD2-CG 3.76Å; F131-L154 HydrophobicContact CE2-CD1 4.09Å; F131-L154 HydrophobicContact CE2-CD2 3.78Å; F131-L154 HydrophobicContact CE2-CG 4.05Å; F131-L154 HydrophobicContact CG-CD1 4.43Å; F131-L158 HydrophobicContact CB-CD1 4.3Å; F131-L158 HydrophobicContact CB-CD2 3.96Å; F131-L158 HydrophobicContact CB-CG 4.46Å; F131-L158 HydrophobicContact CD2-CD1 4.34Å
132	A	89.7	Confident	94.7	Very high	26 Å²	26	53.3 Å²	53.3	22%	0.215	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	143.9	176.8	0	0	0	0	0	110.6	R129 L134	R129-A132 HydrophobicContact CB-CB 4.17Å; R129-A132 VanDerWaalsContact O-CB 3.25Å; R129-A132 WeakPolarHBondContact O-CB 3.25Å; R129-A132 PolarHBondContact O-N 3.1Å; A132-L134 VanDerWaalsContact C-N 3.26Å; A132-L134 PolarHBondContact O-N 2.67Å
133	A	86.9	Confident	94.9	Very high	73 Å²	73	50.7 Å²	50.7	60%	0.603	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.8	5	-177	0	0	0	0	0	116.6	G135	A133-G135 PolarHBondContact O-N 3.13Å; A133-G135 VanDerWaalsContact O-N 3.13Å
134	L	95.1	Very high	95.1	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	24%	0.243	C	C	.	.			trans	-86.6	49.7	173.5	-61.3	-175	0	0	0	112.7	F106 L109 L112 L115 F131 A132 R136 L137 L158	F106-L134 HydrophobicContact CB-CD1 3.98Å; F106-L134 HydrophobicContact CB-CD2 3.96Å; F106-L134 HydrophobicContact CB-CG 4.24Å; F106-L134 HydrophobicContact CD2-CD1 4.36Å; F106-L134 HydrophobicContact CG-CD1 4.29Å; L109-L134 HydrophobicContact CB-CD2 4.31Å; L112-L134 HydrophobicContact CB-CD2 4.24Å; L112-L134 HydrophobicContact CD2-CD1 4.2Å; L112-L134 HydrophobicContact CD2-CD2 3.99Å; L115-L134 HydrophobicContact CD2-CD1 4.19Å; F131-L134 HydrophobicContact CB-CD1 4.08Å; F131-L134 HydrophobicContact CD1-CD1 4.1Å; F131-L134 WeakPolarHBondContact O-CB 3.14Å; F131-L134 PolarHBondContact O-N 2.98Å; A132-L134 VanDerWaalsContact C-N 3.26Å; A132-L134 PolarHBondContact O-N 2.67Å; L134-R136 PolarHBondContact O-N 3.04Å; L134-L137 HydrophobicContact CB-CB 4.11Å; L134-L137 HydrophobicContact CD1-CD2 4.21Å; L134-L137 VanDerWaalsContact O-CB 3.3Å; L134-L137 WeakPolarHBondContact O-CB 3.2Å; L134-L137 PolarHBondContact O-N 3.12Å; L134-L158 HydrophobicContact CB-CD2 3.86Å
135	G	93.9	Very high	95.3	Very high	39 Å²	39	44.1 Å²	44.1	40%	0.402	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-9.4	-172.3	0	0	0	0	0	116.1	A133 A160	A133-G135 PolarHBondContact O-N 3.13Å; A133-G135 VanDerWaalsContact O-N 3.13Å; G135-A160 WeakPolarHBondContact O-CB 3.45Å
136	R	97	Very high	95.5	Very high	154 Å²	154	45.7 Å²	45.7	58%	0.581	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.7	1.6	175.9	-67.6	-166.7	173.8	-170.8	-0.6	113.9	P110 L112 L134 R138	P110-R136 WeakPolarHBondContact O-CD 3.15Å; L112-R136 CarbonylContact O-C 3.53Å; L134-R136 PolarHBondContact O-N 3.04Å; R136-R138 PolarHBondContact O-N 3.32Å
137	L	98.1	Very high	95.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.22	C	C	.	.			trans	-65.7	125.2	-178	-162.8	72.8	0	0	0	109.9	L112 L115 L134 L140 L158 A160 L161	L112-L137 HydrophobicContact CD2-CD1 4.13Å; L112-L137 HydrophobicContact CG-CD1 4.05Å; L112-L137 WeakPolarHBondContact O-CA 3.49Å; L112-L137 PolarHBondContact O-N 3.25Å; L115-L137 HydrophobicContact CB-CD1 3.81Å; L115-L137 HydrophobicContact CB-CD2 4.4Å; L134-L137 HydrophobicContact CB-CB 4.11Å; L134-L137 HydrophobicContact CD1-CD2 4.21Å; L134-L137 VanDerWaalsContact O-CB 3.3Å; L134-L137 WeakPolarHBondContact O-CB 3.2Å; L134-L137 PolarHBondContact O-N 3.12Å; L137-L140 HydrophobicContact CD2-CB 4.12Å; L137-L140 HydrophobicContact CD2-CD1 4.23Å; L137-L158 HydrophobicContact CB-CD2 4.21Å; L137-L158 HydrophobicContact CD2-CD1 4.12Å; L137-L158 HydrophobicContact CD2-CD2 4.09Å; L137-A160 CarbonylContact O-C 3.21Å; L137-L161 WeakPolarHBondContact O-CA 3.42Å; L137-L161 PolarHBondContact O-N 2.89Å; L137-L161 VanDerWaalsContact O-N 3.16Å
138	R	98.5	Very high	95.6	Very high	124 Å²	124	48.1 Å²	48.1	47%	0.468	23%	0.231	S	C	.	.			trans	-109.9	-32.6	-178.8	-67.5	179.8	178.5	177.8	-1.4	112.2	A113 R136 R162 E163	A113-R138 WeakPolarHBondContact O-CA 3.21Å; A113-R138 PolarHBondContact O-N 3.23Å; R136-R138 PolarHBondContact O-N 3.32Å; R138-R162 PolarHBondContact O-N 3.31Å; R138-E163 PolarHBondContact O-N 2.85Å
139	R	98.8	Very high	95.5	Very high	91 Å²	91	49 Å²	49	34%	0.343	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.7	-179.3	-58.8	-175.8	-179.4	-109.7	-8.5	109.5	A113 E114 L115 E163	A113-R139 PolarHBondContact O-N 3.17Å; E114-R139 WeakPolarHBondContact CA-O 3.26Å; E114-R139 HydrophobicContact CB-CB 4.24Å; E114-R139 HydrophobicContact CG-CB 4.04Å; L115-R139 PolarHBondContact N-O 2.66Å; R139-E163 WeakPolarHBondContact CA-O 3.24Å; R139-E163 HydrophobicContact CG-CB 4.13Å; R139-E163 IonicContact CZ-OE1 3.97Å; R139-E163 IonicContact CZ-OE2 3.21Å; R139-E163 IonicContact NE-OE2 3.98Å; R139-E163 IonicContact NH1-OE1 2.93Å; R139-E163 PolarHBondContact NH1-OE1 2.79Å; R139-E163 IonicContact NH1-OE2 2.65Å; R139-E163 PolarHBondContact NH1-OE2 3.23Å; R139-E163 IonicContact NH2-OE2 3.64Å
140	L	98.6	Very high	95.5	Very high	3 Å²	3	42 Å²	42	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	123.3	174.8	178.1	60.7	0	0	0	108.8	L115 F131 L137 L142 L155 L158 L161 E163 L164 A165	L115-L140 HydrophobicContact CB-CD1 4.2Å; L115-L140 HydrophobicContact CD2-CD1 4.11Å; L115-L140 HydrophobicContact CG-CD1 4.22Å; F131-L140 HydrophobicContact CD2-CD2 3.97Å; F131-L140 HydrophobicContact CE1-CD1 4.3Å; F131-L140 HydrophobicContact CE2-CD1 4.24Å; F131-L140 HydrophobicContact CE2-CD2 3.7Å; F131-L140 HydrophobicContact CZ-CD1 4.02Å; F131-L140 HydrophobicContact CZ-CD2 4.31Å; L137-L140 HydrophobicContact CD2-CB 4.12Å; L137-L140 HydrophobicContact CD2-CD1 4.23Å; L140-L142 HydrophobicContact CD1-CD2 4Å; L140-L142 HydrophobicContact CD1-CG 4.27Å; L140-L142 HydrophobicContact CD2-CD1 4.05Å; L140-L142 HydrophobicContact CD2-CG 4.21Å; L140-L142 HydrophobicContact CG-CD1 4.36Å; L140-L142 HydrophobicContact CG-CD2 4.26Å; L140-L142 HydrophobicContact CG-CG 3.97Å; L140-L155 HydrophobicContact CD2-CD2 3.86Å; L140-L158 HydrophobicContact CD2-CD1 4Å; L140-L161 HydrophobicContact CB-CD1 3.78Å; L140-E163 PolarHBondContact N-O 3.28Å; L140-L164 HydrophobicContact CB-CD1 4.17Å; L140-L164 HydrophobicContact CD2-CD1 4.04Å; L140-L164 HydrophobicContact CG-CD1 4.12Å; L140-L164 WeakPolarHBondContact O-CA 3.45Å; L140-A165 PolarHBondContact O-N 3.32Å
141	D	98.6	Very high	95.4	Very high	24 Å²	24	43.3 Å²	43.3	13%	0.128	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	110.4	178	177.3	13.2	0	0	0	110.4	L115 R116 L117 A118 A143 A165	L115-D141 PolarHBondContact O-N 3.16Å; R116-D141 HydrophobicContact CB-CB 4.31Å; R116-D141 HydrophobicContact CG-CB 4.19Å; L117-D141 WeakPolarHBondContact CA-O 3.17Å; L117-D141 WeakPolarHBondContact CB-O 3.36Å; L117-D141 PolarHBondContact N-O 3.11Å; A118-D141 WeakPolarHBondContact CB-OD2 3.19Å; A118-D141 PolarHBondContact N-O 3.16Å; D141-A143 WeakPolarHBondContact OD1-CB 3.3Å; D141-A143 PolarHBondContact OD1-N 3.48Å; D141-A165 HydrophobicContact CB-CB 4.21Å
142	L	97.6	Very high	95.2	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	25%	0.251	C	S	.	.			trans	-115	20	177.6	-58.7	180	0	0	0	111.4	L117 L126 F131 L140 C145 L147 L164 A165 A166 N169	L117-L142 HydrophobicContact CB-CD2 4.19Å; L117-L142 HydrophobicContact CD1-CD2 3.83Å; L126-L142 HydrophobicContact CD1-CD1 3.93Å; L126-L142 HydrophobicContact CD1-CD2 4.01Å; F131-L142 HydrophobicContact CE2-CD1 4.46Å; F131-L142 HydrophobicContact CE2-CD2 4.37Å; F131-L142 HydrophobicContact CZ-CD2 3.94Å; L140-L142 HydrophobicContact CD1-CD2 4Å; L140-L142 HydrophobicContact CD1-CG 4.27Å; L140-L142 HydrophobicContact CD2-CD1 4.05Å; L140-L142 HydrophobicContact CD2-CG 4.21Å; L140-L142 HydrophobicContact CG-CD1 4.36Å; L140-L142 HydrophobicContact CG-CD2 4.26Å; L140-L142 HydrophobicContact CG-CG 3.97Å; L142-C145 PolarHBondContact O-SG 3.17Å; L142-C145 VanDerWaalsContact O-SG 3.42Å; L142-L147 HydrophobicContact CB-CD1 4.05Å; L142-L147 HydrophobicContact CD1-CD1 4.19Å; L142-L164 HydrophobicContact CD1-CD1 4.43Å; L142-A165 PolarHBondContact N-O 3.16Å; L142-A166 HydrophobicContact CB-CB 4.45Å; L142-N169 PolarHBondContact O-ND2 3.38Å
143	A	98.1	Very high	95.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	147.7	-176.7	0	0	0	0	0	112.5	A118 H119 D141 C145 A165 F167	A118-A143 CarbonylContact C-O 3.42Å; A118-A143 WeakPolarHBondContact CA-O 3.35Å; A118-A143 HydrophobicContact CB-CB 4.03Å; H119-A143 PolarHBondContact N-O 2.98Å; D141-A143 WeakPolarHBondContact OD1-CB 3.3Å; D141-A143 PolarHBondContact OD1-N 3.48Å; A143-C145 PolarHBondContact O-N 2.82Å; A143-C145 VanDerWaalsContact O-N 3.1Å; A143-C145 PolarHBondContact O-SG 3.16Å; A143-C145 VanDerWaalsContact O-SG 3.34Å; A143-A165 PolarHBondContact N-O 3.29Å; A143-F167 VanDerWaalsContact CA-O 3.29Å; A143-F167 WeakPolarHBondContact CA-O 3.36Å; A143-F167 HydrophobicContact CB-CD1 3.95Å; A143-F167 HydrophobicContact CB-CD2 3.64Å; A143-F167 HydrophobicContact CB-CE1 3.64Å; A143-F167 HydrophobicContact CB-CE2 3.36Å; A143-F167 HydrophobicContact CB-CG 3.96Å; A143-F167 HydrophobicContact CB-CZ 3.34Å
144	A	97.3	Very high	95.4	Very high	20 Å²	20	54.8 Å²	54.8	17%	0.165	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	35	173.4	0	0	0	0	0	114.7	H119 F167 D168	H119-A144 WeakPolarHBondContact CA-O 3.34Å; H119-A144 WeakPolarHBondContact ND1-CB 3.44Å; A144-F167 PolarHBondContact N-O 3.48Å; A144-D168 WeakPolarHBondContact CA-O 3.23Å; A144-D168 HydrophobicContact CB-CB 4.02Å
145	C	96.7	Very high	95.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-98.2	5.1	179.4	-69	0	0	0	0	113.3	L117 N120 L142 A143 L147 N169	L117-C145 PolarHBondContact O-SG 3.28Å; N120-C145 WeakPolarHBondContact O-CA 3.08Å; L142-C145 PolarHBondContact O-SG 3.17Å; L142-C145 VanDerWaalsContact O-SG 3.42Å; A143-C145 PolarHBondContact O-N 2.82Å; A143-C145 VanDerWaalsContact O-N 3.1Å; A143-C145 PolarHBondContact O-SG 3.16Å; A143-C145 VanDerWaalsContact O-SG 3.34Å; C145-L147 HydrophobicContact CB-CD1 4.07Å; C145-L147 HydrophobicContact CB-CD2 4.37Å; C145-L147 HydrophobicContact CB-CG 3.75Å; C145-L147 PolarHBondContact O-N 2.89Å; C145-N169 PolarHBondContact N-OD1 3.37Å
146	R	95.7	Very high	94.9	Very high	141 Å²	141	56 Å²	56	53%	0.532	25%	0.254	S	S	.	.			trans	52.3	32.4	-173.6	-61.3	-169.8	176.4	155.9	-8.7	113.3	G121 F148 N169 L170	G121-R146 WeakPolarHBondContact O-CD 3.49Å; R146-F148 PolarHBondContact O-N 3.08Å; R146-N169 PolarHBondContact N-OD1 2.93Å; R146-L170 HydrophobicContact CB-CD1 4.07Å; R146-L170 HydrophobicContact CB-CG 4.46Å
147	L	95.6	Very high	94.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.249	C	C	.	.			trans	-70.5	129.8	178.6	-62.2	173	0	0	0	109.7	L126 L142 C145 N169 L170 F171	L126-L147 HydrophobicContact CD1-CD1 4.04Å; L126-L147 HydrophobicContact CD1-CD2 4.37Å; L126-L147 HydrophobicContact CG-CD2 4.28Å; L142-L147 HydrophobicContact CB-CD1 4.05Å; L142-L147 HydrophobicContact CD1-CD1 4.19Å; C145-L147 HydrophobicContact CB-CD1 4.07Å; C145-L147 HydrophobicContact CB-CD2 4.37Å; C145-L147 HydrophobicContact CB-CG 3.75Å; C145-L147 PolarHBondContact O-N 2.89Å; L147-N169 HydrophobicContact CB-CB 4.49Å; L147-N169 PolarHBondContact N-OD1 2.99Å; L147-L170 CarbonylContact O-C 3.58Å; L147-L170 WeakPolarHBondContact O-CA 3.32Å; L147-L170 WeakPolarHBondContact O-CB 3.49Å; L147-L170 PolarHBondContact O-N 2.98Å; L147-F171 HydrophobicContact CB-CE1 3.64Å; L147-F171 HydrophobicContact CB-CZ 3.85Å; L147-F171 HydrophobicContact CD1-CZ 4.38Å; L147-F171 WeakPolarHBondContact O-CD1 3.47Å; L147-F171 WeakPolarHBondContact O-CE1 3.39Å
148	F	94.4	Very high	94	Very high	119 Å²	119	53.7 Å²	53.7	52%	0.522	25%	0.25	S	C	.	.	S	Bend	trans	-94.2	-21.3	175	65.4	-89.7	0	0	0	112.7	R124 Y125 R146 L170	R124-F148 VanDerWaalsContact O-CD1 3.24Å; R124-F148 WeakPolarHBondContact O-CD1 3.17Å; R124-F148 VanDerWaalsContact O-CE1 3.25Å; R124-F148 WeakPolarHBondContact O-CE1 3.47Å; Y125-F148 HydrophobicContact CD2-CZ 4.46Å; R146-F148 PolarHBondContact O-N 3.08Å; F148-L170 HydrophobicContact CB-CB 4.39Å
149	S	93.6	Very high	93.7	Very high	45 Å²	45	51.8 Å²	51.8	32%	0.315	25%	0.253	S	S	.	.			trans	-153.1	162.3	177	63.9	0	0	0	0	111.1
150	V	92.9	Very high	93.6	Very high	17 Å²	17	48.6 Å²	48.6	10%	0.103	25%	0.247	C	C	.	.			trans	-126.4	121.4	169.7	-177.6	0	0	0	0	107	E152 L154 L155 F171 P175 A177	V150-E152 PolarHBondContact O-N 3.48Å; V150-L154 HydrophobicContact CG1-CB 4.12Å; V150-L154 HydrophobicContact CG1-CD2 3.54Å; V150-L154 HydrophobicContact CG1-CG 4.4Å; V150-L155 HydrophobicContact CG1-CD1 4.42Å; V150-L155 HydrophobicContact CG1-CG 4.23Å; V150-F171 HydrophobicContact CG2-CE1 3.7Å; V150-F171 HydrophobicContact CG2-CZ 3.69Å; V150-P175 HydrophobicContact CB-CB 4.27Å; V150-P175 HydrophobicContact CG2-CB 4.43Å; V150-A177 HydrophobicContact CB-CB 4.13Å; V150-A177 HydrophobicContact CG1-CB 3.73Å
151	P	92.9	Very high	93.6	Very high	29 Å²	29	48.5 Å²	48.5	19%	0.188	25%	0.246	C	C	.	.			trans	-59.4	138.4	177.2	-22.2	31.8	0	0	0	111.2	Y125 L126 A128 R153 L154 A177	Y125-P151 HydrophobicContact CE2-CG 4.36Å; L126-P151 VanDerWaalsContact O-CG 3.22Å; L126-P151 WeakPolarHBondContact O-CG 3.49Å; A128-P151 HydrophobicContact CB-CB 4.08Å; P151-R153 VanDerWaalsContact C-N 3.28Å; P151-R153 PolarHBondContact O-N 3.44Å; P151-L154 HydrophobicContact CB-CB 4.42Å; P151-L154 WeakPolarHBondContact O-CB 3.15Å; P151-L154 PolarHBondContact O-N 3.05Å; P151-A177 WeakPolarHBondContact O-CB 3.17Å
152	E	88.5	Confident	93.6	Very high	143 Å²	143	53.2 Å²	53.2	67%	0.668	26%	0.262	S	S	*	.	H	α-helix	trans	-55.4	-42.9	-174.2	-65.3	-175.6	168.8	0	0	113.2	V150 L154	V150-E152 PolarHBondContact O-N 3.48Å; E152-L154 PolarHBondContact O-N 3.35Å
153	R	89.3	Confident	93.6	Very high	197 Å²	197	55 Å²	55	74%	0.743	27%	0.27	S	S	*	.	H	α-helix	trans	-69.4	-16.3	179.6	-65.7	-175.2	-176.9	170	0.8	113.9	A128 P151 L155 E157	A128-R153 HydrophobicContact CB-CB 4.24Å; P151-R153 VanDerWaalsContact C-N 3.28Å; P151-R153 PolarHBondContact O-N 3.44Å; R153-L155 PolarHBondContact O-N 3.07Å; R153-E157 WeakPolarHBondContact O-CG 3.11Å
154	L	92.7	Very high	93.6	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-44.6	-174.9	-176	73.4	0	0	0	112.2	L126 H127 F131 V150 P151 E152	L126-L154 HydrophobicContact CB-CD2 3.9Å; L126-L154 HydrophobicContact CD1-CD2 3.92Å; H127-L154 WeakPolarHBondContact O-CD1 3.34Å; F131-L154 HydrophobicContact CD2-CD1 3.71Å; F131-L154 HydrophobicContact CD2-CD2 4.03Å; F131-L154 HydrophobicContact CD2-CG 3.76Å; F131-L154 HydrophobicContact CE2-CD1 4.09Å; F131-L154 HydrophobicContact CE2-CD2 3.78Å; F131-L154 HydrophobicContact CE2-CG 4.05Å; F131-L154 HydrophobicContact CG-CD1 4.43Å; V150-L154 HydrophobicContact CG1-CB 4.12Å; V150-L154 HydrophobicContact CG1-CD2 3.54Å; V150-L154 HydrophobicContact CG1-CG 4.4Å; P151-L154 HydrophobicContact CB-CB 4.42Å; P151-L154 WeakPolarHBondContact O-CB 3.15Å; P151-L154 PolarHBondContact O-N 3.05Å; E152-L154 PolarHBondContact O-N 3.35Å
155	L	93.1	Very high	93.7	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-92.2	-22.5	-177.2	-56.9	-177.7	0	0	0	112.5	L140 V150 R153 E157 L158 L161 L164 A177 L178 L181	L140-L155 HydrophobicContact CD2-CD2 3.86Å; V150-L155 HydrophobicContact CG1-CD1 4.42Å; V150-L155 HydrophobicContact CG1-CG 4.23Å; R153-L155 PolarHBondContact O-N 3.07Å; L155-E157 PolarHBondContact O-N 3.4Å; L155-L158 HydrophobicContact CD2-CD1 3.96Å; L155-L158 WeakPolarHBondContact O-CB 3.46Å; L155-L158 PolarHBondContact O-N 3.26Å; L155-L161 HydrophobicContact CD2-CD2 4.45Å; L155-L164 HydrophobicContact CD1-CD2 3.94Å; L155-A177 HydrophobicContact CB-CB 4.32Å; L155-A177 WeakPolarHBondContact CB-O 3.17Å; L155-A177 HydrophobicContact CD1-CB 3.86Å; L155-A177 HydrophobicContact CG-CB 4Å; L155-L178 HydrophobicContact CD1-CD2 4.07Å; L155-L181 HydrophobicContact CB-CD1 3.95Å; L155-L181 HydrophobicContact CB-CD2 4.17Å; L155-L181 HydrophobicContact CD1-CD1 4.06Å; L155-L181 WeakPolarHBondContact O-CD2 3.37Å
156	A	85.8	Confident	93.7	Very high	66 Å²	66	55 Å²	55	55%	0.545	27%	0.27	S	S	.	.	H	α-helix	trans	-57.6	-28.9	174.9	0	0	0	0	0	112.6	L158	A156-L158 PolarHBondContact O-N 3.28Å
157	E	82.6	Confident	93.8	Very high	102 Å²	102	50.4 Å²	50.4	48%	0.477	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	2.5	175.7	-63.7	-66.1	146.6	0	0	113.9	R153 L155 P159	R153-E157 WeakPolarHBondContact O-CG 3.11Å; L155-E157 PolarHBondContact O-N 3.4Å; E157-P159 WeakPolarHBondContact O-CD 3.48Å
158	L	93.6	Very high	93.9	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.269	C	S	.	.			trans	-116.5	68.3	-176.9	-55.4	176.6	0	0	0	111.4	F131 L134 L137 L140 L155 A156 A160 L161	F131-L158 HydrophobicContact CB-CD1 4.3Å; F131-L158 HydrophobicContact CB-CD2 3.96Å; F131-L158 HydrophobicContact CB-CG 4.46Å; F131-L158 HydrophobicContact CD2-CD1 4.34Å; L134-L158 HydrophobicContact CB-CD2 3.86Å; L137-L158 HydrophobicContact CB-CD2 4.21Å; L137-L158 HydrophobicContact CD2-CD1 4.12Å; L137-L158 HydrophobicContact CD2-CD2 4.09Å; L140-L158 HydrophobicContact CD2-CD1 4Å; L155-L158 HydrophobicContact CD2-CD1 3.96Å; L155-L158 WeakPolarHBondContact O-CB 3.46Å; L155-L158 PolarHBondContact O-N 3.26Å; A156-L158 PolarHBondContact O-N 3.28Å; L158-A160 PolarHBondContact O-N 3Å; L158-A160 VanDerWaalsContact O-N 3.08Å; L158-L161 HydrophobicContact CB-CB 3.98Å; L158-L161 HydrophobicContact CD1-CD2 4.28Å; L158-L161 VanDerWaalsContact O-CB 3.31Å; L158-L161 WeakPolarHBondContact O-CB 3.25Å; L158-L161 PolarHBondContact O-N 2.91Å
159	P	91.7	Very high	94.1	Very high	84 Å²	84	47.9 Å²	47.9	55%	0.545	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.2	-172.4	27.7	-37.1	0	0	0	114	E157 N183	E157-P159 WeakPolarHBondContact O-CD 3.48Å; P159-N183 PolarHBondContact O-ND2 2.93Å
160	A	96.4	Very high	94.2	Very high	24 Å²	24	48.3 Å²	48.3	20%	0.198	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	1.2	179.3	0	0	0	0	0	113.7	G135 L137 L158 R162	G135-A160 WeakPolarHBondContact O-CB 3.45Å; L137-A160 CarbonylContact O-C 3.21Å; L158-A160 PolarHBondContact O-N 3Å; L158-A160 VanDerWaalsContact O-N 3.08Å; A160-R162 PolarHBondContact O-N 3.02Å
161	L	97.8	Very high	94.4	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	24%	0.241	C	C	.	.			trans	-63.9	130.3	-174.9	-166.5	68.9	0	0	0	110.6	L137 L140 L155 L158 L181 N183 L184	L137-L161 WeakPolarHBondContact O-CA 3.42Å; L137-L161 PolarHBondContact O-N 2.89Å; L137-L161 VanDerWaalsContact O-N 3.16Å; L140-L161 HydrophobicContact CB-CD1 3.78Å; L155-L161 HydrophobicContact CD2-CD2 4.45Å; L158-L161 HydrophobicContact CB-CB 3.98Å; L158-L161 HydrophobicContact CD1-CD2 4.28Å; L158-L161 VanDerWaalsContact O-CB 3.31Å; L158-L161 WeakPolarHBondContact O-CB 3.25Å; L158-L161 PolarHBondContact O-N 2.91Å; L161-L181 HydrophobicContact CD2-CD1 4.39Å; L161-N183 CarbonylContact O-C 3.52Å; L161-L184 HydrophobicContact CD2-CD1 4.12Å; L161-L184 HydrophobicContact CG-CD1 4.07Å; L161-L184 PolarHBondContact O-N 3.21Å
162	R	98.4	Very high	94.5	Very high	122 Å²	122	55.1 Å²	55.1	46%	0.46	27%	0.265	S	S	.	.			trans	-118.8	-34.3	-179.4	-65.9	-176.8	-179	-174.4	-4.3	111.9	R138 A160 T185 H186	R138-R162 PolarHBondContact O-N 3.31Å; A160-R162 PolarHBondContact O-N 3.02Å; R162-T185 PolarHBondContact O-N 3.45Å; R162-T185 PolarHBondContact O-OG1 2.99Å; R162-H186 PolarHBondContact O-N 2.82Å
163	E	98.8	Very high	94.8	Very high	39 Å²	39	57.4 Å²	57.4	18%	0.182	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	124.3	-175.4	-172.8	172.8	127.4	0	0	109.7	R138 R139 L140 H186	R138-E163 PolarHBondContact O-N 2.85Å; R139-E163 WeakPolarHBondContact CA-O 3.24Å; R139-E163 HydrophobicContact CG-CB 4.13Å; R139-E163 IonicContact CZ-OE1 3.97Å; R139-E163 IonicContact CZ-OE2 3.21Å; R139-E163 IonicContact NE-OE2 3.98Å; R139-E163 IonicContact NH1-OE1 2.93Å; R139-E163 PolarHBondContact NH1-OE1 2.79Å; R139-E163 IonicContact NH1-OE2 2.65Å; R139-E163 PolarHBondContact NH1-OE2 3.23Å; R139-E163 IonicContact NH2-OE2 3.64Å; L140-E163 PolarHBondContact N-O 3.28Å; E163-H186 WeakPolarHBondContact CA-O 3.34Å; E163-H186 HydrophobicContact CB-CB 4.39Å; E163-H186 HydrophobicContact CG-CB 4Å
164	L	98.4	Very high	95.1	Very high	7 Å²	7	48.4 Å²	48.4	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.5	171.9	179.6	69.7	0	0	0	108.8	L140 L142 L155 A166 L178 L184 H186 H188	L140-L164 HydrophobicContact CB-CD1 4.17Å; L140-L164 HydrophobicContact CD2-CD1 4.04Å; L140-L164 HydrophobicContact CG-CD1 4.12Å; L140-L164 WeakPolarHBondContact O-CA 3.45Å; L142-L164 HydrophobicContact CD1-CD1 4.43Å; L155-L164 HydrophobicContact CD1-CD2 3.94Å; L164-A166 HydrophobicContact CD2-CB 4.36Å; L164-A166 HydrophobicContact CG-CB 4.2Å; L164-L178 HydrophobicContact CD2-CD2 3.56Å; L164-L184 HydrophobicContact CB-CD1 4.13Å; L164-H186 PolarHBondContact N-O 3.49Å; L164-H188 PolarHBondContact O-N 2.81Å
165	A	98.6	Very high	95.2	Very high	12 Å²	12	49 Å²	49	10%	0.099	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	115.6	164.6	0	0	0	0	0	109	L140 D141 L142 A143 F167	L140-A165 PolarHBondContact O-N 3.32Å; D141-A165 HydrophobicContact CB-CB 4.21Å; L142-A165 PolarHBondContact N-O 3.16Å; A143-A165 PolarHBondContact N-O 3.29Å; A165-F167 HydrophobicContact CB-CD1 4.19Å; A165-F167 HydrophobicContact CB-CE1 4.02Å
166	A	97.6	Very high	95.2	Very high	3 Å²	3	50.4 Å²	50.4	3%	0.025	25%	0.253	C	S	.	.			trans	-141.5	28.9	177.9	0	0	0	0	0	111.9	L142 L164 N169 F171 H188 L189	L142-A166 HydrophobicContact CB-CB 4.45Å; L164-A166 HydrophobicContact CD2-CB 4.36Å; L164-A166 HydrophobicContact CG-CB 4.2Å; A166-N169 VanDerWaalsContact C-ND2 3.34Å; A166-N169 PolarHBondContact O-ND2 2.84Å; A166-F171 HydrophobicContact CB-CE2 3.91Å; A166-F171 HydrophobicContact CB-CZ 4.45Å; A166-F171 WeakPolarHBondContact O-CE2 3.4Å; A166-H188 CarbonylContact C-O 2.99Å; A166-H188 PolarHBondContact N-O 3.45Å; A166-L189 HydrophobicContact CB-CD2 4.04Å
167	F	98.1	Very high	95.6	Very high	43 Å²	43	47.4 Å²	47.4	19%	0.189	23%	0.228	C	C	.	.			trans	-68.8	168.1	174.3	62.3	-104.2	0	0	0	112.4	A143 A144 A165 N169 H188 E190	A143-F167 VanDerWaalsContact CA-O 3.29Å; A143-F167 WeakPolarHBondContact CA-O 3.36Å; A143-F167 HydrophobicContact CB-CD1 3.95Å; A143-F167 HydrophobicContact CB-CD2 3.64Å; A143-F167 HydrophobicContact CB-CE1 3.64Å; A143-F167 HydrophobicContact CB-CE2 3.36Å; A143-F167 HydrophobicContact CB-CG 3.96Å; A143-F167 HydrophobicContact CB-CZ 3.34Å; A144-F167 PolarHBondContact N-O 3.48Å; A165-F167 HydrophobicContact CB-CD1 4.19Å; A165-F167 HydrophobicContact CB-CE1 4.02Å; F167-N169 PolarHBondContact O-N 3.32Å; F167-N169 PolarHBondContact O-ND2 3.28Å; F167-H188 HydrophobicContact CD1-CB 4.14Å; F167-H188 PolarHBondContact N-O 3.49Å; F167-H188 VanDerWaalsContact N-O 3.16Å; F167-E190 CarbonylContact C-O 3.48Å; F167-E190 WeakPolarHBondContact CA-O 3.44Å; F167-E190 HydrophobicContact CB-CG 3.73Å; F167-E190 WeakPolarHBondContact CB-O 3.2Å; F167-E190 WeakPolarHBondContact CB-OE1 3.49Å; F167-E190 WeakPolarHBondContact CD1-OE1 3.14Å; F167-E190 HydrophobicContact CG-CG 4.45Å
168	D	97.4	Very high	96.2	Very high	61 Å²	61	42.5 Å²	42.5	33%	0.326	21%	0.205	S	C	.	.	S	Bend	trans	55.7	35.4	-179	-68.4	-47.5	0	0	0	112.8	A144 E190 R191	A144-D168 WeakPolarHBondContact CA-O 3.23Å; A144-D168 HydrophobicContact CB-CB 4.02Å; D168-E190 PolarHBondContact N-O 3.08Å; D168-R191 WeakPolarHBondContact CA-O 3.49Å; D168-R191 WeakPolarHBondContact OD1-CB 3.48Å; D168-R191 IonicContact OD1-NE 3.92Å; D168-R191 PolarHBondContact OD1-NE 2.99Å; D168-R191 IonicContact OD2-CZ 2.69Å; D168-R191 IonicContact OD2-NE 2.85Å; D168-R191 PolarHBondContact OD2-NE 3.11Å; D168-R191 IonicContact OD2-NH2 3.79Å; D168-R191 PolarHBondContact OD2-NH2 3.26Å
169	N	97.6	Very high	96.2	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.027	23%	0.23	C	C	.	.	S	Bend	trans	-111.6	179	176.2	-80.7	-59.4	0	0	0	112	L142 C145 R146 L147 A166 F167 F171 G192	L142-N169 PolarHBondContact O-ND2 3.38Å; C145-N169 PolarHBondContact N-OD1 3.37Å; R146-N169 PolarHBondContact N-OD1 2.93Å; L147-N169 HydrophobicContact CB-CB 4.49Å; L147-N169 PolarHBondContact N-OD1 2.99Å; A166-N169 VanDerWaalsContact C-ND2 3.34Å; A166-N169 PolarHBondContact O-ND2 2.84Å; F167-N169 PolarHBondContact O-N 3.32Å; F167-N169 PolarHBondContact O-ND2 3.28Å; N169-F171 HydrophobicContact CB-CD2 3.81Å; N169-F171 HydrophobicContact CB-CE1 4.33Å; N169-F171 HydrophobicContact CB-CE2 3.52Å; N169-F171 HydrophobicContact CB-CG 4.34Å; N169-F171 HydrophobicContact CB-CZ 3.8Å; N169-G192 WeakPolarHBondContact O-CA 3.47Å
170	L	96.5	Very high	96.3	Very high	55 Å²	55	47.6 Å²	47.6	29%	0.288	23%	0.228	S	C	.	.			trans	-103.8	21.6	-173.7	-56.1	179.7	0	0	0	113	R146 L147 F148 R172	R146-L170 HydrophobicContact CB-CD1 4.07Å; R146-L170 HydrophobicContact CB-CG 4.46Å; L147-L170 CarbonylContact O-C 3.58Å; L147-L170 WeakPolarHBondContact O-CA 3.32Å; L147-L170 WeakPolarHBondContact O-CB 3.49Å; L147-L170 PolarHBondContact O-N 2.98Å; F148-L170 HydrophobicContact CB-CB 4.39Å; L170-R172 PolarHBondContact O-N 3.18Å
171	F	95.8	Very high	96.2	Very high	8 Å²	8	47.1 Å²	47.1	4%	0.035	22%	0.222	C	C	.	.			trans	-63.1	126.5	179.7	-53.1	-46	0	0	0	110.9	L147 V150 A166 N169 P175 R193 I194	L147-F171 HydrophobicContact CB-CE1 3.64Å; L147-F171 HydrophobicContact CB-CZ 3.85Å; L147-F171 HydrophobicContact CD1-CZ 4.38Å; L147-F171 WeakPolarHBondContact O-CD1 3.47Å; L147-F171 WeakPolarHBondContact O-CE1 3.39Å; V150-F171 HydrophobicContact CG2-CE1 3.7Å; V150-F171 HydrophobicContact CG2-CZ 3.69Å; A166-F171 HydrophobicContact CB-CE2 3.91Å; A166-F171 HydrophobicContact CB-CZ 4.45Å; A166-F171 WeakPolarHBondContact O-CE2 3.4Å; N169-F171 HydrophobicContact CB-CD2 3.81Å; N169-F171 HydrophobicContact CB-CE1 4.33Å; N169-F171 HydrophobicContact CB-CE2 3.52Å; N169-F171 HydrophobicContact CB-CG 4.34Å; N169-F171 HydrophobicContact CB-CZ 3.8Å; F171-P175 HydrophobicContact CD1-CG 4.29Å; F171-P175 HydrophobicContact CD2-CG 3.98Å; F171-P175 HydrophobicContact CE1-CG 4.47Å; F171-P175 HydrophobicContact CE2-CG 4.16Å; F171-P175 HydrophobicContact CG-CG 4.06Å; F171-P175 HydrophobicContact CZ-CG 4.41Å; F171-R193 CarbonylContact O-C 3.24Å; F171-R193 WeakPolarHBondContact O-CA 3.33Å; F171-R193 PolarHBondContact O-N 2.88Å; F171-I194 HydrophobicContact CB-CG1 4.09Å; F171-I194 PolarHBondContact O-N 3.05Å; F171-I194 VanDerWaalsContact O-N 3.07Å
172	R	95	Very high	96.1	Very high	180 Å²	180	49.2 Å²	49.2	68%	0.679	24%	0.24	S	C	*	.	S	Bend	trans	-83	-20.1	173.1	-67	-169	-176.5	-173.4	0.6	113.4	L170 R193 E195	L170-R172 PolarHBondContact O-N 3.18Å; R172-R193 WeakPolarHBondContact CA-O 3.44Å; R172-E195 PolarHBondContact O-N 3.06Å
173	R	95.2	Very high	96	Very high	192 Å²	192	46.2 Å²	46.2	73%	0.725	23%	0.233	S	C	*	.	S	Bend	trans	-140.8	159.9	179.7	-62.8	-178.2	-172.3	136	0.4	108.5	P175	R173-P175 WeakPolarHBondContact O-CD 3.34Å
174	V	96.4	Very high	96	Very high	8 Å²	8	44.4 Å²	44.4	5%	0.048	23%	0.225	C	C	.	.			trans	-54	125.3	167.6	178.3	0	0	0	0	108.6	G176 L178 L189 I194 V197 L202 L213	V174-G176 PolarHBondContact O-N 2.94Å; V174-L178 HydrophobicContact CG1-CD1 3.86Å; V174-L189 HydrophobicContact CG1-CD1 4.13Å; V174-I194 HydrophobicContact CG2-CD1 4.47Å; V174-I194 HydrophobicContact CG2-CG2 4.01Å; V174-V197 HydrophobicContact CG2-CG1 4.42Å; V174-V197 HydrophobicContact CG2-CG2 4.35Å; V174-L202 HydrophobicContact CG1-CD2 3.87Å; V174-L202 HydrophobicContact CG1-CG 4.48Å; V174-L213 HydrophobicContact CG2-CD2 4.08Å
175	P	94.6	Very high	96	Very high	14 Å²	14	45.4 Å²	45.4	9%	0.091	23%	0.231	C	C	.	.			trans	-61.3	125.7	-175.8	-25	34.3	0	0	0	112.4	V150 F171 R173 A177 L178	V150-P175 HydrophobicContact CB-CB 4.27Å; V150-P175 HydrophobicContact CG2-CB 4.43Å; F171-P175 HydrophobicContact CD1-CG 4.29Å; F171-P175 HydrophobicContact CD2-CG 3.98Å; F171-P175 HydrophobicContact CE1-CG 4.47Å; F171-P175 HydrophobicContact CE2-CG 4.16Å; F171-P175 HydrophobicContact CG-CG 4.06Å; F171-P175 HydrophobicContact CZ-CG 4.41Å; R173-P175 WeakPolarHBondContact O-CD 3.34Å; P175-A177 PolarHBondContact O-N 2.98Å; P175-A177 VanDerWaalsContact O-N 3.08Å; P175-L178 WeakPolarHBondContact O-CB 3.42Å; P175-L178 WeakPolarHBondContact O-CG 3.09Å; P175-L178 PolarHBondContact O-N 2.87Å
176	G	92.7	Very high	96	Very high	30 Å²	30	47.7 Å²	47.7	31%	0.309	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-60.5	-18.6	176.4	0	0	0	0	0	113.9	V174 L178 R179	V174-G176 PolarHBondContact O-N 2.94Å; G176-L178 PolarHBondContact O-N 2.92Å; G176-L178 VanDerWaalsContact O-N 3.11Å; G176-R179 WeakPolarHBondContact O-CB 3.18Å; G176-R179 PolarHBondContact O-N 3.34Å
177	A	93.6	Very high	96	Very high	2 Å²	2	47.6 Å²	47.6	2%	0.017	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-60.7	-15	172.3	0	0	0	0	0	114.3	V150 P151 L155 P175 R179	V150-A177 HydrophobicContact CB-CB 4.13Å; V150-A177 HydrophobicContact CG1-CB 3.73Å; P151-A177 WeakPolarHBondContact O-CB 3.17Å; L155-A177 HydrophobicContact CB-CB 4.32Å; L155-A177 WeakPolarHBondContact CB-O 3.17Å; L155-A177 HydrophobicContact CD1-CB 3.86Å; L155-A177 HydrophobicContact CG-CB 4Å; P175-A177 PolarHBondContact O-N 2.98Å; P175-A177 VanDerWaalsContact O-N 3.08Å; A177-R179 VanDerWaalsContact C-N 3.3Å
178	L	95.4	Very high	96.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-74.9	-21.5	172.7	-64.6	179.6	0	0	0	113.1	L155 L164 V174 P175 G176 G180 L181 L184 L189 L202 L205	L155-L178 HydrophobicContact CD1-CD2 4.07Å; L164-L178 HydrophobicContact CD2-CD2 3.56Å; V174-L178 HydrophobicContact CG1-CD1 3.86Å; P175-L178 WeakPolarHBondContact O-CB 3.42Å; P175-L178 WeakPolarHBondContact O-CG 3.09Å; P175-L178 PolarHBondContact O-N 2.87Å; G176-L178 PolarHBondContact O-N 2.92Å; G176-L178 VanDerWaalsContact O-N 3.11Å; L178-G180 PolarHBondContact O-N 3.02Å; L178-L181 HydrophobicContact CD2-CD1 3.9Å; L178-L181 WeakPolarHBondContact O-CB 3.17Å; L178-L181 WeakPolarHBondContact O-CG 3.5Å; L178-L181 PolarHBondContact O-N 3.33Å; L178-L181 VanDerWaalsContact O-N 3.16Å; L178-L184 HydrophobicContact CD2-CD2 3.91Å; L178-L189 HydrophobicContact CD1-CD1 3.92Å; L178-L202 HydrophobicContact CD1-CD2 4.4Å; L178-L205 HydrophobicContact CB-CD1 4.41Å; L178-L205 WeakPolarHBondContact O-CD2 3.31Å
179	R	94.6	Very high	96.1	Very high	144 Å²	144	44.8 Å²	44.8	54%	0.543	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	128.8	-177.4	-174.3	176.5	-176.7	-166.9	-0.5	110.6	G176 A177 L181 Q203	G176-R179 WeakPolarHBondContact O-CB 3.18Å; G176-R179 PolarHBondContact O-N 3.34Å; A177-R179 VanDerWaalsContact C-N 3.3Å; R179-L181 VanDerWaalsContact C-N 3.31Å; R179-L181 PolarHBondContact O-N 2.86Å; R179-Q203 HydrophobicContact CG-CB 4.29Å; R179-Q203 VanDerWaalsContact CZ-OE1 3.24Å
180	G	93.4	Very high	96.1	Very high	49 Å²	49	45.3 Å²	45.3	51%	0.505	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	4	176.5	0	0	0	0	0	115.6	L178 A182 Q203	L178-G180 PolarHBondContact O-N 3.02Å; G180-A182 PolarHBondContact O-N 3.44Å; G180-Q203 PolarHBondContact N-O 3.23Å
181	L	94.8	Very high	96.1	Very high	13 Å²	13	47.3 Å²	47.3	7%	0.068	23%	0.23	C	C	.	.			trans	-74.1	71.2	175.7	-60.2	-178.6	0	0	0	111.8	L155 L161 L178 R179 N183 L184 L205	L155-L181 HydrophobicContact CB-CD1 3.95Å; L155-L181 HydrophobicContact CB-CD2 4.17Å; L155-L181 HydrophobicContact CD1-CD1 4.06Å; L155-L181 WeakPolarHBondContact O-CD2 3.37Å; L161-L181 HydrophobicContact CD2-CD1 4.39Å; L178-L181 HydrophobicContact CD2-CD1 3.9Å; L178-L181 WeakPolarHBondContact O-CB 3.17Å; L178-L181 WeakPolarHBondContact O-CG 3.5Å; L178-L181 PolarHBondContact O-N 3.33Å; L178-L181 VanDerWaalsContact O-N 3.16Å; R179-L181 VanDerWaalsContact C-N 3.31Å; R179-L181 PolarHBondContact O-N 2.86Å; L181-N183 PolarHBondContact O-N 3.09Å; L181-L184 HydrophobicContact CB-CB 3.97Å; L181-L184 HydrophobicContact CD1-CD2 4.3Å; L181-L184 VanDerWaalsContact O-CB 3.31Å; L181-L184 WeakPolarHBondContact O-CB 3.16Å; L181-L184 PolarHBondContact O-N 3.15Å; L181-L205 HydrophobicContact CB-CD2 3.75Å; L181-L205 WeakPolarHBondContact O-CD2 3.47Å
182	A	94.5	Very high	96.1	Very high	47 Å²	47	47.7 Å²	47.7	39%	0.388	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15	-171.5	0	0	0	0	0	115.3	G180 G204 R207	G180-A182 PolarHBondContact O-N 3.44Å; A182-G204 WeakPolarHBondContact CA-O 3.22Å; A182-R207 VanDerWaalsContact O-CB 3.29Å; A182-R207 WeakPolarHBondContact O-CB 3.12Å; A182-R207 WeakPolarHBondContact O-CD 3.49Å; A182-R207 WeakPolarHBondContact O-CG 3.01Å
183	N	96.9	Very high	96.2	Very high	59 Å²	59	44.7 Å²	44.7	32%	0.316	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-6.9	176.6	-82.2	-20	0	0	0	114.1	P159 L161 L181 T185 R207	P159-N183 PolarHBondContact O-ND2 2.93Å; L161-N183 CarbonylContact O-C 3.52Å; L181-N183 PolarHBondContact O-N 3.09Å; N183-T185 PolarHBondContact O-N 2.99Å; N183-R207 PolarHBondContact OD1-NH1 3.05Å
184	L	98.1	Very high	96.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.191	C	C	.	.			trans	-66.4	127.7	179.5	-164.6	73.8	0	0	0	109.3	L161 L164 L178 L181 A187 L205 R207 L208	L161-L184 HydrophobicContact CD2-CD1 4.12Å; L161-L184 HydrophobicContact CG-CD1 4.07Å; L161-L184 PolarHBondContact O-N 3.21Å; L164-L184 HydrophobicContact CB-CD1 4.13Å; L178-L184 HydrophobicContact CD2-CD2 3.91Å; L181-L184 HydrophobicContact CB-CB 3.97Å; L181-L184 HydrophobicContact CD1-CD2 4.3Å; L181-L184 VanDerWaalsContact O-CB 3.31Å; L181-L184 WeakPolarHBondContact O-CB 3.16Å; L181-L184 PolarHBondContact O-N 3.15Å; L184-A187 HydrophobicContact CD2-CB 4.11Å; L184-L205 HydrophobicContact CB-CD2 4.26Å; L184-L205 HydrophobicContact CD2-CD2 4.19Å; L184-R207 CarbonylContact O-C 3.31Å; L184-L208 HydrophobicContact CD2-CD1 4.21Å; L184-L208 HydrophobicContact CG-CD1 4.28Å; L184-L208 WeakPolarHBondContact O-CA 3.46Å; L184-L208 PolarHBondContact O-N 2.65Å; L184-L208 VanDerWaalsContact O-N 3.11Å
185	T	98.6	Very high	96.4	Very high	29 Å²	29	39 Å²	39	18%	0.178	21%	0.206	C	C	.	.			trans	-110.8	-30.8	178.8	59.8	0	0	0	0	112.2	R162 N183 R207 R209 S210	R162-T185 PolarHBondContact O-N 3.45Å; R162-T185 PolarHBondContact O-OG1 2.99Å; N183-T185 PolarHBondContact O-N 2.99Å; T185-R207 WeakPolarHBondContact CA-O 3.16Å; T185-R207 HydrophobicContact CG2-CB 4.46Å; T185-R209 PolarHBondContact O-N 3.06Å; T185-S210 PolarHBondContact O-N 3.38Å
186	H	98.8	Very high	96.6	Very high	60 Å²	60	39.5 Å²	39.5	28%	0.278	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	127.5	-177.6	-63	71.2	0	0	0	110.4	R162 E163 L164 S210	R162-H186 PolarHBondContact O-N 2.82Å; E163-H186 WeakPolarHBondContact CA-O 3.34Å; E163-H186 HydrophobicContact CB-CB 4.39Å; E163-H186 HydrophobicContact CG-CB 4Å; L164-H186 PolarHBondContact N-O 3.49Å; H186-S210 WeakPolarHBondContact CA-O 3.47Å
187	A	98.5	Very high	96.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	113.9	174.4	0	0	0	0	0	109.9	L184 L208 S210 L211 S212	L184-A187 HydrophobicContact CD2-CB 4.11Å; A187-L208 HydrophobicContact CB-CD1 4.05Å; A187-S210 PolarHBondContact N-O 3.33Å; A187-L211 HydrophobicContact CB-CD1 3.91Å; A187-S212 PolarHBondContact O-N 2.87Å
188	H	98.6	Very high	96.9	Very high	43 Å²	43	39.3 Å²	39.3	20%	0.199	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	104.9	178.4	-50.3	-80	0	0	0	109.4	L164 A166 F167 E190	L164-H188 PolarHBondContact O-N 2.81Å; A166-H188 CarbonylContact C-O 2.99Å; A166-H188 PolarHBondContact N-O 3.45Å; F167-H188 HydrophobicContact CD1-CB 4.14Å; F167-H188 PolarHBondContact N-O 3.49Å; F167-H188 VanDerWaalsContact N-O 3.16Å; H188-E190 WeakPolarHBondContact CA-OE2 3.23Å; H188-E190 WeakPolarHBondContact CB-OE2 3.23Å
189	L	98.3	Very high	96.7	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	23%	0.227	C	C	.	.			trans	-123.8	20.1	-175.6	-61.1	174.8	0	0	0	111.6	A166 V174 L178 I194 L211 S212 L213 N216	A166-L189 HydrophobicContact CB-CD2 4.04Å; V174-L189 HydrophobicContact CG1-CD1 4.13Å; L178-L189 HydrophobicContact CD1-CD1 3.92Å; L189-I194 HydrophobicContact CB-CD1 3.98Å; L189-I194 HydrophobicContact CD1-CD1 4.45Å; L189-L211 HydrophobicContact CD1-CD1 4.38Å; L189-S212 CarbonylContact C-O 3.41Å; L189-S212 WeakPolarHBondContact CA-O 3.33Å; L189-S212 WeakPolarHBondContact CB-O 3.34Å; L189-S212 PolarHBondContact N-O 2.89Å; L189-L213 HydrophobicContact CB-CD2 3.84Å; L189-L213 HydrophobicContact CD1-CD2 4.02Å; L189-N216 PolarHBondContact O-ND2 3.21Å
190	E	98.2	Very high	96.7	Very high	15 Å²	15	38.6 Å²	38.6	7%	0.07	22%	0.224	C	C	.	.			trans	-70.8	168	-177.9	65	-83.1	-177.6	0	0	115	F167 D168 H188 G192 S212 Q214	F167-E190 CarbonylContact C-O 3.48Å; F167-E190 WeakPolarHBondContact CA-O 3.44Å; F167-E190 HydrophobicContact CB-CG 3.73Å; F167-E190 WeakPolarHBondContact CB-O 3.2Å; F167-E190 WeakPolarHBondContact CB-OE1 3.49Å; F167-E190 WeakPolarHBondContact CD1-OE1 3.14Å; F167-E190 HydrophobicContact CG-CG 4.45Å; D168-E190 PolarHBondContact N-O 3.08Å; H188-E190 WeakPolarHBondContact CA-OE2 3.23Å; H188-E190 WeakPolarHBondContact CB-OE2 3.23Å; E190-G192 VanDerWaalsContact C-N 3.28Å; E190-G192 PolarHBondContact O-N 3.19Å; E190-S212 PolarHBondContact N-O 3.25Å; E190-S212 VanDerWaalsContact OE2-CB 3.29Å; E190-S212 WeakPolarHBondContact OE2-CB 3.4Å; E190-S212 PolarHBondContact OE2-OG 2.97Å; E190-Q214 CarbonylContact C-O 3.36Å; E190-Q214 WeakPolarHBondContact CA-O 3.29Å; E190-Q214 HydrophobicContact CB-CG 3.41Å; E190-Q214 VanDerWaalsContact CB-CG 3.41Å; E190-Q214 WeakPolarHBondContact CB-O 3.19Å; E190-Q214 HydrophobicContact CG-CG 4.17Å
191	R	96.9	Very high	96.7	Very high	98 Å²	98	36.6 Å²	36.6	37%	0.37	20%	0.202	S	C	.	.	S	Bend	trans	55.4	41.5	173.3	-60.5	-171.4	-60.2	-78.5	-1.2	113.1	D168 Q214 A215	D168-R191 WeakPolarHBondContact CA-O 3.49Å; D168-R191 WeakPolarHBondContact OD1-CB 3.48Å; D168-R191 IonicContact OD1-NE 3.92Å; D168-R191 PolarHBondContact OD1-NE 2.99Å; D168-R191 IonicContact OD2-CZ 2.69Å; D168-R191 IonicContact OD2-NE 2.85Å; D168-R191 PolarHBondContact OD2-NE 3.11Å; D168-R191 IonicContact OD2-NH2 3.79Å; D168-R191 PolarHBondContact OD2-NH2 3.26Å; R191-Q214 PolarHBondContact N-O 2.93Å; R191-A215 WeakPolarHBondContact CA-O 3.18Å; R191-A215 HydrophobicContact CG-CB 3.9Å; R191-A215 PolarHBondContact N-O 2.98Å
192	G	95.8	Very high	96.7	Very high	15 Å²	15	36 Å²	36	16%	0.155	20%	0.199	C	C	.	.	S	Bend	trans	-116.3	-146.9	-177.1	0	0	0	0	0	113.2	N169 E190 A215 N216	N169-G192 WeakPolarHBondContact O-CA 3.47Å; E190-G192 VanDerWaalsContact C-N 3.28Å; E190-G192 PolarHBondContact O-N 3.19Å; G192-A215 PolarHBondContact N-O 3.14Å; G192-N216 WeakPolarHBondContact CA-OD1 3.5Å; G192-N216 PolarHBondContact N-OD1 3.33Å; G192-N216 VanDerWaalsContact N-OD1 3.16Å
193	R	97.1	Very high	96.8	Very high	118 Å²	118	37.6 Å²	37.6	45%	0.445	20%	0.198	S	C	.	.			trans	-130.3	26	176.9	-60.1	-178.2	-178.4	173.5	-0.2	111.5	F171 R172 E195 N216	F171-R193 CarbonylContact O-C 3.24Å; F171-R193 WeakPolarHBondContact O-CA 3.33Å; F171-R193 PolarHBondContact O-N 2.88Å; R172-R193 WeakPolarHBondContact CA-O 3.44Å; R193-E195 PolarHBondContact O-N 3.1Å; R193-N216 PolarHBondContact N-OD1 3.17Å
194	I	98.2	Very high	96.7	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.19	C	C	.	.			trans	-68.4	123.4	-176.5	-63.1	174.1	0	0	0	108.4	F171 V174 L189 L213 N216 R217 V218	F171-I194 HydrophobicContact CB-CG1 4.09Å; F171-I194 PolarHBondContact O-N 3.05Å; F171-I194 VanDerWaalsContact O-N 3.07Å; V174-I194 HydrophobicContact CG2-CD1 4.47Å; V174-I194 HydrophobicContact CG2-CG2 4.01Å; L189-I194 HydrophobicContact CB-CD1 3.98Å; L189-I194 HydrophobicContact CD1-CD1 4.45Å; I194-L213 HydrophobicContact CD1-CD2 3.76Å; I194-N216 HydrophobicContact CB-CB 4.17Å; I194-N216 WeakPolarHBondContact CB-OD1 3.4Å; I194-N216 PolarHBondContact N-OD1 3.15Å; I194-R217 CarbonylContact O-C 3.48Å; I194-R217 WeakPolarHBondContact O-CA 3.15Å; I194-R217 PolarHBondContact O-N 2.95Å; I194-V218 HydrophobicContact CB-CG2 4.48Å; I194-V218 HydrophobicContact CG2-CG2 4.11Å; I194-V218 WeakPolarHBondContact O-CG2 3.23Å; I194-V218 PolarHBondContact O-N 3.29Å
195	E	97.8	Very high	96.6	Very high	79 Å²	79	35.4 Å²	35.4	37%	0.369	19%	0.19	S	C	.	.			trans	-99	-22.3	-174.1	-67.8	173.8	-174.9	0	0	113.2	R172 R193 R217 V218 R219	R172-E195 PolarHBondContact O-N 3.06Å; R193-E195 PolarHBondContact O-N 3.1Å; E195-R217 WeakPolarHBondContact CA-O 3.44Å; E195-R217 HydrophobicContact CG-CB 4.43Å; E195-V218 CarbonylContact O-C 3.14Å; E195-V218 WeakPolarHBondContact O-CA 3.46Å; E195-R219 PolarHBondContact O-N 3.31Å
196	A	97.1	Very high	96.5	Very high	25 Å²	25	42.4 Å²	42.4	21%	0.207	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	153	-179.3	0	0	0	0	0	112.4	A220	A196-A220 VanDerWaalsContact CA-O 3.28Å; A196-A220 WeakPolarHBondContact CA-O 3.27Å
197	V	97.3	Very high	96.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	104.2	169.4	-171.7	0	0	0	0	108.3	V174 L202 L213 V218 A220 V221 H222 A225 F226	V174-V197 HydrophobicContact CG2-CG1 4.42Å; V174-V197 HydrophobicContact CG2-CG2 4.35Å; V197-L202 HydrophobicContact CG1-CD1 3.9Å; V197-L213 HydrophobicContact CG2-CD1 3.71Å; V197-V218 HydrophobicContact CG2-CG1 4.09Å; V197-A220 PolarHBondContact N-O 3.02Å; V197-V221 HydrophobicContact CB-CG1 4.47Å; V197-V221 HydrophobicContact CB-CG2 4.35Å; V197-V221 HydrophobicContact CG2-CG2 4.31Å; V197-H222 PolarHBondContact O-N 3.07Å; V197-A225 HydrophobicContact CG1-CB 4.05Å; V197-F226 HydrophobicContact CG1-CE1 4.03Å; V197-F226 HydrophobicContact CG1-CZ 4.18Å
198	A	95.6	Very high	96.4	Very high	28 Å²	28	46.6 Å²	46.6	23%	0.231	23%	0.226	C	C	.	.			trans	-84.7	148.1	-178.6	0	0	0	0	0	111.4	S200 S201	A198-S200 VanDerWaalsContact C-N 3.25Å; A198-S200 PolarHBondContact O-N 3.45Å; A198-S201 WeakPolarHBondContact O-CB 3.37Å; A198-S201 PolarHBondContact O-N 2.84Å; A198-S201 PolarHBondContact O-OG 2.88Å
199	S	92.6	Very high	96.4	Very high	62 Å²	62	50 Å²	50	43%	0.434	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-27.4	-177.3	54.6	0	0	0	0	115.3
200	S	93.1	Very high	96.4	Very high	66 Å²	66	50.5 Å²	50.5	46%	0.462	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-18.2	176.1	55.7	0	0	0	0	114.2	A198 L202	A198-S200 VanDerWaalsContact C-N 3.25Å; A198-S200 PolarHBondContact O-N 3.45Å; S200-L202 PolarHBondContact O-N 2.82Å
201	S	94.1	Very high	96.5	Very high	7 Å²	7	49.8 Å²	49.8	5%	0.049	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-26.8	-168	65.3	0	0	0	0	114.3	A198	A198-S201 WeakPolarHBondContact O-CB 3.37Å; A198-S201 PolarHBondContact O-N 2.84Å; A198-S201 PolarHBondContact O-OG 2.88Å
202	L	95.3	Very high	96.6	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	10.8	-179.4	-59.5	174.2	0	0	0	112.6	V174 L178 V197 S200 G204 L205 L211 F226	V174-L202 HydrophobicContact CG1-CD2 3.87Å; V174-L202 HydrophobicContact CG1-CG 4.48Å; L178-L202 HydrophobicContact CD1-CD2 4.4Å; V197-L202 HydrophobicContact CG1-CD1 3.9Å; S200-L202 PolarHBondContact O-N 2.82Å; L202-G204 PolarHBondContact O-N 3Å; L202-L205 HydrophobicContact CB-CD1 3.95Å; L202-L205 HydrophobicContact CD2-CD1 3.57Å; L202-L205 HydrophobicContact CG-CD1 4.37Å; L202-L205 WeakPolarHBondContact O-CB 3.22Å; L202-L205 VanDerWaalsContact O-CG 3.32Å; L202-L205 WeakPolarHBondContact O-CG 3.49Å; L202-L205 PolarHBondContact O-N 3.06Å; L202-L211 HydrophobicContact CD1-CD2 3.65Å; L202-L211 HydrophobicContact CD2-CD2 4.37Å; L202-F226 HydrophobicContact CD1-CD1 3.57Å; L202-F226 HydrophobicContact CD1-CE1 3.59Å
203	Q	95.3	Very high	96.7	Very high	80 Å²	80	44.6 Å²	44.6	37%	0.374	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	136.3	-178.6	-169.5	-175.7	27.8	0	0	110.8	R179 G180 L205 D228	R179-Q203 HydrophobicContact CG-CB 4.29Å; R179-Q203 VanDerWaalsContact CZ-OE1 3.24Å; G180-Q203 PolarHBondContact N-O 3.23Å; Q203-L205 VanDerWaalsContact C-N 3.35Å; Q203-D228 VanDerWaalsContact CG-OD2 3.31Å; Q203-D228 WeakPolarHBondContact CG-OD2 3.46Å
204	G	95	Very high	96.7	Very high	13 Å²	13	40.3 Å²	40.3	13%	0.134	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	3.2	178.5	0	0	0	0	0	115.7	A182 L202 R206 D228	A182-G204 WeakPolarHBondContact CA-O 3.22Å; L202-G204 PolarHBondContact O-N 3Å; G204-R206 PolarHBondContact O-N 2.99Å; G204-D228 PolarHBondContact N-OD2 3.16Å
205	L	96.2	Very high	96.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.			trans	-79.2	55.3	179.4	-65.3	-175.1	0	0	0	113.3	L178 L181 L184 L202 Q203 R207 L208	L178-L205 HydrophobicContact CB-CD1 4.41Å; L178-L205 WeakPolarHBondContact O-CD2 3.31Å; L181-L205 HydrophobicContact CB-CD2 3.75Å; L181-L205 WeakPolarHBondContact O-CD2 3.47Å; L184-L205 HydrophobicContact CB-CD2 4.26Å; L184-L205 HydrophobicContact CD2-CD2 4.19Å; L202-L205 HydrophobicContact CB-CD1 3.95Å; L202-L205 HydrophobicContact CD2-CD1 3.57Å; L202-L205 HydrophobicContact CG-CD1 4.37Å; L202-L205 WeakPolarHBondContact O-CB 3.22Å; L202-L205 VanDerWaalsContact O-CG 3.32Å; L202-L205 WeakPolarHBondContact O-CG 3.49Å; L202-L205 PolarHBondContact O-N 3.06Å; Q203-L205 VanDerWaalsContact C-N 3.35Å; L205-R207 PolarHBondContact O-N 3Å; L205-L208 HydrophobicContact CB-CB 4.1Å; L205-L208 HydrophobicContact CB-CD2 4.38Å; L205-L208 HydrophobicContact CD1-CD2 3.96Å; L205-L208 WeakPolarHBondContact O-CB 3.5Å; L205-L208 PolarHBondContact O-N 3.44Å; L205-L208 VanDerWaalsContact O-N 3.17Å
206	R	96.2	Very high	96.8	Very high	176 Å²	176	38.8 Å²	38.8	66%	0.664	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-10.8	-169.5	-60.5	-178	-176.6	-171.9	0.7	115.9	G204 V231	G204-R206 PolarHBondContact O-N 2.99Å; R206-V231 VanDerWaalsContact O-CG2 3.27Å; R206-V231 WeakPolarHBondContact O-CG2 3.43Å
207	R	97.8	Very high	96.9	Very high	147 Å²	147	43.8 Å²	43.8	56%	0.555	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.3	6.4	-179.9	-70.3	-174.7	160.5	161.5	-3.2	113.3	A182 N183 L184 T185 L205 R209	A182-R207 VanDerWaalsContact O-CB 3.29Å; A182-R207 WeakPolarHBondContact O-CB 3.12Å; A182-R207 WeakPolarHBondContact O-CD 3.49Å; A182-R207 WeakPolarHBondContact O-CG 3.01Å; N183-R207 PolarHBondContact OD1-NH1 3.05Å; L184-R207 CarbonylContact O-C 3.31Å; T185-R207 WeakPolarHBondContact CA-O 3.16Å; T185-R207 HydrophobicContact CG2-CB 4.46Å; L205-R207 PolarHBondContact O-N 3Å; R207-R209 PolarHBondContact O-N 2.94Å
208	L	98.4	Very high	96.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.212	C	C	.	.			trans	-66.9	121.1	-178.3	-166.7	71	0	0	0	109.6	L184 A187 L205 L211 V231 L232	L184-L208 HydrophobicContact CD2-CD1 4.21Å; L184-L208 HydrophobicContact CG-CD1 4.28Å; L184-L208 WeakPolarHBondContact O-CA 3.46Å; L184-L208 PolarHBondContact O-N 2.65Å; L184-L208 VanDerWaalsContact O-N 3.11Å; A187-L208 HydrophobicContact CB-CD1 4.05Å; L205-L208 HydrophobicContact CB-CB 4.1Å; L205-L208 HydrophobicContact CB-CD2 4.38Å; L205-L208 HydrophobicContact CD1-CD2 3.96Å; L205-L208 WeakPolarHBondContact O-CB 3.5Å; L205-L208 PolarHBondContact O-N 3.44Å; L205-L208 VanDerWaalsContact O-N 3.17Å; L208-L211 HydrophobicContact CD2-CB 4.07Å; L208-L211 HydrophobicContact CD2-CD2 4.42Å; L208-V231 CarbonylContact O-C 3.52Å; L208-L232 HydrophobicContact CB-CD1 4.36Å; L208-L232 HydrophobicContact CD2-CD1 4.01Å; L208-L232 HydrophobicContact CG-CD1 3.85Å; L208-L232 VanDerWaalsContact O-CA 3.23Å; L208-L232 WeakPolarHBondContact O-CA 3.25Å; L208-L232 PolarHBondContact O-N 3.26Å
209	R	98.7	Very high	97	Very high	115 Å²	115	50 Å²	50	43%	0.434	23%	0.23	S	C	.	.			trans	-105	-33	178.5	-66	-173.2	-175.1	-97	-2.2	112	T185 R207 E233 H234	T185-R209 PolarHBondContact O-N 3.06Å; R207-R209 PolarHBondContact O-N 2.94Å; R209-E233 IonicContact CZ-OE1 2.84Å; R209-E233 IonicContact NH1-OE1 3.02Å; R209-E233 PolarHBondContact NH1-OE1 3.17Å; R209-E233 WeakPolarHBondContact O-CA 3.5Å; R209-E233 PolarHBondContact O-N 3.18Å; R209-H234 PolarHBondContact O-N 3.22Å
210	S	98.8	Very high	97.2	Very high	13 Å²	13	49 Å²	49	9%	0.091	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126.2	-179.2	-174.2	0	0	0	0	111.3	T185 H186 A187 H234	T185-S210 PolarHBondContact O-N 3.38Å; H186-S210 WeakPolarHBondContact CA-O 3.47Å; A187-S210 PolarHBondContact N-O 3.33Å; S210-H234 WeakPolarHBondContact CA-O 3.42Å
211	L	98.8	Very high	97.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	115.6	173.6	178.8	58.8	0	0	0	109.5	A187 L189 L202 L208 L213 F226 L232 H234 L235 L236	A187-L211 HydrophobicContact CB-CD1 3.91Å; L189-L211 HydrophobicContact CD1-CD1 4.38Å; L202-L211 HydrophobicContact CD1-CD2 3.65Å; L202-L211 HydrophobicContact CD2-CD2 4.37Å; L208-L211 HydrophobicContact CD2-CB 4.07Å; L208-L211 HydrophobicContact CD2-CD2 4.42Å; L211-L213 HydrophobicContact CD1-CD1 4.38Å; L211-L213 HydrophobicContact CD1-CG 4.21Å; L211-L213 HydrophobicContact CD2-CD1 3.95Å; L211-L213 HydrophobicContact CG-CD1 4.09Å; L211-L213 HydrophobicContact CG-CG 4.22Å; L211-F226 HydrophobicContact CD2-CD1 4.3Å; L211-F226 HydrophobicContact CD2-CE1 3.84Å; L211-L232 HydrophobicContact CB-CD1 4.06Å; L211-H234 PolarHBondContact N-O 3.43Å; L211-L235 HydrophobicContact CB-CD1 4.18Å; L211-L235 HydrophobicContact CD2-CD1 3.99Å; L211-L235 HydrophobicContact CG-CD1 4.19Å; L211-L236 PolarHBondContact O-N 3.16Å
212	S	98.8	Very high	97.5	Very high	4 Å²	4	50.2 Å²	50.2	3%	0.028	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	114.8	176.2	171.7	0	0	0	0	110.2	A187 L189 E190	A187-S212 PolarHBondContact O-N 2.87Å; L189-S212 CarbonylContact C-O 3.41Å; L189-S212 WeakPolarHBondContact CA-O 3.33Å; L189-S212 WeakPolarHBondContact CB-O 3.34Å; L189-S212 PolarHBondContact N-O 2.89Å; E190-S212 PolarHBondContact N-O 3.25Å; E190-S212 VanDerWaalsContact OE2-CB 3.29Å; E190-S212 WeakPolarHBondContact OE2-CB 3.4Å; E190-S212 PolarHBondContact OE2-OG 2.97Å
213	L	98.6	Very high	97.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.245	C	C	.	.			trans	-122.4	14.5	175.2	-74.6	165.8	0	0	0	111.4	V174 L189 I194 V197 L211 N216 L236 L237 N240	V174-L213 HydrophobicContact CG2-CD2 4.08Å; L189-L213 HydrophobicContact CB-CD2 3.84Å; L189-L213 HydrophobicContact CD1-CD2 4.02Å; I194-L213 HydrophobicContact CD1-CD2 3.76Å; V197-L213 HydrophobicContact CG2-CD1 3.71Å; L211-L213 HydrophobicContact CD1-CD1 4.38Å; L211-L213 HydrophobicContact CD1-CG 4.21Å; L211-L213 HydrophobicContact CD2-CD1 3.95Å; L211-L213 HydrophobicContact CG-CD1 4.09Å; L211-L213 HydrophobicContact CG-CG 4.22Å; L213-N216 WeakPolarHBondContact O-CB 3.25Å; L213-N216 PolarHBondContact O-ND2 3.34Å; L213-L236 CarbonylContact C-O 3.55Å; L213-L236 WeakPolarHBondContact CA-O 3.43Å; L213-L236 PolarHBondContact N-O 3Å; L213-L237 HydrophobicContact CB-CD2 3.89Å; L213-L237 HydrophobicContact CD1-CD2 3.95Å; L213-N240 PolarHBondContact O-ND2 3.14Å
214	Q	98.1	Very high	97.4	Very high	28 Å²	28	50.5 Å²	50.5	13%	0.131	24%	0.243	C	C	.	.			trans	-61	155.6	-177.7	65.1	177.7	-21.8	0	0	112.9	E190 R191 N216 L236 N238	E190-Q214 CarbonylContact C-O 3.36Å; E190-Q214 WeakPolarHBondContact CA-O 3.29Å; E190-Q214 HydrophobicContact CB-CG 3.41Å; E190-Q214 VanDerWaalsContact CB-CG 3.41Å; E190-Q214 WeakPolarHBondContact CB-O 3.19Å; E190-Q214 HydrophobicContact CG-CG 4.17Å; R191-Q214 PolarHBondContact N-O 2.93Å; Q214-N216 VanDerWaalsContact C-N 3.26Å; Q214-N216 PolarHBondContact O-N 2.68Å; Q214-N216 PolarHBondContact O-ND2 2.98Å; Q214-L236 PolarHBondContact N-O 3.36Å; Q214-N238 CarbonylContact C-O 3.19Å; Q214-N238 WeakPolarHBondContact CA-O 3.22Å; Q214-N238 WeakPolarHBondContact CB-O 3.35Å; Q214-N238 WeakPolarHBondContact CB-OD1 3.31Å; Q214-N238 PolarHBondContact OE1-ND2 2.99Å; Q214-N238 VanDerWaalsContact OE1-ND2 3.14Å
215	A	98.4	Very high	97.5	Very high	38 Å²	38	50 Å²	50	31%	0.314	24%	0.237	S	C	.	.	S	Bend	trans	54.2	41.6	177.2	0	0	0	0	0	112.9	R191 G192 N238 D239	R191-A215 WeakPolarHBondContact CA-O 3.18Å; R191-A215 HydrophobicContact CG-CB 3.9Å; R191-A215 PolarHBondContact N-O 2.98Å; G192-A215 PolarHBondContact N-O 3.14Å; A215-N238 PolarHBondContact N-O 3Å; A215-D239 WeakPolarHBondContact CA-O 3.49Å; A215-D239 HydrophobicContact CB-CB 4.49Å; A215-D239 PolarHBondContact N-O 3.19Å
216	N	98.7	Very high	97.5	Very high	11 Å²	11	50.1 Å²	50.1	6%	0.059	24%	0.237	C	C	.	.	S	Bend	trans	-108	-154.7	172.3	-86.7	-74.1	0	0	0	109.3	L189 G192 R193 I194 L213 Q214 V218 D239 N240	L189-N216 PolarHBondContact O-ND2 3.21Å; G192-N216 WeakPolarHBondContact CA-OD1 3.5Å; G192-N216 PolarHBondContact N-OD1 3.33Å; G192-N216 VanDerWaalsContact N-OD1 3.16Å; R193-N216 PolarHBondContact N-OD1 3.17Å; I194-N216 HydrophobicContact CB-CB 4.17Å; I194-N216 WeakPolarHBondContact CB-OD1 3.4Å; I194-N216 PolarHBondContact N-OD1 3.15Å; L213-N216 WeakPolarHBondContact O-CB 3.25Å; L213-N216 PolarHBondContact O-ND2 3.34Å; Q214-N216 VanDerWaalsContact C-N 3.26Å; Q214-N216 PolarHBondContact O-N 2.68Å; Q214-N216 PolarHBondContact O-ND2 2.98Å; N216-V218 HydrophobicContact CB-CG2 4.03Å; N216-D239 PolarHBondContact N-O 3.04Å; N216-N240 VanDerWaalsContact CA-OD1 3.23Å; N216-N240 WeakPolarHBondContact CA-OD1 3.36Å; N216-N240 WeakPolarHBondContact CB-OD1 3.32Å; N216-N240 PolarHBondContact N-OD1 2.84Å; N216-N240 PolarHBondContact O-OD1 2.85Å
217	R	98.3	Very high	97.4	Very high	129 Å²	129	44.1 Å²	44.1	49%	0.487	23%	0.231	S	C	.	.			trans	-125.5	31.5	177.2	-61.6	-178.6	179.3	-173.1	-5.4	110.4	I194 E195 R219 N240 L241	I194-R217 CarbonylContact O-C 3.48Å; I194-R217 WeakPolarHBondContact O-CA 3.15Å; I194-R217 PolarHBondContact O-N 2.95Å; E195-R217 WeakPolarHBondContact CA-O 3.44Å; E195-R217 HydrophobicContact CG-CB 4.43Å; R217-R219 PolarHBondContact O-N 2.84Å; R217-R219 VanDerWaalsContact O-N 3.13Å; R217-N240 PolarHBondContact N-OD1 2.96Å; R217-L241 HydrophobicContact CB-CD1 4.08Å
218	V	98.6	Very high	97.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.222	C	C	.	.			trans	-65.9	116	-171.7	-176.2	0	0	0	0	108.6	I194 E195 V197 N216 V221 N240 L241 L242	I194-V218 HydrophobicContact CB-CG2 4.48Å; I194-V218 HydrophobicContact CG2-CG2 4.11Å; I194-V218 WeakPolarHBondContact O-CG2 3.23Å; I194-V218 PolarHBondContact O-N 3.29Å; E195-V218 CarbonylContact O-C 3.14Å; E195-V218 WeakPolarHBondContact O-CA 3.46Å; V197-V218 HydrophobicContact CG2-CG1 4.09Å; N216-V218 HydrophobicContact CB-CG2 4.03Å; V218-V221 HydrophobicContact CG1-CG2 4.39Å; V218-N240 HydrophobicContact CB-CB 4.16Å; V218-N240 WeakPolarHBondContact CB-OD1 3.38Å; V218-N240 WeakPolarHBondContact CG2-OD1 3.45Å; V218-N240 PolarHBondContact N-OD1 2.99Å; V218-L241 CarbonylContact O-C 3.55Å; V218-L241 WeakPolarHBondContact O-CA 3.16Å; V218-L241 PolarHBondContact O-N 3.11Å; V218-L242 HydrophobicContact CG1-CD2 3.83Å; V218-L242 PolarHBondContact O-N 3.1Å; V218-L242 VanDerWaalsContact O-N 3.16Å
219	R	97.9	Very high	97.2	Very high	159 Å²	159	40.4 Å²	40.4	60%	0.6	22%	0.222	S	C	*	.			trans	-99.4	-28.4	176.8	-69.6	175.7	178.2	157.4	-3.3	112.6	E195 R217 L241	E195-R219 PolarHBondContact O-N 3.31Å; R217-R219 PolarHBondContact O-N 2.84Å; R217-R219 VanDerWaalsContact O-N 3.13Å; R219-L241 HydrophobicContact CG-CB 3.8Å; R219-L241 HydrophobicContact CG-CD1 4.22Å
220	A	96.8	Very high	97.1	Very high	40 Å²	40	36.4 Å²	36.4	33%	0.331	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	136.6	-176.2	0	0	0	0	0	112	A196 V197	A196-A220 VanDerWaalsContact CA-O 3.28Å; A196-A220 WeakPolarHBondContact CA-O 3.27Å; V197-A220 PolarHBondContact N-O 3.02Å
221	V	97.7	Very high	97.1	Very high	7 Å²	7	38.3 Å²	38.3	4%	0.042	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122	163.9	177.3	0	0	0	0	106.8	V197 V218 A225 F226 L242 L245 P246	V197-V221 HydrophobicContact CB-CG1 4.47Å; V197-V221 HydrophobicContact CB-CG2 4.35Å; V197-V221 HydrophobicContact CG2-CG2 4.31Å; V218-V221 HydrophobicContact CG1-CG2 4.39Å; V221-A225 HydrophobicContact CG1-CB 4.03Å; V221-F226 HydrophobicContact CG1-CE2 3.71Å; V221-F226 HydrophobicContact CG1-CZ 4.09Å; V221-L242 HydrophobicContact CG2-CD2 3.96Å; V221-L245 HydrophobicContact CB-CD2 4.09Å; V221-L245 HydrophobicContact CG2-CD2 4.05Å; V221-P246 VanDerWaalsContact O-CD 3.26Å; V221-P246 WeakPolarHBondContact O-CD 3.24Å; V221-P246 WeakPolarHBondContact O-CG 3.38Å
222	H	96.1	Very high	97.1	Very high	93 Å²	93	38.3 Å²	38.3	43%	0.431	23%	0.227	S	C	.	.			trans	-72.4	152.4	179.2	-73.1	-160.7	0	0	0	111.3	V197 G224 A225	V197-H222 PolarHBondContact O-N 3.07Å; H222-G224 PolarHBondContact O-N 3.27Å; H222-A225 WeakPolarHBondContact O-CB 3.49Å; H222-A225 PolarHBondContact O-N 3.15Å; H222-A225 VanDerWaalsContact O-N 3.12Å
223	A	94.9	Very high	97.1	Very high	56 Å²	56	40 Å²	40	46%	0.463	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	135.1	173.3	0	0	0	0	0	111.3	A225 P246 D248	A223-A225 PolarHBondContact O-N 3.14Å; A223-P246 HydrophobicContact CB-CB 4.42Å; A223-D248 WeakPolarHBondContact CA-OD1 3.38Å; A223-D248 WeakPolarHBondContact CB-OD1 3.31Å
224	G	93.4	Very high	97.1	Very high	32 Å²	32	41.8 Å²	41.8	33%	0.33	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	16.8	-178.8	0	0	0	0	0	115.9	H222 F226 G227 D248	H222-G224 PolarHBondContact O-N 3.27Å; G224-F226 PolarHBondContact O-N 2.81Å; G224-G227 PolarHBondContact O-N 3.21Å; G224-D248 PolarHBondContact N-OD2 3.2Å
225	A	96.3	Very high	97.1	Very high	2 Å²	2	40.4 Å²	40.4	2%	0.017	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-21	-173.9	0	0	0	0	0	115.8	V197 V221 H222 A223	V197-A225 HydrophobicContact CG1-CB 4.05Å; V221-A225 HydrophobicContact CG1-CB 4.03Å; H222-A225 WeakPolarHBondContact O-CB 3.49Å; H222-A225 PolarHBondContact O-N 3.15Å; H222-A225 VanDerWaalsContact O-N 3.12Å; A223-A225 PolarHBondContact O-N 3.14Å
226	F	96.7	Very high	97.1	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.009	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	15.3	176.3	-48.3	-68	0	0	0	113.3	V197 L202 L211 V221 G224 D228 C229 L235 L237 A249 F250 L253	V197-F226 HydrophobicContact CG1-CE1 4.03Å; V197-F226 HydrophobicContact CG1-CZ 4.18Å; L202-F226 HydrophobicContact CD1-CD1 3.57Å; L202-F226 HydrophobicContact CD1-CE1 3.59Å; L211-F226 HydrophobicContact CD2-CD1 4.3Å; L211-F226 HydrophobicContact CD2-CE1 3.84Å; V221-F226 HydrophobicContact CG1-CE2 3.71Å; V221-F226 HydrophobicContact CG1-CZ 4.09Å; G224-F226 PolarHBondContact O-N 2.81Å; F226-D228 VanDerWaalsContact C-N 3.29Å; F226-D228 PolarHBondContact O-N 3.46Å; F226-D228 VanDerWaalsContact O-N 3.14Å; F226-C229 HydrophobicContact CB-CB 4.37Å; F226-C229 WeakPolarHBondContact O-CB 3.43Å; F226-C229 PolarHBondContact O-N 2.85Å; F226-L235 HydrophobicContact CD2-CD2 4.26Å; F226-L235 HydrophobicContact CE1-CD1 4.13Å; F226-L235 HydrophobicContact CE1-CD2 4.42Å; F226-L235 HydrophobicContact CE2-CD2 3.92Å; F226-L235 HydrophobicContact CZ-CD1 4.18Å; F226-L235 HydrophobicContact CZ-CD2 4.01Å; F226-L237 HydrophobicContact CZ-CD1 4.41Å; F226-A249 VanDerWaalsContact CD2-O 3.23Å; F226-A249 WeakPolarHBondContact CD2-O 3.34Å; F226-F250 HydrophobicContact CD2-CD1 4.11Å; F226-F250 HydrophobicContact CD2-CE1 4.48Å; F226-F250 HydrophobicContact CE2-CD1 4.09Å; F226-F250 HydrophobicContact CE2-CE1 4.01Å; F226-L253 HydrophobicContact CB-CD1 4.02Å; F226-L253 HydrophobicContact CB-CD2 3.89Å; F226-L253 HydrophobicContact CB-CG 4.29Å; F226-L253 HydrophobicContact CD2-CD1 4.31Å; F226-L253 HydrophobicContact CG-CD1 4.35Å
227	G	94.5	Very high	97.1	Very high	51 Å²	51	39 Å²	39	53%	0.526	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-33	-169.9	0	0	0	0	0	115.6	G224	G224-G227 PolarHBondContact O-N 3.21Å
228	D	95.4	Very high	97.2	Very high	68 Å²	68	33.2 Å²	33.2	36%	0.364	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.3	177	-77.3	-20.7	0	0	0	113.7	Q203 G204 F226 G230	Q203-D228 VanDerWaalsContact CG-OD2 3.31Å; Q203-D228 WeakPolarHBondContact CG-OD2 3.46Å; G204-D228 PolarHBondContact N-OD2 3.16Å; F226-D228 VanDerWaalsContact C-N 3.29Å; F226-D228 PolarHBondContact O-N 3.46Å; F226-D228 VanDerWaalsContact O-N 3.14Å; D228-G230 VanDerWaalsContact C-N 3.35Å; D228-G230 PolarHBondContact O-N 2.77Å
229	C	96.6	Very high	97.2	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.007	22%	0.218	C	C	.	.			trans	-95	38.2	-174	-59.1	0	0	0	0	112.4	F226 V231 L232 L253	F226-C229 HydrophobicContact CB-CB 4.37Å; F226-C229 WeakPolarHBondContact O-CB 3.43Å; F226-C229 PolarHBondContact O-N 2.85Å; C229-V231 PolarHBondContact O-N 3.14Å; C229-L232 HydrophobicContact CB-CB 4.25Å; C229-L232 WeakPolarHBondContact O-CB 3.17Å; C229-L232 PolarHBondContact O-N 2.9Å; C229-L253 HydrophobicContact CB-CD2 4.17Å; C229-L253 VanDerWaalsContact O-CD2 3.24Å; C229-L253 WeakPolarHBondContact O-CD2 3.29Å
230	G	96.1	Very high	97.2	Very high	30 Å²	30	29 Å²	29	31%	0.309	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-10.1	-171.8	0	0	0	0	0	116.7	D228	D228-G230 VanDerWaalsContact C-N 3.35Å; D228-G230 PolarHBondContact O-N 2.77Å
231	V	98.1	Very high	97.3	Very high	54 Å²	54	31 Å²	31	33%	0.327	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	11.9	175	-58.4	0	0	0	0	113.2	R206 L208 C229 E233	R206-V231 VanDerWaalsContact O-CG2 3.27Å; R206-V231 WeakPolarHBondContact O-CG2 3.43Å; L208-V231 CarbonylContact O-C 3.52Å; C229-V231 PolarHBondContact O-N 3.14Å; V231-E233 PolarHBondContact O-N 3.21Å
232	L	98.6	Very high	97.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.194	C	C	.	.			trans	-65.8	128.2	178	-166.2	72.2	0	0	0	110	L208 L211 C229 L235 L253 R255 L256	L208-L232 HydrophobicContact CB-CD1 4.36Å; L208-L232 HydrophobicContact CD2-CD1 4.01Å; L208-L232 HydrophobicContact CG-CD1 3.85Å; L208-L232 VanDerWaalsContact O-CA 3.23Å; L208-L232 WeakPolarHBondContact O-CA 3.25Å; L208-L232 PolarHBondContact O-N 3.26Å; L211-L232 HydrophobicContact CB-CD1 4.06Å; C229-L232 HydrophobicContact CB-CB 4.25Å; C229-L232 WeakPolarHBondContact O-CB 3.17Å; C229-L232 PolarHBondContact O-N 2.9Å; L232-L235 HydrophobicContact CD2-CB 3.95Å; L232-L235 HydrophobicContact CD2-CD1 4.28Å; L232-L235 HydrophobicContact CD2-CD2 4.41Å; L232-L235 HydrophobicContact CD2-CG 4.45Å; L232-L253 HydrophobicContact CB-CD2 4.25Å; L232-L253 HydrophobicContact CD2-CD1 4.34Å; L232-L253 HydrophobicContact CD2-CD2 4.48Å; L232-R255 CarbonylContact O-C 3.13Å; L232-L256 HydrophobicContact CB-CD1 4.35Å; L232-L256 HydrophobicContact CD2-CD1 4.1Å; L232-L256 HydrophobicContact CG-CD1 4.04Å; L232-L256 WeakPolarHBondContact O-CA 3.3Å; L232-L256 PolarHBondContact O-N 2.94Å; L232-L256 VanDerWaalsContact O-N 3.11Å
233	E	98.8	Very high	97.4	Very high	39 Å²	39	28.8 Å²	28.8	18%	0.182	20%	0.195	C	C	.	.			trans	-104.4	-35.2	-179	-68.4	168.9	-169.3	0	0	111.2	R209 V231 R255 R257 T258	R209-E233 IonicContact CZ-OE1 2.84Å; R209-E233 IonicContact NH1-OE1 3.02Å; R209-E233 PolarHBondContact NH1-OE1 3.17Å; R209-E233 WeakPolarHBondContact O-CA 3.5Å; R209-E233 PolarHBondContact O-N 3.18Å; V231-E233 PolarHBondContact O-N 3.21Å; E233-R255 WeakPolarHBondContact CA-O 3.5Å; E233-R257 PolarHBondContact O-N 3.01Å; E233-T258 PolarHBondContact O-N 2.98Å
234	H	98.9	Very high	97.5	Very high	37 Å²	37	32.7 Å²	32.7	17%	0.171	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120	-177	-51.7	-66.5	0	0	0	111.2	R209 S210 L211 T258	R209-H234 PolarHBondContact O-N 3.22Å; S210-H234 WeakPolarHBondContact CA-O 3.42Å; L211-H234 PolarHBondContact N-O 3.43Å; H234-T258 PolarHBondContact ND1-OG1 2.94Å; H234-T258 VanDerWaalsContact ND1-OG1 3.14Å
235	L	98.9	Very high	97.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	110.1	173.6	-179.5	55.9	0	0	0	109.7	L211 F226 L232 L237 F250 L253 L256 T258 L259 N260	L211-L235 HydrophobicContact CB-CD1 4.18Å; L211-L235 HydrophobicContact CD2-CD1 3.99Å; L211-L235 HydrophobicContact CG-CD1 4.19Å; F226-L235 HydrophobicContact CD2-CD2 4.26Å; F226-L235 HydrophobicContact CE1-CD1 4.13Å; F226-L235 HydrophobicContact CE1-CD2 4.42Å; F226-L235 HydrophobicContact CE2-CD2 3.92Å; F226-L235 HydrophobicContact CZ-CD1 4.18Å; F226-L235 HydrophobicContact CZ-CD2 4.01Å; L232-L235 HydrophobicContact CD2-CB 3.95Å; L232-L235 HydrophobicContact CD2-CD1 4.28Å; L232-L235 HydrophobicContact CD2-CD2 4.41Å; L232-L235 HydrophobicContact CD2-CG 4.45Å; L235-L237 HydrophobicContact CD1-CD1 4.19Å; L235-L237 HydrophobicContact CD1-CG 4.16Å; L235-L237 HydrophobicContact CD2-CD1 4.01Å; L235-L237 HydrophobicContact CG-CD1 3.98Å; L235-L237 HydrophobicContact CG-CG 4.25Å; L235-F250 HydrophobicContact CD2-CD1 3.87Å; L235-F250 HydrophobicContact CD2-CE1 3.71Å; L235-L253 HydrophobicContact CD2-CD1 4.26Å; L235-L256 HydrophobicContact CB-CD1 3.85Å; L235-T258 PolarHBondContact N-O 3.28Å; L235-L259 HydrophobicContact CB-CD1 4.19Å; L235-L259 HydrophobicContact CD2-CD1 4Å; L235-L259 HydrophobicContact CG-CD1 4.12Å; L235-N260 PolarHBondContact O-N 3.2Å
236	L	98.9	Very high	97.7	Very high	18 Å²	18	33.5 Å²	33.5	9%	0.094	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	107	-178.8	-49.2	179.2	0	0	0	109.9	L211 L213 Q214 T258 N260	L211-L236 PolarHBondContact O-N 3.16Å; L213-L236 CarbonylContact C-O 3.55Å; L213-L236 WeakPolarHBondContact CA-O 3.43Å; L213-L236 PolarHBondContact N-O 3Å; Q214-L236 PolarHBondContact N-O 3.36Å; L236-T258 HydrophobicContact CD2-CG2 4.33Å; L236-N260 HydrophobicContact CD2-CB 3.86Å
237	L	98.8	Very high	97.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.227	C	C	.	.			trans	-119.1	14.2	179.1	-76.7	165.6	0	0	0	111.8	L213 F226 L235 N240 L242 F250 N260 L261 N264	L213-L237 HydrophobicContact CB-CD2 3.89Å; L213-L237 HydrophobicContact CD1-CD2 3.95Å; F226-L237 HydrophobicContact CZ-CD1 4.41Å; L235-L237 HydrophobicContact CD1-CD1 4.19Å; L235-L237 HydrophobicContact CD1-CG 4.16Å; L235-L237 HydrophobicContact CD2-CD1 4.01Å; L235-L237 HydrophobicContact CG-CD1 3.98Å; L235-L237 HydrophobicContact CG-CG 4.25Å; L237-N240 WeakPolarHBondContact O-CB 3.17Å; L237-N240 PolarHBondContact O-ND2 3.02Å; L237-L242 HydrophobicContact CB-CD1 4.3Å; L237-F250 HydrophobicContact CD1-CE1 4.26Å; L237-N260 CarbonylContact C-O 3.4Å; L237-N260 WeakPolarHBondContact CA-O 3.47Å; L237-N260 WeakPolarHBondContact CB-O 3.34Å; L237-N260 PolarHBondContact N-O 2.97Å; L237-L261 HydrophobicContact CB-CD2 3.93Å; L237-L261 HydrophobicContact CD1-CD2 4.01Å; L237-N264 PolarHBondContact O-ND2 3.16Å
238	N	98.8	Very high	97.6	Very high	9 Å²	9	36.7 Å²	36.7	5%	0.048	22%	0.216	C	C	.	.			trans	-66.8	157.4	-179	54.8	-73.9	0	0	0	113.9	Q214 A215 N240 N260 G262	Q214-N238 CarbonylContact C-O 3.19Å; Q214-N238 WeakPolarHBondContact CA-O 3.22Å; Q214-N238 WeakPolarHBondContact CB-O 3.35Å; Q214-N238 WeakPolarHBondContact CB-OD1 3.31Å; Q214-N238 PolarHBondContact OE1-ND2 2.99Å; Q214-N238 VanDerWaalsContact OE1-ND2 3.14Å; A215-N238 PolarHBondContact N-O 3Å; N238-N240 PolarHBondContact O-ND2 3.21Å; N238-N260 HydrophobicContact CB-CB 4.47Å; N238-N260 WeakPolarHBondContact CB-OD1 3.02Å; N238-N260 PolarHBondContact N-O 3.12Å; N238-N260 VanDerWaalsContact N-O 3.16Å; N238-N260 PolarHBondContact OD1-ND2 2.88Å; N238-G262 CarbonylContact C-O 3.19Å; N238-G262 WeakPolarHBondContact CA-O 3.45Å; N238-G262 WeakPolarHBondContact CB-O 3.3Å
239	D	98.7	Very high	97.6	Very high	62 Å²	62	33.5 Å²	33.5	33%	0.332	20%	0.199	S	C	.	.	S	Bend	trans	55.9	53.6	178.2	-49.3	-58.7	0	0	0	110.7	A215 N216 G262 G263 R287	A215-D239 WeakPolarHBondContact CA-O 3.49Å; A215-D239 HydrophobicContact CB-CB 4.49Å; A215-D239 PolarHBondContact N-O 3.19Å; N216-D239 PolarHBondContact N-O 3.04Å; D239-G262 PolarHBondContact N-O 3.23Å; D239-G263 VanDerWaalsContact CA-O 3.23Å; D239-G263 WeakPolarHBondContact CA-O 3.46Å; D239-G263 PolarHBondContact N-O 3.01Å; D239-R287 IonicContact OD1-NH2 3.94Å
240	N	98.8	Very high	97.6	Very high	8 Å²	8	33.6 Å²	33.6	4%	0.043	20%	0.2	C	C	.	.	S	Bend	trans	-126	-164	177.9	-86.5	-65.7	0	0	0	109.6	L213 N216 R217 V218 L237 N238 G263 N264	L213-N240 PolarHBondContact O-ND2 3.14Å; N216-N240 VanDerWaalsContact CA-OD1 3.23Å; N216-N240 WeakPolarHBondContact CA-OD1 3.36Å; N216-N240 WeakPolarHBondContact CB-OD1 3.32Å; N216-N240 PolarHBondContact N-OD1 2.84Å; N216-N240 PolarHBondContact O-OD1 2.85Å; R217-N240 PolarHBondContact N-OD1 2.96Å; V218-N240 HydrophobicContact CB-CB 4.16Å; V218-N240 WeakPolarHBondContact CB-OD1 3.38Å; V218-N240 WeakPolarHBondContact CG2-OD1 3.45Å; V218-N240 PolarHBondContact N-OD1 2.99Å; L237-N240 WeakPolarHBondContact O-CB 3.17Å; L237-N240 PolarHBondContact O-ND2 3.02Å; N238-N240 PolarHBondContact O-ND2 3.21Å; N240-G263 PolarHBondContact N-O 3.42Å; N240-N264 WeakPolarHBondContact CA-OD1 3.49Å; N240-N264 WeakPolarHBondContact CB-OD1 3.43Å; N240-N264 PolarHBondContact O-OD1 2.87Å
241	L	98.6	Very high	97.6	Very high	82 Å²	82	40.6 Å²	40.6	43%	0.429	22%	0.217	S	C	.	.			trans	-122.2	29.6	-175.4	-58.9	175.5	0	0	0	111.6	R217 V218 R219 A243 N264	R217-L241 HydrophobicContact CB-CD1 4.08Å; V218-L241 CarbonylContact O-C 3.55Å; V218-L241 WeakPolarHBondContact O-CA 3.16Å; V218-L241 PolarHBondContact O-N 3.11Å; R219-L241 HydrophobicContact CG-CB 3.8Å; R219-L241 HydrophobicContact CG-CD1 4.22Å; L241-A243 PolarHBondContact O-N 2.93Å; L241-N264 PolarHBondContact N-OD1 2.63Å
242	L	98.6	Very high	97.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.214	C	C	.	.			trans	-71.1	117.3	-178.6	-64.4	168.5	0	0	0	109.6	V218 V221 L237 L245 L261 N264 A265 L266	V218-L242 HydrophobicContact CG1-CD2 3.83Å; V218-L242 PolarHBondContact O-N 3.1Å; V218-L242 VanDerWaalsContact O-N 3.16Å; V221-L242 HydrophobicContact CG2-CD2 3.96Å; L237-L242 HydrophobicContact CB-CD1 4.3Å; L242-L245 HydrophobicContact CD1-CD2 4.36Å; L242-L245 HydrophobicContact CD2-CD2 4.36Å; L242-L261 HydrophobicContact CD1-CD2 4.11Å; L242-N264 HydrophobicContact CB-CB 4.11Å; L242-N264 VanDerWaalsContact CB-OD1 3.31Å; L242-N264 WeakPolarHBondContact CB-OD1 3.46Å; L242-N264 WeakPolarHBondContact CG-OD1 3.49Å; L242-N264 PolarHBondContact N-OD1 2.92Å; L242-A265 CarbonylContact O-C 3.57Å; L242-A265 VanDerWaalsContact O-C 3.22Å; L242-A265 VanDerWaalsContact O-CA 3.29Å; L242-A265 WeakPolarHBondContact O-CA 3.46Å; L242-A265 PolarHBondContact O-N 3.16Å; L242-L266 HydrophobicContact CB-CD2 4.38Å; L242-L266 PolarHBondContact O-N 3.12Å
243	A	97.8	Very high	97.3	Very high	53 Å²	53	39.3 Å²	39.3	44%	0.438	21%	0.214	S	C	.	.			trans	-98.9	-28.4	172.6	0	0	0	0	0	112.2	L241 A265	L241-A243 PolarHBondContact O-N 2.93Å; A243-A265 HydrophobicContact CB-CB 4.39Å
244	E	96.5	Very high	97.1	Very high	138 Å²	138	45.2 Å²	45.2	65%	0.645	23%	0.234	S	C	*	.			trans	-143.6	159.3	-179.3	61.9	-179.2	-172	0	0	110.8
245	L	97.7	Very high	97	Very high	14 Å²	14	49.6 Å²	49.6	7%	0.073	25%	0.25	C	C	.	.			trans	-136	137.1	174.5	-71.2	168.7	0	0	0	109.1	V221 L242 A249 F250 L261 L266 W273	V221-L245 HydrophobicContact CB-CD2 4.09Å; V221-L245 HydrophobicContact CG2-CD2 4.05Å; L242-L245 HydrophobicContact CD1-CD2 4.36Å; L242-L245 HydrophobicContact CD2-CD2 4.36Å; L245-A249 HydrophobicContact CB-CB 4.29Å; L245-A249 HydrophobicContact CD2-CB 4.44Å; L245-F250 HydrophobicContact CD1-CE2 3.88Å; L245-F250 HydrophobicContact CD1-CZ 3.86Å; L245-F250 HydrophobicContact CD2-CZ 4.44Å; L245-L261 HydrophobicContact CD1-CD1 4.1Å; L245-L261 HydrophobicContact CD1-CD2 4.28Å; L245-L266 HydrophobicContact CD1-CD1 4.48Å; L245-L266 HydrophobicContact CD1-CD2 4.32Å; L245-L266 HydrophobicContact CG-CD2 4.29Å; L245-W273 HydrophobicContact CB-CD2 4.39Å; L245-W273 HydrophobicContact CB-CZ2 3.82Å; L245-W273 HydrophobicContact CD1-CD2 4.31Å; L245-W273 HydrophobicContact CD1-CE3 4.38Å; L245-W273 HydrophobicContact CD1-CH2 4.45Å; L245-W273 HydrophobicContact CD1-CZ2 4.39Å; L245-W273 HydrophobicContact CD1-CZ3 4.44Å; L245-W273 PolarHBondContact O-NE1 3.11Å; L245-W273 VanDerWaalsContact O-NE1 3.14Å
246	P	96.6	Very high	97	Very high	38 Å²	38	49.6 Å²	49.6	25%	0.247	25%	0.25	C	C	.	.			trans	-63.3	153	174.4	27.2	-33.4	0	0	0	110.8	V221 A223 D248 A249	V221-P246 VanDerWaalsContact O-CD 3.26Å; V221-P246 WeakPolarHBondContact O-CD 3.24Å; V221-P246 WeakPolarHBondContact O-CG 3.38Å; A223-P246 HydrophobicContact CB-CB 4.42Å; P246-D248 PolarHBondContact O-N 3.21Å; P246-D248 VanDerWaalsContact O-N 3.13Å; P246-A249 HydrophobicContact CG-CB 3.89Å; P246-A249 VanDerWaalsContact O-CB 3.24Å; P246-A249 WeakPolarHBondContact O-CB 3.34Å; P246-A249 PolarHBondContact O-N 3.15Å
247	A	95.4	Very high	97	Very high	65 Å²	65	53.4 Å²	53.4	54%	0.537	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-33	-177.1	0	0	0	0	0	113	A272	A247-A272 HydrophobicContact CB-CB 3.79Å; A247-A272 CarbonylContact O-C 2.94Å; A247-A272 VanDerWaalsContact O-O 3.13Å
248	D	93.6	Very high	97	Very high	55 Å²	55	54 Å²	54	29%	0.294	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	16.7	-179.2	70.4	-27.6	0	0	0	113.4	A223 G224 P246 F250 R251	A223-D248 WeakPolarHBondContact CA-OD1 3.38Å; A223-D248 WeakPolarHBondContact CB-OD1 3.31Å; G224-D248 PolarHBondContact N-OD2 3.2Å; P246-D248 PolarHBondContact O-N 3.21Å; P246-D248 VanDerWaalsContact O-N 3.13Å; D248-F250 PolarHBondContact O-N 3.29Å; D248-F250 VanDerWaalsContact O-N 3.14Å; D248-R251 HydrophobicContact CB-CB 4.09Å; D248-R251 WeakPolarHBondContact O-CB 3.18Å; D248-R251 PolarHBondContact O-N 2.81Å; D248-R251 VanDerWaalsContact O-N 3.1Å
249	A	95.5	Very high	97	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.008	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-45.7	-176.4	0	0	0	0	0	112.5	F226 L245 P246	F226-A249 VanDerWaalsContact CD2-O 3.23Å; F226-A249 WeakPolarHBondContact CD2-O 3.34Å; L245-A249 HydrophobicContact CB-CB 4.29Å; L245-A249 HydrophobicContact CD2-CB 4.44Å; P246-A249 HydrophobicContact CG-CB 3.89Å; P246-A249 VanDerWaalsContact O-CB 3.24Å; P246-A249 WeakPolarHBondContact O-CB 3.34Å; P246-A249 PolarHBondContact O-N 3.15Å
250	F	96.8	Very high	97	Very high	3 Å²	3	51.2 Å²	51.2	1%	0.013	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	19.3	-176.1	-49.8	-57.3	0	0	0	113.5	F226 L235 L237 L245 D248 G252 L253 L259 L261 W273 L277	F226-F250 HydrophobicContact CD2-CD1 4.11Å; F226-F250 HydrophobicContact CD2-CE1 4.48Å; F226-F250 HydrophobicContact CE2-CD1 4.09Å; F226-F250 HydrophobicContact CE2-CE1 4.01Å; L235-F250 HydrophobicContact CD2-CD1 3.87Å; L235-F250 HydrophobicContact CD2-CE1 3.71Å; L237-F250 HydrophobicContact CD1-CE1 4.26Å; L245-F250 HydrophobicContact CD1-CE2 3.88Å; L245-F250 HydrophobicContact CD1-CZ 3.86Å; L245-F250 HydrophobicContact CD2-CZ 4.44Å; D248-F250 PolarHBondContact O-N 3.29Å; D248-F250 VanDerWaalsContact O-N 3.14Å; F250-G252 PolarHBondContact O-N 3.13Å; F250-L253 HydrophobicContact CB-CD1 4.03Å; F250-L253 HydrophobicContact CD1-CD1 4.13Å; F250-L253 WeakPolarHBondContact O-CB 3.28Å; F250-L253 WeakPolarHBondContact O-CG 3.5Å; F250-L253 PolarHBondContact O-N 3.19Å; F250-L259 HydrophobicContact CD2-CD2 4.11Å; F250-L259 HydrophobicContact CE1-CD1 4.13Å; F250-L259 HydrophobicContact CE2-CD2 3.92Å; F250-L259 HydrophobicContact CZ-CD1 4.13Å; F250-L259 HydrophobicContact CZ-CD2 4.23Å; F250-L261 HydrophobicContact CE2-CD1 4.16Å; F250-L261 HydrophobicContact CZ-CD1 4.12Å; F250-L261 HydrophobicContact CZ-CD2 4.15Å; F250-W273 HydrophobicContact CD2-CB 4.16Å; F250-W273 WeakPolarHBondContact CD2-O 3.07Å; F250-W273 HydrophobicContact CE2-CB 4.39Å; F250-L277 HydrophobicContact CB-CD1 4.49Å; F250-L277 HydrophobicContact CB-CD2 4.17Å
251	R	94.9	Very high	97	Very high	177 Å²	177	50.9 Å²	50.9	67%	0.668	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	133.6	-179.4	-173.1	176.2	-179	133.6	1.9	110.9	D248 L253	D248-R251 HydrophobicContact CB-CB 4.09Å; D248-R251 WeakPolarHBondContact O-CB 3.18Å; D248-R251 PolarHBondContact O-N 2.81Å; D248-R251 VanDerWaalsContact O-N 3.1Å; R251-L253 VanDerWaalsContact C-N 3.34Å; R251-L253 PolarHBondContact O-N 3.31Å
252	G	93.9	Very high	97	Very high	26 Å²	26	47 Å²	47	27%	0.268	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	-3.1	178.2	0	0	0	0	0	116.2	F250 R254 D276	F250-G252 PolarHBondContact O-N 3.13Å; G252-R254 PolarHBondContact O-N 2.92Å; G252-D276 PolarHBondContact N-OD2 3.25Å
253	L	96.8	Very high	97	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.			trans	-80	57.1	-179.5	-58.6	-172.8	0	0	0	113.1	F226 C229 L232 L235 F250 R251 R255 L256 L277	F226-L253 HydrophobicContact CB-CD1 4.02Å; F226-L253 HydrophobicContact CB-CD2 3.89Å; F226-L253 HydrophobicContact CB-CG 4.29Å; F226-L253 HydrophobicContact CD2-CD1 4.31Å; F226-L253 HydrophobicContact CG-CD1 4.35Å; C229-L253 HydrophobicContact CB-CD2 4.17Å; C229-L253 VanDerWaalsContact O-CD2 3.24Å; C229-L253 WeakPolarHBondContact O-CD2 3.29Å; L232-L253 HydrophobicContact CB-CD2 4.25Å; L232-L253 HydrophobicContact CD2-CD1 4.34Å; L232-L253 HydrophobicContact CD2-CD2 4.48Å; L235-L253 HydrophobicContact CD2-CD1 4.26Å; F250-L253 HydrophobicContact CB-CD1 4.03Å; F250-L253 HydrophobicContact CD1-CD1 4.13Å; F250-L253 WeakPolarHBondContact O-CB 3.28Å; F250-L253 WeakPolarHBondContact O-CG 3.5Å; F250-L253 PolarHBondContact O-N 3.19Å; R251-L253 VanDerWaalsContact C-N 3.34Å; R251-L253 PolarHBondContact O-N 3.31Å; L253-R255 VanDerWaalsContact C-N 3.25Å; L253-R255 PolarHBondContact O-N 2.99Å; L253-L256 HydrophobicContact CB-CB 4.16Å; L253-L256 HydrophobicContact CB-CD2 4.47Å; L253-L256 HydrophobicContact CD1-CD2 4.26Å; L253-L256 VanDerWaalsContact O-CB 3.28Å; L253-L256 WeakPolarHBondContact O-CB 3.1Å; L253-L256 PolarHBondContact O-N 3Å; L253-L277 HydrophobicContact CB-CD2 3.82Å; L253-L277 WeakPolarHBondContact O-CD2 3.15Å
254	R	94.9	Very high	97.1	Very high	163 Å²	163	46 Å²	46	62%	0.615	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.9	-171.2	-61.9	-179.9	-178.6	-167.9	-1	115	G252 D276 E279	G252-R254 PolarHBondContact O-N 2.92Å; R254-D276 WeakPolarHBondContact CA-O 3.25Å; R254-D276 HydrophobicContact CG-CB 4.45Å; R254-E279 WeakPolarHBondContact O-CG 3.38Å
255	R	97.4	Very high	97.2	Very high	129 Å²	129	41.7 Å²	41.7	49%	0.487	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	4.6	179.1	-63	-59	-169.2	164.6	0.8	113.3	L232 E233 L253 R257 E279	L232-R255 CarbonylContact O-C 3.13Å; E233-R255 WeakPolarHBondContact CA-O 3.5Å; L253-R255 VanDerWaalsContact C-N 3.25Å; L253-R255 PolarHBondContact O-N 2.99Å; R255-R257 PolarHBondContact O-N 3.14Å; R255-E279 VanDerWaalsContact CD-OE1 3.3Å; R255-E279 WeakPolarHBondContact CD-OE1 3.16Å; R255-E279 VanDerWaalsContact CD-OE2 3.32Å; R255-E279 WeakPolarHBondContact CD-OE2 3.18Å; R255-E279 IonicContact CZ-OE1 3.5Å; R255-E279 IonicContact NE-OE1 2.64Å; R255-E279 IonicContact NH1-OE1 3.77Å; R255-E279 PolarHBondContact NH1-OE1 3.23Å; R255-E279 IonicContact NH1-OE2 3.37Å; R255-E279 PolarHBondContact NH1-OE2 2.95Å
256	L	98.3	Very high	97.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.			trans	-70.1	121.9	-175.1	-161.4	72.7	0	0	0	109.6	L232 L235 L253 L259 L277 E279 L280	L232-L256 HydrophobicContact CB-CD1 4.35Å; L232-L256 HydrophobicContact CD2-CD1 4.1Å; L232-L256 HydrophobicContact CG-CD1 4.04Å; L232-L256 WeakPolarHBondContact O-CA 3.3Å; L232-L256 PolarHBondContact O-N 2.94Å; L232-L256 VanDerWaalsContact O-N 3.11Å; L235-L256 HydrophobicContact CB-CD1 3.85Å; L253-L256 HydrophobicContact CB-CB 4.16Å; L253-L256 HydrophobicContact CB-CD2 4.47Å; L253-L256 HydrophobicContact CD1-CD2 4.26Å; L253-L256 VanDerWaalsContact O-CB 3.28Å; L253-L256 WeakPolarHBondContact O-CB 3.1Å; L253-L256 PolarHBondContact O-N 3Å; L256-L259 HydrophobicContact CD2-CB 3.95Å; L256-L259 HydrophobicContact CD2-CD1 4.36Å; L256-L259 HydrophobicContact CD2-CD2 4.46Å; L256-L259 HydrophobicContact CD2-CG 4.49Å; L256-L277 HydrophobicContact CB-CD2 4.26Å; L256-L277 HydrophobicContact CD2-CD1 4.28Å; L256-L277 HydrophobicContact CD2-CD2 4.08Å; L256-E279 CarbonylContact O-C 3.38Å; L256-L280 HydrophobicContact CB-CD1 4.41Å; L256-L280 HydrophobicContact CD2-CD1 4.15Å; L256-L280 HydrophobicContact CG-CD1 4.13Å; L256-L280 WeakPolarHBondContact O-CA 3.16Å; L256-L280 PolarHBondContact O-N 3.27Å; L256-L280 VanDerWaalsContact O-N 3.15Å
257	R	98.4	Very high	97.3	Very high	99 Å²	99	42.4 Å²	42.4	37%	0.374	21%	0.21	S	C	.	.			trans	-103.6	-33.5	178.5	-64.1	-175	-178.6	-173.5	-3.3	112.3	E233 R255 E281 L282	E233-R257 PolarHBondContact O-N 3.01Å; R255-R257 PolarHBondContact O-N 3.14Å; R257-E281 HydrophobicContact CB-CG 4.45Å; R257-E281 IonicContact NE-OE1 3.82Å; R257-E281 PolarHBondContact O-N 3.37Å; R257-L282 PolarHBondContact O-N 3.26Å
258	T	98.8	Very high	97.4	Very high	13 Å²	13	44.6 Å²	44.6	8%	0.08	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.6	179.8	-48.6	0	0	0	0	110.3	E233 H234 L235 L236 L282 Y284	E233-T258 PolarHBondContact O-N 2.98Å; H234-T258 PolarHBondContact ND1-OG1 2.94Å; H234-T258 VanDerWaalsContact ND1-OG1 3.14Å; L235-T258 PolarHBondContact N-O 3.28Å; L236-T258 HydrophobicContact CD2-CG2 4.33Å; T258-L282 WeakPolarHBondContact CA-O 3.17Å; T258-L282 HydrophobicContact CG2-CB 4.2Å; T258-Y284 HydrophobicContact CG2-CE2 4.26Å
259	L	98.8	Very high	97.6	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	115.7	169.5	178.2	55.9	0	0	0	108.7	L235 F250 L256 L261 F274 L277 L280 L282 L283 Y284	L235-L259 HydrophobicContact CB-CD1 4.19Å; L235-L259 HydrophobicContact CD2-CD1 4Å; L235-L259 HydrophobicContact CG-CD1 4.12Å; F250-L259 HydrophobicContact CD2-CD2 4.11Å; F250-L259 HydrophobicContact CE1-CD1 4.13Å; F250-L259 HydrophobicContact CE2-CD2 3.92Å; F250-L259 HydrophobicContact CZ-CD1 4.13Å; F250-L259 HydrophobicContact CZ-CD2 4.23Å; L256-L259 HydrophobicContact CD2-CB 3.95Å; L256-L259 HydrophobicContact CD2-CD1 4.36Å; L256-L259 HydrophobicContact CD2-CD2 4.46Å; L256-L259 HydrophobicContact CD2-CG 4.49Å; L259-L261 HydrophobicContact CD1-CD1 4.36Å; L259-L261 HydrophobicContact CD1-CD2 4.45Å; L259-L261 HydrophobicContact CD1-CG 4.08Å; L259-L261 HydrophobicContact CD2-CD1 4.03Å; L259-L261 HydrophobicContact CG-CD1 4.11Å; L259-L261 HydrophobicContact CG-CG 4.12Å; L259-F274 HydrophobicContact CD2-CD1 4.41Å; L259-F274 HydrophobicContact CD2-CE1 3.87Å; L259-L277 HydrophobicContact CD2-CD1 3.99Å; L259-L280 HydrophobicContact CB-CD1 3.83Å; L259-L280 HydrophobicContact CB-CD2 4.48Å; L259-L282 PolarHBondContact N-O 2.87Å; L259-L283 HydrophobicContact CB-CD1 4.07Å; L259-L283 HydrophobicContact CD2-CD1 3.99Å; L259-L283 HydrophobicContact CG-CD1 4.04Å; L259-Y284 PolarHBondContact O-N 2.79Å
260	N	98.9	Very high	97.7	Very high	12 Å²	12	42.5 Å²	42.5	6%	0.064	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	108.8	177	-164.3	-12.5	0	0	0	111.7	L235 L236 L237 N238 G262 Y284	L235-N260 PolarHBondContact O-N 3.2Å; L236-N260 HydrophobicContact CD2-CB 3.86Å; L237-N260 CarbonylContact C-O 3.4Å; L237-N260 WeakPolarHBondContact CA-O 3.47Å; L237-N260 WeakPolarHBondContact CB-O 3.34Å; L237-N260 PolarHBondContact N-O 2.97Å; N238-N260 HydrophobicContact CB-CB 4.47Å; N238-N260 WeakPolarHBondContact CB-OD1 3.02Å; N238-N260 PolarHBondContact N-O 3.12Å; N238-N260 VanDerWaalsContact N-O 3.16Å; N238-N260 PolarHBondContact OD1-ND2 2.88Å; N260-G262 PolarHBondContact OD1-N 3.49Å; N260-Y284 HydrophobicContact CB-CD2 4.08Å; N260-Y284 HydrophobicContact CB-CG 4.49Å; N260-Y284 WeakPolarHBondContact OD1-CB 3.24Å
261	L	98.8	Very high	97.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.215	C	C	.	.			trans	-114.8	10.5	176.5	-67.3	168.4	0	0	0	111.7	L237 L242 L245 F250 L259 N264 L266 Y284 L285 N288	L237-L261 HydrophobicContact CB-CD2 3.93Å; L237-L261 HydrophobicContact CD1-CD2 4.01Å; L242-L261 HydrophobicContact CD1-CD2 4.11Å; L245-L261 HydrophobicContact CD1-CD1 4.1Å; L245-L261 HydrophobicContact CD1-CD2 4.28Å; F250-L261 HydrophobicContact CE2-CD1 4.16Å; F250-L261 HydrophobicContact CZ-CD1 4.12Å; F250-L261 HydrophobicContact CZ-CD2 4.15Å; L259-L261 HydrophobicContact CD1-CD1 4.36Å; L259-L261 HydrophobicContact CD1-CD2 4.45Å; L259-L261 HydrophobicContact CD1-CG 4.08Å; L259-L261 HydrophobicContact CD2-CD1 4.03Å; L259-L261 HydrophobicContact CG-CD1 4.11Å; L259-L261 HydrophobicContact CG-CG 4.12Å; L261-N264 PolarHBondContact O-ND2 2.67Å; L261-L266 HydrophobicContact CB-CD1 4.24Å; L261-L266 HydrophobicContact CD1-CD1 4.39Å; L261-Y284 CarbonylContact C-O 3.13Å; L261-Y284 WeakPolarHBondContact CA-O 3.28Å; L261-Y284 WeakPolarHBondContact CB-O 3.46Å; L261-Y284 PolarHBondContact N-O 3.17Å; L261-L285 HydrophobicContact CB-CD2 4.03Å; L261-L285 HydrophobicContact CD1-CD2 3.98Å; L261-N288 PolarHBondContact O-ND2 2.85Å
262	G	98.8	Very high	97.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.2	C	C	.	.			trans	-67.2	152.4	-177	0	0	0	0	0	113.1	N238 D239 N260 Y284 D286	N238-G262 CarbonylContact C-O 3.19Å; N238-G262 WeakPolarHBondContact CA-O 3.45Å; N238-G262 WeakPolarHBondContact CB-O 3.3Å; D239-G262 PolarHBondContact N-O 3.23Å; N260-G262 PolarHBondContact OD1-N 3.49Å; G262-Y284 PolarHBondContact N-O 3.02Å; G262-D286 CarbonylContact C-O 3.58Å; G262-D286 WeakPolarHBondContact CA-O 3.41Å
263	G	98.7	Very high	97.8	Very high	17 Å²	17	40.8 Å²	40.8	18%	0.175	19%	0.19	C	C	.	.	S	Bend	trans	69.3	37.5	-178.9	0	0	0	0	0	113.3	D239 N240 D286 R287	D239-G263 VanDerWaalsContact CA-O 3.23Å; D239-G263 WeakPolarHBondContact CA-O 3.46Å; D239-G263 PolarHBondContact N-O 3.01Å; N240-G263 PolarHBondContact N-O 3.42Å; G263-D286 PolarHBondContact N-O 2.76Å; G263-R287 CarbonylContact C-O 3.57Å; G263-R287 WeakPolarHBondContact CA-O 3.3Å; G263-R287 PolarHBondContact N-O 3.11Å; G263-R287 VanDerWaalsContact N-O 3.13Å
264	N	98.9	Very high	97.8	Very high	15 Å²	15	41 Å²	41	8%	0.08	19%	0.19	C	C	.	.	S	Bend	trans	-115.9	-164.6	173.7	-81.8	-76.3	0	0	0	109.8	L237 N240 L241 L242 L261 L266 R287 N288	L237-N264 PolarHBondContact O-ND2 3.16Å; N240-N264 WeakPolarHBondContact CA-OD1 3.49Å; N240-N264 WeakPolarHBondContact CB-OD1 3.43Å; N240-N264 PolarHBondContact O-OD1 2.87Å; L241-N264 PolarHBondContact N-OD1 2.63Å; L242-N264 HydrophobicContact CB-CB 4.11Å; L242-N264 VanDerWaalsContact CB-OD1 3.31Å; L242-N264 WeakPolarHBondContact CB-OD1 3.46Å; L242-N264 WeakPolarHBondContact CG-OD1 3.49Å; L242-N264 PolarHBondContact N-OD1 2.92Å; L261-N264 PolarHBondContact O-ND2 2.67Å; N264-L266 HydrophobicContact CB-CG 4.4Å; N264-R287 PolarHBondContact N-O 3.05Å; N264-N288 VanDerWaalsContact CA-OD1 3.24Å; N264-N288 WeakPolarHBondContact CA-OD1 3.42Å; N264-N288 WeakPolarHBondContact CB-OD1 3.25Å; N264-N288 PolarHBondContact N-OD1 3.02Å; N264-N288 PolarHBondContact O-OD1 2.79Å
265	A	98.5	Very high	97.7	Very high	48 Å²	48	36.4 Å²	36.4	40%	0.397	18%	0.181	S	C	.	.			trans	-117.6	26.7	-179.7	0	0	0	0	0	112.5	L242 A243 N288	L242-A265 CarbonylContact O-C 3.57Å; L242-A265 VanDerWaalsContact O-C 3.22Å; L242-A265 VanDerWaalsContact O-CA 3.29Å; L242-A265 WeakPolarHBondContact O-CA 3.46Å; L242-A265 PolarHBondContact O-N 3.16Å; A243-A265 HydrophobicContact CB-CB 4.39Å; A265-N288 PolarHBondContact N-OD1 2.98Å
266	L	98.6	Very high	97.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.			trans	-66	134.5	-179.9	-60.5	172.6	0	0	0	110.2	L242 L245 L261 N264 W273 L285 N288 S289 I290	L242-L266 HydrophobicContact CB-CD2 4.38Å; L242-L266 PolarHBondContact O-N 3.12Å; L245-L266 HydrophobicContact CD1-CD1 4.48Å; L245-L266 HydrophobicContact CD1-CD2 4.32Å; L245-L266 HydrophobicContact CG-CD2 4.29Å; L261-L266 HydrophobicContact CB-CD1 4.24Å; L261-L266 HydrophobicContact CD1-CD1 4.39Å; N264-L266 HydrophobicContact CB-CG 4.4Å; L266-W273 HydrophobicContact CD1-CZ3 4.46Å; L266-W273 HydrophobicContact CD2-CH2 4.22Å; L266-L285 HydrophobicContact CD1-CD2 4.25Å; L266-N288 HydrophobicContact CB-CB 4.34Å; L266-N288 WeakPolarHBondContact CB-OD1 3.37Å; L266-N288 PolarHBondContact N-OD1 2.96Å; L266-S289 CarbonylContact O-C 3.58Å; L266-S289 VanDerWaalsContact O-CA 3.32Å; L266-S289 WeakPolarHBondContact O-CA 3.4Å; L266-S289 PolarHBondContact O-N 2.78Å; L266-I290 HydrophobicContact CB-CG1 4.27Å; L266-I290 WeakPolarHBondContact O-CG1 3.42Å; L266-I290 PolarHBondContact O-N 3.43Å
267	D	98.2	Very high	97.4	Very high	67 Å²	67	32.3 Å²	32.3	36%	0.358	17%	0.168	S	C	.	.			trans	-103	-17.8	-178.4	68.6	-15.1	0	0	0	113.5	I290 A291	D267-I290 CarbonylContact O-C 3.22Å; D267-I290 WeakPolarHBondContact O-CA 3.32Å; D267-A291 PolarHBondContact O-N 3.05Å
268	R	98	Very high	97.1	Very high	111 Å²	111	30.1 Å²	30.1	42%	0.419	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	166.3	-179	76.4	-164.6	82	123.2	4.9	111.8	W273 F292	R268-W273 WeakPolarHBondContact O-CH2 3.43Å; R268-W273 WeakPolarHBondContact O-CZ3 3.21Å; R268-F292 CarbonylContact C-O 3.47Å; R268-F292 WeakPolarHBondContact CA-O 3.4Å
269	V	98.1	Very high	97	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	117.1	169.6	180	0	0	0	0	109	F274 L285 I290 F292 V293 E294 A297 F298	V269-F274 HydrophobicContact CG1-CD2 4.39Å; V269-F274 HydrophobicContact CG1-CE2 3.47Å; V269-F274 VanDerWaalsContact CG1-CE2 3.47Å; V269-F274 HydrophobicContact CG1-CZ 4.2Å; V269-L285 HydrophobicContact CG1-CD1 4.41Å; V269-L285 HydrophobicContact CG2-CD1 3.9Å; V269-I290 HydrophobicContact CG2-CD1 3.8Å; V269-I290 HydrophobicContact CG2-CG1 4.31Å; V269-I290 HydrophobicContact CG2-CG2 3.85Å; V269-F292 PolarHBondContact N-O 2.79Å; V269-V293 HydrophobicContact CB-CB 4.35Å; V269-V293 HydrophobicContact CB-CG1 4.12Å; V269-V293 HydrophobicContact CB-CG2 4.12Å; V269-V293 HydrophobicContact CG1-CG1 4.34Å; V269-V293 HydrophobicContact CG2-CG2 4.11Å; V269-E294 WeakPolarHBondContact O-CB 3.47Å; V269-E294 PolarHBondContact O-N 3.27Å; V269-A297 HydrophobicContact CG1-CB 4.11Å; V269-F298 HydrophobicContact CG1-CE1 3.96Å; V269-F298 HydrophobicContact CG1-CZ 4.04Å
270	A	97.2	Very high	96.9	Very high	12 Å²	12	32.5 Å²	32.5	10%	0.099	18%	0.181	C	C	.	.			trans	-97.3	139.9	-179.3	0	0	0	0	0	112.2	A272 W273 E294	A270-A272 VanDerWaalsContact C-N 3.25Å; A270-A272 PolarHBondContact O-N 3.21Å; A270-W273 HydrophobicContact CB-CD2 3.96Å; A270-W273 HydrophobicContact CB-CG 4.26Å; A270-W273 HydrophobicContact CB-CZ2 4.11Å; A270-W273 PolarHBondContact O-N 3.34Å; A270-E294 VanDerWaalsContact CA-OE2 3.3Å; A270-E294 WeakPolarHBondContact CA-OE2 3.37Å
271	R	95.8	Very high	96.8	Very high	116 Å²	116	35.2 Å²	35.2	44%	0.438	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-60.3	-36.6	177.5	173.9	179	174	-162.4	1.2	112.6	W273 F274 E294 G296	R271-W273 PolarHBondContact O-N 3.45Å; R271-W273 VanDerWaalsContact O-N 3.17Å; R271-F274 PolarHBondContact O-N 2.91Å; R271-E294 HydrophobicContact CB-CB 4.5Å; R271-E294 PolarHBondContact N-OE2 3.3Å; R271-G296 WeakPolarHBondContact CG-O 3.29Å
272	A	96.1	Very high	96.8	Very high	42 Å²	42	37.5 Å²	37.5	35%	0.347	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-57.8	-31.4	-177.4	0	0	0	0	0	113.2	A247 A270 F274	A247-A272 HydrophobicContact CB-CB 3.79Å; A247-A272 CarbonylContact O-C 2.94Å; A247-A272 VanDerWaalsContact O-O 3.13Å; A270-A272 VanDerWaalsContact C-N 3.25Å; A270-A272 PolarHBondContact O-N 3.21Å; A272-F274 PolarHBondContact O-N 2.99Å
273	W	96.8	Very high	96.7	Very high	13 Å²	13	37.5 Å²	37.5	5%	0.049	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-63.7	-29	-177.2	-60.5	-18.1	0	0	0	113.4	L245 F250 L266 R268 A270 R271	L245-W273 HydrophobicContact CB-CD2 4.39Å; L245-W273 HydrophobicContact CB-CZ2 3.82Å; L245-W273 HydrophobicContact CD1-CD2 4.31Å; L245-W273 HydrophobicContact CD1-CE3 4.38Å; L245-W273 HydrophobicContact CD1-CH2 4.45Å; L245-W273 HydrophobicContact CD1-CZ2 4.39Å; L245-W273 HydrophobicContact CD1-CZ3 4.44Å; L245-W273 PolarHBondContact O-NE1 3.11Å; L245-W273 VanDerWaalsContact O-NE1 3.14Å; F250-W273 HydrophobicContact CD2-CB 4.16Å; F250-W273 WeakPolarHBondContact CD2-O 3.07Å; F250-W273 HydrophobicContact CE2-CB 4.39Å; L266-W273 HydrophobicContact CD1-CZ3 4.46Å; L266-W273 HydrophobicContact CD2-CH2 4.22Å; R268-W273 WeakPolarHBondContact O-CH2 3.43Å; R268-W273 WeakPolarHBondContact O-CZ3 3.21Å; A270-W273 HydrophobicContact CB-CD2 3.96Å; A270-W273 HydrophobicContact CB-CG 4.26Å; A270-W273 HydrophobicContact CB-CZ2 4.11Å; A270-W273 PolarHBondContact O-N 3.34Å; R271-W273 PolarHBondContact O-N 3.45Å; R271-W273 VanDerWaalsContact O-N 3.17Å
274	F	95.4	Very high	96.7	Very high	3 Å²	3	38.5 Å²	38.5	1%	0.013	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-112.8	5.6	-166.6	-55.1	-38.6	0	0	0	113.9	L259 V269 R271 A272 D276 L277 L283 L285 A297 F298 L301	L259-F274 HydrophobicContact CD2-CD1 4.41Å; L259-F274 HydrophobicContact CD2-CE1 3.87Å; V269-F274 HydrophobicContact CG1-CD2 4.39Å; V269-F274 HydrophobicContact CG1-CE2 3.47Å; V269-F274 VanDerWaalsContact CG1-CE2 3.47Å; V269-F274 HydrophobicContact CG1-CZ 4.2Å; R271-F274 PolarHBondContact O-N 2.91Å; A272-F274 PolarHBondContact O-N 2.99Å; F274-D276 VanDerWaalsContact C-N 3.29Å; F274-D276 PolarHBondContact O-N 3.47Å; F274-L277 HydrophobicContact CB-CD1 4.46Å; F274-L277 HydrophobicContact CD1-CD1 3.65Å; F274-L277 HydrophobicContact CE1-CD1 4.47Å; F274-L277 HydrophobicContact CG-CD1 4.48Å; F274-L277 PolarHBondContact O-N 3.44Å; F274-L277 VanDerWaalsContact O-N 3.14Å; F274-L283 HydrophobicContact CE1-CD1 4.27Å; F274-L283 HydrophobicContact CE1-CD2 4.25Å; F274-L283 HydrophobicContact CE2-CD2 4.01Å; F274-L283 HydrophobicContact CZ-CD1 4.26Å; F274-L283 HydrophobicContact CZ-CD2 3.83Å; F274-L285 HydrophobicContact CZ-CD1 4.38Å; F274-A297 WeakPolarHBondContact CD2-O 3.42Å; F274-F298 HydrophobicContact CD2-CD1 4.14Å; F274-F298 HydrophobicContact CD2-CE1 4.24Å; F274-F298 HydrophobicContact CE2-CD1 4.18Å; F274-F298 AromaticContact CE2-CE1 3.81Å; F274-F298 HydrophobicContact CE2-CE1 3.81Å; F274-L301 HydrophobicContact CB-CD1 4.49Å; F274-L301 HydrophobicContact CB-CD2 4.07Å; F274-L301 HydrophobicContact CB-CG 4.45Å; F274-L301 HydrophobicContact CD2-CD1 4.47Å; F274-L301 HydrophobicContact CG-CD1 4.5Å
275	V	93.4	Very high	96.7	Very high	68 Å²	68	37.8 Å²	37.8	41%	0.412	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-41.6	-173.7	173.7	0	0	0	0	112.9	N300	V275-N300 PolarHBondContact O-ND2 3Å
276	D	94.4	Very high	96.8	Very high	43 Å²	43	35.9 Å²	35.9	23%	0.23	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-2.5	-175.7	-75.6	-34.7	0	0	0	114.2	G252 R254 F274 A278	G252-D276 PolarHBondContact N-OD2 3.25Å; R254-D276 WeakPolarHBondContact CA-O 3.25Å; R254-D276 HydrophobicContact CG-CB 4.45Å; F274-D276 VanDerWaalsContact C-N 3.29Å; F274-D276 PolarHBondContact O-N 3.47Å; D276-A278 VanDerWaalsContact C-N 3.29Å; D276-A278 PolarHBondContact O-N 3.33Å
277	L	95.3	Very high	96.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.			trans	-88.4	50.8	-166.9	-53.2	-170.9	0	0	0	113.6	F250 L253 L256 L259 F274 E279 L280 L301	F250-L277 HydrophobicContact CB-CD1 4.49Å; F250-L277 HydrophobicContact CB-CD2 4.17Å; L253-L277 HydrophobicContact CB-CD2 3.82Å; L253-L277 WeakPolarHBondContact O-CD2 3.15Å; L256-L277 HydrophobicContact CB-CD2 4.26Å; L256-L277 HydrophobicContact CD2-CD1 4.28Å; L256-L277 HydrophobicContact CD2-CD2 4.08Å; L259-L277 HydrophobicContact CD2-CD1 3.99Å; F274-L277 HydrophobicContact CB-CD1 4.46Å; F274-L277 HydrophobicContact CD1-CD1 3.65Å; F274-L277 HydrophobicContact CE1-CD1 4.47Å; F274-L277 HydrophobicContact CG-CD1 4.48Å; F274-L277 PolarHBondContact O-N 3.44Å; F274-L277 VanDerWaalsContact O-N 3.14Å; L277-E279 VanDerWaalsContact C-N 3.32Å; L277-E279 PolarHBondContact O-N 3.34Å; L277-L280 HydrophobicContact CB-CB 4.16Å; L277-L280 HydrophobicContact CB-CD2 4.45Å; L277-L280 HydrophobicContact CD1-CD2 4.14Å; L277-L280 VanDerWaalsContact O-CB 3.3Å; L277-L280 WeakPolarHBondContact O-CB 3.13Å; L277-L280 PolarHBondContact O-N 3.23Å; L277-L301 HydrophobicContact CB-CD2 3.85Å; L277-L301 VanDerWaalsContact O-CD2 3.31Å; L277-L301 WeakPolarHBondContact O-CD2 3.17Å
278	A	91.9	Very high	96.8	Very high	52 Å²	52	38.7 Å²	38.7	43%	0.43	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-28.1	-172.6	0	0	0	0	0	114.8	D276	D276-A278 VanDerWaalsContact C-N 3.29Å; D276-A278 PolarHBondContact O-N 3.33Å
279	E	95.8	Very high	96.8	Very high	64 Å²	64	35.6 Å²	35.6	30%	0.299	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	10	178.6	-65.9	-173.9	-161.8	0	0	113.3	R254 R255 L256 L277 E281	R254-E279 WeakPolarHBondContact O-CG 3.38Å; R255-E279 VanDerWaalsContact CD-OE1 3.3Å; R255-E279 WeakPolarHBondContact CD-OE1 3.16Å; R255-E279 VanDerWaalsContact CD-OE2 3.32Å; R255-E279 WeakPolarHBondContact CD-OE2 3.18Å; R255-E279 IonicContact CZ-OE1 3.5Å; R255-E279 IonicContact NE-OE1 2.64Å; R255-E279 IonicContact NH1-OE1 3.77Å; R255-E279 PolarHBondContact NH1-OE1 3.23Å; R255-E279 IonicContact NH1-OE2 3.37Å; R255-E279 PolarHBondContact NH1-OE2 2.95Å; L256-E279 CarbonylContact O-C 3.38Å; L277-E279 VanDerWaalsContact C-N 3.32Å; L277-E279 PolarHBondContact O-N 3.34Å; E279-E281 PolarHBondContact O-N 2.99Å
280	L	97.1	Very high	96.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.			trans	-69.6	122.8	-176.3	-162.2	72.1	0	0	0	111.1	L256 L259 L277 L283 L301 G303 L304	L256-L280 HydrophobicContact CB-CD1 4.41Å; L256-L280 HydrophobicContact CD2-CD1 4.15Å; L256-L280 HydrophobicContact CG-CD1 4.13Å; L256-L280 WeakPolarHBondContact O-CA 3.16Å; L256-L280 PolarHBondContact O-N 3.27Å; L256-L280 VanDerWaalsContact O-N 3.15Å; L259-L280 HydrophobicContact CB-CD1 3.83Å; L259-L280 HydrophobicContact CB-CD2 4.48Å; L277-L280 HydrophobicContact CB-CB 4.16Å; L277-L280 HydrophobicContact CB-CD2 4.45Å; L277-L280 HydrophobicContact CD1-CD2 4.14Å; L277-L280 VanDerWaalsContact O-CB 3.3Å; L277-L280 WeakPolarHBondContact O-CB 3.13Å; L277-L280 PolarHBondContact O-N 3.23Å; L280-L283 HydrophobicContact CD2-CB 3.97Å; L280-L283 HydrophobicContact CD2-CD1 4.32Å; L280-L283 HydrophobicContact CD2-CD2 4.24Å; L280-L283 HydrophobicContact CD2-CG 4.41Å; L280-L301 HydrophobicContact CB-CD2 4.06Å; L280-L301 HydrophobicContact CD2-CD1 4.26Å; L280-L301 HydrophobicContact CD2-CD2 3.93Å; L280-G303 CarbonylContact O-C 3.4Å; L280-L304 HydrophobicContact CB-CD1 4.44Å; L280-L304 HydrophobicContact CD2-CD1 4.14Å; L280-L304 HydrophobicContact CG-CD1 4.13Å; L280-L304 VanDerWaalsContact O-CA 3.24Å; L280-L304 WeakPolarHBondContact O-CA 3.37Å; L280-L304 PolarHBondContact O-N 2.91Å
281	E	97.1	Very high	96.9	Very high	68 Å²	68	37.5 Å²	37.5	32%	0.318	20%	0.202	S	C	.	.			trans	-102.3	-39.2	-179.2	-66.6	172.2	-169	0	0	111.2	R257 E279 L305 A306	R257-E281 HydrophobicContact CB-CG 4.45Å; R257-E281 IonicContact NE-OE1 3.82Å; R257-E281 PolarHBondContact O-N 3.37Å; E279-E281 PolarHBondContact O-N 2.99Å; E281-L305 HydrophobicContact CB-CD1 4.09Å; E281-L305 HydrophobicContact CB-CG 4.18Å; E281-L305 HydrophobicContact CG-CD1 4.27Å; E281-L305 HydrophobicContact CG-CG 4.48Å; E281-L305 WeakPolarHBondContact O-CA 3.38Å; E281-L305 WeakPolarHBondContact O-CB 3.34Å; E281-L305 PolarHBondContact O-N 3.37Å; E281-A306 PolarHBondContact O-N 3.17Å; E281-A306 VanDerWaalsContact O-N 3.12Å
282	L	98.3	Very high	97	Very high	48 Å²	48	37.8 Å²	37.8	25%	0.251	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	117.6	-173.8	-57.2	176.4	0	0	0	110.5	R257 T258 L259 Y284 A306	R257-L282 PolarHBondContact O-N 3.26Å; T258-L282 WeakPolarHBondContact CA-O 3.17Å; T258-L282 HydrophobicContact CG2-CB 4.2Å; L259-L282 PolarHBondContact N-O 2.87Å; L282-Y284 HydrophobicContact CB-CE2 3.88Å; L282-A306 HydrophobicContact CD2-CB 3.81Å
283	L	98.4	Very high	97.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.1	176	-179.9	53.1	0	0	0	110.5	L259 F274 L280 L285 F298 L301 L304 A306 L307 H308	L259-L283 HydrophobicContact CB-CD1 4.07Å; L259-L283 HydrophobicContact CD2-CD1 3.99Å; L259-L283 HydrophobicContact CG-CD1 4.04Å; F274-L283 HydrophobicContact CE1-CD1 4.27Å; F274-L283 HydrophobicContact CE1-CD2 4.25Å; F274-L283 HydrophobicContact CE2-CD2 4.01Å; F274-L283 HydrophobicContact CZ-CD1 4.26Å; F274-L283 HydrophobicContact CZ-CD2 3.83Å; L280-L283 HydrophobicContact CD2-CB 3.97Å; L280-L283 HydrophobicContact CD2-CD1 4.32Å; L280-L283 HydrophobicContact CD2-CD2 4.24Å; L280-L283 HydrophobicContact CD2-CG 4.41Å; L283-L285 HydrophobicContact CD1-CD1 4.39Å; L283-L285 HydrophobicContact CD1-CG 4.14Å; L283-L285 HydrophobicContact CD2-CD1 4.02Å; L283-L285 HydrophobicContact CG-CD1 4.06Å; L283-L285 HydrophobicContact CG-CG 4.16Å; L283-F298 HydrophobicContact CD2-CD1 4.32Å; L283-F298 HydrophobicContact CD2-CE1 4Å; L283-L301 HydrophobicContact CD2-CD1 3.98Å; L283-L304 HydrophobicContact CB-CD1 3.88Å; L283-A306 PolarHBondContact N-O 3.41Å; L283-L307 HydrophobicContact CB-CD1 4.02Å; L283-L307 HydrophobicContact CD2-CD1 3.84Å; L283-L307 HydrophobicContact CG-CD1 3.81Å; L283-L307 WeakPolarHBondContact O-CA 3.42Å; L283-H308 PolarHBondContact O-N 2.81Å
284	Y	98.8	Very high	97.1	Very high	38 Å²	38	39.1 Å²	39.1	15%	0.149	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.2	176.3	-59.9	-92.6	0	0	0	110.6	T258 L259 N260 L261 G262 L282 D286 H308	T258-Y284 HydrophobicContact CG2-CE2 4.26Å; L259-Y284 PolarHBondContact O-N 2.79Å; N260-Y284 HydrophobicContact CB-CD2 4.08Å; N260-Y284 HydrophobicContact CB-CG 4.49Å; N260-Y284 WeakPolarHBondContact OD1-CB 3.24Å; L261-Y284 CarbonylContact C-O 3.13Å; L261-Y284 WeakPolarHBondContact CA-O 3.28Å; L261-Y284 WeakPolarHBondContact CB-O 3.46Å; L261-Y284 PolarHBondContact N-O 3.17Å; G262-Y284 PolarHBondContact N-O 3.02Å; L282-Y284 HydrophobicContact CB-CE2 3.88Å; Y284-D286 WeakPolarHBondContact CB-OD1 3.32Å; Y284-H308 HydrophobicContact CD1-CB 3.98Å; Y284-H308 AromaticContact CD1-CD2 3.38Å; Y284-H308 WeakPolarHBondContact CD1-CD2 3.49Å; Y284-H308 AromaticContact CD1-CG 3.61Å; Y284-H308 AromaticContact CD1-NE2 3.92Å; Y284-H308 AromaticContact CE1-CD2 3.27Å; Y284-H308 WeakPolarHBondContact CE1-CD2 3.44Å; Y284-H308 AromaticContact CE1-CE1 3.86Å; Y284-H308 AromaticContact CE1-CG 3.83Å; Y284-H308 AromaticContact CE1-NE2 3.31Å; Y284-H308 VanDerWaalsContact CE1-NE2 3.31Å; Y284-H308 WeakPolarHBondContact CE1-NE2 3.48Å; Y284-H308 AromaticContact CZ-NE2 3.97Å
285	L	98.8	Very high	97	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.			trans	-124	10.7	174.9	-71	166.3	0	0	0	110.9	L261 L266 V269 F274 L283 N288 I290 F298 L307 H308 L309 N312	L261-L285 HydrophobicContact CB-CD2 4.03Å; L261-L285 HydrophobicContact CD1-CD2 3.98Å; L266-L285 HydrophobicContact CD1-CD2 4.25Å; V269-L285 HydrophobicContact CG1-CD1 4.41Å; V269-L285 HydrophobicContact CG2-CD1 3.9Å; F274-L285 HydrophobicContact CZ-CD1 4.38Å; L283-L285 HydrophobicContact CD1-CD1 4.39Å; L283-L285 HydrophobicContact CD1-CG 4.14Å; L283-L285 HydrophobicContact CD2-CD1 4.02Å; L283-L285 HydrophobicContact CG-CD1 4.06Å; L283-L285 HydrophobicContact CG-CG 4.16Å; L285-N288 PolarHBondContact O-ND2 3.38Å; L285-I290 HydrophobicContact CB-CD1 3.81Å; L285-I290 HydrophobicContact CD2-CD1 4.25Å; L285-I290 HydrophobicContact CG-CD1 4.45Å; L285-F298 HydrophobicContact CD1-CE1 4.36Å; L285-L307 HydrophobicContact CD1-CD1 4.21Å; L285-H308 CarbonylContact C-O 3.38Å; L285-H308 WeakPolarHBondContact CA-O 3.5Å; L285-H308 WeakPolarHBondContact CB-O 3.38Å; L285-H308 PolarHBondContact N-O 2.99Å; L285-L309 HydrophobicContact CB-CD2 3.88Å; L285-L309 HydrophobicContact CD1-CD2 3.94Å; L285-N312 PolarHBondContact O-ND2 3.23Å
286	D	98.8	Very high	97.1	Very high	9 Å²	9	42.7 Å²	42.7	5%	0.048	22%	0.22	C	C	.	.			trans	-68.5	158.6	-178	60.4	-66.3	0	0	0	113.1	G262 G263 Y284 N288 H308 N310	G262-D286 CarbonylContact C-O 3.58Å; G262-D286 WeakPolarHBondContact CA-O 3.41Å; G263-D286 PolarHBondContact N-O 2.76Å; Y284-D286 WeakPolarHBondContact CB-OD1 3.32Å; D286-N288 VanDerWaalsContact C-N 3.31Å; D286-N288 PolarHBondContact O-N 3.25Å; D286-N288 PolarHBondContact O-ND2 2.93Å; D286-H308 HydrophobicContact CB-CB 4.12Å; D286-H308 PolarHBondContact N-O 3.17Å; D286-N310 WeakPolarHBondContact CA-O 3.31Å; D286-N310 WeakPolarHBondContact CB-ND2 3.48Å; D286-N310 VanDerWaalsContact CB-O 3.25Å; D286-N310 WeakPolarHBondContact CB-O 3.22Å; D286-N310 WeakPolarHBondContact CB-OD1 3.27Å
287	R	98.7	Very high	97.1	Very high	113 Å²	113	40.8 Å²	40.8	43%	0.426	21%	0.21	S	C	.	.	S	Bend	trans	54	47.2	-177.5	-56.3	-172	-63.6	-71.4	-7.1	112.2	D239 G263 N264 N310 S311	D239-R287 IonicContact OD1-NH2 3.94Å; G263-R287 CarbonylContact C-O 3.57Å; G263-R287 WeakPolarHBondContact CA-O 3.3Å; G263-R287 PolarHBondContact N-O 3.11Å; G263-R287 VanDerWaalsContact N-O 3.13Å; N264-R287 PolarHBondContact N-O 3.05Å; R287-N310 PolarHBondContact N-O 3.47Å; R287-N310 VanDerWaalsContact N-O 3.09Å; R287-S311 WeakPolarHBondContact CA-O 3.28Å; R287-S311 PolarHBondContact N-O 2.92Å
288	N	98.9	Very high	97.1	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.064	21%	0.211	C	C	.	.	S	Bend	trans	-116.7	-164.8	169.8	-84.5	-82.7	0	0	0	109.4	L261 N264 A265 L266 L285 D286 I290 S311 N312	L261-N288 PolarHBondContact O-ND2 2.85Å; N264-N288 VanDerWaalsContact CA-OD1 3.24Å; N264-N288 WeakPolarHBondContact CA-OD1 3.42Å; N264-N288 WeakPolarHBondContact CB-OD1 3.25Å; N264-N288 PolarHBondContact N-OD1 3.02Å; N264-N288 PolarHBondContact O-OD1 2.79Å; A265-N288 PolarHBondContact N-OD1 2.98Å; L266-N288 HydrophobicContact CB-CB 4.34Å; L266-N288 WeakPolarHBondContact CB-OD1 3.37Å; L266-N288 PolarHBondContact N-OD1 2.96Å; L285-N288 PolarHBondContact O-ND2 3.38Å; D286-N288 VanDerWaalsContact C-N 3.31Å; D286-N288 PolarHBondContact O-N 3.25Å; D286-N288 PolarHBondContact O-ND2 2.93Å; N288-I290 HydrophobicContact CB-CD1 3.98Å; N288-I290 HydrophobicContact CB-CG1 3.88Å; N288-S311 PolarHBondContact N-O 2.71Å; N288-N312 VanDerWaalsContact CA-OD1 3.24Å; N288-N312 WeakPolarHBondContact CA-OD1 3.26Å; N288-N312 WeakPolarHBondContact CB-OD1 3.24Å; N288-N312 PolarHBondContact N-OD1 2.78Å; N288-N312 PolarHBondContact O-OD1 3.19Å
289	S	98.5	Very high	97	Very high	46 Å²	46	40.8 Å²	40.8	32%	0.322	20%	0.201	S	C	.	.			trans	-115.4	30.6	172	-70.6	0	0	0	0	111.8	L266 A291 N312	L266-S289 CarbonylContact O-C 3.58Å; L266-S289 VanDerWaalsContact O-CA 3.32Å; L266-S289 WeakPolarHBondContact O-CA 3.4Å; L266-S289 PolarHBondContact O-N 2.78Å; S289-A291 PolarHBondContact O-N 2.76Å; S289-N312 PolarHBondContact N-OD1 3.38Å
290	I	98.8	Very high	96.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.202	C	C	.	.			trans	-64.7	119.5	-173	-62.2	163.5	0	0	0	109.2	L266 D267 V269 L285 N288 V293 L309 N312 R313 L314	L266-I290 HydrophobicContact CB-CG1 4.27Å; L266-I290 WeakPolarHBondContact O-CG1 3.42Å; L266-I290 PolarHBondContact O-N 3.43Å; D267-I290 CarbonylContact O-C 3.22Å; D267-I290 WeakPolarHBondContact O-CA 3.32Å; V269-I290 HydrophobicContact CG2-CD1 3.8Å; V269-I290 HydrophobicContact CG2-CG1 4.31Å; V269-I290 HydrophobicContact CG2-CG2 3.85Å; L285-I290 HydrophobicContact CB-CD1 3.81Å; L285-I290 HydrophobicContact CD2-CD1 4.25Å; L285-I290 HydrophobicContact CG-CD1 4.45Å; N288-I290 HydrophobicContact CB-CD1 3.98Å; N288-I290 HydrophobicContact CB-CG1 3.88Å; I290-V293 HydrophobicContact CG2-CG2 4.34Å; I290-L309 HydrophobicContact CD1-CD2 4.34Å; I290-N312 HydrophobicContact CB-CB 4.22Å; I290-N312 WeakPolarHBondContact CB-OD1 3.44Å; I290-N312 WeakPolarHBondContact CG1-OD1 3.23Å; I290-N312 PolarHBondContact N-OD1 2.94Å; I290-R313 CarbonylContact O-C 3.44Å; I290-R313 VanDerWaalsContact O-CA 3.29Å; I290-R313 WeakPolarHBondContact O-CA 3.44Å; I290-R313 PolarHBondContact O-N 2.84Å; I290-L314 HydrophobicContact CG2-CD2 3.95Å; I290-L314 HydrophobicContact CG2-CG 4.37Å; I290-L314 PolarHBondContact O-N 3.31Å; I290-L314 VanDerWaalsContact O-N 3.09Å
291	A	98.2	Very high	96.6	Very high	53 Å²	53	41.2 Å²	41.2	44%	0.438	21%	0.205	S	C	.	.			trans	-109.7	-17.1	175.5	0	0	0	0	0	112.4	D267 S289 R313	D267-A291 PolarHBondContact O-N 3.05Å; S289-A291 PolarHBondContact O-N 2.76Å; A291-R313 HydrophobicContact CB-CB 4.26Å
292	F	97.4	Very high	96.1	Very high	121 Å²	121	43.2 Å²	43.2	53%	0.531	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	140.5	-175.2	179.7	-108.2	0	0	0	112.3	R268 V269 E294	R268-F292 CarbonylContact C-O 3.47Å; R268-F292 WeakPolarHBondContact CA-O 3.4Å; V269-F292 PolarHBondContact N-O 2.79Å; F292-E294 HydrophobicContact CD1-CG 4.42Å; F292-E294 HydrophobicContact CE1-CB 4.4Å; F292-E294 HydrophobicContact CE1-CG 3.67Å; F292-E294 HydrophobicContact CZ-CG 4.47Å
293	V	97.8	Very high	95.6	Very high	16 Å²	16	42.4 Å²	42.4	10%	0.097	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.4	172.9	179.4	0	0	0	0	107.9	V269 I290 A297 F298 L314 L317 A321	V269-V293 HydrophobicContact CB-CB 4.35Å; V269-V293 HydrophobicContact CB-CG1 4.12Å; V269-V293 HydrophobicContact CB-CG2 4.12Å; V269-V293 HydrophobicContact CG1-CG1 4.34Å; V269-V293 HydrophobicContact CG2-CG2 4.11Å; I290-V293 HydrophobicContact CG2-CG2 4.34Å; V293-A297 HydrophobicContact CG1-CB 3.76Å; V293-F298 HydrophobicContact CG1-CD2 4.41Å; V293-F298 HydrophobicContact CG1-CE2 3.63Å; V293-F298 HydrophobicContact CG1-CZ 3.92Å; V293-L314 HydrophobicContact CG2-CD2 4Å; V293-L317 HydrophobicContact CB-CD1 4.4Å; V293-L317 HydrophobicContact CG2-CD1 4.16Å; V293-A321 HydrophobicContact CG1-CB 3.7Å
294	E	97	Very high	95.4	Very high	68 Å²	68	42.8 Å²	42.8	32%	0.318	23%	0.232	S	C	.	.			trans	-62.4	150.9	178.4	-77.2	178.5	-171.8	0	0	112.5	V269 A270 R271 F292 G296 A297	V269-E294 WeakPolarHBondContact O-CB 3.47Å; V269-E294 PolarHBondContact O-N 3.27Å; A270-E294 VanDerWaalsContact CA-OE2 3.3Å; A270-E294 WeakPolarHBondContact CA-OE2 3.37Å; R271-E294 HydrophobicContact CB-CB 4.5Å; R271-E294 PolarHBondContact N-OE2 3.3Å; F292-E294 HydrophobicContact CD1-CG 4.42Å; F292-E294 HydrophobicContact CE1-CB 4.4Å; F292-E294 HydrophobicContact CE1-CG 3.67Å; F292-E294 HydrophobicContact CZ-CG 4.47Å; E294-G296 PolarHBondContact O-N 3Å; E294-A297 HydrophobicContact CB-CB 4.46Å; E294-A297 WeakPolarHBondContact O-CB 3.49Å; E294-A297 PolarHBondContact O-N 2.77Å; E294-A297 VanDerWaalsContact O-N 3.11Å
295	E	94.8	Very high	95.2	Very high	144 Å²	144	46 Å²	46	67%	0.673	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	136	171.3	176.2	168	-169.1	0	0	111.1	A297 A320	E295-A297 PolarHBondContact O-N 3.27Å; E295-A320 HydrophobicContact CB-CB 4.37Å; E295-A320 HydrophobicContact CG-CB 3.82Å
296	G	93.9	Very high	95	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.021	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	16.3	-175.5	0	0	0	0	0	113.9	R271 E294 F298 Q299 A320 A321 Q323	R271-G296 WeakPolarHBondContact CG-O 3.29Å; E294-G296 PolarHBondContact O-N 3Å; G296-F298 PolarHBondContact O-N 3Å; G296-Q299 WeakPolarHBondContact O-CB 3.25Å; G296-Q299 WeakPolarHBondContact O-CG 3.47Å; G296-Q299 PolarHBondContact O-N 2.96Å; G296-Q299 VanDerWaalsContact O-N 3.16Å; G296-A320 PolarHBondContact N-O 3Å; G296-A321 CarbonylContact C-O 3.46Å; G296-Q323 WeakPolarHBondContact CA-O 3.24Å
297	A	95.6	Very high	94.9	Very high	2 Å²	2	46 Å²	46	2%	0.017	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-37.7	-179	0	0	0	0	0	113	V269 F274 V293 E294 E295 A321	V269-A297 HydrophobicContact CG1-CB 4.11Å; F274-A297 WeakPolarHBondContact CD2-O 3.42Å; V293-A297 HydrophobicContact CG1-CB 3.76Å; E294-A297 HydrophobicContact CB-CB 4.46Å; E294-A297 WeakPolarHBondContact O-CB 3.49Å; E294-A297 PolarHBondContact O-N 2.77Å; E294-A297 VanDerWaalsContact O-N 3.11Å; E295-A297 PolarHBondContact O-N 3.27Å; A297-A321 PolarHBondContact N-O 2.95Å; A297-A321 VanDerWaalsContact N-O 3.16Å
298	F	94.6	Very high	94.8	Very high	8 Å²	8	42 Å²	42	4%	0.035	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	9.3	-176.9	-52.1	-54.3	0	0	0	113.5	V269 F274 L283 L285 V293 G296 N300 L301 L307 L309 A321 F322	V269-F298 HydrophobicContact CG1-CE1 3.96Å; V269-F298 HydrophobicContact CG1-CZ 4.04Å; F274-F298 HydrophobicContact CD2-CD1 4.14Å; F274-F298 HydrophobicContact CD2-CE1 4.24Å; F274-F298 HydrophobicContact CE2-CD1 4.18Å; F274-F298 AromaticContact CE2-CE1 3.81Å; F274-F298 HydrophobicContact CE2-CE1 3.81Å; L283-F298 HydrophobicContact CD2-CD1 4.32Å; L283-F298 HydrophobicContact CD2-CE1 4Å; L285-F298 HydrophobicContact CD1-CE1 4.36Å; V293-F298 HydrophobicContact CG1-CD2 4.41Å; V293-F298 HydrophobicContact CG1-CE2 3.63Å; V293-F298 HydrophobicContact CG1-CZ 3.92Å; G296-F298 PolarHBondContact O-N 3Å; F298-N300 VanDerWaalsContact C-N 3.27Å; F298-N300 PolarHBondContact O-N 3.48Å; F298-N300 VanDerWaalsContact O-N 3.15Å; F298-L301 HydrophobicContact CB-CD1 4.15Å; F298-L301 HydrophobicContact CD1-CD1 3.74Å; F298-L301 HydrophobicContact CG-CD1 4.4Å; F298-L301 WeakPolarHBondContact O-CB 3.47Å; F298-L301 PolarHBondContact O-N 2.94Å; F298-L301 VanDerWaalsContact O-N 3.1Å; F298-L307 HydrophobicContact CD1-CD2 4.4Å; F298-L307 HydrophobicContact CD2-CD2 4.06Å; F298-L307 HydrophobicContact CE1-CD1 4.35Å; F298-L307 HydrophobicContact CE1-CD2 4.12Å; F298-L307 HydrophobicContact CE2-CD2 3.74Å; F298-L307 HydrophobicContact CG-CD2 4.37Å; F298-L307 HydrophobicContact CZ-CD1 4.39Å; F298-L307 HydrophobicContact CZ-CD2 3.77Å; F298-L309 HydrophobicContact CZ-CD1 4.48Å; F298-A321 HydrophobicContact CD2-CB 4.17Å; F298-A321 HydrophobicContact CE2-CB 4.39Å; F298-A321 PolarHBondContact N-O 3.02Å; F298-F322 HydrophobicContact CB-CD1 3.89Å; F298-F322 HydrophobicContact CB-CE1 4.21Å; F298-F322 AromaticContact CD2-CD1 3.83Å; F298-F322 HydrophobicContact CD2-CD1 3.83Å; F298-F322 AromaticContact CD2-CE1 3.48Å; F298-F322 HydrophobicContact CD2-CE1 3.48Å; F298-F322 VanDerWaalsContact CD2-CE1 3.48Å; F298-F322 AromaticContact CD2-CZ 3.94Å; F298-F322 HydrophobicContact CD2-CZ 3.94Å; F298-F322 HydrophobicContact CE2-CE1 4.21Å; F298-F322 HydrophobicContact CE2-CZ 4.29Å; F298-F322 HydrophobicContact CG-CD1 4.3Å; F298-F322 HydrophobicContact CG-CE1 4.16Å
299	Q	91	Very high	94.8	Very high	45 Å²	45	41.4 Å²	41.4	21%	0.21	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-32.7	-168.8	73.7	168.6	51.3	0	0	114.6	G296 Q323	G296-Q299 WeakPolarHBondContact O-CB 3.25Å; G296-Q299 WeakPolarHBondContact O-CG 3.47Å; G296-Q299 PolarHBondContact O-N 2.96Å; G296-Q299 VanDerWaalsContact O-N 3.16Å; Q299-Q323 WeakPolarHBondContact CB-O 3.21Å
300	N	90.3	Very high	94.8	Very high	61 Å²	61	39.7 Å²	39.7	33%	0.326	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-2.2	-175	-76.6	8	0	0	0	112.2	V275 F298 S302	V275-N300 PolarHBondContact O-ND2 3Å; F298-N300 VanDerWaalsContact C-N 3.27Å; F298-N300 PolarHBondContact O-N 3.48Å; F298-N300 VanDerWaalsContact O-N 3.15Å; N300-S302 PolarHBondContact O-N 2.8Å
301	L	92.4	Very high	94.7	Very high	11 Å²	11	41 Å²	41	6%	0.058	23%	0.232	C	C	.	.			trans	-86.3	55.7	-175.6	-55.6	-176.2	0	0	0	111.2	F274 L277 L280 L283 F298 G303 L304	F274-L301 HydrophobicContact CB-CD1 4.49Å; F274-L301 HydrophobicContact CB-CD2 4.07Å; F274-L301 HydrophobicContact CB-CG 4.45Å; F274-L301 HydrophobicContact CD2-CD1 4.47Å; F274-L301 HydrophobicContact CG-CD1 4.5Å; L277-L301 HydrophobicContact CB-CD2 3.85Å; L277-L301 VanDerWaalsContact O-CD2 3.31Å; L277-L301 WeakPolarHBondContact O-CD2 3.17Å; L280-L301 HydrophobicContact CB-CD2 4.06Å; L280-L301 HydrophobicContact CD2-CD1 4.26Å; L280-L301 HydrophobicContact CD2-CD2 3.93Å; L283-L301 HydrophobicContact CD2-CD1 3.98Å; F298-L301 HydrophobicContact CB-CD1 4.15Å; F298-L301 HydrophobicContact CD1-CD1 3.74Å; F298-L301 HydrophobicContact CG-CD1 4.4Å; F298-L301 WeakPolarHBondContact O-CB 3.47Å; F298-L301 PolarHBondContact O-N 2.94Å; F298-L301 VanDerWaalsContact O-N 3.1Å; L301-G303 PolarHBondContact O-N 2.85Å; L301-L304 HydrophobicContact CB-CB 4.02Å; L301-L304 HydrophobicContact CB-CD2 4.16Å; L301-L304 HydrophobicContact CD1-CD2 3.84Å; L301-L304 VanDerWaalsContact O-CB 3.28Å; L301-L304 WeakPolarHBondContact O-CB 3.44Å; L301-L304 PolarHBondContact O-N 3.06Å; L301-L304 VanDerWaalsContact O-N 3.13Å
302	S	87.4	Confident	94.8	Very high	110 Å²	110	39 Å²	39	77%	0.769	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-23.5	-173.6	51.8	0	0	0	0	114.4	N300	N300-S302 PolarHBondContact O-N 2.8Å
303	G	88.4	Confident	94.8	Very high	31 Å²	31	40.9 Å²	40.9	32%	0.32	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	3.8	177.6	0	0	0	0	0	115	L280 L301 L305	L280-G303 CarbonylContact O-C 3.4Å; L301-G303 PolarHBondContact O-N 2.85Å; G303-L305 PolarHBondContact O-N 3.24Å
304	L	93.5	Very high	94.8	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.042	21%	0.213	C	C	.	.			trans	-69.9	116.5	-167.7	-160.7	67.8	0	0	0	112	L280 L283 L301 L307 F327	L280-L304 HydrophobicContact CB-CD1 4.44Å; L280-L304 HydrophobicContact CD2-CD1 4.14Å; L280-L304 HydrophobicContact CG-CD1 4.13Å; L280-L304 VanDerWaalsContact O-CA 3.24Å; L280-L304 WeakPolarHBondContact O-CA 3.37Å; L280-L304 PolarHBondContact O-N 2.91Å; L283-L304 HydrophobicContact CB-CD1 3.88Å; L301-L304 HydrophobicContact CB-CB 4.02Å; L301-L304 HydrophobicContact CB-CD2 4.16Å; L301-L304 HydrophobicContact CD1-CD2 3.84Å; L301-L304 VanDerWaalsContact O-CB 3.28Å; L301-L304 WeakPolarHBondContact O-CB 3.44Å; L301-L304 PolarHBondContact O-N 3.06Å; L301-L304 VanDerWaalsContact O-N 3.13Å; L304-L307 HydrophobicContact CD2-CB 3.98Å; L304-F327 HydrophobicContact CB-CD2 4.2Å; L304-F327 HydrophobicContact CB-CE2 3.91Å; L304-F327 HydrophobicContact CD2-CD2 3.98Å; L304-F327 HydrophobicContact CD2-CE2 3.61Å; L304-F327 HydrophobicContact CG-CD2 4.39Å; L304-F327 HydrophobicContact CG-CE2 3.77Å
305	L	94.1	Very high	94.9	Very high	105 Å²	105	39.7 Å²	39.7	55%	0.55	22%	0.215	S	C	.	.			trans	-91.2	-35.2	-179.4	-57.5	-178.8	0	0	0	112	E281 G303 G329 R330	E281-L305 HydrophobicContact CB-CD1 4.09Å; E281-L305 HydrophobicContact CB-CG 4.18Å; E281-L305 HydrophobicContact CG-CD1 4.27Å; E281-L305 HydrophobicContact CG-CG 4.48Å; E281-L305 WeakPolarHBondContact O-CA 3.38Å; E281-L305 WeakPolarHBondContact O-CB 3.34Å; E281-L305 PolarHBondContact O-N 3.37Å; G303-L305 PolarHBondContact O-N 3.24Å; L305-G329 CarbonylContact O-C 3.12Å; L305-G329 WeakPolarHBondContact O-CA 3.3Å; L305-R330 PolarHBondContact O-N 3.4Å
306	A	95.2	Very high	95	Very high	10 Å²	10	34.5 Å²	34.5	8%	0.083	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	135.1	179	0	0	0	0	0	112.1	E281 L282 L283 R330 F332	E281-A306 PolarHBondContact O-N 3.17Å; E281-A306 VanDerWaalsContact O-N 3.12Å; L282-A306 HydrophobicContact CD2-CB 3.81Å; L283-A306 PolarHBondContact N-O 3.41Å; A306-R330 WeakPolarHBondContact CA-O 3.31Å; A306-F332 HydrophobicContact CB-CE2 4.31Å
307	L	96.1	Very high	95.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	118.8	173.7	170.4	59.1	0	0	0	109.5	L283 L285 F298 L304 L309 F322 F327 R330 L331 F332	L283-L307 HydrophobicContact CB-CD1 4.02Å; L283-L307 HydrophobicContact CD2-CD1 3.84Å; L283-L307 HydrophobicContact CG-CD1 3.81Å; L283-L307 WeakPolarHBondContact O-CA 3.42Å; L285-L307 HydrophobicContact CD1-CD1 4.21Å; F298-L307 HydrophobicContact CD1-CD2 4.4Å; F298-L307 HydrophobicContact CD2-CD2 4.06Å; F298-L307 HydrophobicContact CE1-CD1 4.35Å; F298-L307 HydrophobicContact CE1-CD2 4.12Å; F298-L307 HydrophobicContact CE2-CD2 3.74Å; F298-L307 HydrophobicContact CG-CD2 4.37Å; F298-L307 HydrophobicContact CZ-CD1 4.39Å; F298-L307 HydrophobicContact CZ-CD2 3.77Å; L304-L307 HydrophobicContact CD2-CB 3.98Å; L307-L309 HydrophobicContact CD1-CD1 4.47Å; L307-L309 HydrophobicContact CD1-CG 4.12Å; L307-L309 HydrophobicContact CD2-CD1 3.91Å; L307-L309 HydrophobicContact CD2-CG 4.43Å; L307-L309 HydrophobicContact CG-CD1 4.08Å; L307-L309 HydrophobicContact CG-CG 4.09Å; L307-F322 HydrophobicContact CD2-CE1 4.13Å; L307-F322 HydrophobicContact CD2-CZ 4.39Å; L307-F327 HydrophobicContact CB-CE2 4.25Å; L307-F327 HydrophobicContact CB-CZ 4.12Å; L307-R330 PolarHBondContact N-O 3.36Å; L307-L331 HydrophobicContact CB-CD2 3.6Å; L307-L331 HydrophobicContact CD2-CD2 3.74Å; L307-L331 HydrophobicContact CG-CD2 3.92Å; L307-F332 PolarHBondContact O-N 3.11Å
308	H	97.8	Very high	95	Very high	29 Å²	29	36.7 Å²	36.7	13%	0.134	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	111.4	177.7	-64.5	-102	0	0	0	110.4	L283 Y284 L285 D286 F332	L283-H308 PolarHBondContact O-N 2.81Å; Y284-H308 HydrophobicContact CD1-CB 3.98Å; Y284-H308 AromaticContact CD1-CD2 3.38Å; Y284-H308 WeakPolarHBondContact CD1-CD2 3.49Å; Y284-H308 AromaticContact CD1-CG 3.61Å; Y284-H308 AromaticContact CD1-NE2 3.92Å; Y284-H308 AromaticContact CE1-CD2 3.27Å; Y284-H308 WeakPolarHBondContact CE1-CD2 3.44Å; Y284-H308 AromaticContact CE1-CE1 3.86Å; Y284-H308 AromaticContact CE1-CG 3.83Å; Y284-H308 AromaticContact CE1-NE2 3.31Å; Y284-H308 VanDerWaalsContact CE1-NE2 3.31Å; Y284-H308 WeakPolarHBondContact CE1-NE2 3.48Å; Y284-H308 AromaticContact CZ-NE2 3.97Å; L285-H308 CarbonylContact C-O 3.38Å; L285-H308 WeakPolarHBondContact CA-O 3.5Å; L285-H308 WeakPolarHBondContact CB-O 3.38Å; L285-H308 PolarHBondContact N-O 2.99Å; D286-H308 HydrophobicContact CB-CB 4.12Å; D286-H308 PolarHBondContact N-O 3.17Å; H308-F332 AromaticContact CD2-CD2 3.94Å; H308-F332 AromaticContact CE1-CD2 3.22Å; H308-F332 WeakPolarHBondContact CE1-CD2 3.19Å; H308-F332 AromaticContact CE1-CE2 3.3Å; H308-F332 WeakPolarHBondContact CE1-CE2 3.2Å; H308-F332 AromaticContact CE1-CG 3.68Å; H308-F332 AromaticContact CE1-CZ 3.81Å; H308-F332 AromaticContact CG-CD2 3.79Å; H308-F332 AromaticContact ND1-CD2 3.35Å; H308-F332 VanDerWaalsContact ND1-CD2 3.35Å; H308-F332 WeakPolarHBondContact ND1-CD2 3.35Å; H308-F332 AromaticContact ND1-CE2 3.93Å; H308-F332 AromaticContact ND1-CG 3.51Å; H308-F332 AromaticContact NE2-CD2 3.61Å; H308-F332 AromaticContact NE2-CE2 3.52Å
309	L	97.8	Very high	94.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.226	C	C	.	.			trans	-119.6	7.8	174.5	-74.1	166.7	0	0	0	111.7	L285 I290 F298 L307 N312 L314 L317 F332 L333 N336	L285-L309 HydrophobicContact CB-CD2 3.88Å; L285-L309 HydrophobicContact CD1-CD2 3.94Å; I290-L309 HydrophobicContact CD1-CD2 4.34Å; F298-L309 HydrophobicContact CZ-CD1 4.48Å; L307-L309 HydrophobicContact CD1-CD1 4.47Å; L307-L309 HydrophobicContact CD1-CG 4.12Å; L307-L309 HydrophobicContact CD2-CD1 3.91Å; L307-L309 HydrophobicContact CD2-CG 4.43Å; L307-L309 HydrophobicContact CG-CD1 4.08Å; L307-L309 HydrophobicContact CG-CG 4.09Å; L309-N312 WeakPolarHBondContact O-CB 3.34Å; L309-N312 PolarHBondContact O-ND2 2.87Å; L309-L314 HydrophobicContact CB-CD1 4.13Å; L309-L314 HydrophobicContact CD1-CD1 4.29Å; L309-L314 HydrophobicContact CD2-CD1 4.35Å; L309-L317 HydrophobicContact CD1-CD1 4.43Å; L309-L317 HydrophobicContact CD1-CD2 4.42Å; L309-F332 CarbonylContact C-O 3.44Å; L309-F332 PolarHBondContact N-O 3.08Å; L309-L333 HydrophobicContact CB-CD2 4Å; L309-L333 HydrophobicContact CD1-CD2 4.22Å; L309-N336 PolarHBondContact O-ND2 3.11Å
310	N	97.8	Very high	94.9	Very high	9 Å²	9	40 Å²	40	5%	0.048	23%	0.228	C	C	.	.			trans	-65	153.5	-178.4	58.4	-85.7	0	0	0	112.5	D286 R287 F332 F334	D286-N310 WeakPolarHBondContact CA-O 3.31Å; D286-N310 WeakPolarHBondContact CB-ND2 3.48Å; D286-N310 VanDerWaalsContact CB-O 3.25Å; D286-N310 WeakPolarHBondContact CB-O 3.22Å; D286-N310 WeakPolarHBondContact CB-OD1 3.27Å; R287-N310 PolarHBondContact N-O 3.47Å; R287-N310 VanDerWaalsContact N-O 3.09Å; N310-F332 HydrophobicContact CB-CB 4.4Å; N310-F332 PolarHBondContact N-O 3.3Å; N310-F334 CarbonylContact C-O 3.05Å; N310-F334 WeakPolarHBondContact CA-O 3.41Å; N310-F334 HydrophobicContact CB-CD1 3.56Å; N310-F334 HydrophobicContact CB-CD2 3.87Å; N310-F334 HydrophobicContact CB-CE1 3.43Å; N310-F334 VanDerWaalsContact CB-CE1 3.43Å; N310-F334 HydrophobicContact CB-CE2 3.75Å; N310-F334 HydrophobicContact CB-CG 3.77Å; N310-F334 HydrophobicContact CB-CZ 3.53Å; N310-F334 WeakPolarHBondContact CB-O 3.44Å; N310-F334 VanDerWaalsContact CG-CE1 3.46Å; N310-F334 WeakPolarHBondContact ND2-CZ 3.23Å
311	S	98.2	Very high	95	Very high	29 Å²	29	37.2 Å²	37.2	20%	0.203	21%	0.213	C	C	.	.	S	Bend	trans	57.9	56.1	-178.3	-50.5	0	0	0	0	112.2	R287 N288 F334 R335	R287-S311 WeakPolarHBondContact CA-O 3.28Å; R287-S311 PolarHBondContact N-O 2.92Å; N288-S311 PolarHBondContact N-O 2.71Å; S311-F334 PolarHBondContact N-O 2.83Å; S311-R335 WeakPolarHBondContact CA-O 3.37Å; S311-R335 PolarHBondContact N-O 2.64Å; S311-R335 VanDerWaalsContact N-O 3.1Å; S311-R335 WeakPolarHBondContact OG-CD 3.14Å
312	N	98.8	Very high	94.9	Very high	11 Å²	11	36.9 Å²	36.9	6%	0.059	21%	0.211	C	C	.	.	S	Bend	trans	-129.9	-163.6	176	-87.6	-66.4	0	0	0	109.9	L285 N288 S289 I290 L309 R335 N336	L285-N312 PolarHBondContact O-ND2 3.23Å; N288-N312 VanDerWaalsContact CA-OD1 3.24Å; N288-N312 WeakPolarHBondContact CA-OD1 3.26Å; N288-N312 WeakPolarHBondContact CB-OD1 3.24Å; N288-N312 PolarHBondContact N-OD1 2.78Å; N288-N312 PolarHBondContact O-OD1 3.19Å; S289-N312 PolarHBondContact N-OD1 3.38Å; I290-N312 HydrophobicContact CB-CB 4.22Å; I290-N312 WeakPolarHBondContact CB-OD1 3.44Å; I290-N312 WeakPolarHBondContact CG1-OD1 3.23Å; I290-N312 PolarHBondContact N-OD1 2.94Å; L309-N312 WeakPolarHBondContact O-CB 3.34Å; L309-N312 PolarHBondContact O-ND2 2.87Å; N312-R335 PolarHBondContact N-O 3.46Å; N312-N336 VanDerWaalsContact CA-OD1 3.23Å; N312-N336 WeakPolarHBondContact CA-OD1 3.38Å; N312-N336 WeakPolarHBondContact CB-OD1 3.45Å; N312-N336 PolarHBondContact N-OD1 3.05Å; N312-N336 PolarHBondContact O-OD1 3.19Å
313	R	98.5	Very high	94.9	Very high	159 Å²	159	34.4 Å²	34.4	60%	0.6	19%	0.187	S	C	*	.			trans	-116.6	24.1	179.8	-63.3	-178.3	179.3	-92.2	0.3	112.2	I290 A291 T315 N336	I290-R313 CarbonylContact O-C 3.44Å; I290-R313 VanDerWaalsContact O-CA 3.29Å; I290-R313 WeakPolarHBondContact O-CA 3.44Å; I290-R313 PolarHBondContact O-N 2.84Å; A291-R313 HydrophobicContact CB-CB 4.26Å; R313-T315 PolarHBondContact O-N 3.44Å; R313-N336 PolarHBondContact N-OD1 3.01Å
314	L	98.4	Very high	94.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.203	C	C	.	.			trans	-69.1	126	-179.6	-68.2	168.8	0	0	0	110.1	I290 V293 L309 N336 P337 W338	I290-L314 HydrophobicContact CG2-CD2 3.95Å; I290-L314 HydrophobicContact CG2-CG 4.37Å; I290-L314 PolarHBondContact O-N 3.31Å; I290-L314 VanDerWaalsContact O-N 3.09Å; V293-L314 HydrophobicContact CG2-CD2 4Å; L309-L314 HydrophobicContact CB-CD1 4.13Å; L309-L314 HydrophobicContact CD1-CD1 4.29Å; L309-L314 HydrophobicContact CD2-CD1 4.35Å; L314-N336 HydrophobicContact CB-CB 4.34Å; L314-N336 WeakPolarHBondContact CB-OD1 3.11Å; L314-N336 PolarHBondContact N-OD1 2.95Å; L314-P337 CarbonylContact O-C 3.06Å; L314-P337 VanDerWaalsContact O-CD 3.26Å; L314-P337 WeakPolarHBondContact O-CD 3.33Å; L314-W338 HydrophobicContact CB-CE3 4.46Å; L314-W338 HydrophobicContact CB-CH2 3.64Å; L314-W338 HydrophobicContact CB-CZ2 4.34Å; L314-W338 HydrophobicContact CB-CZ3 3.71Å; L314-W338 HydrophobicContact CD1-CH2 3.85Å; L314-W338 HydrophobicContact CG-CH2 4.39Å
315	T	97.9	Very high	93.4	Very high	60 Å²	60	38.3 Å²	38.3	37%	0.368	21%	0.211	S	C	.	.	S	Bend	trans	-95.2	-28.8	168.8	57.2	0	0	0	0	111.4	R313 P337 C339	R313-T315 PolarHBondContact O-N 3.44Å; T315-P337 WeakPolarHBondContact CA-O 3.35Å; T315-P337 HydrophobicContact CG2-CG 4.23Å; T315-C339 PolarHBondContact O-N 3.28Å
316	V	97	Very high	92.1	Very high	34 Å²	34	40.4 Å²	40.4	21%	0.206	22%	0.216	C	C	.	.			trans	-143.7	147.1	178.4	64.7	0	0	0	0	109.3	R343 L344	V316-R343 HydrophobicContact CG2-CB 3.71Å; V316-L344 HydrophobicContact CG2-CD2 3.91Å; V316-L344 HydrophobicContact CG2-CG 4.32Å
317	L	95.3	Very high	90.9	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	22%	0.216	C	C	.	.			trans	-120.3	109.2	167.6	-179	62.5	0	0	0	106.6	V293 L309 F322 L331 L333 W338 W346	V293-L317 HydrophobicContact CB-CD1 4.4Å; V293-L317 HydrophobicContact CG2-CD1 4.16Å; L309-L317 HydrophobicContact CD1-CD1 4.43Å; L309-L317 HydrophobicContact CD1-CD2 4.42Å; L317-F322 HydrophobicContact CD1-CE2 4.44Å; L317-F322 HydrophobicContact CD2-CE2 4.03Å; L317-F322 HydrophobicContact CD2-CZ 4.11Å; L317-F322 HydrophobicContact CG-CE2 4.18Å; L317-L331 HydrophobicContact CD2-CD1 4.08Å; L317-L333 HydrophobicContact CD2-CD1 4.34Å; L317-L333 HydrophobicContact CD2-CD2 4.03Å; L317-W338 HydrophobicContact CB-CH2 4.06Å; L317-W338 HydrophobicContact CB-CZ3 3.88Å; L317-W346 HydrophobicContact CB-CZ2 4.35Å; L317-W346 HydrophobicContact CD2-CH2 4.35Å; L317-W346 HydrophobicContact CD2-CZ2 4.28Å; L317-W346 HydrophobicContact CG-CZ2 4.07Å; L317-W346 VanDerWaalsContact O-CE2 3.29Å; L317-W346 WeakPolarHBondContact O-CZ2 3.17Å; L317-W346 PolarHBondContact O-NE1 2.92Å
318	A	93.7	Very high	89.5	Confident	50 Å²	50	46.7 Å²	46.7	41%	0.413	25%	0.247	S	C	.	.			trans	-76.9	139	-178.7	0	0	0	0	0	110.7	A320 A321	A318-A320 HydrophobicContact CB-CB 4.44Å; A318-A320 PolarHBondContact O-N 2.8Å; A318-A320 VanDerWaalsContact O-N 3.16Å; A318-A321 VanDerWaalsContact O-CB 3.31Å; A318-A321 WeakPolarHBondContact O-CB 3.32Å; A318-A321 PolarHBondContact O-N 2.85Å
319	W	90.8	Very high	88.8	Confident	93 Å²	93	45.6 Å²	45.6	35%	0.352	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-53.4	-34	171.3	176.1	-110.5	0	0	0	112.6	A321 F322 Q323 F326 W346	W319-A321 PolarHBondContact O-N 3.24Å; W319-A321 VanDerWaalsContact O-N 3.08Å; W319-F322 PolarHBondContact O-N 3Å; W319-Q323 VanDerWaalsContact CZ2-NE2 3.26Å; W319-Q323 VanDerWaalsContact NE1-CD 3.27Å; W319-F326 AromaticContact CH2-CD1 3.89Å; W319-F326 HydrophobicContact CH2-CD1 3.89Å; W319-F326 HydrophobicContact CH2-CE1 4.2Å; W319-F326 AromaticContact CZ2-CD1 3.87Å; W319-F326 HydrophobicContact CZ2-CD1 3.87Å; W319-F326 AromaticContact CZ2-CE1 3.77Å; W319-F326 HydrophobicContact CZ2-CE1 3.77Å; W319-W346 HydrophobicContact CB-CD2 4.03Å; W319-W346 HydrophobicContact CB-CG 3.97Å; W319-W346 HydrophobicContact CD2-CE3 4.46Å; W319-W346 AromaticContact CE3-CD2 3.96Å; W319-W346 HydrophobicContact CE3-CD2 3.96Å; W319-W346 AromaticContact CE3-CE3 3.45Å; W319-W346 HydrophobicContact CE3-CE3 3.45Å; W319-W346 VanDerWaalsContact CE3-CE3 3.45Å; W319-W346 HydrophobicContact CE3-CH2 4.41Å; W319-W346 AromaticContact CE3-CZ3 3.71Å; W319-W346 HydrophobicContact CE3-CZ3 3.71Å; W319-W346 AromaticContact CZ3-CE3 3.99Å; W319-W346 HydrophobicContact CZ3-CE3 3.99Å; W319-W346 HydrophobicContact CZ3-CZ3 4.03Å
320	A	92.6	Very high	88.4	Confident	30 Å²	30	53.4 Å²	53.4	25%	0.248	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-56.5	-24.9	178.4	0	0	0	0	0	113.3	E295 G296 A318 F322 Q323	E295-A320 HydrophobicContact CB-CB 4.37Å; E295-A320 HydrophobicContact CG-CB 3.82Å; G296-A320 PolarHBondContact N-O 3Å; A318-A320 HydrophobicContact CB-CB 4.44Å; A318-A320 PolarHBondContact O-N 2.8Å; A318-A320 VanDerWaalsContact O-N 3.16Å; A320-F322 PolarHBondContact O-N 3.5Å; A320-F322 VanDerWaalsContact O-N 3.16Å; A320-Q323 PolarHBondContact O-N 3.36Å
321	A	93.8	Very high	88.2	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.008	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-60.3	-24.2	174.6	0	0	0	0	0	113.4	V293 G296 A297 F298 A318 W319	V293-A321 HydrophobicContact CG1-CB 3.7Å; G296-A321 CarbonylContact C-O 3.46Å; A297-A321 PolarHBondContact N-O 2.95Å; A297-A321 VanDerWaalsContact N-O 3.16Å; F298-A321 HydrophobicContact CD2-CB 4.17Å; F298-A321 HydrophobicContact CE2-CB 4.39Å; F298-A321 PolarHBondContact N-O 3.02Å; A318-A321 VanDerWaalsContact O-CB 3.31Å; A318-A321 WeakPolarHBondContact O-CB 3.32Å; A318-A321 PolarHBondContact O-N 2.85Å; W319-A321 PolarHBondContact O-N 3.24Å; W319-A321 VanDerWaalsContact O-N 3.08Å
322	F	90.8	Very high	88	Confident	5 Å²	5	54.9 Å²	54.9	2%	0.022	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-16.2	-178	-59	-77.7	0	0	0	113.4	F298 L307 L317 W319 A320 G325 F327 L331 W346	F298-F322 HydrophobicContact CB-CD1 3.89Å; F298-F322 HydrophobicContact CB-CE1 4.21Å; F298-F322 AromaticContact CD2-CD1 3.83Å; F298-F322 HydrophobicContact CD2-CD1 3.83Å; F298-F322 AromaticContact CD2-CE1 3.48Å; F298-F322 HydrophobicContact CD2-CE1 3.48Å; F298-F322 VanDerWaalsContact CD2-CE1 3.48Å; F298-F322 AromaticContact CD2-CZ 3.94Å; F298-F322 HydrophobicContact CD2-CZ 3.94Å; F298-F322 HydrophobicContact CE2-CE1 4.21Å; F298-F322 HydrophobicContact CE2-CZ 4.29Å; F298-F322 HydrophobicContact CG-CD1 4.3Å; F298-F322 HydrophobicContact CG-CE1 4.16Å; L307-F322 HydrophobicContact CD2-CE1 4.13Å; L307-F322 HydrophobicContact CD2-CZ 4.39Å; L317-F322 HydrophobicContact CD1-CE2 4.44Å; L317-F322 HydrophobicContact CD2-CE2 4.03Å; L317-F322 HydrophobicContact CD2-CZ 4.11Å; L317-F322 HydrophobicContact CG-CE2 4.18Å; W319-F322 PolarHBondContact O-N 3Å; A320-F322 PolarHBondContact O-N 3.5Å; A320-F322 VanDerWaalsContact O-N 3.16Å; F322-G325 CarbonylContact C-O 3.56Å; F322-G325 CarbonylContact O-C 3.46Å; F322-G325 VanDerWaalsContact O-C 3.24Å; F322-G325 VanDerWaalsContact O-CA 3.22Å; F322-G325 WeakPolarHBondContact O-CA 3.29Å; F322-G325 PolarHBondContact O-N 3.06Å; F322-F327 HydrophobicContact CD1-CB 3.48Å; F322-F327 VanDerWaalsContact CD1-CB 3.48Å; F322-F327 HydrophobicContact CD1-CG 4.14Å; F322-F327 HydrophobicContact CE1-CB 3.81Å; F322-F327 HydrophobicContact CE1-CD1 4.44Å; F322-F327 HydrophobicContact CE1-CD2 4.45Å; F322-F327 AromaticContact CE1-CG 3.97Å; F322-F327 HydrophobicContact CE1-CG 3.97Å; F322-F327 HydrophobicContact CG-CB 4.19Å; F322-L331 HydrophobicContact CZ-CD1 3.95Å; F322-L331 HydrophobicContact CZ-CD2 4.42Å; F322-W346 HydrophobicContact CD2-CH2 4.4Å; F322-W346 AromaticContact CE2-CH2 3.91Å; F322-W346 HydrophobicContact CE2-CH2 3.91Å; F322-W346 HydrophobicContact CE2-CZ2 4.39Å
323	Q	86.1	Confident	87.9	Confident	58 Å²	58	54.4 Å²	54.4	27%	0.271	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	147.8	-174	-69.8	-60.9	-69.4	0	0	113.7	G296 Q299 W319 A320 G325	G296-Q323 WeakPolarHBondContact CA-O 3.24Å; Q299-Q323 WeakPolarHBondContact CB-O 3.21Å; W319-Q323 VanDerWaalsContact CZ2-NE2 3.26Å; W319-Q323 VanDerWaalsContact NE1-CD 3.27Å; A320-Q323 PolarHBondContact O-N 3.36Å; Q323-G325 VanDerWaalsContact C-N 3.27Å; Q323-G325 PolarHBondContact NE2-O 3.16Å
324	P	78.9	Confident	87.8	Confident	99 Å²	99	50.1 Å²	50.1	64%	0.643	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	cis	-79.3	1.6	-3.2	33.6	-39.1	0	0	0	114.2
325	G	70.9	Confident	87.7	Confident	22 Å²	22	59 Å²	59	23%	0.227	29%	0.292	C	S	.	.	S	Bend	trans	-69	165.6	177	0	0	0	0	0	112.8	F322 Q323	F322-G325 CarbonylContact C-O 3.56Å; F322-G325 CarbonylContact O-C 3.46Å; F322-G325 VanDerWaalsContact O-C 3.24Å; F322-G325 VanDerWaalsContact O-CA 3.22Å; F322-G325 WeakPolarHBondContact O-CA 3.29Å; F322-G325 PolarHBondContact O-N 3.06Å; Q323-G325 VanDerWaalsContact C-N 3.27Å; Q323-G325 PolarHBondContact NE2-O 3.16Å
326	F	68	Low	87.7	Confident	148 Å²	148	56.6 Å²	56.6	65%	0.649	28%	0.277	S	S	*	.			trans	-115.4	124.3	167.3	-69.8	-84.7	0	0	0	108.4	W319	W319-F326 AromaticContact CH2-CD1 3.89Å; W319-F326 HydrophobicContact CH2-CD1 3.89Å; W319-F326 HydrophobicContact CH2-CE1 4.2Å; W319-F326 AromaticContact CZ2-CD1 3.87Å; W319-F326 HydrophobicContact CZ2-CD1 3.87Å; W319-F326 AromaticContact CZ2-CE1 3.77Å; W319-F326 HydrophobicContact CZ2-CE1 3.77Å
327	F	68.9	Low	87.7	Confident	20 Å²	20	57.5 Å²	57.5	9%	0.088	28%	0.284	C	S	.	.			trans	-82.7	122.2	171.9	178.6	-100.2	0	0	0	109.8	L304 L307 F322 G329 L331 W350	L304-F327 HydrophobicContact CB-CD2 4.2Å; L304-F327 HydrophobicContact CB-CE2 3.91Å; L304-F327 HydrophobicContact CD2-CD2 3.98Å; L304-F327 HydrophobicContact CD2-CE2 3.61Å; L304-F327 HydrophobicContact CG-CD2 4.39Å; L304-F327 HydrophobicContact CG-CE2 3.77Å; L307-F327 HydrophobicContact CB-CE2 4.25Å; L307-F327 HydrophobicContact CB-CZ 4.12Å; F322-F327 HydrophobicContact CD1-CB 3.48Å; F322-F327 VanDerWaalsContact CD1-CB 3.48Å; F322-F327 HydrophobicContact CD1-CG 4.14Å; F322-F327 HydrophobicContact CE1-CB 3.81Å; F322-F327 HydrophobicContact CE1-CD1 4.44Å; F322-F327 HydrophobicContact CE1-CD2 4.45Å; F322-F327 AromaticContact CE1-CG 3.97Å; F322-F327 HydrophobicContact CE1-CG 3.97Å; F322-F327 HydrophobicContact CG-CB 4.19Å; F327-G329 VanDerWaalsContact CE1-CA 3.5Å; F327-G329 WeakPolarHBondContact CE1-O 3.41Å; F327-L331 HydrophobicContact CD1-CD1 4.47Å; F327-L331 HydrophobicContact CD1-CD2 3.66Å; F327-L331 HydrophobicContact CD1-CG 3.92Å; F327-L331 HydrophobicContact CE1-CD1 4.45Å; F327-L331 HydrophobicContact CE1-CD2 3.1Å; F327-L331 HydrophobicContact CE1-CG 3.46Å; F327-L331 VanDerWaalsContact CE1-CG 3.46Å; F327-L331 HydrophobicContact CE2-CD2 4.29Å; F327-L331 HydrophobicContact CG-CD2 4.43Å; F327-L331 HydrophobicContact CZ-CD2 3.44Å; F327-L331 VanDerWaalsContact CZ-CD2 3.44Å; F327-L331 HydrophobicContact CZ-CG 4.25Å; F327-W350 AromaticContact CD1-CH2 3.61Å; F327-W350 HydrophobicContact CD1-CH2 3.61Å; F327-W350 HydrophobicContact CD1-CZ2 4.14Å; F327-W350 AromaticContact CE1-CH2 3.85Å; F327-W350 HydrophobicContact CE1-CH2 3.85Å
328	L	66.8	Low	87.9	Confident	123 Å²	123	57.5 Å²	57.5	64%	0.644	28%	0.284	S	S	*	.			trans	-114.3	4.7	-178.9	-65.4	171.6	0	0	0	112.1	R356	L328-R356 PolarHBondContact O-NH1 2.91Å
329	G	83.5	Confident	88.1	Confident	6 Å²	6	56.2 Å²	56.2	6%	0.062	27%	0.272	C	S	.	.	S	Bend	trans	-82.4	-167.4	-180	0	0	0	0	0	113.9	L305 F327	L305-G329 CarbonylContact O-C 3.12Å; L305-G329 WeakPolarHBondContact O-CA 3.3Å; F327-G329 VanDerWaalsContact CE1-CA 3.5Å; F327-G329 WeakPolarHBondContact CE1-O 3.41Å
330	R	90.6	Very high	88.4	Confident	164 Å²	164	51.8 Å²	51.8	62%	0.619	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.6	169.1	-62.8	-178.1	-172.9	-175.5	0.9	110	L305 A306 L307 F332	L305-R330 PolarHBondContact O-N 3.4Å; A306-R330 WeakPolarHBondContact CA-O 3.31Å; L307-R330 PolarHBondContact N-O 3.36Å; R330-F332 HydrophobicContact CB-CE2 3.96Å; R330-F332 HydrophobicContact CB-CZ 4.39Å
331	L	92.3	Very high	88.5	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.9	168.1	-61.7	-169.5	0	0	0	110.6	L307 L317 F322 F327 L333 W350 V357	L307-L331 HydrophobicContact CB-CD2 3.6Å; L307-L331 HydrophobicContact CD2-CD2 3.74Å; L307-L331 HydrophobicContact CG-CD2 3.92Å; L317-L331 HydrophobicContact CD2-CD1 4.08Å; F322-L331 HydrophobicContact CZ-CD1 3.95Å; F322-L331 HydrophobicContact CZ-CD2 4.42Å; F327-L331 HydrophobicContact CD1-CD1 4.47Å; F327-L331 HydrophobicContact CD1-CD2 3.66Å; F327-L331 HydrophobicContact CD1-CG 3.92Å; F327-L331 HydrophobicContact CE1-CD1 4.45Å; F327-L331 HydrophobicContact CE1-CD2 3.1Å; F327-L331 HydrophobicContact CE1-CG 3.46Å; F327-L331 VanDerWaalsContact CE1-CG 3.46Å; F327-L331 HydrophobicContact CE2-CD2 4.29Å; F327-L331 HydrophobicContact CG-CD2 4.43Å; F327-L331 HydrophobicContact CZ-CD2 3.44Å; F327-L331 VanDerWaalsContact CZ-CD2 3.44Å; F327-L331 HydrophobicContact CZ-CG 4.25Å; L331-L333 HydrophobicContact CB-CD1 4.31Å; L331-L333 HydrophobicContact CB-CD2 4.28Å; L331-L333 HydrophobicContact CB-CG 3.97Å; L331-L333 HydrophobicContact CD1-CD1 4.25Å; L331-L333 HydrophobicContact CD1-CD2 4.47Å; L331-W350 HydrophobicContact CB-CZ3 4.37Å; L331-W350 HydrophobicContact CD1-CE3 4.5Å; L331-W350 HydrophobicContact CD1-CH2 4Å; L331-W350 HydrophobicContact CD1-CZ3 3.43Å; L331-W350 VanDerWaalsContact CD1-CZ3 3.43Å; L331-W350 HydrophobicContact CG-CH2 3.78Å; L331-W350 HydrophobicContact CG-CZ3 3.66Å; L331-V357 HydrophobicContact CB-CG2 3.78Å; L331-V357 HydrophobicContact CG-CG2 4.34Å
332	F	95.2	Very high	88.6	Confident	65 Å²	65	52.5 Å²	52.5	29%	0.285	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	108.4	170.1	-60.1	-94.5	0	0	0	108.7	A306 L307 H308 L309 N310 R330 F334	A306-F332 HydrophobicContact CB-CE2 4.31Å; L307-F332 PolarHBondContact O-N 3.11Å; H308-F332 AromaticContact CD2-CD2 3.94Å; H308-F332 AromaticContact CE1-CD2 3.22Å; H308-F332 WeakPolarHBondContact CE1-CD2 3.19Å; H308-F332 AromaticContact CE1-CE2 3.3Å; H308-F332 WeakPolarHBondContact CE1-CE2 3.2Å; H308-F332 AromaticContact CE1-CG 3.68Å; H308-F332 AromaticContact CE1-CZ 3.81Å; H308-F332 AromaticContact CG-CD2 3.79Å; H308-F332 AromaticContact ND1-CD2 3.35Å; H308-F332 VanDerWaalsContact ND1-CD2 3.35Å; H308-F332 WeakPolarHBondContact ND1-CD2 3.35Å; H308-F332 AromaticContact ND1-CE2 3.93Å; H308-F332 AromaticContact ND1-CG 3.51Å; H308-F332 AromaticContact NE2-CD2 3.61Å; H308-F332 AromaticContact NE2-CE2 3.52Å; L309-F332 CarbonylContact C-O 3.44Å; L309-F332 PolarHBondContact N-O 3.08Å; N310-F332 HydrophobicContact CB-CB 4.4Å; N310-F332 PolarHBondContact N-O 3.3Å; R330-F332 HydrophobicContact CB-CE2 3.96Å; R330-F332 HydrophobicContact CB-CZ 4.39Å; F332-F334 HydrophobicContact CB-CD1 4.39Å; F332-F334 HydrophobicContact CB-CE1 4.11Å; F332-F334 HydrophobicContact CD1-CE1 4.25Å
333	L	95.8	Very high	88.9	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.279	C	S	.	.			trans	-118.3	-6.6	-169.6	-66.3	-174.6	0	0	0	114.1	L309 L317 L331 N336 W338 L347 V357 V360	L309-L333 HydrophobicContact CB-CD2 4Å; L309-L333 HydrophobicContact CD1-CD2 4.22Å; L317-L333 HydrophobicContact CD2-CD1 4.34Å; L317-L333 HydrophobicContact CD2-CD2 4.03Å; L331-L333 HydrophobicContact CB-CD1 4.31Å; L331-L333 HydrophobicContact CB-CD2 4.28Å; L331-L333 HydrophobicContact CB-CG 3.97Å; L331-L333 HydrophobicContact CD1-CD1 4.25Å; L331-L333 HydrophobicContact CD1-CD2 4.47Å; L333-N336 PolarHBondContact O-ND2 3.06Å; L333-W338 HydrophobicContact CB-CZ2 3.68Å; L333-W338 HydrophobicContact CD1-CZ2 4.3Å; L333-W338 HydrophobicContact CD2-CH2 4.14Å; L333-W338 HydrophobicContact CD2-CZ2 3.98Å; L333-W338 HydrophobicContact CG-CZ2 4.18Å; L333-W338 WeakPolarHBondContact O-CZ2 3.15Å; L333-W338 PolarHBondContact O-NE1 3.23Å; L333-L347 HydrophobicContact CD1-CD1 3.87Å; L333-L347 HydrophobicContact CD1-CD2 3.67Å; L333-L347 HydrophobicContact CD1-CG 4.4Å; L333-V357 HydrophobicContact CD1-CG1 4Å; L333-V357 HydrophobicContact CG-CG1 4.45Å; L333-V360 HydrophobicContact CB-CG2 3.97Å; L333-V360 HydrophobicContact CD1-CG2 4.36Å
334	F	95.4	Very high	89.3	Confident	70 Å²	70	55.8 Å²	55.8	31%	0.307	27%	0.266	S	S	.	.			trans	-56.7	155.8	-177.3	66.2	-90.7	0	0	0	113.3	N310 S311 F332 D359	N310-F334 CarbonylContact C-O 3.05Å; N310-F334 WeakPolarHBondContact CA-O 3.41Å; N310-F334 HydrophobicContact CB-CD1 3.56Å; N310-F334 HydrophobicContact CB-CD2 3.87Å; N310-F334 HydrophobicContact CB-CE1 3.43Å; N310-F334 VanDerWaalsContact CB-CE1 3.43Å; N310-F334 HydrophobicContact CB-CE2 3.75Å; N310-F334 HydrophobicContact CB-CG 3.77Å; N310-F334 HydrophobicContact CB-CZ 3.53Å; N310-F334 WeakPolarHBondContact CB-O 3.44Å; N310-F334 VanDerWaalsContact CG-CE1 3.46Å; N310-F334 WeakPolarHBondContact ND2-CZ 3.23Å; S311-F334 PolarHBondContact N-O 2.83Å; F332-F334 HydrophobicContact CB-CD1 4.39Å; F332-F334 HydrophobicContact CB-CE1 4.11Å; F332-F334 HydrophobicContact CD1-CE1 4.25Å; F334-D359 WeakPolarHBondContact CA-O 3.49Å; F334-D359 HydrophobicContact CB-CB 4.16Å; F334-D359 VanDerWaalsContact CB-O 3.26Å; F334-D359 WeakPolarHBondContact CB-O 3.28Å
335	R	96.8	Very high	90.1	Very high	185 Å²	185	52.8 Å²	52.8	70%	0.698	24%	0.243	S	C	*	.	S	Bend	trans	56.6	56.4	-176.7	-67	172.9	176.1	-161.7	-3	112.7	S311 N312	S311-R335 WeakPolarHBondContact CA-O 3.37Å; S311-R335 PolarHBondContact N-O 2.64Å; S311-R335 VanDerWaalsContact N-O 3.1Å; S311-R335 WeakPolarHBondContact OG-CD 3.14Å; N312-R335 PolarHBondContact N-O 3.46Å
336	N	98.4	Very high	91	Very high	10 Å²	10	53.9 Å²	53.9	5%	0.053	24%	0.241	C	C	.	.	S	Bend	trans	-133.7	148.7	166.9	-84	-76.2	0	0	0	107.9	L309 N312 R313 L314 L333 W338	L309-N336 PolarHBondContact O-ND2 3.11Å; N312-N336 VanDerWaalsContact CA-OD1 3.23Å; N312-N336 WeakPolarHBondContact CA-OD1 3.38Å; N312-N336 WeakPolarHBondContact CB-OD1 3.45Å; N312-N336 PolarHBondContact N-OD1 3.05Å; N312-N336 PolarHBondContact O-OD1 3.19Å; R313-N336 PolarHBondContact N-OD1 3.01Å; L314-N336 HydrophobicContact CB-CB 4.34Å; L314-N336 WeakPolarHBondContact CB-OD1 3.11Å; L314-N336 PolarHBondContact N-OD1 2.95Å; L333-N336 PolarHBondContact O-ND2 3.06Å; N336-W338 HydrophobicContact CB-CD2 4.03Å; N336-W338 VanDerWaalsContact CB-CE2 3.41Å; N336-W338 HydrophobicContact CB-CG 4.35Å; N336-W338 HydrophobicContact CB-CH2 4.41Å; N336-W338 HydrophobicContact CB-CZ2 3.62Å; N336-W338 PolarHBondContact O-N 3.02Å
337	P	97.9	Very high	92.2	Very high	54 Å²	54	46.9 Å²	46.9	35%	0.351	21%	0.21	S	C	.	.			trans	-79.1	63.8	179.6	34.1	-37.2	0	0	0	111.8	L314 T315 C339 A363	L314-P337 CarbonylContact O-C 3.06Å; L314-P337 VanDerWaalsContact O-CD 3.26Å; L314-P337 WeakPolarHBondContact O-CD 3.33Å; T315-P337 WeakPolarHBondContact CA-O 3.35Å; T315-P337 HydrophobicContact CG2-CG 4.23Å; P337-C339 PolarHBondContact O-N 3.09Å; P337-A363 HydrophobicContact CB-CB 4.1Å
338	W	97.9	Very high	93.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	128.7	-173.8	-62.6	112.2	0	0	0	112.9	L314 L317 L333 N336 L344 V360 A363 S364	L314-W338 HydrophobicContact CB-CE3 4.46Å; L314-W338 HydrophobicContact CB-CH2 3.64Å; L314-W338 HydrophobicContact CB-CZ2 4.34Å; L314-W338 HydrophobicContact CB-CZ3 3.71Å; L314-W338 HydrophobicContact CD1-CH2 3.85Å; L314-W338 HydrophobicContact CG-CH2 4.39Å; L317-W338 HydrophobicContact CB-CH2 4.06Å; L317-W338 HydrophobicContact CB-CZ3 3.88Å; L333-W338 HydrophobicContact CB-CZ2 3.68Å; L333-W338 HydrophobicContact CD1-CZ2 4.3Å; L333-W338 HydrophobicContact CD2-CH2 4.14Å; L333-W338 HydrophobicContact CD2-CZ2 3.98Å; L333-W338 HydrophobicContact CG-CZ2 4.18Å; L333-W338 WeakPolarHBondContact O-CZ2 3.15Å; L333-W338 PolarHBondContact O-NE1 3.23Å; N336-W338 HydrophobicContact CB-CD2 4.03Å; N336-W338 VanDerWaalsContact CB-CE2 3.41Å; N336-W338 HydrophobicContact CB-CG 4.35Å; N336-W338 HydrophobicContact CB-CH2 4.41Å; N336-W338 HydrophobicContact CB-CZ2 3.62Å; N336-W338 PolarHBondContact O-N 3.02Å; W338-L344 HydrophobicContact CB-CD1 4.16Å; W338-L344 HydrophobicContact CE3-CD1 4.08Å; W338-L344 HydrophobicContact CE3-CD2 4.47Å; W338-V360 VanDerWaalsContact CD1-CG1 3.41Å; W338-V360 HydrophobicContact CD2-CG1 4.11Å; W338-V360 HydrophobicContact CG-CG1 3.78Å; W338-A363 PolarHBondContact O-N 2.98Å; W338-S364 PolarHBondContact O-N 3.03Å
339	C	97.7	Very high	94.4	Very high	23 Å²	23	45 Å²	45	16%	0.155	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	98.4	169.3	-172.9	0	0	0	0	107.8	T315 P337 D341 L344 S364	T315-C339 PolarHBondContact O-N 3.28Å; P337-C339 PolarHBondContact O-N 3.09Å; C339-D341 PolarHBondContact O-N 2.95Å; C339-L344 WeakPolarHBondContact O-CD1 3.49Å; C339-S364 CarbonylContact C-O 3.35Å; C339-S364 WeakPolarHBondContact CA-O 3.48Å; C339-S364 WeakPolarHBondContact CA-OG 3.21Å; C339-S364 PolarHBondContact SG-OG 3.06Å; C339-S364 VanDerWaalsContact SG-OG 3.41Å
340	C	97.3	Very high	94.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	21%	0.206	C	C	.	.			trans	-82.1	63.5	-174.6	-66.6	0	0	0	0	111.9	C362 S364 V368 L373 V376 F378 P389	C340-C362 HydrophobicContact CB-CB 3.71Å; C340-C362 WeakPolarHBondContact CB-SG 3.49Å; C340-C362 WeakPolarHBondContact SG-CA 3.03Å; C340-C362 WeakPolarHBondContact SG-CB 3.35Å; C340-C362 CovalentContact SG-SG 2.02Å; C340-C362 PolarHBondContact SG-SG 3.01Å; C340-S364 PolarHBondContact N-O 2.8Å; C340-V368 HydrophobicContact CB-CG2 3.98Å; C340-L373 HydrophobicContact CB-CD1 4.12Å; C340-V376 HydrophobicContact CB-CG2 4.46Å; C340-F378 WeakPolarHBondContact O-CE1 3.3Å; C340-P389 WeakPolarHBondContact O-CG 3.38Å
341	D	96.2	Very high	94.6	Very high	19 Å²	19	40.1 Å²	40.1	10%	0.102	18%	0.18	C	C	.	.	S	Bend	trans	-100.8	-176	171.3	69.3	24.2	0	0	0	110.9	C339 R343 L344 F378 D388	C339-D341 PolarHBondContact O-N 2.95Å; D341-R343 PolarHBondContact O-N 2.93Å; D341-R343 WeakPolarHBondContact OD1-CA 3.34Å; D341-R343 WeakPolarHBondContact OD1-CB 3.47Å; D341-R343 VanDerWaalsContact OD1-CG 3.31Å; D341-R343 WeakPolarHBondContact OD1-CG 3.5Å; D341-R343 IonicContact OD1-CZ 3.95Å; D341-R343 PolarHBondContact OD1-N 3.3Å; D341-R343 IonicContact OD1-NE 3.06Å; D341-R343 PolarHBondContact OD1-NE 3.17Å; D341-R343 IonicContact OD1-NH2 3.95Å; D341-R343 IonicContact OD2-CZ 3.16Å; D341-R343 IonicContact OD2-NE 2.87Å; D341-R343 PolarHBondContact OD2-NE 2.59Å; D341-R343 IonicContact OD2-NH2 2.68Å; D341-R343 PolarHBondContact OD2-NH2 2.9Å; D341-L344 PolarHBondContact O-N 2.98Å; D341-F378 WeakPolarHBondContact O-CE1 3.44Å; D341-F378 WeakPolarHBondContact O-CZ 3.48Å; D341-D388 HydrophobicContact CB-CB 4.4Å; D341-D388 WeakPolarHBondContact CB-OD1 3.37Å
342	C	96.1	Very high	94.2	Very high	28 Å²	28	45.3 Å²	45.3	19%	0.189	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-58.7	-17.6	-178.3	-72.3	0	0	0	0	114.4	L344 E345 C386 V387 D388	C342-L344 PolarHBondContact O-N 2.61Å; C342-E345 VanDerWaalsContact O-CB 3.22Å; C342-E345 WeakPolarHBondContact O-CB 3.39Å; C342-E345 PolarHBondContact O-N 3.07Å; C342-C386 WeakPolarHBondContact CA-SG 2.98Å; C342-C386 HydrophobicContact CB-CB 3.71Å; C342-C386 WeakPolarHBondContact CB-SG 3.4Å; C342-C386 WeakPolarHBondContact SG-CB 3.04Å; C342-C386 CovalentContact SG-SG 2.02Å; C342-C386 PolarHBondContact SG-SG 2.03Å; C342-V387 PolarHBondContact SG-N 2.65Å; C342-V387 VanDerWaalsContact SG-N 3.35Å; C342-D388 WeakPolarHBondContact CB-OD1 3.48Å; C342-D388 PolarHBondContact N-OD1 3.46Å; C342-D388 PolarHBondContact SG-OD1 2.84Å
343	R	96.1	Very high	93.6	Very high	131 Å²	131	45.8 Å²	45.8	49%	0.494	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-70.6	-20.5	175.7	-55.6	175.4	-69.2	173.3	-4.3	112.5	V316 D341 W346	V316-R343 HydrophobicContact CG2-CB 3.71Å; D341-R343 PolarHBondContact O-N 2.93Å; D341-R343 WeakPolarHBondContact OD1-CA 3.34Å; D341-R343 WeakPolarHBondContact OD1-CB 3.47Å; D341-R343 VanDerWaalsContact OD1-CG 3.31Å; D341-R343 WeakPolarHBondContact OD1-CG 3.5Å; D341-R343 IonicContact OD1-CZ 3.95Å; D341-R343 PolarHBondContact OD1-N 3.3Å; D341-R343 IonicContact OD1-NE 3.06Å; D341-R343 PolarHBondContact OD1-NE 3.17Å; D341-R343 IonicContact OD1-NH2 3.95Å; D341-R343 IonicContact OD2-CZ 3.16Å; D341-R343 IonicContact OD2-NE 2.87Å; D341-R343 PolarHBondContact OD2-NE 2.59Å; D341-R343 IonicContact OD2-NH2 2.68Å; D341-R343 PolarHBondContact OD2-NH2 2.9Å; R343-W346 VanDerWaalsContact O-CD1 3.23Å; R343-W346 PolarHBondContact O-NE1 3.15Å
344	L	95.6	Very high	92.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-96.1	4.7	173.9	-69.4	-172.7	0	0	0	113.3	V316 W338 C339 D341 C342 W346 L347 R348 L373	V316-L344 HydrophobicContact CG2-CD2 3.91Å; V316-L344 HydrophobicContact CG2-CG 4.32Å; W338-L344 HydrophobicContact CB-CD1 4.16Å; W338-L344 HydrophobicContact CE3-CD1 4.08Å; W338-L344 HydrophobicContact CE3-CD2 4.47Å; C339-L344 WeakPolarHBondContact O-CD1 3.49Å; D341-L344 PolarHBondContact O-N 2.98Å; C342-L344 PolarHBondContact O-N 2.61Å; L344-W346 VanDerWaalsContact C-N 3.31Å; L344-W346 PolarHBondContact O-N 3.36Å; L344-L347 HydrophobicContact CD2-CD2 4.11Å; L344-L347 WeakPolarHBondContact O-CB 3.35Å; L344-L347 PolarHBondContact O-N 3.35Å; L344-R348 PolarHBondContact O-N 3.22Å; L344-L373 HydrophobicContact CB-CD1 4.24Å; L344-L373 HydrophobicContact CB-CD2 4.17Å; L344-L373 HydrophobicContact CD1-CD2 4.41Å
345	E	93.6	Very high	91.4	Very high	36 Å²	36	47.1 Å²	47.1	17%	0.168	26%	0.255	C	S	.	.	H	α-helix	trans	-53.8	-47.4	178	179.2	171.1	-132	0	0	112	C342 L347 R348 D349 F378 R380	C342-E345 VanDerWaalsContact O-CB 3.22Å; C342-E345 WeakPolarHBondContact O-CB 3.39Å; C342-E345 PolarHBondContact O-N 3.07Å; E345-L347 PolarHBondContact O-N 3.17Å; E345-R348 WeakPolarHBondContact O-CB 3.45Å; E345-R348 PolarHBondContact O-N 2.81Å; E345-R348 VanDerWaalsContact O-N 3.17Å; E345-D349 VanDerWaalsContact O-CG 3.32Å; E345-D349 PolarHBondContact O-N 2.97Å; E345-F378 HydrophobicContact CB-CD2 4.09Å; E345-F378 HydrophobicContact CB-CE2 4.16Å; E345-F378 HydrophobicContact CG-CD2 4.13Å; E345-R380 IonicContact OE1-CZ 3.42Å; E345-R380 IonicContact OE1-NH1 3.64Å; E345-R380 PolarHBondContact OE1-NH1 2.91Å; E345-R380 IonicContact OE1-NH2 2.71Å; E345-R380 PolarHBondContact OE1-NH2 3.39Å; E345-R380 IonicContact OE2-NH1 3.07Å
346	W	91.8	Very high	90.4	Very high	46 Å²	46	44.4 Å²	44.4	17%	0.174	25%	0.245	C	C	.	.	H	α-helix	trans	-57	-38.1	177.9	77.8	-91	0	0	0	112.7	L317 W319 F322 R343 L344 W350	L317-W346 HydrophobicContact CB-CZ2 4.35Å; L317-W346 HydrophobicContact CD2-CH2 4.35Å; L317-W346 HydrophobicContact CD2-CZ2 4.28Å; L317-W346 HydrophobicContact CG-CZ2 4.07Å; L317-W346 VanDerWaalsContact O-CE2 3.29Å; L317-W346 WeakPolarHBondContact O-CZ2 3.17Å; L317-W346 PolarHBondContact O-NE1 2.92Å; W319-W346 HydrophobicContact CB-CD2 4.03Å; W319-W346 HydrophobicContact CB-CG 3.97Å; W319-W346 HydrophobicContact CD2-CE3 4.46Å; W319-W346 AromaticContact CE3-CD2 3.96Å; W319-W346 HydrophobicContact CE3-CD2 3.96Å; W319-W346 AromaticContact CE3-CE3 3.45Å; W319-W346 HydrophobicContact CE3-CE3 3.45Å; W319-W346 VanDerWaalsContact CE3-CE3 3.45Å; W319-W346 HydrophobicContact CE3-CH2 4.41Å; W319-W346 AromaticContact CE3-CZ3 3.71Å; W319-W346 HydrophobicContact CE3-CZ3 3.71Å; W319-W346 AromaticContact CZ3-CE3 3.99Å; W319-W346 HydrophobicContact CZ3-CE3 3.99Å; W319-W346 HydrophobicContact CZ3-CZ3 4.03Å; F322-W346 HydrophobicContact CD2-CH2 4.4Å; F322-W346 AromaticContact CE2-CH2 3.91Å; F322-W346 HydrophobicContact CE2-CH2 3.91Å; F322-W346 HydrophobicContact CE2-CZ2 4.39Å; R343-W346 VanDerWaalsContact O-CD1 3.23Å; R343-W346 PolarHBondContact O-NE1 3.15Å; L344-W346 VanDerWaalsContact C-N 3.31Å; L344-W346 PolarHBondContact O-N 3.36Å; W346-W350 HydrophobicContact CE3-CB 4.48Å; W346-W350 HydrophobicContact CZ3-CD2 4.44Å; W346-W350 AromaticContact CZ3-CE3 3.84Å; W346-W350 HydrophobicContact CZ3-CE3 3.84Å; W346-W350 HydrophobicContact CZ3-CZ3 4.49Å; W346-W350 VanDerWaalsContact O-CB 3.23Å; W346-W350 WeakPolarHBondContact O-CB 3.32Å; W346-W350 PolarHBondContact O-N 3.13Å
347	L	92.6	Very high	89.5	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-73.5	-40.4	-176.8	177.2	59.7	0	0	0	109.6	L333 L344 E345 W350 M351 V357 V360 L373	L333-L347 HydrophobicContact CD1-CD1 3.87Å; L333-L347 HydrophobicContact CD1-CD2 3.67Å; L333-L347 HydrophobicContact CD1-CG 4.4Å; L344-L347 HydrophobicContact CD2-CD2 4.11Å; L344-L347 WeakPolarHBondContact O-CB 3.35Å; L344-L347 PolarHBondContact O-N 3.35Å; E345-L347 PolarHBondContact O-N 3.17Å; L347-W350 HydrophobicContact CD1-CE3 3.91Å; L347-W350 HydrophobicContact CD1-CZ3 4.4Å; L347-W350 PolarHBondContact O-N 3.18Å; L347-M351 HydrophobicContact CD1-CG 4.5Å; L347-M351 HydrophobicContact CG-SD 4.28Å; L347-M351 VanDerWaalsContact O-CG 3.23Å; L347-M351 WeakPolarHBondContact O-CG 3.33Å; L347-M351 PolarHBondContact O-N 3.09Å; L347-V357 HydrophobicContact CD1-CG1 4.49Å; L347-V360 HydrophobicContact CD2-CG1 4.43Å; L347-L373 HydrophobicContact CB-CD2 4.07Å; L347-L373 HydrophobicContact CD2-CD2 3.8Å; L347-L373 HydrophobicContact CG-CD2 3.79Å
348	R	92.9	Very high	88.6	Confident	31 Å²	31	45.7 Å²	45.7	12%	0.117	25%	0.252	C	S	.	.	H	α-helix	trans	-59.1	-51.5	174	-170.6	-90.4	-83.7	-133.5	-6.4	111	L344 E345 W350 M351 E352 L373 V376 F378	L344-R348 PolarHBondContact O-N 3.22Å; E345-R348 WeakPolarHBondContact O-CB 3.45Å; E345-R348 PolarHBondContact O-N 2.81Å; E345-R348 VanDerWaalsContact O-N 3.17Å; R348-W350 PolarHBondContact O-N 3.1Å; R348-M351 WeakPolarHBondContact O-CB 3.43Å; R348-M351 PolarHBondContact O-N 3.48Å; R348-M351 VanDerWaalsContact O-N 3.15Å; R348-E352 WeakPolarHBondContact CD-OE1 3.49Å; R348-E352 IonicContact CZ-OE1 3.56Å; R348-E352 IonicContact NE-OE1 2.66Å; R348-E352 IonicContact NH1-OE1 3.01Å; R348-E352 PolarHBondContact NH1-OE1 3.07Å; R348-E352 PolarHBondContact O-N 3.16Å; R348-E352 VanDerWaalsContact O-N 3.09Å; R348-L373 HydrophobicContact CB-CD1 4Å; R348-L373 HydrophobicContact CB-CD2 4.22Å; R348-L373 HydrophobicContact CB-CG 3.81Å; R348-L373 HydrophobicContact CG-CD1 4.26Å; R348-L373 HydrophobicContact CG-CG 4.1Å; R348-L373 WeakPolarHBondContact CG-O 3.39Å; R348-V376 PolarHBondContact NE-O 3.35Å; R348-V376 PolarHBondContact NH1-O 2.84Å; R348-V376 PolarHBondContact NH2-O 3.48Å; R348-F378 HydrophobicContact CB-CE2 3.9Å; R348-F378 HydrophobicContact CG-CE2 4.11Å
349	D	89.7	Confident	88.2	Confident	74 Å²	74	50.5 Å²	50.5	40%	0.396	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-38.2	179.1	-65.6	-8.9	0	0	0	111	E345 E352 G353	E345-D349 VanDerWaalsContact O-CG 3.32Å; E345-D349 PolarHBondContact O-N 2.97Å; D349-E352 PolarHBondContact O-N 3.03Å; D349-G353 PolarHBondContact O-N 3.29Å
350	W	87.6	Confident	88	Confident	54 Å²	54	49.4 Å²	49.4	21%	0.205	27%	0.271	C	S	.	.	H	α-helix	trans	-70.3	-35	177.1	-172.5	49.3	0	0	0	113.4	F327 L331 W346 L347 R348 S354 V357	F327-W350 AromaticContact CD1-CH2 3.61Å; F327-W350 HydrophobicContact CD1-CH2 3.61Å; F327-W350 HydrophobicContact CD1-CZ2 4.14Å; F327-W350 AromaticContact CE1-CH2 3.85Å; F327-W350 HydrophobicContact CE1-CH2 3.85Å; L331-W350 HydrophobicContact CB-CZ3 4.37Å; L331-W350 HydrophobicContact CD1-CE3 4.5Å; L331-W350 HydrophobicContact CD1-CH2 4Å; L331-W350 HydrophobicContact CD1-CZ3 3.43Å; L331-W350 VanDerWaalsContact CD1-CZ3 3.43Å; L331-W350 HydrophobicContact CG-CH2 3.78Å; L331-W350 HydrophobicContact CG-CZ3 3.66Å; W346-W350 HydrophobicContact CE3-CB 4.48Å; W346-W350 HydrophobicContact CZ3-CD2 4.44Å; W346-W350 AromaticContact CZ3-CE3 3.84Å; W346-W350 HydrophobicContact CZ3-CE3 3.84Å; W346-W350 HydrophobicContact CZ3-CZ3 4.49Å; W346-W350 VanDerWaalsContact O-CB 3.23Å; W346-W350 WeakPolarHBondContact O-CB 3.32Å; W346-W350 PolarHBondContact O-N 3.13Å; L347-W350 HydrophobicContact CD1-CE3 3.91Å; L347-W350 HydrophobicContact CD1-CZ3 4.4Å; L347-W350 PolarHBondContact O-N 3.18Å; R348-W350 PolarHBondContact O-N 3.1Å; W350-S354 VanDerWaalsContact O-CB 3.25Å; W350-S354 WeakPolarHBondContact O-CB 3.36Å; W350-S354 PolarHBondContact O-N 3.24Å; W350-S354 PolarHBondContact O-OG 2.81Å; W350-V357 HydrophobicContact CE3-CG2 3.86Å; W350-V357 HydrophobicContact CH2-CG2 3.84Å; W350-V357 HydrophobicContact CZ3-CG2 3.36Å
351	M	89.9	Confident	88	Confident	12 Å²	12	52.1 Å²	52.1	6%	0.059	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-47	172.4	-75.6	169.4	73.6	0	0	110.9	L347 R348 G355 V357 V360 D372 L373	L347-M351 HydrophobicContact CD1-CG 4.5Å; L347-M351 HydrophobicContact CG-SD 4.28Å; L347-M351 VanDerWaalsContact O-CG 3.23Å; L347-M351 WeakPolarHBondContact O-CG 3.33Å; L347-M351 PolarHBondContact O-N 3.09Å; R348-M351 WeakPolarHBondContact O-CB 3.43Å; R348-M351 PolarHBondContact O-N 3.48Å; R348-M351 VanDerWaalsContact O-N 3.15Å; M351-G355 PolarHBondContact O-N 3.32Å; M351-V357 HydrophobicContact CG-CB 3.76Å; M351-V357 HydrophobicContact CG-CG1 3.81Å; M351-V357 HydrophobicContact SD-CG1 4.2Å; M351-V360 HydrophobicContact CE-CB 3.93Å; M351-V360 HydrophobicContact CE-CG2 3.74Å; M351-V360 HydrophobicContact SD-CB 4.11Å; M351-V360 HydrophobicContact SD-CG2 3.83Å; M351-D372 WeakPolarHBondContact CE-OD1 3.28Å; M351-L373 HydrophobicContact CE-CB 4.43Å; M351-L373 HydrophobicContact SD-CB 4.09Å; M351-L373 HydrophobicContact SD-CD2 3.88Å; M351-L373 HydrophobicContact SD-CG 4.18Å
352	E	84.5	Confident	88	Confident	114 Å²	114	51.5 Å²	51.5	53%	0.533	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-43.2	178.1	-70.7	-179.3	-171.2	0	0	112.1	R348 D349	R348-E352 WeakPolarHBondContact CD-OE1 3.49Å; R348-E352 IonicContact CZ-OE1 3.56Å; R348-E352 IonicContact NE-OE1 2.66Å; R348-E352 IonicContact NH1-OE1 3.01Å; R348-E352 PolarHBondContact NH1-OE1 3.07Å; R348-E352 PolarHBondContact O-N 3.16Å; R348-E352 VanDerWaalsContact O-N 3.09Å; D349-E352 PolarHBondContact O-N 3.03Å
353	G	81.1	Confident	88.1	Confident	74 Å²	74	52.7 Å²	52.7	76%	0.763	30%	0.297	S	S	*	.	H	α-helix	trans	-80.3	-29.1	-175.6	0	0	0	0	0	115.6	D349	D349-G353 PolarHBondContact O-N 3.29Å
354	S	76.8	Confident	88.1	Confident	37 Å²	37	48.1 Å²	48.1	26%	0.259	29%	0.285	S	S	.	.	H	α-helix	trans	-106.3	-29.5	-169.5	73.2	0	0	0	0	115.2	W350 R356	W350-S354 VanDerWaalsContact O-CB 3.25Å; W350-S354 WeakPolarHBondContact O-CB 3.36Å; W350-S354 PolarHBondContact O-N 3.24Å; W350-S354 PolarHBondContact O-OG 2.81Å; S354-R356 PolarHBondContact O-N 2.8Å; S354-R356 VanDerWaalsContact O-N 3.14Å; S354-R356 PolarHBondContact OG-N 3.19Å
355	G	68.4	Low	88.1	Confident	62 Å²	62	48.4 Å²	48.4	64%	0.639	29%	0.287	S	S	*	.			trans	59.8	14.6	-169.2	0	0	0	0	0	114.7	M351	M351-G355 PolarHBondContact O-N 3.32Å
356	R	75.8	Confident	88	Confident	127 Å²	127	47.7 Å²	47.7	48%	0.479	29%	0.29	S	S	.	.			trans	-94.3	-4.4	-175.8	-68.2	-179.8	-177.9	-176.2	2.9	114	L328 S354	L328-R356 PolarHBondContact O-NH1 2.91Å; S354-R356 PolarHBondContact O-N 2.8Å; S354-R356 VanDerWaalsContact O-N 3.14Å; S354-R356 PolarHBondContact OG-N 3.19Å
357	V	79.9	Confident	88.2	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.03	30%	0.298	C	S	.	.			trans	-134.7	128.3	-179.8	-178.6	0	0	0	0	107.9	L331 L333 L347 W350 M351 V360	L331-V357 HydrophobicContact CB-CG2 3.78Å; L331-V357 HydrophobicContact CG-CG2 4.34Å; L333-V357 HydrophobicContact CD1-CG1 4Å; L333-V357 HydrophobicContact CG-CG1 4.45Å; L347-V357 HydrophobicContact CD1-CG1 4.49Å; W350-V357 HydrophobicContact CE3-CG2 3.86Å; W350-V357 HydrophobicContact CH2-CG2 3.84Å; W350-V357 HydrophobicContact CZ3-CG2 3.36Å; M351-V357 HydrophobicContact CG-CB 3.76Å; M351-V357 HydrophobicContact CG-CG1 3.81Å; M351-V357 HydrophobicContact SD-CG1 4.2Å; V357-V360 HydrophobicContact CG1-CG2 3.85Å
358	T	79.9	Confident	88.3	Confident	87 Å²	87	48.6 Å²	48.6	53%	0.534	30%	0.302	S	S	.	.			trans	-136.1	163.5	176.1	62.7	0	0	0	0	109.7
359	D	88.1	Confident	88.4	Confident	101 Å²	101	49.5 Å²	49.5	54%	0.54	32%	0.316	S	S	.	.			trans	64.1	60	169.9	-48.4	-58.6	0	0	0	113.3	F334 P361 D372	F334-D359 WeakPolarHBondContact CA-O 3.49Å; F334-D359 HydrophobicContact CB-CB 4.16Å; F334-D359 VanDerWaalsContact CB-O 3.26Å; F334-D359 WeakPolarHBondContact CB-O 3.28Å; D359-P361 WeakPolarHBondContact O-CD 3.02Å; D359-D372 WeakPolarHBondContact CA-OD2 3.26Å
360	V	95	Very high	88.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	33%	0.329	C	S	.	.			trans	-114.1	72.1	176.7	-172.8	0	0	0	0	108.5	L333 W338 L347 M351 V357 D372 L373	L333-V360 HydrophobicContact CB-CG2 3.97Å; L333-V360 HydrophobicContact CD1-CG2 4.36Å; W338-V360 VanDerWaalsContact CD1-CG1 3.41Å; W338-V360 HydrophobicContact CD2-CG1 4.11Å; W338-V360 HydrophobicContact CG-CG1 3.78Å; L347-V360 HydrophobicContact CD2-CG1 4.43Å; M351-V360 HydrophobicContact CE-CB 3.93Å; M351-V360 HydrophobicContact CE-CG2 3.74Å; M351-V360 HydrophobicContact SD-CB 4.11Å; M351-V360 HydrophobicContact SD-CG2 3.83Å; V357-V360 HydrophobicContact CG1-CG2 3.85Å; V360-D372 PolarHBondContact N-OD2 3.07Å; V360-L373 HydrophobicContact CB-CB 4.02Å; V360-L373 HydrophobicContact CG1-CB 3.96Å; V360-L373 HydrophobicContact CG1-CD2 4Å; V360-L373 WeakPolarHBondContact O-CB 3.09Å; V360-L373 PolarHBondContact O-N 2.93Å
361	P	95.8	Very high	88.9	Confident	57 Å²	57	50.1 Å²	50.1	37%	0.37	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-70.6	134.5	179.4	29.6	-34.9	0	0	0	111.1	D359 L371	D359-P361 WeakPolarHBondContact O-CD 3.02Å; P361-L371 CarbonylContact C-O 3.59Å; P361-L371 WeakPolarHBondContact CA-O 3.44Å
362	C	97.4	Very high	89.2	Confident	5 Å²	5	51 Å²	51	3%	0.034	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	132.5	176.3	-58.7	0	0	0	0	110.6	C340 V368 G370 L371	C340-C362 HydrophobicContact CB-CB 3.71Å; C340-C362 WeakPolarHBondContact CB-SG 3.49Å; C340-C362 WeakPolarHBondContact SG-CA 3.03Å; C340-C362 WeakPolarHBondContact SG-CB 3.35Å; C340-C362 CovalentContact SG-SG 2.02Å; C340-C362 PolarHBondContact SG-SG 3.01Å; C362-V368 HydrophobicContact CB-CG2 4.24Å; C362-V368 WeakPolarHBondContact CB-O 3.28Å; C362-G370 PolarHBondContact O-N 2.82Å; C362-L371 WeakPolarHBondContact CB-O 3.41Å; C362-L371 PolarHBondContact N-O 2.93Å; C362-L371 PolarHBondContact SG-O 3.11Å; C362-L371 VanDerWaalsContact SG-O 3.38Å
363	A	97.5	Very high	89.7	Confident	54 Å²	54	45.6 Å²	45.6	45%	0.446	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-29.8	170.3	0	0	0	0	0	111.8	P337 W338	P337-A363 HydrophobicContact CB-CB 4.1Å; W338-A363 PolarHBondContact O-N 2.98Å
364	S	96.1	Very high	90.3	Very high	34 Å²	34	44.3 Å²	44.3	24%	0.238	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	166.1	178.3	66.4	0	0	0	0	109.6	W338 C339 C340	W338-S364 PolarHBondContact O-N 3.03Å; C339-S364 CarbonylContact C-O 3.35Å; C339-S364 WeakPolarHBondContact CA-O 3.48Å; C339-S364 WeakPolarHBondContact CA-OG 3.21Å; C339-S364 PolarHBondContact SG-OG 3.06Å; C339-S364 VanDerWaalsContact SG-OG 3.41Å; C340-S364 PolarHBondContact N-O 2.8Å
365	P	95.4	Very high	91	Very high	6 Å²	6	51.5 Å²	51.5	4%	0.039	32%	0.319	C	S	.	.	S	Bend	cis	-68	164.5	-10.6	30.9	-37.1	0	0	0	112.5	S367 V368 A369 P389 E391	P365-S367 PolarHBondContact O-N 2.02Å; P365-V368 HydrophobicContact CG-CG2 3.99Å; P365-V368 WeakPolarHBondContact O-CG2 3.08Å; P365-V368 PolarHBondContact O-N 2.88Å; P365-A369 PolarHBondContact O-N 2.9Å; P365-A369 VanDerWaalsContact O-N 3.11Å; P365-P389 HydrophobicContact CG-CB 3.79Å; P365-P389 HydrophobicContact CG-CG 4.33Å; P365-P389 WeakPolarHBondContact CG-O 3.46Å; P365-E391 VanDerWaalsContact CA-OE2 3.26Å; P365-E391 WeakPolarHBondContact CA-OE2 3.48Å; P365-E391 HydrophobicContact CB-CB 4.44Å; P365-E391 WeakPolarHBondContact CB-OE2 3.42Å
366	G	92.9	Very high	92.2	Very high	22 Å²	22	48.6 Å²	48.6	23%	0.227	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-27.8	-173.4	0	0	0	0	0	115.8	V368 E391	G366-V368 VanDerWaalsContact C-N 3.26Å; G366-V368 PolarHBondContact O-N 3.46Å; G366-E391 PolarHBondContact N-OE1 2.88Å
367	S	94.6	Very high	92.9	Very high	49 Å²	49	48.2 Å²	48.2	34%	0.343	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.9	176.7	56.4	0	0	0	0	114.4	P365 P389 E390	P365-S367 PolarHBondContact O-N 2.02Å; S367-P389 WeakPolarHBondContact OG-CB 3.45Å; S367-E390 WeakPolarHBondContact CB-O 3.21Å; S367-E390 PolarHBondContact N-O 3.47Å; S367-E390 PolarHBondContact OG-N 3.3Å; S367-E390 PolarHBondContact OG-O 3.04Å
368	V	95.3	Very high	93.6	Very high	15 Å²	15	48.6 Å²	48.6	9%	0.091	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.3	2.2	-177	-61	0	0	0	0	112.9	C340 C362 P365 G366 G370 L371 V376 P389	C340-V368 HydrophobicContact CB-CG2 3.98Å; C362-V368 HydrophobicContact CB-CG2 4.24Å; C362-V368 WeakPolarHBondContact CB-O 3.28Å; P365-V368 HydrophobicContact CG-CG2 3.99Å; P365-V368 WeakPolarHBondContact O-CG2 3.08Å; P365-V368 PolarHBondContact O-N 2.88Å; G366-V368 VanDerWaalsContact C-N 3.26Å; G366-V368 PolarHBondContact O-N 3.46Å; V368-G370 PolarHBondContact O-N 3.4Å; V368-L371 HydrophobicContact CB-CD1 4.32Å; V368-L371 HydrophobicContact CG1-CD1 4.5Å; V368-L371 WeakPolarHBondContact O-CB 3.27Å; V368-L371 PolarHBondContact O-N 3.05Å; V368-V376 HydrophobicContact CB-CG2 4.12Å; V368-V376 HydrophobicContact CG1-CG1 4.1Å; V368-V376 HydrophobicContact CG1-CG2 4.34Å; V368-P389 HydrophobicContact CG1-CB 3.89Å; V368-P389 HydrophobicContact CG1-CG 4.18Å; V368-P389 HydrophobicContact CG2-CB 4.41Å; V368-P389 HydrophobicContact CG2-CG 4.49Å
369	A	95.3	Very high	94.1	Very high	51 Å²	51	46.2 Å²	46.2	42%	0.421	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	131.1	179.1	0	0	0	0	0	111.5	P365 L371	P365-A369 PolarHBondContact O-N 2.9Å; P365-A369 VanDerWaalsContact O-N 3.11Å; A369-L371 VanDerWaalsContact C-N 3.31Å; A369-L371 PolarHBondContact O-N 3.14Å
370	G	93.4	Very high	94.4	Very high	65 Å²	65	48 Å²	48	67%	0.67	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-13.9	-176.3	0	0	0	0	0	115.2	C362 V368	C362-G370 PolarHBondContact O-N 2.82Å; V368-G370 PolarHBondContact O-N 3.4Å
371	L	94.6	Very high	94.2	Very high	75 Å²	75	49.9 Å²	49.9	39%	0.393	31%	0.307	S	S	.	.	S	Bend	trans	-76.7	146.8	172.4	-61.1	178.6	0	0	0	110.6	P361 C362 V368 A369 V376	P361-L371 CarbonylContact C-O 3.59Å; P361-L371 WeakPolarHBondContact CA-O 3.44Å; C362-L371 WeakPolarHBondContact CB-O 3.41Å; C362-L371 PolarHBondContact N-O 2.93Å; C362-L371 PolarHBondContact SG-O 3.11Å; C362-L371 VanDerWaalsContact SG-O 3.38Å; V368-L371 HydrophobicContact CB-CD1 4.32Å; V368-L371 HydrophobicContact CG1-CD1 4.5Å; V368-L371 WeakPolarHBondContact O-CB 3.27Å; V368-L371 PolarHBondContact O-N 3.05Å; A369-L371 VanDerWaalsContact C-N 3.31Å; A369-L371 PolarHBondContact O-N 3.14Å; L371-V376 HydrophobicContact CB-CG2 4.44Å
372	D	94.9	Very high	94	Very high	31 Å²	31	52.9 Å²	52.9	17%	0.166	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-72.6	138.8	167.1	-172.6	-92	0	0	0	109.8	M351 D359 V360 S374 R375	M351-D372 WeakPolarHBondContact CE-OD1 3.28Å; D359-D372 WeakPolarHBondContact CA-OD2 3.26Å; V360-D372 PolarHBondContact N-OD2 3.07Å; D372-S374 PolarHBondContact O-N 3.16Å; D372-S374 VanDerWaalsContact O-N 3.1Å; D372-S374 VanDerWaalsContact OD1-CB 3.3Å; D372-S374 WeakPolarHBondContact OD1-CB 3.4Å; D372-S374 PolarHBondContact OD1-N 2.98Å; D372-S374 PolarHBondContact OD1-OG 3.01Å; D372-R375 WeakPolarHBondContact O-CB 3.21Å; D372-R375 PolarHBondContact O-N 3.24Å
373	L	95.6	Very high	93.6	Very high	0 Å²	0	59 Å²	59	0%	0	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-52.4	-34.8	-177.9	179.8	62.4	0	0	0	112.8	C340 L344 L347 R348 M351 V360 R375 V376 F378	C340-L373 HydrophobicContact CB-CD1 4.12Å; L344-L373 HydrophobicContact CB-CD1 4.24Å; L344-L373 HydrophobicContact CB-CD2 4.17Å; L344-L373 HydrophobicContact CD1-CD2 4.41Å; L347-L373 HydrophobicContact CB-CD2 4.07Å; L347-L373 HydrophobicContact CD2-CD2 3.8Å; L347-L373 HydrophobicContact CG-CD2 3.79Å; R348-L373 HydrophobicContact CB-CD1 4Å; R348-L373 HydrophobicContact CB-CD2 4.22Å; R348-L373 HydrophobicContact CB-CG 3.81Å; R348-L373 HydrophobicContact CG-CD1 4.26Å; R348-L373 HydrophobicContact CG-CG 4.1Å; R348-L373 WeakPolarHBondContact CG-O 3.39Å; M351-L373 HydrophobicContact CE-CB 4.43Å; M351-L373 HydrophobicContact SD-CB 4.09Å; M351-L373 HydrophobicContact SD-CD2 3.88Å; M351-L373 HydrophobicContact SD-CG 4.18Å; V360-L373 HydrophobicContact CB-CB 4.02Å; V360-L373 HydrophobicContact CG1-CB 3.96Å; V360-L373 HydrophobicContact CG1-CD2 4Å; V360-L373 WeakPolarHBondContact O-CB 3.09Å; V360-L373 PolarHBondContact O-N 2.93Å; L373-R375 PolarHBondContact O-N 3.17Å; L373-V376 HydrophobicContact CD1-CB 4.41Å; L373-V376 PolarHBondContact O-N 3.43Å; L373-F378 HydrophobicContact CD1-CE2 4.41Å; L373-F378 HydrophobicContact CD1-CZ 4.03Å
374	S	92.6	Very high	93.2	Very high	48 Å²	48	58.7 Å²	58.7	34%	0.336	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-60.9	-16.6	176.3	61.9	0	0	0	0	114.3	D372	D372-S374 PolarHBondContact O-N 3.16Å; D372-S374 VanDerWaalsContact O-N 3.1Å; D372-S374 VanDerWaalsContact OD1-CB 3.3Å; D372-S374 WeakPolarHBondContact OD1-CB 3.4Å; D372-S374 PolarHBondContact OD1-N 2.98Å; D372-S374 PolarHBondContact OD1-OG 3.01Å
375	R	92.8	Very high	92.9	Very high	188 Å²	188	62.7 Å²	62.7	71%	0.709	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-102.4	-4.8	178.7	-57.7	-177.4	-179	-179.8	0.2	113.1	D372 L373	D372-R375 WeakPolarHBondContact O-CB 3.21Å; D372-R375 PolarHBondContact O-N 3.24Å; L373-R375 PolarHBondContact O-N 3.17Å
376	V	93.3	Very high	92.8	Very high	1 Å²	1	63.8 Å²	63.8	1%	0.006	39%	0.39	C	S	.	.			trans	-79.2	124.5	-178.7	176.1	0	0	0	0	109.5	C340 R348 V368 L371 L373 F378 P389	C340-V376 HydrophobicContact CB-CG2 4.46Å; R348-V376 PolarHBondContact NE-O 3.35Å; R348-V376 PolarHBondContact NH1-O 2.84Å; R348-V376 PolarHBondContact NH2-O 3.48Å; V368-V376 HydrophobicContact CB-CG2 4.12Å; V368-V376 HydrophobicContact CG1-CG1 4.1Å; V368-V376 HydrophobicContact CG1-CG2 4.34Å; L371-V376 HydrophobicContact CB-CG2 4.44Å; L373-V376 HydrophobicContact CD1-CB 4.41Å; L373-V376 PolarHBondContact O-N 3.43Å; V376-F378 HydrophobicContact CG1-CD1 4.29Å; V376-F378 HydrophobicContact CG1-CE1 3.84Å; V376-F378 HydrophobicContact CG1-CE2 4.44Å; V376-F378 HydrophobicContact CG1-CZ 3.92Å; V376-P389 HydrophobicContact CG1-CG 4.36Å
377	T	91.2	Very high	92.9	Very high	118 Å²	118	66.1 Å²	66.1	72%	0.724	40%	0.399	S	S	*	.			trans	-97	111.8	174.8	54.3	0	0	0	0	110.3
378	F	93.8	Very high	92.9	Very high	14 Å²	14	68.1 Å²	68.1	6%	0.061	41%	0.406	C	S	.	.			trans	-78.7	126.9	171.9	-61.9	-64.2	0	0	0	111.1	C340 D341 E345 R348 L373 V376 C386 P389	C340-F378 WeakPolarHBondContact O-CE1 3.3Å; D341-F378 WeakPolarHBondContact O-CE1 3.44Å; D341-F378 WeakPolarHBondContact O-CZ 3.48Å; E345-F378 HydrophobicContact CB-CD2 4.09Å; E345-F378 HydrophobicContact CB-CE2 4.16Å; E345-F378 HydrophobicContact CG-CD2 4.13Å; R348-F378 HydrophobicContact CB-CE2 3.9Å; R348-F378 HydrophobicContact CG-CE2 4.11Å; L373-F378 HydrophobicContact CD1-CE2 4.41Å; L373-F378 HydrophobicContact CD1-CZ 4.03Å; V376-F378 HydrophobicContact CG1-CD1 4.29Å; V376-F378 HydrophobicContact CG1-CE1 3.84Å; V376-F378 HydrophobicContact CG1-CE2 4.44Å; V376-F378 HydrophobicContact CG1-CZ 3.92Å; F378-C386 VanDerWaalsContact CB-SG 3.56Å; F378-P389 HydrophobicContact CD1-CG 4.25Å; F378-P389 HydrophobicContact CE1-CG 4.24Å
379	G	90.6	Very high	92.8	Very high	37 Å²	37	68.6 Å²	68.6	38%	0.381	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	162.1	176.2	0	0	0	0	0	111.9	C386 V387	G379-C386 CarbonylContact O-C 3.51Å; G379-C386 WeakPolarHBondContact O-CA 3.15Å; G379-V387 PolarHBondContact O-N 2.9Å
380	R	94.1	Very high	92.5	Very high	138 Å²	138	73.4 Å²	73.4	52%	0.521	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.7	174.2	-61.4	-64.7	-175.2	-163.8	-8.7	109.7	E345 G384 L385	E345-R380 IonicContact OE1-CZ 3.42Å; E345-R380 IonicContact OE1-NH1 3.64Å; E345-R380 PolarHBondContact OE1-NH1 2.91Å; E345-R380 IonicContact OE1-NH2 2.71Å; E345-R380 PolarHBondContact OE1-NH2 3.39Å; E345-R380 IonicContact OE2-NH1 3.07Å; R380-G384 WeakPolarHBondContact CD-O 3.43Å; R380-L385 WeakPolarHBondContact CA-O 2.99Å
381	S	92.1	Very high	92.2	Very high	40 Å²	40	75.7 Å²	75.7	28%	0.28	42%	0.416	S	S	.	.			trans	-69.9	170	169.4	65.3	0	0	0	0	110.8	N383 G384 L385	S381-N383 PolarHBondContact O-N 2.86Å; S381-N383 PolarHBondContact OG-N 3.45Å; S381-G384 PolarHBondContact O-N 3.47Å; S381-L385 PolarHBondContact N-O 3.18Å; S381-L385 WeakPolarHBondContact OG-CB 2.97Å; S381-L385 PolarHBondContact OG-N 2.98Å; S381-L385 VanDerWaalsContact OG-N 3.15Å; S381-L385 PolarHBondContact OG-O 3.29Å
382	S	90.6	Very high	91.7	Very high	120 Å²	120	76.5 Å²	76.5	84%	0.839	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-25.5	173.3	57.2	0	0	0	0	113.7
383	N	89.7	Confident	90.3	Very high	134 Å²	134	81.8 Å²	81.8	72%	0.717	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	9	-178.6	-58.1	-6.8	0	0	0	112.3	S381 L385	S381-N383 PolarHBondContact O-N 2.86Å; S381-N383 PolarHBondContact OG-N 3.45Å; N383-L385 PolarHBondContact O-N 2.8Å
384	G	88.1	Confident	88.3	Confident	47 Å²	47	88.4 Å²	88.4	49%	0.485	48%	0.484	S	S	.	.	S	Bend	trans	77.1	0.8	-179.6	0	0	0	0	0	115.1	R380 S381	R380-G384 WeakPolarHBondContact CD-O 3.43Å; S381-G384 PolarHBondContact O-N 3.47Å
385	L	90.9	Very high	86	Confident	118 Å²	118	92.4 Å²	92.4	62%	0.618	51%	0.506	S	S	*	.			trans	-73.2	144.5	176.6	-64.1	164.4	0	0	0	110.7	R380 S381 N383	R380-L385 WeakPolarHBondContact CA-O 2.99Å; S381-L385 PolarHBondContact N-O 3.18Å; S381-L385 WeakPolarHBondContact OG-CB 2.97Å; S381-L385 PolarHBondContact OG-N 2.98Å; S381-L385 VanDerWaalsContact OG-N 3.15Å; S381-L385 PolarHBondContact OG-O 3.29Å; N383-L385 PolarHBondContact O-N 2.8Å
386	C	93.5	Very high	83.5	Confident	29 Å²	29	88.8 Å²	88.8	20%	0.196	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	140.5	172.7	-179	0	0	0	0	111	C342 F378 G379	C342-C386 WeakPolarHBondContact CA-SG 2.98Å; C342-C386 HydrophobicContact CB-CB 3.71Å; C342-C386 WeakPolarHBondContact CB-SG 3.4Å; C342-C386 WeakPolarHBondContact SG-CB 3.04Å; C342-C386 CovalentContact SG-SG 2.02Å; C342-C386 PolarHBondContact SG-SG 2.03Å; F378-C386 VanDerWaalsContact CB-SG 3.56Å; G379-C386 CarbonylContact O-C 3.51Å; G379-C386 WeakPolarHBondContact O-CA 3.15Å
387	V	94.7	Very high	81	Confident	70 Å²	70	94.4 Å²	94.4	42%	0.424	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.1	175.1	-179.2	0	0	0	0	109	C342 G379	C342-V387 PolarHBondContact SG-N 2.65Å; C342-V387 VanDerWaalsContact SG-N 3.35Å; G379-V387 PolarHBondContact O-N 2.9Å
388	D	93.9	Very high	78.4	Confident	92 Å²	92	94.1 Å²	94.1	49%	0.492	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-63.6	141.7	-178.9	-65.9	-32.4	0	0	0	111.3	D341 C342	D341-D388 HydrophobicContact CB-CB 4.4Å; D341-D388 WeakPolarHBondContact CB-OD1 3.37Å; C342-D388 WeakPolarHBondContact CB-OD1 3.48Å; C342-D388 PolarHBondContact N-OD1 3.46Å; C342-D388 PolarHBondContact SG-OD1 2.84Å
389	P	93.1	Very high	75.8	Confident	24 Å²	24	98.8 Å²	98.8	16%	0.156	58%	0.579	C	S	.	*	P	Polyproline II helix	trans	-63.8	150.3	172.8	-17.1	30.8	0	0	0	111.6	C340 P365 S367 V368 V376 F378	C340-P389 WeakPolarHBondContact O-CG 3.38Å; P365-P389 HydrophobicContact CG-CB 3.79Å; P365-P389 HydrophobicContact CG-CG 4.33Å; P365-P389 WeakPolarHBondContact CG-O 3.46Å; S367-P389 WeakPolarHBondContact OG-CB 3.45Å; V368-P389 HydrophobicContact CG1-CB 3.89Å; V368-P389 HydrophobicContact CG1-CG 4.18Å; V368-P389 HydrophobicContact CG2-CB 4.41Å; V368-P389 HydrophobicContact CG2-CG 4.49Å; V376-P389 HydrophobicContact CG1-CG 4.36Å; F378-P389 HydrophobicContact CD1-CG 4.25Å; F378-P389 HydrophobicContact CE1-CG 4.24Å
390	E	89.5	Confident	73.2	Confident	152 Å²	152	100.2 Å²	100.2	71%	0.71	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-71	143.8	-173.5	-64.5	-176.8	173.7	0	0	112.9	S367	S367-E390 WeakPolarHBondContact CB-O 3.21Å; S367-E390 PolarHBondContact N-O 3.47Å; S367-E390 PolarHBondContact OG-N 3.3Å; S367-E390 PolarHBondContact OG-O 3.04Å
391	E	87	Confident	70.6	Confident	114 Å²	114	100.1 Å²	100.1	53%	0.533	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-80.5	121.1	169	-165.9	64.7	-121.1	0	0	109.5	P365 G366 N393	P365-E391 VanDerWaalsContact CA-OE2 3.26Å; P365-E391 WeakPolarHBondContact CA-OE2 3.48Å; P365-E391 HydrophobicContact CB-CB 4.44Å; P365-E391 WeakPolarHBondContact CB-OE2 3.42Å; G366-E391 PolarHBondContact N-OE1 2.88Å; E391-N393 PolarHBondContact O-N 3.21Å
392	L	82.9	Confident	67.7	Low	91 Å²	91	103.2 Å²	103.2	48%	0.476	63%	0.632	S	S	.	*			trans	-86.4	107.9	173	-66.8	177.4	0	0	0	108.4	L394	L392-L394 PolarHBondContact O-N 2.03Å
393	N	65.6	Low	65.3	Low	143 Å²	143	103.4 Å²	103.4	77%	0.765	63%	0.631	S	S	*	*			trans	-67.3	81.4	172.6	-73.5	-21.8	0	0	0	110.4	E391 T395	E391-N393 PolarHBondContact O-N 3.21Å; N393-T395 PolarHBondContact O-N 2.87Å
394	L	54.9	Low	62.5	Low	139 Å²	139	105.7 Å²	105.7	73%	0.728	64%	0.637	S	S	*	*			trans	-75.8	74.5	167.9	-71.2	164.9	0	0	0	109	L392 T396	L392-L394 PolarHBondContact O-N 2.03Å; L394-T396 PolarHBondContact O-N 3.26Å
395	T	43.5	Very low	59.9	Low	132 Å²	132	109.4 Å²	109.4	81%	0.81	65%	0.653	S	S	*	*			trans	-76.2	76.3	160	51.6	0	0	0	0	108.6	N393	N393-T395 PolarHBondContact O-N 2.87Å
396	T	41	Very low	57.2	Low	111 Å²	111	107.9 Å²	107.9	68%	0.681	66%	0.658	S	S	*	*			trans	-129.6	113.4	165.8	33.9	0	0	0	0	108.7	L394 S398	L394-T396 PolarHBondContact O-N 3.26Å; T396-S398 PolarHBondContact O-N 3Å; T396-S398 VanDerWaalsContact O-N 3.12Å
397	S	40.5	Very low	54.2	Low	120 Å²	120	111.2 Å²	111.2	84%	0.839	69%	0.687	S	S	*	*			trans	-47.3	112.6	170.5	50.2	0	0	0	0	110.7
398	S	35.5	Very low	51.2	Low	112 Å²	112	114 Å²	114	78%	0.783	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-74.2	134.9	167.4	-171.5	0	0	0	0	109.3	T396	T396-S398 PolarHBondContact O-N 3Å; T396-S398 VanDerWaalsContact O-N 3.12Å
399	P	39.5	Very low	48.4	Very low	112 Å²	112	115.9 Å²	115.9	73%	0.727	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-63.4	150.3	159	-4.7	21.1	0	0	0	108.8
400	G	36.7	Very low	45.7	Very low	67 Å²	67	121.1 Å²	121.1	69%	0.691	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-58.7	169.8	-171.9	0	0	0	0	0	115.9	S402	G400-S402 PolarHBondContact O-N 3.27Å
401	P	39.1	Very low	43.5	Very low	135 Å²	135	117.7 Å²	117.7	88%	0.877	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-71.4	123.6	-169.9	29.7	-32.8	0	0	0	111
402	S	32.1	Very low	41.3	Very low	105 Å²	105	123 Å²	123	73%	0.734	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-79.8	148.5	158.9	51.4	0	0	0	0	109.5	G400 E404	G400-S402 PolarHBondContact O-N 3.27Å; S402-E404 PolarHBondContact O-N 3.13Å
403	P	40.2	Very low	39.1	Very low	125 Å²	125	127.5 Å²	127.5	81%	0.812	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71.7	129.9	-167.6	27.6	-33.1	0	0	0	111.9
404	E	31.4	Very low	37.8	Very low	182 Å²	182	124.4 Å²	124.4	85%	0.85	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-59.1	140.2	173.3	-73.8	-173.4	152.2	0	0	111.6	S402	S402-E404 PolarHBondContact O-N 3.13Å
405	P	33.6	Very low	37.2	Very low	124 Å²	124	121.1 Å²	121.1	81%	0.805	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-70	130.9	163.8	28.5	-29.3	0	0	0	109.5	A407	P405-A407 PolarHBondContact O-N 2.91Å
406	A	33	Very low	36.8	Very low	87 Å²	87	119.3 Å²	119.3	72%	0.719	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-52.1	122.6	-179.6	0	0	0	0	0	112.2	T408	A406-T408 PolarHBondContact O-N 3.12Å
407	A	29.7	Very low	37	Very low	99 Å²	99	117.6 Å²	117.6	82%	0.818	72%	0.724	S	S	*	*			trans	-68.6	91.6	172.8	0	0	0	0	0	110.8	P405 T409	P405-A407 PolarHBondContact O-N 2.91Å; A407-T409 PolarHBondContact O-N 2.84Å
408	T	33.5	Very low	37	Very low	127 Å²	127	114.6 Å²	114.6	78%	0.779	70%	0.703	S	S	*	*			trans	-87.7	71.7	167.5	54.4	0	0	0	0	110.5	A406	A406-T408 PolarHBondContact O-N 3.12Å
409	T	34.2	Very low	37.1	Very low	132 Å²	132	116.8 Å²	116.8	81%	0.81	70%	0.698	S	S	*	*			trans	-140.1	90.1	157.2	47.1	0	0	0	0	109.7	A407 S411	A407-T409 PolarHBondContact O-N 2.84Å; T409-S411 PolarHBondContact O-N 2.71Å
410	V	36.8	Very low	36.9	Very low	135 Å²	135	118.1 Å²	118.1	82%	0.818	70%	0.699	S	S	*	*			trans	-60.4	124.4	170.7	172.2	0	0	0	0	109.3	R412	V410-R412 PolarHBondContact O-N 3.11Å
411	S	43.7	Very low	37	Very low	79 Å²	79	120.2 Å²	120.2	55%	0.552	69%	0.693	S	S	*	*			trans	-35.3	113.1	167.4	179.8	0	0	0	0	113	T409 S414	T409-S411 PolarHBondContact O-N 2.71Å; S411-S414 PolarHBondContact OG-OG 2.83Å; S411-S414 VanDerWaalsContact OG-OG 3.05Å
412	R	39.6	Very low	36.7	Very low	225 Å²	225	116.5 Å²	116.5	85%	0.849	67%	0.674	S	S	*	*			trans	-104.5	3.3	166.7	-78.2	-172	176.1	-175.2	0.5	113.7	V410	V410-R412 PolarHBondContact O-N 3.11Å
413	F	37.6	Very low	36.6	Very low	186 Å²	186	115.5 Å²	115.5	82%	0.816	67%	0.665	S	S	*	*	S	Bend	trans	-88.9	-21.4	-179.4	-100.9	-89.7	0	0	0	114.3	S415	F413-S415 PolarHBondContact O-N 2.91Å
414	S	38.6	Very low	36.1	Very low	78 Å²	78	121.6 Å²	121.6	55%	0.545	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	6.2	179.3	44.1	0	0	0	0	115.1	S411	S411-S414 PolarHBondContact OG-OG 2.83Å; S411-S414 VanDerWaalsContact OG-OG 3.05Å
415	S	41.1	Very low	35.9	Very low	70 Å²	70	118.7 Å²	118.7	49%	0.49	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.4	-10.5	-177.4	-175.6	0	0	0	0	114.4	F413	F413-S415 PolarHBondContact O-N 2.91Å
416	L	36	Very low	35.6	Very low	95 Å²	95	120.9 Å²	120.9	50%	0.497	67%	0.671	S	S	.	*	S	Bend	trans	-92.9	-26.9	-170.7	-79.3	157.8	0	0	0	114.5	S418 K419 L420	L416-S418 VanDerWaalsContact C-N 3.33Å; L416-S418 PolarHBondContact O-N 3.11Å; L416-K419 PolarHBondContact O-N 3.07Å; L416-L420 PolarHBondContact O-N 3.04Å
417	L	45.8	Very low	35.3	Very low	75 Å²	75	123 Å²	123	39%	0.393	67%	0.674	S	S	.	*	H	α-helix	trans	-68.5	-32.8	179.3	-141	84.5	0	0	0	112.2	K419 L420	L417-K419 VanDerWaalsContact C-N 3.25Å; L417-K419 PolarHBondContact O-N 2.99Å; L417-L420 PolarHBondContact O-N 2.97Å
418	S	39.5	Very low	35.2	Very low	57 Å²	57	126.9 Å²	126.9	40%	0.399	68%	0.676	S	S	.	*	H	α-helix	trans	-68.3	-20.8	176.3	-40.6	0	0	0	0	113.6	L416	L416-S418 VanDerWaalsContact C-N 3.33Å; L416-S418 PolarHBondContact O-N 3.11Å
419	K	36.8	Very low	34.8	Very low	158 Å²	158	130 Å²	130	69%	0.687	68%	0.681	S	S	*	*	H	α-helix	trans	-94.4	-22.6	179.8	-74.4	-177	177.9	179.4	0	113.4	L416 L417	L416-K419 PolarHBondContact O-N 3.07Å; L417-K419 VanDerWaalsContact C-N 3.25Å; L417-K419 PolarHBondContact O-N 2.99Å
420	L	36.2	Very low	34.5	Very low	140 Å²	140	132.9 Å²	132.9	73%	0.733	69%	0.686	S	S	*	*	H	α-helix	trans	-79.5	-18.2	178.6	-81.9	157	0	0	0	113.5	L416 L417	L416-L420 PolarHBondContact O-N 3.04Å; L417-L420 PolarHBondContact O-N 2.97Å
421	L	38.3	Very low	34	Very low	110 Å²	110	130.9 Å²	130.9	58%	0.576	68%	0.683	S	S	*	*	S	Bend	trans	-113.6	5.7	-179.3	-64.7	173.3	0	0	0	114.4
422	A	32.8	Very low	33.1	Very low	57 Å²	57	134.9 Å²	134.9	47%	0.471	70%	0.698	S	S	.	*	S	Bend	trans	-86.4	142.1	173.3	0	0	0	0	0	111	R424	A422-R424 PolarHBondContact O-N 3.19Å
423	P	30.6	Very low	32.5	Very low	85 Å²	85	129.9 Å²	129.9	55%	0.552	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-62.9	131	176	24.2	-30.4	0	0	0	110.5	V425	P423-V425 PolarHBondContact O-N 3.27Å; P423-V425 VanDerWaalsContact O-N 3.17Å
424	R	29.1	Very low	32.2	Very low	253 Å²	253	128.2 Å²	128.2	96%	0.955	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-49.1	116.8	-178.5	-69.4	-179.3	174.9	174.9	-2.3	111.5	A422	A422-R424 PolarHBondContact O-N 3.19Å
425	V	27.5	Very low	31.6	Very low	121 Å²	121	128.1 Å²	128.1	73%	0.733	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-100.8	124.2	162.5	177.8	0	0	0	0	106.7	P423 V427	P423-V425 PolarHBondContact O-N 3.27Å; P423-V425 VanDerWaalsContact O-N 3.17Å; V425-V427 PolarHBondContact O-N 3.28Å
426	L	26.9	Very low	30.8	Very low	170 Å²	170	128.3 Å²	128.3	89%	0.89	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-65.5	122.9	173	-72	164	0	0	0	108.6
427	V	26.8	Very low	30.4	Very low	132 Å²	132	132.1 Å²	132.1	80%	0.8	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-100.4	116.8	167.6	177.4	0	0	0	0	106.1	V425	V425-V427 PolarHBondContact O-N 3.28Å
428	E	27.4	Very low	29.5	Very low	180 Å²	180	132.2 Å²	132.2	84%	0.841	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-76	130.5	169.1	-73.6	179.7	156	0	0	109
429	E	26	Very low	28.7	Very low	192 Å²	192	137.5 Å²	137.5	90%	0.897	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-74.8	118.2	171.1	-74.8	-179.5	143.6	0	0	109.6	A431	E429-A431 PolarHBondContact O-N 3.3Å
430	E	27.4	Very low	28.2	Very low	193 Å²	193	134.1 Å²	134.1	90%	0.902	78%	0.779	S	S	*	*			trans	-81.4	106.5	163.1	-78	-176.1	162	0	0	109
431	A	25.9	Very low	27.7	Very low	92 Å²	92	133.4 Å²	133.4	76%	0.76	79%	0.786	S	S	*	*			trans	-68.3	126.9	159.8	0	0	0	0	0	108.8	E429	E429-A431 PolarHBondContact O-N 3.3Å
432	N	25.7	Very low	27.1	Very low	164 Å²	164	135.1 Å²	135.1	88%	0.877	80%	0.795	S	S	*	*			trans	-130.3	107.9	165.8	-129.5	1.4	0	0	0	108.9
433	T	27.3	Very low	26.6	Very low	120 Å²	120	137.4 Å²	137.4	74%	0.736	81%	0.808	S	S	*	*			trans	-100.7	156	168.1	43.5	0	0	0	0	109.9
434	T	30.5	Very low	26.2	Very low	150 Å²	150	142.6 Å²	142.6	92%	0.92	82%	0.818	S	S	*	*			trans	99.1	126.6	179.6	66	0	0	0	0	113.2
435	G	26.5	Very low	26	Very low	77 Å²	77	135.4 Å²	135.4	79%	0.794	81%	0.806	S	S	*	*			cis	-179.6	147.9	-2.3	0	0	0	0	0	106.2
436	G	24.1	Very low	25.8	Very low	73 Å²	73	136.5 Å²	136.5	75%	0.753	81%	0.807	S	S	*	*			trans	-70.6	170.8	-160	0	0	0	0	0	117.5
437	L	26.4	Very low	25.7	Very low	175 Å²	175	133.4 Å²	133.4	92%	0.916	80%	0.8	S	S	*	*				-164.4	117.3	129	-98.6	153.8	0	0	0	111.7
438	A	26.8	Very low	25.6	Very low	78 Å²	78	132.4 Å²	132.4	65%	0.645	80%	0.798	S	S	*	*			trans	27.5	127.4	145.9	0	0	0	0	0	121.8
439	N	23.5	Very low	25.6	Very low	167 Å²	167	135.8 Å²	135.8	89%	0.893	80%	0.803	S	S	*	*				-171.8	146.9	92	-104.5	-17.9	0	0	0	113
440	A	26.8	Very low	25.6	Very low	87 Å²	87	129.9 Å²	129.9	72%	0.719	79%	0.794	S	S	*	*			trans	-81.2	153	-171.6	0	0	0	0	0	114.1
441	S	25.9	Very low	25.6	Very low	125 Å²	125	128 Å²	128	87%	0.874	80%	0.795	S	S	*	*				-160	133	128.6	43.6	0	0	0	0	110.7
442	L	25.3	Very low	25.7	Very low	147 Å²	147	127.4 Å²	127.4	77%	0.77	80%	0.798	S	S	*	*			trans	-90.2	149.1	-174.9	-78.6	132.1	0	0	0	111.8	Y444	L442-Y444 HydrophobicContact CD2-CE2 4.18Å
443	S	22.6	Very low	25.6	Very low	105 Å²	105	123.3 Å²	123.3	73%	0.734	79%	0.794	S	S	*	*				-177.2	109.4	129.4	51.4	0	0	0	0	108.8
444	Y	21.6	Very low	25.7	Very low	194 Å²	194	122.8 Å²	122.8	76%	0.761	80%	0.803	S	S	*	*				52.6	127.7	94.7	-78.7	-82.8	0	0	0	112.5	L442	L442-Y444 HydrophobicContact CD2-CE2 4.18Å
445	S	24.4	Very low	25.4	Very low	101 Å²	101	119.1 Å²	119.1	71%	0.706	79%	0.794	S	S	*	*			cis	-168.7	136	39.2	39.1	0	0	0	0	109.9
446	L	24.3	Very low	25.5	Very low	144 Å²	144	127.5 Å²	127.5	75%	0.754	80%	0.802	S	S	*	*				54.3	128	101.4	-73.9	149.5	0	0	0	115.1
447	S	25	Very low	25.7	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	81%	0.806	S	S	*	*				-168	134.4	55.3	-63.5	0	0	0	0	109.6
448	S	25.1	Very low	25.7	Very low	110 Å²	110	133.5 Å²	133.5	77%	0.769	81%	0.805	S	S	*	*				67	110.2	72.5	176.1	0	0	0	0	115.7
449	R	27.3	Very low	25.7	Very low	252 Å²	252	140.1 Å²	140.1	95%	0.951	81%	0.814	S	S	*	*			trans	-147.8	108.9	139	-119.2	-178.8	-178.6	-178.4	0.7	108.5
450	G	25.9	Very low	25.9	Very low	68 Å²	68	140 Å²	140	70%	0.701	81%	0.806	S	S	*	*			trans	-101.8	161.8	173.9	0	0	0	0	0	112.2
451	V	27.4	Very low	25.9	Very low	153 Å²	153	143.9 Å²	143.9	93%	0.927	81%	0.813	S	S	*	*			trans	-139.6	124.1	149	177.4	0	0	0	0	105.9
452	G	26.1	Very low	26.1	Very low	80 Å²	80	145.4 Å²	145.4	83%	0.825	81%	0.811	S	S	*	*			trans	-99.6	-178.5	-172.1	0	0	0	0	0	114.6
453	G	25.1	Very low	26.2	Very low	77 Å²	77	145.5 Å²	145.5	79%	0.794	82%	0.818	S	S	*	*			trans	157.5	103.1	161.1	0	0	0	0	0	114.7
454	A	28.2	Very low	26.4	Very low	110 Å²	110	145.1 Å²	145.1	91%	0.909	82%	0.815	S	S	*	*			trans	50.4	124.8	152.2	0	0	0	0	0	119.2
455	G	25.3	Very low	26.6	Very low	72 Å²	72	142.4 Å²	142.4	74%	0.742	82%	0.823	S	S	*	*			cis	101.2	92.1	29.6	0	0	0	0	0	110.5
456	R	28.4	Very low	26.9	Very low	253 Å²	253	144.7 Å²	144.7	96%	0.955	83%	0.826	S	S	*	*			trans	-168.2	116.3	145.5	-108.9	171.7	-174.6	-155.7	0.1	111.2
457	Q	28.1	Very low	27.2	Very low	179 Å²	179	145.5 Å²	145.5	84%	0.836	83%	0.831	S	S	*	*			trans	-80.7	151.9	168.6	-66.4	-171.5	-16.1	0	0	110.2
458	H	26.4	Very low	27.7	Very low	196 Å²	196	145.9 Å²	145.9	91%	0.907	83%	0.831	S	S	*	*			trans	-147.5	132.9	141.4	-105.7	-75.7	0	0	0	111.1
459	W	27.6	Very low	28	Very low	216 Å²	216	146 Å²	146	82%	0.818	83%	0.831	S	S	*	*			trans	-82.5	153.7	179	-172.6	-65.6	0	0	0	111
460	F	26.4	Very low	28.2	Very low	166 Å²	166	140.6 Å²	140.6	73%	0.728	83%	0.826	S	S	*	*			trans	-28.9	155.9	170	-59.2	-99.4	0	0	0	118.3
461	L	26.9	Very low	28.4	Very low	168 Å²	168	141.5 Å²	141.5	88%	0.88	83%	0.827	S	S	*	*				-169.5	141.5	113.4	-96.2	165.2	0	0	0	112.5
462	L	30	Very low	28.5	Very low	156 Å²	156	142.9 Å²	142.9	82%	0.817	82%	0.823	S	S	*	*			trans	-72.3	146.6	169.2	-75	125.2	0	0	0	111.2
463	T	27	Very low	28.6	Very low	150 Å²	150	147.8 Å²	147.8	92%	0.92	82%	0.824	S	S	*	*			trans	-156.3	145.5	137.5	34.9	0	0	0	0	112.6
464	S	27.8	Very low	28.8	Very low	97 Å²	97	149.5 Å²	149.5	68%	0.678	82%	0.819	S	S	*	*			trans	-77.4	149.8	-178.2	154.6	0	0	0	0	113.2
465	C	25.7	Very low	28.9	Very low	136 Å²	136	150.3 Å²	150.3	92%	0.919	81%	0.813	S	S	*	*			trans	-138.8	133.5	150.6	-95.1	0	0	0	0	110.6
466	L	30.5	Very low	29.1	Very low	149 Å²	149	155.9 Å²	155.9	78%	0.78	82%	0.816	S	S	*	*			trans	-95.8	167.9	-176.7	-76.2	156.9	0	0	0	112.3
467	L	30.4	Very low	29.2	Very low	161 Å²	161	147 Å²	147	84%	0.843	80%	0.804	S	S	*	*			trans	91.1	150.6	156.5	-60.7	161.2	0	0	0	117.9
468	P	37.1	Very low	29.4	Very low	115 Å²	115	147 Å²	147	75%	0.747	81%	0.809	S	S	*	*			cis	-134.1	173.7	-38.3	34.8	-17	0	0	0	113.5
469	S	29.4	Very low	29.6	Very low	111 Å²	111	146 Å²	146	78%	0.776	80%	0.804	S	S	*	*			trans	-65.5	141.1	175.5	58.9	0	0	0	0	114.9
470	V	31.6	Very low	30	Very low	140 Å²	140	144.2 Å²	144.2	85%	0.848	81%	0.808	S	S	*	*			trans	-143.1	122.5	137.4	-180	0	0	0	0	108.4
471	A	30.2	Very low	30.8	Very low	86 Å²	86	147 Å²	147	71%	0.711	83%	0.83	S	S	*	*			trans	-86.3	134.4	172.8	0	0	0	0	0	110.1
472	Q	30.1	Very low	31	Very low	183 Å²	183	146 Å²	146	86%	0.855	83%	0.828	S	S	*	*			trans	-136.5	112.3	155.2	-87.3	-175.3	-19.8	0	0	109.1
473	H	28.8	Very low	31.1	Very low	183 Å²	183	145.5 Å²	145.5	85%	0.847	83%	0.828	S	S	*	*			trans	-71.8	126.1	165.9	-84	-80.2	0	0	0	109
474	V	28.8	Very low	31.3	Very low	112 Å²	112	145.2 Å²	145.2	68%	0.679	82%	0.823	S	S	*	*			trans	-114	111.7	160.3	176.7	0	0	0	0	107.3	F476	V474-F476 HydrophobicContact CG1-CD2 3.87Å; V474-F476 HydrophobicContact CG1-CE2 3.81Å
475	V	30.9	Very low	31.5	Very low	128 Å²	128	148.1 Å²	148.1	78%	0.776	83%	0.832	S	S	*	*			trans	-91.7	118.6	170.7	172.9	0	0	0	0	106.8
476	F	29.1	Very low	31.9	Very low	188 Å²	188	148.8 Å²	148.8	83%	0.825	83%	0.826	S	S	*	*			trans	-93.6	109.9	163.7	-92.8	-85.6	0	0	0	108.5	V474	V474-F476 HydrophobicContact CG1-CD2 3.87Å; V474-F476 HydrophobicContact CG1-CE2 3.81Å
477	G	29.7	Very low	32	Very low	68 Å²	68	148.8 Å²	148.8	70%	0.701	83%	0.829	S	S	*	*			trans	-91.5	124.9	161.9	0	0	0	0	0	109.1
478	L	33.6	Very low	32.1	Very low	177 Å²	177	147.9 Å²	147.9	93%	0.927	83%	0.829	S	S	*	*			trans	-99.7	114	164.7	-82.8	163.9	0	0	0	107.2
479	Q	29.6	Very low	31.7	Very low	175 Å²	175	150.5 Å²	150.5	82%	0.818	84%	0.835	S	S	*	*			trans	-101.4	126	169.4	-171	155.9	-27.4	0	0	107.4
480	M	35.7	Very low	31.9	Very low	180 Å²	180	153.8 Å²	153.8	89%	0.887	84%	0.84	S	S	*	*			trans	-101.6	124.7	161.9	-76.5	-156.3	177	0	0	107.3
481	D	45	Very low	31.9	Very low	225 Å²	225	155 Å²	155	100%	1.203	84%	0.839	S	S	*	*			trans	44.5	0	170.7	-57.4	-15.7	0	0	0	120

Retrieved 481 of 481 residues in 114.4 ms (Link to these results)

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