A0A077Z2N2_TRITR Loading...

Exo endo phos domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z2N2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 573 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	32	Very low	34.6	Very low	241 Å²	241	162.5 Å²	162.5	100%	1.187	86%	0.855	S	S	*	*				0	147.3	0	-86.2	-178.5	168	0	0	107.4
2	S	34.6	Very low	35.2	Very low	129 Å²	129	156.8 Å²	156.8	90%	0.902	83%	0.832	S	S	*	*			trans	76	115.1	-173.2	86.8	0	0	0	0	116.3
3	K	32.6	Very low	35.8	Very low	196 Å²	196	157.9 Å²	157.9	85%	0.852	83%	0.83	S	S	*	*			trans	-96.3	148.1	-178.1	-76.8	175.6	167.5	178.8	0	109.7
4	S	31.9	Very low	36.1	Very low	111 Å²	111	153.7 Å²	153.7	78%	0.776	81%	0.814	S	S	*	*			trans	48.6	109.5	139.4	67.6	0	0	0	0	119.7
5	S	34.9	Very low	36.2	Very low	122 Å²	122	152.6 Å²	152.6	85%	0.853	80%	0.802	S	S	*	*			trans	-137.3	104	132.6	69.2	0	0	0	0	108.3
6	S	34.8	Very low	36.6	Very low	100 Å²	100	150.9 Å²	150.9	70%	0.699	79%	0.792	S	S	*	*			trans	-64.9	133.6	-179.5	47.6	0	0	0	0	113
7	D	34.9	Very low	36.8	Very low	143 Å²	143	146.4 Å²	146.4	77%	0.765	78%	0.782	S	S	*	*			trans	42.7	87.4	132.1	-53.5	-29.9	0	0	0	117.5	E9	D7-E9 VanDerWaalsContact C-N 3.28Å; D7-E9 PolarHBondContact O-N 3.07Å
8	K	34.7	Very low	36.9	Very low	211 Å²	211	144.3 Å²	144.3	92%	0.917	77%	0.77	S	S	*	*			trans	-83.7	76.6	152.4	-76.3	-177.1	175.7	178.9	0	108.5	T10	K8-T10 PolarHBondContact O-N 3.06Å
9	E	36.8	Very low	37.1	Very low	170 Å²	170	144.4 Å²	144.4	79%	0.794	77%	0.771	S	S	*	*			trans	-72.3	113.7	166.8	-85.8	-176.6	153.2	0	0	109.8	D7 R11	D7-E9 VanDerWaalsContact C-N 3.28Å; D7-E9 PolarHBondContact O-N 3.07Å; E9-R11 PolarHBondContact O-N 3.05Å
10	T	37.1	Very low	37.1	Very low	121 Å²	121	144.9 Å²	144.9	74%	0.742	77%	0.77	S	S	*	*			trans	-15.9	104.6	155.3	41.3	0	0	0	0	114.8	K8 T12	K8-T10 PolarHBondContact O-N 3.06Å; T10-T12 PolarHBondContact O-N 3.02Å
11	R	35.8	Very low	37.1	Very low	244 Å²	244	146.9 Å²	146.9	92%	0.921	77%	0.772	S	S	*	*			trans	-58.1	100.9	159.4	-84.3	178.6	166.2	177.4	-5.8	108.6	E9	E9-R11 PolarHBondContact O-N 3.05Å
12	T	42.4	Very low	37.4	Very low	94 Å²	94	138.9 Å²	138.9	58%	0.577	75%	0.751	S	S	*	*			trans	-64.6	135.2	171	38.1	0	0	0	0	110	T10 T14 Q15	T10-T12 PolarHBondContact O-N 3.02Å; T12-T14 PolarHBondContact O-N 2.91Å; T12-Q15 PolarHBondContact O-N 3.09Å
13	E	42.7	Very low	37.4	Very low	171 Å²	171	141.4 Å²	141.4	80%	0.799	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.7	-11.9	-176.4	-68	172.5	146.9	0	0	115.1	Q15 I16	E13-Q15 PolarHBondContact O-N 3.34Å; E13-I16 PolarHBondContact O-N 3.07Å
14	T	39.5	Very low	37.8	Very low	99 Å²	99	136.6 Å²	136.6	61%	0.607	75%	0.745	S	S	*	*	H	α-helix	trans	-61.9	-27.2	177.6	-20.5	0	0	0	0	113.5	T12 A17	T12-T14 PolarHBondContact O-N 2.91Å; T14-A17 PolarHBondContact O-N 3.27Å
15	Q	38.6	Very low	38.1	Very low	137 Å²	137	139 Å²	139	64%	0.64	75%	0.748	S	S	*	*	H	α-helix	trans	-74.6	-26.6	178.2	-140.4	98.8	35.9	0	0	112.8	T12 E13 A17 L18	T12-Q15 PolarHBondContact O-N 3.09Å; E13-Q15 PolarHBondContact O-N 3.34Å; Q15-A17 VanDerWaalsContact C-N 3.26Å; Q15-A17 PolarHBondContact O-N 3.15Å; Q15-L18 PolarHBondContact O-N 3.5Å
16	I	41.7	Very low	38.1	Very low	126 Å²	126	137 Å²	137	65%	0.646	74%	0.739	S	S	*	*	H	α-helix	trans	-72.1	-25.6	178.3	-60.6	176.4	0	0	0	110.6	E13	E13-I16 PolarHBondContact O-N 3.07Å
17	A	40.7	Very low	38.1	Very low	74 Å²	74	138.1 Å²	138.1	61%	0.612	74%	0.743	S	S	*	*	H	α-helix	trans	-76.8	-22.2	179.1	0	0	0	0	0	114.1	T14 Q15	T14-A17 PolarHBondContact O-N 3.27Å; Q15-A17 VanDerWaalsContact C-N 3.26Å; Q15-A17 PolarHBondContact O-N 3.15Å
18	L	38.4	Very low	38.5	Very low	109 Å²	109	137 Å²	137	57%	0.571	74%	0.736	S	S	*	*	H	α-helix	trans	-88.6	-18.9	-176.9	-84.6	159	0	0	0	114	Q15	Q15-L18 PolarHBondContact O-N 3.5Å
19	D	40.6	Very low	38.6	Very low	146 Å²	146	132.1 Å²	132.1	78%	0.781	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-3.4	177.9	-81.1	-12.8	0	0	0	113.9	K21	D19-K21 VanDerWaalsContact C-N 3.26Å; D19-K21 PolarHBondContact O-N 3.34Å
20	M	36.5	Very low	39	Very low	154 Å²	154	132.2 Å²	132.2	76%	0.759	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	27.2	172.4	-68.7	-147.1	-85.6	0	0	114	G22	M20-G22 PolarHBondContact O-N 3.3Å; M20-G22 VanDerWaalsContact O-N 3.09Å
21	K	37	Very low	39.9	Very low	187 Å²	187	130.9 Å²	130.9	81%	0.813	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	93.9	164.1	-81.9	-173.5	176.6	179.4	0	109.7	D19	D19-K21 VanDerWaalsContact C-N 3.26Å; D19-K21 PolarHBondContact O-N 3.34Å
22	G	39	Very low	41.3	Very low	72 Å²	72	123.7 Å²	123.7	74%	0.742	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	155.5	-11.6	158.1	0	0	0	0	0	118.1	M20 A24	M20-G22 PolarHBondContact O-N 3.3Å; M20-G22 VanDerWaalsContact O-N 3.09Å; G22-A24 PolarHBondContact O-N 3.34Å; G22-A24 VanDerWaalsContact O-N 3.15Å
23	E	35.2	Very low	42.2	Very low	183 Å²	183	122 Å²	122	86%	0.855	69%	0.685	S	S	*	*			trans	-85.6	97.4	177.7	-71.7	-169.1	168.1	0	0	110.1	I25	E23-I25 PolarHBondContact O-N 3.01Å
24	A	39.7	Very low	43.2	Very low	95 Å²	95	120.8 Å²	120.8	79%	0.785	68%	0.677	S	S	*	*			trans	-49.5	111.3	165.9	0	0	0	0	0	108.6	G22 A26	G22-A24 PolarHBondContact O-N 3.34Å; G22-A24 VanDerWaalsContact O-N 3.15Å; A24-A26 PolarHBondContact O-N 3.13Å
25	I	38.2	Very low	44.6	Very low	162 Å²	162	120 Å²	120	83%	0.831	67%	0.672	S	S	*	*			trans	-51.4	109.1	173.8	-60.9	170.8	0	0	0	106.7	E23	E23-I25 PolarHBondContact O-N 3.01Å
26	A	35.5	Very low	45.8	Very low	80 Å²	80	118.9 Å²	118.9	66%	0.661	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-54.1	124.9	178.5	0	0	0	0	0	107.9	A24 I28	A24-A26 PolarHBondContact O-N 3.13Å; A26-I28 PolarHBondContact O-N 3.4Å; A26-I28 VanDerWaalsContact O-N 3.16Å
27	P	35.9	Very low	47	Very low	122 Å²	122	113.1 Å²	113.1	79%	0.792	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-58.4	126.9	179.8	20.6	-29.2	0	0	0	108.6
28	I	42.3	Very low	48.4	Very low	121 Å²	121	114.4 Å²	114.4	62%	0.621	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-46.6	128.4	174.8	-59	170.3	0	0	0	107.2	A26 L30	A26-I28 PolarHBondContact O-N 3.4Å; A26-I28 VanDerWaalsContact O-N 3.16Å; I28-L30 PolarHBondContact O-N 3.21Å
29	P	36.7	Very low	50	Low	108 Å²	108	114.5 Å²	114.5	70%	0.701	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-56.9	116.8	-178.2	-16.2	26	0	0	0	107.9	I31	P29-I31 VanDerWaalsContact C-N 3.27Å; P29-I31 PolarHBondContact O-N 3.32Å
30	L	45.8	Very low	51.2	Low	171 Å²	171	109.8 Å²	109.8	90%	0.895	60%	0.597	S	S	*	*			trans	-56.8	101.6	165.2	-102.4	135.9	0	0	0	105.5	I28 D32	I28-L30 PolarHBondContact O-N 3.21Å; L30-D32 PolarHBondContact O-N 2.96Å
31	I	55.1	Low	52.8	Low	93 Å²	93	104.9 Å²	104.9	48%	0.477	57%	0.57	S	S	.	*			trans	-57.4	111.2	171.6	-63.2	172.7	0	0	0	104.6	P29 L33 R36	P29-I31 VanDerWaalsContact C-N 3.27Å; P29-I31 PolarHBondContact O-N 3.32Å; I31-L33 VanDerWaalsContact C-N 3.26Å; I31-L33 PolarHBondContact O-N 3.22Å; I31-R36 HydrophobicContact CG2-CB 4.11Å
32	D	64.8	Low	54.3	Low	94 Å²	94	100.1 Å²	100.1	50%	0.503	55%	0.55	S	S	.	*			trans	-62.7	97.3	173.2	173.8	14.3	0	0	0	107.7	L30 K34 T35 R36	L30-D32 PolarHBondContact O-N 2.96Å; D32-K34 PolarHBondContact O-N 3.48Å; D32-K34 WeakPolarHBondContact OD1-CB 3.19Å; D32-K34 PolarHBondContact OD1-N 3.12Å; D32-K34 VanDerWaalsContact OD1-N 3.13Å; D32-T35 PolarHBondContact O-N 2.79Å; D32-T35 VanDerWaalsContact O-N 3.16Å; D32-T35 WeakPolarHBondContact OD2-CB 3.11Å; D32-T35 PolarHBondContact OD2-OG1 2.92Å; D32-R36 PolarHBondContact O-N 3.28Å
33	L	62.1	Low	55.7	Low	58 Å²	58	101.2 Å²	101.2	30%	0.304	54%	0.536	S	S	.	.	H	α-helix	trans	-60.1	-35.2	-174.3	-73.4	174.7	0	0	0	110.6	I31 T35 R36 F37	I31-L33 VanDerWaalsContact C-N 3.26Å; I31-L33 PolarHBondContact O-N 3.22Å; L33-T35 VanDerWaalsContact C-N 3.33Å; L33-T35 PolarHBondContact O-N 3.24Å; L33-R36 PolarHBondContact O-N 3.15Å; L33-F37 HydrophobicContact CB-CD2 4.07Å; L33-F37 HydrophobicContact CB-CE2 3.69Å; L33-F37 HydrophobicContact CD2-CE2 4.11Å; L33-F37 HydrophobicContact CD2-CZ 4.12Å; L33-F37 HydrophobicContact CG-CE2 4.34Å; L33-F37 WeakPolarHBondContact O-CB 3.48Å; L33-F37 WeakPolarHBondContact O-CD2 3.42Å; L33-F37 VanDerWaalsContact O-CG 3.25Å; L33-F37 WeakPolarHBondContact O-CG 3.27Å; L33-F37 PolarHBondContact O-N 2.82Å
34	K	64.7	Low	57.1	Low	145 Å²	145	96.9 Å²	96.9	63%	0.63	51%	0.512	S	S	*	.	H	α-helix	trans	-60.1	-48.6	178.5	-170.9	-177.8	178.7	-175.1	0	110	D32 F37 Q38	D32-K34 PolarHBondContact O-N 3.48Å; D32-K34 WeakPolarHBondContact OD1-CB 3.19Å; D32-K34 PolarHBondContact OD1-N 3.12Å; D32-K34 VanDerWaalsContact OD1-N 3.13Å; K34-F37 PolarHBondContact O-N 2.79Å; K34-Q38 VanDerWaalsContact O-CB 3.28Å; K34-Q38 WeakPolarHBondContact O-CB 3.36Å; K34-Q38 PolarHBondContact O-N 2.93Å
35	T	67.5	Low	58.3	Low	82 Å²	82	95.4 Å²	95.4	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-65.8	-41.9	177.9	-61	0	0	0	0	112	D32 L33 F37 Q38 F39	D32-T35 PolarHBondContact O-N 2.79Å; D32-T35 VanDerWaalsContact O-N 3.16Å; D32-T35 WeakPolarHBondContact OD2-CB 3.11Å; D32-T35 PolarHBondContact OD2-OG1 2.92Å; L33-T35 VanDerWaalsContact C-N 3.33Å; L33-T35 PolarHBondContact O-N 3.24Å; T35-F37 PolarHBondContact O-N 3.48Å; T35-Q38 PolarHBondContact O-N 2.93Å; T35-F39 PolarHBondContact O-N 3.48Å
36	R	65.2	Low	59.4	Low	115 Å²	115	94.2 Å²	94.2	43%	0.434	48%	0.484	S	S	.	.	H	α-helix	trans	-65.9	-38.6	177.4	-175	167	177	162.4	-2.3	113	I31 D32 L33 F39 L40	I31-R36 HydrophobicContact CG2-CB 4.11Å; D32-R36 PolarHBondContact O-N 3.28Å; L33-R36 PolarHBondContact O-N 3.15Å; R36-F39 PolarHBondContact O-N 3.29Å; R36-L40 HydrophobicContact CG-CD1 4.49Å; R36-L40 WeakPolarHBondContact O-CG 3.2Å; R36-L40 PolarHBondContact O-N 2.91Å
37	F	66.5	Low	60.5	Low	5 Å²	5	94.5 Å²	94.5	2%	0.022	49%	0.486	C	S	.	.	H	α-helix	trans	-70.8	-37.4	175.3	-67.6	-48.8	0	0	0	112	L33 K34 T35 F39 L40 R41 Y65 F348 A371	L33-F37 HydrophobicContact CB-CD2 4.07Å; L33-F37 HydrophobicContact CB-CE2 3.69Å; L33-F37 HydrophobicContact CD2-CE2 4.11Å; L33-F37 HydrophobicContact CD2-CZ 4.12Å; L33-F37 HydrophobicContact CG-CE2 4.34Å; L33-F37 WeakPolarHBondContact O-CB 3.48Å; L33-F37 WeakPolarHBondContact O-CD2 3.42Å; L33-F37 VanDerWaalsContact O-CG 3.25Å; L33-F37 WeakPolarHBondContact O-CG 3.27Å; L33-F37 PolarHBondContact O-N 2.82Å; K34-F37 PolarHBondContact O-N 2.79Å; T35-F37 PolarHBondContact O-N 3.48Å; F37-F39 VanDerWaalsContact C-N 3.32Å; F37-L40 HydrophobicContact CD1-CD1 4.31Å; F37-L40 PolarHBondContact O-N 3.15Å; F37-R41 WeakPolarHBondContact O-CB 3.42Å; F37-R41 WeakPolarHBondContact O-CG 3.28Å; F37-R41 PolarHBondContact O-N 2.85Å; F37-Y65 HydrophobicContact CB-CE1 4.04Å; F37-Y65 HydrophobicContact CD1-CD1 4.44Å; F37-Y65 HydrophobicContact CD1-CE1 4.27Å; F37-Y65 AromaticContact CD2-CD1 3.43Å; F37-Y65 HydrophobicContact CD2-CD1 3.43Å; F37-Y65 VanDerWaalsContact CD2-CD1 3.43Å; F37-Y65 AromaticContact CD2-CD2 3.54Å; F37-Y65 HydrophobicContact CD2-CD2 3.54Å; F37-Y65 AromaticContact CD2-CE1 3.31Å; F37-Y65 HydrophobicContact CD2-CE1 3.31Å; F37-Y65 AromaticContact CD2-CE2 3.45Å; F37-Y65 HydrophobicContact CD2-CE2 3.45Å; F37-Y65 VanDerWaalsContact CD2-CE2 3.45Å; F37-Y65 AromaticContact CD2-CG 3.54Å; F37-Y65 HydrophobicContact CD2-CG 3.54Å; F37-Y65 AromaticContact CD2-CZ 3.34Å; F37-Y65 HydrophobicContact CE1-CD1 4.41Å; F37-Y65 AromaticContact CE2-CD1 3.35Å; F37-Y65 HydrophobicContact CE2-CD1 3.35Å; F37-Y65 AromaticContact CE2-CD2 3.53Å; F37-Y65 HydrophobicContact CE2-CD2 3.53Å; F37-Y65 AromaticContact CE2-CE1 3.78Å; F37-Y65 HydrophobicContact CE2-CE1 3.78Å; F37-Y65 AromaticContact CE2-CE2 3.97Å; F37-Y65 HydrophobicContact CE2-CE2 3.97Å; F37-Y65 AromaticContact CE2-CG 3.2Å; F37-Y65 HydrophobicContact CE2-CG 3.2Å; F37-Y65 HydrophobicContact CG-CD1 4.02Å; F37-Y65 AromaticContact CG-CE1 3.62Å; F37-Y65 HydrophobicContact CG-CE1 3.62Å; F37-Y65 HydrophobicContact CG-CE2 4.37Å; F37-Y65 AromaticContact CG-CZ 3.83Å; F37-Y65 AromaticContact CZ-CD1 3.9Å; F37-Y65 HydrophobicContact CZ-CD1 3.9Å; F37-Y65 HydrophobicContact CZ-CE1 4.47Å; F37-Y65 HydrophobicContact CZ-CG 4.02Å; F37-F348 HydrophobicContact CD1-CB 4.18Å; F37-F348 HydrophobicContact CD1-CD1 4.18Å; F37-F348 AromaticContact CD1-CD2 3.54Å; F37-F348 HydrophobicContact CD1-CD2 3.54Å; F37-F348 AromaticContact CD1-CE2 3.92Å; F37-F348 HydrophobicContact CD1-CE2 3.92Å; F37-F348 AromaticContact CD1-CG 3.69Å; F37-F348 HydrophobicContact CD1-CG 3.69Å; F37-F348 HydrophobicContact CD1-CZ 4.39Å; F37-F348 HydrophobicContact CE1-CB 4.01Å; F37-F348 AromaticContact CE1-CD2 3.79Å; F37-F348 HydrophobicContact CE1-CD2 3.79Å; F37-F348 AromaticContact CE1-CG 3.97Å; F37-F348 HydrophobicContact CE1-CG 3.97Å; F37-F348 HydrophobicContact CG-CD2 4.39Å; F37-F348 HydrophobicContact CG-CE2 4.37Å; F37-A371 HydrophobicContact CE1-CB 3.46Å; F37-A371 VanDerWaalsContact CE1-CB 3.46Å; F37-A371 HydrophobicContact CZ-CB 3.33Å
38	Q	69.9	Low	61.2	Low	101 Å²	101	92.1 Å²	92.1	47%	0.472	47%	0.471	S	S	.	.	H	α-helix	trans	-60.4	-44.7	172.8	-170	166	-11.1	0	0	110.7	K34 T35 R41 E42	K34-Q38 VanDerWaalsContact O-CB 3.28Å; K34-Q38 WeakPolarHBondContact O-CB 3.36Å; K34-Q38 PolarHBondContact O-N 2.93Å; T35-Q38 PolarHBondContact O-N 2.93Å; Q38-R41 PolarHBondContact O-N 2.86Å; Q38-E42 WeakPolarHBondContact O-CB 3.45Å; Q38-E42 VanDerWaalsContact O-CG 3.28Å; Q38-E42 WeakPolarHBondContact O-CG 3.4Å; Q38-E42 PolarHBondContact O-N 2.85Å
39	F	71.2	Confident	61.8	Low	110 Å²	110	93.2 Å²	93.2	48%	0.482	49%	0.486	S	S	.	.	H	α-helix	trans	-59.4	-47.1	171.9	175	-98.6	0	0	0	112.8	T35 R36 F37 R41 E42 Q43	T35-F39 PolarHBondContact O-N 3.48Å; R36-F39 PolarHBondContact O-N 3.29Å; F37-F39 VanDerWaalsContact C-N 3.32Å; F39-R41 VanDerWaalsContact C-N 3.32Å; F39-R41 PolarHBondContact O-N 3.34Å; F39-E42 WeakPolarHBondContact O-CB 3.16Å; F39-E42 PolarHBondContact O-N 3.02Å; F39-Q43 HydrophobicContact CD1-CG 4.23Å; F39-Q43 HydrophobicContact CD2-CG 4.49Å; F39-Q43 HydrophobicContact CE1-CG 3.77Å; F39-Q43 HydrophobicContact CE2-CG 4.06Å; F39-Q43 HydrophobicContact CZ-CG 3.67Å; F39-Q43 WeakPolarHBondContact O-CG 3.37Å; F39-Q43 PolarHBondContact O-N 2.97Å
40	L	66.1	Low	62.9	Low	48 Å²	48	91.9 Å²	91.9	25%	0.251	49%	0.485	S	S	.	.	H	α-helix	trans	-64.2	-36.8	178.6	-72.3	172.6	0	0	0	112.5	R36 F37 Q43 R44 F348	R36-L40 HydrophobicContact CG-CD1 4.49Å; R36-L40 WeakPolarHBondContact O-CG 3.2Å; R36-L40 PolarHBondContact O-N 2.91Å; F37-L40 HydrophobicContact CD1-CD1 4.31Å; F37-L40 PolarHBondContact O-N 3.15Å; L40-Q43 PolarHBondContact O-N 2.59Å; L40-R44 PolarHBondContact O-N 3.04Å; L40-R44 VanDerWaalsContact O-N 3.07Å; L40-F348 HydrophobicContact CB-CD1 3.81Å; L40-F348 HydrophobicContact CB-CE1 4.1Å; L40-F348 HydrophobicContact CD1-CB 4.12Å; L40-F348 HydrophobicContact CD1-CD1 4.03Å; L40-F348 HydrophobicContact CD1-CG 4.36Å
41	R	69.5	Low	63.3	Low	50 Å²	50	86.5 Å²	86.5	19%	0.189	46%	0.46	C	S	.	.	H	α-helix	trans	-63	-49	170.5	-79.8	-166.1	-171.7	128	20	110.8	F37 Q38 F39 Q43 R44 Q45 Y65 E346 F348	F37-R41 WeakPolarHBondContact O-CB 3.42Å; F37-R41 WeakPolarHBondContact O-CG 3.28Å; F37-R41 PolarHBondContact O-N 2.85Å; Q38-R41 PolarHBondContact O-N 2.86Å; F39-R41 VanDerWaalsContact C-N 3.32Å; F39-R41 PolarHBondContact O-N 3.34Å; R41-Q43 VanDerWaalsContact C-N 3.28Å; R41-Q43 PolarHBondContact O-N 2.98Å; R41-R44 CarbonylContact O-C 3.48Å; R41-R44 PolarHBondContact O-N 2.87Å; R41-R44 VanDerWaalsContact O-N 3.1Å; R41-Q45 WeakPolarHBondContact O-CB 3.28Å; R41-Q45 VanDerWaalsContact O-CG 3.23Å; R41-Q45 WeakPolarHBondContact O-CG 3.22Å; R41-Q45 PolarHBondContact O-N 2.9Å; R41-Y65 PolarHBondContact NH2-OH 2.73Å; R41-E346 WeakPolarHBondContact CG-OE1 3.32Å; R41-E346 IonicContact CZ-OE1 3.4Å; R41-E346 IonicContact CZ-OE2 3.24Å; R41-E346 VanDerWaalsContact NE-CD 3.27Å; R41-E346 IonicContact NE-OE1 2.68Å; R41-E346 PolarHBondContact NE-OE1 2.9Å; R41-E346 IonicContact NE-OE2 4Å; R41-E346 PolarHBondContact NE-OE2 2.77Å; R41-E346 IonicContact NH2-OE2 2.87Å; R41-E346 PolarHBondContact NH2-OE2 2.83Å; R41-F348 HydrophobicContact CG-CE1 3.9Å; R41-F348 HydrophobicContact CG-CZ 3.88Å
42	E	69.7	Low	63.3	Low	87 Å²	87	87.2 Å²	87.2	41%	0.407	47%	0.471	S	S	.	.	H	α-helix	trans	-57.1	-41.2	177.6	-74.8	167.6	-170	0	0	111.6	Q38 F39 Q45 L46	Q38-E42 WeakPolarHBondContact O-CB 3.45Å; Q38-E42 VanDerWaalsContact O-CG 3.28Å; Q38-E42 WeakPolarHBondContact O-CG 3.4Å; Q38-E42 PolarHBondContact O-N 2.85Å; F39-E42 WeakPolarHBondContact O-CB 3.16Å; F39-E42 PolarHBondContact O-N 3.02Å; E42-Q45 PolarHBondContact O-N 2.87Å; E42-L46 WeakPolarHBondContact O-CB 3.36Å; E42-L46 VanDerWaalsContact O-CG 3.27Å; E42-L46 WeakPolarHBondContact O-CG 3.49Å; E42-L46 PolarHBondContact O-N 3.17Å
43	Q	67.7	Low	63	Low	95 Å²	95	86.8 Å²	86.8	44%	0.444	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-42.4	174.8	-68.2	-60	-54.8	0	0	112.6	F39 L40 R41 A47	F39-Q43 HydrophobicContact CD1-CG 4.23Å; F39-Q43 HydrophobicContact CD2-CG 4.49Å; F39-Q43 HydrophobicContact CE1-CG 3.77Å; F39-Q43 HydrophobicContact CE2-CG 4.06Å; F39-Q43 HydrophobicContact CZ-CG 3.67Å; F39-Q43 WeakPolarHBondContact O-CG 3.37Å; F39-Q43 PolarHBondContact O-N 2.97Å; L40-Q43 PolarHBondContact O-N 2.59Å; R41-Q43 VanDerWaalsContact C-N 3.28Å; R41-Q43 PolarHBondContact O-N 2.98Å; Q43-A47 PolarHBondContact O-N 2.88Å
44	R	65.7	Low	63.1	Low	92 Å²	92	89 Å²	89	35%	0.347	50%	0.498	S	S	.	.	H	α-helix	trans	-64.3	-41	172.7	-82.4	-175.5	169.9	160.8	-4	111.9	L40 R41 A47 C48 E298 V347	L40-R44 PolarHBondContact O-N 3.04Å; L40-R44 VanDerWaalsContact O-N 3.07Å; R41-R44 CarbonylContact O-C 3.48Å; R41-R44 PolarHBondContact O-N 2.87Å; R41-R44 VanDerWaalsContact O-N 3.1Å; R44-A47 WeakPolarHBondContact O-CB 3.39Å; R44-A47 PolarHBondContact O-N 3.25Å; R44-C48 PolarHBondContact O-N 2.88Å; R44-E298 IonicContact NH2-OE2 3.45Å; R44-E298 PolarHBondContact NH2-OE2 3.08Å; R44-V347 PolarHBondContact NH1-O 2.84Å; R44-V347 PolarHBondContact NH2-O 2.84Å
45	Q	64.6	Low	63	Low	65 Å²	65	85.4 Å²	85.4	30%	0.304	49%	0.488	S	S	.	.	H	α-helix	trans	-64.7	-39.5	179	-75.7	-173.2	-2.1	0	0	111.9	R41 E42 A47 C48 P51	R41-Q45 WeakPolarHBondContact O-CB 3.28Å; R41-Q45 VanDerWaalsContact O-CG 3.23Å; R41-Q45 WeakPolarHBondContact O-CG 3.22Å; R41-Q45 PolarHBondContact O-N 2.9Å; E42-Q45 PolarHBondContact O-N 2.87Å; Q45-A47 VanDerWaalsContact C-N 3.26Å; Q45-A47 PolarHBondContact O-N 2.81Å; Q45-C48 PolarHBondContact O-N 2.97Å; Q45-C48 VanDerWaalsContact O-N 3.09Å; Q45-P51 HydrophobicContact CB-CB 3.5Å; Q45-P51 HydrophobicContact CB-CG 3.83Å; Q45-P51 HydrophobicContact CG-CB 3.37Å; Q45-P51 HydrophobicContact CG-CG 4.15Å
46	L	59.7	Low	63.2	Low	137 Å²	137	86.6 Å²	86.6	72%	0.717	50%	0.497	S	S	*	.	H	α-helix	trans	-65.1	-28.1	173.8	-74.7	166.6	0	0	0	112.8	E42 C48	E42-L46 WeakPolarHBondContact O-CB 3.36Å; E42-L46 VanDerWaalsContact O-CG 3.27Å; E42-L46 WeakPolarHBondContact O-CG 3.49Å; E42-L46 PolarHBondContact O-N 3.17Å; L46-C48 VanDerWaalsContact C-N 3.29Å
47	A	60.5	Low	63.5	Low	86 Å²	86	83.9 Å²	83.9	71%	0.711	49%	0.493	S	S	*	.	H	α-helix	trans	-76.2	-16.7	173.6	0	0	0	0	0	113	Q43 R44 Q45	Q43-A47 PolarHBondContact O-N 2.88Å; R44-A47 WeakPolarHBondContact O-CB 3.39Å; R44-A47 PolarHBondContact O-N 3.25Å; Q45-A47 VanDerWaalsContact C-N 3.26Å; Q45-A47 PolarHBondContact O-N 2.81Å
48	C	50.8	Low	63.8	Low	72 Å²	72	85.1 Å²	85.1	49%	0.486	50%	0.502	S	S	.	.	S	Bend	trans	-99.4	131.9	176.9	-78.4	0	0	0	0	111.3	R44 Q45 L46 A50	R44-C48 PolarHBondContact O-N 2.88Å; Q45-C48 PolarHBondContact O-N 2.97Å; Q45-C48 VanDerWaalsContact O-N 3.09Å; L46-C48 VanDerWaalsContact C-N 3.29Å; C48-A50 PolarHBondContact O-N 3.4Å
49	P	54.6	Low	64.2	Low	143 Å²	143	90 Å²	90	93%	0.929	53%	0.525	S	S	*	.	S	Bend	trans	-64	-14.1	-175	18.9	-28.5	0	0	0	115.5
50	A	58.6	Low	64.5	Low	81 Å²	81	86.7 Å²	86.7	67%	0.669	52%	0.522	S	S	*	.	S	Bend	trans	-157.6	101.9	165.2	0	0	0	0	0	109.2	C48	C48-A50 PolarHBondContact O-N 3.4Å
51	P	53.8	Low	65	Low	58 Å²	58	85.3 Å²	85.3	38%	0.377	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-67.4	133.2	177.1	27.8	-35	0	0	0	110.4	Q45	Q45-P51 HydrophobicContact CB-CB 3.5Å; Q45-P51 HydrophobicContact CB-CG 3.83Å; Q45-P51 HydrophobicContact CG-CB 3.37Å; Q45-P51 HydrophobicContact CG-CG 4.15Å
52	P	55.7	Low	65.2	Low	108 Å²	108	90.5 Å²	90.5	70%	0.701	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-62.2	147	173	25.3	-31.3	0	0	0	110.1
53	A	59.5	Low	65.7	Low	84 Å²	84	89.2 Å²	89.2	69%	0.694	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-56.7	138.2	175.4	0	0	0	0	0	109.9	T55	A53-T55 PolarHBondContact O-N 3.06Å; A53-T55 VanDerWaalsContact O-N 3.11Å
54	P	63.3	Low	66.3	Low	106 Å²	106	87.7 Å²	87.7	69%	0.688	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-57.7	121.7	-179.1	21.3	-30.9	0	0	0	109.5
55	T	63.9	Low	67.3	Low	69 Å²	69	85.8 Å²	85.8	42%	0.423	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-65.7	125	-179.3	-44.4	0	0	0	0	108.8	A53 V57 T342	A53-T55 PolarHBondContact O-N 3.06Å; A53-T55 VanDerWaalsContact O-N 3.11Å; T55-V57 PolarHBondContact O-N 3.17Å; T55-T342 WeakPolarHBondContact CG2-O 3.2Å
56	P	70.2	Confident	68.6	Low	107 Å²	107	83.5 Å²	83.5	70%	0.695	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-60.7	137.6	178.9	21.3	-29.5	0	0	0	110.1
57	V	72.2	Confident	70.3	Confident	57 Å²	57	77.6 Å²	77.6	35%	0.345	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-62	128.8	175.7	178.4	0	0	0	0	108.2	T55 L61 R63 F343	T55-V57 PolarHBondContact O-N 3.17Å; V57-L61 HydrophobicContact CG1-CB 3.78Å; V57-L61 VanDerWaalsContact CG1-O 3.29Å; V57-L61 WeakPolarHBondContact CG1-O 3.23Å; V57-R63 HydrophobicContact CG2-CB 4.14Å; V57-F343 HydrophobicContact CG1-CD2 4.18Å; V57-F343 HydrophobicContact CG1-CE2 4.02Å; V57-F343 HydrophobicContact CG2-CE2 4.12Å
58	P	72.8	Confident	72	Confident	31 Å²	31	73.5 Å²	73.5	20%	0.201	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-53.6	145.8	178	-27	34.6	0	0	0	112.3	G60 L61 T342	P58-G60 PolarHBondContact O-N 2.89Å; P58-L61 HydrophobicContact CB-CD1 3.9Å; P58-L61 HydrophobicContact CB-CG 4.33Å; P58-L61 HydrophobicContact CG-CD1 3.99Å; P58-L61 WeakPolarHBondContact O-CB 3.5Å; P58-L61 PolarHBondContact O-N 3.26Å; P58-L61 VanDerWaalsContact O-N 3.14Å; P58-T342 WeakPolarHBondContact CG-OG1 3.39Å
59	Q	77.6	Confident	74.3	Confident	204 Å²	204	70.3 Å²	70.3	95%	0.953	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	133.2	-178.8	-170.8	177.8	4.3	0	0	110.9	L61	Q59-L61 VanDerWaalsContact C-N 3.34Å
60	G	77.5	Confident	76.4	Confident	41 Å²	41	63.5 Å²	63.5	42%	0.423	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-3.7	-178.2	0	0	0	0	0	114.9	P58 D378	P58-G60 PolarHBondContact O-N 2.89Å; G60-D378 PolarHBondContact O-N 3.19Å; G60-D378 VanDerWaalsContact O-N 3.12Å
61	L	77.9	Confident	78.3	Confident	19 Å²	19	59.6 Å²	59.6	10%	0.099	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	143.8	173	-59.4	-175.6	0	0	0	111.4	V57 P58 Q59 F340 Y375 L376 E377	V57-L61 HydrophobicContact CG1-CB 3.78Å; V57-L61 VanDerWaalsContact CG1-O 3.29Å; V57-L61 WeakPolarHBondContact CG1-O 3.23Å; P58-L61 HydrophobicContact CB-CD1 3.9Å; P58-L61 HydrophobicContact CB-CG 4.33Å; P58-L61 HydrophobicContact CG-CD1 3.99Å; P58-L61 WeakPolarHBondContact O-CB 3.5Å; P58-L61 PolarHBondContact O-N 3.26Å; P58-L61 VanDerWaalsContact O-N 3.14Å; Q59-L61 VanDerWaalsContact C-N 3.34Å; L61-F340 HydrophobicContact CD1-CB 4.3Å; L61-F340 HydrophobicContact CD1-CD1 3.81Å; L61-F340 HydrophobicContact CD1-CD2 4.21Å; L61-F340 HydrophobicContact CD1-CE1 4.13Å; L61-F340 HydrophobicContact CD1-CE2 4.5Å; L61-F340 HydrophobicContact CD1-CG 3.84Å; L61-F340 HydrophobicContact CD1-CZ 4.45Å; L61-F340 HydrophobicContact CD2-CE1 4.48Å; L61-F340 HydrophobicContact CD2-CE2 4.39Å; L61-F340 HydrophobicContact CD2-CZ 4.2Å; L61-Y375 HydrophobicContact CD1-CD2 4.06Å; L61-Y375 HydrophobicContact CD1-CG 4.29Å; L61-Y375 HydrophobicContact CD2-CD2 4.1Å; L61-L376 WeakPolarHBondContact CA-O 3.42Å; L61-E377 HydrophobicContact CD2-CB 3.82Å; L61-E377 HydrophobicContact CD2-CG 3.69Å
62	R	73.7	Confident	80.4	Confident	159 Å²	159	56.9 Å²	56.9	60%	0.6	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	130	168.5	-72.4	176	-160.1	-170.6	8.9	110.4	Y375 L376 D378	R62-Y375 WeakPolarHBondContact O-CA 3.5Å; R62-L376 PolarHBondContact N-O 3Å; R62-L376 PolarHBondContact O-N 2.99Å; R62-D378 WeakPolarHBondContact CD-OD1 3.24Å; R62-D378 WeakPolarHBondContact CG-OD1 3.23Å; R62-D378 IonicContact CZ-OD1 3.78Å; R62-D378 IonicContact CZ-OD2 3.24Å; R62-D378 VanDerWaalsContact NE-CG 3.28Å; R62-D378 IonicContact NE-OD1 3.51Å; R62-D378 PolarHBondContact NE-OD1 2.82Å; R62-D378 IonicContact NE-OD2 3.44Å; R62-D378 PolarHBondContact NE-OD2 3.35Å; R62-D378 VanDerWaalsContact NE-OD2 3.16Å; R62-D378 IonicContact NH2-OD1 2.79Å; R62-D378 IonicContact NH2-OD2 3.52Å; R62-D378 PolarHBondContact NH2-OD2 2.98Å
63	R	78.7	Confident	82.4	Confident	59 Å²	59	51.7 Å²	51.7	22%	0.223	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	129.1	171.1	-179.3	167.9	-62.5	-143.4	1.1	109.9	V57 F343 E346 Y374	V57-R63 HydrophobicContact CG2-CB 4.14Å; R63-F343 HydrophobicContact CB-CE2 3.96Å; R63-F343 HydrophobicContact CB-CZ 3.9Å; R63-F343 HydrophobicContact CG-CE2 4.29Å; R63-F343 HydrophobicContact CG-CZ 3.77Å; R63-F343 VanDerWaalsContact NE-CZ 3.32Å; R63-E346 IonicContact NH1-OE2 2.99Å; R63-E346 PolarHBondContact NH1-OE2 2.9Å; R63-Y374 WeakPolarHBondContact CA-O 3.44Å
64	F	82	Confident	84.2	Confident	64 Å²	64	47.7 Å²	47.7	28%	0.281	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	-175.8	165.3	67.7	-81.3	0	0	0	110.1	Y374 L376	F64-Y374 HydrophobicContact CD1-CD1 4.1Å; F64-Y374 AromaticContact CE1-CD1 3.03Å; F64-Y374 HydrophobicContact CE1-CD1 3.03Å; F64-Y374 AromaticContact CE1-CE1 3.68Å; F64-Y374 HydrophobicContact CE1-CE1 3.68Å; F64-Y374 AromaticContact CE1-CG 3.85Å; F64-Y374 HydrophobicContact CE1-CG 3.85Å; F64-Y374 AromaticContact CE2-CD1 3.86Å; F64-Y374 HydrophobicContact CE2-CD1 3.86Å; F64-Y374 AromaticContact CE2-CG 3.96Å; F64-Y374 HydrophobicContact CE2-CG 3.96Å; F64-Y374 AromaticContact CZ-CD1 2.88Å; F64-Y374 HydrophobicContact CZ-CD1 2.88Å; F64-Y374 HydrophobicContact CZ-CD2 4.39Å; F64-Y374 AromaticContact CZ-CE1 3.42Å; F64-Y374 HydrophobicContact CZ-CE1 3.42Å; F64-Y374 VanDerWaalsContact CZ-CE1 3.42Å; F64-Y374 AromaticContact CZ-CG 3.43Å; F64-Y374 HydrophobicContact CZ-CG 3.43Å; F64-Y374 VanDerWaalsContact CZ-CG 3.43Å; F64-Y374 PolarHBondContact N-O 2.74Å; F64-Y374 PolarHBondContact O-N 2.74Å; F64-L376 HydrophobicContact CD1-CB 4.15Å; F64-L376 HydrophobicContact CD1-CD1 3.89Å; F64-L376 HydrophobicContact CD1-CG 4.11Å; F64-L376 HydrophobicContact CE1-CB 3.57Å; F64-L376 HydrophobicContact CE1-CD1 3.25Å; F64-L376 HydrophobicContact CE1-CG 3.19Å; F64-L376 HydrophobicContact CE2-CD1 4.47Å; F64-L376 HydrophobicContact CZ-CD1 3.56Å; F64-L376 HydrophobicContact CZ-CG 3.66Å
65	Y	85.4	Confident	85.7	Confident	51 Å²	51	42.7 Å²	42.7	20%	0.2	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.7	-178.7	-56.6	-91.6	0	0	0	109.6	F37 R41 F348 C372 T373	F37-Y65 HydrophobicContact CB-CE1 4.04Å; F37-Y65 HydrophobicContact CD1-CD1 4.44Å; F37-Y65 HydrophobicContact CD1-CE1 4.27Å; F37-Y65 AromaticContact CD2-CD1 3.43Å; F37-Y65 HydrophobicContact CD2-CD1 3.43Å; F37-Y65 VanDerWaalsContact CD2-CD1 3.43Å; F37-Y65 AromaticContact CD2-CD2 3.54Å; F37-Y65 HydrophobicContact CD2-CD2 3.54Å; F37-Y65 AromaticContact CD2-CE1 3.31Å; F37-Y65 HydrophobicContact CD2-CE1 3.31Å; F37-Y65 AromaticContact CD2-CE2 3.45Å; F37-Y65 HydrophobicContact CD2-CE2 3.45Å; F37-Y65 VanDerWaalsContact CD2-CE2 3.45Å; F37-Y65 AromaticContact CD2-CG 3.54Å; F37-Y65 HydrophobicContact CD2-CG 3.54Å; F37-Y65 AromaticContact CD2-CZ 3.34Å; F37-Y65 HydrophobicContact CE1-CD1 4.41Å; F37-Y65 AromaticContact CE2-CD1 3.35Å; F37-Y65 HydrophobicContact CE2-CD1 3.35Å; F37-Y65 AromaticContact CE2-CD2 3.53Å; F37-Y65 HydrophobicContact CE2-CD2 3.53Å; F37-Y65 AromaticContact CE2-CE1 3.78Å; F37-Y65 HydrophobicContact CE2-CE1 3.78Å; F37-Y65 AromaticContact CE2-CE2 3.97Å; F37-Y65 HydrophobicContact CE2-CE2 3.97Å; F37-Y65 AromaticContact CE2-CG 3.2Å; F37-Y65 HydrophobicContact CE2-CG 3.2Å; F37-Y65 HydrophobicContact CG-CD1 4.02Å; F37-Y65 AromaticContact CG-CE1 3.62Å; F37-Y65 HydrophobicContact CG-CE1 3.62Å; F37-Y65 HydrophobicContact CG-CE2 4.37Å; F37-Y65 AromaticContact CG-CZ 3.83Å; F37-Y65 AromaticContact CZ-CD1 3.9Å; F37-Y65 HydrophobicContact CZ-CD1 3.9Å; F37-Y65 HydrophobicContact CZ-CE1 4.47Å; F37-Y65 HydrophobicContact CZ-CG 4.02Å; R41-Y65 PolarHBondContact NH2-OH 2.73Å; Y65-F348 HydrophobicContact CD1-CE2 4.47Å; Y65-F348 AromaticContact CE1-CE2 3.97Å; Y65-F348 HydrophobicContact CE1-CE2 3.97Å; Y65-C372 VanDerWaalsContact CA-O 3.22Å; Y65-C372 WeakPolarHBondContact CA-O 2.95Å; Y65-T373 HydrophobicContact CD1-CG2 4.04Å; Y65-T373 HydrophobicContact CE1-CG2 3.59Å
66	W	92.2	Very high	87.1	Confident	17 Å²	17	42.2 Å²	42.2	6%	0.064	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	156.4	169.2	66	-74.4	0	0	0	109	I68 D101 M102 V206 Y247 F249 A371 C372	W66-I68 HydrophobicContact CE3-CB 4.3Å; W66-I68 HydrophobicContact CH2-CB 4.16Å; W66-I68 HydrophobicContact CH2-CD1 4.32Å; W66-I68 HydrophobicContact CH2-CG2 4.2Å; W66-I68 HydrophobicContact CZ3-CB 3.62Å; W66-I68 HydrophobicContact CZ3-CD1 4.18Å; W66-I68 HydrophobicContact CZ3-CG1 4.34Å; W66-I68 HydrophobicContact CZ3-CG2 4.13Å; W66-D101 WeakPolarHBondContact CA-OD2 3.35Å; W66-D101 HydrophobicContact CB-CB 4.49Å; W66-M102 HydrophobicContact CZ3-CB 4.18Å; W66-M102 HydrophobicContact CZ3-CE 4.22Å; W66-M102 HydrophobicContact CZ3-SD 4.21Å; W66-V206 HydrophobicContact CH2-CG1 3.83Å; W66-V206 HydrophobicContact CH2-CG2 4.01Å; W66-V206 HydrophobicContact CZ2-CG1 4.36Å; W66-V206 HydrophobicContact CZ2-CG2 3.82Å; W66-Y247 HydrophobicContact CZ2-CD2 4.32Å; W66-F249 HydrophobicContact CH2-CE2 4.37Å; W66-A371 CarbonylContact O-C 3.59Å; W66-A371 WeakPolarHBondContact O-CA 3.42Å; W66-C372 HydrophobicContact CD2-CB 4.17Å; W66-C372 VanDerWaalsContact CE2-CB 3.43Å; W66-C372 HydrophobicContact CG-CB 4.35Å; W66-C372 HydrophobicContact CZ2-CB 3.75Å; W66-C372 PolarHBondContact N-O 2.7Å; W66-C372 VanDerWaalsContact N-O 3.08Å; W66-C372 PolarHBondContact O-N 2.81Å
67	K	94.8	Very high	88.1	Confident	14 Å²	14	41.3 Å²	41.3	6%	0.061	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.3	-176.3	-61.8	172.7	-170.2	166.5	0	111.1	N99 F100 D101 M102 M350 F370 A371	K67-N99 WeakPolarHBondContact CD-O 3.48Å; K67-N99 VanDerWaalsContact NZ-CG 3.28Å; K67-N99 PolarHBondContact NZ-ND2 2.85Å; K67-N99 VanDerWaalsContact NZ-ND2 3.1Å; K67-N99 PolarHBondContact NZ-OD1 3.28Å; K67-F100 HydrophobicContact CB-CD1 3.74Å; K67-F100 HydrophobicContact CB-CE1 4.38Å; K67-D101 PolarHBondContact N-OD2 3.24Å; K67-D101 PolarHBondContact O-N 3.3Å; K67-M102 PolarHBondContact O-N 3.24Å; K67-M102 VanDerWaalsContact O-N 3.13Å; K67-M350 HydrophobicContact CD-CE 4.33Å; K67-M350 HydrophobicContact CD-SD 4.31Å; K67-M350 HydrophobicContact CG-SD 4.27Å; K67-F370 CarbonylContact C-O 3.44Å; K67-F370 VanDerWaalsContact CA-O 3.3Å; K67-F370 WeakPolarHBondContact CA-O 3.46Å; K67-A371 HydrophobicContact CG-CB 4.24Å
68	I	97.9	Very high	88.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.8	172.5	-172	169.7	0	0	0	110.6	W66 I70 M102 L208 F249 F370	W66-I68 HydrophobicContact CE3-CB 4.3Å; W66-I68 HydrophobicContact CH2-CB 4.16Å; W66-I68 HydrophobicContact CH2-CD1 4.32Å; W66-I68 HydrophobicContact CH2-CG2 4.2Å; W66-I68 HydrophobicContact CZ3-CB 3.62Å; W66-I68 HydrophobicContact CZ3-CD1 4.18Å; W66-I68 HydrophobicContact CZ3-CG1 4.34Å; W66-I68 HydrophobicContact CZ3-CG2 4.13Å; I68-I70 HydrophobicContact CD1-CD1 4.21Å; I68-I70 HydrophobicContact CD1-CG1 4.1Å; I68-I70 HydrophobicContact CG1-CG1 4.01Å; I68-M102 VanDerWaalsContact CA-O 3.3Å; I68-M102 WeakPolarHBondContact CA-O 3.5Å; I68-M102 HydrophobicContact CB-CB 4.45Å; I68-M102 HydrophobicContact CD1-CB 4.47Å; I68-M102 HydrophobicContact CD1-CG 4.16Å; I68-M102 HydrophobicContact CD1-SD 3.76Å; I68-M102 HydrophobicContact CG1-CB 4.15Å; I68-M102 HydrophobicContact CG1-CG 4.24Å; I68-M102 HydrophobicContact CG1-SD 4.45Å; I68-L208 HydrophobicContact CD1-CD2 3.68Å; I68-F249 HydrophobicContact CD1-CD2 4.45Å; I68-F249 HydrophobicContact CD1-CE2 4.47Å; I68-F249 HydrophobicContact CG2-CE1 4.08Å; I68-F249 HydrophobicContact CG2-CE2 4.14Å; I68-F249 HydrophobicContact CG2-CZ 3.71Å; I68-F370 HydrophobicContact CG2-CB 3.89Å; I68-F370 HydrophobicContact CG2-CD2 4.15Å; I68-F370 HydrophobicContact CG2-CG 4.5Å; I68-F370 PolarHBondContact N-O 2.89Å; I68-F370 PolarHBondContact O-N 3.46Å
69	Q	97.9	Very high	89.4	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.019	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137	166.1	-171	170.1	74.6	0	0	109.9	Y91 F100 M102 V103 A104 L367 G368 S369	Q69-Y91 VanDerWaalsContact OE1-CE1 3.31Å; Q69-Y91 PolarHBondContact OE1-OH 3.16Å; Q69-F100 HydrophobicContact CB-CD1 3.76Å; Q69-F100 HydrophobicContact CB-CD2 4.14Å; Q69-F100 HydrophobicContact CB-CE1 3.92Å; Q69-F100 HydrophobicContact CB-CE2 4.28Å; Q69-F100 HydrophobicContact CB-CG 3.88Å; Q69-F100 HydrophobicContact CB-CZ 4.18Å; Q69-F100 HydrophobicContact CG-CZ 4.43Å; Q69-M102 PolarHBondContact N-O 2.79Å; Q69-V103 HydrophobicContact CB-CG1 4.41Å; Q69-V103 HydrophobicContact CB-CG2 4.35Å; Q69-V103 CarbonylContact O-C 3.59Å; Q69-V103 VanDerWaalsContact O-CA 3.27Å; Q69-V103 WeakPolarHBondContact O-CA 3.39Å; Q69-A104 PolarHBondContact O-N 3.4Å; Q69-L367 HydrophobicContact CG-CD1 3.59Å; Q69-L367 HydrophobicContact CG-CG 4.1Å; Q69-G368 CarbonylContact C-O 3.59Å; Q69-G368 WeakPolarHBondContact CA-O 3.36Å; Q69-S369 PolarHBondContact NE2-OG 3.02Å; Q69-S369 VanDerWaalsContact NE2-OG 3.12Å
70	I	98.8	Very high	89.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.8	-178.4	-56.6	-175.6	0	0	0	107.5	I68 A104 F249 F251 I329 L367 G368 F370	I68-I70 HydrophobicContact CD1-CD1 4.21Å; I68-I70 HydrophobicContact CD1-CG1 4.1Å; I68-I70 HydrophobicContact CG1-CG1 4.01Å; I70-A104 CarbonylContact C-O 3.59Å; I70-A104 WeakPolarHBondContact CA-O 3.48Å; I70-A104 HydrophobicContact CG1-CB 4.28Å; I70-F249 HydrophobicContact CD1-CB 3.39Å; I70-F249 HydrophobicContact CD1-CD1 3.42Å; I70-F249 VanDerWaalsContact CD1-CD1 3.42Å; I70-F249 HydrophobicContact CD1-CD2 4.35Å; I70-F249 HydrophobicContact CD1-CE1 4.28Å; I70-F249 HydrophobicContact CD1-CG 3.47Å; I70-F249 VanDerWaalsContact CD1-CG 3.47Å; I70-F251 HydrophobicContact CD1-CD1 4.22Å; I70-F251 HydrophobicContact CD1-CE1 4.3Å; I70-F251 HydrophobicContact CG2-CB 4.03Å; I70-F251 HydrophobicContact CG2-CD1 3.52Å; I70-F251 HydrophobicContact CG2-CD2 3.73Å; I70-F251 HydrophobicContact CG2-CE1 3.82Å; I70-F251 HydrophobicContact CG2-CE2 3.98Å; I70-F251 HydrophobicContact CG2-CG 3.48Å; I70-F251 VanDerWaalsContact CG2-CG 3.48Å; I70-F251 HydrophobicContact CG2-CZ 4.03Å; I70-I329 HydrophobicContact CB-CD1 4.29Å; I70-I329 HydrophobicContact CB-CG2 4.43Å; I70-I329 HydrophobicContact CD1-CG2 4.36Å; I70-I329 HydrophobicContact CG2-CD1 4.12Å; I70-I329 HydrophobicContact CG2-CG1 4.44Å; I70-I329 HydrophobicContact CG2-CG2 4.29Å; I70-I329 WeakPolarHBondContact O-CD1 3.45Å; I70-L367 CarbonylContact O-C 3.51Å; I70-L367 WeakPolarHBondContact O-CA 3.4Å; I70-G368 PolarHBondContact N-O 2.88Å; I70-G368 PolarHBondContact O-N 2.81Å; I70-F370 HydrophobicContact CD1-CD2 4.37Å; I70-F370 HydrophobicContact CD1-CE2 4.12Å; I70-F370 HydrophobicContact CG1-CE2 4.34Å
71	L	98.4	Very high	90.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.9	171.9	173.7	63.9	0	0	0	108.2	F90 A104 V105 G106 F133 P365 L366 L367	L71-F90 HydrophobicContact CD1-CD1 4.47Å; L71-F90 HydrophobicContact CD1-CE1 3.71Å; L71-F90 HydrophobicContact CD1-CE2 4.2Å; L71-F90 HydrophobicContact CD1-CZ 3.55Å; L71-F90 HydrophobicContact CD2-CD2 4.22Å; L71-F90 HydrophobicContact CD2-CE1 4.43Å; L71-F90 HydrophobicContact CD2-CE2 3.41Å; L71-F90 VanDerWaalsContact CD2-CE2 3.41Å; L71-F90 HydrophobicContact CD2-CZ 3.54Å; L71-F90 HydrophobicContact CG-CE2 4.45Å; L71-F90 HydrophobicContact CG-CZ 4.22Å; L71-A104 PolarHBondContact N-O 3.37Å; L71-V105 HydrophobicContact CB-CG1 4.48Å; L71-V105 HydrophobicContact CB-CG2 4.34Å; L71-V105 HydrophobicContact CD2-CG1 4.01Å; L71-V105 HydrophobicContact CD2-CG2 4.38Å; L71-V105 HydrophobicContact CG-CG1 4.38Å; L71-V105 WeakPolarHBondContact O-CA 3.46Å; L71-G106 PolarHBondContact O-N 3.06Å; L71-F133 HydrophobicContact CD2-CE1 3.53Å; L71-F133 HydrophobicContact CD2-CZ 3.53Å; L71-P365 HydrophobicContact CD1-CB 4.02Å; L71-L366 WeakPolarHBondContact CA-O 3.27Å; L71-L367 HydrophobicContact CB-CD1 4.09Å; L71-L367 HydrophobicContact CD1-CD1 4.27Å
72	T	98.5	Very high	91	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.9	166.5	-172.3	0	0	0	0	111.4	G106 Q108 G252 D327 I329 L366	T72-G106 CarbonylContact C-O 3.48Å; T72-G106 VanDerWaalsContact CA-O 3.23Å; T72-G106 WeakPolarHBondContact CA-O 3.41Å; T72-Q108 PolarHBondContact OG1-NE2 3.48Å; T72-Q108 VanDerWaalsContact OG1-NE2 3.11Å; T72-Q108 PolarHBondContact OG1-OE1 2.96Å; T72-G252 WeakPolarHBondContact OG1-CA 3.32Å; T72-G252 PolarHBondContact OG1-N 2.77Å; T72-D327 HydrophobicContact CG2-CB 4.32Å; T72-I329 HydrophobicContact CG2-CD1 4.34Å; T72-I329 HydrophobicContact CG2-CG1 4.02Å; T72-L366 HydrophobicContact CG2-CB 3.85Å; T72-L366 HydrophobicContact CG2-CD2 4.08Å; T72-L366 HydrophobicContact CG2-CG 4.31Å; T72-L366 PolarHBondContact N-O 2.91Å; T72-L366 PolarHBondContact O-N 3.17Å
73	Y	97.9	Very high	91.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	118.8	179.2	-175.1	-150.7	0	0	0	113	V75 F85 G106 L107 Q108 W129 V358 C360 S361 H363 P365	Y73-V75 HydrophobicContact CD1-CG1 3.58Å; Y73-V75 HydrophobicContact CE1-CG1 3.83Å; Y73-V75 HydrophobicContact CG-CG1 4.11Å; Y73-V75 PolarHBondContact O-N 2.85Å; Y73-F85 HydrophobicContact CD1-CE2 4.31Å; Y73-F85 HydrophobicContact CD1-CZ 4.43Å; Y73-F85 HydrophobicContact CE1-CD2 4.46Å; Y73-F85 HydrophobicContact CE1-CE2 4.22Å; Y73-G106 PolarHBondContact N-O 3.33Å; Y73-L107 WeakPolarHBondContact O-CA 3.11Å; Y73-Q108 VanDerWaalsContact C-OE1 3.29Å; Y73-Q108 PolarHBondContact O-N 2.8Å; Y73-Q108 VanDerWaalsContact O-N 3.12Å; Y73-Q108 PolarHBondContact O-OE1 2.65Å; Y73-W129 HydrophobicContact CD1-CH2 4.31Å; Y73-W129 HydrophobicContact CD1-CZ3 4.27Å; Y73-W129 AromaticContact CE1-CH2 3.89Å; Y73-W129 HydrophobicContact CE1-CH2 3.89Å; Y73-W129 HydrophobicContact CE1-CZ3 4.26Å; Y73-V358 HydrophobicContact CE1-CG1 4.3Å; Y73-V358 WeakPolarHBondContact OH-CG1 3.47Å; Y73-C360 PolarHBondContact OH-SG 3.3Å; Y73-C360 VanDerWaalsContact OH-SG 3.36Å; Y73-S361 WeakPolarHBondContact OH-CB 3.14Å; Y73-S361 PolarHBondContact OH-N 3.39Å; Y73-H363 HydrophobicContact CE2-CB 4.35Å; Y73-H363 WeakPolarHBondContact CE2-O 3.29Å; Y73-P365 HydrophobicContact CD1-CB 4.43Å; Y73-P365 HydrophobicContact CD1-CG 3.92Å; Y73-P365 HydrophobicContact CD2-CB 4.13Å; Y73-P365 HydrophobicContact CD2-CG 3.79Å; Y73-P365 HydrophobicContact CE1-CG 3.97Å; Y73-P365 HydrophobicContact CE2-CG 3.86Å; Y73-P365 HydrophobicContact CG-CB 4.02Å; Y73-P365 HydrophobicContact CG-CG 3.83Å
74	S	97.1	Very high	91.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	114.1	164.9	-177.8	0	0	0	0	110.8	Q108 D109 S361	S74-Q108 CarbonylContact C-O 3.58Å; S74-Q108 WeakPolarHBondContact CA-O 3.4Å; S74-D109 PolarHBondContact OG-OD2 3.28Å; S74-S361 WeakPolarHBondContact O-CB 3.43Å; S74-S361 PolarHBondContact O-OG 2.95Å
75	V	95.5	Very high	92.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.203	C	C	.	.			trans	-92.8	7	-172	-52.7	0	0	0	0	113.8	Y73 N77 A78 L107 Q108 D109 V110 W129	Y73-V75 HydrophobicContact CD1-CG1 3.58Å; Y73-V75 HydrophobicContact CE1-CG1 3.83Å; Y73-V75 HydrophobicContact CG-CG1 4.11Å; Y73-V75 PolarHBondContact O-N 2.85Å; V75-N77 PolarHBondContact O-N 3.14Å; V75-A78 HydrophobicContact CB-CB 4.37Å; V75-A78 HydrophobicContact CG2-CB 4.49Å; V75-A78 WeakPolarHBondContact O-CB 3.21Å; V75-A78 PolarHBondContact O-N 3.03Å; V75-L107 HydrophobicContact CG1-CD2 4.28Å; V75-Q108 PolarHBondContact N-O 3.42Å; V75-D109 VanDerWaalsContact CG2-O 3.24Å; V75-D109 WeakPolarHBondContact CG2-O 3.16Å; V75-V110 HydrophobicContact CG2-CB 4.24Å; V75-V110 HydrophobicContact CG2-CG2 3.87Å; V75-W129 HydrophobicContact CB-CH2 4.14Å; V75-W129 HydrophobicContact CB-CZ2 3.67Å; V75-W129 HydrophobicContact CG1-CD2 4.22Å; V75-W129 HydrophobicContact CG1-CE3 4.22Å; V75-W129 HydrophobicContact CG1-CH2 3.63Å; V75-W129 HydrophobicContact CG1-CZ2 3.6Å; V75-W129 HydrophobicContact CG1-CZ3 3.93Å; V75-W129 HydrophobicContact CG2-CZ2 4.25Å
76	N	93.2	Very high	92.5	Very high	59 Å²	59	37.5 Å²	37.5	32%	0.316	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	50.3	173	-172.2	38.5	0	0	0	114.3	A78 S361 N362	N76-A78 PolarHBondContact O-N 3.14Å; N76-A78 VanDerWaalsContact O-N 3.16Å; N76-S361 VanDerWaalsContact CB-OG 3.27Å; N76-S361 WeakPolarHBondContact CB-OG 3.48Å; N76-N362 VanDerWaalsContact CB-OD1 3.3Å; N76-N362 WeakPolarHBondContact CB-OD1 3.27Å
77	N	89.7	Confident	92.6	Very high	89 Å²	89	36.7 Å²	36.7	48%	0.476	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	21.8	-179.2	-59.5	-68.6	0	0	0	114.5	V75 V79 D109	V75-N77 PolarHBondContact O-N 3.14Å; N77-V79 PolarHBondContact O-N 2.77Å; N77-D109 WeakPolarHBondContact CA-O 3.25Å; N77-D109 PolarHBondContact N-O 3.33Å
78	A	87.7	Confident	92.5	Very high	20 Å²	20	38.2 Å²	38.2	17%	0.165	22%	0.218	C	C	.	.			trans	-64.4	121	172.9	0	0	0	0	0	110.6	V75 N76 K80 W129	V75-A78 HydrophobicContact CB-CB 4.37Å; V75-A78 HydrophobicContact CG2-CB 4.49Å; V75-A78 WeakPolarHBondContact O-CB 3.21Å; V75-A78 PolarHBondContact O-N 3.03Å; N76-A78 PolarHBondContact O-N 3.14Å; N76-A78 VanDerWaalsContact O-N 3.16Å; A78-K80 VanDerWaalsContact C-N 3.27Å; A78-K80 PolarHBondContact O-N 2.91Å; A78-W129 HydrophobicContact CB-CZ2 4.08Å; A78-W129 PolarHBondContact O-NE1 2.87Å
79	V	85.5	Confident	92.2	Very high	86 Å²	86	40.2 Å²	40.2	52%	0.521	23%	0.229	S	C	.	.	S	Bend	trans	-62	-37.1	179	-178.6	0	0	0	0	111.9	N77 Y111	N77-V79 PolarHBondContact O-N 2.77Å; V79-Y111 HydrophobicContact CB-CD1 4.45Å; V79-Y111 HydrophobicContact CB-CG 4.44Å; V79-Y111 HydrophobicContact CG1-CD1 4.33Å; V79-Y111 HydrophobicContact CG2-CD1 3.84Å; V79-Y111 HydrophobicContact CG2-CD2 4.02Å; V79-Y111 HydrophobicContact CG2-CE1 4.2Å; V79-Y111 HydrophobicContact CG2-CE2 4.39Å; V79-Y111 HydrophobicContact CG2-CG 3.72Å
80	K	88.6	Confident	91.9	Very high	146 Å²	146	40.3 Å²	40.3	64%	0.635	23%	0.229	S	C	*	.	S	Bend	trans	-145.3	158	179.3	64	176.3	-179.2	177.9	0	110.3	A78 P128	A78-K80 VanDerWaalsContact C-N 3.27Å; A78-K80 PolarHBondContact O-N 2.91Å; K80-P128 HydrophobicContact CB-CB 3.76Å; K80-P128 HydrophobicContact CB-CG 4.13Å
81	P	90.4	Very high	91.6	Very high	25 Å²	25	41.1 Å²	41.1	16%	0.162	23%	0.232	C	C	.	.			trans	-52.6	141	167.9	-23.4	31.9	0	0	0	111.9	F85 W129 M132	P81-F85 HydrophobicContact CB-CD1 4.2Å; P81-W129 HydrophobicContact CB-CE3 4.43Å; P81-W129 HydrophobicContact CB-CH2 4.2Å; P81-W129 HydrophobicContact CB-CZ2 4.36Å; P81-W129 HydrophobicContact CB-CZ3 4.25Å; P81-W129 HydrophobicContact CG-CD2 3.68Å; P81-W129 HydrophobicContact CG-CE3 3.71Å; P81-W129 HydrophobicContact CG-CG 4.16Å; P81-W129 HydrophobicContact CG-CH2 4.28Å; P81-W129 HydrophobicContact CG-CZ2 4.26Å; P81-W129 HydrophobicContact CG-CZ3 4.03Å; P81-M132 HydrophobicContact CB-CE 3.27Å; P81-M132 HydrophobicContact CG-CE 3.19Å
82	S	87	Confident	90.8	Very high	32 Å²	32	45.9 Å²	45.9	22%	0.224	26%	0.263	C	S	.	.			trans	-74.9	163.1	170.5	55.4	0	0	0	0	111.4	D84 F85 C360	S82-D84 WeakPolarHBondContact CB-OD1 3.35Å; S82-D84 PolarHBondContact O-N 2.85Å; S82-D84 PolarHBondContact OG-OD1 2.78Å; S82-F85 PolarHBondContact O-N 3.16Å; S82-C360 WeakPolarHBondContact OG-CB 3.27Å; S82-C360 PolarHBondContact OG-SG 2.81Å
83	A	83.5	Confident	89.9	Confident	116 Å²	116	52.3 Å²	52.3	96%	0.959	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.5	-177.5	0	0	0	0	0	113.8	F85	A83-F85 VanDerWaalsContact C-N 3.34Å
84	D	81.5	Confident	89	Confident	82 Å²	82	54.8 Å²	54.8	44%	0.439	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-7.8	175.9	63.9	-43.6	0	0	0	113.4	S82 G359	S82-D84 WeakPolarHBondContact CB-OD1 3.35Å; S82-D84 PolarHBondContact O-N 2.85Å; S82-D84 PolarHBondContact OG-OD1 2.78Å; D84-G359 PolarHBondContact OD2-N 2.84Å; D84-G359 VanDerWaalsContact OD2-N 3.1Å
85	F	92.2	Very high	88	Confident	5 Å²	5	57 Å²	57	2%	0.022	33%	0.329	C	S	.	.			trans	-108.2	113.1	179.4	-174.7	-89.3	0	0	0	111.5	Y73 P81 S82 A83 I89 F90 W129 M132 F133 V358 P365	Y73-F85 HydrophobicContact CD1-CE2 4.31Å; Y73-F85 HydrophobicContact CD1-CZ 4.43Å; Y73-F85 HydrophobicContact CE1-CD2 4.46Å; Y73-F85 HydrophobicContact CE1-CE2 4.22Å; P81-F85 HydrophobicContact CB-CD1 4.2Å; S82-F85 PolarHBondContact O-N 3.16Å; A83-F85 VanDerWaalsContact C-N 3.34Å; F85-I89 HydrophobicContact CD2-CD1 3.9Å; F85-I89 HydrophobicContact CE2-CD1 3.85Å; F85-F90 HydrophobicContact CE2-CE2 4.45Å; F85-F90 AromaticContact CE2-CZ 3.82Å; F85-F90 HydrophobicContact CE2-CZ 3.82Å; F85-F90 HydrophobicContact CZ-CE2 4.05Å; F85-F90 AromaticContact CZ-CZ 3.79Å; F85-F90 HydrophobicContact CZ-CZ 3.79Å; F85-W129 HydrophobicContact CD1-CH2 4.13Å; F85-W129 AromaticContact CD1-CZ3 3.67Å; F85-W129 HydrophobicContact CD1-CZ3 3.67Å; F85-W129 HydrophobicContact CE1-CE3 4.32Å; F85-W129 HydrophobicContact CE1-CH2 4.35Å; F85-W129 AromaticContact CE1-CZ3 3.51Å; F85-W129 HydrophobicContact CE1-CZ3 3.51Å; F85-W129 HydrophobicContact CG-CZ3 4.47Å; F85-W129 HydrophobicContact CZ-CZ3 4.14Å; F85-M132 HydrophobicContact CD1-CE 3.31Å; F85-M132 HydrophobicContact CD1-SD 4.47Å; F85-M132 HydrophobicContact CE1-CE 3.48Å; F85-M132 VanDerWaalsContact CE1-CE 3.48Å; F85-M132 HydrophobicContact CE1-SD 4.12Å; F85-F133 HydrophobicContact CE1-CE2 4.43Å; F85-F133 AromaticContact CE1-CZ 3.89Å; F85-F133 HydrophobicContact CE1-CZ 3.89Å; F85-F133 AromaticContact CZ-CZ 3.92Å; F85-F133 HydrophobicContact CZ-CZ 3.92Å; F85-V358 HydrophobicContact CB-CG1 4.44Å; F85-V358 HydrophobicContact CD2-CB 4.3Å; F85-V358 HydrophobicContact CD2-CG1 3.56Å; F85-V358 HydrophobicContact CD2-CG2 3.72Å; F85-V358 HydrophobicContact CE2-CG1 4.3Å; F85-V358 HydrophobicContact CE2-CG2 4.23Å; F85-V358 HydrophobicContact CG-CG1 4.38Å; F85-P365 HydrophobicContact CE2-CG 3.97Å
86	Y	94.2	Very high	87.1	Confident	93 Å²	93	62.5 Å²	62.5	37%	0.365	36%	0.358	S	S	.	.			trans	-144.7	146.8	168.7	-164.1	-109.5	0	0	0	109.8	T88 I89 M132 F136	Y86-T88 HydrophobicContact CD1-CG2 3.65Å; Y86-T88 HydrophobicContact CE1-CG2 3.89Å; Y86-T88 PolarHBondContact O-N 2.89Å; Y86-I89 WeakPolarHBondContact O-CG1 3.32Å; Y86-I89 WeakPolarHBondContact O-CG2 3.48Å; Y86-I89 PolarHBondContact O-N 2.97Å; Y86-I89 VanDerWaalsContact O-N 3.14Å; Y86-M132 HydrophobicContact CD2-CG 3.92Å; Y86-M132 HydrophobicContact CE2-CG 3.8Å; Y86-F136 HydrophobicContact CD1-CD2 4.39Å; Y86-F136 AromaticContact CE1-CD2 3.62Å; Y86-F136 HydrophobicContact CE1-CD2 3.62Å; Y86-F136 HydrophobicContact CE1-CE2 4.13Å; Y86-F136 AromaticContact CZ-CD2 3.94Å
87	P	94.7	Very high	86.4	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-65.1	-10.6	-169.3	-23.5	36.2	0	0	0	114.9	I89 F90 Y91 M132 F133 F136	P87-I89 PolarHBondContact O-N 3.19Å; P87-F90 HydrophobicContact CB-CD2 4.06Å; P87-F90 HydrophobicContact CB-CE2 4.21Å; P87-F90 WeakPolarHBondContact O-CD2 3.36Å; P87-F90 PolarHBondContact O-N 2.84Å; P87-F90 VanDerWaalsContact O-N 3.14Å; P87-Y91 WeakPolarHBondContact O-CD2 3.48Å; P87-M132 WeakPolarHBondContact CD-SD 3.21Å; P87-M132 HydrophobicContact CG-CG 4.29Å; P87-M132 HydrophobicContact CG-SD 3.39Å; P87-M132 WeakPolarHBondContact CG-SD 3.25Å; P87-F133 HydrophobicContact CB-CD1 4.24Å; P87-F133 HydrophobicContact CB-CE1 4.11Å; P87-F133 HydrophobicContact CG-CD1 3.68Å; P87-F133 HydrophobicContact CG-CE1 3.7Å; P87-F136 HydrophobicContact CB-CB 4.4Å; P87-F136 HydrophobicContact CB-CD1 3.54Å; P87-F136 HydrophobicContact CB-CD2 3.92Å; P87-F136 HydrophobicContact CB-CE1 3.65Å; P87-F136 HydrophobicContact CB-CE2 4.03Å; P87-F136 HydrophobicContact CB-CG 3.68Å; P87-F136 HydrophobicContact CB-CZ 3.9Å; P87-F136 HydrophobicContact CG-CB 4.05Å; P87-F136 HydrophobicContact CG-CD1 4.09Å; P87-F136 HydrophobicContact CG-CD2 4.23Å; P87-F136 HydrophobicContact CG-CG 3.85Å
88	T	92.6	Very high	86.2	Confident	46 Å²	46	65.4 Å²	65.4	28%	0.282	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-55.3	-28.5	171.2	47.1	0	0	0	0	113.1	Y86 F90 Y91 T95 F136	Y86-T88 HydrophobicContact CD1-CG2 3.65Å; Y86-T88 HydrophobicContact CE1-CG2 3.89Å; Y86-T88 PolarHBondContact O-N 2.89Å; T88-F90 PolarHBondContact O-N 2.72Å; T88-F90 VanDerWaalsContact O-N 3.13Å; T88-Y91 CarbonylContact O-C 3.54Å; T88-Y91 PolarHBondContact O-N 2.87Å; T88-T95 HydrophobicContact CG2-CG2 3.88Å; T88-F136 HydrophobicContact CG2-CE2 3.73Å
89	I	91.7	Very high	86.3	Confident	42 Å²	42	69.3 Å²	69.3	22%	0.215	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-57.8	-28.3	178.6	67.4	-178.6	0	0	0	112.5	F85 Y86 P87 Y91 F355 V358	F85-I89 HydrophobicContact CD2-CD1 3.9Å; F85-I89 HydrophobicContact CE2-CD1 3.85Å; Y86-I89 WeakPolarHBondContact O-CG1 3.32Å; Y86-I89 WeakPolarHBondContact O-CG2 3.48Å; Y86-I89 PolarHBondContact O-N 2.97Å; Y86-I89 VanDerWaalsContact O-N 3.14Å; P87-I89 PolarHBondContact O-N 3.19Å; I89-Y91 VanDerWaalsContact C-N 3.25Å; I89-Y91 PolarHBondContact O-N 3.25Å; I89-F355 HydrophobicContact CB-CD1 4.47Å; I89-F355 HydrophobicContact CD1-CD1 4.41Å; I89-F355 HydrophobicContact CG1-CD1 4.26Å; I89-F355 VanDerWaalsContact O-CE1 3.25Å; I89-F355 WeakPolarHBondContact O-CE1 2.9Å; I89-V358 HydrophobicContact CD1-CG2 3.47Å; I89-V358 VanDerWaalsContact CD1-CG2 3.47Å
90	F	92.2	Very high	86.8	Confident	5 Å²	5	66.2 Å²	66.2	2%	0.022	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-77.4	-11.4	179.3	-50.7	-54.6	0	0	0	113	L71 F85 P87 T88 F133 F355 P365 L367	L71-F90 HydrophobicContact CD1-CD1 4.47Å; L71-F90 HydrophobicContact CD1-CE1 3.71Å; L71-F90 HydrophobicContact CD1-CE2 4.2Å; L71-F90 HydrophobicContact CD1-CZ 3.55Å; L71-F90 HydrophobicContact CD2-CD2 4.22Å; L71-F90 HydrophobicContact CD2-CE1 4.43Å; L71-F90 HydrophobicContact CD2-CE2 3.41Å; L71-F90 VanDerWaalsContact CD2-CE2 3.41Å; L71-F90 HydrophobicContact CD2-CZ 3.54Å; L71-F90 HydrophobicContact CG-CE2 4.45Å; L71-F90 HydrophobicContact CG-CZ 4.22Å; F85-F90 HydrophobicContact CE2-CE2 4.45Å; F85-F90 AromaticContact CE2-CZ 3.82Å; F85-F90 HydrophobicContact CE2-CZ 3.82Å; F85-F90 HydrophobicContact CZ-CE2 4.05Å; F85-F90 AromaticContact CZ-CZ 3.79Å; F85-F90 HydrophobicContact CZ-CZ 3.79Å; P87-F90 HydrophobicContact CB-CD2 4.06Å; P87-F90 HydrophobicContact CB-CE2 4.21Å; P87-F90 WeakPolarHBondContact O-CD2 3.36Å; P87-F90 PolarHBondContact O-N 2.84Å; P87-F90 VanDerWaalsContact O-N 3.14Å; T88-F90 PolarHBondContact O-N 2.72Å; T88-F90 VanDerWaalsContact O-N 3.13Å; F90-F133 HydrophobicContact CE2-CE1 4.23Å; F90-F355 HydrophobicContact CB-CZ 4.48Å; F90-F355 HydrophobicContact CD1-CD1 4.05Å; F90-F355 AromaticContact CD1-CD2 3.81Å; F90-F355 HydrophobicContact CD1-CD2 3.81Å; F90-F355 AromaticContact CD1-CE1 3.78Å; F90-F355 HydrophobicContact CD1-CE1 3.78Å; F90-F355 AromaticContact CD1-CE2 3.55Å; F90-F355 HydrophobicContact CD1-CE2 3.55Å; F90-F355 HydrophobicContact CD1-CG 4.07Å; F90-F355 AromaticContact CD1-CZ 3.52Å; F90-F355 HydrophobicContact CD1-CZ 3.52Å; F90-F355 HydrophobicContact CE1-CD1 4.26Å; F90-F355 AromaticContact CE1-CD2 3.71Å; F90-F355 HydrophobicContact CE1-CD2 3.71Å; F90-F355 HydrophobicContact CE1-CE1 4.43Å; F90-F355 AromaticContact CE1-CE2 3.93Å; F90-F355 HydrophobicContact CE1-CE2 3.93Å; F90-F355 AromaticContact CE1-CG 3.91Å; F90-F355 HydrophobicContact CE1-CG 3.91Å; F90-F355 HydrophobicContact CE1-CZ 4.28Å; F90-F355 HydrophobicContact CG-CZ 4.48Å; F90-P365 HydrophobicContact CE1-CB 4.23Å; F90-P365 HydrophobicContact CZ-CB 4.4Å; F90-L367 HydrophobicContact CB-CD2 4.28Å; F90-L367 HydrophobicContact CD1-CD1 4.38Å; F90-L367 HydrophobicContact CD1-CD2 4.46Å; F90-L367 HydrophobicContact CG-CD1 4.47Å
91	Y	91.4	Very high	87.1	Confident	17 Å²	17	60.8 Å²	60.8	7%	0.067	33%	0.334	C	S	.	.			trans	-131.7	63.1	-173.9	-49.5	-78	0	0	0	112	Q69 P87 T88 I89 V93 T95 I98 F100 F136 Y137	Q69-Y91 VanDerWaalsContact OE1-CE1 3.31Å; Q69-Y91 PolarHBondContact OE1-OH 3.16Å; P87-Y91 WeakPolarHBondContact O-CD2 3.48Å; T88-Y91 CarbonylContact O-C 3.54Å; T88-Y91 PolarHBondContact O-N 2.87Å; I89-Y91 VanDerWaalsContact C-N 3.25Å; I89-Y91 PolarHBondContact O-N 3.25Å; Y91-V93 PolarHBondContact O-N 3.49Å; Y91-V93 VanDerWaalsContact O-N 3.14Å; Y91-T95 WeakPolarHBondContact O-CG2 3.23Å; Y91-I98 HydrophobicContact CD1-CG1 4.08Å; Y91-I98 HydrophobicContact CD2-CD1 4.22Å; Y91-I98 HydrophobicContact CD2-CG1 4.44Å; Y91-I98 HydrophobicContact CE1-CB 4.42Å; Y91-I98 HydrophobicContact CE1-CD1 4.05Å; Y91-I98 HydrophobicContact CE1-CG1 3.89Å; Y91-I98 HydrophobicContact CE1-CG2 3.85Å; Y91-I98 HydrophobicContact CE2-CD1 3.68Å; Y91-I98 HydrophobicContact CE2-CG1 4.25Å; Y91-I98 HydrophobicContact CG-CG1 4.33Å; Y91-F100 HydrophobicContact CE1-CD2 4.34Å; Y91-F100 HydrophobicContact CE1-CE2 4.26Å; Y91-F136 HydrophobicContact CD2-CE1 4Å; Y91-F136 AromaticContact CD2-CZ 3.67Å; Y91-F136 HydrophobicContact CD2-CZ 3.67Å; Y91-F136 AromaticContact CE2-CE1 3.54Å; Y91-F136 HydrophobicContact CE2-CE1 3.54Å; Y91-F136 AromaticContact CE2-CZ 3.72Å; Y91-F136 HydrophobicContact CE2-CZ 3.72Å; Y91-Y137 HydrophobicContact CE2-CE1 4.34Å; Y91-Y137 VanDerWaalsContact OH-CE1 3.32Å; Y91-Y137 WeakPolarHBondContact OH-CE1 3.34Å; Y91-Y137 PolarHBondContact OH-OH 2.88Å
92	P	81.8	Confident	87.5	Confident	101 Å²	101	59.9 Å²	59.9	66%	0.656	33%	0.328	S	S	*	.	S	Bend	trans	-66.7	-18	-173	26.9	-35.8	0	0	0	114.7
93	V	80	Confident	88	Confident	134 Å²	134	58.3 Å²	58.3	81%	0.812	32%	0.317	S	S	*	.	S	Bend	trans	-92.9	-52.4	-175.4	-179.2	0	0	0	0	112.2	Y91	Y91-V93 PolarHBondContact O-N 3.49Å; Y91-V93 VanDerWaalsContact O-N 3.14Å
94	D	78.6	Confident	88.7	Confident	52 Å²	52	52.8 Å²	52.8	28%	0.278	27%	0.271	S	S	.	.			trans	-140.8	101.5	177.6	-174.9	-15	0	0	0	108.5	N96 R97	D94-N96 PolarHBondContact O-N 2.84Å; D94-N96 WeakPolarHBondContact OD1-CA 3.44Å; D94-N96 WeakPolarHBondContact OD1-CB 3.49Å; D94-N96 PolarHBondContact OD1-N 2.69Å; D94-R97 PolarHBondContact OD1-N 2.83Å; D94-R97 WeakPolarHBondContact OD2-CB 3.44Å
95	T	76.6	Confident	89.5	Confident	47 Å²	47	48.9 Å²	48.9	29%	0.288	25%	0.251	S	S	.	.	S	Bend	trans	-76.9	-10.2	177.1	57.6	0	0	0	0	112.5	T88 Y91 R140	T88-T95 HydrophobicContact CG2-CG2 3.88Å; Y91-T95 WeakPolarHBondContact O-CG2 3.23Å; T95-R140 PolarHBondContact O-NE 2.67Å; T95-R140 PolarHBondContact O-NH2 3.01Å
96	N	77	Confident	89.8	Confident	116 Å²	116	48.7 Å²	48.7	62%	0.62	25%	0.25	S	C	*	.	S	Bend	trans	-96.5	-29.8	-175.6	-67.9	-25.3	0	0	0	112.2	D94	D94-N96 PolarHBondContact O-N 2.84Å; D94-N96 WeakPolarHBondContact OD1-CA 3.44Å; D94-N96 WeakPolarHBondContact OD1-CB 3.49Å; D94-N96 PolarHBondContact OD1-N 2.69Å
97	R	78	Confident	90	Very high	199 Å²	199	44.3 Å²	44.3	75%	0.751	23%	0.232	S	C	*	.			trans	-116	89.8	179	-59.4	-179.6	176.3	-176.3	0.6	111.4	D94 N99	D94-R97 PolarHBondContact OD1-N 2.83Å; D94-R97 WeakPolarHBondContact OD2-CB 3.44Å; R97-N99 PolarHBondContact O-N 2.8Å
98	I	86.1	Confident	90.1	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.046	23%	0.232	C	C	.	.			trans	-74.5	107.6	172.4	-64.2	-179.1	0	0	0	108.8	Y91 F100 F136 Y137 R140 F142	Y91-I98 HydrophobicContact CD1-CG1 4.08Å; Y91-I98 HydrophobicContact CD2-CD1 4.22Å; Y91-I98 HydrophobicContact CD2-CG1 4.44Å; Y91-I98 HydrophobicContact CE1-CB 4.42Å; Y91-I98 HydrophobicContact CE1-CD1 4.05Å; Y91-I98 HydrophobicContact CE1-CG1 3.89Å; Y91-I98 HydrophobicContact CE1-CG2 3.85Å; Y91-I98 HydrophobicContact CE2-CD1 3.68Å; Y91-I98 HydrophobicContact CE2-CG1 4.25Å; Y91-I98 HydrophobicContact CG-CG1 4.33Å; I98-F100 HydrophobicContact CG2-CB 4.07Å; I98-F100 HydrophobicContact CG2-CD2 3.73Å; I98-F100 HydrophobicContact CG2-CG 4.4Å; I98-F100 PolarHBondContact O-N 2.82Å; I98-F136 HydrophobicContact CD1-CE1 3.63Å; I98-F136 HydrophobicContact CD1-CZ 4.16Å; I98-Y137 HydrophobicContact CD1-CD1 3.8Å; I98-Y137 HydrophobicContact CD1-CE1 3.75Å; I98-R140 HydrophobicContact CD1-CB 4.29Å; I98-R140 HydrophobicContact CD1-CG 4.42Å; I98-F142 HydrophobicContact CB-CE2 3.9Å; I98-F142 HydrophobicContact CB-CZ 4.22Å; I98-F142 HydrophobicContact CG2-CE2 3.91Å; I98-F142 HydrophobicContact CG2-CZ 3.76Å
99	N	89.1	Confident	90.2	Very high	103 Å²	103	44 Å²	44	55%	0.551	23%	0.229	S	C	*	.			trans	-83.8	53	-179.9	-169.4	6.8	0	0	0	112.2	K67 R97	K67-N99 WeakPolarHBondContact CD-O 3.48Å; K67-N99 VanDerWaalsContact NZ-CG 3.28Å; K67-N99 PolarHBondContact NZ-ND2 2.85Å; K67-N99 VanDerWaalsContact NZ-ND2 3.1Å; K67-N99 PolarHBondContact NZ-OD1 3.28Å; R97-N99 PolarHBondContact O-N 2.8Å
100	F	94.8	Very high	90.2	Very high	21 Å²	21	42.1 Å²	42.1	9%	0.092	22%	0.22	C	C	.	.			trans	-130.7	153.6	173.6	-67.3	-82.1	0	0	0	109.5	K67 Q69 Y91 I98 V103 F142 K165 S369	K67-F100 HydrophobicContact CB-CD1 3.74Å; K67-F100 HydrophobicContact CB-CE1 4.38Å; Q69-F100 HydrophobicContact CB-CD1 3.76Å; Q69-F100 HydrophobicContact CB-CD2 4.14Å; Q69-F100 HydrophobicContact CB-CE1 3.92Å; Q69-F100 HydrophobicContact CB-CE2 4.28Å; Q69-F100 HydrophobicContact CB-CG 3.88Å; Q69-F100 HydrophobicContact CB-CZ 4.18Å; Q69-F100 HydrophobicContact CG-CZ 4.43Å; Y91-F100 HydrophobicContact CE1-CD2 4.34Å; Y91-F100 HydrophobicContact CE1-CE2 4.26Å; I98-F100 HydrophobicContact CG2-CB 4.07Å; I98-F100 HydrophobicContact CG2-CD2 3.73Å; I98-F100 HydrophobicContact CG2-CG 4.4Å; I98-F100 PolarHBondContact O-N 2.82Å; F100-V103 HydrophobicContact CB-CG2 4.29Å; F100-F142 WeakPolarHBondContact O-CZ 3.32Å; F100-K165 WeakPolarHBondContact O-CE 3.17Å; F100-K165 PolarHBondContact O-NZ 3.05Å; F100-S369 WeakPolarHBondContact CZ-OG 3.39Å
101	D	95.7	Very high	90	Very high	31 Å²	31	46 Å²	46	17%	0.166	24%	0.235	C	C	.	.	S	Bend	trans	-98.8	-30.6	-178	-58.6	-46	0	0	0	111.1	W66 K67 K165 L168	W66-D101 WeakPolarHBondContact CA-OD2 3.35Å; W66-D101 HydrophobicContact CB-CB 4.49Å; K67-D101 PolarHBondContact N-OD2 3.24Å; K67-D101 PolarHBondContact O-N 3.3Å; D101-K165 PolarHBondContact O-N 2.53Å; D101-K165 IonicContact OD1-NZ 2.73Å; D101-K165 PolarHBondContact OD1-NZ 3.24Å; D101-L168 HydrophobicContact CB-CD1 3.51Å
102	M	98.1	Very high	89.3	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.03	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143.9	174.7	-173.5	179.9	-62.2	0	0	110.3	W66 K67 I68 Q69 V162 F163 V164 L198 I200 L208	W66-M102 HydrophobicContact CZ3-CB 4.18Å; W66-M102 HydrophobicContact CZ3-CE 4.22Å; W66-M102 HydrophobicContact CZ3-SD 4.21Å; K67-M102 PolarHBondContact O-N 3.24Å; K67-M102 VanDerWaalsContact O-N 3.13Å; I68-M102 VanDerWaalsContact CA-O 3.3Å; I68-M102 WeakPolarHBondContact CA-O 3.5Å; I68-M102 HydrophobicContact CB-CB 4.45Å; I68-M102 HydrophobicContact CD1-CB 4.47Å; I68-M102 HydrophobicContact CD1-CG 4.16Å; I68-M102 HydrophobicContact CD1-SD 3.76Å; I68-M102 HydrophobicContact CG1-CB 4.15Å; I68-M102 HydrophobicContact CG1-CG 4.24Å; I68-M102 HydrophobicContact CG1-SD 4.45Å; Q69-M102 PolarHBondContact N-O 2.79Å; M102-V162 HydrophobicContact CG-CG1 4.05Å; M102-V162 HydrophobicContact SD-CG1 4.09Å; M102-F163 CarbonylContact C-O 3.5Å; M102-F163 VanDerWaalsContact CA-O 3.3Å; M102-F163 WeakPolarHBondContact CA-O 3.13Å; M102-V164 HydrophobicContact CE-CG2 4.13Å; M102-V164 HydrophobicContact CG-CG2 4.23Å; M102-L198 HydrophobicContact CE-CD1 3.45Å; M102-L198 VanDerWaalsContact CE-CD1 3.45Å; M102-L198 HydrophobicContact SD-CD1 3.92Å; M102-I200 HydrophobicContact CE-CD1 3.97Å; M102-L208 HydrophobicContact SD-CD1 4.18Å
103	V	98.3	Very high	88.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	125	171	-175	0	0	0	0	109.3	Q69 F100 V105 Y137 F142 F163	Q69-V103 HydrophobicContact CB-CG1 4.41Å; Q69-V103 HydrophobicContact CB-CG2 4.35Å; Q69-V103 CarbonylContact O-C 3.59Å; Q69-V103 VanDerWaalsContact O-CA 3.27Å; Q69-V103 WeakPolarHBondContact O-CA 3.39Å; F100-V103 HydrophobicContact CB-CG2 4.29Å; V103-V105 HydrophobicContact CG1-CG2 4.23Å; V103-Y137 HydrophobicContact CB-CE1 4.29Å; V103-Y137 HydrophobicContact CG1-CE1 3.99Å; V103-Y137 HydrophobicContact CG1-CE2 4.11Å; V103-Y137 WeakPolarHBondContact CG1-OH 3.34Å; V103-Y137 HydrophobicContact CG2-CD1 4.47Å; V103-Y137 HydrophobicContact CG2-CE1 4.07Å; V103-F142 HydrophobicContact CG2-CD1 4.48Å; V103-F142 HydrophobicContact CG2-CE1 3.91Å; V103-F142 HydrophobicContact CG2-CZ 4.28Å; V103-F163 HydrophobicContact CB-CB 4.31Å; V103-F163 PolarHBondContact N-O 2.73Å; V103-F163 PolarHBondContact O-N 3.3Å
104	A	98.7	Very high	88.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	132	171.9	0	0	0	0	0	109.5	Q69 I70 L71 M161 L208 F251	Q69-A104 PolarHBondContact O-N 3.4Å; I70-A104 CarbonylContact C-O 3.59Å; I70-A104 WeakPolarHBondContact CA-O 3.48Å; I70-A104 HydrophobicContact CG1-CB 4.28Å; L71-A104 PolarHBondContact N-O 3.37Å; A104-M161 CarbonylContact C-O 3.47Å; A104-M161 WeakPolarHBondContact CA-O 3.18Å; A104-L208 HydrophobicContact CB-CD1 3.99Å; A104-L208 HydrophobicContact CB-CD2 4.48Å; A104-F251 HydrophobicContact CB-CZ 4.04Å
105	V	98.7	Very high	87.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	110.4	175.1	-177.9	0	0	0	0	108.6	L71 V103 L107 F133 Y137 M161 F163	L71-V105 HydrophobicContact CB-CG1 4.48Å; L71-V105 HydrophobicContact CB-CG2 4.34Å; L71-V105 HydrophobicContact CD2-CG1 4.01Å; L71-V105 HydrophobicContact CD2-CG2 4.38Å; L71-V105 HydrophobicContact CG-CG1 4.38Å; L71-V105 WeakPolarHBondContact O-CA 3.46Å; V103-V105 HydrophobicContact CG1-CG2 4.23Å; V105-L107 HydrophobicContact CG1-CD2 4.01Å; V105-L107 HydrophobicContact CG1-CG 4.18Å; V105-F133 HydrophobicContact CG1-CD1 4.38Å; V105-F133 HydrophobicContact CG1-CD2 3.99Å; V105-F133 HydrophobicContact CG1-CE1 4.18Å; V105-F133 HydrophobicContact CG1-CE2 3.78Å; V105-F133 HydrophobicContact CG1-CG 4.29Å; V105-F133 HydrophobicContact CG1-CZ 3.88Å; V105-F133 HydrophobicContact CG2-CD1 4.14Å; V105-F133 HydrophobicContact CG2-CE1 4.34Å; V105-F133 HydrophobicContact CG2-CG 4.44Å; V105-Y137 HydrophobicContact CG2-CE2 3.95Å; V105-M161 HydrophobicContact CB-CB 4.36Å; V105-M161 HydrophobicContact CB-CE 3.94Å; V105-M161 HydrophobicContact CG1-CE 3.69Å; V105-M161 PolarHBondContact N-O 2.93Å; V105-M161 PolarHBondContact O-N 3.37Å; V105-F163 HydrophobicContact CG2-CD2 4.39Å; V105-F163 HydrophobicContact CG2-CE2 4.06Å
106	G	98.4	Very high	86.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	119.6	173	0	0	0	0	0	111.2	L71 T72 Y73 Q108 V159 N210	L71-G106 PolarHBondContact O-N 3.06Å; T72-G106 CarbonylContact C-O 3.48Å; T72-G106 VanDerWaalsContact CA-O 3.23Å; T72-G106 WeakPolarHBondContact CA-O 3.41Å; Y73-G106 PolarHBondContact N-O 3.33Å; G106-Q108 PolarHBondContact O-NE2 2.96Å; G106-V159 WeakPolarHBondContact CA-O 3.33Å; G106-N210 WeakPolarHBondContact CA-ND2 3.38Å
107	L	97.8	Very high	85.5	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	148.6	172.7	-53.3	177.4	0	0	0	109.8	Y73 V75 V105 V110 W129 F133 T158 V159 M161 N210	Y73-L107 WeakPolarHBondContact O-CA 3.11Å; V75-L107 HydrophobicContact CG1-CD2 4.28Å; V105-L107 HydrophobicContact CG1-CD2 4.01Å; V105-L107 HydrophobicContact CG1-CG 4.18Å; L107-V110 HydrophobicContact CB-CG2 3.49Å; L107-V110 VanDerWaalsContact CB-CG2 3.49Å; L107-V110 HydrophobicContact CD1-CG2 4.02Å; L107-V110 HydrophobicContact CG-CG2 4.42Å; L107-W129 HydrophobicContact CD1-CB 3.75Å; L107-W129 HydrophobicContact CD1-CD2 4.18Å; L107-W129 HydrophobicContact CD1-CE3 4.03Å; L107-W129 HydrophobicContact CD1-CG 4.1Å; L107-F133 HydrophobicContact CD1-CE2 4.14Å; L107-F133 HydrophobicContact CD2-CE2 4.26Å; L107-T158 CarbonylContact O-C 3.55Å; L107-T158 WeakPolarHBondContact O-CA 3.34Å; L107-V159 HydrophobicContact CB-CB 4.35Å; L107-V159 PolarHBondContact N-O 2.81Å; L107-V159 PolarHBondContact O-N 2.69Å; L107-M161 HydrophobicContact CD1-CE 4.08Å; L107-M161 HydrophobicContact CG-CE 4.44Å; L107-N210 PolarHBondContact N-ND2 3.34Å; L107-N210 PolarHBondContact O-ND2 3.32Å
108	Q	96.7	Very high	84.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	157	172	-52.2	78.1	39.1	0	0	109	T72 Y73 S74 V75 G106 V110 G157 N210 H212 N253	T72-Q108 PolarHBondContact OG1-NE2 3.48Å; T72-Q108 VanDerWaalsContact OG1-NE2 3.11Å; T72-Q108 PolarHBondContact OG1-OE1 2.96Å; Y73-Q108 VanDerWaalsContact C-OE1 3.29Å; Y73-Q108 PolarHBondContact O-N 2.8Å; Y73-Q108 VanDerWaalsContact O-N 3.12Å; Y73-Q108 PolarHBondContact O-OE1 2.65Å; S74-Q108 CarbonylContact C-O 3.58Å; S74-Q108 WeakPolarHBondContact CA-O 3.4Å; V75-Q108 PolarHBondContact N-O 3.42Å; G106-Q108 PolarHBondContact O-NE2 2.96Å; Q108-V110 PolarHBondContact O-N 3.09Å; Q108-V110 VanDerWaalsContact O-N 3.12Å; Q108-G157 CarbonylContact C-O 3.56Å; Q108-N210 PolarHBondContact NE2-OD1 3.12Å; Q108-H212 HydrophobicContact CB-CB 4.2Å; Q108-H212 HydrophobicContact CG-CB 3.85Å; Q108-N253 HydrophobicContact CB-CB 4.24Å; Q108-N253 HydrophobicContact CG-CB 4Å
109	D	93.8	Very high	83	Confident	39 Å²	39	43.5 Å²	43.5	21%	0.209	22%	0.222	C	C	.	.	S	Bend	trans	49.9	35.6	-175.2	-68.5	-31.4	0	0	0	113.7	S74 V75 N77 Y111 G157 H212	S74-D109 PolarHBondContact OG-OD2 3.28Å; V75-D109 VanDerWaalsContact CG2-O 3.24Å; V75-D109 WeakPolarHBondContact CG2-O 3.16Å; N77-D109 WeakPolarHBondContact CA-O 3.25Å; N77-D109 PolarHBondContact N-O 3.33Å; D109-Y111 PolarHBondContact O-N 2.66Å; D109-G157 PolarHBondContact N-O 2.74Å; D109-H212 IonicContact OD1-CE1 2.75Å; D109-H212 PolarHBondContact OD1-CE1 3.31Å; D109-H212 IonicContact OD1-ND1 3.24Å; D109-H212 IonicContact OD2-CE1 3.56Å; D109-H212 PolarHBondContact OD2-CE1 3.34Å; D109-H212 VanDerWaalsContact OD2-CE1 3.25Å; D109-H212 IonicContact OD2-NE2 3.54Å
110	V	92.3	Very high	81.3	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.018	21%	0.209	C	C	.	.			trans	-65.2	133.4	164.4	-177.2	0	0	0	0	107.7	V75 L107 Q108 Y112 G157 V159	V75-V110 HydrophobicContact CG2-CB 4.24Å; V75-V110 HydrophobicContact CG2-CG2 3.87Å; L107-V110 HydrophobicContact CB-CG2 3.49Å; L107-V110 VanDerWaalsContact CB-CG2 3.49Å; L107-V110 HydrophobicContact CD1-CG2 4.02Å; L107-V110 HydrophobicContact CG-CG2 4.42Å; Q108-V110 PolarHBondContact O-N 3.09Å; Q108-V110 VanDerWaalsContact O-N 3.12Å; V110-Y112 PolarHBondContact O-N 3.08Å; V110-G157 WeakPolarHBondContact CB-O 2.97Å; V110-G157 PolarHBondContact N-O 2.78Å; V110-G157 WeakPolarHBondContact O-CA 3.47Å; V110-V159 HydrophobicContact CB-CG2 4.19Å; V110-V159 HydrophobicContact CG2-CB 4.46Å; V110-V159 HydrophobicContact CG2-CG2 3.94Å
111	Y	87.9	Confident	79.3	Confident	87 Å²	87	47.4 Å²	47.4	34%	0.341	24%	0.243	S	C	.	.			trans	-51.8	133.4	179.8	-176.7	-102.8	0	0	0	111.8	V79 D109 E113	V79-Y111 HydrophobicContact CB-CD1 4.45Å; V79-Y111 HydrophobicContact CB-CG 4.44Å; V79-Y111 HydrophobicContact CG1-CD1 4.33Å; V79-Y111 HydrophobicContact CG2-CD1 3.84Å; V79-Y111 HydrophobicContact CG2-CD2 4.02Å; V79-Y111 HydrophobicContact CG2-CE1 4.2Å; V79-Y111 HydrophobicContact CG2-CE2 4.39Å; V79-Y111 HydrophobicContact CG2-CG 3.72Å; D109-Y111 PolarHBondContact O-N 2.66Å; Y111-E113 HydrophobicContact CE1-CG 3.49Å; Y111-E113 VanDerWaalsContact CE1-CG 3.49Å; Y111-E113 WeakPolarHBondContact OH-CG 3.17Å; Y111-E113 PolarHBondContact OH-OE1 3.16Å; Y111-E113 VanDerWaalsContact OH-OE1 3.05Å
112	Y	76.9	Confident	77.2	Confident	49 Å²	49	51.5 Å²	51.5	19%	0.192	26%	0.263	C	S	.	.			trans	-142.8	118.5	179.9	177.4	-96.4	0	0	0	109.8	V110 H116 M117 M156	V110-Y112 PolarHBondContact O-N 3.08Å; Y112-H116 HydrophobicContact CD2-CB 4.46Å; Y112-H116 HydrophobicContact CE2-CB 4.07Å; Y112-M117 WeakPolarHBondContact OH-CB 3.46Å; Y112-M117 WeakPolarHBondContact OH-CG 3.49Å; Y112-M156 HydrophobicContact CD1-CB 4.23Å; Y112-M156 HydrophobicContact CD1-CG 4.36Å; Y112-M156 HydrophobicContact CE1-CG 4.32Å; Y112-M156 HydrophobicContact CG-CB 4.42Å
113	E	72	Confident	74.9	Confident	74 Å²	74	59.1 Å²	59.1	35%	0.346	29%	0.293	S	S	.	.			trans	-89.8	139.7	166.6	-50.7	175.6	147	0	0	110.5	Y111 I115 H116	Y111-E113 HydrophobicContact CE1-CG 3.49Å; Y111-E113 VanDerWaalsContact CE1-CG 3.49Å; Y111-E113 WeakPolarHBondContact OH-CG 3.17Å; Y111-E113 PolarHBondContact OH-OE1 3.16Å; Y111-E113 VanDerWaalsContact OH-OE1 3.05Å; E113-I115 HydrophobicContact CB-CG2 4.45Å; E113-I115 PolarHBondContact O-N 2.89Å; E113-I115 VanDerWaalsContact O-N 3.11Å; E113-H116 WeakPolarHBondContact CA-ND1 3.48Å; E113-H116 WeakPolarHBondContact CB-ND1 3.47Å; E113-H116 PolarHBondContact N-ND1 3Å; E113-H116 VanDerWaalsContact N-ND1 3.13Å; E113-H116 WeakPolarHBondContact O-CB 3.37Å; E113-H116 PolarHBondContact O-N 2.6Å; E113-H116 PolarHBondContact O-ND1 3.29Å; E113-H116 VanDerWaalsContact O-ND1 3.15Å; E113-H116 IonicContact OE2-CE1 2.81Å; E113-H116 PolarHBondContact OE2-CE1 3.42Å; E113-H116 VanDerWaalsContact OE2-CE1 3.24Å; E113-H116 IonicContact OE2-ND1 3.09Å
114	P	65.2	Low	72.9	Confident	106 Å²	106	66.2 Å²	66.2	69%	0.688	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-34.3	176.7	-27.3	34.7	0	0	0	114.4	H116 M117	P114-H116 PolarHBondContact O-N 2.81Å; P114-M117 PolarHBondContact O-N 2.99Å
115	I	63.4	Low	71	Confident	99 Å²	99	75 Å²	75	51%	0.508	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.3	179.2	-144.6	165.9	0	0	0	112.2	E113 M117 I118 T119	E113-I115 HydrophobicContact CB-CG2 4.45Å; E113-I115 PolarHBondContact O-N 2.89Å; E113-I115 VanDerWaalsContact O-N 3.11Å; I115-M117 PolarHBondContact O-N 3.34Å; I115-M117 VanDerWaalsContact O-N 3.14Å; I115-I118 PolarHBondContact O-N 3.16Å; I115-T119 HydrophobicContact CG1-CG2 4.19Å; I115-T119 HydrophobicContact CG2-CG2 4.07Å; I115-T119 PolarHBondContact O-N 3.12Å; I115-T119 PolarHBondContact O-OG1 3.2Å
116	H	58.2	Low	69.8	Low	20 Å²	20	79.5 Å²	79.5	9%	0.093	39%	0.387	C	S	.	.	H	α-helix	trans	-59.3	-25.8	177.4	-73.3	97.3	0	0	0	113.1	Y112 E113 P114 I118 T119 N120	Y112-H116 HydrophobicContact CD2-CB 4.46Å; Y112-H116 HydrophobicContact CE2-CB 4.07Å; E113-H116 WeakPolarHBondContact CA-ND1 3.48Å; E113-H116 WeakPolarHBondContact CB-ND1 3.47Å; E113-H116 PolarHBondContact N-ND1 3Å; E113-H116 VanDerWaalsContact N-ND1 3.13Å; E113-H116 WeakPolarHBondContact O-CB 3.37Å; E113-H116 PolarHBondContact O-N 2.6Å; E113-H116 PolarHBondContact O-ND1 3.29Å; E113-H116 VanDerWaalsContact O-ND1 3.15Å; E113-H116 IonicContact OE2-CE1 2.81Å; E113-H116 PolarHBondContact OE2-CE1 3.42Å; E113-H116 VanDerWaalsContact OE2-CE1 3.24Å; E113-H116 IonicContact OE2-ND1 3.09Å; P114-H116 PolarHBondContact O-N 2.81Å; H116-I118 PolarHBondContact O-N 3.25Å; H116-T119 WeakPolarHBondContact CA-OG1 3.09Å; H116-N120 WeakPolarHBondContact O-CB 3.37Å; H116-N120 PolarHBondContact O-N 3.05Å; H116-N120 PolarHBondContact O-ND2 2.94Å
117	M	55.5	Low	69.2	Low	128 Å²	128	80.5 Å²	80.5	63%	0.631	39%	0.393	S	S	*	.	H	α-helix	trans	-61.6	-35.9	173.7	-128.2	-169.3	-60.1	0	0	111.7	Y112 P114 I115	Y112-M117 WeakPolarHBondContact OH-CB 3.46Å; Y112-M117 WeakPolarHBondContact OH-CG 3.49Å; P114-M117 PolarHBondContact O-N 2.99Å; I115-M117 PolarHBondContact O-N 3.34Å; I115-M117 VanDerWaalsContact O-N 3.14Å
118	I	57.5	Low	68.8	Low	108 Å²	108	83.1 Å²	83.1	55%	0.554	41%	0.41	S	S	*	.	H	α-helix	trans	-88.8	-44.6	179.2	-57.1	172.6	0	0	0	110	I115 H116 N120 L121 I122	I115-I118 PolarHBondContact O-N 3.16Å; H116-I118 PolarHBondContact O-N 3.25Å; I118-N120 PolarHBondContact O-N 2.91Å; I118-L121 WeakPolarHBondContact O-CB 3.48Å; I118-L121 PolarHBondContact O-N 2.97Å; I118-I122 HydrophobicContact CG2-CD1 4.46Å
119	T	54.3	Low	68.7	Low	38 Å²	38	83.2 Å²	83.2	23%	0.233	41%	0.41	C	S	.	.	H	α-helix	trans	-72.8	-30.1	-175.2	62.7	0	0	0	0	112.6	I115 H116 L121 I122 Y123	I115-T119 HydrophobicContact CG1-CG2 4.19Å; I115-T119 HydrophobicContact CG2-CG2 4.07Å; I115-T119 PolarHBondContact O-N 3.12Å; I115-T119 PolarHBondContact O-OG1 3.2Å; H116-T119 WeakPolarHBondContact CA-OG1 3.09Å; T119-L121 PolarHBondContact O-N 2.84Å; T119-I122 CarbonylContact O-C 3.46Å; T119-I122 WeakPolarHBondContact O-CA 3.3Å; T119-I122 PolarHBondContact O-N 2.77Å; T119-Y123 PolarHBondContact O-N 2.85Å; T119-Y123 VanDerWaalsContact O-O 3.13Å
120	N	52.4	Low	68.7	Low	53 Å²	53	81.5 Å²	81.5	28%	0.283	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.7	175.1	-73	-10.6	0	0	0	112.8	H116 I118 I122 Y123	H116-N120 WeakPolarHBondContact O-CB 3.37Å; H116-N120 PolarHBondContact O-N 3.05Å; H116-N120 PolarHBondContact O-ND2 2.94Å; I118-N120 PolarHBondContact O-N 2.91Å; N120-I122 VanDerWaalsContact C-N 3.28Å; N120-Y123 WeakPolarHBondContact CA-O 3.22Å
121	L	52.9	Low	68.7	Low	153 Å²	153	83.8 Å²	83.8	80%	0.801	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.4	170.6	-63.8	165.8	0	0	0	112.6	I118 T119	I118-L121 WeakPolarHBondContact O-CB 3.48Å; I118-L121 PolarHBondContact O-N 2.97Å; T119-L121 PolarHBondContact O-N 2.84Å
122	I	51.5	Low	69.1	Low	117 Å²	117	80.7 Å²	80.7	60%	0.6	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-36.8	-172.7	-53.9	175	0	0	0	111.5	I118 T119 N120	I118-I122 HydrophobicContact CG2-CD1 4.46Å; T119-I122 CarbonylContact O-C 3.46Å; T119-I122 WeakPolarHBondContact O-CA 3.3Å; T119-I122 PolarHBondContact O-N 2.77Å; N120-I122 VanDerWaalsContact C-N 3.28Å
123	Y	51.1	Low	70	Confident	166 Å²	166	78.3 Å²	78.3	65%	0.651	39%	0.391	S	S	*	.	S	Bend	trans	-134.8	112.9	-179.8	-69.7	-80.9	0	0	0	107.9	T119 N120 R125	T119-Y123 PolarHBondContact O-N 2.85Å; T119-Y123 VanDerWaalsContact O-O 3.13Å; N120-Y123 WeakPolarHBondContact CA-O 3.22Å; Y123-R125 PolarHBondContact O-N 2.79Å
124	E	55	Low	71.1	Confident	149 Å²	149	76.4 Å²	76.4	70%	0.696	38%	0.382	S	S	*	.			trans	-65.9	80.7	168	-69.8	-176.5	153.1	0	0	108.8	T126 S150	E124-T126 PolarHBondContact O-N 2.87Å; E124-T126 VanDerWaalsContact O-N 3.12Å; E124-S150 PolarHBondContact OE1-OG 2.76Å
125	R	60.6	Low	72.5	Confident	184 Å²	184	73.7 Å²	73.7	69%	0.694	36%	0.363	S	S	*	.			trans	-69.5	111.7	170.5	-106.7	-168	-168.9	-143.1	5	107.5	Y123 D127	Y123-R125 PolarHBondContact O-N 2.79Å; R125-D127 PolarHBondContact O-N 2.83Å
126	T	72.1	Confident	74.1	Confident	95 Å²	95	69 Å²	69	58%	0.583	34%	0.339	S	S	*	.			trans	-58.8	122.3	170.9	51.9	0	0	0	0	109.8	E124 P128 E131	E124-T126 PolarHBondContact O-N 2.87Å; E124-T126 VanDerWaalsContact O-N 3.12Å; T126-P128 WeakPolarHBondContact O-CD 3.31Å; T126-E131 HydrophobicContact CG2-CG 4.14Å
127	D	85.5	Confident	76	Confident	22 Å²	22	68 Å²	68	12%	0.118	34%	0.335	C	S	.	.			trans	-71.4	116.8	173.4	-179.6	-38.3	0	0	0	108.8	R125 W129 A130 E131	R125-D127 PolarHBondContact O-N 2.83Å; D127-W129 PolarHBondContact O-N 2.75Å; D127-W129 WeakPolarHBondContact OD1-CB 3.45Å; D127-W129 PolarHBondContact OD1-N 3.12Å; D127-A130 HydrophobicContact CB-CB 3.86Å; D127-A130 PolarHBondContact O-N 2.85Å; D127-A130 PolarHBondContact OD1-N 2.9Å; D127-E131 WeakPolarHBondContact O-CG 3.16Å; D127-E131 PolarHBondContact O-N 3.43Å
128	P	91.1	Very high	77.9	Confident	56 Å²	56	62.3 Å²	62.3	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-59.3	-31.5	-175.6	-25.3	35.3	0	0	0	114.2	K80 T126 M132	K80-P128 HydrophobicContact CB-CB 3.76Å; K80-P128 HydrophobicContact CB-CG 4.13Å; T126-P128 WeakPolarHBondContact O-CD 3.31Å; P128-M132 WeakPolarHBondContact O-CB 3.45Å; P128-M132 PolarHBondContact O-N 3.18Å
129	W	94.1	Very high	79.7	Confident	1 Å²	1	61.3 Å²	61.3	0%	0.004	31%	0.311	C	S	.	.	H	α-helix	trans	-68.7	-48.1	174.8	-74.4	96.9	0	0	0	110.4	Y73 V75 A78 P81 F85 L107 D127 E131 M132 F133	Y73-W129 HydrophobicContact CD1-CH2 4.31Å; Y73-W129 HydrophobicContact CD1-CZ3 4.27Å; Y73-W129 AromaticContact CE1-CH2 3.89Å; Y73-W129 HydrophobicContact CE1-CH2 3.89Å; Y73-W129 HydrophobicContact CE1-CZ3 4.26Å; V75-W129 HydrophobicContact CB-CH2 4.14Å; V75-W129 HydrophobicContact CB-CZ2 3.67Å; V75-W129 HydrophobicContact CG1-CD2 4.22Å; V75-W129 HydrophobicContact CG1-CE3 4.22Å; V75-W129 HydrophobicContact CG1-CH2 3.63Å; V75-W129 HydrophobicContact CG1-CZ2 3.6Å; V75-W129 HydrophobicContact CG1-CZ3 3.93Å; V75-W129 HydrophobicContact CG2-CZ2 4.25Å; A78-W129 HydrophobicContact CB-CZ2 4.08Å; A78-W129 PolarHBondContact O-NE1 2.87Å; P81-W129 HydrophobicContact CB-CE3 4.43Å; P81-W129 HydrophobicContact CB-CH2 4.2Å; P81-W129 HydrophobicContact CB-CZ2 4.36Å; P81-W129 HydrophobicContact CB-CZ3 4.25Å; P81-W129 HydrophobicContact CG-CD2 3.68Å; P81-W129 HydrophobicContact CG-CE3 3.71Å; P81-W129 HydrophobicContact CG-CG 4.16Å; P81-W129 HydrophobicContact CG-CH2 4.28Å; P81-W129 HydrophobicContact CG-CZ2 4.26Å; P81-W129 HydrophobicContact CG-CZ3 4.03Å; F85-W129 HydrophobicContact CD1-CH2 4.13Å; F85-W129 AromaticContact CD1-CZ3 3.67Å; F85-W129 HydrophobicContact CD1-CZ3 3.67Å; F85-W129 HydrophobicContact CE1-CE3 4.32Å; F85-W129 HydrophobicContact CE1-CH2 4.35Å; F85-W129 AromaticContact CE1-CZ3 3.51Å; F85-W129 HydrophobicContact CE1-CZ3 3.51Å; F85-W129 HydrophobicContact CG-CZ3 4.47Å; F85-W129 HydrophobicContact CZ-CZ3 4.14Å; L107-W129 HydrophobicContact CD1-CB 3.75Å; L107-W129 HydrophobicContact CD1-CD2 4.18Å; L107-W129 HydrophobicContact CD1-CE3 4.03Å; L107-W129 HydrophobicContact CD1-CG 4.1Å; D127-W129 PolarHBondContact O-N 2.75Å; D127-W129 WeakPolarHBondContact OD1-CB 3.45Å; D127-W129 PolarHBondContact OD1-N 3.12Å; W129-E131 PolarHBondContact O-N 2.92Å; W129-M132 PolarHBondContact O-N 3.46Å; W129-F133 HydrophobicContact CE3-CE2 4.09Å; W129-F133 VanDerWaalsContact O-CD2 3.29Å; W129-F133 WeakPolarHBondContact O-CD2 3.47Å; W129-F133 PolarHBondContact O-N 2.9Å
130	A	93.4	Very high	81.6	Confident	3 Å²	3	61.5 Å²	61.5	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-62.4	-44.5	179.1	0	0	0	0	0	111.6	D127 M132 F133 K134 V152 M161	D127-A130 HydrophobicContact CB-CB 3.86Å; D127-A130 PolarHBondContact O-N 2.85Å; D127-A130 PolarHBondContact OD1-N 2.9Å; A130-M132 VanDerWaalsContact C-N 3.34Å; A130-M132 PolarHBondContact O-N 3.13Å; A130-F133 PolarHBondContact O-N 2.78Å; A130-K134 WeakPolarHBondContact O-CB 3.5Å; A130-K134 PolarHBondContact O-N 2.94Å; A130-V152 HydrophobicContact CB-CB 4.45Å; A130-V152 HydrophobicContact CB-CG1 4.31Å; A130-M161 HydrophobicContact CB-SD 3.86Å
131	E	93	Very high	83.6	Confident	51 Å²	51	60.4 Å²	60.4	24%	0.238	31%	0.308	C	S	.	.	H	α-helix	trans	-60.7	-40.1	178.7	-73.4	-51.5	126.9	0	0	113.2	T126 D127 W129 K134 T135	T126-E131 HydrophobicContact CG2-CG 4.14Å; D127-E131 WeakPolarHBondContact O-CG 3.16Å; D127-E131 PolarHBondContact O-N 3.43Å; W129-E131 PolarHBondContact O-N 2.92Å; E131-K134 WeakPolarHBondContact OE1-CE 3.28Å; E131-K134 IonicContact OE1-NZ 3.24Å; E131-K134 PolarHBondContact OE1-NZ 3.5Å; E131-K134 WeakPolarHBondContact OE2-CE 3.4Å; E131-K134 IonicContact OE2-NZ 3.79Å; E131-K134 PolarHBondContact OE2-NZ 3.05Å; E131-T135 VanDerWaalsContact O-CB 3.3Å; E131-T135 WeakPolarHBondContact O-CB 3.36Å; E131-T135 PolarHBondContact O-N 3.4Å; E131-T135 PolarHBondContact O-OG1 2.91Å
132	M	95.5	Very high	85.8	Confident	22 Å²	22	53.1 Å²	53.1	11%	0.108	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-50.1	179.5	169.6	-111.4	-91.8	0	0	111.6	P81 F85 Y86 P87 P128 W129 A130 K134 T135 F136	P81-M132 HydrophobicContact CB-CE 3.27Å; P81-M132 HydrophobicContact CG-CE 3.19Å; F85-M132 HydrophobicContact CD1-CE 3.31Å; F85-M132 HydrophobicContact CD1-SD 4.47Å; F85-M132 HydrophobicContact CE1-CE 3.48Å; F85-M132 VanDerWaalsContact CE1-CE 3.48Å; F85-M132 HydrophobicContact CE1-SD 4.12Å; Y86-M132 HydrophobicContact CD2-CG 3.92Å; Y86-M132 HydrophobicContact CE2-CG 3.8Å; P87-M132 WeakPolarHBondContact CD-SD 3.21Å; P87-M132 HydrophobicContact CG-CG 4.29Å; P87-M132 HydrophobicContact CG-SD 3.39Å; P87-M132 WeakPolarHBondContact CG-SD 3.25Å; P128-M132 WeakPolarHBondContact O-CB 3.45Å; P128-M132 PolarHBondContact O-N 3.18Å; W129-M132 PolarHBondContact O-N 3.46Å; A130-M132 VanDerWaalsContact C-N 3.34Å; A130-M132 PolarHBondContact O-N 3.13Å; M132-K134 VanDerWaalsContact C-N 3.32Å; M132-K134 PolarHBondContact O-N 2.82Å; M132-T135 PolarHBondContact O-N 2.84Å; M132-F136 VanDerWaalsContact O-CB 3.25Å; M132-F136 WeakPolarHBondContact O-CB 3.35Å; M132-F136 PolarHBondContact O-N 3.14Å
133	F	96.7	Very high	87.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-42.8	176.5	-76.4	-66.8	0	0	0	111.5	L71 F85 P87 F90 V105 L107 W129 A130 F136 Y137 M161 F163	L71-F133 HydrophobicContact CD2-CE1 3.53Å; L71-F133 HydrophobicContact CD2-CZ 3.53Å; F85-F133 HydrophobicContact CE1-CE2 4.43Å; F85-F133 AromaticContact CE1-CZ 3.89Å; F85-F133 HydrophobicContact CE1-CZ 3.89Å; F85-F133 AromaticContact CZ-CZ 3.92Å; F85-F133 HydrophobicContact CZ-CZ 3.92Å; P87-F133 HydrophobicContact CB-CD1 4.24Å; P87-F133 HydrophobicContact CB-CE1 4.11Å; P87-F133 HydrophobicContact CG-CD1 3.68Å; P87-F133 HydrophobicContact CG-CE1 3.7Å; F90-F133 HydrophobicContact CE2-CE1 4.23Å; V105-F133 HydrophobicContact CG1-CD1 4.38Å; V105-F133 HydrophobicContact CG1-CD2 3.99Å; V105-F133 HydrophobicContact CG1-CE1 4.18Å; V105-F133 HydrophobicContact CG1-CE2 3.78Å; V105-F133 HydrophobicContact CG1-CG 4.29Å; V105-F133 HydrophobicContact CG1-CZ 3.88Å; V105-F133 HydrophobicContact CG2-CD1 4.14Å; V105-F133 HydrophobicContact CG2-CE1 4.34Å; V105-F133 HydrophobicContact CG2-CG 4.44Å; L107-F133 HydrophobicContact CD1-CE2 4.14Å; L107-F133 HydrophobicContact CD2-CE2 4.26Å; W129-F133 HydrophobicContact CE3-CE2 4.09Å; W129-F133 VanDerWaalsContact O-CD2 3.29Å; W129-F133 WeakPolarHBondContact O-CD2 3.47Å; W129-F133 PolarHBondContact O-N 2.9Å; A130-F133 PolarHBondContact O-N 2.78Å; F133-F136 PolarHBondContact O-N 3.36Å; F133-Y137 HydrophobicContact CB-CD2 4.28Å; F133-Y137 HydrophobicContact CB-CE2 4.26Å; F133-Y137 HydrophobicContact CD1-CD2 4.49Å; F133-Y137 AromaticContact CD1-CE2 3.72Å; F133-Y137 HydrophobicContact CD1-CE2 3.72Å; F133-Y137 HydrophobicContact CG-CE2 4.43Å; F133-Y137 WeakPolarHBondContact O-CD2 3.31Å; F133-Y137 PolarHBondContact O-N 2.82Å; F133-M161 HydrophobicContact CB-CE 4.28Å; F133-M161 HydrophobicContact CB-SD 4.24Å; F133-M161 HydrophobicContact CD2-CE 3.72Å; F133-M161 HydrophobicContact CE2-CE 4.45Å; F133-M161 HydrophobicContact CG-CE 4.27Å; F133-F163 HydrophobicContact CB-CE2 4.17Å; F133-F163 HydrophobicContact CB-CZ 3.96Å
134	K	95.1	Very high	90.1	Very high	33 Å²	33	40.1 Å²	40.1	14%	0.143	21%	0.212	C	C	.	.	H	α-helix	trans	-56.1	-53.3	177.7	-177.4	-178.1	81.5	-178.5	0	111.7	A130 E131 M132 F136 A138 F163 V429	A130-K134 WeakPolarHBondContact O-CB 3.5Å; A130-K134 PolarHBondContact O-N 2.94Å; E131-K134 WeakPolarHBondContact OE1-CE 3.28Å; E131-K134 IonicContact OE1-NZ 3.24Å; E131-K134 PolarHBondContact OE1-NZ 3.5Å; E131-K134 WeakPolarHBondContact OE2-CE 3.4Å; E131-K134 IonicContact OE2-NZ 3.79Å; E131-K134 PolarHBondContact OE2-NZ 3.05Å; M132-K134 VanDerWaalsContact C-N 3.32Å; M132-K134 PolarHBondContact O-N 2.82Å; K134-F136 PolarHBondContact O-N 3.32Å; K134-A138 WeakPolarHBondContact O-CB 3.14Å; K134-A138 PolarHBondContact O-N 3.32Å; K134-F163 HydrophobicContact CB-CE1 4.41Å; K134-V429 HydrophobicContact CB-CG1 4.49Å; K134-V429 HydrophobicContact CD-CG1 3.53Å; K134-V429 HydrophobicContact CG-CG1 3.12Å
135	T	94.6	Very high	92.1	Very high	49 Å²	49	33.1 Å²	33.1	30%	0.301	18%	0.18	S	C	.	.	H	α-helix	trans	-62.1	-44.1	178.9	-56.8	0	0	0	0	111.5	E131 M132 S139 I544	E131-T135 VanDerWaalsContact O-CB 3.3Å; E131-T135 WeakPolarHBondContact O-CB 3.36Å; E131-T135 PolarHBondContact O-N 3.4Å; E131-T135 PolarHBondContact O-OG1 2.91Å; M132-T135 PolarHBondContact O-N 2.84Å; T135-S139 PolarHBondContact O-N 2.9Å; T135-I544 HydrophobicContact CG2-CD1 3.86Å
136	F	96.2	Very high	93.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-49.6	-178	175.8	-93.1	0	0	0	112.5	Y86 P87 T88 Y91 I98 M132 F133 K134 S139 R140	Y86-F136 HydrophobicContact CD1-CD2 4.39Å; Y86-F136 AromaticContact CE1-CD2 3.62Å; Y86-F136 HydrophobicContact CE1-CD2 3.62Å; Y86-F136 HydrophobicContact CE1-CE2 4.13Å; Y86-F136 AromaticContact CZ-CD2 3.94Å; P87-F136 HydrophobicContact CB-CB 4.4Å; P87-F136 HydrophobicContact CB-CD1 3.54Å; P87-F136 HydrophobicContact CB-CD2 3.92Å; P87-F136 HydrophobicContact CB-CE1 3.65Å; P87-F136 HydrophobicContact CB-CE2 4.03Å; P87-F136 HydrophobicContact CB-CG 3.68Å; P87-F136 HydrophobicContact CB-CZ 3.9Å; P87-F136 HydrophobicContact CG-CB 4.05Å; P87-F136 HydrophobicContact CG-CD1 4.09Å; P87-F136 HydrophobicContact CG-CD2 4.23Å; P87-F136 HydrophobicContact CG-CG 3.85Å; T88-F136 HydrophobicContact CG2-CE2 3.73Å; Y91-F136 HydrophobicContact CD2-CE1 4Å; Y91-F136 AromaticContact CD2-CZ 3.67Å; Y91-F136 HydrophobicContact CD2-CZ 3.67Å; Y91-F136 AromaticContact CE2-CE1 3.54Å; Y91-F136 HydrophobicContact CE2-CE1 3.54Å; Y91-F136 AromaticContact CE2-CZ 3.72Å; Y91-F136 HydrophobicContact CE2-CZ 3.72Å; I98-F136 HydrophobicContact CD1-CE1 3.63Å; I98-F136 HydrophobicContact CD1-CZ 4.16Å; M132-F136 VanDerWaalsContact O-CB 3.25Å; M132-F136 WeakPolarHBondContact O-CB 3.35Å; M132-F136 PolarHBondContact O-N 3.14Å; F133-F136 PolarHBondContact O-N 3.36Å; K134-F136 PolarHBondContact O-N 3.32Å; F136-S139 PolarHBondContact O-OG 3.19Å; F136-S139 VanDerWaalsContact O-OG 3.12Å; F136-R140 VanDerWaalsContact CD2-CZ 3.49Å; F136-R140 VanDerWaalsContact CD2-NH1 3.26Å; F136-R140 VanDerWaalsContact CZ-NE 3.27Å; F136-R140 VanDerWaalsContact O-CD 3.27Å; F136-R140 WeakPolarHBondContact O-CD 3.35Å; F136-R140 PolarHBondContact O-NH1 3.24Å
137	Y	97.1	Very high	94.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-73.9	-34.7	-178.7	-71.5	-59.7	0	0	0	112.2	Y91 I98 V103 V105 F133 S139 R140 G141 F142 F163	Y91-Y137 HydrophobicContact CE2-CE1 4.34Å; Y91-Y137 VanDerWaalsContact OH-CE1 3.32Å; Y91-Y137 WeakPolarHBondContact OH-CE1 3.34Å; Y91-Y137 PolarHBondContact OH-OH 2.88Å; I98-Y137 HydrophobicContact CD1-CD1 3.8Å; I98-Y137 HydrophobicContact CD1-CE1 3.75Å; V103-Y137 HydrophobicContact CB-CE1 4.29Å; V103-Y137 HydrophobicContact CG1-CE1 3.99Å; V103-Y137 HydrophobicContact CG1-CE2 4.11Å; V103-Y137 WeakPolarHBondContact CG1-OH 3.34Å; V103-Y137 HydrophobicContact CG2-CD1 4.47Å; V103-Y137 HydrophobicContact CG2-CE1 4.07Å; V105-Y137 HydrophobicContact CG2-CE2 3.95Å; F133-Y137 HydrophobicContact CB-CD2 4.28Å; F133-Y137 HydrophobicContact CB-CE2 4.26Å; F133-Y137 HydrophobicContact CD1-CD2 4.49Å; F133-Y137 AromaticContact CD1-CE2 3.72Å; F133-Y137 HydrophobicContact CD1-CE2 3.72Å; F133-Y137 HydrophobicContact CG-CE2 4.43Å; F133-Y137 WeakPolarHBondContact O-CD2 3.31Å; F133-Y137 PolarHBondContact O-N 2.82Å; Y137-S139 VanDerWaalsContact C-N 3.33Å; Y137-S139 PolarHBondContact O-N 2.86Å; Y137-R140 CarbonylContact O-C 3.51Å; Y137-R140 WeakPolarHBondContact O-CA 3.4Å; Y137-R140 PolarHBondContact O-N 3.02Å; Y137-G141 PolarHBondContact O-N 3.15Å; Y137-F142 PolarHBondContact O-N 3.27Å; Y137-F163 HydrophobicContact CD2-CD1 4.15Å; Y137-F163 AromaticContact CD2-CD2 3.47Å; Y137-F163 HydrophobicContact CD2-CD2 3.47Å; Y137-F163 VanDerWaalsContact CD2-CD2 3.47Å; Y137-F163 HydrophobicContact CD2-CE1 4.19Å; Y137-F163 AromaticContact CD2-CE2 3.51Å; Y137-F163 HydrophobicContact CD2-CE2 3.51Å; Y137-F163 AromaticContact CD2-CG 3.8Å; Y137-F163 HydrophobicContact CD2-CG 3.8Å; Y137-F163 AromaticContact CD2-CZ 3.88Å; Y137-F163 HydrophobicContact CD2-CZ 3.88Å; Y137-F163 AromaticContact CE2-CD2 3.88Å; Y137-F163 HydrophobicContact CE2-CD2 3.88Å; Y137-F163 AromaticContact CE2-CE2 3.87Å; Y137-F163 HydrophobicContact CE2-CE2 3.87Å; Y137-F163 HydrophobicContact CG-CB 4.49Å; Y137-F163 HydrophobicContact CG-CD1 4.38Å; Y137-F163 HydrophobicContact CG-CD2 4.19Å; Y137-F163 HydrophobicContact CG-CG 4.09Å
138	A	96	Very high	94.4	Very high	9 Å²	9	21.9 Å²	21.9	7%	0.074	13%	0.129	C	C	.	.	H	α-helix	trans	-63.8	-37.8	178.4	0	0	0	0	0	113.4	K134 R140 G141 F142 R166 V429	K134-A138 WeakPolarHBondContact O-CB 3.14Å; K134-A138 PolarHBondContact O-N 3.32Å; A138-R140 PolarHBondContact O-N 3.03Å; A138-G141 PolarHBondContact O-N 2.98Å; A138-F142 WeakPolarHBondContact CA-O 3.37Å; A138-R166 PolarHBondContact O-NH1 3.37Å; A138-R166 PolarHBondContact O-NH2 3.09Å; A138-V429 HydrophobicContact CB-CB 4.05Å; A138-V429 HydrophobicContact CB-CG1 3.77Å; A138-V429 HydrophobicContact CB-CG2 3.78Å
139	S	94.8	Very high	94	Very high	87 Å²	87	23 Å²	23	61%	0.608	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-5.6	175.2	79	0	0	0	0	113.3	T135 F136 Y137	T135-S139 PolarHBondContact O-N 2.9Å; F136-S139 PolarHBondContact O-OG 3.19Å; F136-S139 VanDerWaalsContact O-OG 3.12Å; Y137-S139 VanDerWaalsContact C-N 3.33Å; Y137-S139 PolarHBondContact O-N 2.86Å
140	R	95.2	Very high	93	Very high	42 Å²	42	25.9 Å²	25.9	16%	0.158	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	17.7	-175.3	-66.1	164.7	173.8	63	16.8	113.5	T95 I98 F136 Y137 A138 F142	T95-R140 PolarHBondContact O-NE 2.67Å; T95-R140 PolarHBondContact O-NH2 3.01Å; I98-R140 HydrophobicContact CD1-CB 4.29Å; I98-R140 HydrophobicContact CD1-CG 4.42Å; F136-R140 VanDerWaalsContact CD2-CZ 3.49Å; F136-R140 VanDerWaalsContact CD2-NH1 3.26Å; F136-R140 VanDerWaalsContact CZ-NE 3.27Å; F136-R140 VanDerWaalsContact O-CD 3.27Å; F136-R140 WeakPolarHBondContact O-CD 3.35Å; F136-R140 PolarHBondContact O-NH1 3.24Å; Y137-R140 CarbonylContact O-C 3.51Å; Y137-R140 WeakPolarHBondContact O-CA 3.4Å; Y137-R140 PolarHBondContact O-N 3.02Å; A138-R140 PolarHBondContact O-N 3.03Å; R140-F142 HydrophobicContact CB-CD2 4.38Å; R140-F142 WeakPolarHBondContact O-CD2 3.37Å
141	G	94.9	Very high	92.5	Very high	30 Å²	30	29.3 Å²	29.3	31%	0.309	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	3.3	172.7	0	0	0	0	0	115.2	Y137 A138 R166	Y137-G141 PolarHBondContact O-N 3.15Å; A138-G141 PolarHBondContact O-N 2.98Å; G141-R166 VanDerWaalsContact CA-NH1 3.27Å; G141-R166 WeakPolarHBondContact O-CG 3.36Å; G141-R166 PolarHBondContact O-N 3.2Å
142	F	97.4	Very high	92.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	157.4	178.5	-63.4	-105	0	0	0	111.4	I98 F100 V103 Y137 A138 R140 F163 V164 K165 R166	I98-F142 HydrophobicContact CB-CE2 3.9Å; I98-F142 HydrophobicContact CB-CZ 4.22Å; I98-F142 HydrophobicContact CG2-CE2 3.91Å; I98-F142 HydrophobicContact CG2-CZ 3.76Å; F100-F142 WeakPolarHBondContact O-CZ 3.32Å; V103-F142 HydrophobicContact CG2-CD1 4.48Å; V103-F142 HydrophobicContact CG2-CE1 3.91Å; V103-F142 HydrophobicContact CG2-CZ 4.28Å; Y137-F142 PolarHBondContact O-N 3.27Å; A138-F142 WeakPolarHBondContact CA-O 3.37Å; R140-F142 HydrophobicContact CB-CD2 4.38Å; R140-F142 WeakPolarHBondContact O-CD2 3.37Å; F142-F163 HydrophobicContact CB-CB 4.12Å; F142-F163 HydrophobicContact CD1-CB 4.13Å; F142-F163 HydrophobicContact CG-CB 4.45Å; F142-V164 CarbonylContact C-O 3.54Å; F142-V164 VanDerWaalsContact CA-O 3.31Å; F142-V164 WeakPolarHBondContact CA-O 3.22Å; F142-K165 HydrophobicContact CD1-CG 4.19Å; F142-K165 HydrophobicContact CE1-CG 3.79Å; F142-K165 HydrophobicContact CE2-CG 4.27Å; F142-K165 HydrophobicContact CZ-CG 3.84Å; F142-R166 VanDerWaalsContact O-CZ 3.26Å; F142-R166 PolarHBondContact O-NH2 3.3Å
143	A	97.1	Very high	92	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.7	162.3	0	0	0	0	0	109	F163 V164 R166 L169 F428 V429	A143-F163 CarbonylContact O-C 3.54Å; A143-F163 WeakPolarHBondContact O-CA 3.34Å; A143-V164 PolarHBondContact N-O 3.24Å; A143-V164 PolarHBondContact O-N 3.24Å; A143-R166 HydrophobicContact CB-CG 3.88Å; A143-L169 HydrophobicContact CB-CD1 3.78Å; A143-F428 HydrophobicContact CB-CD2 3.87Å; A143-F428 HydrophobicContact CB-CE2 3.43Å; A143-F428 VanDerWaalsContact CB-CE2 3.43Å; A143-F428 HydrophobicContact CB-CZ 4.2Å; A143-V429 CarbonylContact C-O 3.54Å; A143-V429 WeakPolarHBondContact CA-O 3.49Å
144	R	97	Very high	91.8	Very high	10 Å²	10	29 Å²	29	4%	0.038	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	139.2	176.1	-167.3	177.1	56.1	146.9	4.9	109.7	V162 F163 V429 D430 D431	R144-V162 CarbonylContact C-O 3.55Å; R144-V162 WeakPolarHBondContact CA-O 3.13Å; R144-F163 HydrophobicContact CB-CD1 3.72Å; R144-F163 HydrophobicContact CB-CE1 3.64Å; R144-F163 HydrophobicContact CG-CD1 4.06Å; R144-F163 HydrophobicContact CG-CE1 3.73Å; R144-F163 HydrophobicContact CG-CZ 4.29Å; R144-V429 PolarHBondContact N-O 3.37Å; R144-D430 WeakPolarHBondContact CB-OD1 3.36Å; R144-D430 IonicContact CZ-OD1 3.06Å; R144-D430 IonicContact CZ-OD2 3.37Å; R144-D430 IonicContact NE-OD1 3.4Å; R144-D430 PolarHBondContact NE-OD1 2.76Å; R144-D430 IonicContact NE-OD2 2.58Å; R144-D430 VanDerWaalsContact NH2-CG 3.27Å; R144-D430 IonicContact NH2-OD1 2.6Å; R144-D430 PolarHBondContact NH2-OD1 3.22Å; R144-D430 IonicContact NH2-OD2 3.87Å; R144-D430 PolarHBondContact NH2-OD2 3.34Å; R144-D431 PolarHBondContact O-N 3.08Å; R144-D431 VanDerWaalsContact O-N 3.07Å
145	L	96.3	Very high	91.5	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	17%	0.166	C	C	.	.			trans	-78.4	124	166.8	-65.1	177.8	0	0	0	109.6	F147 V162 V164 L169 L198	L145-F147 HydrophobicContact CB-CE1 4.24Å; L145-F147 HydrophobicContact CB-CE2 4.05Å; L145-F147 HydrophobicContact CB-CZ 3.84Å; L145-F147 HydrophobicContact CD1-CZ 4.46Å; L145-F147 WeakPolarHBondContact O-CD2 3.48Å; L145-F147 VanDerWaalsContact O-CE2 3.25Å; L145-F147 WeakPolarHBondContact O-CE2 3.44Å; L145-V162 HydrophobicContact CD1-CB 4.4Å; L145-V162 HydrophobicContact CD1-CG1 4.08Å; L145-V162 PolarHBondContact N-O 2.98Å; L145-V164 HydrophobicContact CD1-CG2 3.92Å; L145-V164 HydrophobicContact CG-CG2 4.15Å; L145-L169 HydrophobicContact CD2-CD2 3.41Å; L145-L169 VanDerWaalsContact CD2-CD2 3.41Å; L145-L169 HydrophobicContact CG-CD2 4.36Å; L145-L198 HydrophobicContact CD1-CD1 3.81Å; L145-L198 HydrophobicContact CD1-CD2 3.62Å; L145-L198 HydrophobicContact CD1-CG 4.4Å
146	T	92.4	Very high	91.1	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.012	17%	0.166	C	C	.	.			trans	-93.5	-15.9	-179.1	61.9	0	0	0	0	113.8	N148 K149 D430 D431 W432	T146-N148 PolarHBondContact O-N 3.05Å; T146-K149 VanDerWaalsContact CB-O 3.28Å; T146-K149 WeakPolarHBondContact CB-O 3.38Å; T146-K149 WeakPolarHBondContact O-CB 3.27Å; T146-K149 PolarHBondContact O-N 3.37Å; T146-D430 HydrophobicContact CG2-CB 3.73Å; T146-D431 WeakPolarHBondContact CB-OD1 3.28Å; T146-D431 WeakPolarHBondContact CG2-OD1 3.2Å; T146-D431 PolarHBondContact N-OD1 2.84Å; T146-D431 PolarHBondContact OG1-OD1 3.41Å; T146-W432 HydrophobicContact CG2-CB 3.86Å
147	F	90	Very high	90.8	Very high	13 Å²	13	29.1 Å²	29.1	6%	0.057	17%	0.171	C	C	.	.	S	Bend	trans	56.3	39.1	-177	-47.3	-83.6	0	0	0	112.3	L145 K149 P153 V162 A175 L177 V196 L198	L145-F147 HydrophobicContact CB-CE1 4.24Å; L145-F147 HydrophobicContact CB-CE2 4.05Å; L145-F147 HydrophobicContact CB-CZ 3.84Å; L145-F147 HydrophobicContact CD1-CZ 4.46Å; L145-F147 WeakPolarHBondContact O-CD2 3.48Å; L145-F147 VanDerWaalsContact O-CE2 3.25Å; L145-F147 WeakPolarHBondContact O-CE2 3.44Å; F147-K149 VanDerWaalsContact C-N 3.33Å; F147-K149 PolarHBondContact O-N 3.48Å; F147-P153 HydrophobicContact CD2-CG 3.5Å; F147-P153 HydrophobicContact CE2-CG 3.77Å; F147-V162 HydrophobicContact CZ-CB 4.25Å; F147-V162 HydrophobicContact CZ-CG2 4.07Å; F147-A175 HydrophobicContact CD1-CB 3.83Å; F147-A175 HydrophobicContact CE1-CB 3.99Å; F147-L177 HydrophobicContact CB-CB 4.12Å; F147-L177 HydrophobicContact CB-CD2 4.03Å; F147-L177 HydrophobicContact CD1-CB 4.25Å; F147-L177 HydrophobicContact CD2-CD2 4.36Å; F147-L177 HydrophobicContact CG-CB 4.16Å; F147-L177 HydrophobicContact CG-CD2 4.26Å; F147-V196 HydrophobicContact CE1-CB 4.27Å; F147-V196 HydrophobicContact CE1-CG1 3.43Å; F147-V196 VanDerWaalsContact CE1-CG1 3.43Å; F147-V196 HydrophobicContact CE1-CG2 3.81Å; F147-V196 HydrophobicContact CE2-CG2 4.11Å; F147-V196 HydrophobicContact CZ-CB 4.24Å; F147-V196 HydrophobicContact CZ-CG1 3.61Å; F147-V196 HydrophobicContact CZ-CG2 3.55Å; F147-L198 HydrophobicContact CE1-CD2 4.06Å
148	N	84.2	Confident	90.7	Very high	50 Å²	50	29.2 Å²	29.2	27%	0.267	17%	0.171	S	C	.	.	S	Bend	trans	61.5	35.9	-177.2	-158.1	11.5	0	0	0	114	T146 W432 F475 Q477	T146-N148 PolarHBondContact O-N 3.05Å; N148-W432 WeakPolarHBondContact OD1-CZ3 3.2Å; N148-F475 HydrophobicContact CB-CE1 4.49Å; N148-F475 HydrophobicContact CB-CZ 3.89Å; N148-Q477 PolarHBondContact ND2-NE2 3.38Å; N148-Q477 PolarHBondContact ND2-OE1 2.86Å
149	K	82.3	Confident	90.6	Very high	79 Å²	79	28.9 Å²	28.9	34%	0.343	17%	0.168	S	C	.	.			trans	-137.5	133.8	179.9	-62.4	-178.4	-178.2	-174.1	0	110.5	T146 F147 S151 L177 Y179	T146-K149 VanDerWaalsContact CB-O 3.28Å; T146-K149 WeakPolarHBondContact CB-O 3.38Å; T146-K149 WeakPolarHBondContact O-CB 3.27Å; T146-K149 PolarHBondContact O-N 3.37Å; F147-K149 VanDerWaalsContact C-N 3.33Å; F147-K149 PolarHBondContact O-N 3.48Å; K149-S151 VanDerWaalsContact C-N 3.25Å; K149-S151 PolarHBondContact O-N 2.78Å; K149-L177 HydrophobicContact CD-CD2 4.21Å; K149-Y179 PolarHBondContact NZ-OH 3.15Å; K149-Y179 VanDerWaalsContact NZ-OH 3.12Å
150	S	74.2	Confident	90.8	Very high	62 Å²	62	24.7 Å²	24.7	43%	0.434	14%	0.139	S	C	.	.	S	Bend	trans	-58.1	-39.7	174.5	-179.6	0	0	0	0	112.1	E124	E124-S150 PolarHBondContact OE1-OG 2.76Å
151	S	81.7	Confident	90.9	Very high	74 Å²	74	22.8 Å²	22.8	52%	0.517	13%	0.132	S	C	.	.	S	Bend	trans	-92.3	151.8	-176.8	65.1	0	0	0	0	113.5	K149	K149-S151 VanDerWaalsContact C-N 3.25Å; K149-S151 PolarHBondContact O-N 2.78Å
152	V	88.6	Confident	91.1	Very high	11 Å²	11	21.3 Å²	21.3	7%	0.067	12%	0.117	C	C	.	.			trans	-55.2	140.1	171.3	68.7	0	0	0	0	112.1	A130 R154 V159 M161	A130-V152 HydrophobicContact CB-CB 4.45Å; A130-V152 HydrophobicContact CB-CG1 4.31Å; V152-R154 PolarHBondContact O-N 2.85Å; V152-R154 VanDerWaalsContact O-N 3.09Å; V152-V159 HydrophobicContact CB-CG1 4.4Å; V152-V159 HydrophobicContact CG1-CG1 3.94Å; V152-V159 HydrophobicContact CG2-CG1 3.54Å; V152-M161 HydrophobicContact CG2-CG 3.34Å; V152-M161 HydrophobicContact CG2-SD 4.25Å
153	P	91.2	Very high	91.1	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.013	12%	0.118	C	C	.	.			trans	-55.1	115.4	169.5	-27.5	35.7	0	0	0	111.9	F147 V159 L160 L177 I194	F147-P153 HydrophobicContact CD2-CG 3.5Å; F147-P153 HydrophobicContact CE2-CG 3.77Å; P153-V159 WeakPolarHBondContact O-CA 3.39Å; P153-L160 WeakPolarHBondContact CD-O 3.12Å; P153-L160 PolarHBondContact O-N 3.23Å; P153-L177 HydrophobicContact CB-CD1 3.83Å; P153-L177 HydrophobicContact CB-CD2 3.83Å; P153-L177 HydrophobicContact CB-CG 4.5Å; P153-L177 HydrophobicContact CG-CD1 4.14Å; P153-L177 HydrophobicContact CG-CD2 3.73Å; P153-I194 HydrophobicContact CB-CG2 4.16Å
154	R	90.8	Very high	91.1	Very high	54 Å²	54	21.7 Å²	21.7	20%	0.204	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	150.3	178.8	73.6	-176.9	-58	168.6	11.7	113.4	V152 M156 T158 V159 Y179	V152-R154 PolarHBondContact O-N 2.85Å; V152-R154 VanDerWaalsContact O-N 3.09Å; R154-M156 PolarHBondContact NE-O 3.36Å; R154-M156 PolarHBondContact NH2-O 3.05Å; R154-M156 VanDerWaalsContact NH2-O 3.09Å; R154-T158 CarbonylContact C-O 3.51Å; R154-T158 WeakPolarHBondContact CA-O 3.49Å; R154-V159 HydrophobicContact CB-CG2 4.03Å; R154-Y179 VanDerWaalsContact O-CE1 3.29Å; R154-Y179 WeakPolarHBondContact O-CE1 3.29Å
155	M	89.4	Confident	91.1	Very high	16 Å²	16	23 Å²	23	8%	0.079	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	94.8	170.5	-166	179.1	66.2	0	0	107.5	G157 T158 Y179 G189 K191 I194	M155-G157 PolarHBondContact O-N 3.17Å; M155-T158 PolarHBondContact N-O 3.03Å; M155-T158 PolarHBondContact O-N 3.17Å; M155-Y179 HydrophobicContact CB-CD1 4.19Å; M155-G189 CarbonylContact C-O 3.58Å; M155-G189 WeakPolarHBondContact CG-O 3.41Å; M155-K191 WeakPolarHBondContact CE-O 3.46Å; M155-I194 HydrophobicContact CB-CD1 4.26Å; M155-I194 HydrophobicContact CB-CG1 4.15Å
156	M	85.9	Confident	91.1	Very high	58 Å²	58	24.5 Å²	24.5	29%	0.286	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	-108.1	-166.4	-61.1	-169.6	165.2	0	0	112	Y112 R154 R190	Y112-M156 HydrophobicContact CD1-CB 4.23Å; Y112-M156 HydrophobicContact CD1-CG 4.36Å; Y112-M156 HydrophobicContact CE1-CG 4.32Å; Y112-M156 HydrophobicContact CG-CB 4.42Å; R154-M156 PolarHBondContact NE-O 3.36Å; R154-M156 PolarHBondContact NH2-O 3.05Å; R154-M156 VanDerWaalsContact NH2-O 3.09Å; M156-R190 HydrophobicContact CE-CG 4.4Å; M156-R190 HydrophobicContact SD-CB 4.16Å; M156-R190 HydrophobicContact SD-CG 3.31Å; M156-R190 WeakPolarHBondContact SD-CG 3.45Å; M156-R190 PolarHBondContact SD-N 3.09Å
157	G	90.4	Very high	91	Very high	11 Å²	11	30.6 Å²	30.6	11%	0.113	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-3.5	178.7	0	0	0	0	0	115	Q108 D109 V110 M155	Q108-G157 CarbonylContact C-O 3.56Å; D109-G157 PolarHBondContact N-O 2.74Å; V110-G157 WeakPolarHBondContact CB-O 2.97Å; V110-G157 PolarHBondContact N-O 2.78Å; V110-G157 WeakPolarHBondContact O-CA 3.47Å; M155-G157 PolarHBondContact O-N 3.17Å
158	T	94	Very high	91.1	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.9	172.5	-56.1	0	0	0	0	109.2	L107 R154 M155 I194	L107-T158 CarbonylContact O-C 3.55Å; L107-T158 WeakPolarHBondContact O-CA 3.34Å; R154-T158 CarbonylContact C-O 3.51Å; R154-T158 WeakPolarHBondContact CA-O 3.49Å; M155-T158 PolarHBondContact N-O 3.03Å; M155-T158 PolarHBondContact O-N 3.17Å; T158-I194 HydrophobicContact CG2-CD1 4.09Å; T158-I194 HydrophobicContact CG2-CG1 4.13Å; T158-I194 WeakPolarHBondContact O-CD1 3.19Å
159	V	95.4	Very high	91.6	Very high	2 Å²	2	30 Å²	30	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	138	-177.1	178.5	0	0	0	0	109.6	G106 L107 V110 V152 P153 R154 M161 N210	G106-V159 WeakPolarHBondContact CA-O 3.33Å; L107-V159 HydrophobicContact CB-CB 4.35Å; L107-V159 PolarHBondContact N-O 2.81Å; L107-V159 PolarHBondContact O-N 2.69Å; V110-V159 HydrophobicContact CB-CG2 4.19Å; V110-V159 HydrophobicContact CG2-CB 4.46Å; V110-V159 HydrophobicContact CG2-CG2 3.94Å; V152-V159 HydrophobicContact CB-CG1 4.4Å; V152-V159 HydrophobicContact CG1-CG1 3.94Å; V152-V159 HydrophobicContact CG2-CG1 3.54Å; P153-V159 WeakPolarHBondContact O-CA 3.39Å; R154-V159 HydrophobicContact CB-CG2 4.03Å; V159-M161 HydrophobicContact CG1-CE 4.41Å; V159-M161 HydrophobicContact CG1-CG 4.39Å; V159-N210 PolarHBondContact O-ND2 2.86Å
160	L	97.6	Very high	92	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	123.1	173.6	176.7	55.8	0	0	0	110.2	P153 V162 I194 V196 N210 F251	P153-L160 WeakPolarHBondContact CD-O 3.12Å; P153-L160 PolarHBondContact O-N 3.23Å; L160-V162 HydrophobicContact CD1-CG2 4.37Å; L160-V162 HydrophobicContact CG-CG2 4.36Å; L160-I194 HydrophobicContact CB-CB 4.15Å; L160-I194 HydrophobicContact CB-CD1 4.36Å; L160-I194 HydrophobicContact CB-CG2 4Å; L160-I194 HydrophobicContact CD2-CB 4.37Å; L160-I194 HydrophobicContact CD2-CG2 4.11Å; L160-V196 HydrophobicContact CD2-CB 4.11Å; L160-V196 HydrophobicContact CD2-CG2 3.69Å; L160-V196 HydrophobicContact CG-CG2 4.43Å; L160-N210 HydrophobicContact CB-CB 4.18Å; L160-N210 HydrophobicContact CD1-CB 4.16Å; L160-N210 HydrophobicContact CD2-CB 4.25Å; L160-N210 HydrophobicContact CG-CB 4.43Å; L160-F251 HydrophobicContact CD1-CE2 4.03Å; L160-F251 HydrophobicContact CD1-CZ 3.73Å
161	M	98.1	Very high	92.7	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.4	173.1	-66.3	167	-73.5	0	0	109.5	A104 V105 L107 A130 F133 V152 V159 F163	A104-M161 CarbonylContact C-O 3.47Å; A104-M161 WeakPolarHBondContact CA-O 3.18Å; V105-M161 HydrophobicContact CB-CB 4.36Å; V105-M161 HydrophobicContact CB-CE 3.94Å; V105-M161 HydrophobicContact CG1-CE 3.69Å; V105-M161 PolarHBondContact N-O 2.93Å; V105-M161 PolarHBondContact O-N 3.37Å; L107-M161 HydrophobicContact CD1-CE 4.08Å; L107-M161 HydrophobicContact CG-CE 4.44Å; A130-M161 HydrophobicContact CB-SD 3.86Å; F133-M161 HydrophobicContact CB-CE 4.28Å; F133-M161 HydrophobicContact CB-SD 4.24Å; F133-M161 HydrophobicContact CD2-CE 3.72Å; F133-M161 HydrophobicContact CE2-CE 4.45Å; F133-M161 HydrophobicContact CG-CE 4.27Å; V152-M161 HydrophobicContact CG2-CG 3.34Å; V152-M161 HydrophobicContact CG2-SD 4.25Å; V159-M161 HydrophobicContact CG1-CE 4.41Å; V159-M161 HydrophobicContact CG1-CG 4.39Å; M161-F163 HydrophobicContact CB-CD2 4.4Å; M161-F163 HydrophobicContact CB-CE2 3.57Å; M161-F163 HydrophobicContact CB-CZ 3.87Å; M161-F163 HydrophobicContact CG-CE2 4.5Å; M161-F163 HydrophobicContact CG-CZ 4.4Å; M161-F163 HydrophobicContact SD-CE2 4.43Å; M161-F163 HydrophobicContact SD-CZ 4.12Å
162	V	98.4	Very high	93.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122	175.1	-173.5	0	0	0	0	108.1	M102 R144 L145 F147 L160 V164 V196 L198 L208	M102-V162 HydrophobicContact CG-CG1 4.05Å; M102-V162 HydrophobicContact SD-CG1 4.09Å; R144-V162 CarbonylContact C-O 3.55Å; R144-V162 WeakPolarHBondContact CA-O 3.13Å; L145-V162 HydrophobicContact CD1-CB 4.4Å; L145-V162 HydrophobicContact CD1-CG1 4.08Å; L145-V162 PolarHBondContact N-O 2.98Å; F147-V162 HydrophobicContact CZ-CB 4.25Å; F147-V162 HydrophobicContact CZ-CG2 4.07Å; L160-V162 HydrophobicContact CD1-CG2 4.37Å; L160-V162 HydrophobicContact CG-CG2 4.36Å; V162-V164 HydrophobicContact CG1-CG2 4.43Å; V162-V196 HydrophobicContact CG2-CG1 4.35Å; V162-L198 HydrophobicContact CG1-CD1 4.16Å; V162-L208 HydrophobicContact CB-CD1 4.48Å; V162-L208 HydrophobicContact CG1-CD1 3.94Å; V162-L208 HydrophobicContact CG2-CD1 3.65Å
163	F	98.2	Very high	93.3	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	132.7	178.3	-57.6	-82.5	0	0	0	108.6	M102 V103 V105 F133 K134 Y137 F142 A143 R144 M161	M102-F163 CarbonylContact C-O 3.5Å; M102-F163 VanDerWaalsContact CA-O 3.3Å; M102-F163 WeakPolarHBondContact CA-O 3.13Å; V103-F163 HydrophobicContact CB-CB 4.31Å; V103-F163 PolarHBondContact N-O 2.73Å; V103-F163 PolarHBondContact O-N 3.3Å; V105-F163 HydrophobicContact CG2-CD2 4.39Å; V105-F163 HydrophobicContact CG2-CE2 4.06Å; F133-F163 HydrophobicContact CB-CE2 4.17Å; F133-F163 HydrophobicContact CB-CZ 3.96Å; K134-F163 HydrophobicContact CB-CE1 4.41Å; Y137-F163 HydrophobicContact CD2-CD1 4.15Å; Y137-F163 AromaticContact CD2-CD2 3.47Å; Y137-F163 HydrophobicContact CD2-CD2 3.47Å; Y137-F163 VanDerWaalsContact CD2-CD2 3.47Å; Y137-F163 HydrophobicContact CD2-CE1 4.19Å; Y137-F163 AromaticContact CD2-CE2 3.51Å; Y137-F163 HydrophobicContact CD2-CE2 3.51Å; Y137-F163 AromaticContact CD2-CG 3.8Å; Y137-F163 HydrophobicContact CD2-CG 3.8Å; Y137-F163 AromaticContact CD2-CZ 3.88Å; Y137-F163 HydrophobicContact CD2-CZ 3.88Å; Y137-F163 AromaticContact CE2-CD2 3.88Å; Y137-F163 HydrophobicContact CE2-CD2 3.88Å; Y137-F163 AromaticContact CE2-CE2 3.87Å; Y137-F163 HydrophobicContact CE2-CE2 3.87Å; Y137-F163 HydrophobicContact CG-CB 4.49Å; Y137-F163 HydrophobicContact CG-CD1 4.38Å; Y137-F163 HydrophobicContact CG-CD2 4.19Å; Y137-F163 HydrophobicContact CG-CG 4.09Å; F142-F163 HydrophobicContact CB-CB 4.12Å; F142-F163 HydrophobicContact CD1-CB 4.13Å; F142-F163 HydrophobicContact CG-CB 4.45Å; A143-F163 CarbonylContact O-C 3.54Å; A143-F163 WeakPolarHBondContact O-CA 3.34Å; R144-F163 HydrophobicContact CB-CD1 3.72Å; R144-F163 HydrophobicContact CB-CE1 3.64Å; R144-F163 HydrophobicContact CG-CD1 4.06Å; R144-F163 HydrophobicContact CG-CE1 3.73Å; R144-F163 HydrophobicContact CG-CZ 4.29Å; M161-F163 HydrophobicContact CB-CD2 4.4Å; M161-F163 HydrophobicContact CB-CE2 3.57Å; M161-F163 HydrophobicContact CB-CZ 3.87Å; M161-F163 HydrophobicContact CG-CE2 4.5Å; M161-F163 HydrophobicContact CG-CZ 4.4Å; M161-F163 HydrophobicContact SD-CE2 4.43Å; M161-F163 HydrophobicContact SD-CZ 4.12Å
164	V	97.9	Very high	93.4	Very high	5 Å²	5	28.4 Å²	28.4	3%	0.03	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	141.2	177.2	-178.2	0	0	0	0	107.5	M102 F142 A143 L145 V162 R166 L168 L169	M102-V164 HydrophobicContact CE-CG2 4.13Å; M102-V164 HydrophobicContact CG-CG2 4.23Å; F142-V164 CarbonylContact C-O 3.54Å; F142-V164 VanDerWaalsContact CA-O 3.31Å; F142-V164 WeakPolarHBondContact CA-O 3.22Å; A143-V164 PolarHBondContact N-O 3.24Å; A143-V164 PolarHBondContact O-N 3.24Å; L145-V164 HydrophobicContact CD1-CG2 3.92Å; L145-V164 HydrophobicContact CG-CG2 4.15Å; V162-V164 HydrophobicContact CG1-CG2 4.43Å; V164-R166 PolarHBondContact O-N 2.75Å; V164-L168 HydrophobicContact CG1-CB 3.92Å; V164-L169 HydrophobicContact CB-CD2 3.86Å; V164-L169 HydrophobicContact CB-CG 4.44Å; V164-L169 HydrophobicContact CG1-CD2 4.26Å; V164-L169 HydrophobicContact CG2-CD2 4.48Å
165	K	96.5	Very high	93.6	Very high	38 Å²	38	26.2 Å²	26.2	17%	0.165	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	134.3	171.1	-80.3	-178.3	173.5	150.7	0	109.7	F100 D101 F142 E167 L168 L169	F100-K165 WeakPolarHBondContact O-CE 3.17Å; F100-K165 PolarHBondContact O-NZ 3.05Å; D101-K165 PolarHBondContact O-N 2.53Å; D101-K165 IonicContact OD1-NZ 2.73Å; D101-K165 PolarHBondContact OD1-NZ 3.24Å; F142-K165 HydrophobicContact CD1-CG 4.19Å; F142-K165 HydrophobicContact CE1-CG 3.79Å; F142-K165 HydrophobicContact CE2-CG 4.27Å; F142-K165 HydrophobicContact CZ-CG 3.84Å; K165-E167 VanDerWaalsContact C-N 3.27Å; K165-E167 HydrophobicContact CB-CG 4.35Å; K165-E167 PolarHBondContact O-N 3.34Å; K165-L168 HydrophobicContact CB-CB 4.34Å; K165-L168 HydrophobicContact CB-CD1 3.99Å; K165-L168 HydrophobicContact CB-CG 3.98Å; K165-L168 HydrophobicContact CD-CD1 4.18Å; K165-L168 WeakPolarHBondContact O-CA 3.37Å; K165-L168 WeakPolarHBondContact O-CB 3.47Å; K165-L168 PolarHBondContact O-N 2.85Å; K165-L169 PolarHBondContact O-N 3.07Å
166	R	95.5	Very high	93.8	Very high	33 Å²	33	26.8 Å²	26.8	13%	0.125	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-53.4	-44.4	-174.3	-73.4	179.1	-172.2	104.2	4.4	112.6	A138 G141 F142 A143 V164 L168 L169 K427 F428 L485	A138-R166 PolarHBondContact O-NH1 3.37Å; A138-R166 PolarHBondContact O-NH2 3.09Å; G141-R166 VanDerWaalsContact CA-NH1 3.27Å; G141-R166 WeakPolarHBondContact O-CG 3.36Å; G141-R166 PolarHBondContact O-N 3.2Å; F142-R166 VanDerWaalsContact O-CZ 3.26Å; F142-R166 PolarHBondContact O-NH2 3.3Å; A143-R166 HydrophobicContact CB-CG 3.88Å; V164-R166 PolarHBondContact O-N 2.75Å; R166-L168 PolarHBondContact O-N 3.13Å; R166-L169 WeakPolarHBondContact O-CB 3.43Å; R166-L169 PolarHBondContact O-N 3.15Å; R166-K427 PolarHBondContact NH2-O 2.66Å; R166-K427 VanDerWaalsContact NH2-O 3.17Å; R166-F428 HydrophobicContact CB-CE1 4.41Å; R166-F428 HydrophobicContact CB-CZ 4.33Å; R166-F428 HydrophobicContact CG-CE1 4.11Å; R166-F428 HydrophobicContact CG-CE2 4.45Å; R166-F428 HydrophobicContact CG-CZ 3.98Å; R166-F428 PolarHBondContact NE-O 3.43Å; R166-F428 PolarHBondContact NH2-O 3.13Å; R166-L485 WeakPolarHBondContact O-CD1 3.18Å
167	E	91.2	Very high	94.2	Very high	131 Å²	131	25.8 Å²	25.8	61%	0.612	12%	0.123	S	C	*	.	G	3₁₀ helix	trans	-62.9	-20.7	178.5	68.3	-169.4	179.4	0	0	113.9	K165 Q170	K165-E167 VanDerWaalsContact C-N 3.27Å; K165-E167 HydrophobicContact CB-CG 4.35Å; K165-E167 PolarHBondContact O-N 3.34Å; E167-Q170 PolarHBondContact O-NE2 3.17Å
168	L	92.3	Very high	94.3	Very high	47 Å²	47	27.6 Å²	27.6	25%	0.246	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-95.8	-12.7	-178.6	-57.8	-177.1	0	0	0	113.6	D101 V164 K165 R166 Q170 Y171	D101-L168 HydrophobicContact CB-CD1 3.51Å; V164-L168 HydrophobicContact CG1-CB 3.92Å; K165-L168 HydrophobicContact CB-CB 4.34Å; K165-L168 HydrophobicContact CB-CD1 3.99Å; K165-L168 HydrophobicContact CB-CG 3.98Å; K165-L168 HydrophobicContact CD-CD1 4.18Å; K165-L168 WeakPolarHBondContact O-CA 3.37Å; K165-L168 WeakPolarHBondContact O-CB 3.47Å; K165-L168 PolarHBondContact O-N 2.85Å; R166-L168 PolarHBondContact O-N 3.13Å; L168-Q170 PolarHBondContact O-N 2.94Å; L168-Y171 HydrophobicContact CB-CD2 4.39Å; L168-Y171 HydrophobicContact CD2-CD2 4.05Å; L168-Y171 HydrophobicContact CD2-CE2 4.01Å; L168-Y171 WeakPolarHBondContact O-CB 3.21Å; L168-Y171 PolarHBondContact O-N 3.25Å
169	L	93.7	Very high	94.3	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-55.6	-37.2	-179.3	-79.8	174.5	0	0	0	112.5	A143 L145 V164 K165 R166 Y171 V172 F428 L485	A143-L169 HydrophobicContact CB-CD1 3.78Å; L145-L169 HydrophobicContact CD2-CD2 3.41Å; L145-L169 VanDerWaalsContact CD2-CD2 3.41Å; L145-L169 HydrophobicContact CG-CD2 4.36Å; V164-L169 HydrophobicContact CB-CD2 3.86Å; V164-L169 HydrophobicContact CB-CG 4.44Å; V164-L169 HydrophobicContact CG1-CD2 4.26Å; V164-L169 HydrophobicContact CG2-CD2 4.48Å; K165-L169 PolarHBondContact O-N 3.07Å; R166-L169 WeakPolarHBondContact O-CB 3.43Å; R166-L169 PolarHBondContact O-N 3.15Å; L169-Y171 PolarHBondContact O-N 3.36Å; L169-Y171 VanDerWaalsContact O-N 3.07Å; L169-V172 WeakPolarHBondContact O-CB 3.19Å; L169-V172 PolarHBondContact O-N 3.42Å; L169-F428 HydrophobicContact CD1-CE2 3.65Å; L169-F428 HydrophobicContact CD1-CZ 3.61Å; L169-L485 HydrophobicContact CB-CD1 4.01Å
170	Q	90.5	Very high	94.2	Very high	46 Å²	46	31.6 Å²	31.6	22%	0.215	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-61.2	-17	178.3	64.4	179.8	-11	0	0	114.5	E167 L168 R173 L485	E167-Q170 PolarHBondContact O-NE2 3.17Å; L168-Q170 PolarHBondContact O-N 2.94Å; Q170-R173 PolarHBondContact O-NH1 3.03Å; Q170-L485 HydrophobicContact CB-CB 4.29Å; Q170-L485 HydrophobicContact CB-CG 4.21Å
171	Y	90.3	Very high	94	Very high	93 Å²	93	33 Å²	33	37%	0.365	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-89.5	-10.4	175.1	-56.9	-69.2	0	0	0	112.5	L168 L169 R173 I200 G201	L168-Y171 HydrophobicContact CB-CD2 4.39Å; L168-Y171 HydrophobicContact CD2-CD2 4.05Å; L168-Y171 HydrophobicContact CD2-CE2 4.01Å; L168-Y171 WeakPolarHBondContact O-CB 3.21Å; L168-Y171 PolarHBondContact O-N 3.25Å; L169-Y171 PolarHBondContact O-N 3.36Å; L169-Y171 VanDerWaalsContact O-N 3.07Å; Y171-R173 PolarHBondContact O-N 3.11Å; Y171-I200 CarbonylContact O-C 3.51Å; Y171-I200 WeakPolarHBondContact O-CA 3.28Å; Y171-G201 PolarHBondContact O-N 2.9Å
172	V	92.5	Very high	93.5	Very high	4 Å²	4	33 Å²	33	2%	0.024	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	105.5	171	-174.7	0	0	0	0	108.1	L169 A175 L198 C481	L169-V172 WeakPolarHBondContact O-CB 3.19Å; L169-V172 PolarHBondContact O-N 3.42Å; V172-A175 HydrophobicContact CG1-CB 4.38Å; V172-L198 HydrophobicContact CG1-CD2 4.24Å; V172-C481 HydrophobicContact CG1-CB 4.3Å; V172-C481 PolarHBondContact O-SG 2.88Å
173	R	90	Very high	92.6	Very high	34 Å²	34	33.7 Å²	33.7	13%	0.128	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-21.7	-177.1	-62.2	-51	-166.8	-162.5	-3.7	114.2	Q170 Y171 T199 G201 S479 I483	Q170-R173 PolarHBondContact O-NH1 3.03Å; Y171-R173 PolarHBondContact O-N 3.11Å; R173-T199 HydrophobicContact CB-CG2 4.49Å; R173-T199 PolarHBondContact N-O 3.12Å; R173-G201 WeakPolarHBondContact CG-O 3.5Å; R173-S479 WeakPolarHBondContact O-CB 3.5Å; R173-S479 PolarHBondContact O-OG 3.26Å; R173-I483 PolarHBondContact NH1-O 3.36Å
174	S	92.3	Very high	91.4	Very high	19 Å²	19	39.6 Å²	39.6	13%	0.133	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	142.2	175.5	-171.7	0	0	0	0	109.3	L198 T199 S479	S174-L198 CarbonylContact O-C 3.54Å; S174-L198 WeakPolarHBondContact O-CA 3.36Å; S174-T199 PolarHBondContact N-O 3.06Å; S174-T199 PolarHBondContact O-N 2.81Å; S174-S479 CarbonylContact C-O 3.59Å; S174-S479 WeakPolarHBondContact CA-O 3.3Å
175	A	94.8	Very high	90	Very high	8 Å²	8	45.7 Å²	45.7	7%	0.066	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	108.1	173.2	0	0	0	0	0	109.1	F147 V172 L198 S479 C481	F147-A175 HydrophobicContact CD1-CB 3.83Å; F147-A175 HydrophobicContact CE1-CB 3.99Å; V172-A175 HydrophobicContact CG1-CB 4.38Å; A175-L198 HydrophobicContact CB-CD2 3.65Å; A175-S479 PolarHBondContact N-O 3.38Å; A175-C481 HydrophobicContact CB-CB 3.87Å
176	E	94.2	Very high	88.7	Confident	28 Å²	28	45.3 Å²	45.3	13%	0.131	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	142.5	-176.1	-58	179.9	-105.3	0	0	110	V196 R197 F236 S237	E176-V196 CarbonylContact O-C 3.58Å; E176-V196 VanDerWaalsContact O-CA 3.29Å; E176-V196 WeakPolarHBondContact O-CA 3.43Å; E176-R197 HydrophobicContact CB-CB 4.47Å; E176-R197 PolarHBondContact N-O 2.85Å; E176-R197 PolarHBondContact O-N 3.47Å; E176-R197 IonicContact OE1-CZ 3.03Å; E176-R197 IonicContact OE1-NE 3.42Å; E176-R197 PolarHBondContact OE1-NE 3.25Å; E176-R197 IonicContact OE1-NH2 2.74Å; E176-F236 HydrophobicContact CB-CD1 3.68Å; E176-F236 HydrophobicContact CB-CE1 4.3Å; E176-S237 VanDerWaalsContact CD-OG 3.25Å; E176-S237 WeakPolarHBondContact OE2-CB 3.4Å; E176-S237 PolarHBondContact OE2-N 3.45Å; E176-S237 PolarHBondContact OE2-OG 3.18Å
177	L	94.1	Very high	87.1	Confident	37 Å²	37	51.2 Å²	51.2	19%	0.194	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	129.1	-176	175.4	65.3	0	0	0	109.8	F147 K149 P153 Y179 I194 V196	F147-L177 HydrophobicContact CB-CB 4.12Å; F147-L177 HydrophobicContact CB-CD2 4.03Å; F147-L177 HydrophobicContact CD1-CB 4.25Å; F147-L177 HydrophobicContact CD2-CD2 4.36Å; F147-L177 HydrophobicContact CG-CB 4.16Å; F147-L177 HydrophobicContact CG-CD2 4.26Å; K149-L177 HydrophobicContact CD-CD2 4.21Å; P153-L177 HydrophobicContact CB-CD1 3.83Å; P153-L177 HydrophobicContact CB-CD2 3.83Å; P153-L177 HydrophobicContact CB-CG 4.5Å; P153-L177 HydrophobicContact CG-CD1 4.14Å; P153-L177 HydrophobicContact CG-CD2 3.73Å; L177-Y179 HydrophobicContact CD2-CE2 4.06Å; L177-Y179 WeakPolarHBondContact CD2-OH 3.3Å; L177-Y179 HydrophobicContact CG-CE2 4.03Å; L177-I194 HydrophobicContact CD1-CG2 3.53Å; L177-V196 HydrophobicContact CD1-CG2 3.6Å
178	K	93.4	Very high	86.2	Confident	49 Å²	49	45.7 Å²	45.7	21%	0.213	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.9	179.2	-167	159.5	-169.6	177.9	0	111.4	C195 M233 D235 F236	K178-C195 HydrophobicContact CB-CB 4.41Å; K178-C195 PolarHBondContact N-O 3.39Å; K178-C195 PolarHBondContact O-N 3.49Å; K178-M233 WeakPolarHBondContact CD-O 3.21Å; K178-M233 WeakPolarHBondContact CE-O 3.45Å; K178-M233 PolarHBondContact NZ-O 2.85Å; K178-D235 WeakPolarHBondContact CD-O 3.1Å; K178-D235 PolarHBondContact NZ-O 3.3Å; K178-D235 IonicContact NZ-OD1 2.66Å; K178-D235 PolarHBondContact NZ-OD1 3.23Å; K178-D235 IonicContact NZ-OD2 3.63Å; K178-F236 HydrophobicContact CB-CE1 4.11Å
179	Y	93.2	Very high	85.1	Confident	80 Å²	80	44.2 Å²	44.2	31%	0.314	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.5	174.9	-55.3	-90.3	0	0	0	108.5	K149 R154 M155 L177 I194	K149-Y179 PolarHBondContact NZ-OH 3.15Å; K149-Y179 VanDerWaalsContact NZ-OH 3.12Å; R154-Y179 VanDerWaalsContact O-CE1 3.29Å; R154-Y179 WeakPolarHBondContact O-CE1 3.29Å; M155-Y179 HydrophobicContact CB-CD1 4.19Å; L177-Y179 HydrophobicContact CD2-CE2 4.06Å; L177-Y179 WeakPolarHBondContact CD2-OH 3.3Å; L177-Y179 HydrophobicContact CG-CE2 4.03Å; Y179-I194 HydrophobicContact CD1-CD1 4.45Å; Y179-I194 HydrophobicContact CD1-CG1 3.99Å; Y179-I194 HydrophobicContact CD1-CG2 4.25Å; Y179-I194 HydrophobicContact CE1-CD1 4.23Å; Y179-I194 HydrophobicContact CE1-CG1 4.23Å; Y179-I194 HydrophobicContact CE1-CG2 4.12Å
180	V	93.7	Very high	84.5	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.036	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	109.3	174.8	-175.8	0	0	0	0	107.8	G192 A193 I230 M233	V180-G192 CarbonylContact O-C 3.6Å; V180-G192 WeakPolarHBondContact O-CA 3.25Å; V180-A193 PolarHBondContact N-O 3.21Å; V180-A193 PolarHBondContact O-N 3.12Å; V180-I230 HydrophobicContact CB-CG1 4.35Å; V180-I230 HydrophobicContact CG1-CG1 4Å; V180-M233 HydrophobicContact CB-CB 4.4Å; V180-M233 HydrophobicContact CG1-CB 3.75Å; V180-M233 HydrophobicContact CG1-CG 4.35Å; V180-M233 HydrophobicContact CG2-CB 3.7Å
181	S	92.6	Very high	84.5	Confident	30 Å²	30	51.8 Å²	51.8	21%	0.21	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	134.7	175	174.8	0	0	0	0	109.6	G186 S188	S181-G186 VanDerWaalsContact CB-O 3.29Å; S181-G186 WeakPolarHBondContact CB-O 3.34Å; S181-G186 VanDerWaalsContact O-CA 3.28Å; S181-G186 WeakPolarHBondContact O-CA 3.17Å; S181-G186 VanDerWaalsContact OG-C 3.23Å; S181-G186 WeakPolarHBondContact OG-CA 3.34Å; S181-G186 PolarHBondContact OG-O 3.48Å; S181-S188 PolarHBondContact OG-O 3.41Å
182	T	88.5	Confident	84.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-33.1	178.3	54.9	0	0	0	0	112.8	N185 G186 K191 G192 Y222 W225 E226 R229 I230	T182-N185 PolarHBondContact O-N 2.99Å; T182-G186 PolarHBondContact O-N 3.31Å; T182-K191 PolarHBondContact N-O 2.8Å; T182-K191 PolarHBondContact OG1-O 3.17Å; T182-G192 VanDerWaalsContact OG1-CA 3.25Å; T182-G192 WeakPolarHBondContact OG1-CA 3.49Å; T182-G192 PolarHBondContact OG1-N 3.05Å; T182-G192 VanDerWaalsContact OG1-N 3.1Å; T182-Y222 PolarHBondContact O-OH 3.34Å; T182-W225 HydrophobicContact CG2-CZ3 4.42Å; T182-E226 VanDerWaalsContact CB-OE1 3.29Å; T182-E226 WeakPolarHBondContact CB-OE1 3.49Å; T182-E226 HydrophobicContact CG2-CB 4.11Å; T182-E226 HydrophobicContact CG2-CG 4.1Å; T182-E226 PolarHBondContact OG1-OE1 3.03Å; T182-R229 HydrophobicContact CG2-CG 4.36Å; T182-I230 HydrophobicContact CG2-CD1 4.23Å; T182-I230 HydrophobicContact CG2-CG1 4.02Å
183	A	78.7	Confident	84.9	Confident	15 Å²	15	47.1 Å²	47.1	12%	0.124	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	143.4	-179.6	0	0	0	0	0	112.3	N185 G186 L187 S188 R190 K191	A183-N185 VanDerWaalsContact C-N 3.26Å; A183-N185 PolarHBondContact O-N 3.46Å; A183-G186 CarbonylContact O-C 3.59Å; A183-G186 WeakPolarHBondContact O-CA 3.44Å; A183-G186 PolarHBondContact O-N 2.79Å; A183-L187 PolarHBondContact O-N 3.49Å; A183-L187 VanDerWaalsContact O-N 3.17Å; A183-S188 WeakPolarHBondContact CB-O 3.31Å; A183-S188 PolarHBondContact O-N 3.07Å; A183-R190 HydrophobicContact CB-CB 4.42Å; A183-K191 HydrophobicContact CB-CB 3.8Å; A183-K191 HydrophobicContact CB-CG 4.1Å
184	L	74.5	Confident	85.2	Confident	126 Å²	126	45.5 Å²	45.5	66%	0.66	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	50.9	45.5	-173.5	-58.8	-179.5	0	0	0	112	G186 L187	L184-G186 PolarHBondContact O-N 2.87Å; L184-L187 HydrophobicContact CB-CB 3.99Å; L184-L187 WeakPolarHBondContact O-CB 3.29Å; L184-L187 WeakPolarHBondContact O-CG 3Å; L184-L187 PolarHBondContact O-N 2.99Å; L184-L187 VanDerWaalsContact O-N 3.11Å
185	N	68.4	Low	85.4	Confident	134 Å²	134	44.6 Å²	44.6	72%	0.717	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	54.5	35.5	-175.7	-62.9	-19.9	0	0	0	113.2	T182 A183	T182-N185 PolarHBondContact O-N 2.99Å; A183-N185 VanDerWaalsContact C-N 3.26Å; A183-N185 PolarHBondContact O-N 3.46Å
186	G	67.6	Low	85.5	Confident	30 Å²	30	44.2 Å²	44.2	31%	0.309	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	94	-4	179.9	0	0	0	0	0	115.6	S181 T182 A183 L184 S188	S181-G186 VanDerWaalsContact CB-O 3.29Å; S181-G186 WeakPolarHBondContact CB-O 3.34Å; S181-G186 VanDerWaalsContact O-CA 3.28Å; S181-G186 WeakPolarHBondContact O-CA 3.17Å; S181-G186 VanDerWaalsContact OG-C 3.23Å; S181-G186 WeakPolarHBondContact OG-CA 3.34Å; S181-G186 PolarHBondContact OG-O 3.48Å; T182-G186 PolarHBondContact O-N 3.31Å; A183-G186 CarbonylContact O-C 3.59Å; A183-G186 WeakPolarHBondContact O-CA 3.44Å; A183-G186 PolarHBondContact O-N 2.79Å; L184-G186 PolarHBondContact O-N 2.87Å; G186-S188 VanDerWaalsContact C-N 3.27Å; G186-S188 PolarHBondContact O-N 3.19Å
187	L	62.7	Low	85.6	Confident	157 Å²	157	43 Å²	43	82%	0.822	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-11.9	179.1	-64.6	169.2	0	0	0	113.8	A183 L184	A183-L187 PolarHBondContact O-N 3.49Å; A183-L187 VanDerWaalsContact O-N 3.17Å; L184-L187 HydrophobicContact CB-CB 3.99Å; L184-L187 WeakPolarHBondContact O-CB 3.29Å; L184-L187 WeakPolarHBondContact O-CG 3Å; L184-L187 PolarHBondContact O-N 2.99Å; L184-L187 VanDerWaalsContact O-N 3.11Å
188	S	71.8	Confident	85.7	Confident	14 Å²	14	41.2 Å²	41.2	10%	0.098	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	120.8	-176.2	-178.8	0	0	0	0	112.7	S181 A183 G186 R190	S181-S188 PolarHBondContact OG-O 3.41Å; A183-S188 WeakPolarHBondContact CB-O 3.31Å; A183-S188 PolarHBondContact O-N 3.07Å; G186-S188 VanDerWaalsContact C-N 3.27Å; G186-S188 PolarHBondContact O-N 3.19Å; S188-R190 PolarHBondContact O-N 3Å; S188-R190 WeakPolarHBondContact OG-CG 3.37Å
189	G	70.4	Confident	85.6	Confident	16 Å²	16	39.5 Å²	39.5	17%	0.165	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	16.2	176	0	0	0	0	0	115.5	M155 K191	M155-G189 CarbonylContact C-O 3.58Å; M155-G189 WeakPolarHBondContact CG-O 3.41Å; G189-K191 VanDerWaalsContact C-N 3.3Å
190	R	80.5	Confident	85.4	Confident	176 Å²	176	36.7 Å²	36.7	66%	0.664	20%	0.197	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71	-26.6	177.8	-72.9	-175.6	-177.1	172.8	-0.1	113.1	M156 A183 S188	M156-R190 HydrophobicContact CE-CG 4.4Å; M156-R190 HydrophobicContact SD-CB 4.16Å; M156-R190 HydrophobicContact SD-CG 3.31Å; M156-R190 WeakPolarHBondContact SD-CG 3.45Å; M156-R190 PolarHBondContact SD-N 3.09Å; A183-R190 HydrophobicContact CB-CB 4.42Å; S188-R190 PolarHBondContact O-N 3Å; S188-R190 WeakPolarHBondContact OG-CG 3.37Å
191	K	90.1	Very high	84.9	Confident	31 Å²	31	36.8 Å²	36.8	14%	0.135	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	154.1	-178	-60.5	-67.5	-178	-106.5	0	109.9	M155 T182 A183 G189 H212 L213	M155-K191 WeakPolarHBondContact CE-O 3.46Å; T182-K191 PolarHBondContact N-O 2.8Å; T182-K191 PolarHBondContact OG1-O 3.17Å; A183-K191 HydrophobicContact CB-CB 3.8Å; A183-K191 HydrophobicContact CB-CG 4.1Å; G189-K191 VanDerWaalsContact C-N 3.3Å; K191-H212 VanDerWaalsContact CA-O 3.3Å; K191-H212 WeakPolarHBondContact CA-O 3.48Å; K191-H212 WeakPolarHBondContact CB-O 3.47Å; K191-H212 HydrophobicContact CD-CB 4.48Å; K191-H212 VanDerWaalsContact CD-O 3.24Å; K191-H212 WeakPolarHBondContact CD-O 3.33Å; K191-H212 PolarHBondContact NZ-CE1 3.09Å; K191-H212 PolarHBondContact NZ-ND1 3.19Å; K191-H212 PolarHBondContact NZ-NE2 3.27Å; K191-H212 VanDerWaalsContact NZ-NE2 3.1Å; K191-L213 VanDerWaalsContact CD-O 3.32Å; K191-L213 WeakPolarHBondContact CD-O 3.38Å; K191-L213 WeakPolarHBondContact CE-O 3.4Å
192	G	94.6	Very high	83.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128.3	-142.3	-178.1	0	0	0	0	0	110.9	V180 T182 S211 H212	V180-G192 CarbonylContact O-C 3.6Å; V180-G192 WeakPolarHBondContact O-CA 3.25Å; T182-G192 VanDerWaalsContact OG1-CA 3.25Å; T182-G192 WeakPolarHBondContact OG1-CA 3.49Å; T182-G192 PolarHBondContact OG1-N 3.05Å; T182-G192 VanDerWaalsContact OG1-N 3.1Å; G192-S211 CarbonylContact O-C 3.47Å; G192-S211 VanDerWaalsContact O-CA 3.29Å; G192-S211 WeakPolarHBondContact O-CA 3.35Å; G192-H212 PolarHBondContact N-O 2.95Å; G192-H212 PolarHBondContact O-N 2.99Å
193	A	97	Very high	83.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.2	-175.7	0	0	0	0	0	114.4	V180 I209 N210 I230	V180-A193 PolarHBondContact N-O 3.21Å; V180-A193 PolarHBondContact O-N 3.12Å; A193-I209 HydrophobicContact CB-CG2 3.8Å; A193-N210 CarbonylContact C-O 3.56Å; A193-N210 WeakPolarHBondContact CA-O 3.29Å; A193-N210 WeakPolarHBondContact CB-O 2.86Å; A193-I230 HydrophobicContact CB-CD1 3.94Å; A193-I230 HydrophobicContact CB-CG1 4.12Å; A193-I230 HydrophobicContact CB-CG2 3.75Å
194	I	96.9	Very high	84.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115.1	161.4	-52.3	-179.2	0	0	0	106.4	P153 M155 T158 L160 L177 Y179 N210	P153-I194 HydrophobicContact CB-CG2 4.16Å; M155-I194 HydrophobicContact CB-CD1 4.26Å; M155-I194 HydrophobicContact CB-CG1 4.15Å; T158-I194 HydrophobicContact CG2-CD1 4.09Å; T158-I194 HydrophobicContact CG2-CG1 4.13Å; T158-I194 WeakPolarHBondContact O-CD1 3.19Å; L160-I194 HydrophobicContact CB-CB 4.15Å; L160-I194 HydrophobicContact CB-CD1 4.36Å; L160-I194 HydrophobicContact CB-CG2 4Å; L160-I194 HydrophobicContact CD2-CB 4.37Å; L160-I194 HydrophobicContact CD2-CG2 4.11Å; L177-I194 HydrophobicContact CD1-CG2 3.53Å; Y179-I194 HydrophobicContact CD1-CD1 4.45Å; Y179-I194 HydrophobicContact CD1-CG1 3.99Å; Y179-I194 HydrophobicContact CD1-CG2 4.25Å; Y179-I194 HydrophobicContact CE1-CD1 4.23Å; Y179-I194 HydrophobicContact CE1-CG1 4.23Å; Y179-I194 HydrophobicContact CE1-CG2 4.12Å; I194-N210 PolarHBondContact N-O 2.85Å; I194-N210 PolarHBondContact O-N 3.42Å
195	C	97	Very high	84.9	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.4	176.2	-19.9	0	0	0	0	109	K178 L208 I209 C234 F236	K178-C195 HydrophobicContact CB-CB 4.41Å; K178-C195 PolarHBondContact N-O 3.39Å; K178-C195 PolarHBondContact O-N 3.49Å; C195-L208 CarbonylContact C-O 3.6Å; C195-L208 WeakPolarHBondContact CA-O 3.4Å; C195-I209 HydrophobicContact CB-CG1 4.29Å; C195-C234 HydrophobicContact CB-CB 3.9Å; C195-C234 WeakPolarHBondContact CB-SG 3.44Å; C195-C234 WeakPolarHBondContact SG-CB 3.45Å; C195-C234 CovalentContact SG-SG 2.07Å; C195-C234 PolarHBondContact SG-SG 3.39Å; C195-F236 HydrophobicContact CB-CE1 4.31Å; C195-F236 HydrophobicContact CB-CZ 3.7Å
196	V	96.8	Very high	86.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.7	169.8	162	0	0	0	0	108.2	F147 L160 V162 E176 L177 L198 T207 L208	F147-V196 HydrophobicContact CE1-CB 4.27Å; F147-V196 HydrophobicContact CE1-CG1 3.43Å; F147-V196 VanDerWaalsContact CE1-CG1 3.43Å; F147-V196 HydrophobicContact CE1-CG2 3.81Å; F147-V196 HydrophobicContact CE2-CG2 4.11Å; F147-V196 HydrophobicContact CZ-CB 4.24Å; F147-V196 HydrophobicContact CZ-CG1 3.61Å; F147-V196 HydrophobicContact CZ-CG2 3.55Å; L160-V196 HydrophobicContact CD2-CB 4.11Å; L160-V196 HydrophobicContact CD2-CG2 3.69Å; L160-V196 HydrophobicContact CG-CG2 4.43Å; V162-V196 HydrophobicContact CG2-CG1 4.35Å; E176-V196 CarbonylContact O-C 3.58Å; E176-V196 VanDerWaalsContact O-CA 3.29Å; E176-V196 WeakPolarHBondContact O-CA 3.43Å; L177-V196 HydrophobicContact CD1-CG2 3.6Å; V196-L198 HydrophobicContact CG1-CD2 3.8Å; V196-L198 HydrophobicContact CG1-CG 3.99Å; V196-T207 CarbonylContact O-C 3.6Å; V196-T207 VanDerWaalsContact O-CA 3.25Å; V196-T207 WeakPolarHBondContact O-CA 3.25Å; V196-L208 HydrophobicContact CB-CB 4.41Å; V196-L208 PolarHBondContact N-O 3.19Å; V196-L208 PolarHBondContact O-N 3.41Å
197	R	95.5	Very high	87.6	Confident	1 Å²	1	26.1 Å²	26.1	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.7	168.6	178.2	170.1	114.8	144	8	109.8	E176 H205 T207 F236 D245	E176-R197 HydrophobicContact CB-CB 4.47Å; E176-R197 PolarHBondContact N-O 2.85Å; E176-R197 PolarHBondContact O-N 3.47Å; E176-R197 IonicContact OE1-CZ 3.03Å; E176-R197 IonicContact OE1-NE 3.42Å; E176-R197 PolarHBondContact OE1-NE 3.25Å; E176-R197 IonicContact OE1-NH2 2.74Å; R197-H205 PolarHBondContact NH2-CE1 2.85Å; R197-H205 PolarHBondContact NH2-NE2 3.24Å; R197-T207 WeakPolarHBondContact CB-OG1 3.45Å; R197-T207 WeakPolarHBondContact CG-OG1 2.95Å; R197-F236 HydrophobicContact CB-CD1 3.68Å; R197-F236 HydrophobicContact CB-CD2 3.76Å; R197-F236 HydrophobicContact CB-CE1 3.51Å; R197-F236 HydrophobicContact CB-CE2 3.59Å; R197-F236 HydrophobicContact CB-CG 3.79Å; R197-F236 HydrophobicContact CB-CZ 3.45Å; R197-F236 VanDerWaalsContact CB-CZ 3.45Å; R197-F236 HydrophobicContact CG-CD2 4.3Å; R197-F236 HydrophobicContact CG-CE2 4.41Å; R197-F236 HydrophobicContact CG-CG 4.45Å; R197-D245 IonicContact CZ-OD1 2.69Å; R197-D245 IonicContact NH1-OD1 2.81Å; R197-D245 PolarHBondContact NH1-OD1 3.49Å
198	L	95.1	Very high	89.3	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.6	172.3	-55.9	-177.6	0	0	0	108.7	M102 L145 F147 V162 V172 S174 A175 V196 I200 H205 V206	M102-L198 HydrophobicContact CE-CD1 3.45Å; M102-L198 VanDerWaalsContact CE-CD1 3.45Å; M102-L198 HydrophobicContact SD-CD1 3.92Å; L145-L198 HydrophobicContact CD1-CD1 3.81Å; L145-L198 HydrophobicContact CD1-CD2 3.62Å; L145-L198 HydrophobicContact CD1-CG 4.4Å; F147-L198 HydrophobicContact CE1-CD2 4.06Å; V162-L198 HydrophobicContact CG1-CD1 4.16Å; V172-L198 HydrophobicContact CG1-CD2 4.24Å; S174-L198 CarbonylContact O-C 3.54Å; S174-L198 WeakPolarHBondContact O-CA 3.36Å; A175-L198 HydrophobicContact CB-CD2 3.65Å; V196-L198 HydrophobicContact CG1-CD2 3.8Å; V196-L198 HydrophobicContact CG1-CG 3.99Å; L198-I200 HydrophobicContact CB-CG1 4.42Å; L198-H205 WeakPolarHBondContact O-CA 3.45Å; L198-V206 PolarHBondContact N-O 3.2Å; L198-V206 PolarHBondContact O-N 2.89Å
199	T	91.6	Very high	90.6	Very high	14 Å²	14	18 Å²	18	9%	0.086	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	113.8	164.5	-55.8	0	0	0	0	107.4	R173 S174 V204 H205	R173-T199 HydrophobicContact CB-CG2 4.49Å; R173-T199 PolarHBondContact N-O 3.12Å; S174-T199 PolarHBondContact N-O 3.06Å; S174-T199 PolarHBondContact O-N 2.81Å; T199-V204 WeakPolarHBondContact CA-O 3.29Å; T199-H205 PolarHBondContact OG1-CE1 3.45Å; T199-H205 VanDerWaalsContact OG1-CE1 3.26Å; T199-H205 PolarHBondContact OG1-ND1 2.85Å
200	I	89.8	Confident	91.9	Very high	21 Å²	21	17.2 Å²	17.2	11%	0.108	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	133.5	178.1	-52.3	179.7	0	0	0	108	M102 Y171 L198 D202 V204 V206 Y374	M102-I200 HydrophobicContact CE-CD1 3.97Å; Y171-I200 CarbonylContact O-C 3.51Å; Y171-I200 WeakPolarHBondContact O-CA 3.28Å; L198-I200 HydrophobicContact CB-CG1 4.42Å; I200-D202 PolarHBondContact O-N 3.32Å; I200-V204 PolarHBondContact N-O 2.84Å; I200-V204 PolarHBondContact O-N 2.89Å; I200-V204 VanDerWaalsContact O-N 3.16Å; I200-V206 HydrophobicContact CD1-CB 4.34Å; I200-V206 HydrophobicContact CD1-CG2 3.63Å; I200-V206 HydrophobicContact CG1-CG2 4.25Å; I200-Y374 HydrophobicContact CB-CE2 3.95Å; I200-Y374 HydrophobicContact CG2-CE2 3.68Å; I200-Y374 PolarHBondContact O-OH 3.49Å
201	G	82.7	Confident	92.7	Very high	7 Å²	7	8.9 Å²	8.9	7%	0.072	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	-134.8	-172.3	0	0	0	0	0	111.2	Y171 R173 G203 Y374	Y171-G201 PolarHBondContact O-N 2.9Å; R173-G201 WeakPolarHBondContact CG-O 3.5Å; G201-G203 VanDerWaalsContact C-N 3.35Å; G201-G203 PolarHBondContact O-N 3.2Å; G201-Y374 VanDerWaalsContact CA-OH 3.28Å; G201-Y374 WeakPolarHBondContact CA-OH 3.39Å; G201-Y374 PolarHBondContact N-OH 2.87Å
202	D	72.3	Confident	93.1	Very high	85 Å²	85	7.6 Å²	7.6	46%	0.455	4%	0.044	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	10.5	-164.7	-81.8	30.1	0	0	0	115.1	I200 Q380	I200-D202 PolarHBondContact O-N 3.32Å; D202-Q380 VanDerWaalsContact CG-NE2 3.33Å; D202-Q380 PolarHBondContact OD1-OE1 2.79Å; D202-Q380 PolarHBondContact OD2-NE2 3.23Å; D202-Q380 PolarHBondContact OD2-OE1 3.46Å
203	G	81.6	Confident	93.1	Very high	10 Å²	10	7.6 Å²	7.6	10%	0.103	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	163.1	7.3	172.5	0	0	0	0	0	117.2	G201 H205	G201-G203 VanDerWaalsContact C-N 3.35Å; G201-G203 PolarHBondContact O-N 3.2Å; G203-H205 PolarHBondContact O-N 3.24Å
204	V	88.5	Confident	92.9	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	111.4	177.1	-180	0	0	0	0	109.3	T199 I200 V206 D246 Y247 Y374 Y375	T199-V204 WeakPolarHBondContact CA-O 3.29Å; I200-V204 PolarHBondContact N-O 2.84Å; I200-V204 PolarHBondContact O-N 2.89Å; I200-V204 VanDerWaalsContact O-N 3.16Å; V204-V206 HydrophobicContact CG1-CG2 4.26Å; V204-D246 VanDerWaalsContact CA-OD2 3.31Å; V204-D246 WeakPolarHBondContact CA-OD2 3.49Å; V204-D246 HydrophobicContact CG1-CB 4.01Å; V204-Y247 HydrophobicContact CG1-CD2 3.88Å; V204-Y247 HydrophobicContact CG1-CE2 3.98Å; V204-Y374 HydrophobicContact CB-CD2 4.16Å; V204-Y374 HydrophobicContact CB-CE2 3.54Å; V204-Y374 HydrophobicContact CG1-CD2 4.09Å; V204-Y374 HydrophobicContact CG1-CE2 3.93Å; V204-Y374 HydrophobicContact CG2-CD2 3.93Å; V204-Y374 HydrophobicContact CG2-CE2 3.48Å; V204-Y374 VanDerWaalsContact CG2-CE2 3.48Å; V204-Y375 HydrophobicContact CG2-CD1 4.41Å; V204-Y375 HydrophobicContact CG2-CE1 3.49Å; V204-Y375 VanDerWaalsContact CG2-CE1 3.49Å; V204-Y375 WeakPolarHBondContact CG2-OH 3.22Å
205	H	92.2	Very high	92.6	Very high	17 Å²	17	11.6 Å²	11.6	8%	0.079	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115.3	177.9	-62.1	-48.4	0	0	0	111.1	R197 L198 T199 G203 D245 D246 Y247	R197-H205 PolarHBondContact NH2-CE1 2.85Å; R197-H205 PolarHBondContact NH2-NE2 3.24Å; L198-H205 WeakPolarHBondContact O-CA 3.45Å; T199-H205 PolarHBondContact OG1-CE1 3.45Å; T199-H205 VanDerWaalsContact OG1-CE1 3.26Å; T199-H205 PolarHBondContact OG1-ND1 2.85Å; G203-H205 PolarHBondContact O-N 3.24Å; H205-D245 HydrophobicContact CB-CB 4.16Å; H205-D246 PolarHBondContact N-OD2 3.26Å; H205-D246 WeakPolarHBondContact O-CB 3.35Å; H205-D246 PolarHBondContact O-N 3.18Å; H205-Y247 PolarHBondContact O-N 3.33Å
206	V	95.3	Very high	91.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	113.9	174.9	-177.7	0	0	0	0	109.1	W66 L198 I200 V204 L208 Y247 F249	W66-V206 HydrophobicContact CH2-CG1 3.83Å; W66-V206 HydrophobicContact CH2-CG2 4.01Å; W66-V206 HydrophobicContact CZ2-CG1 4.36Å; W66-V206 HydrophobicContact CZ2-CG2 3.82Å; L198-V206 PolarHBondContact N-O 3.2Å; L198-V206 PolarHBondContact O-N 2.89Å; I200-V206 HydrophobicContact CD1-CB 4.34Å; I200-V206 HydrophobicContact CD1-CG2 3.63Å; I200-V206 HydrophobicContact CG1-CG2 4.25Å; V204-V206 HydrophobicContact CG1-CG2 4.26Å; V206-L208 HydrophobicContact CG1-CD2 4.39Å; V206-Y247 WeakPolarHBondContact CA-O 3.16Å; V206-Y247 HydrophobicContact CG2-CD2 4.13Å; V206-F249 HydrophobicContact CG1-CD2 4.36Å; V206-F249 HydrophobicContact CG1-CE2 4.32Å
207	T	96.9	Very high	90.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.2	179.5	-67.3	0	0	0	0	111.4	V196 R197 I209 F236 L242 D245 Y247 V248 F249	V196-T207 CarbonylContact O-C 3.6Å; V196-T207 VanDerWaalsContact O-CA 3.25Å; V196-T207 WeakPolarHBondContact O-CA 3.25Å; R197-T207 WeakPolarHBondContact CB-OG1 3.45Å; R197-T207 WeakPolarHBondContact CG-OG1 2.95Å; T207-I209 HydrophobicContact CG2-CD1 4.17Å; T207-I209 HydrophobicContact CG2-CG1 3.85Å; T207-F236 HydrophobicContact CG2-CE2 3.92Å; T207-F236 HydrophobicContact CG2-CZ 4.03Å; T207-L242 HydrophobicContact CG2-CD1 3.69Å; T207-D245 WeakPolarHBondContact CB-OD2 3.29Å; T207-D245 PolarHBondContact OG1-OD2 2.78Å; T207-Y247 PolarHBondContact N-O 2.81Å; T207-V248 HydrophobicContact CG2-CG1 4.34Å; T207-V248 CarbonylContact O-C 3.6Å; T207-V248 WeakPolarHBondContact O-CA 3.36Å; T207-F249 PolarHBondContact O-N 2.86Å
208	L	98.5	Very high	90.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.2	-179.5	-56.4	173.7	0	0	0	108.2	I68 M102 A104 V162 C195 V196 V206 F249 F251	I68-L208 HydrophobicContact CD1-CD2 3.68Å; M102-L208 HydrophobicContact SD-CD1 4.18Å; A104-L208 HydrophobicContact CB-CD1 3.99Å; A104-L208 HydrophobicContact CB-CD2 4.48Å; V162-L208 HydrophobicContact CB-CD1 4.48Å; V162-L208 HydrophobicContact CG1-CD1 3.94Å; V162-L208 HydrophobicContact CG2-CD1 3.65Å; C195-L208 CarbonylContact C-O 3.6Å; C195-L208 WeakPolarHBondContact CA-O 3.4Å; V196-L208 HydrophobicContact CB-CB 4.41Å; V196-L208 PolarHBondContact N-O 3.19Å; V196-L208 PolarHBondContact O-N 3.41Å; V206-L208 HydrophobicContact CG1-CD2 4.39Å; L208-F249 WeakPolarHBondContact CA-O 3.31Å; L208-F249 HydrophobicContact CD2-CB 4Å; L208-F249 HydrophobicContact CD2-CD2 3.94Å; L208-F249 HydrophobicContact CD2-CG 4.3Å; L208-F251 HydrophobicContact CB-CE1 4.11Å; L208-F251 HydrophobicContact CB-CZ 4.39Å; L208-F251 HydrophobicContact CD2-CE1 4.44Å
209	I	98.5	Very high	89.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	108.1	-177.4	-54.6	177.4	0	0	0	107.9	A193 C195 T207 I230 L242 V248 F249 W250 F251	A193-I209 HydrophobicContact CB-CG2 3.8Å; C195-I209 HydrophobicContact CB-CG1 4.29Å; T207-I209 HydrophobicContact CG2-CD1 4.17Å; T207-I209 HydrophobicContact CG2-CG1 3.85Å; I209-I230 HydrophobicContact CG2-CG2 4.09Å; I209-L242 HydrophobicContact CD1-CD1 4.32Å; I209-L242 HydrophobicContact CD1-CD2 3.83Å; I209-V248 HydrophobicContact CD1-CG1 3.9Å; I209-V248 HydrophobicContact CG1-CG1 4.43Å; I209-F249 PolarHBondContact N-O 3.42Å; I209-W250 HydrophobicContact CB-CB 4.38Å; I209-W250 HydrophobicContact CB-CD2 4.11Å; I209-W250 HydrophobicContact CB-CG 4.02Å; I209-W250 HydrophobicContact CD1-CD2 4.08Å; I209-W250 HydrophobicContact CD1-CE3 3.62Å; I209-W250 HydrophobicContact CD1-CZ3 4.04Å; I209-W250 HydrophobicContact CG2-CD2 3.87Å; I209-W250 HydrophobicContact CG2-CE3 4.39Å; I209-W250 HydrophobicContact CG2-CG 4.12Å; I209-W250 HydrophobicContact CG2-CZ2 4.34Å; I209-F251 WeakPolarHBondContact O-CD1 3.38Å; I209-F251 PolarHBondContact O-N 3.27Å
210	N	98.6	Very high	89.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.2	168.1	179.6	19.4	0	0	0	109.5	G106 L107 Q108 V159 L160 A193 I194 F251	G106-N210 WeakPolarHBondContact CA-ND2 3.38Å; L107-N210 PolarHBondContact N-ND2 3.34Å; L107-N210 PolarHBondContact O-ND2 3.32Å; Q108-N210 PolarHBondContact NE2-OD1 3.12Å; V159-N210 PolarHBondContact O-ND2 2.86Å; L160-N210 HydrophobicContact CB-CB 4.18Å; L160-N210 HydrophobicContact CD1-CB 4.16Å; L160-N210 HydrophobicContact CD2-CB 4.25Å; L160-N210 HydrophobicContact CG-CB 4.43Å; A193-N210 CarbonylContact C-O 3.56Å; A193-N210 WeakPolarHBondContact CA-O 3.29Å; A193-N210 WeakPolarHBondContact CB-O 2.86Å; I194-N210 PolarHBondContact N-O 2.85Å; I194-N210 PolarHBondContact O-N 3.42Å; N210-F251 CarbonylContact C-O 3.44Å; N210-F251 WeakPolarHBondContact CA-O 3.06Å; N210-F251 HydrophobicContact CB-CD2 4.24Å; N210-F251 HydrophobicContact CB-CE2 3.75Å; N210-F251 HydrophobicContact CB-CZ 4.23Å
211	S	97.9	Very high	89.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	152.3	-177.4	62.5	0	0	0	0	113.9	G192 W250 F251 G252 N253	G192-S211 CarbonylContact O-C 3.47Å; G192-S211 VanDerWaalsContact O-CA 3.29Å; G192-S211 WeakPolarHBondContact O-CA 3.35Å; S211-W250 PolarHBondContact OG-NE1 3.07Å; S211-F251 PolarHBondContact N-O 2.86Å; S211-F251 PolarHBondContact OG-O 2.07Å; S211-G252 CarbonylContact O-C 3.5Å; S211-G252 VanDerWaalsContact O-CA 3.23Å; S211-G252 WeakPolarHBondContact O-CA 3.42Å; S211-N253 PolarHBondContact O-N 2.91Å; S211-N253 VanDerWaalsContact O-N 3.11Å
212	H	96.8	Very high	90.4	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.019	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	104.9	166.6	-171.8	-179.1	0	0	0	108.5	Q108 D109 K191 G192 N253	Q108-H212 HydrophobicContact CB-CB 4.2Å; Q108-H212 HydrophobicContact CG-CB 3.85Å; D109-H212 IonicContact OD1-CE1 2.75Å; D109-H212 PolarHBondContact OD1-CE1 3.31Å; D109-H212 IonicContact OD1-ND1 3.24Å; D109-H212 IonicContact OD2-CE1 3.56Å; D109-H212 PolarHBondContact OD2-CE1 3.34Å; D109-H212 VanDerWaalsContact OD2-CE1 3.25Å; D109-H212 IonicContact OD2-NE2 3.54Å; K191-H212 VanDerWaalsContact CA-O 3.3Å; K191-H212 WeakPolarHBondContact CA-O 3.48Å; K191-H212 WeakPolarHBondContact CB-O 3.47Å; K191-H212 HydrophobicContact CD-CB 4.48Å; K191-H212 VanDerWaalsContact CD-O 3.24Å; K191-H212 WeakPolarHBondContact CD-O 3.33Å; K191-H212 PolarHBondContact NZ-CE1 3.09Å; K191-H212 PolarHBondContact NZ-ND1 3.19Å; K191-H212 PolarHBondContact NZ-NE2 3.27Å; K191-H212 VanDerWaalsContact NZ-NE2 3.1Å; G192-H212 PolarHBondContact N-O 2.95Å; G192-H212 PolarHBondContact O-N 2.99Å; H212-N253 VanDerWaalsContact CA-O 3.28Å; H212-N253 WeakPolarHBondContact CA-O 3.39Å
213	L	95.8	Very high	91.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.			trans	-94.9	170.9	-175.7	-53.6	-171.3	0	0	0	112.3	K191 R223 E226 I230 N253 M254 N255 W256	K191-L213 VanDerWaalsContact CD-O 3.32Å; K191-L213 WeakPolarHBondContact CD-O 3.38Å; K191-L213 WeakPolarHBondContact CE-O 3.4Å; L213-R223 HydrophobicContact CB-CG 4.22Å; L213-R223 HydrophobicContact CD1-CB 4.48Å; L213-E226 HydrophobicContact CD2-CB 3.94Å; L213-I230 HydrophobicContact CD2-CD1 3.75Å; L213-N253 PolarHBondContact N-O 2.83Å; L213-M254 WeakPolarHBondContact CB-O 3.27Å; L213-M254 HydrophobicContact CD1-CB 3.94Å; L213-M254 HydrophobicContact CD1-CG 4.38Å; L213-M254 HydrophobicContact CG-CB 4.27Å; L213-N255 PolarHBondContact O-ND2 3.02Å; L213-W256 HydrophobicContact CD1-CZ2 4.26Å
214	T	93.7	Very high	92.2	Very high	17 Å²	17	36.6 Å²	36.6	10%	0.104	18%	0.184	C	C	.	.			trans	-72	127.5	-172.2	-63.2	0	0	0	0	112.2	E216 A219 Y222 R223 E226	T214-E216 WeakPolarHBondContact CG2-OE2 3.18Å; T214-A219 HydrophobicContact CG2-CB 3.88Å; T214-Y222 HydrophobicContact CG2-CD1 3.88Å; T214-Y222 HydrophobicContact CG2-CE1 4.21Å; T214-Y222 WeakPolarHBondContact OG1-CD1 3.07Å; T214-Y222 VanDerWaalsContact OG1-CE1 3.23Å; T214-Y222 WeakPolarHBondContact OG1-CE1 3.41Å; T214-R223 WeakPolarHBondContact O-CD 3.15Å; T214-R223 WeakPolarHBondContact O-CG 3.5Å; T214-R223 PolarHBondContact O-NH1 3.26Å; T214-E226 VanDerWaalsContact CB-OE2 3.27Å; T214-E226 WeakPolarHBondContact CB-OE2 3.48Å; T214-E226 PolarHBondContact N-OE2 3.02Å; T214-E226 VanDerWaalsContact OG1-CD 3.24Å; T214-E226 PolarHBondContact OG1-OE1 3.16Å; T214-E226 PolarHBondContact OG1-OE2 2.77Å
215	P	88.9	Confident	92.5	Very high	68 Å²	68	41.1 Å²	41.1	44%	0.442	20%	0.201	S	C	.	.			trans	-82.7	-20.3	-167.7	32.7	-37.8	0	0	0	116.2	E217 N255	P215-E217 PolarHBondContact O-N 3.01Å; P215-N255 HydrophobicContact CB-CB 4.33Å
216	E	83.1	Confident	92.6	Very high	108 Å²	108	40.3 Å²	40.3	51%	0.505	20%	0.197	S	C	.	.			trans	-58.2	132.9	-175.5	-68.1	80.6	176	0	0	110.6	T214 E218 A219 R223	T214-E216 WeakPolarHBondContact CG2-OE2 3.18Å; E216-E218 VanDerWaalsContact C-N 3.28Å; E216-E218 PolarHBondContact O-N 2.79Å; E216-A219 HydrophobicContact CB-CB 3.92Å; E216-A219 WeakPolarHBondContact O-CB 3.32Å; E216-A219 PolarHBondContact O-N 3.14Å; E216-R223 PolarHBondContact O-NH1 2.98Å
217	E	75.4	Confident	92.7	Very high	109 Å²	109	41.4 Å²	41.4	51%	0.509	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-62.6	-39.9	-174	-170	173.1	172.3	0	0	110.7	P215 A219 R223	P215-E217 PolarHBondContact O-N 3.01Å; E217-A219 PolarHBondContact O-N 2.9Å; E217-A219 VanDerWaalsContact O-N 3.12Å; E217-R223 PolarHBondContact O-NH2 2.97Å
218	E	82.2	Confident	92.6	Very high	167 Å²	167	47.1 Å²	47.1	78%	0.78	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-67.9	-11.3	177.3	-54.8	79.6	-173.9	0	0	113.1	E216 M220	E216-E218 VanDerWaalsContact C-N 3.28Å; E216-E218 PolarHBondContact O-N 2.79Å; E218-M220 VanDerWaalsContact C-N 3.27Å; E218-M220 PolarHBondContact O-N 2.82Å
219	A	85.2	Confident	92.3	Very high	15 Å²	15	50.9 Å²	50.9	12%	0.124	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-85.8	16.4	-177.1	0	0	0	0	0	113.8	T214 E216 E217 N221 Y222 R223	T214-A219 HydrophobicContact CG2-CB 3.88Å; E216-A219 HydrophobicContact CB-CB 3.92Å; E216-A219 WeakPolarHBondContact O-CB 3.32Å; E216-A219 PolarHBondContact O-N 3.14Å; E217-A219 PolarHBondContact O-N 2.9Å; E217-A219 VanDerWaalsContact O-N 3.12Å; A219-N221 VanDerWaalsContact C-N 3.33Å; A219-N221 PolarHBondContact O-N 3.49Å; A219-Y222 CarbonylContact O-C 3.55Å; A219-Y222 WeakPolarHBondContact O-CA 3.15Å; A219-Y222 WeakPolarHBondContact O-CB 3.24Å; A219-Y222 PolarHBondContact O-N 2.84Å; A219-R223 PolarHBondContact O-N 3.03Å
220	M	91.9	Very high	92.2	Very high	54 Å²	54	50.9 Å²	50.9	27%	0.266	24%	0.241	S	C	.	.	H	α-helix	trans	-48.7	-51.8	176.5	-176.8	-171.5	68.3	0	0	112.2	E218 Y222 R223 V224 W256 E283 L287	E218-M220 VanDerWaalsContact C-N 3.27Å; E218-M220 PolarHBondContact O-N 2.82Å; M220-Y222 PolarHBondContact O-N 2.89Å; M220-R223 PolarHBondContact O-N 3.37Å; M220-V224 WeakPolarHBondContact O-CG2 3.28Å; M220-V224 PolarHBondContact O-N 3.06Å; M220-W256 HydrophobicContact CG-CZ3 4.35Å; M220-E283 WeakPolarHBondContact CB-OE2 3.39Å; M220-E283 HydrophobicContact CG-CG 4.2Å; M220-E283 VanDerWaalsContact CG-OE2 3.31Å; M220-E283 WeakPolarHBondContact CG-OE2 3.41Å; M220-E283 HydrophobicContact SD-CG 4.19Å; M220-L287 HydrophobicContact CG-CD1 4.05Å; M220-L287 HydrophobicContact SD-CD1 4.26Å; M220-L287 HydrophobicContact SD-CD2 4.32Å
221	N	92.9	Very high	91.9	Very high	123 Å²	123	52.7 Å²	52.7	66%	0.658	25%	0.252	S	S	*	.	H	α-helix	trans	-63.3	-32.2	178.4	-72.8	-35.4	0	0	0	112.5	A219 W225	A219-N221 VanDerWaalsContact C-N 3.33Å; A219-N221 PolarHBondContact O-N 3.49Å; N221-W225 PolarHBondContact O-N 3.24Å; N221-W225 VanDerWaalsContact O-N 3.1Å
222	Y	93	Very high	91.6	Very high	68 Å²	68	59 Å²	59	27%	0.267	28%	0.281	S	S	.	.	H	α-helix	trans	-70.9	-42.4	175.4	-171.5	-106.1	0	0	0	111.1	T182 T214 A219 M220 V224 W225 E226	T182-Y222 PolarHBondContact O-OH 3.34Å; T214-Y222 HydrophobicContact CG2-CD1 3.88Å; T214-Y222 HydrophobicContact CG2-CE1 4.21Å; T214-Y222 WeakPolarHBondContact OG1-CD1 3.07Å; T214-Y222 VanDerWaalsContact OG1-CE1 3.23Å; T214-Y222 WeakPolarHBondContact OG1-CE1 3.41Å; A219-Y222 CarbonylContact O-C 3.55Å; A219-Y222 WeakPolarHBondContact O-CA 3.15Å; A219-Y222 WeakPolarHBondContact O-CB 3.24Å; A219-Y222 PolarHBondContact O-N 2.84Å; M220-Y222 PolarHBondContact O-N 2.89Å; Y222-V224 VanDerWaalsContact C-N 3.28Å; Y222-V224 PolarHBondContact O-N 2.81Å; Y222-W225 HydrophobicContact CD2-CE3 4.11Å; Y222-W225 HydrophobicContact CE2-CD2 4.45Å; Y222-W225 AromaticContact CE2-CE3 3.64Å; Y222-W225 HydrophobicContact CE2-CE3 3.64Å; Y222-W225 AromaticContact CE2-CZ3 3.83Å; Y222-W225 HydrophobicContact CE2-CZ3 3.83Å; Y222-W225 AromaticContact CZ-CE3 3.96Å; Y222-W225 AromaticContact CZ-CZ3 3.83Å; Y222-W225 CarbonylContact O-C 3.45Å; Y222-W225 WeakPolarHBondContact O-CA 3.42Å; Y222-W225 VanDerWaalsContact O-CB 3.3Å; Y222-W225 WeakPolarHBondContact O-CB 3.3Å; Y222-W225 PolarHBondContact O-N 2.56Å; Y222-E226 HydrophobicContact CD1-CG 3.91Å; Y222-E226 HydrophobicContact CE1-CG 3.73Å; Y222-E226 WeakPolarHBondContact O-CG 3.49Å; Y222-E226 PolarHBondContact O-N 2.96Å
223	R	94.9	Very high	91.3	Very high	1 Å²	1	61.5 Å²	61.5	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-37.6	173	-71.1	-170.4	-76.5	-82.7	1.6	112.1	L213 T214 E216 E217 A219 M220 W225 E226 F227 M254 N255 W256 E283	L213-R223 HydrophobicContact CB-CG 4.22Å; L213-R223 HydrophobicContact CD1-CB 4.48Å; T214-R223 WeakPolarHBondContact O-CD 3.15Å; T214-R223 WeakPolarHBondContact O-CG 3.5Å; T214-R223 PolarHBondContact O-NH1 3.26Å; E216-R223 PolarHBondContact O-NH1 2.98Å; E217-R223 PolarHBondContact O-NH2 2.97Å; A219-R223 PolarHBondContact O-N 3.03Å; M220-R223 PolarHBondContact O-N 3.37Å; R223-W225 VanDerWaalsContact C-N 3.32Å; R223-W225 PolarHBondContact O-N 2.8Å; R223-E226 PolarHBondContact O-N 3.02Å; R223-F227 WeakPolarHBondContact O-CB 3.08Å; R223-F227 PolarHBondContact O-N 3.27Å; R223-M254 VanDerWaalsContact CD-O 3.28Å; R223-M254 WeakPolarHBondContact CD-O 3.37Å; R223-N255 WeakPolarHBondContact CD-O 3.39Å; R223-N255 PolarHBondContact NE-O 3.17Å; R223-N255 PolarHBondContact NH1-O 3.37Å; R223-W256 HydrophobicContact CB-CE3 4.41Å; R223-W256 HydrophobicContact CB-CH2 3.36Å; R223-W256 HydrophobicContact CB-CZ2 3.9Å; R223-W256 HydrophobicContact CB-CZ3 3.66Å; R223-E283 IonicContact CZ-OE1 2.54Å; R223-E283 IonicContact NE-OE1 2.82Å; R223-E283 IonicContact NH2-OE1 3.41Å; R223-E283 PolarHBondContact NH2-OE1 2.85Å; R223-E283 IonicContact NH2-OE2 3.69Å; R223-E283 PolarHBondContact NH2-OE2 2.62Å
224	V	96	Very high	90.9	Very high	17 Å²	17	61.5 Å²	61.5	10%	0.103	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-42.4	171.4	174.8	0	0	0	0	110.9	M220 Y222 K228 W256 L287 V293	M220-V224 WeakPolarHBondContact O-CG2 3.28Å; M220-V224 PolarHBondContact O-N 3.06Å; Y222-V224 VanDerWaalsContact C-N 3.28Å; Y222-V224 PolarHBondContact O-N 2.81Å; V224-K228 HydrophobicContact CG1-CD 4.39Å; V224-K228 WeakPolarHBondContact O-CG 3.43Å; V224-K228 PolarHBondContact O-N 2.83Å; V224-K228 VanDerWaalsContact O-N 3.09Å; V224-W256 HydrophobicContact CG2-CH2 4.19Å; V224-L287 HydrophobicContact CG2-CD1 4.2Å; V224-V293 HydrophobicContact CB-CG1 4.14Å; V224-V293 HydrophobicContact CG1-CG1 3.96Å; V224-V293 HydrophobicContact CG2-CG1 3.78Å
225	W	94.8	Very high	90.3	Very high	96 Å²	96	64.3 Å²	64.3	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-64.6	-43.1	173.2	175	89.1	0	0	0	112.1	T182 N221 Y222 R223 F227 K228 R229	T182-W225 HydrophobicContact CG2-CZ3 4.42Å; N221-W225 PolarHBondContact O-N 3.24Å; N221-W225 VanDerWaalsContact O-N 3.1Å; Y222-W225 HydrophobicContact CD2-CE3 4.11Å; Y222-W225 HydrophobicContact CE2-CD2 4.45Å; Y222-W225 AromaticContact CE2-CE3 3.64Å; Y222-W225 HydrophobicContact CE2-CE3 3.64Å; Y222-W225 AromaticContact CE2-CZ3 3.83Å; Y222-W225 HydrophobicContact CE2-CZ3 3.83Å; Y222-W225 AromaticContact CZ-CE3 3.96Å; Y222-W225 AromaticContact CZ-CZ3 3.83Å; Y222-W225 CarbonylContact O-C 3.45Å; Y222-W225 WeakPolarHBondContact O-CA 3.42Å; Y222-W225 VanDerWaalsContact O-CB 3.3Å; Y222-W225 WeakPolarHBondContact O-CB 3.3Å; Y222-W225 PolarHBondContact O-N 2.56Å; R223-W225 VanDerWaalsContact C-N 3.32Å; R223-W225 PolarHBondContact O-N 2.8Å; W225-F227 VanDerWaalsContact C-N 3.35Å; W225-F227 PolarHBondContact O-N 3.05Å; W225-K228 PolarHBondContact O-N 2.79Å; W225-R229 HydrophobicContact CD2-CB 4.48Å; W225-R229 HydrophobicContact CH2-CB 4.42Å; W225-R229 HydrophobicContact CH2-CG 4.06Å; W225-R229 HydrophobicContact CZ2-CB 4.33Å; W225-R229 HydrophobicContact CZ2-CG 4.11Å; W225-R229 VanDerWaalsContact O-CB 3.24Å; W225-R229 WeakPolarHBondContact O-CB 3.25Å; W225-R229 PolarHBondContact O-N 2.73Å
226	E	95.2	Very high	90.2	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.1	-44.6	176.9	-66	-172.6	109.3	0	0	111.3	T182 L213 T214 Y222 R223 K228 R229 I230	T182-E226 VanDerWaalsContact CB-OE1 3.29Å; T182-E226 WeakPolarHBondContact CB-OE1 3.49Å; T182-E226 HydrophobicContact CG2-CB 4.11Å; T182-E226 HydrophobicContact CG2-CG 4.1Å; T182-E226 PolarHBondContact OG1-OE1 3.03Å; L213-E226 HydrophobicContact CD2-CB 3.94Å; T214-E226 VanDerWaalsContact CB-OE2 3.27Å; T214-E226 WeakPolarHBondContact CB-OE2 3.48Å; T214-E226 PolarHBondContact N-OE2 3.02Å; T214-E226 VanDerWaalsContact OG1-CD 3.24Å; T214-E226 PolarHBondContact OG1-OE1 3.16Å; T214-E226 PolarHBondContact OG1-OE2 2.77Å; Y222-E226 HydrophobicContact CD1-CG 3.91Å; Y222-E226 HydrophobicContact CE1-CG 3.73Å; Y222-E226 WeakPolarHBondContact O-CG 3.49Å; Y222-E226 PolarHBondContact O-N 2.96Å; R223-E226 PolarHBondContact O-N 3.02Å; E226-K228 PolarHBondContact O-N 3.07Å; E226-R229 PolarHBondContact O-N 3.26Å; E226-I230 WeakPolarHBondContact O-CB 3.45Å; E226-I230 WeakPolarHBondContact O-CD1 3.36Å; E226-I230 VanDerWaalsContact O-CG1 3.24Å; E226-I230 WeakPolarHBondContact O-CG1 3.23Å; E226-I230 PolarHBondContact O-N 3.2Å
227	F	96.1	Very high	89.9	Confident	22 Å²	22	61.6 Å²	61.6	10%	0.096	30%	0.3	C	S	.	.	H	α-helix	trans	-56.2	-50.8	173.6	163.3	-103.1	0	0	0	111.7	R223 W225 R229 I230 T231 W250 V293 F294	R223-F227 WeakPolarHBondContact O-CB 3.08Å; R223-F227 PolarHBondContact O-N 3.27Å; W225-F227 VanDerWaalsContact C-N 3.35Å; W225-F227 PolarHBondContact O-N 3.05Å; F227-R229 VanDerWaalsContact C-N 3.34Å; F227-R229 PolarHBondContact O-N 2.9Å; F227-I230 PolarHBondContact O-N 2.76Å; F227-T231 WeakPolarHBondContact O-CB 3.38Å; F227-T231 PolarHBondContact O-N 2.88Å; F227-T231 PolarHBondContact O-OG1 2.78Å; F227-W250 AromaticContact CD2-CH2 3.65Å; F227-W250 HydrophobicContact CD2-CH2 3.65Å; F227-W250 HydrophobicContact CD2-CZ2 4.13Å; F227-W250 AromaticContact CD2-CZ3 3.96Å; F227-W250 HydrophobicContact CD2-CZ3 3.96Å; F227-W250 HydrophobicContact CE2-CE3 4.46Å; F227-W250 HydrophobicContact CE2-CH2 4.07Å; F227-W250 AromaticContact CE2-CZ3 3.89Å; F227-W250 HydrophobicContact CE2-CZ3 3.89Å; F227-V293 HydrophobicContact CB-CG1 4.38Å; F227-V293 HydrophobicContact CD1-CB 3.8Å; F227-V293 HydrophobicContact CD1-CG1 3.68Å; F227-V293 HydrophobicContact CE1-CB 4.04Å; F227-V293 HydrophobicContact CE1-CG1 4.3Å; F227-V293 HydrophobicContact CG-CB 4.16Å; F227-V293 HydrophobicContact CG-CG1 4.14Å; F227-F294 HydrophobicContact CD2-CD1 4.05Å; F227-F294 AromaticContact CD2-CD2 3.9Å; F227-F294 HydrophobicContact CD2-CD2 3.9Å; F227-F294 AromaticContact CD2-CE1 3.67Å; F227-F294 HydrophobicContact CD2-CE1 3.67Å; F227-F294 AromaticContact CD2-CE2 3.51Å; F227-F294 HydrophobicContact CD2-CE2 3.51Å; F227-F294 HydrophobicContact CD2-CG 4.15Å; F227-F294 AromaticContact CD2-CZ 3.39Å; F227-F294 HydrophobicContact CD2-CZ 3.39Å; F227-F294 AromaticContact CE2-CD1 3.52Å; F227-F294 HydrophobicContact CE2-CD1 3.52Å; F227-F294 AromaticContact CE2-CD2 3.96Å; F227-F294 HydrophobicContact CE2-CD2 3.96Å; F227-F294 AromaticContact CE2-CE1 3.54Å; F227-F294 HydrophobicContact CE2-CE1 3.54Å; F227-F294 AromaticContact CE2-CE2 3.98Å; F227-F294 HydrophobicContact CE2-CE2 3.98Å; F227-F294 AromaticContact CE2-CG 3.75Å; F227-F294 HydrophobicContact CE2-CG 3.75Å; F227-F294 AromaticContact CE2-CZ 3.78Å; F227-F294 HydrophobicContact CE2-CZ 3.78Å; F227-F294 HydrophobicContact CG-CE2 4.18Å; F227-F294 HydrophobicContact CG-CZ 4.42Å; F227-F294 HydrophobicContact CZ-CD1 4.38Å; F227-F294 HydrophobicContact CZ-CG 4.34Å
228	K	94.8	Very high	89.5	Confident	120 Å²	120	60.2 Å²	60.2	52%	0.522	29%	0.294	S	S	.	.	H	α-helix	trans	-61.9	-43.3	178.6	-71.8	175.3	-178.2	179.9	0	111.3	V224 W225 E226 T231 E232	V224-K228 HydrophobicContact CG1-CD 4.39Å; V224-K228 WeakPolarHBondContact O-CG 3.43Å; V224-K228 PolarHBondContact O-N 2.83Å; V224-K228 VanDerWaalsContact O-N 3.09Å; W225-K228 PolarHBondContact O-N 2.79Å; E226-K228 PolarHBondContact O-N 3.07Å; K228-T231 PolarHBondContact O-N 3.23Å; K228-E232 WeakPolarHBondContact O-CB 3.44Å; K228-E232 PolarHBondContact O-N 2.95Å
229	R	93.5	Very high	88.2	Confident	80 Å²	80	58.1 Å²	58.1	30%	0.302	30%	0.295	S	S	.	.	H	α-helix	trans	-62.6	-45.3	179.6	-177.5	63	-179.5	146.2	5.4	112	T182 W225 E226 F227 E232 M233	T182-R229 HydrophobicContact CG2-CG 4.36Å; W225-R229 HydrophobicContact CD2-CB 4.48Å; W225-R229 HydrophobicContact CH2-CB 4.42Å; W225-R229 HydrophobicContact CH2-CG 4.06Å; W225-R229 HydrophobicContact CZ2-CB 4.33Å; W225-R229 HydrophobicContact CZ2-CG 4.11Å; W225-R229 VanDerWaalsContact O-CB 3.24Å; W225-R229 WeakPolarHBondContact O-CB 3.25Å; W225-R229 PolarHBondContact O-N 2.73Å; E226-R229 PolarHBondContact O-N 3.26Å; F227-R229 VanDerWaalsContact C-N 3.34Å; F227-R229 PolarHBondContact O-N 2.9Å; R229-E232 IonicContact NH1-OE2 3.39Å; R229-E232 PolarHBondContact NH1-OE2 3.47Å; R229-E232 PolarHBondContact O-N 2.84Å; R229-M233 PolarHBondContact NH1-SD 3.12Å; R229-M233 PolarHBondContact NH2-SD 2.89Å; R229-M233 VanDerWaalsContact NH2-SD 3.38Å; R229-M233 VanDerWaalsContact O-CB 3.25Å; R229-M233 WeakPolarHBondContact O-CB 3.39Å; R229-M233 VanDerWaalsContact O-CG 3.24Å; R229-M233 WeakPolarHBondContact O-CG 3.49Å; R229-M233 PolarHBondContact O-N 3.17Å
230	I	94.8	Very high	87.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-43.1	177	-66.8	160.3	0	0	0	110.3	V180 T182 A193 I209 L213 E226 F227 E232 M233 C234 W250	V180-I230 HydrophobicContact CB-CG1 4.35Å; V180-I230 HydrophobicContact CG1-CG1 4Å; T182-I230 HydrophobicContact CG2-CD1 4.23Å; T182-I230 HydrophobicContact CG2-CG1 4.02Å; A193-I230 HydrophobicContact CB-CD1 3.94Å; A193-I230 HydrophobicContact CB-CG1 4.12Å; A193-I230 HydrophobicContact CB-CG2 3.75Å; I209-I230 HydrophobicContact CG2-CG2 4.09Å; L213-I230 HydrophobicContact CD2-CD1 3.75Å; E226-I230 WeakPolarHBondContact O-CB 3.45Å; E226-I230 WeakPolarHBondContact O-CD1 3.36Å; E226-I230 VanDerWaalsContact O-CG1 3.24Å; E226-I230 WeakPolarHBondContact O-CG1 3.23Å; E226-I230 PolarHBondContact O-N 3.2Å; F227-I230 PolarHBondContact O-N 2.76Å; I230-E232 VanDerWaalsContact C-N 3.31Å; I230-E232 PolarHBondContact O-N 3.16Å; I230-M233 PolarHBondContact O-N 3.42Å; I230-C234 VanDerWaalsContact CG2-SG 3.59Å; I230-C234 WeakPolarHBondContact O-CB 3.28Å; I230-C234 PolarHBondContact O-N 2.78Å; I230-C234 PolarHBondContact O-SG 2.65Å; I230-C234 VanDerWaalsContact O-SG 3.32Å; I230-W250 HydrophobicContact CB-CH2 3.59Å; I230-W250 HydrophobicContact CB-CZ2 3.81Å; I230-W250 HydrophobicContact CD1-CZ2 3.99Å; I230-W250 HydrophobicContact CG2-CH2 3.36Å; I230-W250 HydrophobicContact CG2-CZ2 3.5Å; I230-W250 VanDerWaalsContact CG2-CZ2 3.5Å; I230-W250 HydrophobicContact CG2-CZ3 4.15Å
231	T	93.6	Very high	86.8	Confident	37 Å²	37	62.6 Å²	62.6	23%	0.227	32%	0.318	C	S	.	.	H	α-helix	trans	-58.3	-43	176.8	-59	0	0	0	0	112	F227 K228 L242 W250	F227-T231 WeakPolarHBondContact O-CB 3.38Å; F227-T231 PolarHBondContact O-N 2.88Å; F227-T231 PolarHBondContact O-OG1 2.78Å; K228-T231 PolarHBondContact O-N 3.23Å; T231-L242 HydrophobicContact CG2-CD2 4.36Å; T231-W250 WeakPolarHBondContact OG1-CZ3 3.45Å
232	E	90.4	Very high	86.4	Confident	132 Å²	132	57 Å²	57	62%	0.617	29%	0.288	S	S	*	.	H	α-helix	trans	-69.7	-41.7	177.9	-175.8	-173.7	-156.7	0	0	112.3	K228 R229 I230	K228-E232 WeakPolarHBondContact O-CB 3.44Å; K228-E232 PolarHBondContact O-N 2.95Å; R229-E232 IonicContact NH1-OE2 3.39Å; R229-E232 PolarHBondContact NH1-OE2 3.47Å; R229-E232 PolarHBondContact O-N 2.84Å; I230-E232 VanDerWaalsContact C-N 3.31Å; I230-E232 PolarHBondContact O-N 3.16Å
233	M	90.3	Very high	85.8	Confident	58 Å²	58	57.2 Å²	57.2	29%	0.286	30%	0.296	S	S	.	.	H	α-helix	trans	-91.9	-9.9	-171.5	-68.2	-64.3	-65.9	0	0	115	K178 V180 R229 I230 D235	K178-M233 WeakPolarHBondContact CD-O 3.21Å; K178-M233 WeakPolarHBondContact CE-O 3.45Å; K178-M233 PolarHBondContact NZ-O 2.85Å; V180-M233 HydrophobicContact CB-CB 4.4Å; V180-M233 HydrophobicContact CG1-CB 3.75Å; V180-M233 HydrophobicContact CG1-CG 4.35Å; V180-M233 HydrophobicContact CG2-CB 3.7Å; R229-M233 PolarHBondContact NH1-SD 3.12Å; R229-M233 PolarHBondContact NH2-SD 2.89Å; R229-M233 VanDerWaalsContact NH2-SD 3.38Å; R229-M233 VanDerWaalsContact O-CB 3.25Å; R229-M233 WeakPolarHBondContact O-CB 3.39Å; R229-M233 VanDerWaalsContact O-CG 3.24Å; R229-M233 WeakPolarHBondContact O-CG 3.49Å; R229-M233 PolarHBondContact O-N 3.17Å; I230-M233 PolarHBondContact O-N 3.42Å; M233-D235 VanDerWaalsContact C-OD1 3.26Å; M233-D235 WeakPolarHBondContact CA-OD1 3.18Å; M233-D235 PolarHBondContact O-N 3.48Å
234	C	88.7	Confident	85.4	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.32	C	S	.	.			trans	-77.4	44.4	166.4	-64.2	0	0	0	0	110.5	C195 I230 F236 L242	C195-C234 HydrophobicContact CB-CB 3.9Å; C195-C234 WeakPolarHBondContact CB-SG 3.44Å; C195-C234 WeakPolarHBondContact SG-CB 3.45Å; C195-C234 CovalentContact SG-SG 2.07Å; C195-C234 PolarHBondContact SG-SG 3.39Å; I230-C234 VanDerWaalsContact CG2-SG 3.59Å; I230-C234 WeakPolarHBondContact O-CB 3.28Å; I230-C234 PolarHBondContact O-N 2.78Å; I230-C234 PolarHBondContact O-SG 2.65Å; I230-C234 VanDerWaalsContact O-SG 3.32Å; C234-F236 HydrophobicContact CB-CE2 4.36Å; C234-F236 WeakPolarHBondContact O-CD2 3.32Å; C234-F236 WeakPolarHBondContact O-CE2 3.32Å; C234-L242 HydrophobicContact CB-CD2 4.45Å
235	D	81.2	Confident	85.1	Confident	75 Å²	75	62 Å²	62	40%	0.401	32%	0.316	S	S	.	.			trans	-83.7	123	167	58.5	-43.6	0	0	0	109.8	K178 M233	K178-D235 WeakPolarHBondContact CD-O 3.1Å; K178-D235 PolarHBondContact NZ-O 3.3Å; K178-D235 IonicContact NZ-OD1 2.66Å; K178-D235 PolarHBondContact NZ-OD1 3.23Å; K178-D235 IonicContact NZ-OD2 3.63Å; M233-D235 VanDerWaalsContact C-OD1 3.26Å; M233-D235 WeakPolarHBondContact CA-OD1 3.18Å; M233-D235 PolarHBondContact O-N 3.48Å
236	F	86.4	Confident	85	Confident	22 Å²	22	57.4 Å²	57.4	10%	0.096	30%	0.298	C	S	.	.			trans	-94.4	-168.1	-177.1	-64.5	-85.8	0	0	0	111	E176 K178 C195 R197 T207 C234 Q238	E176-F236 HydrophobicContact CB-CD1 3.68Å; E176-F236 HydrophobicContact CB-CE1 4.3Å; K178-F236 HydrophobicContact CB-CE1 4.11Å; C195-F236 HydrophobicContact CB-CE1 4.31Å; C195-F236 HydrophobicContact CB-CZ 3.7Å; R197-F236 HydrophobicContact CB-CD1 3.68Å; R197-F236 HydrophobicContact CB-CD2 3.76Å; R197-F236 HydrophobicContact CB-CE1 3.51Å; R197-F236 HydrophobicContact CB-CE2 3.59Å; R197-F236 HydrophobicContact CB-CG 3.79Å; R197-F236 HydrophobicContact CB-CZ 3.45Å; R197-F236 VanDerWaalsContact CB-CZ 3.45Å; R197-F236 HydrophobicContact CG-CD2 4.3Å; R197-F236 HydrophobicContact CG-CE2 4.41Å; R197-F236 HydrophobicContact CG-CG 4.45Å; T207-F236 HydrophobicContact CG2-CE2 3.92Å; T207-F236 HydrophobicContact CG2-CZ 4.03Å; C234-F236 HydrophobicContact CB-CE2 4.36Å; C234-F236 WeakPolarHBondContact O-CD2 3.32Å; C234-F236 WeakPolarHBondContact O-CE2 3.32Å; F236-Q238 PolarHBondContact O-N 3.04Å
237	S	76.6	Confident	85	Confident	98 Å²	98	57.4 Å²	57.4	69%	0.685	30%	0.298	S	S	*	.	S	Bend	trans	-64.5	-25.9	-174.4	62.2	0	0	0	0	114.4	E176	E176-S237 VanDerWaalsContact CD-OG 3.25Å; E176-S237 WeakPolarHBondContact OE2-CB 3.4Å; E176-S237 PolarHBondContact OE2-N 3.45Å; E176-S237 PolarHBondContact OE2-OG 3.18Å
238	Q	68	Low	85	Confident	79 Å²	79	56.3 Å²	56.3	37%	0.369	29%	0.294	S	S	.	.	S	Bend	trans	-83.5	138.7	170.5	-64	-165.3	0.1	0	0	109.6	F236 Y240	F236-Q238 PolarHBondContact O-N 3.04Å; Q238-Y240 HydrophobicContact CB-CD2 3.7Å; Q238-Y240 HydrophobicContact CB-CE2 4.1Å; Q238-Y240 PolarHBondContact O-N 2.92Å; Q238-Y240 VanDerWaalsContact OE1-CE2 3.24Å
239	P	55.2	Low	85.2	Confident	124 Å²	124	50.6 Å²	50.6	81%	0.805	27%	0.269	S	S	*	.	S	Bend	trans	-73.3	24.1	-172.5	33.6	-38.5	0	0	0	113.5
240	Y	70.2	Confident	85.5	Confident	108 Å²	108	46.8 Å²	46.8	42%	0.424	25%	0.254	S	S	.	.			trans	-94.4	129.3	-179.6	-58.2	-49.8	0	0	0	108.7	Q238 K244	Q238-Y240 HydrophobicContact CB-CD2 3.7Å; Q238-Y240 HydrophobicContact CB-CE2 4.1Å; Q238-Y240 PolarHBondContact O-N 2.92Å; Q238-Y240 VanDerWaalsContact OE1-CE2 3.24Å; Y240-K244 HydrophobicContact CD1-CD 3.78Å; Y240-K244 HydrophobicContact CG-CD 4.04Å
241	A	76.3	Confident	85.7	Confident	54 Å²	54	46.8 Å²	46.8	45%	0.446	25%	0.254	S	S	.	.			trans	-58.8	153	173.9	0	0	0	0	0	110.6	T243 K244	A241-T243 WeakPolarHBondContact CB-OG1 3.46Å; A241-T243 PolarHBondContact O-N 2.99Å; A241-K244 WeakPolarHBondContact O-CB 3.39Å; A241-K244 PolarHBondContact O-N 2.89Å
242	L	84	Confident	85.9	Confident	5 Å²	5	45 Å²	45	3%	0.026	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-46	-38.1	174.5	177.8	64.8	0	0	0	111.5	T207 I209 T231 C234 K244 D245 V248 R332	T207-L242 HydrophobicContact CG2-CD1 3.69Å; I209-L242 HydrophobicContact CD1-CD1 4.32Å; I209-L242 HydrophobicContact CD1-CD2 3.83Å; T231-L242 HydrophobicContact CG2-CD2 4.36Å; C234-L242 HydrophobicContact CB-CD2 4.45Å; L242-K244 PolarHBondContact O-N 2.83Å; L242-D245 WeakPolarHBondContact CD1-OD2 3.5Å; L242-D245 WeakPolarHBondContact O-CB 3.48Å; L242-D245 PolarHBondContact O-N 2.81Å; L242-V248 HydrophobicContact CD1-CG1 4.17Å; L242-V248 HydrophobicContact CD1-CG2 3.86Å; L242-V248 HydrophobicContact CG-CG2 4.37Å; L242-R332 PolarHBondContact O-NH2 2.83Å
243	T	81.2	Confident	86.3	Confident	73 Å²	73	38.8 Å²	38.8	45%	0.448	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-54.5	-20.4	178.1	53.3	0	0	0	0	114.8	A241	A241-T243 WeakPolarHBondContact CB-OG1 3.46Å; A241-T243 PolarHBondContact O-N 2.99Å
244	K	85.7	Confident	86.6	Confident	118 Å²	118	36 Å²	36	51%	0.513	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-89	-10	176.1	-67.1	-171.8	169.9	-173.8	0	114.2	Y240 A241 L242	Y240-K244 HydrophobicContact CD1-CD 3.78Å; Y240-K244 HydrophobicContact CG-CD 4.04Å; A241-K244 WeakPolarHBondContact O-CB 3.39Å; A241-K244 PolarHBondContact O-N 2.89Å; L242-K244 PolarHBondContact O-N 2.83Å
245	D	90.5	Very high	86.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.204	C	C	.	.			trans	-67.2	139	175.6	-71.4	-13.1	0	0	0	110.4	R197 H205 T207 L242 V248 R332	R197-D245 IonicContact CZ-OD1 2.69Å; R197-D245 IonicContact NH1-OD1 2.81Å; R197-D245 PolarHBondContact NH1-OD1 3.49Å; H205-D245 HydrophobicContact CB-CB 4.16Å; T207-D245 WeakPolarHBondContact CB-OD2 3.29Å; T207-D245 PolarHBondContact OG1-OD2 2.78Å; L242-D245 WeakPolarHBondContact CD1-OD2 3.5Å; L242-D245 WeakPolarHBondContact O-CB 3.48Å; L242-D245 PolarHBondContact O-N 2.81Å; D245-V248 HydrophobicContact CB-CG2 3.85Å; D245-R332 PolarHBondContact O-NH1 2.99Å
246	D	92.5	Very high	87.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-67.3	-41.4	-174.3	-69	-66.6	0	0	0	112.9	V204 H205 S333 S334 A337 A338 L345	V204-D246 VanDerWaalsContact CA-OD2 3.31Å; V204-D246 WeakPolarHBondContact CA-OD2 3.49Å; V204-D246 HydrophobicContact CG1-CB 4.01Å; H205-D246 PolarHBondContact N-OD2 3.26Å; H205-D246 WeakPolarHBondContact O-CB 3.35Å; H205-D246 PolarHBondContact O-N 3.18Å; D246-S333 CarbonylContact O-C 3.49Å; D246-S333 WeakPolarHBondContact O-CA 3.45Å; D246-S334 PolarHBondContact O-N 2.99Å; D246-A337 VanDerWaalsContact OD1-CA 3.27Å; D246-A337 WeakPolarHBondContact OD1-CA 3.28Å; D246-A338 PolarHBondContact OD1-N 3.18Å; D246-L345 HydrophobicContact CB-CD1 3.48Å; D246-L345 VanDerWaalsContact CB-CD1 3.48Å; D246-L345 WeakPolarHBondContact OD1-CD1 3.45Å
247	Y	95.4	Very high	87.9	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.4	174.3	-68	-75.3	0	0	0	109.4	W66 V204 H205 V206 T207 R332 L345 E346 V347 C372 T373	W66-Y247 HydrophobicContact CZ2-CD2 4.32Å; V204-Y247 HydrophobicContact CG1-CD2 3.88Å; V204-Y247 HydrophobicContact CG1-CE2 3.98Å; H205-Y247 PolarHBondContact O-N 3.33Å; V206-Y247 WeakPolarHBondContact CA-O 3.16Å; V206-Y247 HydrophobicContact CG2-CD2 4.13Å; T207-Y247 PolarHBondContact N-O 2.81Å; Y247-R332 WeakPolarHBondContact CA-O 3.38Å; Y247-L345 HydrophobicContact CE1-CB 4.33Å; Y247-L345 HydrophobicContact CE2-CB 4.4Å; Y247-L345 HydrophobicContact CE2-CD1 4.07Å; Y247-L345 HydrophobicContact CE2-CD2 4.14Å; Y247-L345 HydrophobicContact CE2-CG 4.46Å; Y247-L345 WeakPolarHBondContact OH-CB 3.25Å; Y247-E346 PolarHBondContact OH-N 3.38Å; Y247-E346 PolarHBondContact OH-O 2.94Å; Y247-V347 HydrophobicContact CD1-CG2 3.6Å; Y247-V347 HydrophobicContact CE1-CG2 3.56Å; Y247-C372 HydrophobicContact CE1-CB 4.05Å; Y247-T373 PolarHBondContact OH-N 3.45Å; Y247-T373 PolarHBondContact OH-O 2.97Å; Y247-T373 PolarHBondContact OH-OG1 3.3Å
248	V	96.8	Very high	88.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.2	169.7	-173.5	0	0	0	0	108.9	T207 I209 L242 D245 Y297 F331 R332	T207-V248 HydrophobicContact CG2-CG1 4.34Å; T207-V248 CarbonylContact O-C 3.6Å; T207-V248 WeakPolarHBondContact O-CA 3.36Å; I209-V248 HydrophobicContact CD1-CG1 3.9Å; I209-V248 HydrophobicContact CG1-CG1 4.43Å; L242-V248 HydrophobicContact CD1-CG1 4.17Å; L242-V248 HydrophobicContact CD1-CG2 3.86Å; L242-V248 HydrophobicContact CG-CG2 4.37Å; D245-V248 HydrophobicContact CB-CG2 3.85Å; V248-Y297 HydrophobicContact CB-CE1 4.09Å; V248-Y297 HydrophobicContact CG1-CE1 3.86Å; V248-F331 CarbonylContact O-C 3.6Å; V248-F331 WeakPolarHBondContact O-CA 3.2Å; V248-R332 HydrophobicContact CB-CG 3.98Å; V248-R332 HydrophobicContact CG2-CG 4.43Å; V248-R332 PolarHBondContact N-O 3Å; V248-R332 PolarHBondContact O-N 2.79Å
249	F	98.6	Very high	89.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.4	170.1	-61.8	-90.3	0	0	0	108.7	W66 I68 I70 V206 T207 L208 I209 F251 L330 F331 V347 F370	W66-F249 HydrophobicContact CH2-CE2 4.37Å; I68-F249 HydrophobicContact CD1-CD2 4.45Å; I68-F249 HydrophobicContact CD1-CE2 4.47Å; I68-F249 HydrophobicContact CG2-CE1 4.08Å; I68-F249 HydrophobicContact CG2-CE2 4.14Å; I68-F249 HydrophobicContact CG2-CZ 3.71Å; I70-F249 HydrophobicContact CD1-CB 3.39Å; I70-F249 HydrophobicContact CD1-CD1 3.42Å; I70-F249 VanDerWaalsContact CD1-CD1 3.42Å; I70-F249 HydrophobicContact CD1-CD2 4.35Å; I70-F249 HydrophobicContact CD1-CE1 4.28Å; I70-F249 HydrophobicContact CD1-CG 3.47Å; I70-F249 VanDerWaalsContact CD1-CG 3.47Å; V206-F249 HydrophobicContact CG1-CD2 4.36Å; V206-F249 HydrophobicContact CG1-CE2 4.32Å; T207-F249 PolarHBondContact O-N 2.86Å; L208-F249 WeakPolarHBondContact CA-O 3.31Å; L208-F249 HydrophobicContact CD2-CB 4Å; L208-F249 HydrophobicContact CD2-CD2 3.94Å; L208-F249 HydrophobicContact CD2-CG 4.3Å; I209-F249 PolarHBondContact N-O 3.42Å; F249-F251 HydrophobicContact CB-CD1 4.38Å; F249-L330 WeakPolarHBondContact CA-O 3.36Å; F249-F331 HydrophobicContact CD1-CB 3.54Å; F249-F331 HydrophobicContact CE1-CB 3.71Å; F249-F331 HydrophobicContact CE1-CG 4.41Å; F249-F331 HydrophobicContact CG-CB 4.39Å; F249-V347 HydrophobicContact CE1-CG1 4.23Å; F249-V347 HydrophobicContact CZ-CG1 4.42Å; F249-V347 HydrophobicContact CZ-CG2 4.47Å; F249-F370 HydrophobicContact CD1-CD2 4.17Å; F249-F370 HydrophobicContact CD1-CE2 4.27Å; F249-F370 HydrophobicContact CE1-CB 4.17Å; F249-F370 HydrophobicContact CE1-CD1 4.44Å; F249-F370 AromaticContact CE1-CD2 3.74Å; F249-F370 HydrophobicContact CE1-CD2 3.74Å; F249-F370 HydrophobicContact CE1-CE2 4.25Å; F249-F370 AromaticContact CE1-CG 3.85Å; F249-F370 HydrophobicContact CE1-CG 3.85Å
250	W	98.7	Very high	91.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119	177.2	-164.2	-41.1	0	0	0	109.4	I209 S211 F227 I230 T231 M254 F294 Y297 L330	I209-W250 HydrophobicContact CB-CB 4.38Å; I209-W250 HydrophobicContact CB-CD2 4.11Å; I209-W250 HydrophobicContact CB-CG 4.02Å; I209-W250 HydrophobicContact CD1-CD2 4.08Å; I209-W250 HydrophobicContact CD1-CE3 3.62Å; I209-W250 HydrophobicContact CD1-CZ3 4.04Å; I209-W250 HydrophobicContact CG2-CD2 3.87Å; I209-W250 HydrophobicContact CG2-CE3 4.39Å; I209-W250 HydrophobicContact CG2-CG 4.12Å; I209-W250 HydrophobicContact CG2-CZ2 4.34Å; S211-W250 PolarHBondContact OG-NE1 3.07Å; F227-W250 AromaticContact CD2-CH2 3.65Å; F227-W250 HydrophobicContact CD2-CH2 3.65Å; F227-W250 HydrophobicContact CD2-CZ2 4.13Å; F227-W250 AromaticContact CD2-CZ3 3.96Å; F227-W250 HydrophobicContact CD2-CZ3 3.96Å; F227-W250 HydrophobicContact CE2-CE3 4.46Å; F227-W250 HydrophobicContact CE2-CH2 4.07Å; F227-W250 AromaticContact CE2-CZ3 3.89Å; F227-W250 HydrophobicContact CE2-CZ3 3.89Å; I230-W250 HydrophobicContact CB-CH2 3.59Å; I230-W250 HydrophobicContact CB-CZ2 3.81Å; I230-W250 HydrophobicContact CD1-CZ2 3.99Å; I230-W250 HydrophobicContact CG2-CH2 3.36Å; I230-W250 HydrophobicContact CG2-CZ2 3.5Å; I230-W250 VanDerWaalsContact CG2-CZ2 3.5Å; I230-W250 HydrophobicContact CG2-CZ3 4.15Å; T231-W250 WeakPolarHBondContact OG1-CZ3 3.45Å; W250-M254 HydrophobicContact CG-CE 4.22Å; W250-F294 HydrophobicContact CB-CE1 4.09Å; W250-F294 AromaticContact CD2-CE1 3.48Å; W250-F294 HydrophobicContact CD2-CE1 3.48Å; W250-F294 VanDerWaalsContact CD2-CE1 3.48Å; W250-F294 AromaticContact CD2-CZ 3.9Å; W250-F294 HydrophobicContact CD2-CZ 3.9Å; W250-F294 AromaticContact CE2-CE1 3.89Å; W250-F294 AromaticContact CE2-CZ 3.79Å; W250-F294 AromaticContact CE3-CE1 3.69Å; W250-F294 HydrophobicContact CE3-CE1 3.69Å; W250-F294 HydrophobicContact CE3-CZ 4.36Å; W250-F294 AromaticContact CG-CE1 3.68Å; W250-F294 HydrophobicContact CG-CE1 3.68Å; W250-F294 HydrophobicContact CG-CZ 4.16Å; W250-F294 HydrophobicContact CZ2-CE1 4.42Å; W250-F294 HydrophobicContact CZ2-CZ 4.16Å; W250-F294 HydrophobicContact CZ3-CE1 4.24Å; W250-Y297 HydrophobicContact CB-CE1 4.17Å; W250-Y297 HydrophobicContact CE3-CE1 4.5Å; W250-L330 PolarHBondContact N-O 3.42Å; W250-L330 PolarHBondContact O-N 2.86Å
251	F	98.9	Very high	92.9	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	171	-178	53.4	-83.4	0	0	0	111.4	I70 A104 L160 L208 I209 N210 S211 F249 R328 I329	I70-F251 HydrophobicContact CD1-CD1 4.22Å; I70-F251 HydrophobicContact CD1-CE1 4.3Å; I70-F251 HydrophobicContact CG2-CB 4.03Å; I70-F251 HydrophobicContact CG2-CD1 3.52Å; I70-F251 HydrophobicContact CG2-CD2 3.73Å; I70-F251 HydrophobicContact CG2-CE1 3.82Å; I70-F251 HydrophobicContact CG2-CE2 3.98Å; I70-F251 HydrophobicContact CG2-CG 3.48Å; I70-F251 VanDerWaalsContact CG2-CG 3.48Å; I70-F251 HydrophobicContact CG2-CZ 4.03Å; A104-F251 HydrophobicContact CB-CZ 4.04Å; L160-F251 HydrophobicContact CD1-CE2 4.03Å; L160-F251 HydrophobicContact CD1-CZ 3.73Å; L208-F251 HydrophobicContact CB-CE1 4.11Å; L208-F251 HydrophobicContact CB-CZ 4.39Å; L208-F251 HydrophobicContact CD2-CE1 4.44Å; I209-F251 WeakPolarHBondContact O-CD1 3.38Å; I209-F251 PolarHBondContact O-N 3.27Å; N210-F251 CarbonylContact C-O 3.44Å; N210-F251 WeakPolarHBondContact CA-O 3.06Å; N210-F251 HydrophobicContact CB-CD2 4.24Å; N210-F251 HydrophobicContact CB-CE2 3.75Å; N210-F251 HydrophobicContact CB-CZ 4.23Å; S211-F251 PolarHBondContact N-O 2.86Å; S211-F251 PolarHBondContact OG-O 2.07Å; F249-F251 HydrophobicContact CB-CD1 4.38Å; F251-R328 WeakPolarHBondContact CA-O 3.41Å; F251-R328 WeakPolarHBondContact CB-O 3.49Å; F251-I329 HydrophobicContact CB-CB 4.28Å; F251-I329 HydrophobicContact CB-CG1 3.84Å; F251-I329 HydrophobicContact CB-CG2 4.25Å
252	G	98.5	Very high	93.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	135.4	-175.8	177.8	0	0	0	0	0	113.5	T72 S211 M254 D327 R328	T72-G252 WeakPolarHBondContact OG1-CA 3.32Å; T72-G252 PolarHBondContact OG1-N 2.77Å; S211-G252 CarbonylContact O-C 3.5Å; S211-G252 VanDerWaalsContact O-CA 3.23Å; S211-G252 WeakPolarHBondContact O-CA 3.42Å; G252-M254 PolarHBondContact O-N 3.22Å; G252-D327 WeakPolarHBondContact O-CA 3.38Å; G252-R328 PolarHBondContact N-O 3.14Å; G252-R328 PolarHBondContact O-N 3.13Å; G252-R328 VanDerWaalsContact O-N 3.13Å
253	N	97.8	Very high	94.3	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	95.2	169.2	-178.2	10.7	0	0	0	109.3	Q108 S211 H212 L213 N255 C326	Q108-N253 HydrophobicContact CB-CB 4.24Å; Q108-N253 HydrophobicContact CG-CB 4Å; S211-N253 PolarHBondContact O-N 2.91Å; S211-N253 VanDerWaalsContact O-N 3.11Å; H212-N253 VanDerWaalsContact CA-O 3.28Å; H212-N253 WeakPolarHBondContact CA-O 3.39Å; L213-N253 PolarHBondContact N-O 2.83Å; N253-N255 PolarHBondContact ND2-ND2 2.54Å; N253-N255 PolarHBondContact ND2-OD1 2.88Å; N253-N255 VanDerWaalsContact OD1-CG 3.26Å; N253-N255 PolarHBondContact OD1-N 3.48Å; N253-N255 PolarHBondContact OD1-OD1 2.85Å; N253-C326 WeakPolarHBondContact OD1-CB 3.13Å
254	M	97.2	Very high	94.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.			trans	-91.1	-3.8	-177.3	-55.2	-172.1	-158.2	0	0	113.1	L213 R223 W250 G252 W256 F294 C326 R328 L330	L213-M254 WeakPolarHBondContact CB-O 3.27Å; L213-M254 HydrophobicContact CD1-CB 3.94Å; L213-M254 HydrophobicContact CD1-CG 4.38Å; L213-M254 HydrophobicContact CG-CB 4.27Å; R223-M254 VanDerWaalsContact CD-O 3.28Å; R223-M254 WeakPolarHBondContact CD-O 3.37Å; W250-M254 HydrophobicContact CG-CE 4.22Å; G252-M254 PolarHBondContact O-N 3.22Å; M254-W256 HydrophobicContact CB-CG 4.47Å; M254-W256 PolarHBondContact O-N 3.02Å; M254-W256 VanDerWaalsContact O-N 3.13Å; M254-F294 HydrophobicContact CE-CZ 4.47Å; M254-F294 HydrophobicContact SD-CE2 4.08Å; M254-F294 HydrophobicContact SD-CZ 3.79Å; M254-C326 PolarHBondContact N-O 2.86Å; M254-R328 HydrophobicContact CE-CB 4.16Å; M254-R328 HydrophobicContact SD-CB 4.37Å; M254-L330 HydrophobicContact CE-CD1 3.64Å; M254-L330 HydrophobicContact SD-CD1 4.01Å
255	N	95.6	Very high	95.5	Very high	13 Å²	13	30 Å²	30	7%	0.07	16%	0.155	C	C	.	.			trans	49.3	37.6	175.2	-68.8	-53.2	0	0	0	114.8	L213 P215 R223 N253 C326	L213-N255 PolarHBondContact O-ND2 3.02Å; P215-N255 HydrophobicContact CB-CB 4.33Å; R223-N255 WeakPolarHBondContact CD-O 3.39Å; R223-N255 PolarHBondContact NE-O 3.17Å; R223-N255 PolarHBondContact NH1-O 3.37Å; N253-N255 PolarHBondContact ND2-ND2 2.54Å; N253-N255 PolarHBondContact ND2-OD1 2.88Å; N253-N255 VanDerWaalsContact OD1-CG 3.26Å; N253-N255 PolarHBondContact OD1-N 3.48Å; N253-N255 PolarHBondContact OD1-OD1 2.85Å; N255-C326 PolarHBondContact N-O 2.86Å
256	W	95.4	Very high	95.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.			trans	-77.6	132.7	168.2	-58.5	110	0	0	0	109.5	L213 M220 R223 V224 M254 E283 L284 L287 V293	L213-W256 HydrophobicContact CD1-CZ2 4.26Å; M220-W256 HydrophobicContact CG-CZ3 4.35Å; R223-W256 HydrophobicContact CB-CE3 4.41Å; R223-W256 HydrophobicContact CB-CH2 3.36Å; R223-W256 HydrophobicContact CB-CZ2 3.9Å; R223-W256 HydrophobicContact CB-CZ3 3.66Å; V224-W256 HydrophobicContact CG2-CH2 4.19Å; M254-W256 HydrophobicContact CB-CG 4.47Å; M254-W256 PolarHBondContact O-N 3.02Å; M254-W256 VanDerWaalsContact O-N 3.13Å; W256-E283 WeakPolarHBondContact CA-OE1 3.02Å; W256-E283 HydrophobicContact CB-CB 4.38Å; W256-E283 HydrophobicContact CE3-CG 3.86Å; W256-E283 HydrophobicContact CZ3-CG 4.48Å; W256-L284 HydrophobicContact CB-CB 3.83Å; W256-L284 HydrophobicContact CD2-CB 4.18Å; W256-L284 HydrophobicContact CD2-CD1 4.36Å; W256-L284 HydrophobicContact CG-CB 3.64Å; W256-L284 HydrophobicContact CG-CD1 4.41Å; W256-L284 HydrophobicContact CG-CD2 4.38Å; W256-L284 HydrophobicContact CG-CG 4.34Å; W256-L284 HydrophobicContact CZ2-CD1 4.5Å; W256-L287 HydrophobicContact CE3-CD1 3.93Å; W256-L287 HydrophobicContact CH2-CD1 3.97Å; W256-L287 HydrophobicContact CZ3-CD1 3.38Å; W256-V293 HydrophobicContact CH2-CG1 4.42Å
257	S	93	Very high	95.9	Very high	20 Å²	20	32 Å²	32	14%	0.14	17%	0.165	C	C	.	.			trans	-96.9	-168.7	-175.6	-162.8	0	0	0	0	112.4	E283	S257-E283 PolarHBondContact N-OE1 2.69Å; S257-E283 VanDerWaalsContact N-OE1 3.16Å; S257-E283 WeakPolarHBondContact O-CB 3.14Å; S257-E283 PolarHBondContact O-N 2.77Å
258	M	94.3	Very high	96	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.02	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-97.1	145.1	168	-54.3	-59.1	-65.2	0	0	110	I261 L266 L278 F281 P323 A324 Y325	M258-I261 HydrophobicContact CB-CG2 3.86Å; M258-L266 HydrophobicContact CE-CD1 3.89Å; M258-L266 HydrophobicContact CG-CD1 4.19Å; M258-L266 HydrophobicContact CG-CD2 4.09Å; M258-L278 HydrophobicContact CE-CD2 4.42Å; M258-L278 WeakPolarHBondContact CE-O 3.46Å; M258-F281 CarbonylContact C-O 3.59Å; M258-F281 WeakPolarHBondContact CA-O 3.21Å; M258-F281 HydrophobicContact CE-CB 3.79Å; M258-P323 WeakPolarHBondContact CG-O 3.47Å; M258-A324 HydrophobicContact CG-CB 4.26Å; M258-Y325 HydrophobicContact SD-CD2 4.22Å
259	L	93.1	Very high	96.1	Very high	41 Å²	41	38.2 Å²	38.2	22%	0.215	20%	0.195	C	C	.	.			trans	-115.5	146.2	179.7	-63.2	178.9	0	0	0	111.1	I261 F281 E283 T286	L259-I261 PolarHBondContact O-N 3.11Å; L259-F281 PolarHBondContact N-O 3.25Å; L259-F281 WeakPolarHBondContact O-CB 3.5Å; L259-F281 WeakPolarHBondContact O-CD1 3.43Å; L259-E283 HydrophobicContact CD1-CB 4.04Å; L259-E283 HydrophobicContact CD1-CG 4.04Å; L259-E283 HydrophobicContact CD2-CB 4.28Å; L259-E283 HydrophobicContact CD2-CG 4.17Å; L259-E283 HydrophobicContact CG-CB 3.83Å; L259-E283 HydrophobicContact CG-CG 4.11Å; L259-T286 HydrophobicContact CD1-CG2 4.37Å
260	N	93.1	Very high	96	Very high	158 Å²	158	38.7 Å²	38.7	85%	0.845	20%	0.198	S	C	*	.	S	Bend	trans	52.7	30.8	166.1	-56.2	-39.1	0	0	0	115.3
261	I	95.1	Very high	95.8	Very high	18 Å²	18	45.8 Å²	45.8	9%	0.092	23%	0.231	C	C	.	.			trans	-131.3	133.7	177.5	-171	166.2	0	0	0	109.7	M258 L259 Q265 L266 L269 F281	M258-I261 HydrophobicContact CB-CG2 3.86Å; L259-I261 PolarHBondContact O-N 3.11Å; I261-Q265 HydrophobicContact CD1-CB 4.37Å; I261-Q265 HydrophobicContact CD1-CG 4.12Å; I261-Q265 HydrophobicContact CG1-CB 4.03Å; I261-Q265 HydrophobicContact CG1-CG 4.14Å; I261-L266 HydrophobicContact CD1-CB 3.87Å; I261-L266 HydrophobicContact CD1-CD1 4.2Å; I261-L266 HydrophobicContact CG1-CB 4.05Å; I261-L266 HydrophobicContact CG2-CB 4.38Å; I261-L269 HydrophobicContact CD1-CD1 3.69Å; I261-F281 HydrophobicContact CB-CB 4.21Å; I261-F281 HydrophobicContact CB-CD1 3.71Å; I261-F281 HydrophobicContact CB-CE1 4.17Å; I261-F281 HydrophobicContact CB-CG 3.92Å; I261-F281 HydrophobicContact CD1-CB 4.48Å; I261-F281 HydrophobicContact CD1-CD1 4.34Å; I261-F281 HydrophobicContact CD1-CD2 3.73Å; I261-F281 HydrophobicContact CD1-CE1 4.5Å; I261-F281 HydrophobicContact CD1-CE2 3.94Å; I261-F281 HydrophobicContact CD1-CG 3.94Å; I261-F281 HydrophobicContact CD1-CZ 4.31Å; I261-F281 HydrophobicContact CG1-CD1 4.4Å; I261-F281 HydrophobicContact CG1-CG 4.43Å; I261-F281 HydrophobicContact CG2-CB 4.05Å; I261-F281 HydrophobicContact CG2-CD1 4.45Å; I261-F281 HydrophobicContact CG2-CG 4.32Å
262	D	94.4	Very high	95.8	Very high	89 Å²	89	52.4 Å²	52.4	48%	0.476	26%	0.26	S	S	.	.			trans	-78.6	157.1	171.7	78.1	78.9	0	0	0	111	N264 Q265 L266	D262-N264 VanDerWaalsContact C-N 3.32Å; D262-N264 PolarHBondContact O-N 3.41Å; D262-N264 WeakPolarHBondContact OD1-CA 3.37Å; D262-N264 WeakPolarHBondContact OD1-CB 3.21Å; D262-N264 PolarHBondContact OD1-N 3.06Å; D262-Q265 PolarHBondContact O-N 2.81Å; D262-Q265 PolarHBondContact OD1-N 3.47Å; D262-Q265 WeakPolarHBondContact OD2-CB 3.32Å; D262-L266 WeakPolarHBondContact O-CB 3.49Å; D262-L266 PolarHBondContact O-N 3.46Å
263	K	93.9	Very high	95.7	Very high	83 Å²	83	60.2 Å²	60.2	36%	0.361	29%	0.289	S	S	.	.	H	α-helix	trans	-59	-39	-175.3	-179.6	-177.9	167.7	-170.5	0	113.8	L266 L267 V319 L322	K263-L266 PolarHBondContact O-N 3.22Å; K263-L267 HydrophobicContact CG-CD1 4.05Å; K263-L267 HydrophobicContact CG-CG 4.43Å; K263-L267 WeakPolarHBondContact O-CB 3.35Å; K263-L267 WeakPolarHBondContact O-CG 3.27Å; K263-L267 PolarHBondContact O-N 3.38Å; K263-V319 WeakPolarHBondContact CE-O 3.42Å; K263-V319 PolarHBondContact NZ-O 3.44Å; K263-L322 HydrophobicContact CB-CD2 3.74Å; K263-L322 HydrophobicContact CG-CD2 4.15Å
264	N	95.3	Very high	95.7	Very high	124 Å²	124	61.5 Å²	61.5	66%	0.663	30%	0.3	S	S	*	.	H	α-helix	trans	-70.2	-44.7	-176.8	-67.5	-30.4	0	0	0	109.9	D262 L266 L267 E268	D262-N264 VanDerWaalsContact C-N 3.32Å; D262-N264 PolarHBondContact O-N 3.41Å; D262-N264 WeakPolarHBondContact OD1-CA 3.37Å; D262-N264 WeakPolarHBondContact OD1-CB 3.21Å; D262-N264 PolarHBondContact OD1-N 3.06Å; N264-L266 VanDerWaalsContact C-N 3.32Å; N264-L266 PolarHBondContact O-N 2.76Å; N264-L267 PolarHBondContact O-N 3.18Å; N264-E268 WeakPolarHBondContact O-CB 3.3Å; N264-E268 PolarHBondContact O-N 3.23Å
265	Q	96.6	Very high	95.7	Very high	79 Å²	79	63.1 Å²	63.1	37%	0.369	31%	0.307	S	S	.	.	H	α-helix	trans	-60.7	-42.5	174.4	-171.1	179.6	27.7	0	0	111.7	I261 D262 E268 L269	I261-Q265 HydrophobicContact CD1-CB 4.37Å; I261-Q265 HydrophobicContact CD1-CG 4.12Å; I261-Q265 HydrophobicContact CG1-CB 4.03Å; I261-Q265 HydrophobicContact CG1-CG 4.14Å; D262-Q265 PolarHBondContact O-N 2.81Å; D262-Q265 PolarHBondContact OD1-N 3.47Å; D262-Q265 WeakPolarHBondContact OD2-CB 3.32Å; Q265-E268 WeakPolarHBondContact O-CB 3.36Å; Q265-E268 PolarHBondContact O-N 3.14Å; Q265-L269 WeakPolarHBondContact O-CG 2.94Å; Q265-L269 PolarHBondContact O-N 3.18Å
266	L	96.6	Very high	95.7	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.9	-48.6	176.3	176.8	60.3	0	0	0	111.8	M258 I261 D262 K263 N264 E268 L269 I270 L278 L322	M258-L266 HydrophobicContact CE-CD1 3.89Å; M258-L266 HydrophobicContact CG-CD1 4.19Å; M258-L266 HydrophobicContact CG-CD2 4.09Å; I261-L266 HydrophobicContact CD1-CB 3.87Å; I261-L266 HydrophobicContact CD1-CD1 4.2Å; I261-L266 HydrophobicContact CG1-CB 4.05Å; I261-L266 HydrophobicContact CG2-CB 4.38Å; D262-L266 WeakPolarHBondContact O-CB 3.49Å; D262-L266 PolarHBondContact O-N 3.46Å; K263-L266 PolarHBondContact O-N 3.22Å; N264-L266 VanDerWaalsContact C-N 3.32Å; N264-L266 PolarHBondContact O-N 2.76Å; L266-E268 VanDerWaalsContact C-N 3.29Å; L266-E268 PolarHBondContact O-N 2.94Å; L266-L269 PolarHBondContact O-N 3.14Å; L266-I270 HydrophobicContact CD1-CD1 3.96Å; L266-I270 HydrophobicContact CD1-CG1 4.37Å; L266-I270 HydrophobicContact CG-CD1 3.88Å; L266-I270 WeakPolarHBondContact O-CB 3.45Å; L266-I270 VanDerWaalsContact O-CG1 3.26Å; L266-I270 WeakPolarHBondContact O-CG1 3.36Å; L266-I270 PolarHBondContact O-N 2.82Å; L266-L278 HydrophobicContact CD1-CD2 3.56Å; L266-L322 HydrophobicContact CD2-CB 4.13Å; L266-L322 HydrophobicContact CD2-CD2 3.78Å
267	L	96.5	Very high	95.8	Very high	42 Å²	42	73.5 Å²	73.5	22%	0.22	36%	0.358	C	S	.	.	H	α-helix	trans	-64.1	-35.7	178.9	-70.1	175	0	0	0	112.1	K263 N264 I270 Q271 L317 V319 P323	K263-L267 HydrophobicContact CG-CD1 4.05Å; K263-L267 HydrophobicContact CG-CG 4.43Å; K263-L267 WeakPolarHBondContact O-CB 3.35Å; K263-L267 WeakPolarHBondContact O-CG 3.27Å; K263-L267 PolarHBondContact O-N 3.38Å; N264-L267 PolarHBondContact O-N 3.18Å; L267-I270 PolarHBondContact O-N 2.95Å; L267-Q271 VanDerWaalsContact O-CB 3.3Å; L267-Q271 WeakPolarHBondContact O-CB 3.27Å; L267-Q271 PolarHBondContact O-N 2.48Å; L267-L317 HydrophobicContact CD2-CD1 4.43Å; L267-V319 HydrophobicContact CD1-CG1 4.25Å; L267-V319 HydrophobicContact CD2-CG1 4.4Å; L267-P323 HydrophobicContact CD2-CG 4.31Å
268	E	97.1	Very high	96	Very high	102 Å²	102	72.5 Å²	72.5	48%	0.477	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-50.9	173.9	-176.7	178.2	-153.2	0	0	111.3	N264 Q265 L266 I270 Q271 F272	N264-E268 WeakPolarHBondContact O-CB 3.3Å; N264-E268 PolarHBondContact O-N 3.23Å; Q265-E268 WeakPolarHBondContact O-CB 3.36Å; Q265-E268 PolarHBondContact O-N 3.14Å; L266-E268 VanDerWaalsContact C-N 3.29Å; L266-E268 PolarHBondContact O-N 2.94Å; E268-I270 VanDerWaalsContact C-N 3.27Å; E268-I270 PolarHBondContact O-N 3.24Å; E268-Q271 WeakPolarHBondContact O-CB 3.3Å; E268-Q271 PolarHBondContact O-N 3.36Å; E268-Q271 VanDerWaalsContact O-N 3.12Å; E268-F272 HydrophobicContact CG-CD2 3.61Å; E268-F272 HydrophobicContact CG-CE2 3.47Å; E268-F272 VanDerWaalsContact CG-CE2 3.47Å; E268-F272 WeakPolarHBondContact O-CD2 3.34Å; E268-F272 PolarHBondContact O-N 3.27Å
269	L	97.8	Very high	96.2	Very high	28 Å²	28	73.6 Å²	73.6	15%	0.147	36%	0.357	C	S	.	.	H	α-helix	trans	-59.8	-38.7	176.9	-69.5	179.5	0	0	0	112.2	I261 Q265 L266 R273 A274 R277 L278 F281	I261-L269 HydrophobicContact CD1-CD1 3.69Å; Q265-L269 WeakPolarHBondContact O-CG 2.94Å; Q265-L269 PolarHBondContact O-N 3.18Å; L266-L269 PolarHBondContact O-N 3.14Å; L269-R273 PolarHBondContact O-N 2.84Å; L269-A274 HydrophobicContact CB-CB 4.39Å; L269-A274 HydrophobicContact CD2-CB 3.88Å; L269-A274 PolarHBondContact O-N 3.01Å; L269-R277 HydrophobicContact CD1-CB 4.46Å; L269-R277 HydrophobicContact CD2-CB 4.17Å; L269-L278 HydrophobicContact CB-CD2 3.57Å; L269-L278 HydrophobicContact CB-CG 3.98Å; L269-L278 HydrophobicContact CD1-CD2 4.09Å; L269-F281 HydrophobicContact CD1-CD2 4.16Å; L269-F281 HydrophobicContact CD1-CE2 3.85Å
270	I	96.5	Very high	96.4	Very high	10 Å²	10	75.9 Å²	75.9	5%	0.051	37%	0.369	C	S	.	.	H	α-helix	trans	-63.3	-47.1	174.1	-73.2	166.2	0	0	0	110.9	L266 L267 E268 F272 R273 L278 L305 P306 L317 P323	L266-I270 HydrophobicContact CD1-CD1 3.96Å; L266-I270 HydrophobicContact CD1-CG1 4.37Å; L266-I270 HydrophobicContact CG-CD1 3.88Å; L266-I270 WeakPolarHBondContact O-CB 3.45Å; L266-I270 VanDerWaalsContact O-CG1 3.26Å; L266-I270 WeakPolarHBondContact O-CG1 3.36Å; L266-I270 PolarHBondContact O-N 2.82Å; L267-I270 PolarHBondContact O-N 2.95Å; E268-I270 VanDerWaalsContact C-N 3.27Å; E268-I270 PolarHBondContact O-N 3.24Å; I270-F272 VanDerWaalsContact C-N 3.3Å; I270-F272 PolarHBondContact O-N 2.53Å; I270-R273 PolarHBondContact O-N 3.32Å; I270-L278 HydrophobicContact CG1-CD1 4.02Å; I270-L278 HydrophobicContact CG1-CD2 4.08Å; I270-L305 HydrophobicContact CG2-CD2 3.84Å; I270-P306 HydrophobicContact CD1-CG 3.78Å; I270-P306 HydrophobicContact CG1-CG 4Å; I270-L317 HydrophobicContact CD1-CD1 4.33Å; I270-L317 HydrophobicContact CG2-CD1 3.8Å; I270-P323 HydrophobicContact CD1-CB 3.85Å; I270-P323 HydrophobicContact CD1-CG 3.96Å
271	Q	95.9	Very high	96.6	Very high	150 Å²	150	70.1 Å²	70.1	70%	0.701	34%	0.336	S	S	*	.	H	α-helix	trans	-60	-42.2	179.3	-178.3	178.6	10.5	0	0	111.4	L267 E268 R273	L267-Q271 VanDerWaalsContact O-CB 3.3Å; L267-Q271 WeakPolarHBondContact O-CB 3.27Å; L267-Q271 PolarHBondContact O-N 2.48Å; E268-Q271 WeakPolarHBondContact O-CB 3.3Å; E268-Q271 PolarHBondContact O-N 3.36Å; E268-Q271 VanDerWaalsContact O-N 3.12Å; Q271-R273 PolarHBondContact O-N 2.88Å
272	F	97.6	Very high	96.7	Very high	139 Å²	139	69.2 Å²	69.2	61%	0.61	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-1.9	175.6	-71.8	-62.5	0	0	0	114.2	E268 I270 A274	E268-F272 HydrophobicContact CG-CD2 3.61Å; E268-F272 HydrophobicContact CG-CE2 3.47Å; E268-F272 VanDerWaalsContact CG-CE2 3.47Å; E268-F272 WeakPolarHBondContact O-CD2 3.34Å; E268-F272 PolarHBondContact O-N 3.27Å; I270-F272 VanDerWaalsContact C-N 3.3Å; I270-F272 PolarHBondContact O-N 2.53Å; F272-A274 PolarHBondContact O-N 2.82Å
273	R	97.5	Very high	96.8	Very high	163 Å²	163	65.2 Å²	65.2	62%	0.615	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	38.2	-175.9	-63	-173.3	171.6	95.5	-2	112.4	L269 I270 Q271 F275	L269-R273 PolarHBondContact O-N 2.84Å; I270-R273 PolarHBondContact O-N 3.32Å; Q271-R273 PolarHBondContact O-N 2.88Å; R273-F275 HydrophobicContact CB-CE1 4.12Å; R273-F275 HydrophobicContact CB-CE2 3.84Å; R273-F275 HydrophobicContact CB-CZ 3.6Å; R273-F275 HydrophobicContact CG-CE1 4.43Å; R273-F275 HydrophobicContact CG-CE2 4.49Å; R273-F275 HydrophobicContact CG-CZ 3.87Å; R273-F275 WeakPolarHBondContact O-CD2 3.2Å; R273-F275 PolarHBondContact O-N 2.68Å
274	A	97.6	Very high	97	Very high	28 Å²	28	61.2 Å²	61.2	23%	0.231	29%	0.293	C	S	.	.			trans	-79.1	58.4	-179.2	0	0	0	0	0	111.2	L269 F272 S276 R277 L278	L269-A274 HydrophobicContact CB-CB 4.39Å; L269-A274 HydrophobicContact CD2-CB 3.88Å; L269-A274 PolarHBondContact O-N 3.01Å; F272-A274 PolarHBondContact O-N 2.82Å; A274-S276 PolarHBondContact O-N 3.47Å; A274-R277 HydrophobicContact CB-CB 4.24Å; A274-R277 WeakPolarHBondContact O-CA 3.22Å; A274-R277 WeakPolarHBondContact O-CB 3.5Å; A274-R277 PolarHBondContact O-N 3.48Å; A274-L278 PolarHBondContact O-N 3.02Å
275	F	97.4	Very high	97	Very high	34 Å²	34	56.4 Å²	56.4	15%	0.149	27%	0.268	C	S	.	.	H	α-helix	trans	-56.4	-43.8	-169.2	-54.6	-55.2	0	0	0	113.5	R273 R277 L278 M279 I302 S303 F304 L305	R273-F275 HydrophobicContact CB-CE1 4.12Å; R273-F275 HydrophobicContact CB-CE2 3.84Å; R273-F275 HydrophobicContact CB-CZ 3.6Å; R273-F275 HydrophobicContact CG-CE1 4.43Å; R273-F275 HydrophobicContact CG-CE2 4.49Å; R273-F275 HydrophobicContact CG-CZ 3.87Å; R273-F275 WeakPolarHBondContact O-CD2 3.2Å; R273-F275 PolarHBondContact O-N 2.68Å; F275-R277 PolarHBondContact O-N 3.12Å; F275-L278 HydrophobicContact CD1-CD1 4.18Å; F275-L278 WeakPolarHBondContact O-CB 3.28Å; F275-L278 PolarHBondContact O-N 2.82Å; F275-L278 VanDerWaalsContact O-N 3.13Å; F275-M279 WeakPolarHBondContact O-CG 3.23Å; F275-M279 PolarHBondContact O-N 2.98Å; F275-M279 VanDerWaalsContact O-N 3.08Å; F275-I302 WeakPolarHBondContact CB-O 3.16Å; F275-S303 VanDerWaalsContact CE2-C 3.46Å; F275-S303 WeakPolarHBondContact CE2-O 3.39Å; F275-F304 VanDerWaalsContact CD1-O 3.27Å; F275-F304 WeakPolarHBondContact CD1-O 3.43Å; F275-F304 WeakPolarHBondContact CE1-O 3.48Å; F275-L305 HydrophobicContact CE1-CD2 4.19Å
276	S	96	Very high	97	Very high	81 Å²	81	55.5 Å²	55.5	57%	0.566	27%	0.268	S	S	*	.	H	α-helix	trans	-59.2	-37.8	177	-51.7	0	0	0	0	112.2	A274 M279	A274-S276 PolarHBondContact O-N 3.47Å; S276-M279 PolarHBondContact O-N 3.13Å
277	R	97.1	Very high	97	Very high	150 Å²	150	56.6 Å²	56.6	57%	0.566	27%	0.273	S	S	*	.	H	α-helix	trans	-75.1	-33.6	177	-63.8	-67	-77.8	164.8	-11.6	112.1	L269 A274 F275 M279 D280 F281	L269-R277 HydrophobicContact CD1-CB 4.46Å; L269-R277 HydrophobicContact CD2-CB 4.17Å; A274-R277 HydrophobicContact CB-CB 4.24Å; A274-R277 WeakPolarHBondContact O-CA 3.22Å; A274-R277 WeakPolarHBondContact O-CB 3.5Å; A274-R277 PolarHBondContact O-N 3.48Å; F275-R277 PolarHBondContact O-N 3.12Å; R277-M279 PolarHBondContact O-N 2.89Å; R277-D280 WeakPolarHBondContact CD-OD2 3.47Å; R277-D280 IonicContact CZ-OD2 3.55Å; R277-D280 IonicContact NE-OD2 3.91Å; R277-D280 IonicContact NH1-OD2 2.75Å; R277-D280 PolarHBondContact NH1-OD2 3.49Å; R277-D280 WeakPolarHBondContact O-CB 3.29Å; R277-D280 PolarHBondContact O-N 2.73Å; R277-F281 WeakPolarHBondContact O-CD2 3.47Å; R277-F281 WeakPolarHBondContact O-CE2 3.5Å
278	L	97.7	Very high	97	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-37.3	172.3	-72	168.6	0	0	0	111.3	M258 L266 L269 I270 A274 F275 D280 F281 D282 Y325	M258-L278 HydrophobicContact CE-CD2 4.42Å; M258-L278 WeakPolarHBondContact CE-O 3.46Å; L266-L278 HydrophobicContact CD1-CD2 3.56Å; L269-L278 HydrophobicContact CB-CD2 3.57Å; L269-L278 HydrophobicContact CB-CG 3.98Å; L269-L278 HydrophobicContact CD1-CD2 4.09Å; I270-L278 HydrophobicContact CG1-CD1 4.02Å; I270-L278 HydrophobicContact CG1-CD2 4.08Å; A274-L278 PolarHBondContact O-N 3.02Å; F275-L278 HydrophobicContact CD1-CD1 4.18Å; F275-L278 WeakPolarHBondContact O-CB 3.28Å; F275-L278 PolarHBondContact O-N 2.82Å; F275-L278 VanDerWaalsContact O-N 3.13Å; L278-D280 PolarHBondContact O-N 2.86Å; L278-F281 PolarHBondContact O-N 2.8Å; L278-D282 PolarHBondContact O-N 3.41Å; L278-Y325 HydrophobicContact CB-CE2 4.42Å
279	M	97.6	Very high	96.9	Very high	27 Å²	27	58.5 Å²	58.5	13%	0.133	28%	0.284	C	S	.	.	H	α-helix	trans	-66.8	-22.1	178.6	-63.4	-56	93.7	0	0	113.7	F275 S276 R277 F281 D282 T285 I302 Y325	F275-M279 WeakPolarHBondContact O-CG 3.23Å; F275-M279 PolarHBondContact O-N 2.98Å; F275-M279 VanDerWaalsContact O-N 3.08Å; S276-M279 PolarHBondContact O-N 3.13Å; R277-M279 PolarHBondContact O-N 2.89Å; M279-F281 PolarHBondContact O-N 3.16Å; M279-D282 HydrophobicContact CE-CB 4.19Å; M279-D282 PolarHBondContact O-N 3.38Å; M279-D282 HydrophobicContact SD-CB 4.22Å; M279-T285 HydrophobicContact CB-CG2 4.5Å; M279-I302 HydrophobicContact CE-CD1 4.32Å; M279-I302 HydrophobicContact CE-CG2 4.24Å; M279-I302 HydrophobicContact SD-CB 4.05Å; M279-I302 HydrophobicContact SD-CD1 3.62Å; M279-I302 HydrophobicContact SD-CG1 4.31Å; M279-I302 HydrophobicContact SD-CG2 4.37Å; M279-Y325 HydrophobicContact CE-CD2 3.58Å; M279-Y325 HydrophobicContact CE-CE1 4.39Å; M279-Y325 HydrophobicContact CE-CE2 3.32Å; M279-Y325 HydrophobicContact CE-CG 4.23Å
280	D	96.7	Very high	96.9	Very high	88 Å²	88	61 Å²	61	47%	0.471	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.1	172.3	-60.4	-26.4	0	0	0	111.9	R277 L278	R277-D280 WeakPolarHBondContact CD-OD2 3.47Å; R277-D280 IonicContact CZ-OD2 3.55Å; R277-D280 IonicContact NE-OD2 3.91Å; R277-D280 IonicContact NH1-OD2 2.75Å; R277-D280 PolarHBondContact NH1-OD2 3.49Å; R277-D280 WeakPolarHBondContact O-CB 3.29Å; R277-D280 PolarHBondContact O-N 2.73Å; L278-D280 PolarHBondContact O-N 2.86Å
281	F	97.2	Very high	96.8	Very high	37 Å²	37	62.6 Å²	62.6	16%	0.162	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	2.7	-179.4	-55.2	-79.7	0	0	0	112.7	M258 L259 I261 L269 R277 L278 M279	M258-F281 CarbonylContact C-O 3.59Å; M258-F281 WeakPolarHBondContact CA-O 3.21Å; M258-F281 HydrophobicContact CE-CB 3.79Å; L259-F281 PolarHBondContact N-O 3.25Å; L259-F281 WeakPolarHBondContact O-CB 3.5Å; L259-F281 WeakPolarHBondContact O-CD1 3.43Å; I261-F281 HydrophobicContact CB-CB 4.21Å; I261-F281 HydrophobicContact CB-CD1 3.71Å; I261-F281 HydrophobicContact CB-CE1 4.17Å; I261-F281 HydrophobicContact CB-CG 3.92Å; I261-F281 HydrophobicContact CD1-CB 4.48Å; I261-F281 HydrophobicContact CD1-CD1 4.34Å; I261-F281 HydrophobicContact CD1-CD2 3.73Å; I261-F281 HydrophobicContact CD1-CE1 4.5Å; I261-F281 HydrophobicContact CD1-CE2 3.94Å; I261-F281 HydrophobicContact CD1-CG 3.94Å; I261-F281 HydrophobicContact CD1-CZ 4.31Å; I261-F281 HydrophobicContact CG1-CD1 4.4Å; I261-F281 HydrophobicContact CG1-CG 4.43Å; I261-F281 HydrophobicContact CG2-CB 4.05Å; I261-F281 HydrophobicContact CG2-CD1 4.45Å; I261-F281 HydrophobicContact CG2-CG 4.32Å; L269-F281 HydrophobicContact CD1-CD2 4.16Å; L269-F281 HydrophobicContact CD1-CE2 3.85Å; R277-F281 WeakPolarHBondContact O-CD2 3.47Å; R277-F281 WeakPolarHBondContact O-CE2 3.5Å; L278-F281 PolarHBondContact O-N 2.8Å; M279-F281 PolarHBondContact O-N 3.16Å
282	D	97.2	Very high	96.8	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-78.1	127	179.5	175.9	66.1	0	0	0	110.4	L278 M279 L284 T285 T286 R328	L278-D282 PolarHBondContact O-N 3.41Å; M279-D282 HydrophobicContact CE-CB 4.19Å; M279-D282 PolarHBondContact O-N 3.38Å; M279-D282 HydrophobicContact SD-CB 4.22Å; D282-L284 PolarHBondContact O-N 2.99Å; D282-T285 PolarHBondContact O-N 2.81Å; D282-T285 WeakPolarHBondContact OD2-CB 3.47Å; D282-T285 PolarHBondContact OD2-N 2.67Å; D282-T285 PolarHBondContact OD2-OG1 3.38Å; D282-T286 WeakPolarHBondContact O-CB 3.31Å; D282-T286 PolarHBondContact O-N 3.11Å; D282-T286 PolarHBondContact O-OG1 3.11Å; D282-R328 VanDerWaalsContact CG-NH1 3.31Å; D282-R328 IonicContact OD1-NH1 2.89Å; D282-R328 PolarHBondContact OD1-NH1 3.4Å; D282-R328 IonicContact OD2-CZ 3.32Å; D282-R328 IonicContact OD2-NH1 3.51Å; D282-R328 PolarHBondContact OD2-NH1 3.32Å; D282-R328 IonicContact OD2-NH2 3.16Å; D282-R328 PolarHBondContact OD2-NH2 3.12Å; D282-R328 VanDerWaalsContact OD2-NH2 3.15Å
283	E	96.5	Very high	96.7	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.019	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-45.5	-176.3	-178.1	175.1	67.6	0	0	111.6	M220 R223 W256 S257 L259 T286 L287	M220-E283 WeakPolarHBondContact CB-OE2 3.39Å; M220-E283 HydrophobicContact CG-CG 4.2Å; M220-E283 VanDerWaalsContact CG-OE2 3.31Å; M220-E283 WeakPolarHBondContact CG-OE2 3.41Å; M220-E283 HydrophobicContact SD-CG 4.19Å; R223-E283 IonicContact CZ-OE1 2.54Å; R223-E283 IonicContact NE-OE1 2.82Å; R223-E283 IonicContact NH2-OE1 3.41Å; R223-E283 PolarHBondContact NH2-OE1 2.85Å; R223-E283 IonicContact NH2-OE2 3.69Å; R223-E283 PolarHBondContact NH2-OE2 2.62Å; W256-E283 WeakPolarHBondContact CA-OE1 3.02Å; W256-E283 HydrophobicContact CB-CB 4.38Å; W256-E283 HydrophobicContact CE3-CG 3.86Å; W256-E283 HydrophobicContact CZ3-CG 4.48Å; S257-E283 PolarHBondContact N-OE1 2.69Å; S257-E283 VanDerWaalsContact N-OE1 3.16Å; S257-E283 WeakPolarHBondContact O-CB 3.14Å; S257-E283 PolarHBondContact O-N 2.77Å; L259-E283 HydrophobicContact CD1-CB 4.04Å; L259-E283 HydrophobicContact CD1-CG 4.04Å; L259-E283 HydrophobicContact CD2-CB 4.28Å; L259-E283 HydrophobicContact CD2-CG 4.17Å; L259-E283 HydrophobicContact CG-CB 3.83Å; L259-E283 HydrophobicContact CG-CG 4.11Å; E283-T286 PolarHBondContact O-N 3.14Å; E283-L287 HydrophobicContact CG-CD1 4.1Å; E283-L287 WeakPolarHBondContact O-CG 3.37Å; E283-L287 PolarHBondContact O-N 3.1Å
284	L	97.6	Very high	96.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-46.3	-179.9	177.7	55.9	0	0	0	111.7	W256 D282 T286 L287 R288 V293 F294 R328 L330	W256-L284 HydrophobicContact CB-CB 3.83Å; W256-L284 HydrophobicContact CD2-CB 4.18Å; W256-L284 HydrophobicContact CD2-CD1 4.36Å; W256-L284 HydrophobicContact CG-CB 3.64Å; W256-L284 HydrophobicContact CG-CD1 4.41Å; W256-L284 HydrophobicContact CG-CD2 4.38Å; W256-L284 HydrophobicContact CG-CG 4.34Å; W256-L284 HydrophobicContact CZ2-CD1 4.5Å; D282-L284 PolarHBondContact O-N 2.99Å; L284-T286 VanDerWaalsContact C-N 3.27Å; L284-T286 PolarHBondContact O-N 3.12Å; L284-L287 PolarHBondContact O-N 3.45Å; L284-R288 HydrophobicContact CD1-CG 3.94Å; L284-R288 HydrophobicContact CG-CG 4.36Å; L284-R288 WeakPolarHBondContact O-CB 3.33Å; L284-R288 VanDerWaalsContact O-CG 3.31Å; L284-R288 WeakPolarHBondContact O-CG 3.32Å; L284-R288 PolarHBondContact O-N 2.84Å; L284-V293 HydrophobicContact CD1-CG2 3.77Å; L284-F294 HydrophobicContact CD1-CD2 3.71Å; L284-F294 HydrophobicContact CD1-CE2 4.2Å; L284-R328 HydrophobicContact CD2-CB 4.37Å; L284-R328 HydrophobicContact CD2-CG 3.89Å; L284-R328 VanDerWaalsContact CD2-CZ 3.49Å; L284-L330 HydrophobicContact CD2-CD1 4.16Å; L284-L330 HydrophobicContact CD2-CD2 4.43Å
285	T	96.9	Very high	96.5	Very high	23 Å²	23	45 Å²	45	14%	0.141	27%	0.268	C	S	.	.	H	α-helix	trans	-54.9	-46	175.7	-60	0	0	0	0	111.1	M279 D282 R288 N289	M279-T285 HydrophobicContact CB-CG2 4.5Å; D282-T285 PolarHBondContact O-N 2.81Å; D282-T285 WeakPolarHBondContact OD2-CB 3.47Å; D282-T285 PolarHBondContact OD2-N 2.67Å; D282-T285 PolarHBondContact OD2-OG1 3.38Å; T285-R288 PolarHBondContact O-N 2.81Å; T285-N289 WeakPolarHBondContact O-CB 3.41Å; T285-N289 PolarHBondContact O-N 3.18Å; T285-N289 PolarHBondContact O-ND2 3.31Å
286	T	96.2	Very high	96.2	Very high	60 Å²	60	49.5 Å²	49.5	37%	0.368	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-49.4	178.1	-59.3	0	0	0	0	111.7	L259 D282 E283 L284 R288 N289 A290	L259-T286 HydrophobicContact CD1-CG2 4.37Å; D282-T286 WeakPolarHBondContact O-CB 3.31Å; D282-T286 PolarHBondContact O-N 3.11Å; D282-T286 PolarHBondContact O-OG1 3.11Å; E283-T286 PolarHBondContact O-N 3.14Å; L284-T286 VanDerWaalsContact C-N 3.27Å; L284-T286 PolarHBondContact O-N 3.12Å; T286-R288 VanDerWaalsContact C-N 3.34Å; T286-R288 PolarHBondContact O-N 2.83Å; T286-N289 PolarHBondContact O-N 2.81Å; T286-A290 WeakPolarHBondContact O-CB 3.3Å; T286-A290 PolarHBondContact O-N 2.93Å
287	L	96.6	Very high	96.3	Very high	22 Å²	22	46.4 Å²	46.4	12%	0.115	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-32.4	-179.6	-67.8	169.5	0	0	0	112.8	M220 V224 W256 E283 L284 A290 G291 A292 V293	M220-L287 HydrophobicContact CG-CD1 4.05Å; M220-L287 HydrophobicContact SD-CD1 4.26Å; M220-L287 HydrophobicContact SD-CD2 4.32Å; V224-L287 HydrophobicContact CG2-CD1 4.2Å; W256-L287 HydrophobicContact CE3-CD1 3.93Å; W256-L287 HydrophobicContact CH2-CD1 3.97Å; W256-L287 HydrophobicContact CZ3-CD1 3.38Å; E283-L287 HydrophobicContact CG-CD1 4.1Å; E283-L287 WeakPolarHBondContact O-CG 3.37Å; E283-L287 PolarHBondContact O-N 3.1Å; L284-L287 PolarHBondContact O-N 3.45Å; L287-A290 PolarHBondContact O-N 2.85Å; L287-G291 PolarHBondContact O-N 2.85Å; L287-A292 HydrophobicContact CB-CB 4.39Å; L287-A292 HydrophobicContact CD2-CB 4.16Å; L287-A292 PolarHBondContact O-N 2.63Å; L287-V293 HydrophobicContact CB-CG2 3.61Å; L287-V293 HydrophobicContact CD1-CG2 4.43Å
288	R	97.2	Very high	96.2	Very high	49 Å²	49	43.7 Å²	43.7	19%	0.185	26%	0.259	C	S	.	.	H	α-helix	trans	-66.4	-46.5	173.4	-78.6	177.2	69	-147.5	-2.8	111.8	L284 T285 T286 A290 G291 V293 F294 Y297 E299	L284-R288 HydrophobicContact CD1-CG 3.94Å; L284-R288 HydrophobicContact CG-CG 4.36Å; L284-R288 WeakPolarHBondContact O-CB 3.33Å; L284-R288 VanDerWaalsContact O-CG 3.31Å; L284-R288 WeakPolarHBondContact O-CG 3.32Å; L284-R288 PolarHBondContact O-N 2.84Å; T285-R288 PolarHBondContact O-N 2.81Å; T286-R288 VanDerWaalsContact C-N 3.34Å; T286-R288 PolarHBondContact O-N 2.83Å; R288-A290 PolarHBondContact O-N 3.1Å; R288-G291 WeakPolarHBondContact O-CA 3.25Å; R288-G291 PolarHBondContact O-N 3.32Å; R288-V293 WeakPolarHBondContact CA-O 3.48Å; R288-V293 HydrophobicContact CG-CG2 4.38Å; R288-V293 WeakPolarHBondContact CG-O 3.24Å; R288-F294 HydrophobicContact CG-CB 3.84Å; R288-Y297 PolarHBondContact NH2-O 2.95Å; R288-E299 VanDerWaalsContact NH1-CB 3.27Å; R288-E299 IonicContact NH1-OE2 3.78Å; R288-E299 PolarHBondContact NH1-OE2 3.3Å; R288-E299 VanDerWaalsContact NH1-OE2 3.16Å
289	N	95	Very high	96.2	Very high	136 Å²	136	45.1 Å²	45.1	73%	0.727	27%	0.266	S	S	*	.	H	α-helix	trans	-62.9	-32.4	176.9	-68.1	-17.1	0	0	0	111.8	T285 T286 G291	T285-N289 WeakPolarHBondContact O-CB 3.41Å; T285-N289 PolarHBondContact O-N 3.18Å; T285-N289 PolarHBondContact O-ND2 3.31Å; T286-N289 PolarHBondContact O-N 2.81Å; N289-G291 VanDerWaalsContact C-N 3.26Å; N289-G291 PolarHBondContact O-N 2.55Å
290	A	96.1	Very high	96.1	Very high	79 Å²	79	44.3 Å²	44.3	65%	0.653	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-4.8	172.5	0	0	0	0	0	114.1	T286 L287 R288 A292	T286-A290 WeakPolarHBondContact O-CB 3.3Å; T286-A290 PolarHBondContact O-N 2.93Å; L287-A290 PolarHBondContact O-N 2.85Å; R288-A290 PolarHBondContact O-N 3.1Å; A290-A292 VanDerWaalsContact C-N 3.26Å; A290-A292 PolarHBondContact O-N 3.02Å
291	G	95.3	Very high	96.1	Very high	45 Å²	45	47.2 Å²	47.2	46%	0.464	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	13.4	-177.6	0	0	0	0	0	114.9	L287 R288 N289	L287-G291 PolarHBondContact O-N 2.85Å; R288-G291 WeakPolarHBondContact O-CA 3.25Å; R288-G291 PolarHBondContact O-N 3.32Å; N289-G291 VanDerWaalsContact C-N 3.26Å; N289-G291 PolarHBondContact O-N 2.55Å
292	A	95.6	Very high	96.1	Very high	39 Å²	39	46 Å²	46	32%	0.322	27%	0.269	S	S	.	.	S	Bend	trans	-78.9	-33.8	-174	0	0	0	0	0	113.3	L287 A290	L287-A292 HydrophobicContact CB-CB 4.39Å; L287-A292 HydrophobicContact CD2-CB 4.16Å; L287-A292 PolarHBondContact O-N 2.63Å; A290-A292 VanDerWaalsContact C-N 3.26Å; A290-A292 PolarHBondContact O-N 3.02Å
293	V	96.8	Very high	96.1	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.012	29%	0.293	C	S	.	.	S	Bend	trans	-142.1	149.7	177.8	-60.3	0	0	0	0	109.3	V224 F227 W256 L284 L287 R288 A295	V224-V293 HydrophobicContact CB-CG1 4.14Å; V224-V293 HydrophobicContact CG1-CG1 3.96Å; V224-V293 HydrophobicContact CG2-CG1 3.78Å; F227-V293 HydrophobicContact CB-CG1 4.38Å; F227-V293 HydrophobicContact CD1-CB 3.8Å; F227-V293 HydrophobicContact CD1-CG1 3.68Å; F227-V293 HydrophobicContact CE1-CB 4.04Å; F227-V293 HydrophobicContact CE1-CG1 4.3Å; F227-V293 HydrophobicContact CG-CB 4.16Å; F227-V293 HydrophobicContact CG-CG1 4.14Å; W256-V293 HydrophobicContact CH2-CG1 4.42Å; L284-V293 HydrophobicContact CD1-CG2 3.77Å; L287-V293 HydrophobicContact CB-CG2 3.61Å; L287-V293 HydrophobicContact CD1-CG2 4.43Å; R288-V293 WeakPolarHBondContact CA-O 3.48Å; R288-V293 HydrophobicContact CG-CG2 4.38Å; R288-V293 WeakPolarHBondContact CG-O 3.24Å; V293-A295 PolarHBondContact O-N 3.06Å
294	F	96.7	Very high	96.1	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.009	30%	0.295	C	S	.	.	S	Bend	trans	50.2	29	172.9	-62.2	-78.1	0	0	0	115.2	F227 W250 M254 L284 R288 E296 Y297 L330	F227-F294 HydrophobicContact CD2-CD1 4.05Å; F227-F294 AromaticContact CD2-CD2 3.9Å; F227-F294 HydrophobicContact CD2-CD2 3.9Å; F227-F294 AromaticContact CD2-CE1 3.67Å; F227-F294 HydrophobicContact CD2-CE1 3.67Å; F227-F294 AromaticContact CD2-CE2 3.51Å; F227-F294 HydrophobicContact CD2-CE2 3.51Å; F227-F294 HydrophobicContact CD2-CG 4.15Å; F227-F294 AromaticContact CD2-CZ 3.39Å; F227-F294 HydrophobicContact CD2-CZ 3.39Å; F227-F294 AromaticContact CE2-CD1 3.52Å; F227-F294 HydrophobicContact CE2-CD1 3.52Å; F227-F294 AromaticContact CE2-CD2 3.96Å; F227-F294 HydrophobicContact CE2-CD2 3.96Å; F227-F294 AromaticContact CE2-CE1 3.54Å; F227-F294 HydrophobicContact CE2-CE1 3.54Å; F227-F294 AromaticContact CE2-CE2 3.98Å; F227-F294 HydrophobicContact CE2-CE2 3.98Å; F227-F294 AromaticContact CE2-CG 3.75Å; F227-F294 HydrophobicContact CE2-CG 3.75Å; F227-F294 AromaticContact CE2-CZ 3.78Å; F227-F294 HydrophobicContact CE2-CZ 3.78Å; F227-F294 HydrophobicContact CG-CE2 4.18Å; F227-F294 HydrophobicContact CG-CZ 4.42Å; F227-F294 HydrophobicContact CZ-CD1 4.38Å; F227-F294 HydrophobicContact CZ-CG 4.34Å; W250-F294 HydrophobicContact CB-CE1 4.09Å; W250-F294 AromaticContact CD2-CE1 3.48Å; W250-F294 HydrophobicContact CD2-CE1 3.48Å; W250-F294 VanDerWaalsContact CD2-CE1 3.48Å; W250-F294 AromaticContact CD2-CZ 3.9Å; W250-F294 HydrophobicContact CD2-CZ 3.9Å; W250-F294 AromaticContact CE2-CE1 3.89Å; W250-F294 AromaticContact CE2-CZ 3.79Å; W250-F294 AromaticContact CE3-CE1 3.69Å; W250-F294 HydrophobicContact CE3-CE1 3.69Å; W250-F294 HydrophobicContact CE3-CZ 4.36Å; W250-F294 AromaticContact CG-CE1 3.68Å; W250-F294 HydrophobicContact CG-CE1 3.68Å; W250-F294 HydrophobicContact CG-CZ 4.16Å; W250-F294 HydrophobicContact CZ2-CE1 4.42Å; W250-F294 HydrophobicContact CZ2-CZ 4.16Å; W250-F294 HydrophobicContact CZ3-CE1 4.24Å; M254-F294 HydrophobicContact CE-CZ 4.47Å; M254-F294 HydrophobicContact SD-CE2 4.08Å; M254-F294 HydrophobicContact SD-CZ 3.79Å; L284-F294 HydrophobicContact CD1-CD2 3.71Å; L284-F294 HydrophobicContact CD1-CE2 4.2Å; R288-F294 HydrophobicContact CG-CB 3.84Å; F294-E296 PolarHBondContact O-N 2.9Å; F294-Y297 HydrophobicContact CB-CD2 4.21Å; F294-Y297 HydrophobicContact CB-CG 4.41Å; F294-Y297 HydrophobicContact CD1-CD1 4.31Å; F294-Y297 AromaticContact CD1-CD2 3.82Å; F294-Y297 HydrophobicContact CD1-CD2 3.82Å; F294-Y297 HydrophobicContact CD1-CE2 4.16Å; F294-Y297 AromaticContact CD1-CG 3.91Å; F294-Y297 HydrophobicContact CD1-CG 3.91Å; F294-Y297 PolarHBondContact O-N 3.23Å; F294-L330 HydrophobicContact CB-CD2 3.91Å; F294-L330 HydrophobicContact CD1-CD2 4.13Å; F294-L330 HydrophobicContact CG-CD2 3.97Å
295	A	92.8	Very high	96.1	Very high	68 Å²	68	51.6 Å²	51.6	56%	0.562	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-33.3	-176.3	0	0	0	0	0	112.8	V293 Y297	V293-A295 PolarHBondContact O-N 3.06Å; A295-Y297 VanDerWaalsContact C-N 3.31Å
296	E	91.8	Very high	96.1	Very high	127 Å²	127	50.5 Å²	50.5	59%	0.593	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	1.2	178	-61.8	176	-163.5	0	0	113.3	F294 R332	F294-E296 PolarHBondContact O-N 2.9Å; E296-R332 WeakPolarHBondContact O-CB 3.22Å
297	Y	96.8	Very high	96.1	Very high	16 Å²	16	47.7 Å²	47.7	6%	0.063	28%	0.28	C	S	.	.			trans	-106.3	140.6	-177.2	-65.9	-108.8	0	0	0	110.9	V248 W250 R288 F294 A295 L330 F331 R332	V248-Y297 HydrophobicContact CB-CE1 4.09Å; V248-Y297 HydrophobicContact CG1-CE1 3.86Å; W250-Y297 HydrophobicContact CB-CE1 4.17Å; W250-Y297 HydrophobicContact CE3-CE1 4.5Å; R288-Y297 PolarHBondContact NH2-O 2.95Å; F294-Y297 HydrophobicContact CB-CD2 4.21Å; F294-Y297 HydrophobicContact CB-CG 4.41Å; F294-Y297 HydrophobicContact CD1-CD1 4.31Å; F294-Y297 AromaticContact CD1-CD2 3.82Å; F294-Y297 HydrophobicContact CD1-CD2 3.82Å; F294-Y297 HydrophobicContact CD1-CE2 4.16Å; F294-Y297 AromaticContact CD1-CG 3.91Å; F294-Y297 HydrophobicContact CD1-CG 3.91Å; F294-Y297 PolarHBondContact O-N 3.23Å; A295-Y297 VanDerWaalsContact C-N 3.31Å; Y297-L330 HydrophobicContact CD1-CB 4.28Å; Y297-F331 CarbonylContact C-O 3.5Å; Y297-F331 WeakPolarHBondContact CA-O 3.39Å; Y297-R332 HydrophobicContact CD1-CB 4.18Å; Y297-R332 HydrophobicContact CD1-CG 4.04Å; Y297-R332 HydrophobicContact CE1-CG 3.92Å; Y297-R332 HydrophobicContact CG-CB 4.35Å; Y297-R332 HydrophobicContact CG-CG 4.43Å
298	E	96.5	Very high	96.1	Very high	93 Å²	93	48.8 Å²	48.8	44%	0.435	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	156.5	167.4	-71	179.7	-143.2	0	0	110.7	R44 L330 F331	R44-E298 IonicContact NH2-OE2 3.45Å; R44-E298 PolarHBondContact NH2-OE2 3.08Å; E298-L330 CarbonylContact O-C 3.35Å; E298-L330 WeakPolarHBondContact O-CA 3.3Å; E298-F331 HydrophobicContact CB-CD2 4.04Å; E298-F331 HydrophobicContact CB-CE1 4.33Å; E298-F331 HydrophobicContact CB-CE2 3.52Å; E298-F331 HydrophobicContact CB-CZ 3.69Å; E298-F331 HydrophobicContact CG-CE2 4.38Å; E298-F331 PolarHBondContact N-O 3.1Å; E298-F331 PolarHBondContact O-N 3.01Å
299	E	97.6	Very high	96	Very high	31 Å²	31	49.4 Å²	49.4	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139	168.1	-174.2	177.8	-165.7	0	0	107.7	R288 R328 L330 Y352	R288-E299 VanDerWaalsContact NH1-CB 3.27Å; R288-E299 IonicContact NH1-OE2 3.78Å; R288-E299 PolarHBondContact NH1-OE2 3.3Å; R288-E299 VanDerWaalsContact NH1-OE2 3.16Å; E299-R328 IonicContact OE1-CZ 3.01Å; E299-R328 IonicContact OE1-NE 3.15Å; E299-R328 PolarHBondContact OE1-NE 2.9Å; E299-R328 IonicContact OE1-NH2 3.48Å; E299-R328 IonicContact OE2-CZ 3.16Å; E299-R328 IonicContact OE2-NE 2.73Å; E299-R328 PolarHBondContact OE2-NE 3.1Å; E299-R328 IonicContact OE2-NH2 3.69Å; E299-R328 PolarHBondContact OE2-NH2 3.42Å; E299-L330 HydrophobicContact CB-CD2 4.43Å; E299-L330 HydrophobicContact CB-CG 4.28Å; E299-L330 HydrophobicContact CG-CG 4.49Å; E299-Y352 HydrophobicContact CG-CE1 3.83Å; E299-Y352 PolarHBondContact OE1-OH 2.81Å
300	A	95.8	Very high	96.1	Very high	9 Å²	9	43.1 Å²	43.1	7%	0.074	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-64.3	149.7	175.2	0	0	0	0	0	110.9	I302 N349 Y352	A300-I302 PolarHBondContact O-N 3.21Å; A300-I302 VanDerWaalsContact O-N 3.13Å; A300-N349 HydrophobicContact CB-CB 4.06Å; A300-N349 WeakPolarHBondContact CB-ND2 3.29Å; A300-Y352 HydrophobicContact CB-CD1 3.51Å; A300-Y352 HydrophobicContact CB-CE1 4.29Å; A300-Y352 HydrophobicContact CB-CG 3.83Å; A300-Y352 WeakPolarHBondContact O-CD1 3.15Å; A300-Y352 WeakPolarHBondContact O-CE1 3.34Å
301	Q	96.2	Very high	96	Very high	149 Å²	149	42.4 Å²	42.4	70%	0.696	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-55.8	121.9	179.5	-175.7	-179.3	4.7	0	0	111.2	S303	Q301-S303 PolarHBondContact O-N 2.6Å
302	I	97.6	Very high	95.9	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.056	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-71.7	117.6	175.2	-67.3	175.6	0	0	0	108.6	F275 M279 A300 F304 Y325 Y352	F275-I302 WeakPolarHBondContact CB-O 3.16Å; M279-I302 HydrophobicContact CE-CD1 4.32Å; M279-I302 HydrophobicContact CE-CG2 4.24Å; M279-I302 HydrophobicContact SD-CB 4.05Å; M279-I302 HydrophobicContact SD-CD1 3.62Å; M279-I302 HydrophobicContact SD-CG1 4.31Å; M279-I302 HydrophobicContact SD-CG2 4.37Å; A300-I302 PolarHBondContact O-N 3.21Å; A300-I302 VanDerWaalsContact O-N 3.13Å; I302-F304 HydrophobicContact CB-CE1 4.46Å; I302-F304 HydrophobicContact CB-CZ 4.42Å; I302-F304 HydrophobicContact CG1-CE1 4.28Å; I302-F304 HydrophobicContact CG1-CZ 3.97Å; I302-F304 HydrophobicContact CG2-CD1 4.38Å; I302-F304 HydrophobicContact CG2-CD2 4.21Å; I302-F304 HydrophobicContact CG2-CE1 4.21Å; I302-F304 HydrophobicContact CG2-CE2 4.01Å; I302-F304 HydrophobicContact CG2-CG 4.38Å; I302-F304 HydrophobicContact CG2-CZ 4Å; I302-Y325 HydrophobicContact CD1-CD1 4.33Å; I302-Y325 HydrophobicContact CG2-CD1 4.02Å; I302-Y325 HydrophobicContact CG2-CE1 3.48Å; I302-Y325 VanDerWaalsContact CG2-CE1 3.48Å; I302-Y352 HydrophobicContact CG1-CD1 4.48Å; I302-Y352 HydrophobicContact CG1-CE1 3.82Å
303	S	96.5	Very high	95.6	Very high	73 Å²	73	44.8 Å²	44.8	51%	0.51	25%	0.252	S	S	.	.			trans	-128.6	25.8	179.1	53.2	0	0	0	0	111.7	F275 Q301	F275-S303 VanDerWaalsContact CE2-C 3.46Å; F275-S303 WeakPolarHBondContact CE2-O 3.39Å; Q301-S303 PolarHBondContact O-N 2.6Å
304	F	97.3	Very high	95.3	Very high	14 Å²	14	45.9 Å²	45.9	6%	0.061	26%	0.258	C	S	.	.	S	Bend	trans	-132.1	163.7	-176.6	52.8	-98.2	0	0	0	111.9	F275 I302 T307 Y325 Y352 T354 L366	F275-F304 VanDerWaalsContact CD1-O 3.27Å; F275-F304 WeakPolarHBondContact CD1-O 3.43Å; F275-F304 WeakPolarHBondContact CE1-O 3.48Å; I302-F304 HydrophobicContact CB-CE1 4.46Å; I302-F304 HydrophobicContact CB-CZ 4.42Å; I302-F304 HydrophobicContact CG1-CE1 4.28Å; I302-F304 HydrophobicContact CG1-CZ 3.97Å; I302-F304 HydrophobicContact CG2-CD1 4.38Å; I302-F304 HydrophobicContact CG2-CD2 4.21Å; I302-F304 HydrophobicContact CG2-CE1 4.21Å; I302-F304 HydrophobicContact CG2-CE2 4.01Å; I302-F304 HydrophobicContact CG2-CG 4.38Å; I302-F304 HydrophobicContact CG2-CZ 4Å; F304-T307 HydrophobicContact CE2-CG2 4.13Å; F304-Y325 HydrophobicContact CD2-CD1 4.44Å; F304-Y325 HydrophobicContact CD2-CE1 4.09Å; F304-Y325 AromaticContact CE2-CD1 3.99Å; F304-Y325 HydrophobicContact CE2-CD1 3.99Å; F304-Y325 HydrophobicContact CE2-CE1 4.05Å; F304-Y325 VanDerWaalsContact O-CE1 3.31Å; F304-Y325 WeakPolarHBondContact O-CE1 3.48Å; F304-Y325 PolarHBondContact O-OH 3.04Å; F304-Y352 WeakPolarHBondContact CD1-O 3.45Å; F304-Y352 AromaticContact CE1-CD1 3.64Å; F304-Y352 HydrophobicContact CE1-CD1 3.64Å; F304-Y352 HydrophobicContact CE1-CD2 4.25Å; F304-Y352 AromaticContact CE1-CE1 3.82Å; F304-Y352 HydrophobicContact CE1-CE1 3.82Å; F304-Y352 HydrophobicContact CE1-CE2 4.37Å; F304-Y352 AromaticContact CE1-CG 3.89Å; F304-Y352 HydrophobicContact CE1-CG 3.89Å; F304-Y352 HydrophobicContact CZ-CD1 4.18Å; F304-Y352 AromaticContact CZ-CE1 3.86Å; F304-Y352 HydrophobicContact CZ-CE1 3.86Å; F304-Y352 HydrophobicContact CZ-CE2 4.28Å; F304-Y352 AromaticContact CZ-CZ 3.92Å; F304-T354 HydrophobicContact CB-CG2 3.81Å; F304-T354 HydrophobicContact CD2-CG2 4.06Å; F304-T354 HydrophobicContact CG-CG2 4.18Å; F304-L366 HydrophobicContact CE1-CD1 3.93Å; F304-L366 HydrophobicContact CE2-CD1 3.79Å; F304-L366 HydrophobicContact CZ-CD1 3.41Å; F304-L366 VanDerWaalsContact CZ-CD1 3.41Å
305	L	96.8	Very high	94.9	Very high	36 Å²	36	50 Å²	50	19%	0.188	29%	0.285	C	S	.	.			trans	-67	157	178.4	-66.9	172.7	0	0	0	111.5	I270 F275 M356	I270-L305 HydrophobicContact CG2-CD2 3.84Å; F275-L305 HydrophobicContact CE1-CD2 4.19Å; L305-M356 HydrophobicContact CB-SD 4.3Å; L305-M356 HydrophobicContact CD1-CE 4.09Å; L305-M356 HydrophobicContact CD1-SD 4.41Å
306	P	96.9	Very high	94.9	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.291	C	S	.	.			trans	-47	143	175	-29.6	36.1	0	0	0	112.8	I270 Y308 Y310 P323 A324 Y325	I270-P306 HydrophobicContact CD1-CG 3.78Å; I270-P306 HydrophobicContact CG1-CG 4Å; P306-Y308 VanDerWaalsContact C-N 3.32Å; P306-Y310 WeakPolarHBondContact O-CE2 3.29Å; P306-Y310 VanDerWaalsContact O-CZ 3.3Å; P306-Y310 PolarHBondContact O-OH 3.46Å; P306-P323 HydrophobicContact CB-CB 3.86Å; P306-P323 HydrophobicContact CG-CB 3.97Å; P306-A324 WeakPolarHBondContact CB-O 3.21Å; P306-Y325 HydrophobicContact CB-CE2 4.38Å; P306-Y325 HydrophobicContact CG-CE1 4.5Å; P306-Y325 HydrophobicContact CG-CE2 3.9Å
307	T	97	Very high	95	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.	S	Bend	trans	-82.2	-15.7	-178.9	46.7	0	0	0	0	112.6	F304 A324 C326 D327 H363 K364	F304-T307 HydrophobicContact CE2-CG2 4.13Å; T307-A324 PolarHBondContact N-O 3.43Å; T307-A324 VanDerWaalsContact N-O 3.17Å; T307-C326 PolarHBondContact OG1-N 3.09Å; T307-D327 WeakPolarHBondContact CB-OD2 3.25Å; T307-D327 HydrophobicContact CG2-CB 4.16Å; T307-D327 PolarHBondContact OG1-N 2.99Å; T307-D327 PolarHBondContact OG1-OD2 2.94Å; T307-H363 CarbonylContact O-C 3.04Å; T307-H363 VanDerWaalsContact O-CA 3.25Å; T307-H363 WeakPolarHBondContact O-CA 3.27Å; T307-K364 PolarHBondContact O-N 3.32Å
308	Y	96.8	Very high	94.9	Very high	45 Å²	45	51.5 Å²	51.5	18%	0.176	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-142.2	152.7	179	174.3	-103	0	0	0	109.5	P306 P323 A324 C326 H363	P306-Y308 VanDerWaalsContact C-N 3.32Å; Y308-P323 CarbonylContact O-C 3.59Å; Y308-P323 WeakPolarHBondContact O-CA 3.38Å; Y308-P323 WeakPolarHBondContact O-CB 3.05Å; Y308-A324 PolarHBondContact N-O 2.86Å; Y308-A324 PolarHBondContact O-N 3.35Å; Y308-A324 VanDerWaalsContact O-O 3.08Å; Y308-C326 VanDerWaalsContact CD1-SG 3.59Å; Y308-H363 AromaticContact CD2-CD2 3.73Å; Y308-H363 AromaticContact CD2-CE1 3.46Å; Y308-H363 VanDerWaalsContact CD2-CE1 3.46Å; Y308-H363 WeakPolarHBondContact CD2-CE1 3.23Å; Y308-H363 AromaticContact CD2-ND1 3.98Å; Y308-H363 AromaticContact CD2-NE2 3.28Å; Y308-H363 VanDerWaalsContact CD2-NE2 3.28Å; Y308-H363 WeakPolarHBondContact CD2-NE2 3.46Å; Y308-H363 AromaticContact CE2-NE2 3.7Å; Y308-H363 AromaticContact CG-CE1 3.82Å
309	R	94.7	Very high	94.5	Very high	63 Å²	63	50.7 Å²	50.7	24%	0.238	28%	0.277	C	S	.	.			cis	-108.5	141.1	-9.1	-171.4	178.4	177.6	143.4	-6.4	110.2	D318 N362	R309-D318 HydrophobicContact CB-CB 4.36Å; R309-D318 HydrophobicContact CG-CB 4.06Å; R309-D318 IonicContact NE-OD2 2.7Å; R309-D318 PolarHBondContact NE-OD2 2.97Å; R309-D318 PolarHBondContact O-N 2.95Å; R309-N362 HydrophobicContact CG-CB 4.01Å
310	Y	95.8	Very high	94.1	Very high	3 Å²	3	53.7 Å²	53.7	1%	0.012	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-116.1	152.4	176.6	-65.9	-93.6	0	0	0	111.8	P306 V312 P315 R316 L317 M356 N362 K364	P306-Y310 WeakPolarHBondContact O-CE2 3.29Å; P306-Y310 VanDerWaalsContact O-CZ 3.3Å; P306-Y310 PolarHBondContact O-OH 3.46Å; Y310-V312 PolarHBondContact O-N 3.28Å; Y310-P315 WeakPolarHBondContact CD1-O 3.34Å; Y310-P315 WeakPolarHBondContact CE1-O 3.44Å; Y310-R316 WeakPolarHBondContact CA-O 3.24Å; Y310-R316 WeakPolarHBondContact CD1-O 3.45Å; Y310-L317 HydrophobicContact CD1-CD2 3.96Å; Y310-L317 HydrophobicContact CD1-CG 4.33Å; Y310-L317 HydrophobicContact CD2-CD2 4.44Å; Y310-L317 HydrophobicContact CE1-CD2 3.41Å; Y310-L317 VanDerWaalsContact CE1-CD2 3.41Å; Y310-L317 HydrophobicContact CE1-CG 3.82Å; Y310-L317 HydrophobicContact CE2-CD2 3.96Å; Y310-L317 HydrophobicContact CG-CD2 4.43Å; Y310-L317 VanDerWaalsContact CZ-CD2 3.4Å; Y310-M356 HydrophobicContact CD1-CE 4.21Å; Y310-M356 HydrophobicContact CE1-CE 3.23Å; Y310-M356 HydrophobicContact CE2-CE 4.28Å; Y310-M356 WeakPolarHBondContact OH-CE 3.5Å; Y310-N362 PolarHBondContact N-O 3.19Å; Y310-N362 WeakPolarHBondContact O-CA 3.44Å; Y310-N362 WeakPolarHBondContact O-CB 3.31Å; Y310-K364 HydrophobicContact CD2-CD 4.21Å; Y310-K364 HydrophobicContact CD2-CG 3.73Å; Y310-K364 HydrophobicContact CE2-CD 4.41Å; Y310-K364 HydrophobicContact CE2-CG 3.54Å; Y310-K364 HydrophobicContact CG-CD 4.43Å; Y310-K364 VanDerWaalsContact CG-CE 3.42Å; Y310-K364 HydrophobicContact CG-CG 4.39Å
311	V	95.1	Very high	93.8	Very high	64 Å²	64	58.6 Å²	58.6	39%	0.388	32%	0.319	S	S	.	.			trans	-70.3	118.3	167.7	179.3	0	0	0	0	108	G313 T314 R316 D318	V311-G313 PolarHBondContact O-N 3.39Å; V311-T314 HydrophobicContact CG1-CG2 4.27Å; V311-T314 PolarHBondContact O-N 2.95Å; V311-T314 PolarHBondContact O-OG1 3.32Å; V311-R316 PolarHBondContact N-O 3.32Å; V311-D318 HydrophobicContact CG2-CB 3.95Å
312	V	93.4	Very high	93.6	Very high	75 Å²	75	53.9 Å²	53.9	46%	0.455	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	137.2	-179.7	-178.7	0	0	0	0	110.4	Y310 T314 N362	Y310-V312 PolarHBondContact O-N 3.28Å; V312-T314 VanDerWaalsContact C-N 3.28Å; V312-N362 HydrophobicContact CG2-CB 4.02Å
313	G	89.8	Confident	93.5	Very high	60 Å²	60	53.4 Å²	53.4	62%	0.619	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	0.7	-174.8	0	0	0	0	0	114	V311 G359	V311-G313 PolarHBondContact O-N 3.39Å; G313-G359 WeakPolarHBondContact CA-O 3.24Å; G313-G359 PolarHBondContact N-O 2.94Å
314	T	89.1	Confident	93.5	Very high	24 Å²	24	50 Å²	50	15%	0.147	27%	0.272	C	S	.	.	S	Bend	trans	-137	159.8	-176.5	85	0	0	0	0	112.7	V311 V312 R316 K364	V311-T314 HydrophobicContact CG1-CG2 4.27Å; V311-T314 PolarHBondContact O-N 2.95Å; V311-T314 PolarHBondContact O-OG1 3.32Å; V312-T314 VanDerWaalsContact C-N 3.28Å; T314-R316 PolarHBondContact O-N 3Å; T314-R316 PolarHBondContact OG1-N 2.87Å; T314-R316 VanDerWaalsContact OG1-N 3.12Å; T314-K364 PolarHBondContact O-NZ 2.83Å; T314-K364 VanDerWaalsContact O-NZ 3.13Å
315	P	88.4	Confident	93.5	Very high	88 Å²	88	49.3 Å²	49.3	57%	0.571	27%	0.269	S	S	*	.	S	Bend	trans	-83.7	5.6	168.6	34.7	-35.8	0	0	0	112.8	Y310	Y310-P315 WeakPolarHBondContact CD1-O 3.34Å; Y310-P315 WeakPolarHBondContact CE1-O 3.44Å
316	R	93	Very high	93.5	Very high	181 Å²	181	47.9 Å²	47.9	68%	0.683	26%	0.261	S	S	*	.	S	Bend	trans	-85.7	134.6	-174.8	-68.6	-179.7	-93.4	-176.6	-7.4	110.6	Y310 V311 T314	Y310-R316 WeakPolarHBondContact CA-O 3.24Å; Y310-R316 WeakPolarHBondContact CD1-O 3.45Å; V311-R316 PolarHBondContact N-O 3.32Å; T314-R316 PolarHBondContact O-N 3Å; T314-R316 PolarHBondContact OG1-N 2.87Å; T314-R316 VanDerWaalsContact OG1-N 3.12Å
317	L	94.2	Very high	93.6	Very high	36 Å²	36	47.9 Å²	47.9	19%	0.188	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-60.7	138.7	172.4	-71.7	167.5	0	0	0	110	L267 I270 Y310 V319 P323	L267-L317 HydrophobicContact CD2-CD1 4.43Å; I270-L317 HydrophobicContact CD1-CD1 4.33Å; I270-L317 HydrophobicContact CG2-CD1 3.8Å; Y310-L317 HydrophobicContact CD1-CD2 3.96Å; Y310-L317 HydrophobicContact CD1-CG 4.33Å; Y310-L317 HydrophobicContact CD2-CD2 4.44Å; Y310-L317 HydrophobicContact CE1-CD2 3.41Å; Y310-L317 VanDerWaalsContact CE1-CD2 3.41Å; Y310-L317 HydrophobicContact CE1-CG 3.82Å; Y310-L317 HydrophobicContact CE2-CD2 3.96Å; Y310-L317 HydrophobicContact CG-CD2 4.43Å; Y310-L317 VanDerWaalsContact CZ-CD2 3.4Å; L317-V319 PolarHBondContact O-N 3.29Å; L317-V319 VanDerWaalsContact O-N 3.12Å; L317-P323 HydrophobicContact CD1-CG 4.15Å; L317-P323 HydrophobicContact CD2-CB 3.92Å; L317-P323 HydrophobicContact CD2-CG 3.92Å; L317-P323 HydrophobicContact CG-CG 4.43Å
318	D	94.1	Very high	93.6	Very high	26 Å²	26	47.9 Å²	47.9	14%	0.139	26%	0.261	C	S	.	.			trans	-79.4	92.5	170.3	-174.8	-6.1	0	0	0	108.3	R309 V311 S320 Y321	R309-D318 HydrophobicContact CB-CB 4.36Å; R309-D318 HydrophobicContact CG-CB 4.06Å; R309-D318 IonicContact NE-OD2 2.7Å; R309-D318 PolarHBondContact NE-OD2 2.97Å; R309-D318 PolarHBondContact O-N 2.95Å; V311-D318 HydrophobicContact CG2-CB 3.95Å; D318-S320 PolarHBondContact O-N 3.2Å; D318-S320 VanDerWaalsContact OD1-CB 3.29Å; D318-S320 WeakPolarHBondContact OD1-CB 3.24Å; D318-S320 PolarHBondContact OD1-N 3.29Å; D318-S320 PolarHBondContact OD1-OG 3.23Å; D318-Y321 HydrophobicContact CB-CD2 4.49Å; D318-Y321 PolarHBondContact O-N 3.47Å; D318-Y321 VanDerWaalsContact O-N 3.12Å; D318-Y321 WeakPolarHBondContact OD2-CD2 3.21Å; D318-Y321 WeakPolarHBondContact OD2-CE2 3.37Å
319	V	88.4	Confident	93.7	Very high	76 Å²	76	45.8 Å²	45.8	46%	0.461	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-0	-179.6	-60.1	0	0	0	0	112.4	K263 L267 L317 Y321	K263-V319 WeakPolarHBondContact CE-O 3.42Å; K263-V319 PolarHBondContact NZ-O 3.44Å; L267-V319 HydrophobicContact CD1-CG1 4.25Å; L267-V319 HydrophobicContact CD2-CG1 4.4Å; L317-V319 PolarHBondContact O-N 3.29Å; L317-V319 VanDerWaalsContact O-N 3.12Å; V319-Y321 PolarHBondContact O-N 3.27Å
320	S	89.8	Confident	93.9	Very high	94 Å²	94	42.8 Å²	42.8	66%	0.657	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.3	169.8	-61	0	0	0	0	112.8	D318	D318-S320 PolarHBondContact O-N 3.2Å; D318-S320 VanDerWaalsContact OD1-CB 3.29Å; D318-S320 WeakPolarHBondContact OD1-CB 3.24Å; D318-S320 PolarHBondContact OD1-N 3.29Å; D318-S320 PolarHBondContact OD1-OG 3.23Å
321	Y	89.4	Confident	94	Very high	113 Å²	113	42.8 Å²	42.8	44%	0.443	24%	0.242	S	C	.	.	S	Bend	trans	-123.8	166.1	-177.1	-60.9	-89.6	0	0	0	111	D318 V319 P323	D318-Y321 HydrophobicContact CB-CD2 4.49Å; D318-Y321 PolarHBondContact O-N 3.47Å; D318-Y321 VanDerWaalsContact O-N 3.12Å; D318-Y321 WeakPolarHBondContact OD2-CD2 3.21Å; D318-Y321 WeakPolarHBondContact OD2-CE2 3.37Å; V319-Y321 PolarHBondContact O-N 3.27Å; Y321-P323 WeakPolarHBondContact O-CD 3.25Å
322	L	91.9	Very high	94	Very high	50 Å²	50	40.3 Å²	40.3	26%	0.262	23%	0.226	S	C	.	.			trans	-79	120.2	168.3	-67.4	174.3	0	0	0	109.2	K263 L266	K263-L322 HydrophobicContact CB-CD2 3.74Å; K263-L322 HydrophobicContact CG-CD2 4.15Å; L266-L322 HydrophobicContact CD2-CB 4.13Å; L266-L322 HydrophobicContact CD2-CD2 3.78Å
323	P	95.1	Very high	94	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.215	C	C	.	.			trans	-64.1	141.5	170.8	-23.1	35.7	0	0	0	111.6	M258 L267 I270 P306 Y308 L317 Y321	M258-P323 WeakPolarHBondContact CG-O 3.47Å; L267-P323 HydrophobicContact CD2-CG 4.31Å; I270-P323 HydrophobicContact CD1-CB 3.85Å; I270-P323 HydrophobicContact CD1-CG 3.96Å; P306-P323 HydrophobicContact CB-CB 3.86Å; P306-P323 HydrophobicContact CG-CB 3.97Å; Y308-P323 CarbonylContact O-C 3.59Å; Y308-P323 WeakPolarHBondContact O-CA 3.38Å; Y308-P323 WeakPolarHBondContact O-CB 3.05Å; L317-P323 HydrophobicContact CD1-CG 4.15Å; L317-P323 HydrophobicContact CD2-CB 3.92Å; L317-P323 HydrophobicContact CD2-CG 3.92Å; L317-P323 HydrophobicContact CG-CG 4.43Å; Y321-P323 WeakPolarHBondContact O-CD 3.25Å
324	A	95.9	Very high	93.8	Very high	2 Å²	2	36.6 Å²	36.6	2%	0.017	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-146.4	165.5	-176.9	0	0	0	0	0	112.7	M258 P306 T307 Y308 C326	M258-A324 HydrophobicContact CG-CB 4.26Å; P306-A324 WeakPolarHBondContact CB-O 3.21Å; T307-A324 PolarHBondContact N-O 3.43Å; T307-A324 VanDerWaalsContact N-O 3.17Å; Y308-A324 PolarHBondContact N-O 2.86Å; Y308-A324 PolarHBondContact O-N 3.35Å; Y308-A324 VanDerWaalsContact O-O 3.08Å; A324-C326 PolarHBondContact O-N 3.15Å
325	Y	97.3	Very high	93.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.224	C	C	.	.			trans	-96	65.2	177.8	-66	-89	0	0	0	110.4	M258 L278 M279 I302 F304 P306 R328	M258-Y325 HydrophobicContact SD-CD2 4.22Å; L278-Y325 HydrophobicContact CB-CE2 4.42Å; M279-Y325 HydrophobicContact CE-CD2 3.58Å; M279-Y325 HydrophobicContact CE-CE1 4.39Å; M279-Y325 HydrophobicContact CE-CE2 3.32Å; M279-Y325 HydrophobicContact CE-CG 4.23Å; I302-Y325 HydrophobicContact CD1-CD1 4.33Å; I302-Y325 HydrophobicContact CG2-CD1 4.02Å; I302-Y325 HydrophobicContact CG2-CE1 3.48Å; I302-Y325 VanDerWaalsContact CG2-CE1 3.48Å; F304-Y325 HydrophobicContact CD2-CD1 4.44Å; F304-Y325 HydrophobicContact CD2-CE1 4.09Å; F304-Y325 AromaticContact CE2-CD1 3.99Å; F304-Y325 HydrophobicContact CE2-CD1 3.99Å; F304-Y325 HydrophobicContact CE2-CE1 4.05Å; F304-Y325 VanDerWaalsContact O-CE1 3.31Å; F304-Y325 WeakPolarHBondContact O-CE1 3.48Å; F304-Y325 PolarHBondContact O-OH 3.04Å; P306-Y325 HydrophobicContact CB-CE2 4.38Å; P306-Y325 HydrophobicContact CG-CE1 4.5Å; P306-Y325 HydrophobicContact CG-CE2 3.9Å; Y325-R328 VanDerWaalsContact O-CD 3.28Å; Y325-R328 WeakPolarHBondContact O-CD 3.23Å; Y325-R328 WeakPolarHBondContact O-CG 3.48Å
326	C	97.1	Very high	92.3	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.034	20%	0.201	C	C	.	.			trans	-72	-39.5	-174.3	-58.6	0	0	0	0	112.6	N253 M254 N255 T307 Y308 A324	N253-C326 WeakPolarHBondContact OD1-CB 3.13Å; M254-C326 PolarHBondContact N-O 2.86Å; N255-C326 PolarHBondContact N-O 2.86Å; T307-C326 PolarHBondContact OG1-N 3.09Å; Y308-C326 VanDerWaalsContact CD1-SG 3.59Å; A324-C326 PolarHBondContact O-N 3.15Å
327	D	98.5	Very high	91.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.7	174.6	-54.3	-92.8	0	0	0	110.2	T72 G252 T307 H363 L366	T72-D327 HydrophobicContact CG2-CB 4.32Å; G252-D327 WeakPolarHBondContact O-CA 3.38Å; T307-D327 WeakPolarHBondContact CB-OD2 3.25Å; T307-D327 HydrophobicContact CG2-CB 4.16Å; T307-D327 PolarHBondContact OG1-N 2.99Å; T307-D327 PolarHBondContact OG1-OD2 2.94Å; D327-H363 IonicContact OD1-ND1 3.81Å; D327-H363 IonicContact OD2-CE1 3.75Å; D327-H363 IonicContact OD2-CG 3.34Å; D327-H363 IonicContact OD2-ND1 3.98Å; D327-H363 PolarHBondContact OD2-ND1 3.25Å; D327-L366 VanDerWaalsContact C-CD2 3.47Å; D327-L366 HydrophobicContact CB-CB 4.32Å; D327-L366 HydrophobicContact CB-CD2 4.19Å; D327-L366 WeakPolarHBondContact O-CD2 3.44Å
328	R	98.5	Very high	90.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	153.6	-175	-56.9	-67.8	-82.2	-94.5	4.7	111.8	F251 G252 M254 D282 L284 E299 Y325 L330	F251-R328 WeakPolarHBondContact CA-O 3.41Å; F251-R328 WeakPolarHBondContact CB-O 3.49Å; G252-R328 PolarHBondContact N-O 3.14Å; G252-R328 PolarHBondContact O-N 3.13Å; G252-R328 VanDerWaalsContact O-N 3.13Å; M254-R328 HydrophobicContact CE-CB 4.16Å; M254-R328 HydrophobicContact SD-CB 4.37Å; D282-R328 VanDerWaalsContact CG-NH1 3.31Å; D282-R328 IonicContact OD1-NH1 2.89Å; D282-R328 PolarHBondContact OD1-NH1 3.4Å; D282-R328 IonicContact OD2-CZ 3.32Å; D282-R328 IonicContact OD2-NH1 3.51Å; D282-R328 PolarHBondContact OD2-NH1 3.32Å; D282-R328 IonicContact OD2-NH2 3.16Å; D282-R328 PolarHBondContact OD2-NH2 3.12Å; D282-R328 VanDerWaalsContact OD2-NH2 3.15Å; L284-R328 HydrophobicContact CD2-CB 4.37Å; L284-R328 HydrophobicContact CD2-CG 3.89Å; L284-R328 VanDerWaalsContact CD2-CZ 3.49Å; E299-R328 IonicContact OE1-CZ 3.01Å; E299-R328 IonicContact OE1-NE 3.15Å; E299-R328 PolarHBondContact OE1-NE 2.9Å; E299-R328 IonicContact OE1-NH2 3.48Å; E299-R328 IonicContact OE2-CZ 3.16Å; E299-R328 IonicContact OE2-NE 2.73Å; E299-R328 PolarHBondContact OE2-NE 3.1Å; E299-R328 IonicContact OE2-NH2 3.69Å; E299-R328 PolarHBondContact OE2-NH2 3.42Å; Y325-R328 VanDerWaalsContact O-CD 3.28Å; Y325-R328 WeakPolarHBondContact O-CD 3.23Å; Y325-R328 WeakPolarHBondContact O-CG 3.48Å; R328-L330 HydrophobicContact CB-CD1 3.79Å
329	I	98.8	Very high	89.3	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	105.9	171.7	-55	172.5	0	0	0	108.4	I70 T72 F251 Y352 L366 F370	I70-I329 HydrophobicContact CB-CD1 4.29Å; I70-I329 HydrophobicContact CB-CG2 4.43Å; I70-I329 HydrophobicContact CD1-CG2 4.36Å; I70-I329 HydrophobicContact CG2-CD1 4.12Å; I70-I329 HydrophobicContact CG2-CG1 4.44Å; I70-I329 HydrophobicContact CG2-CG2 4.29Å; I70-I329 WeakPolarHBondContact O-CD1 3.45Å; T72-I329 HydrophobicContact CG2-CD1 4.34Å; T72-I329 HydrophobicContact CG2-CG1 4.02Å; F251-I329 HydrophobicContact CB-CB 4.28Å; F251-I329 HydrophobicContact CB-CG1 3.84Å; F251-I329 HydrophobicContact CB-CG2 4.25Å; I329-Y352 HydrophobicContact CB-CE2 3.88Å; I329-Y352 HydrophobicContact CD1-CE2 4.16Å; I329-Y352 HydrophobicContact CG1-CE2 4.15Å; I329-Y352 PolarHBondContact N-OH 3.39Å; I329-Y352 VanDerWaalsContact N-OH 3.08Å; I329-L366 HydrophobicContact CD1-CD2 4.32Å; I329-L366 HydrophobicContact CD1-CG 4.05Å; I329-L366 HydrophobicContact CG1-CD2 3.99Å; I329-L366 HydrophobicContact CG1-CG 4.28Å; I329-F370 HydrophobicContact CG2-CE2 3.85Å; I329-F370 HydrophobicContact CG2-CZ 3.74Å
330	L	98.6	Very high	88.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	152.7	175.8	-59.9	96.2	0	0	0	109.8	F249 W250 M254 L284 F294 Y297 E298 E299 R328	F249-L330 WeakPolarHBondContact CA-O 3.36Å; W250-L330 PolarHBondContact N-O 3.42Å; W250-L330 PolarHBondContact O-N 2.86Å; M254-L330 HydrophobicContact CE-CD1 3.64Å; M254-L330 HydrophobicContact SD-CD1 4.01Å; L284-L330 HydrophobicContact CD2-CD1 4.16Å; L284-L330 HydrophobicContact CD2-CD2 4.43Å; F294-L330 HydrophobicContact CB-CD2 3.91Å; F294-L330 HydrophobicContact CD1-CD2 4.13Å; F294-L330 HydrophobicContact CG-CD2 3.97Å; Y297-L330 HydrophobicContact CD1-CB 4.28Å; E298-L330 CarbonylContact O-C 3.35Å; E298-L330 WeakPolarHBondContact O-CA 3.3Å; E299-L330 HydrophobicContact CB-CD2 4.43Å; E299-L330 HydrophobicContact CB-CG 4.28Å; E299-L330 HydrophobicContact CG-CG 4.49Å; R328-L330 HydrophobicContact CB-CD1 3.79Å
331	F	98.1	Very high	88.3	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.018	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	155.8	-179.8	59.8	-90.9	0	0	0	111.5	V248 F249 Y297 E298 V347 F370	V248-F331 CarbonylContact O-C 3.6Å; V248-F331 WeakPolarHBondContact O-CA 3.2Å; F249-F331 HydrophobicContact CD1-CB 3.54Å; F249-F331 HydrophobicContact CE1-CB 3.71Å; F249-F331 HydrophobicContact CE1-CG 4.41Å; F249-F331 HydrophobicContact CG-CB 4.39Å; Y297-F331 CarbonylContact C-O 3.5Å; Y297-F331 WeakPolarHBondContact CA-O 3.39Å; E298-F331 HydrophobicContact CB-CD2 4.04Å; E298-F331 HydrophobicContact CB-CE1 4.33Å; E298-F331 HydrophobicContact CB-CE2 3.52Å; E298-F331 HydrophobicContact CB-CZ 3.69Å; E298-F331 HydrophobicContact CG-CE2 4.38Å; E298-F331 PolarHBondContact N-O 3.1Å; E298-F331 PolarHBondContact O-N 3.01Å; F331-V347 HydrophobicContact CD2-CB 3.61Å; F331-V347 HydrophobicContact CD2-CG1 3.54Å; F331-V347 HydrophobicContact CD2-CG2 3.94Å; F331-V347 HydrophobicContact CE2-CB 3.71Å; F331-V347 HydrophobicContact CE2-CG1 3.71Å; F331-V347 HydrophobicContact CE2-CG2 4.5Å; F331-V347 HydrophobicContact CG-CG1 4.04Å; F331-V347 HydrophobicContact CZ-CG1 4.34Å; F331-F370 HydrophobicContact CD1-CD1 4.04Å; F331-F370 AromaticContact CD1-CE1 3.42Å; F331-F370 HydrophobicContact CD1-CE1 3.42Å; F331-F370 VanDerWaalsContact CD1-CE1 3.42Å; F331-F370 AromaticContact CD1-CZ 3.95Å; F331-F370 HydrophobicContact CD1-CZ 3.95Å; F331-F370 HydrophobicContact CE1-CD1 4.08Å; F331-F370 AromaticContact CE1-CE1 3.47Å; F331-F370 HydrophobicContact CE1-CE1 3.47Å; F331-F370 VanDerWaalsContact CE1-CE1 3.47Å; F331-F370 HydrophobicContact CE1-CZ 4.34Å; F331-F370 HydrophobicContact CG-CE1 4.32Å; F331-F370 HydrophobicContact CZ-CE1 4.39Å
332	R	94.7	Very high	87.7	Confident	11 Å²	11	29 Å²	29	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.3	164.8	66.2	170.4	-173.3	74.7	5.1	110.7	L242 D245 Y247 V248 E296 Y297	L242-R332 PolarHBondContact O-NH2 2.83Å; D245-R332 PolarHBondContact O-NH1 2.99Å; Y247-R332 WeakPolarHBondContact CA-O 3.38Å; V248-R332 HydrophobicContact CB-CG 3.98Å; V248-R332 HydrophobicContact CG2-CG 4.43Å; V248-R332 PolarHBondContact N-O 3Å; V248-R332 PolarHBondContact O-N 2.79Å; E296-R332 WeakPolarHBondContact O-CB 3.22Å; Y297-R332 HydrophobicContact CD1-CB 4.18Å; Y297-R332 HydrophobicContact CD1-CG 4.04Å; Y297-R332 HydrophobicContact CE1-CG 3.92Å; Y297-R332 HydrophobicContact CG-CB 4.35Å; Y297-R332 HydrophobicContact CG-CG 4.43Å
333	S	92.4	Very high	87.2	Confident	32 Å²	32	26.7 Å²	26.7	22%	0.224	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151.1	164.1	51.9	0	0	0	0	110.8	D246 L345	D246-S333 CarbonylContact O-C 3.49Å; D246-S333 WeakPolarHBondContact O-CA 3.45Å; S333-L345 VanDerWaalsContact CB-O 3.29Å; S333-L345 WeakPolarHBondContact CB-O 3.32Å; S333-L345 PolarHBondContact OG-O 3.47Å
334	S	86.5	Confident	86.6	Confident	25 Å²	25	30.3 Å²	30.3	18%	0.175	19%	0.194	C	C	.	.			trans	-66.4	143.8	168.4	179.4	0	0	0	0	109.6	D246 G336	D246-S334 PolarHBondContact O-N 2.99Å; S334-G336 VanDerWaalsContact CB-O 3.31Å; S334-G336 WeakPolarHBondContact CB-O 3.28Å; S334-G336 PolarHBondContact O-N 2.72Å; S334-G336 VanDerWaalsContact O-N 3.08Å; S334-G336 PolarHBondContact OG-O 3.3Å
335	P	75	Confident	86.2	Confident	120 Å²	120	30.4 Å²	30.4	78%	0.779	19%	0.194	S	C	*	.	S	Bend	trans	-55.3	-27	175	-25.5	33.9	0	0	0	113.6
336	G	71.2	Confident	85.9	Confident	9 Å²	9	31.1 Å²	31.1	9%	0.093	20%	0.197	C	C	.	.	S	Bend	trans	-149.1	153.7	174.4	0	0	0	0	0	111.2	S334 P341 F343	S334-G336 VanDerWaalsContact CB-O 3.31Å; S334-G336 WeakPolarHBondContact CB-O 3.28Å; S334-G336 PolarHBondContact O-N 2.72Å; S334-G336 VanDerWaalsContact O-N 3.08Å; S334-G336 PolarHBondContact OG-O 3.3Å; G336-P341 WeakPolarHBondContact CA-O 3.46Å; G336-F343 WeakPolarHBondContact CA-O 3.18Å
337	A	69.8	Low	85.7	Confident	1 Å²	1	31 Å²	31	1%	0.008	20%	0.196	C	C	.	.			trans	-62.6	141.1	179.7	0	0	0	0	0	112.1	D246 A339 F340 P341 F343 L345 Y375	D246-A337 VanDerWaalsContact OD1-CA 3.27Å; D246-A337 WeakPolarHBondContact OD1-CA 3.28Å; A337-A339 VanDerWaalsContact C-N 3.27Å; A337-A339 PolarHBondContact O-N 3.42Å; A337-F340 HydrophobicContact CB-CB 4.44Å; A337-F340 PolarHBondContact N-O 3.12Å; A337-F340 CarbonylContact O-C 3.6Å; A337-F340 PolarHBondContact O-N 2.73Å; A337-P341 VanDerWaalsContact O-CA 3.29Å; A337-P341 WeakPolarHBondContact O-CA 3.46Å; A337-F343 PolarHBondContact N-O 2.91Å; A337-L345 HydrophobicContact CB-CD1 3.89Å; A337-L345 HydrophobicContact CB-CD2 4.23Å; A337-L345 HydrophobicContact CB-CG 4.05Å; A337-Y375 HydrophobicContact CB-CD1 4.11Å; A337-Y375 HydrophobicContact CB-CE1 3.26Å
338	A	72.8	Confident	85.4	Confident	59 Å²	59	31.2 Å²	31.2	49%	0.488	20%	0.197	S	C	.	.	S	Bend	trans	-54.5	-43	-179.6	0	0	0	0	0	112.6	D246	D246-A338 PolarHBondContact OD1-N 3.18Å
339	A	75	Confident	85.1	Confident	51 Å²	51	34 Å²	34	42%	0.421	21%	0.212	S	C	.	.	S	Bend	trans	-81	-27.7	177.2	0	0	0	0	0	113.6	A337	A337-A339 VanDerWaalsContact C-N 3.27Å; A337-A339 PolarHBondContact O-N 3.42Å
340	F	78.2	Confident	84.8	Confident	56 Å²	56	37.2 Å²	37.2	25%	0.246	23%	0.228	C	C	.	.			trans	-136.2	81	-178.6	-63.9	-85.4	0	0	0	110.6	L61 A337 T342 F343 Y375 E377	L61-F340 HydrophobicContact CD1-CB 4.3Å; L61-F340 HydrophobicContact CD1-CD1 3.81Å; L61-F340 HydrophobicContact CD1-CD2 4.21Å; L61-F340 HydrophobicContact CD1-CE1 4.13Å; L61-F340 HydrophobicContact CD1-CE2 4.5Å; L61-F340 HydrophobicContact CD1-CG 3.84Å; L61-F340 HydrophobicContact CD1-CZ 4.45Å; L61-F340 HydrophobicContact CD2-CE1 4.48Å; L61-F340 HydrophobicContact CD2-CE2 4.39Å; L61-F340 HydrophobicContact CD2-CZ 4.2Å; A337-F340 HydrophobicContact CB-CB 4.44Å; A337-F340 PolarHBondContact N-O 3.12Å; A337-F340 CarbonylContact O-C 3.6Å; A337-F340 PolarHBondContact O-N 2.73Å; F340-T342 PolarHBondContact O-N 3.06Å; F340-F343 HydrophobicContact CB-CB 4.2Å; F340-F343 WeakPolarHBondContact O-CB 3.5Å; F340-F343 PolarHBondContact O-N 3.5Å; F340-Y375 AromaticContact CD2-CD2 3.74Å; F340-Y375 HydrophobicContact CD2-CD2 3.74Å; F340-Y375 AromaticContact CD2-CE2 3.17Å; F340-Y375 HydrophobicContact CD2-CE2 3.17Å; F340-Y375 AromaticContact CD2-CZ 3.65Å; F340-Y375 HydrophobicContact CE2-CD2 4.06Å; F340-Y375 AromaticContact CE2-CE2 3.52Å; F340-Y375 HydrophobicContact CE2-CE2 3.52Å; F340-Y375 HydrophobicContact CG-CE2 4.26Å; F340-E377 WeakPolarHBondContact CE2-OE1 3.26Å; F340-E377 VanDerWaalsContact CZ-OE1 3.23Å; F340-E377 WeakPolarHBondContact CZ-OE1 3.04Å
341	P	79	Confident	84.5	Confident	100 Å²	100	40.7 Å²	40.7	65%	0.649	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-18.7	-171.8	-26.7	35.7	0	0	0	114.9	G336 A337 F343	G336-P341 WeakPolarHBondContact CA-O 3.46Å; A337-P341 VanDerWaalsContact O-CA 3.29Å; A337-P341 WeakPolarHBondContact O-CA 3.46Å; P341-F343 VanDerWaalsContact C-N 3.32Å
342	T	78.2	Confident	84.5	Confident	83 Å²	83	41.1 Å²	41.1	51%	0.509	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-13	174.8	53	0	0	0	0	113.1	T55 P58 F340	T55-T342 WeakPolarHBondContact CG2-O 3.2Å; P58-T342 WeakPolarHBondContact CG-OG1 3.39Å; F340-T342 PolarHBondContact O-N 3.06Å
343	F	80.8	Confident	84.6	Confident	1 Å²	1	43 Å²	43	0%	0.004	25%	0.254	C	S	.	.	S	Bend	trans	-89.5	107.5	174.1	-167.4	-80.2	0	0	0	109.9	V57 R63 G336 A337 F340 P341 L345 Y374 Y375	V57-F343 HydrophobicContact CG1-CD2 4.18Å; V57-F343 HydrophobicContact CG1-CE2 4.02Å; V57-F343 HydrophobicContact CG2-CE2 4.12Å; R63-F343 HydrophobicContact CB-CE2 3.96Å; R63-F343 HydrophobicContact CB-CZ 3.9Å; R63-F343 HydrophobicContact CG-CE2 4.29Å; R63-F343 HydrophobicContact CG-CZ 3.77Å; R63-F343 VanDerWaalsContact NE-CZ 3.32Å; G336-F343 WeakPolarHBondContact CA-O 3.18Å; A337-F343 PolarHBondContact N-O 2.91Å; F340-F343 HydrophobicContact CB-CB 4.2Å; F340-F343 WeakPolarHBondContact O-CB 3.5Å; F340-F343 PolarHBondContact O-N 3.5Å; P341-F343 VanDerWaalsContact C-N 3.32Å; F343-L345 HydrophobicContact CD1-CD2 3.85Å; F343-L345 HydrophobicContact CE1-CD2 4.04Å; F343-L345 PolarHBondContact O-N 2.91Å; F343-Y374 WeakPolarHBondContact CZ-O 3.47Å; F343-Y375 HydrophobicContact CB-CD1 4.37Å; F343-Y375 AromaticContact CD1-CD1 3.66Å; F343-Y375 HydrophobicContact CD1-CD1 3.66Å; F343-Y375 HydrophobicContact CD1-CG 4.35Å; F343-Y375 HydrophobicContact CD2-CD1 4.49Å; F343-Y375 HydrophobicContact CD2-CG 4.42Å; F343-Y375 HydrophobicContact CE1-CD1 4Å; F343-Y375 AromaticContact CG-CD1 3.92Å; F343-Y375 HydrophobicContact CG-CD1 3.92Å; F343-Y375 HydrophobicContact CG-CG 4.26Å
344	E	82.6	Confident	84.8	Confident	77 Å²	77	42.3 Å²	42.3	36%	0.36	25%	0.248	S	C	.	.			trans	-65.5	128.4	177.7	-168.8	-177.1	-172.4	0	0	112.2	E346 T373	E344-E346 HydrophobicContact CG-CG 4.1Å; E344-T373 PolarHBondContact O-OG1 3.26Å
345	L	87.7	Confident	85.1	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	25%	0.245	C	C	.	.			trans	-102.1	123.5	175.8	-63.9	-176.8	0	0	0	110.3	D246 Y247 S333 A337 F343 T373 Y375	D246-L345 HydrophobicContact CB-CD1 3.48Å; D246-L345 VanDerWaalsContact CB-CD1 3.48Å; D246-L345 WeakPolarHBondContact OD1-CD1 3.45Å; Y247-L345 HydrophobicContact CE1-CB 4.33Å; Y247-L345 HydrophobicContact CE2-CB 4.4Å; Y247-L345 HydrophobicContact CE2-CD1 4.07Å; Y247-L345 HydrophobicContact CE2-CD2 4.14Å; Y247-L345 HydrophobicContact CE2-CG 4.46Å; Y247-L345 WeakPolarHBondContact OH-CB 3.25Å; S333-L345 VanDerWaalsContact CB-O 3.29Å; S333-L345 WeakPolarHBondContact CB-O 3.32Å; S333-L345 PolarHBondContact OG-O 3.47Å; A337-L345 HydrophobicContact CB-CD1 3.89Å; A337-L345 HydrophobicContact CB-CD2 4.23Å; A337-L345 HydrophobicContact CB-CG 4.05Å; F343-L345 HydrophobicContact CD1-CD2 3.85Å; F343-L345 HydrophobicContact CE1-CD2 4.04Å; F343-L345 PolarHBondContact O-N 2.91Å; L345-T373 WeakPolarHBondContact CA-OG1 3.41Å; L345-Y375 HydrophobicContact CD2-CD1 4.49Å; L345-Y375 HydrophobicContact CD2-CE1 4.49Å
346	E	90.4	Very high	85.9	Confident	15 Å²	15	38.7 Å²	38.7	7%	0.07	22%	0.219	C	C	.	.			trans	-127.2	148.4	-175.6	-63.1	167.1	91.1	0	0	110.3	R41 R63 Y247 E344 F348 C372 T373	R41-E346 WeakPolarHBondContact CG-OE1 3.32Å; R41-E346 IonicContact CZ-OE1 3.4Å; R41-E346 IonicContact CZ-OE2 3.24Å; R41-E346 VanDerWaalsContact NE-CD 3.27Å; R41-E346 IonicContact NE-OE1 2.68Å; R41-E346 PolarHBondContact NE-OE1 2.9Å; R41-E346 IonicContact NE-OE2 4Å; R41-E346 PolarHBondContact NE-OE2 2.77Å; R41-E346 IonicContact NH2-OE2 2.87Å; R41-E346 PolarHBondContact NH2-OE2 2.83Å; R63-E346 IonicContact NH1-OE2 2.99Å; R63-E346 PolarHBondContact NH1-OE2 2.9Å; Y247-E346 PolarHBondContact OH-N 3.38Å; Y247-E346 PolarHBondContact OH-O 2.94Å; E344-E346 HydrophobicContact CG-CG 4.1Å; E346-F348 HydrophobicContact CB-CE2 3.89Å; E346-F348 HydrophobicContact CB-CZ 3.97Å; E346-F348 WeakPolarHBondContact OE1-CZ 3.35Å; E346-C372 WeakPolarHBondContact O-CA 3.05Å; E346-T373 HydrophobicContact CB-CG2 4.05Å; E346-T373 PolarHBondContact N-OG1 2.78Å; E346-T373 PolarHBondContact O-N 3.01Å
347	V	92.9	Very high	86.7	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.5	168	-175.2	0	0	0	0	108.7	R44 Y247 F249 F331 F370	R44-V347 PolarHBondContact NH1-O 2.84Å; R44-V347 PolarHBondContact NH2-O 2.84Å; Y247-V347 HydrophobicContact CD1-CG2 3.6Å; Y247-V347 HydrophobicContact CE1-CG2 3.56Å; F249-V347 HydrophobicContact CE1-CG1 4.23Å; F249-V347 HydrophobicContact CZ-CG1 4.42Å; F249-V347 HydrophobicContact CZ-CG2 4.47Å; F331-V347 HydrophobicContact CD2-CB 3.61Å; F331-V347 HydrophobicContact CD2-CG1 3.54Å; F331-V347 HydrophobicContact CD2-CG2 3.94Å; F331-V347 HydrophobicContact CE2-CB 3.71Å; F331-V347 HydrophobicContact CE2-CG1 3.71Å; F331-V347 HydrophobicContact CE2-CG2 4.5Å; F331-V347 HydrophobicContact CG-CG1 4.04Å; F331-V347 HydrophobicContact CZ-CG1 4.34Å; V347-F370 HydrophobicContact CG1-CB 3.87Å; V347-F370 HydrophobicContact CG1-CD1 3.82Å; V347-F370 HydrophobicContact CG1-CG 4.12Å
348	F	92.1	Very high	87.7	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.4	175.1	-59.9	-80.4	0	0	0	109.4	F37 L40 R41 Y65 E346 M350 F370 A371 T373	F37-F348 HydrophobicContact CD1-CB 4.18Å; F37-F348 HydrophobicContact CD1-CD1 4.18Å; F37-F348 AromaticContact CD1-CD2 3.54Å; F37-F348 HydrophobicContact CD1-CD2 3.54Å; F37-F348 AromaticContact CD1-CE2 3.92Å; F37-F348 HydrophobicContact CD1-CE2 3.92Å; F37-F348 AromaticContact CD1-CG 3.69Å; F37-F348 HydrophobicContact CD1-CG 3.69Å; F37-F348 HydrophobicContact CD1-CZ 4.39Å; F37-F348 HydrophobicContact CE1-CB 4.01Å; F37-F348 AromaticContact CE1-CD2 3.79Å; F37-F348 HydrophobicContact CE1-CD2 3.79Å; F37-F348 AromaticContact CE1-CG 3.97Å; F37-F348 HydrophobicContact CE1-CG 3.97Å; F37-F348 HydrophobicContact CG-CD2 4.39Å; F37-F348 HydrophobicContact CG-CE2 4.37Å; L40-F348 HydrophobicContact CB-CD1 3.81Å; L40-F348 HydrophobicContact CB-CE1 4.1Å; L40-F348 HydrophobicContact CD1-CB 4.12Å; L40-F348 HydrophobicContact CD1-CD1 4.03Å; L40-F348 HydrophobicContact CD1-CG 4.36Å; R41-F348 HydrophobicContact CG-CE1 3.9Å; R41-F348 HydrophobicContact CG-CZ 3.88Å; Y65-F348 HydrophobicContact CD1-CE2 4.47Å; Y65-F348 AromaticContact CE1-CE2 3.97Å; Y65-F348 HydrophobicContact CE1-CE2 3.97Å; E346-F348 HydrophobicContact CB-CE2 3.89Å; E346-F348 HydrophobicContact CB-CZ 3.97Å; E346-F348 WeakPolarHBondContact OE1-CZ 3.35Å; F348-M350 PolarHBondContact O-N 3.08Å; F348-F370 WeakPolarHBondContact O-CA 3.37Å; F348-A371 HydrophobicContact CB-CB 4.43Å; F348-A371 PolarHBondContact N-O 2.94Å; F348-A371 PolarHBondContact O-N 2.85Å; F348-T373 HydrophobicContact CE2-CG2 4Å
349	N	91.8	Very high	88.4	Confident	58 Å²	58	41.3 Å²	41.3	31%	0.31	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	129.1	173.1	-179.8	53.1	0	0	0	110.7	A300 K351	A300-N349 HydrophobicContact CB-CB 4.06Å; A300-N349 WeakPolarHBondContact CB-ND2 3.29Å; N349-K351 PolarHBondContact OD1-O 2.94Å
350	M	92.6	Very high	89	Confident	70 Å²	70	40 Å²	40	35%	0.345	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-40.6	175.9	-59.5	176.7	58.8	0	0	111.8	K67 F348 S369 A371	K67-M350 HydrophobicContact CD-CE 4.33Å; K67-M350 HydrophobicContact CD-SD 4.31Å; K67-M350 HydrophobicContact CG-SD 4.27Å; F348-M350 PolarHBondContact O-N 3.08Å; M350-S369 WeakPolarHBondContact CA-O 3.47Å; M350-S369 WeakPolarHBondContact CB-O 3.37Å; M350-S369 PolarHBondContact N-O 2.83Å; M350-A371 HydrophobicContact CG-CB 4.33Å; M350-A371 HydrophobicContact SD-CB 3.87Å
351	K	93.5	Very high	89.8	Confident	73 Å²	73	37.4 Å²	37.4	32%	0.317	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	136.6	-177.3	-154	179.3	-154.9	-161.5	0	109.7	N349 E353 G368 S369	N349-K351 PolarHBondContact OD1-O 2.94Å; K351-E353 HydrophobicContact CD-CG 4.29Å; K351-E353 VanDerWaalsContact CD-OE1 3.23Å; K351-E353 WeakPolarHBondContact CD-OE1 3.43Å; K351-E353 WeakPolarHBondContact CE-OE1 3.48Å; K351-E353 WeakPolarHBondContact CE-OE2 3.2Å; K351-E353 HydrophobicContact CG-CG 4.28Å; K351-E353 IonicContact NZ-OE1 2.86Å; K351-E353 PolarHBondContact NZ-OE1 2.97Å; K351-E353 IonicContact NZ-OE2 3.88Å; K351-E353 PolarHBondContact NZ-OE2 2.9Å; K351-G368 CarbonylContact O-C 3.51Å; K351-G368 WeakPolarHBondContact O-CA 3.3Å; K351-S369 PolarHBondContact N-O 2.91Å; K351-S369 PolarHBondContact O-N 3.01Å
352	Y	97.3	Very high	90.6	Very high	12 Å²	12	33.1 Å²	33.1	5%	0.047	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	105.1	171.7	-169	-144.1	0	0	0	109.5	E299 A300 I302 F304 I329 L366 L367	E299-Y352 HydrophobicContact CG-CE1 3.83Å; E299-Y352 PolarHBondContact OE1-OH 2.81Å; A300-Y352 HydrophobicContact CB-CD1 3.51Å; A300-Y352 HydrophobicContact CB-CE1 4.29Å; A300-Y352 HydrophobicContact CB-CG 3.83Å; A300-Y352 WeakPolarHBondContact O-CD1 3.15Å; A300-Y352 WeakPolarHBondContact O-CE1 3.34Å; I302-Y352 HydrophobicContact CG1-CD1 4.48Å; I302-Y352 HydrophobicContact CG1-CE1 3.82Å; F304-Y352 WeakPolarHBondContact CD1-O 3.45Å; F304-Y352 AromaticContact CE1-CD1 3.64Å; F304-Y352 HydrophobicContact CE1-CD1 3.64Å; F304-Y352 HydrophobicContact CE1-CD2 4.25Å; F304-Y352 AromaticContact CE1-CE1 3.82Å; F304-Y352 HydrophobicContact CE1-CE1 3.82Å; F304-Y352 HydrophobicContact CE1-CE2 4.37Å; F304-Y352 AromaticContact CE1-CG 3.89Å; F304-Y352 HydrophobicContact CE1-CG 3.89Å; F304-Y352 HydrophobicContact CZ-CD1 4.18Å; F304-Y352 AromaticContact CZ-CE1 3.86Å; F304-Y352 HydrophobicContact CZ-CE1 3.86Å; F304-Y352 HydrophobicContact CZ-CE2 4.28Å; F304-Y352 AromaticContact CZ-CZ 3.92Å; I329-Y352 HydrophobicContact CB-CE2 3.88Å; I329-Y352 HydrophobicContact CD1-CE2 4.16Å; I329-Y352 HydrophobicContact CG1-CE2 4.15Å; I329-Y352 PolarHBondContact N-OH 3.39Å; I329-Y352 VanDerWaalsContact N-OH 3.08Å; Y352-L366 HydrophobicContact CD2-CD1 4.07Å; Y352-L366 HydrophobicContact CE2-CD1 3.64Å; Y352-L366 HydrophobicContact CE2-CD2 3.8Å; Y352-L366 HydrophobicContact CE2-CG 3.85Å; Y352-L367 WeakPolarHBondContact CA-O 3.47Å
353	E	96.7	Very high	91.5	Very high	50 Å²	50	29.5 Å²	29.5	23%	0.234	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	161.7	-168.5	70	-179.3	176.2	0	0	113.1	K351 F355 L366 L367	K351-E353 HydrophobicContact CD-CG 4.29Å; K351-E353 VanDerWaalsContact CD-OE1 3.23Å; K351-E353 WeakPolarHBondContact CD-OE1 3.43Å; K351-E353 WeakPolarHBondContact CE-OE1 3.48Å; K351-E353 WeakPolarHBondContact CE-OE2 3.2Å; K351-E353 HydrophobicContact CG-CG 4.28Å; K351-E353 IonicContact NZ-OE1 2.86Å; K351-E353 PolarHBondContact NZ-OE1 2.97Å; K351-E353 IonicContact NZ-OE2 3.88Å; K351-E353 PolarHBondContact NZ-OE2 2.9Å; E353-F355 HydrophobicContact CG-CE2 3.83Å; E353-F355 HydrophobicContact CG-CZ 4.09Å; E353-F355 WeakPolarHBondContact OE1-CZ 3.39Å; E353-L366 WeakPolarHBondContact O-CD1 3.38Å; E353-L367 HydrophobicContact CG-CB 4.5Å; E353-L367 PolarHBondContact N-O 2.82Å; E353-L367 PolarHBondContact O-N 3.48Å
354	T	96	Very high	92.2	Very high	18 Å²	18	29.5 Å²	29.5	11%	0.11	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	154.9	174.9	-167.2	0	0	0	0	112.5	F304 M356 K364 P365	F304-T354 HydrophobicContact CB-CG2 3.81Å; F304-T354 HydrophobicContact CD2-CG2 4.06Å; F304-T354 HydrophobicContact CG-CG2 4.18Å; T354-M356 HydrophobicContact CG2-CG 4.11Å; T354-M356 HydrophobicContact CG2-SD 3.57Å; T354-M356 VanDerWaalsContact CG2-SD 3.57Å; T354-K364 WeakPolarHBondContact OG1-CB 3.34Å; T354-P365 VanDerWaalsContact CA-O 3.26Å; T354-P365 WeakPolarHBondContact CA-O 3.32Å; T354-P365 PolarHBondContact OG1-O 2.98Å
355	F	94.2	Very high	92.9	Very high	22 Å²	22	25.8 Å²	25.8	10%	0.096	14%	0.136	C	C	.	.			trans	-107.8	85	-176.3	-69	-96.4	0	0	0	111.2	I89 F90 E353 T357 V358 P365 L367	I89-F355 HydrophobicContact CB-CD1 4.47Å; I89-F355 HydrophobicContact CD1-CD1 4.41Å; I89-F355 HydrophobicContact CG1-CD1 4.26Å; I89-F355 VanDerWaalsContact O-CE1 3.25Å; I89-F355 WeakPolarHBondContact O-CE1 2.9Å; F90-F355 HydrophobicContact CB-CZ 4.48Å; F90-F355 HydrophobicContact CD1-CD1 4.05Å; F90-F355 AromaticContact CD1-CD2 3.81Å; F90-F355 HydrophobicContact CD1-CD2 3.81Å; F90-F355 AromaticContact CD1-CE1 3.78Å; F90-F355 HydrophobicContact CD1-CE1 3.78Å; F90-F355 AromaticContact CD1-CE2 3.55Å; F90-F355 HydrophobicContact CD1-CE2 3.55Å; F90-F355 HydrophobicContact CD1-CG 4.07Å; F90-F355 AromaticContact CD1-CZ 3.52Å; F90-F355 HydrophobicContact CD1-CZ 3.52Å; F90-F355 HydrophobicContact CE1-CD1 4.26Å; F90-F355 AromaticContact CE1-CD2 3.71Å; F90-F355 HydrophobicContact CE1-CD2 3.71Å; F90-F355 HydrophobicContact CE1-CE1 4.43Å; F90-F355 AromaticContact CE1-CE2 3.93Å; F90-F355 HydrophobicContact CE1-CE2 3.93Å; F90-F355 AromaticContact CE1-CG 3.91Å; F90-F355 HydrophobicContact CE1-CG 3.91Å; F90-F355 HydrophobicContact CE1-CZ 4.28Å; F90-F355 HydrophobicContact CG-CZ 4.48Å; E353-F355 HydrophobicContact CG-CE2 3.83Å; E353-F355 HydrophobicContact CG-CZ 4.09Å; E353-F355 WeakPolarHBondContact OE1-CZ 3.39Å; F355-T357 PolarHBondContact O-N 2.77Å; F355-V358 HydrophobicContact CB-CG2 4.19Å; F355-V358 PolarHBondContact O-N 3.06Å; F355-P365 HydrophobicContact CB-CB 4.41Å; F355-P365 HydrophobicContact CB-CG 4.39Å; F355-P365 PolarHBondContact N-O 3.25Å; F355-P365 VanDerWaalsContact N-O 3.08Å; F355-L367 HydrophobicContact CD2-CB 4.45Å; F355-L367 HydrophobicContact CE2-CB 3.59Å; F355-L367 HydrophobicContact CE2-CD2 3.89Å; F355-L367 HydrophobicContact CE2-CG 4.35Å; F355-L367 HydrophobicContact CZ-CB 4.41Å; F355-L367 HydrophobicContact CZ-CD2 3.87Å
356	M	91.7	Very high	93.4	Very high	48 Å²	48	25.6 Å²	25.6	24%	0.236	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.2	-173.9	-65.5	-50.4	-61.2	0	0	115.1	L305 Y310 T354 V358 K364	L305-M356 HydrophobicContact CB-SD 4.3Å; L305-M356 HydrophobicContact CD1-CE 4.09Å; L305-M356 HydrophobicContact CD1-SD 4.41Å; Y310-M356 HydrophobicContact CD1-CE 4.21Å; Y310-M356 HydrophobicContact CE1-CE 3.23Å; Y310-M356 HydrophobicContact CE2-CE 4.28Å; Y310-M356 WeakPolarHBondContact OH-CE 3.5Å; T354-M356 HydrophobicContact CG2-CG 4.11Å; T354-M356 HydrophobicContact CG2-SD 3.57Å; T354-M356 VanDerWaalsContact CG2-SD 3.57Å; M356-V358 VanDerWaalsContact C-N 3.25Å; M356-V358 PolarHBondContact O-N 3.16Å; M356-K364 HydrophobicContact CE-CG 4.18Å; M356-K364 HydrophobicContact SD-CG 3.94Å
357	T	88.3	Confident	93.7	Very high	116 Å²	116	24.9 Å²	24.9	71%	0.712	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-20.9	-177.9	50.4	0	0	0	0	113.2	F355 G359	F355-T357 PolarHBondContact O-N 2.77Å; T357-G359 PolarHBondContact O-N 3.44Å
358	V	90.3	Very high	94	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.			trans	-75.1	121.2	-177.9	178.4	0	0	0	0	110	Y73 F85 I89 F355 M356 K364 P365	Y73-V358 HydrophobicContact CE1-CG1 4.3Å; Y73-V358 WeakPolarHBondContact OH-CG1 3.47Å; F85-V358 HydrophobicContact CB-CG1 4.44Å; F85-V358 HydrophobicContact CD2-CB 4.3Å; F85-V358 HydrophobicContact CD2-CG1 3.56Å; F85-V358 HydrophobicContact CD2-CG2 3.72Å; F85-V358 HydrophobicContact CE2-CG1 4.3Å; F85-V358 HydrophobicContact CE2-CG2 4.23Å; F85-V358 HydrophobicContact CG-CG1 4.38Å; I89-V358 HydrophobicContact CD1-CG2 3.47Å; I89-V358 VanDerWaalsContact CD1-CG2 3.47Å; F355-V358 HydrophobicContact CB-CG2 4.19Å; F355-V358 PolarHBondContact O-N 3.06Å; M356-V358 VanDerWaalsContact C-N 3.25Å; M356-V358 PolarHBondContact O-N 3.16Å; V358-K364 PolarHBondContact O-NZ 3.45Å; V358-P365 HydrophobicContact CB-CG 4.07Å; V358-P365 HydrophobicContact CG1-CG 4.07Å; V358-P365 HydrophobicContact CG2-CG 4Å
359	G	86.7	Confident	94.2	Very high	7 Å²	7	24.7 Å²	24.7	7%	0.072	13%	0.131	C	C	.	.			trans	-102.9	-16.8	-172.1	0	0	0	0	0	116.3	D84 G313 T357 S361	D84-G359 PolarHBondContact OD2-N 2.84Å; D84-G359 VanDerWaalsContact OD2-N 3.1Å; G313-G359 WeakPolarHBondContact CA-O 3.24Å; G313-G359 PolarHBondContact N-O 2.94Å; T357-G359 PolarHBondContact O-N 3.44Å; G359-S361 VanDerWaalsContact C-N 3.28Å; G359-S361 PolarHBondContact O-N 2.93Å
360	C	89.1	Confident	94.4	Very high	25 Å²	25	22 Å²	22	17%	0.169	12%	0.117	C	C	.	.	S	Bend	trans	-74.2	-9.8	-165.2	55.9	0	0	0	0	116.9	Y73 S82	Y73-C360 PolarHBondContact OH-SG 3.3Å; Y73-C360 VanDerWaalsContact OH-SG 3.36Å; S82-C360 WeakPolarHBondContact OG-CB 3.27Å; S82-C360 PolarHBondContact OG-SG 2.81Å
361	S	94.5	Very high	94.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.1	C	C	.	.	S	Bend	trans	-124.1	159.1	175	-177.6	0	0	0	0	110.4	Y73 S74 N76 G359 H363	Y73-S361 WeakPolarHBondContact OH-CB 3.14Å; Y73-S361 PolarHBondContact OH-N 3.39Å; S74-S361 WeakPolarHBondContact O-CB 3.43Å; S74-S361 PolarHBondContact O-OG 2.95Å; N76-S361 VanDerWaalsContact CB-OG 3.27Å; N76-S361 WeakPolarHBondContact CB-OG 3.48Å; G359-S361 VanDerWaalsContact C-N 3.28Å; G359-S361 PolarHBondContact O-N 2.93Å; S361-H363 PolarHBondContact O-N 3.48Å; S361-H363 PolarHBondContact OG-N 2.74Å
362	N	94.9	Very high	94.5	Very high	11 Å²	11	15.2 Å²	15.2	6%	0.059	9%	0.085	C	C	.	.	S	Bend	trans	-75.6	-6.6	165.8	60.8	-22.2	0	0	0	112.4	N76 R309 Y310 V312	N76-N362 VanDerWaalsContact CB-OD1 3.3Å; N76-N362 WeakPolarHBondContact CB-OD1 3.27Å; R309-N362 HydrophobicContact CG-CB 4.01Å; Y310-N362 PolarHBondContact N-O 3.19Å; Y310-N362 WeakPolarHBondContact O-CA 3.44Å; Y310-N362 WeakPolarHBondContact O-CB 3.31Å; V312-N362 HydrophobicContact CG2-CB 4.02Å
363	H	96.5	Very high	94.2	Very high	7 Å²	7	14.6 Å²	14.6	3%	0.032	8%	0.083	C	C	.	.	S	Bend	trans	-99.6	163	165.5	-70.1	-106.4	0	0	0	111.7	Y73 T307 Y308 D327 S361	Y73-H363 HydrophobicContact CE2-CB 4.35Å; Y73-H363 WeakPolarHBondContact CE2-O 3.29Å; T307-H363 CarbonylContact O-C 3.04Å; T307-H363 VanDerWaalsContact O-CA 3.25Å; T307-H363 WeakPolarHBondContact O-CA 3.27Å; Y308-H363 AromaticContact CD2-CD2 3.73Å; Y308-H363 AromaticContact CD2-CE1 3.46Å; Y308-H363 VanDerWaalsContact CD2-CE1 3.46Å; Y308-H363 WeakPolarHBondContact CD2-CE1 3.23Å; Y308-H363 AromaticContact CD2-ND1 3.98Å; Y308-H363 AromaticContact CD2-NE2 3.28Å; Y308-H363 VanDerWaalsContact CD2-NE2 3.28Å; Y308-H363 WeakPolarHBondContact CD2-NE2 3.46Å; Y308-H363 AromaticContact CE2-NE2 3.7Å; Y308-H363 AromaticContact CG-CE1 3.82Å; D327-H363 IonicContact OD1-ND1 3.81Å; D327-H363 IonicContact OD2-CE1 3.75Å; D327-H363 IonicContact OD2-CG 3.34Å; D327-H363 IonicContact OD2-ND1 3.98Å; D327-H363 PolarHBondContact OD2-ND1 3.25Å; S361-H363 PolarHBondContact O-N 3.48Å; S361-H363 PolarHBondContact OG-N 2.74Å
364	K	96	Very high	93.6	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.074	C	C	.	.			trans	-111.5	139.2	170.9	-58.7	-58.5	-179.1	-165.1	0	110.8	T307 Y310 T314 T354 M356 V358	T307-K364 PolarHBondContact O-N 3.32Å; Y310-K364 HydrophobicContact CD2-CD 4.21Å; Y310-K364 HydrophobicContact CD2-CG 3.73Å; Y310-K364 HydrophobicContact CE2-CD 4.41Å; Y310-K364 HydrophobicContact CE2-CG 3.54Å; Y310-K364 HydrophobicContact CG-CD 4.43Å; Y310-K364 VanDerWaalsContact CG-CE 3.42Å; Y310-K364 HydrophobicContact CG-CG 4.39Å; T314-K364 PolarHBondContact O-NZ 2.83Å; T314-K364 VanDerWaalsContact O-NZ 3.13Å; T354-K364 WeakPolarHBondContact OG1-CB 3.34Å; M356-K364 HydrophobicContact CE-CG 4.18Å; M356-K364 HydrophobicContact SD-CG 3.94Å; V358-K364 PolarHBondContact O-NZ 3.45Å
365	P	97	Very high	92.9	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.069	C	C	.	.			trans	-59.1	141.5	175.1	-18.7	28.9	0	0	0	111.1	L71 Y73 F85 F90 T354 F355 V358	L71-P365 HydrophobicContact CD1-CB 4.02Å; Y73-P365 HydrophobicContact CD1-CB 4.43Å; Y73-P365 HydrophobicContact CD1-CG 3.92Å; Y73-P365 HydrophobicContact CD2-CB 4.13Å; Y73-P365 HydrophobicContact CD2-CG 3.79Å; Y73-P365 HydrophobicContact CE1-CG 3.97Å; Y73-P365 HydrophobicContact CE2-CG 3.86Å; Y73-P365 HydrophobicContact CG-CB 4.02Å; Y73-P365 HydrophobicContact CG-CG 3.83Å; F85-P365 HydrophobicContact CE2-CG 3.97Å; F90-P365 HydrophobicContact CE1-CB 4.23Å; F90-P365 HydrophobicContact CZ-CB 4.4Å; T354-P365 VanDerWaalsContact CA-O 3.26Å; T354-P365 WeakPolarHBondContact CA-O 3.32Å; T354-P365 PolarHBondContact OG1-O 2.98Å; F355-P365 HydrophobicContact CB-CB 4.41Å; F355-P365 HydrophobicContact CB-CG 4.39Å; F355-P365 PolarHBondContact N-O 3.25Å; F355-P365 VanDerWaalsContact N-O 3.08Å; V358-P365 HydrophobicContact CB-CG 4.07Å; V358-P365 HydrophobicContact CG1-CG 4.07Å; V358-P365 HydrophobicContact CG2-CG 4Å
366	L	98.1	Very high	91.9	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.5	177.7	178.1	67.5	0	0	0	109.8	L71 T72 F304 D327 I329 Y352 E353	L71-L366 WeakPolarHBondContact CA-O 3.27Å; T72-L366 HydrophobicContact CG2-CB 3.85Å; T72-L366 HydrophobicContact CG2-CD2 4.08Å; T72-L366 HydrophobicContact CG2-CG 4.31Å; T72-L366 PolarHBondContact N-O 2.91Å; T72-L366 PolarHBondContact O-N 3.17Å; F304-L366 HydrophobicContact CE1-CD1 3.93Å; F304-L366 HydrophobicContact CE2-CD1 3.79Å; F304-L366 HydrophobicContact CZ-CD1 3.41Å; F304-L366 VanDerWaalsContact CZ-CD1 3.41Å; D327-L366 VanDerWaalsContact C-CD2 3.47Å; D327-L366 HydrophobicContact CB-CB 4.32Å; D327-L366 HydrophobicContact CB-CD2 4.19Å; D327-L366 WeakPolarHBondContact O-CD2 3.44Å; I329-L366 HydrophobicContact CD1-CD2 4.32Å; I329-L366 HydrophobicContact CD1-CG 4.05Å; I329-L366 HydrophobicContact CG1-CD2 3.99Å; I329-L366 HydrophobicContact CG1-CG 4.28Å; Y352-L366 HydrophobicContact CD2-CD1 4.07Å; Y352-L366 HydrophobicContact CE2-CD1 3.64Å; Y352-L366 HydrophobicContact CE2-CD2 3.8Å; Y352-L366 HydrophobicContact CE2-CG 3.85Å; E353-L366 WeakPolarHBondContact O-CD1 3.38Å
367	L	98.1	Very high	91.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.5	-177.7	-169.3	78.2	0	0	0	110.3	Q69 I70 L71 F90 Y352 E353 F355	Q69-L367 HydrophobicContact CG-CD1 3.59Å; Q69-L367 HydrophobicContact CG-CG 4.1Å; I70-L367 CarbonylContact O-C 3.51Å; I70-L367 WeakPolarHBondContact O-CA 3.4Å; L71-L367 HydrophobicContact CB-CD1 4.09Å; L71-L367 HydrophobicContact CD1-CD1 4.27Å; F90-L367 HydrophobicContact CB-CD2 4.28Å; F90-L367 HydrophobicContact CD1-CD1 4.38Å; F90-L367 HydrophobicContact CD1-CD2 4.46Å; F90-L367 HydrophobicContact CG-CD1 4.47Å; Y352-L367 WeakPolarHBondContact CA-O 3.47Å; E353-L367 HydrophobicContact CG-CB 4.5Å; E353-L367 PolarHBondContact N-O 2.82Å; E353-L367 PolarHBondContact O-N 3.48Å; F355-L367 HydrophobicContact CD2-CB 4.45Å; F355-L367 HydrophobicContact CE2-CB 3.59Å; F355-L367 HydrophobicContact CE2-CD2 3.89Å; F355-L367 HydrophobicContact CE2-CG 4.35Å; F355-L367 HydrophobicContact CZ-CB 4.41Å; F355-L367 HydrophobicContact CZ-CD2 3.87Å
368	G	98.2	Very high	90.2	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.7	170.2	0	0	0	0	0	109.5	Q69 I70 K351	Q69-G368 CarbonylContact C-O 3.59Å; Q69-G368 WeakPolarHBondContact CA-O 3.36Å; I70-G368 PolarHBondContact N-O 2.88Å; I70-G368 PolarHBondContact O-N 2.81Å; K351-G368 CarbonylContact O-C 3.51Å; K351-G368 WeakPolarHBondContact O-CA 3.3Å
369	S	96.9	Very high	89.1	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.014	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.9	176.4	-62	0	0	0	0	108.9	Q69 F100 M350 K351	Q69-S369 PolarHBondContact NE2-OG 3.02Å; Q69-S369 VanDerWaalsContact NE2-OG 3.12Å; F100-S369 WeakPolarHBondContact CZ-OG 3.39Å; M350-S369 WeakPolarHBondContact CA-O 3.47Å; M350-S369 WeakPolarHBondContact CB-O 3.37Å; M350-S369 PolarHBondContact N-O 2.83Å; K351-S369 PolarHBondContact N-O 2.91Å; K351-S369 PolarHBondContact O-N 3.01Å
370	F	96.6	Very high	88.3	Confident	1 Å²	1	22.2 Å²	22.2	0%	0.004	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	146.6	-171.9	-49.3	-84.4	0	0	0	110.4	K67 I68 I70 F249 I329 F331 V347 F348	K67-F370 CarbonylContact C-O 3.44Å; K67-F370 VanDerWaalsContact CA-O 3.3Å; K67-F370 WeakPolarHBondContact CA-O 3.46Å; I68-F370 HydrophobicContact CG2-CB 3.89Å; I68-F370 HydrophobicContact CG2-CD2 4.15Å; I68-F370 HydrophobicContact CG2-CG 4.5Å; I68-F370 PolarHBondContact N-O 2.89Å; I68-F370 PolarHBondContact O-N 3.46Å; I70-F370 HydrophobicContact CD1-CD2 4.37Å; I70-F370 HydrophobicContact CD1-CE2 4.12Å; I70-F370 HydrophobicContact CG1-CE2 4.34Å; F249-F370 HydrophobicContact CD1-CD2 4.17Å; F249-F370 HydrophobicContact CD1-CE2 4.27Å; F249-F370 HydrophobicContact CE1-CB 4.17Å; F249-F370 HydrophobicContact CE1-CD1 4.44Å; F249-F370 AromaticContact CE1-CD2 3.74Å; F249-F370 HydrophobicContact CE1-CD2 3.74Å; F249-F370 HydrophobicContact CE1-CE2 4.25Å; F249-F370 AromaticContact CE1-CG 3.85Å; F249-F370 HydrophobicContact CE1-CG 3.85Å; I329-F370 HydrophobicContact CG2-CE2 3.85Å; I329-F370 HydrophobicContact CG2-CZ 3.74Å; F331-F370 HydrophobicContact CD1-CD1 4.04Å; F331-F370 AromaticContact CD1-CE1 3.42Å; F331-F370 HydrophobicContact CD1-CE1 3.42Å; F331-F370 VanDerWaalsContact CD1-CE1 3.42Å; F331-F370 AromaticContact CD1-CZ 3.95Å; F331-F370 HydrophobicContact CD1-CZ 3.95Å; F331-F370 HydrophobicContact CE1-CD1 4.08Å; F331-F370 AromaticContact CE1-CE1 3.47Å; F331-F370 HydrophobicContact CE1-CE1 3.47Å; F331-F370 VanDerWaalsContact CE1-CE1 3.47Å; F331-F370 HydrophobicContact CE1-CZ 4.34Å; F331-F370 HydrophobicContact CG-CE1 4.32Å; F331-F370 HydrophobicContact CZ-CE1 4.39Å; V347-F370 HydrophobicContact CG1-CB 3.87Å; V347-F370 HydrophobicContact CG1-CD1 3.82Å; V347-F370 HydrophobicContact CG1-CG 4.12Å; F348-F370 WeakPolarHBondContact O-CA 3.37Å
371	A	94.8	Very high	87.6	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.4	163.6	0	0	0	0	0	109.1	F37 W66 K67 F348 M350	F37-A371 HydrophobicContact CE1-CB 3.46Å; F37-A371 VanDerWaalsContact CE1-CB 3.46Å; F37-A371 HydrophobicContact CZ-CB 3.33Å; W66-A371 CarbonylContact O-C 3.59Å; W66-A371 WeakPolarHBondContact O-CA 3.42Å; K67-A371 HydrophobicContact CG-CB 4.24Å; F348-A371 HydrophobicContact CB-CB 4.43Å; F348-A371 PolarHBondContact N-O 2.94Å; F348-A371 PolarHBondContact O-N 2.85Å; M350-A371 HydrophobicContact CG-CB 4.33Å; M350-A371 HydrophobicContact SD-CB 3.87Å
372	C	93.1	Very high	87	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	141.7	-173.7	-64.2	0	0	0	0	109.2	Y65 W66 Y247 E346	Y65-C372 VanDerWaalsContact CA-O 3.22Å; Y65-C372 WeakPolarHBondContact CA-O 2.95Å; W66-C372 HydrophobicContact CD2-CB 4.17Å; W66-C372 VanDerWaalsContact CE2-CB 3.43Å; W66-C372 HydrophobicContact CG-CB 4.35Å; W66-C372 HydrophobicContact CZ2-CB 3.75Å; W66-C372 PolarHBondContact N-O 2.7Å; W66-C372 VanDerWaalsContact N-O 3.08Å; W66-C372 PolarHBondContact O-N 2.81Å; Y247-C372 HydrophobicContact CE1-CB 4.05Å; E346-C372 WeakPolarHBondContact O-CA 3.05Å
373	T	90.1	Very high	86.8	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	155.8	169.2	53.7	0	0	0	0	110.6	Y65 Y247 E344 L345 E346 F348	Y65-T373 HydrophobicContact CD1-CG2 4.04Å; Y65-T373 HydrophobicContact CE1-CG2 3.59Å; Y247-T373 PolarHBondContact OH-N 3.45Å; Y247-T373 PolarHBondContact OH-O 2.97Å; Y247-T373 PolarHBondContact OH-OG1 3.3Å; E344-T373 PolarHBondContact O-OG1 3.26Å; L345-T373 WeakPolarHBondContact CA-OG1 3.41Å; E346-T373 HydrophobicContact CB-CG2 4.05Å; E346-T373 PolarHBondContact N-OG1 2.78Å; E346-T373 PolarHBondContact O-N 3.01Å; F348-T373 HydrophobicContact CE2-CG2 4Å
374	Y	85.7	Confident	86.7	Confident	10 Å²	10	29.5 Å²	29.5	4%	0.039	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	155.9	172.3	-166.4	-76.1	0	0	0	109.2	R63 F64 I200 G201 V204 F343 L376	R63-Y374 WeakPolarHBondContact CA-O 3.44Å; F64-Y374 HydrophobicContact CD1-CD1 4.1Å; F64-Y374 AromaticContact CE1-CD1 3.03Å; F64-Y374 HydrophobicContact CE1-CD1 3.03Å; F64-Y374 AromaticContact CE1-CE1 3.68Å; F64-Y374 HydrophobicContact CE1-CE1 3.68Å; F64-Y374 AromaticContact CE1-CG 3.85Å; F64-Y374 HydrophobicContact CE1-CG 3.85Å; F64-Y374 AromaticContact CE2-CD1 3.86Å; F64-Y374 HydrophobicContact CE2-CD1 3.86Å; F64-Y374 AromaticContact CE2-CG 3.96Å; F64-Y374 HydrophobicContact CE2-CG 3.96Å; F64-Y374 AromaticContact CZ-CD1 2.88Å; F64-Y374 HydrophobicContact CZ-CD1 2.88Å; F64-Y374 HydrophobicContact CZ-CD2 4.39Å; F64-Y374 AromaticContact CZ-CE1 3.42Å; F64-Y374 HydrophobicContact CZ-CE1 3.42Å; F64-Y374 VanDerWaalsContact CZ-CE1 3.42Å; F64-Y374 AromaticContact CZ-CG 3.43Å; F64-Y374 HydrophobicContact CZ-CG 3.43Å; F64-Y374 VanDerWaalsContact CZ-CG 3.43Å; F64-Y374 PolarHBondContact N-O 2.74Å; F64-Y374 PolarHBondContact O-N 2.74Å; I200-Y374 HydrophobicContact CB-CE2 3.95Å; I200-Y374 HydrophobicContact CG2-CE2 3.68Å; I200-Y374 PolarHBondContact O-OH 3.49Å; G201-Y374 VanDerWaalsContact CA-OH 3.28Å; G201-Y374 WeakPolarHBondContact CA-OH 3.39Å; G201-Y374 PolarHBondContact N-OH 2.87Å; V204-Y374 HydrophobicContact CB-CD2 4.16Å; V204-Y374 HydrophobicContact CB-CE2 3.54Å; V204-Y374 HydrophobicContact CG1-CD2 4.09Å; V204-Y374 HydrophobicContact CG1-CE2 3.93Å; V204-Y374 HydrophobicContact CG2-CD2 3.93Å; V204-Y374 HydrophobicContact CG2-CE2 3.48Å; V204-Y374 VanDerWaalsContact CG2-CE2 3.48Å; F343-Y374 WeakPolarHBondContact CZ-O 3.47Å; Y374-L376 HydrophobicContact CE1-CG 4.17Å
375	Y	81.3	Confident	86.6	Confident	6 Å²	6	32.1 Å²	32.1	2%	0.024	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.8	170.9	59.3	-82.2	0	0	0	111.3	L61 R62 V204 A337 F340 F343 L345	L61-Y375 HydrophobicContact CD1-CD2 4.06Å; L61-Y375 HydrophobicContact CD1-CG 4.29Å; L61-Y375 HydrophobicContact CD2-CD2 4.1Å; R62-Y375 WeakPolarHBondContact O-CA 3.5Å; V204-Y375 HydrophobicContact CG2-CD1 4.41Å; V204-Y375 HydrophobicContact CG2-CE1 3.49Å; V204-Y375 VanDerWaalsContact CG2-CE1 3.49Å; V204-Y375 WeakPolarHBondContact CG2-OH 3.22Å; A337-Y375 HydrophobicContact CB-CD1 4.11Å; A337-Y375 HydrophobicContact CB-CE1 3.26Å; F340-Y375 AromaticContact CD2-CD2 3.74Å; F340-Y375 HydrophobicContact CD2-CD2 3.74Å; F340-Y375 AromaticContact CD2-CE2 3.17Å; F340-Y375 HydrophobicContact CD2-CE2 3.17Å; F340-Y375 AromaticContact CD2-CZ 3.65Å; F340-Y375 HydrophobicContact CE2-CD2 4.06Å; F340-Y375 AromaticContact CE2-CE2 3.52Å; F340-Y375 HydrophobicContact CE2-CE2 3.52Å; F340-Y375 HydrophobicContact CG-CE2 4.26Å; F343-Y375 HydrophobicContact CB-CD1 4.37Å; F343-Y375 AromaticContact CD1-CD1 3.66Å; F343-Y375 HydrophobicContact CD1-CD1 3.66Å; F343-Y375 HydrophobicContact CD1-CG 4.35Å; F343-Y375 HydrophobicContact CD2-CD1 4.49Å; F343-Y375 HydrophobicContact CD2-CG 4.42Å; F343-Y375 HydrophobicContact CE1-CD1 4Å; F343-Y375 AromaticContact CG-CD1 3.92Å; F343-Y375 HydrophobicContact CG-CD1 3.92Å; F343-Y375 HydrophobicContact CG-CG 4.26Å; L345-Y375 HydrophobicContact CD2-CD1 4.49Å; L345-Y375 HydrophobicContact CD2-CE1 4.49Å
376	L	71.3	Confident	86.6	Confident	59 Å²	59	33.3 Å²	33.3	31%	0.309	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.1	167.6	-96	161.9	0	0	0	107.1	L61 R62 F64 Y374	L61-L376 WeakPolarHBondContact CA-O 3.42Å; R62-L376 PolarHBondContact N-O 3Å; R62-L376 PolarHBondContact O-N 2.99Å; F64-L376 HydrophobicContact CD1-CB 4.15Å; F64-L376 HydrophobicContact CD1-CD1 3.89Å; F64-L376 HydrophobicContact CD1-CG 4.11Å; F64-L376 HydrophobicContact CE1-CB 3.57Å; F64-L376 HydrophobicContact CE1-CD1 3.25Å; F64-L376 HydrophobicContact CE1-CG 3.19Å; F64-L376 HydrophobicContact CE2-CD1 4.47Å; F64-L376 HydrophobicContact CZ-CD1 3.56Å; F64-L376 HydrophobicContact CZ-CG 3.66Å; Y374-L376 HydrophobicContact CE1-CG 4.17Å
377	E	75.3	Confident	86.5	Confident	63 Å²	63	35.7 Å²	35.7	29%	0.294	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	138.9	166.4	-19.7	-178.8	153.9	0	0	109.4	L61 F340 N379 Q380	L61-E377 HydrophobicContact CD2-CB 3.82Å; L61-E377 HydrophobicContact CD2-CG 3.69Å; F340-E377 WeakPolarHBondContact CE2-OE1 3.26Å; F340-E377 VanDerWaalsContact CZ-OE1 3.23Å; F340-E377 WeakPolarHBondContact CZ-OE1 3.04Å; E377-N379 PolarHBondContact O-N 3.5Å; E377-Q380 HydrophobicContact CB-CG 3.73Å; E377-Q380 VanDerWaalsContact CD-NE2 3.3Å; E377-Q380 HydrophobicContact CG-CG 3.76Å; E377-Q380 WeakPolarHBondContact O-CB 3.46Å; E377-Q380 WeakPolarHBondContact O-CG 3.34Å; E377-Q380 PolarHBondContact O-N 3.09Å; E377-Q380 PolarHBondContact OE2-NE2 3.46Å
378	D	70.1	Confident	86.4	Confident	77 Å²	77	36 Å²	36	41%	0.412	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.3	-168.7	-85.4	8.4	0	0	0	114.7	G60 R62	G60-D378 PolarHBondContact O-N 3.19Å; G60-D378 VanDerWaalsContact O-N 3.12Å; R62-D378 WeakPolarHBondContact CD-OD1 3.24Å; R62-D378 WeakPolarHBondContact CG-OD1 3.23Å; R62-D378 IonicContact CZ-OD1 3.78Å; R62-D378 IonicContact CZ-OD2 3.24Å; R62-D378 VanDerWaalsContact NE-CG 3.28Å; R62-D378 IonicContact NE-OD1 3.51Å; R62-D378 PolarHBondContact NE-OD1 2.82Å; R62-D378 IonicContact NE-OD2 3.44Å; R62-D378 PolarHBondContact NE-OD2 3.35Å; R62-D378 VanDerWaalsContact NE-OD2 3.16Å; R62-D378 IonicContact NH2-OD1 2.79Å; R62-D378 IonicContact NH2-OD2 3.52Å; R62-D378 PolarHBondContact NH2-OD2 2.98Å
379	N	67.9	Low	86.4	Confident	150 Å²	150	36.1 Å²	36.1	80%	0.802	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113	18.7	-174.4	-71.8	-26.6	0	0	0	113.6	E377 K381	E377-N379 PolarHBondContact O-N 3.5Å; N379-K381 PolarHBondContact O-N 3.31Å; N379-K381 VanDerWaalsContact O-N 3.14Å
380	Q	69.3	Low	86.1	Confident	56 Å²	56	36.6 Å²	36.6	26%	0.262	19%	0.189	S	C	.	.			trans	-64.1	115.3	-179.3	-81.8	-63.7	-31	0	0	111.8	D202 E377	D202-Q380 VanDerWaalsContact CG-NE2 3.33Å; D202-Q380 PolarHBondContact OD1-OE1 2.79Å; D202-Q380 PolarHBondContact OD2-NE2 3.23Å; D202-Q380 PolarHBondContact OD2-OE1 3.46Å; E377-Q380 HydrophobicContact CB-CG 3.73Å; E377-Q380 VanDerWaalsContact CD-NE2 3.3Å; E377-Q380 HydrophobicContact CG-CG 3.76Å; E377-Q380 WeakPolarHBondContact O-CB 3.46Å; E377-Q380 WeakPolarHBondContact O-CG 3.34Å; E377-Q380 PolarHBondContact O-N 3.09Å; E377-Q380 PolarHBondContact OE2-NE2 3.46Å
381	K	74.3	Confident	85.8	Confident	141 Å²	141	42.5 Å²	42.5	61%	0.613	21%	0.211	S	C	*	.			trans	-114.4	139.1	173.5	-71.3	-178.6	-178.5	176.2	0	108.8	N379	N379-K381 PolarHBondContact O-N 3.31Å; N379-K381 VanDerWaalsContact O-N 3.14Å
382	P	82.3	Confident	85.5	Confident	30 Å²	30	48.4 Å²	48.4	20%	0.195	24%	0.243	C	C	.	.			trans	-60	146.1	169.1	28	-32.6	0	0	0	109.5	I384 V385 A484	P382-I384 WeakPolarHBondContact CB-O 3.45Å; P382-I384 WeakPolarHBondContact CG-O 2.88Å; P382-I384 PolarHBondContact O-N 3.1Å; P382-V385 HydrophobicContact CG-CG2 3.96Å; P382-A484 HydrophobicContact CB-CB 4.33Å
383	P	90	Very high	85.4	Confident	24 Å²	24	54 Å²	54	16%	0.156	27%	0.267	C	S	.	.	S	Bend	trans	-60.4	-20.7	-179.9	24.6	-34.8	0	0	0	112.5	Q409 E410 Y413 I483	P383-Q409 WeakPolarHBondContact O-CA 3.22Å; P383-E410 PolarHBondContact O-N 3.37Å; P383-Y413 HydrophobicContact CB-CD2 3.69Å; P383-Y413 HydrophobicContact CB-CE2 4.49Å; P383-Y413 HydrophobicContact CB-CG 3.99Å; P383-Y413 HydrophobicContact CG-CD2 4.01Å; P383-Y413 HydrophobicContact CG-CE2 4.37Å; P383-I483 HydrophobicContact CG-CD1 4.16Å
384	I	94.6	Very high	85.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	125.5	175.5	-54.1	-60.7	0	0	0	108.6	P382 F386 Y407 S408 Q409 Y413 M440 C474 I483 A484	P382-I384 WeakPolarHBondContact CB-O 3.45Å; P382-I384 WeakPolarHBondContact CG-O 2.88Å; P382-I384 PolarHBondContact O-N 3.1Å; I384-F386 HydrophobicContact CG2-CE2 4.47Å; I384-F386 HydrophobicContact CG2-CZ 4.36Å; I384-Y407 HydrophobicContact CG2-CD2 3.98Å; I384-Y407 HydrophobicContact CG2-CG 4.41Å; I384-S408 WeakPolarHBondContact CA-O 3.29Å; I384-Q409 HydrophobicContact CD1-CB 3.72Å; I384-Q409 HydrophobicContact CD1-CG 3.67Å; I384-Y413 HydrophobicContact CD1-CD1 4.02Å; I384-Y413 HydrophobicContact CD1-CE1 4.28Å; I384-M440 HydrophobicContact CD1-CE 3.64Å; I384-M440 HydrophobicContact CG1-CE 4.33Å; I384-C474 HydrophobicContact CB-CB 4.4Å; I384-C474 HydrophobicContact CG1-CB 4.5Å; I384-C474 HydrophobicContact CG2-CB 4.15Å; I384-I483 HydrophobicContact CG1-CD1 4.23Å; I384-A484 HydrophobicContact CB-CB 3.84Å; I384-A484 HydrophobicContact CG2-CB 4.27Å; I384-A484 VanDerWaalsContact O-CB 3.22Å; I384-A484 WeakPolarHBondContact O-CB 3.43Å
385	V	94.8	Very high	85.5	Confident	55 Å²	55	54.7 Å²	54.7	33%	0.333	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	118.5	176.7	178.5	0	0	0	0	109	P382 L387 Y407 S408	P382-V385 HydrophobicContact CG-CG2 3.96Å; V385-L387 HydrophobicContact CG1-CD2 4.38Å; V385-Y407 CarbonylContact O-C 3.57Å; V385-Y407 WeakPolarHBondContact O-CA 3.35Å; V385-Y407 WeakPolarHBondContact O-CB 3.44Å; V385-S408 PolarHBondContact N-O 2.8Å; V385-S408 PolarHBondContact O-N 3.05Å
386	F	96.5	Very high	86.1	Confident	25 Å²	25	55.2 Å²	55.2	11%	0.11	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	135.1	177.2	-64.4	-80.7	0	0	0	111.3	I384 I421 F472 C474 A484 S486	I384-F386 HydrophobicContact CG2-CE2 4.47Å; I384-F386 HydrophobicContact CG2-CZ 4.36Å; F386-I421 HydrophobicContact CE1-CD1 3.92Å; F386-I421 HydrophobicContact CE1-CG1 4.1Å; F386-I421 HydrophobicContact CE1-CG2 3.77Å; F386-I421 HydrophobicContact CZ-CD1 4.43Å; F386-I421 HydrophobicContact CZ-CG1 4.23Å; F386-I421 HydrophobicContact CZ-CG2 4.21Å; F386-F472 HydrophobicContact CD1-CB 3.69Å; F386-F472 AromaticContact CD1-CD2 3.89Å; F386-F472 HydrophobicContact CD1-CD2 3.89Å; F386-F472 HydrophobicContact CD1-CG 4.05Å; F386-F472 HydrophobicContact CD2-CB 4.32Å; F386-F472 HydrophobicContact CE1-CB 3.34Å; F386-F472 HydrophobicContact CE1-CD2 4.3Å; F386-F472 AromaticContact CE1-CG 3.97Å; F386-F472 HydrophobicContact CE1-CG 3.97Å; F386-F472 HydrophobicContact CE2-CB 4Å; F386-F472 HydrophobicContact CG-CB 4.17Å; F386-F472 HydrophobicContact CG-CD2 4.4Å; F386-F472 HydrophobicContact CZ-CB 3.5Å; F386-F472 VanDerWaalsContact CZ-CB 3.5Å; F386-C474 HydrophobicContact CE2-CB 4.42Å; F386-C474 HydrophobicContact CZ-CB 4Å; F386-A484 HydrophobicContact CE2-CB 4.06Å; F386-S486 VanDerWaalsContact CB-CB 3.46Å; F386-S486 VanDerWaalsContact CD2-N 3.33Å
387	L	95.9	Very high	87.3	Confident	50 Å²	50	52.6 Å²	52.6	26%	0.262	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-35.5	-175.8	-58.8	-179.7	0	0	0	112.6	V385 K393 T406 V454	V385-L387 HydrophobicContact CG1-CD2 4.38Å; L387-K393 PolarHBondContact O-NZ 3.24Å; L387-T406 WeakPolarHBondContact CA-O 3.28Å; L387-T406 HydrophobicContact CB-CG2 4.2Å; L387-T406 WeakPolarHBondContact CB-O 3.19Å; L387-T406 HydrophobicContact CD1-CG2 4.19Å; L387-T406 PolarHBondContact N-O 2.87Å; L387-V454 HydrophobicContact CD1-CG1 3.92Å; L387-V454 HydrophobicContact CD1-CG2 4.42Å
388	S	96.4	Very high	88.1	Confident	6 Å²	6	50.7 Å²	50.7	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	146	-176.6	-175.5	0	0	0	0	111.7	C405 T406 E513	S388-C405 WeakPolarHBondContact O-CA 3.34Å; S388-T406 PolarHBondContact N-O 2.89Å; S388-T406 VanDerWaalsContact N-O 3.16Å; S388-T406 PolarHBondContact O-N 3.39Å; S388-E513 WeakPolarHBondContact CB-OE1 3.48Å; S388-E513 VanDerWaalsContact OG-CD 3.3Å; S388-E513 PolarHBondContact OG-OE1 3.22Å
389	P	96.5	Very high	89.1	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.019	24%	0.24	C	C	.	.	S	Bend	cis	-63.3	165	-8	29.1	-42.8	0	0	0	113.2	V395 W397 F472 F489	P389-V395 HydrophobicContact CB-CB 4.45Å; P389-V395 HydrophobicContact CB-CG1 4.07Å; P389-V395 VanDerWaalsContact CB-O 3.32Å; P389-V395 WeakPolarHBondContact CB-O 3.25Å; P389-W397 HydrophobicContact CG-CD2 4.28Å; P389-W397 HydrophobicContact CG-CG 4Å; P389-W397 VanDerWaalsContact CG-NE1 3.34Å; P389-F472 HydrophobicContact CG-CE2 3.7Å; P389-F472 HydrophobicContact CG-CZ 3.9Å; P389-F489 HydrophobicContact CB-CB 3.9Å; P389-F489 HydrophobicContact CB-CD2 4.06Å; P389-F489 HydrophobicContact CB-CG 3.99Å; P389-F489 HydrophobicContact CG-CB 3.96Å; P389-F489 HydrophobicContact CG-CD1 3.89Å; P389-F489 HydrophobicContact CG-CD2 3.44Å; P389-F489 VanDerWaalsContact CG-CD2 3.44Å; P389-F489 HydrophobicContact CG-CE1 4.21Å; P389-F489 HydrophobicContact CG-CE2 3.8Å; P389-F489 HydrophobicContact CG-CG 3.48Å; P389-F489 VanDerWaalsContact CG-CG 3.48Å; P389-F489 HydrophobicContact CG-CZ 4.17Å
390	S	92.1	Very high	90	Very high	12 Å²	12	47.4 Å²	47.4	8%	0.084	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-159.2	127	178	176.5	0	0	0	0	109.9	N392 K393 G394 V395	S390-N392 PolarHBondContact O-N 2.94Å; S390-N392 PolarHBondContact OG-N 3.2Å; S390-K393 PolarHBondContact O-N 2.9Å; S390-G394 PolarHBondContact O-N 3.16Å; S390-V395 CarbonylContact C-O 3.6Å; S390-V395 PolarHBondContact N-O 3.13Å; S390-V395 VanDerWaalsContact N-O 3.14Å; S390-V395 PolarHBondContact O-N 2.58Å
391	R	90.1	Very high	91.1	Very high	126 Å²	126	47.6 Å²	47.6	48%	0.475	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-56.9	-38.1	174.7	-173.5	-171.8	-78.2	-172.7	-7.2	111.9	K393 G394 T469 P488 E490	R391-K393 PolarHBondContact O-N 2.95Å; R391-G394 PolarHBondContact O-N 2.81Å; R391-T469 PolarHBondContact NH2-OG1 2.99Å; R391-T469 VanDerWaalsContact NH2-OG1 3.16Å; R391-P488 WeakPolarHBondContact CB-O 3.44Å; R391-P488 PolarHBondContact N-O 3.21Å; R391-E490 IonicContact CZ-OE1 3.72Å; R391-E490 IonicContact NE-OE1 3.95Å; R391-E490 PolarHBondContact NE-OE1 3.5Å; R391-E490 IonicContact NH2-OE1 2.81Å; R391-E490 PolarHBondContact NH2-OE1 2.88Å; R391-E490 IonicContact NH2-OE2 3.79Å
392	N	89	Confident	92	Very high	124 Å²	124	44 Å²	44	66%	0.663	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-65.6	-24.7	179.7	-65.2	-16	0	0	0	113.1	S390	S390-N392 PolarHBondContact O-N 2.94Å; S390-N392 PolarHBondContact OG-N 3.2Å
393	K	89.5	Confident	92.7	Very high	117 Å²	117	43.5 Å²	43.5	51%	0.509	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-95.7	0.1	175.1	-61	-178.5	-177.9	175.2	0	112.7	L387 S390 R391 V395	L387-K393 PolarHBondContact O-NZ 3.24Å; S390-K393 PolarHBondContact O-N 2.9Å; R391-K393 PolarHBondContact O-N 2.95Å; K393-V395 HydrophobicContact CB-CG2 4.07Å; K393-V395 PolarHBondContact O-N 2.79Å
394	G	87.5	Confident	93	Very high	15 Å²	15	44.7 Å²	44.7	16%	0.155	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	11.7	-173.1	0	0	0	0	0	114	S390 R391 L514 I515 F516	S390-G394 PolarHBondContact O-N 3.16Å; R391-G394 PolarHBondContact O-N 2.81Å; G394-L514 VanDerWaalsContact O-O 3.04Å; G394-I515 CarbonylContact O-C 3.55Å; G394-I515 WeakPolarHBondContact O-CA 3.42Å; G394-F516 PolarHBondContact O-N 3.31Å
395	V	91.5	Very high	93.1	Very high	9 Å²	9	44.7 Å²	44.7	6%	0.055	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-92.4	125.1	-176.5	-176	0	0	0	0	110.1	P389 S390 K393 E513 L514	P389-V395 HydrophobicContact CB-CB 4.45Å; P389-V395 HydrophobicContact CB-CG1 4.07Å; P389-V395 VanDerWaalsContact CB-O 3.32Å; P389-V395 WeakPolarHBondContact CB-O 3.25Å; S390-V395 CarbonylContact C-O 3.6Å; S390-V395 PolarHBondContact N-O 3.13Å; S390-V395 VanDerWaalsContact N-O 3.14Å; S390-V395 PolarHBondContact O-N 2.58Å; K393-V395 HydrophobicContact CB-CG2 4.07Å; K393-V395 PolarHBondContact O-N 2.79Å; V395-E513 HydrophobicContact CG1-CB 3.73Å; V395-E513 HydrophobicContact CG1-CG 3.86Å; V395-E513 HydrophobicContact CG2-CB 3.98Å; V395-L514 WeakPolarHBondContact CA-O 3.17Å
396	C	93.7	Very high	93.3	Very high	18 Å²	18	42.3 Å²	42.3	12%	0.122	21%	0.213	C	C	.	.			trans	-117.7	164.5	179.5	60.6	0	0	0	0	112	E490 V492	C396-E490 CarbonylContact C-O 3.5Å; C396-E490 WeakPolarHBondContact CA-O 3.47Å; C396-E490 HydrophobicContact CB-CB 4.24Å; C396-E490 VanDerWaalsContact CB-O 3.27Å; C396-E490 WeakPolarHBondContact CB-O 3.42Å; C396-V492 HydrophobicContact CB-CG1 4.22Å; C396-V492 HydrophobicContact CB-CG2 4.37Å
397	W	95.3	Very high	93.3	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.015	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	148.8	165.9	-85.7	7.2	0	0	0	110.2	P389 N403 M404 C405 V423 F459 I464 F472 F489 E490 V491 V492	P389-W397 HydrophobicContact CG-CD2 4.28Å; P389-W397 HydrophobicContact CG-CG 4Å; P389-W397 VanDerWaalsContact CG-NE1 3.34Å; W397-N403 WeakPolarHBondContact CA-OD1 3.38Å; W397-N403 HydrophobicContact CB-CB 4.27Å; W397-N403 HydrophobicContact CD2-CB 3.5Å; W397-N403 VanDerWaalsContact CE2-CB 3.45Å; W397-N403 HydrophobicContact CE3-CB 4.16Å; W397-N403 HydrophobicContact CG-CB 3.56Å; W397-N403 HydrophobicContact CZ2-CB 4.02Å; W397-M404 PolarHBondContact NE1-O 3.12Å; W397-C405 HydrophobicContact CZ2-CB 4.22Å; W397-V423 HydrophobicContact CH2-CG2 4.04Å; W397-V423 HydrophobicContact CZ3-CG2 3.84Å; W397-F459 HydrophobicContact CH2-CB 3.77Å; W397-F459 HydrophobicContact CH2-CD1 4.15Å; W397-F459 AromaticContact CH2-CD2 3.48Å; W397-F459 HydrophobicContact CH2-CD2 3.48Å; W397-F459 VanDerWaalsContact CH2-CD2 3.48Å; W397-F459 HydrophobicContact CH2-CE2 4.06Å; W397-F459 AromaticContact CH2-CG 3.52Å; W397-F459 HydrophobicContact CH2-CG 3.52Å; W397-F459 HydrophobicContact CZ2-CB 4.38Å; W397-F459 AromaticContact CZ2-CD2 3.88Å; W397-F459 HydrophobicContact CZ2-CD2 3.88Å; W397-F459 HydrophobicContact CZ2-CE2 4.5Å; W397-F459 HydrophobicContact CZ2-CG 4.28Å; W397-F459 HydrophobicContact CZ3-CB 4.35Å; W397-F459 HydrophobicContact CZ3-CG 4.33Å; W397-I464 HydrophobicContact CE3-CD1 3.79Å; W397-I464 HydrophobicContact CE3-CG2 4.42Å; W397-I464 HydrophobicContact CH2-CD1 4.18Å; W397-I464 HydrophobicContact CZ3-CD1 3.58Å; W397-F472 HydrophobicContact CD2-CZ 4.42Å; W397-F472 AromaticContact CE2-CZ 3.72Å; W397-F472 AromaticContact CH2-CE1 3.36Å; W397-F472 HydrophobicContact CH2-CE1 3.36Å; W397-F472 AromaticContact CH2-CZ 3.58Å; W397-F472 HydrophobicContact CH2-CZ 3.58Å; W397-F472 AromaticContact CZ2-CE1 3.57Å; W397-F472 HydrophobicContact CZ2-CE1 3.57Å; W397-F472 AromaticContact CZ2-CZ 3.28Å; W397-F472 HydrophobicContact CZ2-CZ 3.28Å; W397-F472 HydrophobicContact CZ3-CE1 4.04Å; W397-F472 HydrophobicContact CZ3-CZ 4.25Å; W397-F489 HydrophobicContact CB-CE2 4.35Å; W397-F489 AromaticContact CD2-CE2 3.82Å; W397-F489 HydrophobicContact CD2-CE2 3.82Å; W397-F489 HydrophobicContact CD2-CZ 4.36Å; W397-F489 AromaticContact CE3-CE2 3.82Å; W397-F489 HydrophobicContact CE3-CE2 3.82Å; W397-F489 HydrophobicContact CE3-CZ 4.18Å; W397-F489 HydrophobicContact CG-CD2 4.44Å; W397-F489 HydrophobicContact CG-CE2 4.05Å; W397-F489 HydrophobicContact CZ3-CE2 4.49Å; W397-F489 HydrophobicContact CZ3-CZ 4.42Å; W397-E490 PolarHBondContact N-O 2.85Å; W397-V491 HydrophobicContact CB-CG2 3.91Å; W397-V491 HydrophobicContact CE3-CG2 4.31Å; W397-V491 CarbonylContact O-C 3.54Å; W397-V491 VanDerWaalsContact O-CA 3.28Å; W397-V491 WeakPolarHBondContact O-CA 3.29Å; W397-V492 PolarHBondContact O-N 2.84Å
398	I	93.2	Very high	93.3	Very high	22 Å²	22	40 Å²	40	11%	0.113	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.3	175.6	-59.1	162.1	0	0	0	109.4	K401 N403 R494 L514	I398-K401 HydrophobicContact CB-CB 4.33Å; I398-K401 HydrophobicContact CB-CD 4.26Å; I398-K401 HydrophobicContact CB-CG 4.48Å; I398-K401 HydrophobicContact CD1-CD 4.02Å; I398-K401 HydrophobicContact CG2-CB 4.45Å; I398-K401 HydrophobicContact CG2-CD 4.04Å; I398-K401 HydrophobicContact CG2-CG 4.14Å; I398-K401 PolarHBondContact O-N 3.08Å; I398-N403 PolarHBondContact N-OD1 3.13Å; I398-N403 PolarHBondContact O-ND2 2.91Å; I398-R494 HydrophobicContact CG2-CB 4.03Å; I398-R494 HydrophobicContact CG2-CG 4.41Å; I398-L514 HydrophobicContact CD1-CD1 3.55Å; I398-L514 HydrophobicContact CG1-CD1 4.08Å
399	S	91.3	Very high	93.3	Very high	7 Å²	7	40.4 Å²	40.4	5%	0.049	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	148.8	174.3	63.6	0	0	0	0	111.7	K401 V492 D493	S399-K401 PolarHBondContact O-N 2.9Å; S399-V492 PolarHBondContact N-O 3.43Å; S399-V492 PolarHBondContact OG-O 3.5Å; S399-D493 WeakPolarHBondContact OG-CA 3.21Å
400	E	86.5	Confident	93.1	Very high	151 Å²	151	43.7 Å²	43.7	71%	0.706	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	4.4	178.3	-47.1	-174.3	161.7	0	0	116.2	S461	E400-S461 WeakPolarHBondContact O-CB 3.18Å
401	K	91.5	Very high	93.1	Very high	61 Å²	61	46.6 Å²	46.6	27%	0.265	23%	0.233	S	C	.	.	S	Bend	trans	-108.7	152.9	170.2	-71.4	-166.4	178.4	-176.7	0	110.6	I398 S399 N403 S461 I464	I398-K401 HydrophobicContact CB-CB 4.33Å; I398-K401 HydrophobicContact CB-CD 4.26Å; I398-K401 HydrophobicContact CB-CG 4.48Å; I398-K401 HydrophobicContact CD1-CD 4.02Å; I398-K401 HydrophobicContact CG2-CB 4.45Å; I398-K401 HydrophobicContact CG2-CD 4.04Å; I398-K401 HydrophobicContact CG2-CG 4.14Å; I398-K401 PolarHBondContact O-N 3.08Å; S399-K401 PolarHBondContact O-N 2.9Å; K401-N403 PolarHBondContact O-N 3.27Å; K401-N403 PolarHBondContact O-ND2 3.31Å; K401-S461 WeakPolarHBondContact O-CA 3.18Å; K401-I464 WeakPolarHBondContact O-CG1 3.46Å
402	S	94.6	Very high	93.1	Very high	65 Å²	65	46 Å²	46	46%	0.455	24%	0.244	S	C	.	.			trans	-68.3	134.1	167.9	-58.2	0	0	0	0	108.8	F459 S461	S402-F459 CarbonylContact C-O 3.59Å; S402-F459 VanDerWaalsContact CA-O 3.27Å; S402-F459 WeakPolarHBondContact CA-O 3.35Å; S402-S461 PolarHBondContact OG-N 3.47Å; S402-S461 VanDerWaalsContact OG-N 3.15Å
403	N	96.3	Very high	93.2	Very high	19 Å²	19	41.7 Å²	41.7	10%	0.102	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	163.9	-178.4	-71.1	-89.2	0	0	0	110.6	W397 I398 K401 F459 I464	W397-N403 WeakPolarHBondContact CA-OD1 3.38Å; W397-N403 HydrophobicContact CB-CB 4.27Å; W397-N403 HydrophobicContact CD2-CB 3.5Å; W397-N403 VanDerWaalsContact CE2-CB 3.45Å; W397-N403 HydrophobicContact CE3-CB 4.16Å; W397-N403 HydrophobicContact CG-CB 3.56Å; W397-N403 HydrophobicContact CZ2-CB 4.02Å; I398-N403 PolarHBondContact N-OD1 3.13Å; I398-N403 PolarHBondContact O-ND2 2.91Å; K401-N403 PolarHBondContact O-N 3.27Å; K401-N403 PolarHBondContact O-ND2 3.31Å; N403-F459 PolarHBondContact N-O 2.83Å; N403-F459 PolarHBondContact O-N 3.27Å; N403-I464 HydrophobicContact CB-CD1 4.06Å
404	M	95.9	Very high	93.1	Very high	49 Å²	49	43.6 Å²	43.6	24%	0.241	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.5	-176.7	-158.7	153.9	62.6	0	0	110.7	W397 F444 N456 I457 A510	W397-M404 PolarHBondContact NE1-O 3.12Å; M404-F444 HydrophobicContact SD-CE2 4.48Å; M404-F444 HydrophobicContact SD-CZ 3.74Å; M404-N456 HydrophobicContact CE-CB 4.45Å; M404-N456 WeakPolarHBondContact CE-ND2 3.38Å; M404-N456 HydrophobicContact CG-CB 3.91Å; M404-N456 HydrophobicContact SD-CB 3.62Å; M404-N456 VanDerWaalsContact SD-CG 3.6Å; M404-N456 PolarHBondContact SD-ND2 3.45Å; M404-I457 WeakPolarHBondContact CA-O 3.38Å; M404-I457 WeakPolarHBondContact CG-O 3.45Å; M404-A510 HydrophobicContact CE-CB 4.22Å
405	C	97.3	Very high	93.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.6	165.8	171.1	0	0	0	0	107.7	S388 W397 N456 I457 F459 F472	S388-C405 WeakPolarHBondContact O-CA 3.34Å; W397-C405 HydrophobicContact CZ2-CB 4.22Å; C405-N456 CarbonylContact O-C 3.53Å; C405-N456 WeakPolarHBondContact O-CA 3.48Å; C405-I457 PolarHBondContact N-O 2.82Å; C405-I457 PolarHBondContact O-N 3.03Å; C405-F459 HydrophobicContact CB-CD2 4.25Å; C405-F459 HydrophobicContact CB-CE2 3.87Å; C405-F472 HydrophobicContact CB-CE1 4.01Å; C405-F472 HydrophobicContact CB-CE2 4.21Å; C405-F472 HydrophobicContact CB-CZ 3.86Å
406	T	97.9	Very high	93.1	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.5	172.7	-51.4	0	0	0	0	109.1	L387 S388 K446 V454 Q455 N456	L387-T406 WeakPolarHBondContact CA-O 3.28Å; L387-T406 HydrophobicContact CB-CG2 4.2Å; L387-T406 WeakPolarHBondContact CB-O 3.19Å; L387-T406 HydrophobicContact CD1-CG2 4.19Å; L387-T406 PolarHBondContact N-O 2.87Å; S388-T406 PolarHBondContact N-O 2.89Å; S388-T406 VanDerWaalsContact N-O 3.16Å; S388-T406 PolarHBondContact O-N 3.39Å; T406-K446 HydrophobicContact CG2-CD 4.31Å; T406-V454 HydrophobicContact CG2-CG1 3.79Å; T406-Q455 WeakPolarHBondContact CA-O 3.39Å; T406-N456 WeakPolarHBondContact CG2-OD1 3.38Å; T406-N456 PolarHBondContact OG1-OD1 2.88Å; T406-N456 VanDerWaalsContact OG1-OD1 3.08Å
407	Y	97.1	Very high	93.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	157	176.3	63.4	-84.5	0	0	0	111.7	I384 V385 Q409 I421 M440 A443 V454 Q455 I457	I384-Y407 HydrophobicContact CG2-CD2 3.98Å; I384-Y407 HydrophobicContact CG2-CG 4.41Å; V385-Y407 CarbonylContact O-C 3.57Å; V385-Y407 WeakPolarHBondContact O-CA 3.35Å; V385-Y407 WeakPolarHBondContact O-CB 3.44Å; Y407-Q409 HydrophobicContact CD2-CB 4.3Å; Y407-Q409 HydrophobicContact CE2-CB 4.11Å; Y407-I421 HydrophobicContact CD1-CD1 3.46Å; Y407-I421 VanDerWaalsContact CD1-CD1 3.46Å; Y407-I421 HydrophobicContact CD2-CD1 4.29Å; Y407-I421 HydrophobicContact CE1-CD1 3.3Å; Y407-I421 HydrophobicContact CE2-CD1 4.18Å; Y407-I421 HydrophobicContact CG-CD1 3.95Å; Y407-M440 HydrophobicContact CE2-CE 3.67Å; Y407-A443 HydrophobicContact CE1-CB 4.44Å; Y407-A443 WeakPolarHBondContact OH-CB 3.45Å; Y407-V454 WeakPolarHBondContact O-CA 3.34Å; Y407-Q455 HydrophobicContact CE1-CB 4.02Å; Y407-Q455 HydrophobicContact CE2-CB 3.94Å; Y407-Q455 HydrophobicContact CE2-CG 4.47Å; Y407-Q455 PolarHBondContact N-O 2.61Å; Y407-Q455 PolarHBondContact O-N 3.12Å; Y407-Q455 PolarHBondContact OH-OE1 3.17Å; Y407-I457 HydrophobicContact CE1-CD1 3.6Å; Y407-I457 HydrophobicContact CE1-CG1 3.84Å
408	S	96.2	Very high	93	Very high	26 Å²	26	56.3 Å²	56.3	18%	0.182	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133	169.3	-179.2	0	0	0	0	109.1	I384 V385 A452 Y453	I384-S408 WeakPolarHBondContact CA-O 3.29Å; V385-S408 PolarHBondContact N-O 2.8Å; V385-S408 PolarHBondContact O-N 3.05Å; S408-A452 WeakPolarHBondContact OG-CB 3.44Å; S408-Y453 CarbonylContact C-O 3.53Å; S408-Y453 WeakPolarHBondContact CA-O 3.43Å
409	Q	95.4	Very high	93.1	Very high	15 Å²	15	55.3 Å²	55.3	7%	0.07	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.4	175	171	-178.4	-18.1	0	0	109.5	P383 I384 Y407 Y413 A452 Y453	P383-Q409 WeakPolarHBondContact O-CA 3.22Å; I384-Q409 HydrophobicContact CD1-CB 3.72Å; I384-Q409 HydrophobicContact CD1-CG 3.67Å; Y407-Q409 HydrophobicContact CD2-CB 4.3Å; Y407-Q409 HydrophobicContact CE2-CB 4.11Å; Q409-Y413 HydrophobicContact CG-CD1 4.15Å; Q409-Y413 PolarHBondContact NE2-O 2.8Å; Q409-A452 CarbonylContact O-C 3.48Å; Q409-A452 WeakPolarHBondContact O-CA 3.48Å; Q409-A452 WeakPolarHBondContact O-CB 3.47Å; Q409-Y453 PolarHBondContact N-O 3.46Å; Q409-Y453 PolarHBondContact O-N 3.49Å
410	E	93.6	Very high	93.4	Very high	72 Å²	72	55.5 Å²	55.5	34%	0.336	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	138.3	173.3	-67.3	-159.8	161.4	0	0	111.7	P383 T412 Y413	P383-E410 PolarHBondContact O-N 3.37Å; E410-T412 PolarHBondContact O-N 3.45Å; E410-T412 VanDerWaalsContact O-N 3.15Å; E410-T412 PolarHBondContact OE2-OG1 2.77Å; E410-Y413 WeakPolarHBondContact O-CB 3.28Å; E410-Y413 PolarHBondContact O-N 2.91Å
411	M	92	Very high	93.9	Very high	73 Å²	73	48.3 Å²	48.3	36%	0.36	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.1	-178.5	-69	-176.8	176.5	0	0	113.3	R448 T449 T451 Y453	M411-R448 HydrophobicContact CE-CB 4.45Å; M411-T449 WeakPolarHBondContact CE-O 3.35Å; M411-T451 WeakPolarHBondContact CG-O 3.31Å; M411-T451 PolarHBondContact N-O 2.78Å; M411-Y453 HydrophobicContact CB-CE2 4.2Å; M411-Y453 HydrophobicContact CE-CD1 4.31Å; M411-Y453 HydrophobicContact CE-CE1 3.97Å; M411-Y453 HydrophobicContact CE-CE2 4.49Å; M411-Y453 HydrophobicContact CG-CD2 3.95Å; M411-Y453 HydrophobicContact CG-CE2 3.58Å
412	T	89.8	Confident	94.1	Very high	113 Å²	113	45.4 Å²	45.4	69%	0.693	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-21.6	176.2	52.1	0	0	0	0	112.5	E410 K414	E410-T412 PolarHBondContact O-N 3.45Å; E410-T412 VanDerWaalsContact O-N 3.15Å; E410-T412 PolarHBondContact OE2-OG1 2.77Å; T412-K414 PolarHBondContact O-N 3.29Å
413	Y	90.4	Very high	94.3	Very high	34 Å²	34	42.3 Å²	42.3	13%	0.133	22%	0.217	C	C	.	.			trans	-71.7	116	-179.2	-178.7	-104.3	0	0	0	111.3	P383 I384 Q409 E410 C415 D419 I483	P383-Y413 HydrophobicContact CB-CD2 3.69Å; P383-Y413 HydrophobicContact CB-CE2 4.49Å; P383-Y413 HydrophobicContact CB-CG 3.99Å; P383-Y413 HydrophobicContact CG-CD2 4.01Å; P383-Y413 HydrophobicContact CG-CE2 4.37Å; I384-Y413 HydrophobicContact CD1-CD1 4.02Å; I384-Y413 HydrophobicContact CD1-CE1 4.28Å; Q409-Y413 HydrophobicContact CG-CD1 4.15Å; Q409-Y413 PolarHBondContact NE2-O 2.8Å; E410-Y413 WeakPolarHBondContact O-CB 3.28Å; E410-Y413 PolarHBondContact O-N 2.91Å; Y413-C415 HydrophobicContact CD1-CB 4.32Å; Y413-C415 HydrophobicContact CE1-CB 4.03Å; Y413-C415 PolarHBondContact O-N 3.4Å; Y413-D419 PolarHBondContact OH-OD2 3.19Å; Y413-I483 HydrophobicContact CE2-CD1 3.6Å; Y413-I483 WeakPolarHBondContact OH-CD1 3.45Å
414	K	88	Confident	94.3	Very high	157 Å²	157	41.4 Å²	41.4	68%	0.683	21%	0.212	S	C	*	.			trans	-87.7	86.9	177.7	-65.4	-174.9	-177.8	179	0	111.1	T412 G416 R478	T412-K414 PolarHBondContact O-N 3.29Å; K414-G416 PolarHBondContact O-N 3.36Å; K414-R478 PolarHBondContact O-NH1 3.45Å
415	C	88.8	Confident	94.4	Very high	47 Å²	47	42.9 Å²	42.9	32%	0.318	22%	0.218	S	C	.	.			trans	-53.6	126.1	175.9	-170.4	0	0	0	0	112	Y413 M440	Y413-C415 HydrophobicContact CD1-CB 4.32Å; Y413-C415 HydrophobicContact CE1-CB 4.03Å; Y413-C415 PolarHBondContact O-N 3.4Å; C415-M440 VanDerWaalsContact SG-CB 3.57Å
416	G	90.6	Very high	94.2	Very high	14 Å²	14	45.8 Å²	45.8	14%	0.144	23%	0.233	C	C	.	.			trans	-76.1	155.8	170.2	0	0	0	0	0	112.2	K414 F418 D419	K414-G416 PolarHBondContact O-N 3.36Å; G416-F418 PolarHBondContact O-N 3.05Å; G416-D419 VanDerWaalsContact N-CG 3.3Å; G416-D419 PolarHBondContact N-OD2 3.23Å; G416-D419 PolarHBondContact O-N 3.13Å
417	L	93	Very high	94.1	Very high	125 Å²	125	52.4 Å²	52.4	65%	0.654	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.1	176.6	-69.4	175.3	0	0	0	113.2	I441	L417-I441 HydrophobicContact CD2-CG2 4.36Å
418	F	94	Very high	94	Very high	127 Å²	127	52.7 Å²	52.7	56%	0.557	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	14.1	-178.7	-59	-68.8	0	0	0	112.5	G416 W420 Y439 Q477	G416-F418 PolarHBondContact O-N 3.05Å; F418-W420 VanDerWaalsContact O-CD1 3.23Å; F418-Y439 HydrophobicContact CB-CE1 4.46Å; F418-Y439 HydrophobicContact CD1-CE1 4.22Å; F418-Q477 HydrophobicContact CB-CB 4Å; F418-Q477 HydrophobicContact CB-CG 4.04Å
419	D	95.7	Very high	93.9	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.265	C	S	.	.			trans	-73.1	140.5	169.9	-65.9	0.5	0	0	0	108.7	Y413 G416 Y439 M440 F475 Q477	Y413-D419 PolarHBondContact OH-OD2 3.19Å; G416-D419 VanDerWaalsContact N-CG 3.3Å; G416-D419 PolarHBondContact N-OD2 3.23Å; G416-D419 PolarHBondContact O-N 3.13Å; D419-Y439 WeakPolarHBondContact O-CA 3.41Å; D419-M440 HydrophobicContact CB-CG 4.37Å; D419-M440 HydrophobicContact CB-SD 3.87Å; D419-M440 PolarHBondContact O-N 3.5Å; D419-F475 WeakPolarHBondContact CA-O 3.49Å; D419-Q477 PolarHBondContact OD1-N 3.01Å
420	W	96.1	Very high	93.9	Very high	11 Å²	11	53.1 Å²	53.1	4%	0.042	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	152.9	-174.3	53.2	-98	0	0	0	112.1	F418 F424 W432 V434 F437 S438 Y439 C474 F475	F418-W420 VanDerWaalsContact O-CD1 3.23Å; W420-F424 AromaticContact CH2-CZ 3.89Å; W420-F424 HydrophobicContact CH2-CZ 3.89Å; W420-F424 HydrophobicContact CZ3-CE2 4.08Å; W420-F424 AromaticContact CZ3-CZ 3.83Å; W420-F424 HydrophobicContact CZ3-CZ 3.83Å; W420-W432 AromaticContact CZ2-CE3 4Å; W420-W432 HydrophobicContact CZ2-CE3 4Å; W420-W432 HydrophobicContact CZ2-CH2 4.33Å; W420-W432 AromaticContact CZ2-CZ3 3.63Å; W420-W432 HydrophobicContact CZ2-CZ3 3.63Å; W420-V434 HydrophobicContact CH2-CB 4.18Å; W420-V434 HydrophobicContact CH2-CG1 4.28Å; W420-V434 HydrophobicContact CH2-CG2 4.36Å; W420-V434 HydrophobicContact CZ3-CB 4.19Å; W420-V434 HydrophobicContact CZ3-CG2 3.87Å; W420-F437 HydrophobicContact CB-CB 4.47Å; W420-F437 HydrophobicContact CB-CD2 4Å; W420-F437 HydrophobicContact CD2-CB 4.23Å; W420-F437 HydrophobicContact CD2-CG 4.49Å; W420-F437 HydrophobicContact CE3-CB 3.78Å; W420-F437 HydrophobicContact CE3-CG 4.48Å; W420-F437 HydrophobicContact CG-CD2 4.17Å; W420-F437 HydrophobicContact CZ3-CB 4.43Å; W420-S438 WeakPolarHBondContact CA-O 3.33Å; W420-S438 WeakPolarHBondContact CB-O 2.81Å; W420-Y439 HydrophobicContact CB-CD1 4.09Å; W420-C474 WeakPolarHBondContact O-CA 3.34Å; W420-F475 HydrophobicContact CD2-CB 3.64Å; W420-F475 HydrophobicContact CD2-CG 4.44Å; W420-F475 AromaticContact CE2-CD1 3.79Å; W420-F475 AromaticContact CE2-CG 3.64Å; W420-F475 HydrophobicContact CE3-CB 3.92Å; W420-F475 HydrophobicContact CG-CB 4.31Å; W420-F475 HydrophobicContact CH2-CB 3.66Å; W420-F475 HydrophobicContact CH2-CD2 4.29Å; W420-F475 HydrophobicContact CH2-CG 4.09Å; W420-F475 HydrophobicContact CZ2-CB 3.34Å; W420-F475 AromaticContact CZ2-CD1 3.92Å; W420-F475 HydrophobicContact CZ2-CD1 3.92Å; W420-F475 AromaticContact CZ2-CD2 3.87Å; W420-F475 HydrophobicContact CZ2-CD2 3.87Å; W420-F475 AromaticContact CZ2-CG 3.44Å; W420-F475 HydrophobicContact CZ2-CG 3.44Å; W420-F475 VanDerWaalsContact CZ2-CG 3.44Å; W420-F475 HydrophobicContact CZ3-CB 3.92Å; W420-F475 PolarHBondContact N-O 3.08Å; W420-F475 VanDerWaalsContact N-O 3.16Å; W420-F475 AromaticContact NE1-CD1 3.5Å; W420-F475 AromaticContact NE1-CG 3.86Å; W420-F475 PolarHBondContact O-N 2.62Å
421	I	97.6	Very high	93.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	124.2	169.3	-73	167.5	0	0	0	107.6	F386 Y407 F437 S438 M440 I457 F459 F472 G473 C474	F386-I421 HydrophobicContact CE1-CD1 3.92Å; F386-I421 HydrophobicContact CE1-CG1 4.1Å; F386-I421 HydrophobicContact CE1-CG2 3.77Å; F386-I421 HydrophobicContact CZ-CD1 4.43Å; F386-I421 HydrophobicContact CZ-CG1 4.23Å; F386-I421 HydrophobicContact CZ-CG2 4.21Å; Y407-I421 HydrophobicContact CD1-CD1 3.46Å; Y407-I421 VanDerWaalsContact CD1-CD1 3.46Å; Y407-I421 HydrophobicContact CD2-CD1 4.29Å; Y407-I421 HydrophobicContact CE1-CD1 3.3Å; Y407-I421 HydrophobicContact CE2-CD1 4.18Å; Y407-I421 HydrophobicContact CG-CD1 3.95Å; I421-F437 CarbonylContact O-C 3.57Å; I421-F437 VanDerWaalsContact O-CA 3.23Å; I421-F437 WeakPolarHBondContact O-CA 3.41Å; I421-F437 WeakPolarHBondContact O-CB 3.46Å; I421-S438 PolarHBondContact N-O 2.81Å; I421-S438 PolarHBondContact O-N 3.44Å; I421-M440 HydrophobicContact CD1-CG 4.23Å; I421-M440 HydrophobicContact CG1-CG 4.11Å; I421-I457 HydrophobicContact CB-CD1 4.28Å; I421-I457 HydrophobicContact CD1-CD1 3.78Å; I421-I457 HydrophobicContact CG1-CD1 4.43Å; I421-F459 HydrophobicContact CG2-CZ 4.26Å; I421-F472 HydrophobicContact CG2-CB 4.16Å; I421-F472 HydrophobicContact CG2-CD1 4.04Å; I421-F472 HydrophobicContact CG2-CG 4.32Å; I421-G473 CarbonylContact C-O 3.59Å; I421-G473 WeakPolarHBondContact CA-O 3.17Å; I421-C474 HydrophobicContact CG1-CB 4.23Å
422	G	96.8	Very high	93.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	153	-178.2	0	0	0	0	0	112.7	F424 A436 F472 G473	G422-F424 WeakPolarHBondContact O-CD2 3.46Å; G422-A436 CarbonylContact C-O 3.6Å; G422-A436 VanDerWaalsContact CA-O 3.25Å; G422-A436 WeakPolarHBondContact CA-O 3.41Å; G422-F472 CarbonylContact O-C 3.55Å; G422-F472 VanDerWaalsContact O-CA 3.23Å; G422-F472 WeakPolarHBondContact O-CA 3.37Å; G422-G473 PolarHBondContact N-O 2.96Å; G422-G473 PolarHBondContact O-N 2.87Å
423	V	97.6	Very high	93.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.2	172.3	-173.8	0	0	0	0	108.4	W397 L435 A436 F459 P465 Y470 F472	W397-V423 HydrophobicContact CH2-CG2 4.04Å; W397-V423 HydrophobicContact CZ3-CG2 3.84Å; V423-L435 WeakPolarHBondContact O-CB 3.38Å; V423-L435 PolarHBondContact O-N 3.41Å; V423-A436 PolarHBondContact N-O 3.17Å; V423-F459 HydrophobicContact CG2-CD1 4.14Å; V423-F459 HydrophobicContact CG2-CE1 3.78Å; V423-F459 HydrophobicContact CG2-CZ 4.22Å; V423-P465 HydrophobicContact CG1-CG 4.1Å; V423-Y470 HydrophobicContact CG1-CD1 4.15Å; V423-Y470 HydrophobicContact CG1-CG 4.26Å; V423-F472 HydrophobicContact CG2-CD1 4.19Å; V423-F472 HydrophobicContact CG2-CE1 3.95Å
424	F	97.1	Very high	94	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	140	179.9	-64.7	-95.4	0	0	0	109.8	W420 G422 F428 D433 V434 Y470 L471 L482	W420-F424 AromaticContact CH2-CZ 3.89Å; W420-F424 HydrophobicContact CH2-CZ 3.89Å; W420-F424 HydrophobicContact CZ3-CE2 4.08Å; W420-F424 AromaticContact CZ3-CZ 3.83Å; W420-F424 HydrophobicContact CZ3-CZ 3.83Å; G422-F424 WeakPolarHBondContact O-CD2 3.46Å; F424-F428 HydrophobicContact CB-CB 4.29Å; F424-F428 HydrophobicContact CB-CD1 3.92Å; F424-F428 HydrophobicContact CB-CG 4.21Å; F424-F428 HydrophobicContact CD1-CB 4.22Å; F424-F428 HydrophobicContact CD1-CD2 4.27Å; F424-F428 HydrophobicContact CD1-CG 4.11Å; F424-D433 WeakPolarHBondContact CD1-O 3.31Å; F424-V434 HydrophobicContact CE1-CB 3.92Å; F424-V434 HydrophobicContact CE2-CG2 4.38Å; F424-V434 HydrophobicContact CZ-CB 3.91Å; F424-V434 HydrophobicContact CZ-CG2 4.21Å; F424-Y470 CarbonylContact O-C 3.58Å; F424-Y470 VanDerWaalsContact O-CA 3.22Å; F424-Y470 WeakPolarHBondContact O-CA 3.47Å; F424-Y470 WeakPolarHBondContact O-CB 3.49Å; F424-Y470 WeakPolarHBondContact O-CD1 3.45Å; F424-L471 HydrophobicContact CB-CD1 4.16Å; F424-L471 HydrophobicContact CB-CG 4.19Å; F424-L471 PolarHBondContact N-O 2.63Å; F424-L471 PolarHBondContact O-N 3.01Å; F424-L482 HydrophobicContact CE1-CD1 4.41Å; F424-L482 HydrophobicContact CE2-CD1 4.48Å; F424-L482 HydrophobicContact CE2-CD2 4.14Å; F424-L482 HydrophobicContact CZ-CD1 4.09Å; F424-L482 HydrophobicContact CZ-CD2 3.93Å
425	H	96.6	Very high	94.3	Very high	80 Å²	80	44.5 Å²	44.5	37%	0.37	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	143.1	165.4	-178.7	-100.2	0	0	0	109.6	K427 F428 L435 Y470	H425-K427 PolarHBondContact ND1-N 3.42Å; H425-K427 VanDerWaalsContact ND1-N 3.16Å; H425-K427 PolarHBondContact O-N 3.31Å; H425-F428 WeakPolarHBondContact O-CB 3.41Å; H425-F428 VanDerWaalsContact O-CD1 3.3Å; H425-F428 WeakPolarHBondContact O-CD1 3.38Å; H425-F428 PolarHBondContact O-N 2.74Å; H425-L435 HydrophobicContact CB-CD1 4.27Å; H425-Y470 HydrophobicContact CB-CD1 4.36Å; H425-Y470 HydrophobicContact CB-CE1 4.27Å
426	L	94.9	Very high	94.6	Very high	61 Å²	61	42.8 Å²	42.8	32%	0.319	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-31.8	-177.1	-176.8	66.1	0	0	0	114.2	T469 L471 P488	L426-T469 HydrophobicContact CB-CG2 4.18Å; L426-T469 HydrophobicContact CD1-CG2 4.47Å; L426-T469 HydrophobicContact CD2-CG2 3.9Å; L426-T469 HydrophobicContact CG-CG2 4.41Å; L426-T469 PolarHBondContact N-O 3.24Å; L426-T469 VanDerWaalsContact N-O 3.12Å; L426-L471 HydrophobicContact CD1-CD2 3.94Å; L426-P488 HydrophobicContact CD1-CB 4.18Å; L426-P488 HydrophobicContact CD1-CG 3.86Å
427	K	94.3	Very high	94.8	Very high	145 Å²	145	46.3 Å²	46.3	63%	0.63	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	28.6	-179.6	-56	-178.4	-179.2	176.2	0	113.5	R166 H425	R166-K427 PolarHBondContact NH2-O 2.66Å; R166-K427 VanDerWaalsContact NH2-O 3.17Å; H425-K427 PolarHBondContact ND1-N 3.42Å; H425-K427 VanDerWaalsContact ND1-N 3.16Å; H425-K427 PolarHBondContact O-N 3.31Å
428	F	95.5	Very high	95	Very high	5 Å²	5	41.4 Å²	41.4	2%	0.022	20%	0.199	C	C	.	.			trans	-51.8	144.2	177.3	70.6	-90.1	0	0	0	111.8	A143 R166 L169 F424 H425 D430 D433 L471	A143-F428 HydrophobicContact CB-CD2 3.87Å; A143-F428 HydrophobicContact CB-CE2 3.43Å; A143-F428 VanDerWaalsContact CB-CE2 3.43Å; A143-F428 HydrophobicContact CB-CZ 4.2Å; R166-F428 HydrophobicContact CB-CE1 4.41Å; R166-F428 HydrophobicContact CB-CZ 4.33Å; R166-F428 HydrophobicContact CG-CE1 4.11Å; R166-F428 HydrophobicContact CG-CE2 4.45Å; R166-F428 HydrophobicContact CG-CZ 3.98Å; R166-F428 PolarHBondContact NE-O 3.43Å; R166-F428 PolarHBondContact NH2-O 3.13Å; L169-F428 HydrophobicContact CD1-CE2 3.65Å; L169-F428 HydrophobicContact CD1-CZ 3.61Å; F424-F428 HydrophobicContact CB-CB 4.29Å; F424-F428 HydrophobicContact CB-CD1 3.92Å; F424-F428 HydrophobicContact CB-CG 4.21Å; F424-F428 HydrophobicContact CD1-CB 4.22Å; F424-F428 HydrophobicContact CD1-CD2 4.27Å; F424-F428 HydrophobicContact CD1-CG 4.11Å; H425-F428 WeakPolarHBondContact O-CB 3.41Å; H425-F428 VanDerWaalsContact O-CD1 3.3Å; H425-F428 WeakPolarHBondContact O-CD1 3.38Å; H425-F428 PolarHBondContact O-N 2.74Å; F428-D430 WeakPolarHBondContact CD2-O 3.07Å; F428-D433 HydrophobicContact CB-CB 4.09Å; F428-L471 HydrophobicContact CD1-CD2 4.3Å; F428-L471 HydrophobicContact CE1-CD1 4.03Å; F428-L471 HydrophobicContact CE1-CD2 4.03Å
429	V	94.8	Very high	95.1	Very high	39 Å²	39	40 Å²	40	24%	0.236	19%	0.19	C	C	.	.	S	Bend	trans	-98.3	-41.7	-169.1	174.6	0	0	0	0	110.6	K134 A138 A143 R144 D433	K134-V429 HydrophobicContact CB-CG1 4.49Å; K134-V429 HydrophobicContact CD-CG1 3.53Å; K134-V429 HydrophobicContact CG-CG1 3.12Å; A138-V429 HydrophobicContact CB-CB 4.05Å; A138-V429 HydrophobicContact CB-CG1 3.77Å; A138-V429 HydrophobicContact CB-CG2 3.78Å; A143-V429 CarbonylContact C-O 3.54Å; A143-V429 WeakPolarHBondContact CA-O 3.49Å; R144-V429 PolarHBondContact N-O 3.37Å; V429-D433 VanDerWaalsContact CA-OD2 3.28Å; V429-D433 WeakPolarHBondContact CA-OD2 3.32Å; V429-D433 WeakPolarHBondContact CB-OD2 3.47Å; V429-D433 PolarHBondContact N-OD2 2.99Å
430	D	94.3	Very high	95.1	Very high	11 Å²	11	40.2 Å²	40.2	6%	0.059	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-117.3	147.7	178	-66.3	-31.6	0	0	0	110	R144 T146 F428 W432 D433	R144-D430 WeakPolarHBondContact CB-OD1 3.36Å; R144-D430 IonicContact CZ-OD1 3.06Å; R144-D430 IonicContact CZ-OD2 3.37Å; R144-D430 IonicContact NE-OD1 3.4Å; R144-D430 PolarHBondContact NE-OD1 2.76Å; R144-D430 IonicContact NE-OD2 2.58Å; R144-D430 VanDerWaalsContact NH2-CG 3.27Å; R144-D430 IonicContact NH2-OD1 2.6Å; R144-D430 PolarHBondContact NH2-OD1 3.22Å; R144-D430 IonicContact NH2-OD2 3.87Å; R144-D430 PolarHBondContact NH2-OD2 3.34Å; T146-D430 HydrophobicContact CG2-CB 3.73Å; F428-D430 WeakPolarHBondContact CD2-O 3.07Å; D430-W432 PolarHBondContact O-N 2.9Å; D430-D433 PolarHBondContact N-OD2 3.34Å; D430-D433 WeakPolarHBondContact O-CB 3.27Å; D430-D433 PolarHBondContact O-N 2.73Å
431	D	92.7	Very high	95	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-1.6	172.6	66.9	-11.1	0	0	0	113.9	R144 T146 L482	R144-D431 PolarHBondContact O-N 3.08Å; R144-D431 VanDerWaalsContact O-N 3.07Å; T146-D431 WeakPolarHBondContact CB-OD1 3.28Å; T146-D431 WeakPolarHBondContact CG2-OD1 3.2Å; T146-D431 PolarHBondContact N-OD1 2.84Å; T146-D431 PolarHBondContact OG1-OD1 3.41Å; D431-L482 HydrophobicContact CB-CD1 3.72Å; D431-L482 HydrophobicContact CB-CG 4.1Å
432	W	90.7	Very high	94.9	Very high	99 Å²	99	47.8 Å²	47.8	38%	0.375	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	1.4	171.2	-162.4	-102.4	0	0	0	114.2	T146 N148 W420 D430 V434 F475	T146-W432 HydrophobicContact CG2-CB 3.86Å; N148-W432 WeakPolarHBondContact OD1-CZ3 3.2Å; W420-W432 AromaticContact CZ2-CE3 4Å; W420-W432 HydrophobicContact CZ2-CE3 4Å; W420-W432 HydrophobicContact CZ2-CH2 4.33Å; W420-W432 AromaticContact CZ2-CZ3 3.63Å; W420-W432 HydrophobicContact CZ2-CZ3 3.63Å; D430-W432 PolarHBondContact O-N 2.9Å; W432-V434 PolarHBondContact O-N 2.75Å; W432-F475 HydrophobicContact CZ3-CZ 4.44Å
433	D	91.2	Very high	94.8	Very high	62 Å²	62	48.9 Å²	48.9	33%	0.332	25%	0.249	S	C	.	.			trans	-75.4	48.5	177.2	-73.4	-16.8	0	0	0	112.6	F424 F428 V429 D430	F424-D433 WeakPolarHBondContact CD1-O 3.31Å; F428-D433 HydrophobicContact CB-CB 4.09Å; V429-D433 VanDerWaalsContact CA-OD2 3.28Å; V429-D433 WeakPolarHBondContact CA-OD2 3.32Å; V429-D433 WeakPolarHBondContact CB-OD2 3.47Å; V429-D433 PolarHBondContact N-OD2 2.99Å; D430-D433 PolarHBondContact N-OD2 3.34Å; D430-D433 WeakPolarHBondContact O-CB 3.27Å; D430-D433 PolarHBondContact O-N 2.73Å
434	V	93.7	Very high	94.7	Very high	31 Å²	31	53.7 Å²	53.7	19%	0.188	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.8	-179.4	64.4	0	0	0	0	110.1	W420 F424 W432 A436 F437	W420-V434 HydrophobicContact CH2-CB 4.18Å; W420-V434 HydrophobicContact CH2-CG1 4.28Å; W420-V434 HydrophobicContact CH2-CG2 4.36Å; W420-V434 HydrophobicContact CZ3-CB 4.19Å; W420-V434 HydrophobicContact CZ3-CG2 3.87Å; F424-V434 HydrophobicContact CE1-CB 3.92Å; F424-V434 HydrophobicContact CE2-CG2 4.38Å; F424-V434 HydrophobicContact CZ-CB 3.91Å; F424-V434 HydrophobicContact CZ-CG2 4.21Å; W432-V434 PolarHBondContact O-N 2.75Å; V434-A436 WeakPolarHBondContact CG2-O 3.49Å; V434-F437 HydrophobicContact CG1-CD1 4.33Å; V434-F437 HydrophobicContact CG2-CB 3.93Å; V434-F437 HydrophobicContact CG2-CD1 4.49Å
435	L	94.9	Very high	94.6	Very high	76 Å²	76	57.8 Å²	57.8	40%	0.398	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-37.8	179.7	-60.5	177	0	0	0	111.7	V423 H425 P465 Y470	V423-L435 WeakPolarHBondContact O-CB 3.38Å; V423-L435 PolarHBondContact O-N 3.41Å; H425-L435 HydrophobicContact CB-CD1 4.27Å; L435-P465 HydrophobicContact CD1-CB 4.09Å; L435-Y470 HydrophobicContact CD1-CD1 3.84Å; L435-Y470 HydrophobicContact CD1-CE1 3.49Å; L435-Y470 VanDerWaalsContact CD1-CE1 3.49Å
436	A	94.7	Very high	94.5	Very high	11 Å²	11	59.7 Å²	59.7	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	148.4	175.3	0	0	0	0	0	108.7	G422 V423 V434 C463	G422-A436 CarbonylContact C-O 3.6Å; G422-A436 VanDerWaalsContact CA-O 3.25Å; G422-A436 WeakPolarHBondContact CA-O 3.41Å; V423-A436 PolarHBondContact N-O 3.17Å; V434-A436 WeakPolarHBondContact CG2-O 3.49Å; A436-C463 HydrophobicContact CB-CB 3.9Å; A436-C463 VanDerWaalsContact CB-O 3.22Å; A436-C463 WeakPolarHBondContact CB-O 3.26Å
437	F	95.6	Very high	94.6	Very high	88 Å²	88	59.4 Å²	59.4	39%	0.386	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	160.1	175.8	67.4	-87.1	0	0	0	111.4	W420 I421 V434 Y439	W420-F437 HydrophobicContact CB-CB 4.47Å; W420-F437 HydrophobicContact CB-CD2 4Å; W420-F437 HydrophobicContact CD2-CB 4.23Å; W420-F437 HydrophobicContact CD2-CG 4.49Å; W420-F437 HydrophobicContact CE3-CB 3.78Å; W420-F437 HydrophobicContact CE3-CG 4.48Å; W420-F437 HydrophobicContact CG-CD2 4.17Å; W420-F437 HydrophobicContact CZ3-CB 4.43Å; I421-F437 CarbonylContact O-C 3.57Å; I421-F437 VanDerWaalsContact O-CA 3.23Å; I421-F437 WeakPolarHBondContact O-CA 3.41Å; I421-F437 WeakPolarHBondContact O-CB 3.46Å; V434-F437 HydrophobicContact CG1-CD1 4.33Å; V434-F437 HydrophobicContact CG2-CB 3.93Å; V434-F437 HydrophobicContact CG2-CD1 4.49Å; F437-Y439 HydrophobicContact CE2-CD2 4.46Å; F437-Y439 HydrophobicContact CE2-CE1 4.27Å; F437-Y439 AromaticContact CE2-CE2 3.89Å; F437-Y439 HydrophobicContact CE2-CE2 3.89Å; F437-Y439 AromaticContact CE2-CZ 3.79Å
438	S	96.6	Very high	94.5	Very high	23 Å²	23	59.7 Å²	59.7	16%	0.161	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138	167.4	179.8	0	0	0	0	109.1	W420 I421 I457	W420-S438 WeakPolarHBondContact CA-O 3.33Å; W420-S438 WeakPolarHBondContact CB-O 2.81Å; I421-S438 PolarHBondContact N-O 2.81Å; I421-S438 PolarHBondContact O-N 3.44Å; S438-I457 VanDerWaalsContact CB-CG2 3.48Å; S438-I457 WeakPolarHBondContact OG-CG2 3.47Å
439	Y	96.5	Very high	94.3	Very high	97 Å²	97	63.1 Å²	63.1	38%	0.38	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	140.1	172.8	-65.4	-72.9	0	0	0	110.5	F418 D419 W420 F437 I441 A442	F418-Y439 HydrophobicContact CB-CE1 4.46Å; F418-Y439 HydrophobicContact CD1-CE1 4.22Å; D419-Y439 WeakPolarHBondContact O-CA 3.41Å; W420-Y439 HydrophobicContact CB-CD1 4.09Å; F437-Y439 HydrophobicContact CE2-CD2 4.46Å; F437-Y439 HydrophobicContact CE2-CE1 4.27Å; F437-Y439 AromaticContact CE2-CE2 3.89Å; F437-Y439 HydrophobicContact CE2-CE2 3.89Å; F437-Y439 AromaticContact CE2-CZ 3.79Å; Y439-I441 PolarHBondContact O-N 2.79Å; Y439-A442 WeakPolarHBondContact O-CB 3.12Å; Y439-A442 PolarHBondContact O-N 3.12Å
440	M	95.4	Very high	94.2	Very high	5 Å²	5	66 Å²	66	3%	0.025	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-64.9	-25.9	-179.3	-70.2	-175.7	72.9	0	0	112.5	I384 Y407 C415 D419 I421 A442 A443 C474	I384-M440 HydrophobicContact CD1-CE 3.64Å; I384-M440 HydrophobicContact CG1-CE 4.33Å; Y407-M440 HydrophobicContact CE2-CE 3.67Å; C415-M440 VanDerWaalsContact SG-CB 3.57Å; D419-M440 HydrophobicContact CB-CG 4.37Å; D419-M440 HydrophobicContact CB-SD 3.87Å; D419-M440 PolarHBondContact O-N 3.5Å; I421-M440 HydrophobicContact CD1-CG 4.23Å; I421-M440 HydrophobicContact CG1-CG 4.11Å; M440-A442 PolarHBondContact O-N 3.33Å; M440-A443 WeakPolarHBondContact O-CB 3.15Å; M440-A443 PolarHBondContact O-N 3.28Å; M440-C474 PolarHBondContact SD-SG 3.02Å
441	I	94.1	Very high	94	Very high	105 Å²	105	70.3 Å²	70.3	54%	0.538	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-64.5	-16.5	174.5	62.7	170.1	0	0	0	113.6	L417 Y439 A443	L417-I441 HydrophobicContact CD2-CG2 4.36Å; Y439-I441 PolarHBondContact O-N 2.79Å; I441-A443 VanDerWaalsContact C-N 3.29Å
442	A	94.2	Very high	94.1	Very high	65 Å²	65	70.6 Å²	70.6	54%	0.537	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-85.5	-3.1	174.5	0	0	0	0	0	112.7	Y439 M440	Y439-A442 WeakPolarHBondContact O-CB 3.12Å; Y439-A442 PolarHBondContact O-N 3.12Å; M440-A442 PolarHBondContact O-N 3.33Å
443	A	95.9	Very high	94.3	Very high	23 Å²	23	69.1 Å²	69.1	19%	0.19	37%	0.371	C	S	.	.			trans	-70.8	150.5	177.7	0	0	0	0	0	111.7	Y407 M440 I441 Q455 N456 I457	Y407-A443 HydrophobicContact CE1-CB 4.44Å; Y407-A443 WeakPolarHBondContact OH-CB 3.45Å; M440-A443 WeakPolarHBondContact O-CB 3.15Å; M440-A443 PolarHBondContact O-N 3.28Å; I441-A443 VanDerWaalsContact C-N 3.29Å; A443-Q455 HydrophobicContact CB-CB 4.14Å; A443-N456 VanDerWaalsContact CA-O 3.24Å; A443-N456 WeakPolarHBondContact CA-O 3.35Å; A443-I457 HydrophobicContact CB-CD1 4.03Å; A443-I457 HydrophobicContact CB-CG1 3.47Å; A443-I457 VanDerWaalsContact CB-CG1 3.47Å
444	F	95.8	Very high	94.6	Very high	102 Å²	102	67 Å²	67	45%	0.447	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.9	173.6	57	-85.6	0	0	0	110.5	M404 K446 Q455 N456	M404-F444 HydrophobicContact SD-CE2 4.48Å; M404-F444 HydrophobicContact SD-CZ 3.74Å; F444-K446 PolarHBondContact O-N 3.31Å; F444-Q455 WeakPolarHBondContact O-CA 3.31Å; F444-N456 HydrophobicContact CD1-CB 4.35Å; F444-N456 WeakPolarHBondContact CD1-O 3.35Å; F444-N456 HydrophobicContact CD2-CB 4.03Å; F444-N456 HydrophobicContact CE1-CB 3.89Å; F444-N456 HydrophobicContact CE2-CB 3.55Å; F444-N456 HydrophobicContact CG-CB 4.42Å; F444-N456 HydrophobicContact CZ-CB 3.47Å; F444-N456 VanDerWaalsContact CZ-CB 3.47Å; F444-N456 PolarHBondContact N-O 3.29Å; F444-N456 PolarHBondContact O-N 2.85Å
445	E	95.1	Very high	94.8	Very high	85 Å²	85	66.9 Å²	66.9	40%	0.397	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	125.9	-178.6	-170.5	-177.9	137.5	0	0	110.6	S447 R448	E445-S447 WeakPolarHBondContact CG-O 3.1Å; E445-R448 VanDerWaalsContact CD-NH2 3.27Å; E445-R448 IonicContact OE1-CZ 3.25Å; E445-R448 VanDerWaalsContact OE1-CZ 3.28Å; E445-R448 IonicContact OE1-NE 3.67Å; E445-R448 PolarHBondContact OE1-NE 2.92Å; E445-R448 IonicContact OE1-NH2 3.12Å; E445-R448 PolarHBondContact OE1-NH2 3.02Å; E445-R448 IonicContact OE2-CZ 3.28Å; E445-R448 IonicContact OE2-NE 2.74Å; E445-R448 IonicContact OE2-NH2 2.99Å; E445-R448 PolarHBondContact OE2-NH2 2.97Å
446	K	94.3	Very high	94.9	Very high	120 Å²	120	63.7 Å²	63.7	52%	0.522	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-43.9	171	-177.8	-177.2	-177	174.8	0	110.7	T406 F444 V454	T406-K446 HydrophobicContact CG2-CD 4.31Å; F444-K446 PolarHBondContact O-N 3.31Å; K446-V454 HydrophobicContact CB-CG1 4.27Å; K446-V454 HydrophobicContact CD-CG1 4.27Å; K446-V454 PolarHBondContact N-O 2.94Å
447	S	95.7	Very high	95	Very high	55 Å²	55	63.2 Å²	63.2	39%	0.385	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	177.7	176.9	64.4	0	0	0	0	110.5	E445 V454	E445-S447 WeakPolarHBondContact CG-O 3.1Å; S447-V454 PolarHBondContact N-O 2.9Å; S447-V454 PolarHBondContact O-N 3.45Å; S447-V454 WeakPolarHBondContact OG-CB 3.36Å
448	R	93.7	Very high	95	Very high	152 Å²	152	63.4 Å²	63.4	57%	0.574	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.9	174.4	63.5	-179.3	66.4	-171.1	-3.1	111	M411 E445 A452 Y453	M411-R448 HydrophobicContact CE-CB 4.45Å; E445-R448 VanDerWaalsContact CD-NH2 3.27Å; E445-R448 IonicContact OE1-CZ 3.25Å; E445-R448 VanDerWaalsContact OE1-CZ 3.28Å; E445-R448 IonicContact OE1-NE 3.67Å; E445-R448 PolarHBondContact OE1-NE 2.92Å; E445-R448 IonicContact OE1-NH2 3.12Å; E445-R448 PolarHBondContact OE1-NH2 3.02Å; E445-R448 IonicContact OE2-CZ 3.28Å; E445-R448 IonicContact OE2-NE 2.74Å; E445-R448 IonicContact OE2-NH2 2.99Å; E445-R448 PolarHBondContact OE2-NH2 2.97Å; R448-A452 WeakPolarHBondContact CA-O 3.43Å; R448-Y453 HydrophobicContact CB-CD1 4.15Å
449	T	91	Very high	95	Very high	76 Å²	76	62.4 Å²	62.4	47%	0.466	33%	0.334	S	S	.	.			trans	-107.5	-175.2	167.4	69.6	0	0	0	0	109.3	M411 T451 A452	M411-T449 WeakPolarHBondContact CE-O 3.35Å; T449-T451 PolarHBondContact O-N 3.16Å; T449-T451 PolarHBondContact OG1-N 3.28Å; T449-A452 PolarHBondContact N-O 3.34Å; T449-A452 PolarHBondContact OG1-N 2.58Å; T449-A452 PolarHBondContact OG1-O 2.92Å
450	A	91.3	Very high	94.9	Very high	99 Å²	99	60.5 Å²	60.5	82%	0.818	33%	0.333	S	S	*	.	S	Bend	trans	-64.3	-23.4	175.9	0	0	0	0	0	113.5
451	T	91.4	Very high	94.8	Very high	103 Å²	103	62.8 Å²	62.8	63%	0.632	35%	0.35	S	S	*	.	S	Bend	trans	-127.6	-9.5	-171.7	57.6	0	0	0	0	114.3	M411 T449	M411-T451 WeakPolarHBondContact CG-O 3.31Å; M411-T451 PolarHBondContact N-O 2.78Å; T449-T451 PolarHBondContact O-N 3.16Å; T449-T451 PolarHBondContact OG1-N 3.28Å
452	A	94.6	Very high	94.6	Very high	6 Å²	6	62.2 Å²	62.2	5%	0.05	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	151.9	-175.5	0	0	0	0	0	113.4	S408 Q409 R448 T449	S408-A452 WeakPolarHBondContact OG-CB 3.44Å; Q409-A452 CarbonylContact O-C 3.48Å; Q409-A452 WeakPolarHBondContact O-CA 3.48Å; Q409-A452 WeakPolarHBondContact O-CB 3.47Å; R448-A452 WeakPolarHBondContact CA-O 3.43Å; T449-A452 PolarHBondContact N-O 3.34Å; T449-A452 PolarHBondContact OG1-N 2.58Å; T449-A452 PolarHBondContact OG1-O 2.92Å
453	Y	95.2	Very high	94.4	Very high	68 Å²	68	61.2 Å²	61.2	27%	0.267	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.8	165.6	-59.4	-73.4	0	0	0	109.4	S408 Q409 M411 R448	S408-Y453 CarbonylContact C-O 3.53Å; S408-Y453 WeakPolarHBondContact CA-O 3.43Å; Q409-Y453 PolarHBondContact N-O 3.46Å; Q409-Y453 PolarHBondContact O-N 3.49Å; M411-Y453 HydrophobicContact CB-CE2 4.2Å; M411-Y453 HydrophobicContact CE-CD1 4.31Å; M411-Y453 HydrophobicContact CE-CE1 3.97Å; M411-Y453 HydrophobicContact CE-CE2 4.49Å; M411-Y453 HydrophobicContact CG-CD2 3.95Å; M411-Y453 HydrophobicContact CG-CE2 3.58Å; R448-Y453 HydrophobicContact CB-CD1 4.15Å
454	V	97.2	Very high	94.2	Very high	18 Å²	18	60.8 Å²	60.8	11%	0.109	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.1	166.6	-178.9	0	0	0	0	107.3	L387 T406 Y407 K446 S447	L387-V454 HydrophobicContact CD1-CG1 3.92Å; L387-V454 HydrophobicContact CD1-CG2 4.42Å; T406-V454 HydrophobicContact CG2-CG1 3.79Å; Y407-V454 WeakPolarHBondContact O-CA 3.34Å; K446-V454 HydrophobicContact CB-CG1 4.27Å; K446-V454 HydrophobicContact CD-CG1 4.27Å; K446-V454 PolarHBondContact N-O 2.94Å; S447-V454 PolarHBondContact N-O 2.9Å; S447-V454 PolarHBondContact O-N 3.45Å; S447-V454 WeakPolarHBondContact OG-CB 3.36Å
455	Q	97.1	Very high	94	Very high	28 Å²	28	56.8 Å²	56.8	13%	0.131	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	152.1	-173.1	-64.2	-171.5	-2.8	0	0	111.5	T406 Y407 A443 F444	T406-Q455 WeakPolarHBondContact CA-O 3.39Å; Y407-Q455 HydrophobicContact CE1-CB 4.02Å; Y407-Q455 HydrophobicContact CE2-CB 3.94Å; Y407-Q455 HydrophobicContact CE2-CG 4.47Å; Y407-Q455 PolarHBondContact N-O 2.61Å; Y407-Q455 PolarHBondContact O-N 3.12Å; Y407-Q455 PolarHBondContact OH-OE1 3.17Å; A443-Q455 HydrophobicContact CB-CB 4.14Å; F444-Q455 WeakPolarHBondContact O-CA 3.31Å
456	N	98.1	Very high	93.9	Very high	9 Å²	9	57.8 Å²	57.8	5%	0.048	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137.8	174.7	-75.5	-14.4	0	0	0	110.1	M404 C405 T406 A443 F444	M404-N456 HydrophobicContact CE-CB 4.45Å; M404-N456 WeakPolarHBondContact CE-ND2 3.38Å; M404-N456 HydrophobicContact CG-CB 3.91Å; M404-N456 HydrophobicContact SD-CB 3.62Å; M404-N456 VanDerWaalsContact SD-CG 3.6Å; M404-N456 PolarHBondContact SD-ND2 3.45Å; C405-N456 CarbonylContact O-C 3.53Å; C405-N456 WeakPolarHBondContact O-CA 3.48Å; T406-N456 WeakPolarHBondContact CG2-OD1 3.38Å; T406-N456 PolarHBondContact OG1-OD1 2.88Å; T406-N456 VanDerWaalsContact OG1-OD1 3.08Å; A443-N456 VanDerWaalsContact CA-O 3.24Å; A443-N456 WeakPolarHBondContact CA-O 3.35Å; F444-N456 HydrophobicContact CD1-CB 4.35Å; F444-N456 WeakPolarHBondContact CD1-O 3.35Å; F444-N456 HydrophobicContact CD2-CB 4.03Å; F444-N456 HydrophobicContact CE1-CB 3.89Å; F444-N456 HydrophobicContact CE2-CB 3.55Å; F444-N456 HydrophobicContact CG-CB 4.42Å; F444-N456 HydrophobicContact CZ-CB 3.47Å; F444-N456 VanDerWaalsContact CZ-CB 3.47Å; F444-N456 PolarHBondContact N-O 3.29Å; F444-N456 PolarHBondContact O-N 2.85Å
457	I	96.2	Very high	93.9	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127	166.8	-74.2	174.9	0	0	0	108.5	M404 C405 Y407 I421 S438 A443 F459	M404-I457 WeakPolarHBondContact CA-O 3.38Å; M404-I457 WeakPolarHBondContact CG-O 3.45Å; C405-I457 PolarHBondContact N-O 2.82Å; C405-I457 PolarHBondContact O-N 3.03Å; Y407-I457 HydrophobicContact CE1-CD1 3.6Å; Y407-I457 HydrophobicContact CE1-CG1 3.84Å; I421-I457 HydrophobicContact CB-CD1 4.28Å; I421-I457 HydrophobicContact CD1-CD1 3.78Å; I421-I457 HydrophobicContact CG1-CD1 4.43Å; S438-I457 VanDerWaalsContact CB-CG2 3.48Å; S438-I457 WeakPolarHBondContact OG-CG2 3.47Å; A443-I457 HydrophobicContact CB-CD1 4.03Å; A443-I457 HydrophobicContact CB-CG1 3.47Å; A443-I457 VanDerWaalsContact CB-CG1 3.47Å; I457-F459 HydrophobicContact CB-CE2 4.37Å; I457-F459 HydrophobicContact CG2-CD2 3.9Å; I457-F459 HydrophobicContact CG2-CE2 3.53Å; I457-F459 HydrophobicContact CG2-CZ 4.24Å
458	L	95.8	Very high	93.9	Very high	92 Å²	92	53.7 Å²	53.7	48%	0.482	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	124.5	173.7	-177.2	71.3	0	0	0	109.8
459	F	96.6	Very high	94	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.009	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	115.1	165.8	-75.8	-100	0	0	0	108.6	W397 S402 N403 C405 I421 V423 I457 I464 F472	W397-F459 HydrophobicContact CH2-CB 3.77Å; W397-F459 HydrophobicContact CH2-CD1 4.15Å; W397-F459 AromaticContact CH2-CD2 3.48Å; W397-F459 HydrophobicContact CH2-CD2 3.48Å; W397-F459 VanDerWaalsContact CH2-CD2 3.48Å; W397-F459 HydrophobicContact CH2-CE2 4.06Å; W397-F459 AromaticContact CH2-CG 3.52Å; W397-F459 HydrophobicContact CH2-CG 3.52Å; W397-F459 HydrophobicContact CZ2-CB 4.38Å; W397-F459 AromaticContact CZ2-CD2 3.88Å; W397-F459 HydrophobicContact CZ2-CD2 3.88Å; W397-F459 HydrophobicContact CZ2-CE2 4.5Å; W397-F459 HydrophobicContact CZ2-CG 4.28Å; W397-F459 HydrophobicContact CZ3-CB 4.35Å; W397-F459 HydrophobicContact CZ3-CG 4.33Å; S402-F459 CarbonylContact C-O 3.59Å; S402-F459 VanDerWaalsContact CA-O 3.27Å; S402-F459 WeakPolarHBondContact CA-O 3.35Å; N403-F459 PolarHBondContact N-O 2.83Å; N403-F459 PolarHBondContact O-N 3.27Å; C405-F459 HydrophobicContact CB-CD2 4.25Å; C405-F459 HydrophobicContact CB-CE2 3.87Å; I421-F459 HydrophobicContact CG2-CZ 4.26Å; V423-F459 HydrophobicContact CG2-CD1 4.14Å; V423-F459 HydrophobicContact CG2-CE1 3.78Å; V423-F459 HydrophobicContact CG2-CZ 4.22Å; I457-F459 HydrophobicContact CB-CE2 4.37Å; I457-F459 HydrophobicContact CG2-CD2 3.9Å; I457-F459 HydrophobicContact CG2-CE2 3.53Å; I457-F459 HydrophobicContact CG2-CZ 4.24Å; F459-I464 HydrophobicContact CB-CD1 3.63Å; F459-F472 HydrophobicContact CE2-CE1 4.4Å
460	P	94.2	Very high	94.3	Very high	57 Å²	57	44.8 Å²	44.8	37%	0.37	28%	0.283	S	S	.	.			trans	-60.9	153	176.9	-22.8	33.9	0	0	0	112	C462 C463	P460-C462 PolarHBondContact O-N 2.56Å; P460-C462 VanDerWaalsContact O-N 3.12Å; P460-C463 WeakPolarHBondContact O-CB 3.21Å; P460-C463 PolarHBondContact O-N 2.74Å
461	S	92.6	Very high	94.6	Very high	52 Å²	52	40.6 Å²	40.6	36%	0.364	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-51.1	-37.5	-179.6	54	0	0	0	0	114.7	E400 K401 S402 C463 I464	E400-S461 WeakPolarHBondContact O-CB 3.18Å; K401-S461 WeakPolarHBondContact O-CA 3.18Å; S402-S461 PolarHBondContact OG-N 3.47Å; S402-S461 VanDerWaalsContact OG-N 3.15Å; S461-C463 PolarHBondContact O-N 3.12Å; S461-I464 PolarHBondContact O-N 3Å
462	C	90.8	Very high	94.9	Very high	94 Å²	94	35.7 Å²	35.7	64%	0.635	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-68.5	-14.5	179.5	59.7	0	0	0	0	114.4	P460	P460-C462 PolarHBondContact O-N 2.56Å; P460-C462 VanDerWaalsContact O-N 3.12Å
463	C	89.8	Confident	95	Very high	43 Å²	43	35.4 Å²	35.4	29%	0.291	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-99.3	-4.8	178.2	-62.3	0	0	0	0	112.6	A436 P460 S461	A436-C463 HydrophobicContact CB-CB 3.9Å; A436-C463 VanDerWaalsContact CB-O 3.22Å; A436-C463 WeakPolarHBondContact CB-O 3.26Å; P460-C463 WeakPolarHBondContact O-CB 3.21Å; P460-C463 PolarHBondContact O-N 2.74Å; S461-C463 PolarHBondContact O-N 3.12Å
464	I	91.9	Very high	95	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.077	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-81	126.4	-178.5	-54.9	-52.7	0	0	0	108.9	W397 K401 N403 F459 S461 V491	W397-I464 HydrophobicContact CE3-CD1 3.79Å; W397-I464 HydrophobicContact CE3-CG2 4.42Å; W397-I464 HydrophobicContact CH2-CD1 4.18Å; W397-I464 HydrophobicContact CZ3-CD1 3.58Å; K401-I464 WeakPolarHBondContact O-CG1 3.46Å; N403-I464 HydrophobicContact CB-CD1 4.06Å; F459-I464 HydrophobicContact CB-CD1 3.63Å; S461-I464 PolarHBondContact O-N 3Å; I464-V491 HydrophobicContact CG2-CG1 3.96Å
465	P	91.4	Very high	94.9	Very high	18 Å²	18	31.3 Å²	31.3	12%	0.117	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-69.7	169.5	179.2	31.7	-36.1	0	0	0	111.1	V423 L435 Y470 V491	V423-P465 HydrophobicContact CG1-CG 4.1Å; L435-P465 HydrophobicContact CD1-CB 4.09Å; P465-Y470 HydrophobicContact CB-CD1 4.48Å; P465-Y470 HydrophobicContact CB-CE1 3.75Å; P465-Y470 HydrophobicContact CB-CE2 4.29Å; P465-Y470 HydrophobicContact CG-CD1 3.92Å; P465-Y470 HydrophobicContact CG-CD2 4.11Å; P465-Y470 HydrophobicContact CG-CE1 3.65Å; P465-Y470 HydrophobicContact CG-CE2 3.81Å; P465-Y470 HydrophobicContact CG-CG 4.16Å; P465-V491 HydrophobicContact CG-CG2 4.22Å
466	T	92.7	Very high	94.8	Very high	106 Å²	106	30 Å²	30	65%	0.65	19%	0.191	S	C	*	.	S	Bend	trans	-62.4	161.8	174.9	52.4	0	0	0	0	111.4	G468 Y470	T466-G468 PolarHBondContact O-N 2.7Å; T466-Y470 VanDerWaalsContact O-CE2 3.25Å; T466-Y470 WeakPolarHBondContact O-CE2 3.28Å; T466-Y470 VanDerWaalsContact O-CZ 3.32Å; T466-Y470 PolarHBondContact O-OH 2.87Å
467	P	94.9	Very high	94.5	Very high	64 Å²	64	33.4 Å²	33.4	42%	0.416	21%	0.207	S	C	.	.	S	Bend	trans	-49.5	138.6	176.5	-29.2	36.3	0	0	0	113.5	V491 D493	P467-V491 CarbonylContact C-O 3.53Å; P467-V491 WeakPolarHBondContact CA-O 3.38Å; P467-D493 HydrophobicContact CG-CB 4.19Å
468	G	95.2	Very high	94.2	Very high	25 Å²	25	41.7 Å²	41.7	26%	0.258	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	156.4	-176.4	-173.5	0	0	0	0	0	112.9	T466 Y470 V491	T466-G468 PolarHBondContact O-N 2.7Å; G468-Y470 WeakPolarHBondContact O-CD2 3.35Å; G468-Y470 VanDerWaalsContact O-CE2 3.27Å; G468-Y470 WeakPolarHBondContact O-CE2 3.39Å; G468-V491 PolarHBondContact N-O 3.2Å; G468-V491 PolarHBondContact O-N 3.13Å
469	T	96.4	Very high	94	Very high	29 Å²	29	38.4 Å²	38.4	18%	0.178	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.4	179.8	-50	0	0	0	0	111.7	R391 L426 P488 E490	R391-T469 PolarHBondContact NH2-OG1 2.99Å; R391-T469 VanDerWaalsContact NH2-OG1 3.16Å; L426-T469 HydrophobicContact CB-CG2 4.18Å; L426-T469 HydrophobicContact CD1-CG2 4.47Å; L426-T469 HydrophobicContact CD2-CG2 3.9Å; L426-T469 HydrophobicContact CG-CG2 4.41Å; L426-T469 PolarHBondContact N-O 3.24Å; L426-T469 VanDerWaalsContact N-O 3.12Å; T469-P488 HydrophobicContact CG2-CB 3.88Å; T469-E490 WeakPolarHBondContact CA-OE2 3.49Å; T469-E490 WeakPolarHBondContact CB-OE2 3.49Å; T469-E490 WeakPolarHBondContact CG2-OE1 3.49Å; T469-E490 PolarHBondContact OG1-OE1 3.01Å; T469-E490 PolarHBondContact OG1-OE2 3.33Å
470	Y	97.2	Very high	93.7	Very high	11 Å²	11	38.8 Å²	38.8	4%	0.043	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	170.7	-175.3	-58.1	-85.6	0	0	0	111.2	V423 F424 H425 L435 P465 T466 G468 P488 F489 V491	V423-Y470 HydrophobicContact CG1-CD1 4.15Å; V423-Y470 HydrophobicContact CG1-CG 4.26Å; F424-Y470 CarbonylContact O-C 3.58Å; F424-Y470 VanDerWaalsContact O-CA 3.22Å; F424-Y470 WeakPolarHBondContact O-CA 3.47Å; F424-Y470 WeakPolarHBondContact O-CB 3.49Å; F424-Y470 WeakPolarHBondContact O-CD1 3.45Å; H425-Y470 HydrophobicContact CB-CD1 4.36Å; H425-Y470 HydrophobicContact CB-CE1 4.27Å; L435-Y470 HydrophobicContact CD1-CD1 3.84Å; L435-Y470 HydrophobicContact CD1-CE1 3.49Å; L435-Y470 VanDerWaalsContact CD1-CE1 3.49Å; P465-Y470 HydrophobicContact CB-CD1 4.48Å; P465-Y470 HydrophobicContact CB-CE1 3.75Å; P465-Y470 HydrophobicContact CB-CE2 4.29Å; P465-Y470 HydrophobicContact CG-CD1 3.92Å; P465-Y470 HydrophobicContact CG-CD2 4.11Å; P465-Y470 HydrophobicContact CG-CE1 3.65Å; P465-Y470 HydrophobicContact CG-CE2 3.81Å; P465-Y470 HydrophobicContact CG-CG 4.16Å; T466-Y470 VanDerWaalsContact O-CE2 3.25Å; T466-Y470 WeakPolarHBondContact O-CE2 3.28Å; T466-Y470 VanDerWaalsContact O-CZ 3.32Å; T466-Y470 PolarHBondContact O-OH 2.87Å; G468-Y470 WeakPolarHBondContact O-CD2 3.35Å; G468-Y470 VanDerWaalsContact O-CE2 3.27Å; G468-Y470 WeakPolarHBondContact O-CE2 3.39Å; Y470-P488 CarbonylContact O-C 3.59Å; Y470-P488 VanDerWaalsContact O-CA 3.31Å; Y470-P488 WeakPolarHBondContact O-CA 3.27Å; Y470-F489 PolarHBondContact N-O 3.16Å; Y470-F489 WeakPolarHBondContact O-CD1 3.41Å; Y470-F489 PolarHBondContact O-N 2.94Å; Y470-V491 HydrophobicContact CD2-CB 3.99Å; Y470-V491 HydrophobicContact CD2-CG2 3.48Å; Y470-V491 VanDerWaalsContact CD2-CG2 3.48Å; Y470-V491 HydrophobicContact CE2-CB 3.87Å; Y470-V491 HydrophobicContact CE2-CG2 3.76Å; Y470-V491 HydrophobicContact CG-CG2 4.42Å
471	L	96.8	Very high	93.7	Very high	11 Å²	11	36.1 Å²	36.1	6%	0.058	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	158.4	170.9	59.6	107.4	0	0	0	109.5	F424 L426 F428 L485 S486	F424-L471 HydrophobicContact CB-CD1 4.16Å; F424-L471 HydrophobicContact CB-CG 4.19Å; F424-L471 PolarHBondContact N-O 2.63Å; F424-L471 PolarHBondContact O-N 3.01Å; L426-L471 HydrophobicContact CD1-CD2 3.94Å; F428-L471 HydrophobicContact CD1-CD2 4.3Å; F428-L471 HydrophobicContact CE1-CD1 4.03Å; F428-L471 HydrophobicContact CE1-CD2 4.03Å; L471-L485 HydrophobicContact CD1-CB 4.46Å; L471-L485 HydrophobicContact CD1-CD2 3.75Å; L471-S486 WeakPolarHBondContact CA-OG 3.43Å
472	F	97.7	Very high	93.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	144.7	168.8	-58.8	-66.9	0	0	0	110.9	F386 P389 W397 C405 I421 G422 V423 F459 L485 S486 F489	F386-F472 HydrophobicContact CD1-CB 3.69Å; F386-F472 AromaticContact CD1-CD2 3.89Å; F386-F472 HydrophobicContact CD1-CD2 3.89Å; F386-F472 HydrophobicContact CD1-CG 4.05Å; F386-F472 HydrophobicContact CD2-CB 4.32Å; F386-F472 HydrophobicContact CE1-CB 3.34Å; F386-F472 HydrophobicContact CE1-CD2 4.3Å; F386-F472 AromaticContact CE1-CG 3.97Å; F386-F472 HydrophobicContact CE1-CG 3.97Å; F386-F472 HydrophobicContact CE2-CB 4Å; F386-F472 HydrophobicContact CG-CB 4.17Å; F386-F472 HydrophobicContact CG-CD2 4.4Å; F386-F472 HydrophobicContact CZ-CB 3.5Å; F386-F472 VanDerWaalsContact CZ-CB 3.5Å; P389-F472 HydrophobicContact CG-CE2 3.7Å; P389-F472 HydrophobicContact CG-CZ 3.9Å; W397-F472 HydrophobicContact CD2-CZ 4.42Å; W397-F472 AromaticContact CE2-CZ 3.72Å; W397-F472 AromaticContact CH2-CE1 3.36Å; W397-F472 HydrophobicContact CH2-CE1 3.36Å; W397-F472 AromaticContact CH2-CZ 3.58Å; W397-F472 HydrophobicContact CH2-CZ 3.58Å; W397-F472 AromaticContact CZ2-CE1 3.57Å; W397-F472 HydrophobicContact CZ2-CE1 3.57Å; W397-F472 AromaticContact CZ2-CZ 3.28Å; W397-F472 HydrophobicContact CZ2-CZ 3.28Å; W397-F472 HydrophobicContact CZ3-CE1 4.04Å; W397-F472 HydrophobicContact CZ3-CZ 4.25Å; C405-F472 HydrophobicContact CB-CE1 4.01Å; C405-F472 HydrophobicContact CB-CE2 4.21Å; C405-F472 HydrophobicContact CB-CZ 3.86Å; I421-F472 HydrophobicContact CG2-CB 4.16Å; I421-F472 HydrophobicContact CG2-CD1 4.04Å; I421-F472 HydrophobicContact CG2-CG 4.32Å; G422-F472 CarbonylContact O-C 3.55Å; G422-F472 VanDerWaalsContact O-CA 3.23Å; G422-F472 WeakPolarHBondContact O-CA 3.37Å; V423-F472 HydrophobicContact CG2-CD1 4.19Å; V423-F472 HydrophobicContact CG2-CE1 3.95Å; F459-F472 HydrophobicContact CE2-CE1 4.4Å; F472-L485 CarbonylContact O-C 3.5Å; F472-L485 VanDerWaalsContact O-CA 3.31Å; F472-L485 WeakPolarHBondContact O-CA 3.41Å; F472-S486 PolarHBondContact N-OG 3.47Å; F472-S486 PolarHBondContact O-N 2.87Å; F472-F489 HydrophobicContact CD1-CE1 4.19Å; F472-F489 HydrophobicContact CD1-CZ 4.35Å; F472-F489 HydrophobicContact CD2-CD1 4.2Å; F472-F489 AromaticContact CD2-CE1 3.59Å; F472-F489 HydrophobicContact CD2-CE1 3.59Å; F472-F489 HydrophobicContact CD2-CZ 4.35Å; F472-F489 AromaticContact CE1-CE1 3.92Å; F472-F489 HydrophobicContact CE1-CE1 3.92Å; F472-F489 AromaticContact CE1-CZ 3.72Å; F472-F489 HydrophobicContact CE1-CZ 3.72Å; F472-F489 AromaticContact CE2-CD1 3.84Å; F472-F489 HydrophobicContact CE2-CD1 3.84Å; F472-F489 AromaticContact CE2-CE1 3.27Å; F472-F489 HydrophobicContact CE2-CE1 3.27Å; F472-F489 AromaticContact CE2-CZ 3.72Å; F472-F489 HydrophobicContact CE2-CZ 3.72Å; F472-F489 HydrophobicContact CG-CE1 4.02Å; F472-F489 HydrophobicContact CZ-CD1 4.33Å; F472-F489 AromaticContact CZ-CE1 3.43Å; F472-F489 HydrophobicContact CZ-CE1 3.43Å; F472-F489 VanDerWaalsContact CZ-CE1 3.43Å; F472-F489 HydrophobicContact CZ-CE2 4.18Å; F472-F489 AromaticContact CZ-CZ 3.34Å; F472-F489 HydrophobicContact CZ-CZ 3.34Å
473	G	96.6	Very high	93.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.1	166	0	0	0	0	0	110.2	I421 G422 A484	I421-G473 CarbonylContact C-O 3.59Å; I421-G473 WeakPolarHBondContact CA-O 3.17Å; G422-G473 PolarHBondContact N-O 2.96Å; G422-G473 PolarHBondContact O-N 2.87Å; G473-A484 WeakPolarHBondContact CA-O 3.23Å
474	C	96.4	Very high	94.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	115	172	-176.4	0	0	0	0	109.2	I384 F386 W420 I421 M440 L482 I483 A484	I384-C474 HydrophobicContact CB-CB 4.4Å; I384-C474 HydrophobicContact CG1-CB 4.5Å; I384-C474 HydrophobicContact CG2-CB 4.15Å; F386-C474 HydrophobicContact CE2-CB 4.42Å; F386-C474 HydrophobicContact CZ-CB 4Å; W420-C474 WeakPolarHBondContact O-CA 3.34Å; I421-C474 HydrophobicContact CG1-CB 4.23Å; M440-C474 PolarHBondContact SD-SG 3.02Å; C474-L482 CarbonylContact O-C 3.48Å; C474-L482 VanDerWaalsContact O-CA 3.32Å; C474-L482 WeakPolarHBondContact O-CA 3.32Å; C474-I483 HydrophobicContact CB-CG1 4.23Å; C474-I483 WeakPolarHBondContact O-CG1 3.37Å; C474-I483 PolarHBondContact O-N 2.68Å; C474-A484 HydrophobicContact CB-CB 4.05Å; C474-A484 PolarHBondContact N-O 3.15Å
475	F	95.4	Very high	94.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.2	176.6	-168.9	-91	0	0	0	110.7	N148 D419 W420 W432 L482	N148-F475 HydrophobicContact CB-CE1 4.49Å; N148-F475 HydrophobicContact CB-CZ 3.89Å; D419-F475 WeakPolarHBondContact CA-O 3.49Å; W420-F475 HydrophobicContact CD2-CB 3.64Å; W420-F475 HydrophobicContact CD2-CG 4.44Å; W420-F475 AromaticContact CE2-CD1 3.79Å; W420-F475 AromaticContact CE2-CG 3.64Å; W420-F475 HydrophobicContact CE3-CB 3.92Å; W420-F475 HydrophobicContact CG-CB 4.31Å; W420-F475 HydrophobicContact CH2-CB 3.66Å; W420-F475 HydrophobicContact CH2-CD2 4.29Å; W420-F475 HydrophobicContact CH2-CG 4.09Å; W420-F475 HydrophobicContact CZ2-CB 3.34Å; W420-F475 AromaticContact CZ2-CD1 3.92Å; W420-F475 HydrophobicContact CZ2-CD1 3.92Å; W420-F475 AromaticContact CZ2-CD2 3.87Å; W420-F475 HydrophobicContact CZ2-CD2 3.87Å; W420-F475 AromaticContact CZ2-CG 3.44Å; W420-F475 HydrophobicContact CZ2-CG 3.44Å; W420-F475 VanDerWaalsContact CZ2-CG 3.44Å; W420-F475 HydrophobicContact CZ3-CB 3.92Å; W420-F475 PolarHBondContact N-O 3.08Å; W420-F475 VanDerWaalsContact N-O 3.16Å; W420-F475 AromaticContact NE1-CD1 3.5Å; W420-F475 AromaticContact NE1-CG 3.86Å; W420-F475 PolarHBondContact O-N 2.62Å; W432-F475 HydrophobicContact CZ3-CZ 4.44Å; F475-L482 HydrophobicContact CB-CD2 3.94Å; F475-L482 HydrophobicContact CD2-CD2 4.06Å; F475-L482 HydrophobicContact CD2-CG 4.37Å
476	S	93.5	Very high	94.5	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.014	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.2	172.8	159.6	0	0	0	0	109.3	R478 S479 G480 C481	S476-R478 PolarHBondContact O-N 3.35Å; S476-S479 PolarHBondContact O-N 3.16Å; S476-S479 VanDerWaalsContact OG-CB 3.27Å; S476-S479 WeakPolarHBondContact OG-CB 3.44Å; S476-S479 PolarHBondContact OG-N 3.11Å; S476-S479 PolarHBondContact OG-OG 3.42Å; S476-G480 PolarHBondContact O-N 2.74Å; S476-C481 PolarHBondContact N-O 3.32Å; S476-C481 VanDerWaalsContact N-O 3.13Å
477	Q	91.6	Very high	94.6	Very high	80 Å²	80	27.7 Å²	27.7	37%	0.374	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-34.1	178.7	178.7	62.5	26.1	0	0	111.3	N148 F418 D419	N148-Q477 PolarHBondContact ND2-NE2 3.38Å; N148-Q477 PolarHBondContact ND2-OE1 2.86Å; F418-Q477 HydrophobicContact CB-CB 4Å; F418-Q477 HydrophobicContact CB-CG 4.04Å; D419-Q477 PolarHBondContact OD1-N 3.01Å
478	R	90.4	Very high	94.6	Very high	174 Å²	174	26.3 Å²	26.3	66%	0.657	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-39	177.7	-175	-175.2	-63.3	134.3	7.3	111.6	K414 S476	K414-R478 PolarHBondContact O-NH1 3.45Å; S476-R478 PolarHBondContact O-N 3.35Å
479	S	91	Very high	94.7	Very high	24 Å²	24	25.1 Å²	25.1	17%	0.168	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-22.8	-178.6	-64.1	0	0	0	0	113.1	R173 S174 A175 S476 C481	R173-S479 WeakPolarHBondContact O-CB 3.5Å; R173-S479 PolarHBondContact O-OG 3.26Å; S174-S479 CarbonylContact C-O 3.59Å; S174-S479 WeakPolarHBondContact CA-O 3.3Å; A175-S479 PolarHBondContact N-O 3.38Å; S476-S479 PolarHBondContact O-N 3.16Å; S476-S479 VanDerWaalsContact OG-CB 3.27Å; S476-S479 WeakPolarHBondContact OG-CB 3.44Å; S476-S479 PolarHBondContact OG-N 3.11Å; S476-S479 PolarHBondContact OG-OG 3.42Å; S479-C481 VanDerWaalsContact C-N 3.29Å; S479-C481 PolarHBondContact O-N 3.37Å
480	G	92	Very high	94.7	Very high	9 Å²	9	26 Å²	26	9%	0.093	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	18.8	-178.4	0	0	0	0	0	114.7	S476	S476-G480 PolarHBondContact O-N 2.74Å
481	C	94.1	Very high	94.6	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.007	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	170.8	-176.5	63.4	0	0	0	0	113	V172 A175 S476 S479 I483	V172-C481 HydrophobicContact CG1-CB 4.3Å; V172-C481 PolarHBondContact O-SG 2.88Å; A175-C481 HydrophobicContact CB-CB 3.87Å; S476-C481 PolarHBondContact N-O 3.32Å; S476-C481 VanDerWaalsContact N-O 3.13Å; S479-C481 VanDerWaalsContact C-N 3.29Å; S479-C481 PolarHBondContact O-N 3.37Å; C481-I483 PolarHBondContact O-N 3.28Å
482	L	94.4	Very high	94.5	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	107.9	170.2	-66.5	174.4	0	0	0	110.6	F424 D431 C474 F475 L485	F424-L482 HydrophobicContact CE1-CD1 4.41Å; F424-L482 HydrophobicContact CE2-CD1 4.48Å; F424-L482 HydrophobicContact CE2-CD2 4.14Å; F424-L482 HydrophobicContact CZ-CD1 4.09Å; F424-L482 HydrophobicContact CZ-CD2 3.93Å; D431-L482 HydrophobicContact CB-CD1 3.72Å; D431-L482 HydrophobicContact CB-CG 4.1Å; C474-L482 CarbonylContact O-C 3.48Å; C474-L482 VanDerWaalsContact O-CA 3.32Å; C474-L482 WeakPolarHBondContact O-CA 3.32Å; F475-L482 HydrophobicContact CB-CD2 3.94Å; F475-L482 HydrophobicContact CD2-CD2 4.06Å; F475-L482 HydrophobicContact CD2-CG 4.37Å; L482-L485 HydrophobicContact CB-CD2 4.46Å; L482-L485 HydrophobicContact CD1-CD2 4.01Å
483	I	92.8	Very high	94	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-10.7	-176.4	58.4	162.6	0	0	0	113.7	R173 P383 I384 Y413 C474 C481	R173-I483 PolarHBondContact NH1-O 3.36Å; P383-I483 HydrophobicContact CG-CD1 4.16Å; I384-I483 HydrophobicContact CG1-CD1 4.23Å; Y413-I483 HydrophobicContact CE2-CD1 3.6Å; Y413-I483 WeakPolarHBondContact OH-CD1 3.45Å; C474-I483 HydrophobicContact CB-CG1 4.23Å; C474-I483 WeakPolarHBondContact O-CG1 3.37Å; C474-I483 PolarHBondContact O-N 2.68Å; C481-I483 PolarHBondContact O-N 3.28Å
484	A	94.8	Very high	93	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	147.2	174.7	0	0	0	0	0	110.5	P382 I384 F386 G473 C474	P382-A484 HydrophobicContact CB-CB 4.33Å; I384-A484 HydrophobicContact CB-CB 3.84Å; I384-A484 HydrophobicContact CG2-CB 4.27Å; I384-A484 VanDerWaalsContact O-CB 3.22Å; I384-A484 WeakPolarHBondContact O-CB 3.43Å; F386-A484 HydrophobicContact CE2-CB 4.06Å; G473-A484 WeakPolarHBondContact CA-O 3.23Å; C474-A484 HydrophobicContact CB-CB 4.05Å; C474-A484 PolarHBondContact N-O 3.15Å
485	L	95.6	Very high	91.7	Very high	21 Å²	21	43.7 Å²	43.7	11%	0.11	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	148.4	170.1	-65.1	-179.6	0	0	0	109.4	R166 L169 Q170 L471 F472 L482	R166-L485 WeakPolarHBondContact O-CD1 3.18Å; L169-L485 HydrophobicContact CB-CD1 4.01Å; Q170-L485 HydrophobicContact CB-CB 4.29Å; Q170-L485 HydrophobicContact CB-CG 4.21Å; L471-L485 HydrophobicContact CD1-CB 4.46Å; L471-L485 HydrophobicContact CD1-CD2 3.75Å; F472-L485 CarbonylContact O-C 3.5Å; F472-L485 VanDerWaalsContact O-CA 3.31Å; F472-L485 WeakPolarHBondContact O-CA 3.41Å; L482-L485 HydrophobicContact CB-CD2 4.46Å; L482-L485 HydrophobicContact CD1-CD2 4.01Å
486	S	95.6	Very high	90	Very high	13 Å²	13	49.8 Å²	49.8	9%	0.091	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-84.1	162.1	170.2	78.9	0	0	0	0	111.2	F386 L471 F472	F386-S486 VanDerWaalsContact CB-CB 3.46Å; F386-S486 VanDerWaalsContact CD2-N 3.33Å; L471-S486 WeakPolarHBondContact CA-OG 3.43Å; F472-S486 PolarHBondContact N-OG 3.47Å; F472-S486 PolarHBondContact O-N 2.87Å
487	E	94	Very high	88.1	Confident	111 Å²	111	50 Å²	50	52%	0.519	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-57	151.1	155.6	-67.6	-60.3	142.5	0	0	110.3
488	P	95.9	Very high	85.7	Confident	35 Å²	35	51.1 Å²	51.1	23%	0.227	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-57.8	148.9	173.4	-23.5	34	0	0	0	112.2	R391 L426 T469 Y470	R391-P488 WeakPolarHBondContact CB-O 3.44Å; R391-P488 PolarHBondContact N-O 3.21Å; L426-P488 HydrophobicContact CD1-CB 4.18Å; L426-P488 HydrophobicContact CD1-CG 3.86Å; T469-P488 HydrophobicContact CG2-CB 3.88Å; Y470-P488 CarbonylContact O-C 3.59Å; Y470-P488 VanDerWaalsContact O-CA 3.31Å; Y470-P488 WeakPolarHBondContact O-CA 3.27Å
489	F	96.5	Very high	83.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	158.9	171.7	66.9	-91	0	0	0	110.6	P389 W397 Y470 F472 V491	P389-F489 HydrophobicContact CB-CB 3.9Å; P389-F489 HydrophobicContact CB-CD2 4.06Å; P389-F489 HydrophobicContact CB-CG 3.99Å; P389-F489 HydrophobicContact CG-CB 3.96Å; P389-F489 HydrophobicContact CG-CD1 3.89Å; P389-F489 HydrophobicContact CG-CD2 3.44Å; P389-F489 VanDerWaalsContact CG-CD2 3.44Å; P389-F489 HydrophobicContact CG-CE1 4.21Å; P389-F489 HydrophobicContact CG-CE2 3.8Å; P389-F489 HydrophobicContact CG-CG 3.48Å; P389-F489 VanDerWaalsContact CG-CG 3.48Å; P389-F489 HydrophobicContact CG-CZ 4.17Å; W397-F489 HydrophobicContact CB-CE2 4.35Å; W397-F489 AromaticContact CD2-CE2 3.82Å; W397-F489 HydrophobicContact CD2-CE2 3.82Å; W397-F489 HydrophobicContact CD2-CZ 4.36Å; W397-F489 AromaticContact CE3-CE2 3.82Å; W397-F489 HydrophobicContact CE3-CE2 3.82Å; W397-F489 HydrophobicContact CE3-CZ 4.18Å; W397-F489 HydrophobicContact CG-CD2 4.44Å; W397-F489 HydrophobicContact CG-CE2 4.05Å; W397-F489 HydrophobicContact CZ3-CE2 4.49Å; W397-F489 HydrophobicContact CZ3-CZ 4.42Å; Y470-F489 PolarHBondContact N-O 3.16Å; Y470-F489 WeakPolarHBondContact O-CD1 3.41Å; Y470-F489 PolarHBondContact O-N 2.94Å; F472-F489 HydrophobicContact CD1-CE1 4.19Å; F472-F489 HydrophobicContact CD1-CZ 4.35Å; F472-F489 HydrophobicContact CD2-CD1 4.2Å; F472-F489 AromaticContact CD2-CE1 3.59Å; F472-F489 HydrophobicContact CD2-CE1 3.59Å; F472-F489 HydrophobicContact CD2-CZ 4.35Å; F472-F489 AromaticContact CE1-CE1 3.92Å; F472-F489 HydrophobicContact CE1-CE1 3.92Å; F472-F489 AromaticContact CE1-CZ 3.72Å; F472-F489 HydrophobicContact CE1-CZ 3.72Å; F472-F489 AromaticContact CE2-CD1 3.84Å; F472-F489 HydrophobicContact CE2-CD1 3.84Å; F472-F489 AromaticContact CE2-CE1 3.27Å; F472-F489 HydrophobicContact CE2-CE1 3.27Å; F472-F489 AromaticContact CE2-CZ 3.72Å; F472-F489 HydrophobicContact CE2-CZ 3.72Å; F472-F489 HydrophobicContact CG-CE1 4.02Å; F472-F489 HydrophobicContact CZ-CD1 4.33Å; F472-F489 AromaticContact CZ-CE1 3.43Å; F472-F489 HydrophobicContact CZ-CE1 3.43Å; F472-F489 VanDerWaalsContact CZ-CE1 3.43Å; F472-F489 HydrophobicContact CZ-CE2 4.18Å; F472-F489 AromaticContact CZ-CZ 3.34Å; F472-F489 HydrophobicContact CZ-CZ 3.34Å; F489-V491 HydrophobicContact CE2-CG2 4.08Å
490	E	96	Very high	80.5	Confident	49 Å²	49	52.1 Å²	52.1	23%	0.229	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	141.1	176.7	-56.6	-40.3	120.5	0	0	111.3	R391 C396 W397 T469 V492	R391-E490 IonicContact CZ-OE1 3.72Å; R391-E490 IonicContact NE-OE1 3.95Å; R391-E490 PolarHBondContact NE-OE1 3.5Å; R391-E490 IonicContact NH2-OE1 2.81Å; R391-E490 PolarHBondContact NH2-OE1 2.88Å; R391-E490 IonicContact NH2-OE2 3.79Å; C396-E490 CarbonylContact C-O 3.5Å; C396-E490 WeakPolarHBondContact CA-O 3.47Å; C396-E490 HydrophobicContact CB-CB 4.24Å; C396-E490 VanDerWaalsContact CB-O 3.27Å; C396-E490 WeakPolarHBondContact CB-O 3.42Å; W397-E490 PolarHBondContact N-O 2.85Å; T469-E490 WeakPolarHBondContact CA-OE2 3.49Å; T469-E490 WeakPolarHBondContact CB-OE2 3.49Å; T469-E490 WeakPolarHBondContact CG2-OE1 3.49Å; T469-E490 PolarHBondContact OG1-OE1 3.01Å; T469-E490 PolarHBondContact OG1-OE2 3.33Å; E490-V492 HydrophobicContact CB-CG1 4.01Å
491	V	95.5	Very high	77.6	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.7	153.1	-180	0	0	0	0	106.8	W397 I464 P465 P467 G468 Y470 F489	W397-V491 HydrophobicContact CB-CG2 3.91Å; W397-V491 HydrophobicContact CE3-CG2 4.31Å; W397-V491 CarbonylContact O-C 3.54Å; W397-V491 VanDerWaalsContact O-CA 3.28Å; W397-V491 WeakPolarHBondContact O-CA 3.29Å; I464-V491 HydrophobicContact CG2-CG1 3.96Å; P465-V491 HydrophobicContact CG-CG2 4.22Å; P467-V491 CarbonylContact C-O 3.53Å; P467-V491 WeakPolarHBondContact CA-O 3.38Å; G468-V491 PolarHBondContact N-O 3.2Å; G468-V491 PolarHBondContact O-N 3.13Å; Y470-V491 HydrophobicContact CD2-CB 3.99Å; Y470-V491 HydrophobicContact CD2-CG2 3.48Å; Y470-V491 VanDerWaalsContact CD2-CG2 3.48Å; Y470-V491 HydrophobicContact CE2-CB 3.87Å; Y470-V491 HydrophobicContact CE2-CG2 3.76Å; Y470-V491 HydrophobicContact CG-CG2 4.42Å; F489-V491 HydrophobicContact CE2-CG2 4.08Å
492	V	94	Very high	74.4	Confident	32 Å²	32	63.6 Å²	63.6	19%	0.194	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	155.2	-178.5	-60.6	0	0	0	0	110.9	C396 W397 S399 E490	C396-V492 HydrophobicContact CB-CG1 4.22Å; C396-V492 HydrophobicContact CB-CG2 4.37Å; W397-V492 PolarHBondContact O-N 2.84Å; S399-V492 PolarHBondContact N-O 3.43Å; S399-V492 PolarHBondContact OG-O 3.5Å; E490-V492 HydrophobicContact CB-CG1 4.01Å
493	D	88.7	Confident	71.1	Confident	66 Å²	66	69.1 Å²	69.1	35%	0.353	36%	0.364	S	S	.	.			trans	-63.9	147.1	172.9	-156.5	-60.3	0	0	0	110.8	S399 P467 E495 L496 G497	S399-D493 WeakPolarHBondContact OG-CA 3.21Å; P467-D493 HydrophobicContact CG-CB 4.19Å; D493-E495 PolarHBondContact O-N 3.32Å; D493-E495 PolarHBondContact OD1-N 3.07Å; D493-E495 VanDerWaalsContact OD1-N 3.13Å; D493-L496 HydrophobicContact CB-CD1 4.16Å; D493-L496 PolarHBondContact O-N 3.08Å; D493-G497 PolarHBondContact O-N 3.38Å
494	R	74.9	Confident	67.9	Low	123 Å²	123	79.4 Å²	79.4	46%	0.464	40%	0.404	S	S	.	.	H	α-helix	trans	-57.1	-38.2	176	-176.9	-179.3	175.1	-179	-0.9	112.1	I398	I398-R494 HydrophobicContact CG2-CB 4.03Å; I398-R494 HydrophobicContact CG2-CG 4.41Å
495	E	68.3	Low	64.5	Low	168 Å²	168	82.7 Å²	82.7	79%	0.785	44%	0.438	S	S	*	.	H	α-helix	trans	-69.4	-39	-178.5	-65.8	-172.1	170.9	0	0	111.9	D493	D493-E495 PolarHBondContact O-N 3.32Å; D493-E495 PolarHBondContact OD1-N 3.07Å; D493-E495 VanDerWaalsContact OD1-N 3.13Å
496	L	60.3	Low	61.2	Low	128 Å²	128	88 Å²	88	67%	0.67	47%	0.471	S	S	*	.	H	α-helix	trans	-74.9	-30.1	178.7	-78.5	156.3	0	0	0	112.8	D493 M498	D493-L496 HydrophobicContact CB-CD1 4.16Å; D493-L496 PolarHBondContact O-N 3.08Å; L496-M498 VanDerWaalsContact C-N 3.27Å; L496-M498 PolarHBondContact O-N 3.44Å
497	G	53.1	Low	57.8	Low	7 Å²	7	90.6 Å²	90.6	7%	0.072	50%	0.5	C	S	.	.	H	α-helix	trans	-72.1	-15.5	179.1	0	0	0	0	0	114.7	D493	D493-G497 PolarHBondContact O-N 3.38Å
498	M	42.8	Very low	54.5	Low	103 Å²	103	96.6 Å²	96.6	51%	0.507	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-85.5	-14.9	-175.6	-80.6	-172.8	170.1	0	0	114.9	L496 S500	L496-M498 VanDerWaalsContact C-N 3.27Å; L496-M498 PolarHBondContact O-N 3.44Å; M498-S500 PolarHBondContact O-N 3.1Å
499	D	36.3	Very low	51.3	Low	164 Å²	164	100.3 Å²	100.3	88%	0.877	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-70.4	1.7	177.8	-92.7	-6.6	0	0	0	113.6
500	S	34.3	Very low	48.3	Very low	56 Å²	56	103.6 Å²	103.6	39%	0.392	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-135.5	60.8	175	65.3	0	0	0	0	113.2	M498 L514	M498-S500 PolarHBondContact O-N 3.1Å; S500-L514 WeakPolarHBondContact O-CD2 3.44Å
501	S	32	Very low	45.2	Very low	75 Å²	75	109.3 Å²	109.3	52%	0.524	60%	0.596	S	S	.	*			trans	-142.8	102.8	161.6	69.9	0	0	0	0	113.1	T503	S501-T503 PolarHBondContact O-N 2.77Å
502	M	25.7	Very low	42.1	Very low	175 Å²	175	117.8 Å²	117.8	86%	0.862	64%	0.635	S	S	*	*			trans	-63.2	109.2	153	-79.1	-81.3	-76.3	0	0	107.7	Y504	M502-Y504 PolarHBondContact O-N 2.74Å
503	T	25.7	Very low	39.3	Very low	119 Å²	119	120.7 Å²	120.7	73%	0.73	65%	0.647	S	S	*	*			trans	-69.2	119.4	179.6	42.4	0	0	0	0	112	S501	S501-T503 PolarHBondContact O-N 2.77Å
504	Y	25.8	Very low	36.8	Very low	219 Å²	219	119.3 Å²	119.3	86%	0.859	64%	0.639	S	S	*	*			trans	-134.3	116.9	150	-81	-79.4	0	0	0	108.6	M502	M502-Y504 PolarHBondContact O-N 2.74Å
505	G	24.4	Very low	34.8	Very low	69 Å²	69	118.4 Å²	118.4	71%	0.711	64%	0.642	S	S	*	*			trans	-80.2	163.4	-174.2	0	0	0	0	0	114.2
506	T	25.6	Very low	32.9	Very low	133 Å²	133	115.6 Å²	115.6	82%	0.816	63%	0.628	S	S	*	*			trans	-165.3	145	136.3	32.6	0	0	0	0	107.9
507	G	24	Very low	31.4	Very low	67 Å²	67	116.8 Å²	116.8	69%	0.691	63%	0.629	S	S	*	*	S	Bend	trans	-60.1	152.4	-177.4	0	0	0	0	0	114
508	Y	25.8	Very low	30.2	Very low	237 Å²	237	121.5 Å²	121.5	93%	0.929	66%	0.659	S	S	*	*	S	Bend	trans	55.5	83.5	179.9	-63.3	-84.1	0	0	0	114.3
509	T	27.6	Very low	29.5	Very low	113 Å²	113	122.1 Å²	122.1	69%	0.693	67%	0.67	S	S	*	*	S	Bend	trans	-175.8	146.2	151.3	29.8	0	0	0	0	108.6	E511	T509-E511 PolarHBondContact O-N 3.27Å; T509-E511 VanDerWaalsContact O-N 3.07Å
510	A	34	Very low	29.2	Very low	70 Å²	70	122.8 Å²	122.8	58%	0.579	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-50.5	117.1	168	0	0	0	0	0	108.4	M404	M404-A510 HydrophobicContact CE-CB 4.22Å
511	E	29.7	Very low	28.9	Very low	168 Å²	168	129.1 Å²	129.1	79%	0.785	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-55.7	142.1	-177	-74.7	-179.9	152.4	0	0	110.6	T509	T509-E511 PolarHBondContact O-N 3.27Å; T509-E511 VanDerWaalsContact O-N 3.07Å
512	H	30.9	Very low	28.7	Very low	181 Å²	181	137 Å²	137	84%	0.838	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-56.4	136.6	-175.4	-82.7	-97.3	0	0	0	111.9	L514	H512-L514 PolarHBondContact O-N 3.29Å
513	E	36.1	Very low	28.9	Very low	94 Å²	94	136.8 Å²	136.8	44%	0.439	71%	0.706	S	S	.	*			trans	-40	118.4	177.9	-66.1	175.1	161.8	0	0	112.4	S388 V395 I515	S388-E513 WeakPolarHBondContact CB-OE1 3.48Å; S388-E513 VanDerWaalsContact OG-CD 3.3Å; S388-E513 PolarHBondContact OG-OE1 3.22Å; V395-E513 HydrophobicContact CG1-CB 3.73Å; V395-E513 HydrophobicContact CG1-CG 3.86Å; V395-E513 HydrophobicContact CG2-CB 3.98Å; E513-I515 PolarHBondContact O-N 3.04Å
514	L	35.1	Very low	29	Very low	37 Å²	37	139.1 Å²	139.1	19%	0.194	71%	0.713	C	S	.	*			trans	-68.3	119.2	172.3	-79.6	157.3	0	0	0	109.2	G394 V395 I398 S500 H512	G394-L514 VanDerWaalsContact O-O 3.04Å; V395-L514 WeakPolarHBondContact CA-O 3.17Å; I398-L514 HydrophobicContact CD1-CD1 3.55Å; I398-L514 HydrophobicContact CG1-CD1 4.08Å; S500-L514 WeakPolarHBondContact O-CD2 3.44Å; H512-L514 PolarHBondContact O-N 3.29Å
515	I	34	Very low	29.1	Very low	103 Å²	103	139.8 Å²	139.8	53%	0.528	72%	0.715	S	S	.	*	B	Isolated β-bridge	trans	-92.7	107.9	174.5	-58.1	172.9	0	0	0	107.9	G394 E513	G394-I515 CarbonylContact O-C 3.55Å; G394-I515 WeakPolarHBondContact O-CA 3.42Å; E513-I515 PolarHBondContact O-N 3.04Å
516	F	28.4	Very low	29.7	Very low	110 Å²	110	143 Å²	143	48%	0.482	72%	0.721	S	S	.	*	P	Polyproline II helix	trans	-85.3	124.5	173.1	-157.8	-92.4	0	0	0	110.1	G394	G394-F516 PolarHBondContact O-N 3.31Å
517	H	28.3	Very low	30.2	Very low	153 Å²	153	143.7 Å²	143.7	71%	0.708	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-89.6	123.6	169.7	-69.8	-71.1	0	0	0	109.2
518	P	28	Very low	30.8	Very low	106 Å²	106	143.4 Å²	143.4	69%	0.688	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-60.4	143.6	177.8	22.8	-30	0	0	0	110.3	Q520	P518-Q520 PolarHBondContact O-N 2.93Å; P518-Q520 VanDerWaalsContact O-N 3.09Å
519	P	28.2	Very low	31.6	Very low	116 Å²	116	137.2 Å²	137.2	75%	0.753	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-62.6	117	-174.8	-17.4	29.3	0	0	0	110.4	E521	P519-E521 PolarHBondContact O-N 3.03Å
520	Q	29.5	Very low	32.2	Very low	178 Å²	178	140 Å²	140	83%	0.832	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-56.6	130	167.4	-74.6	-176.5	-23.1	0	0	109	P518 R522	P518-Q520 PolarHBondContact O-N 2.93Å; P518-Q520 VanDerWaalsContact O-N 3.09Å; Q520-R522 PolarHBondContact O-N 3Å
521	E	27.1	Very low	32.7	Very low	188 Å²	188	141 Å²	141	88%	0.879	68%	0.678	S	S	*	*			trans	-29.8	87.6	179	-66.2	173.9	156	0	0	113.3	P519 H523	P519-E521 PolarHBondContact O-N 3.03Å; E521-H523 PolarHBondContact O-N 3.31Å; E521-H523 VanDerWaalsContact O-N 3.15Å
522	R	29.6	Very low	33.2	Very low	240 Å²	240	139.2 Å²	139.2	91%	0.906	67%	0.668	S	S	*	*			trans	-80.6	100.7	168.7	-78.9	-170.8	-173.4	174.4	4.3	107.5	Q520 L524	Q520-R522 PolarHBondContact O-N 3Å; R522-L524 PolarHBondContact O-N 2.95Å
523	H	28.5	Very low	33.9	Very low	171 Å²	171	137.3 Å²	137.3	79%	0.792	66%	0.659	S	S	*	*			trans	-24.8	113.7	164.8	-73.5	-79	0	0	0	113.9	E521 R525	E521-H523 PolarHBondContact O-N 3.31Å; E521-H523 VanDerWaalsContact O-N 3.15Å; H523-R525 PolarHBondContact O-N 3.36Å
524	L	28.5	Very low	34.3	Very low	168 Å²	168	140 Å²	140	88%	0.88	67%	0.672	S	S	*	*			trans	21.6	86	142.2	-73.4	146.7	0	0	0	115.4	R522	R522-L524 PolarHBondContact O-N 2.95Å
525	R	28.7	Very low	34.7	Very low	234 Å²	234	146.7 Å²	146.7	88%	0.883	70%	0.695	S	S	*	*			trans	-131.6	107.2	152.1	-83	-171.5	175.2	178.7	-1.2	109.5	H523	H523-R525 PolarHBondContact O-N 3.36Å
526	T	36.1	Very low	35.1	Very low	137 Å²	137	147 Å²	147	84%	0.84	69%	0.694	S	S	*	*			trans	45.5	97.6	154.5	39.1	0	0	0	0	116	D528	T526-D528 PolarHBondContact O-N 3.03Å
527	E	35.3	Very low	35.9	Very low	146 Å²	146	144.6 Å²	144.6	68%	0.682	69%	0.694	S	S	*	*			trans	-50	124.8	172.7	-75.5	-176.9	148.5	0	0	111.5
528	D	38.2	Very low	36.5	Very low	62 Å²	62	141.4 Å²	141.4	33%	0.332	70%	0.695	S	S	.	*			trans	-60.1	125.8	169.6	-174	-36.3	0	0	0	108.7	T526 R530 I531	T526-D528 PolarHBondContact O-N 3.03Å; D528-R530 PolarHBondContact O-N 2.9Å; D528-R530 IonicContact OD1-CZ 2.74Å; D528-R530 PolarHBondContact OD1-N 3.38Å; D528-R530 VanDerWaalsContact OD1-N 3.12Å; D528-R530 IonicContact OD1-NE 2.73Å; D528-R530 PolarHBondContact OD1-NE 3Å; D528-R530 IonicContact OD1-NH2 3.45Å; D528-R530 IonicContact OD2-CZ 3.61Å; D528-R530 IonicContact OD2-NE 3.88Å; D528-R530 PolarHBondContact OD2-NE 2.92Å; D528-R530 IonicContact OD2-NH2 3.75Å; D528-R530 PolarHBondContact OD2-NH2 3.42Å; D528-I531 HydrophobicContact CB-CD1 4.34Å; D528-I531 HydrophobicContact CB-CG1 4.48Å; D528-I531 PolarHBondContact O-N 3.25Å
529	P	41.8	Very low	37.1	Very low	106 Å²	106	143.4 Å²	143.4	69%	0.688	70%	0.698	S	S	*	*	H	α-helix	trans	-57.5	-18.7	-175.4	18.5	-29.7	0	0	0	114.2	I531 K532	P529-I531 VanDerWaalsContact C-N 3.33Å; P529-I531 PolarHBondContact O-N 3.33Å; P529-K532 WeakPolarHBondContact O-CB 3.45Å; P529-K532 PolarHBondContact O-N 3.47Å
530	R	41.3	Very low	37.3	Very low	173 Å²	173	144.4 Å²	144.4	65%	0.653	70%	0.696	S	S	*	*	H	α-helix	trans	-68.6	-28.6	174.7	-68.4	174.8	-74.1	-178.3	-0.6	113.7	D528 K532 E533 E534	D528-R530 PolarHBondContact O-N 2.9Å; D528-R530 IonicContact OD1-CZ 2.74Å; D528-R530 PolarHBondContact OD1-N 3.38Å; D528-R530 VanDerWaalsContact OD1-N 3.12Å; D528-R530 IonicContact OD1-NE 2.73Å; D528-R530 PolarHBondContact OD1-NE 3Å; D528-R530 IonicContact OD1-NH2 3.45Å; D528-R530 IonicContact OD2-CZ 3.61Å; D528-R530 IonicContact OD2-NE 3.88Å; D528-R530 PolarHBondContact OD2-NE 2.92Å; D528-R530 IonicContact OD2-NH2 3.75Å; D528-R530 PolarHBondContact OD2-NH2 3.42Å; R530-K532 VanDerWaalsContact C-N 3.28Å; R530-K532 PolarHBondContact O-N 3.43Å; R530-E533 PolarHBondContact O-N 2.86Å; R530-E534 PolarHBondContact O-N 3.07Å
531	I	43.4	Very low	37.4	Very low	89 Å²	89	138.8 Å²	138.8	46%	0.456	69%	0.686	S	S	.	*	H	α-helix	trans	-73.6	-26.2	177.9	-60.6	175	0	0	0	110.7	D528 P529 R535	D528-I531 HydrophobicContact CB-CD1 4.34Å; D528-I531 HydrophobicContact CB-CG1 4.48Å; D528-I531 PolarHBondContact O-N 3.25Å; P529-I531 VanDerWaalsContact C-N 3.33Å; P529-I531 PolarHBondContact O-N 3.33Å; I531-R535 PolarHBondContact O-N 3.33Å
532	K	40.1	Very low	37.8	Very low	132 Å²	132	135.1 Å²	135.1	57%	0.574	68%	0.678	S	S	*	*	H	α-helix	trans	-69	-38.5	173.8	-157.6	179.9	178.5	-171	0	111.3	P529 R530 R535 E536	P529-K532 WeakPolarHBondContact O-CB 3.45Å; P529-K532 PolarHBondContact O-N 3.47Å; R530-K532 VanDerWaalsContact C-N 3.28Å; R530-K532 PolarHBondContact O-N 3.43Å; K532-R535 PolarHBondContact O-N 3.32Å; K532-E536 WeakPolarHBondContact O-CG 3.32Å; K532-E536 PolarHBondContact O-N 2.93Å
533	E	46	Very low	37.7	Very low	141 Å²	141	130.4 Å²	130.4	66%	0.659	68%	0.676	S	S	*	*	H	α-helix	trans	-67	-39.1	177.8	-129.2	174	-173.2	0	0	112.2	R530 E536 A537	R530-E533 PolarHBondContact O-N 2.86Å; E533-E536 PolarHBondContact O-N 3.45Å; E533-A537 VanDerWaalsContact O-CB 3.29Å; E533-A537 WeakPolarHBondContact O-CB 3.49Å; E533-A537 PolarHBondContact O-N 3.34Å
534	E	43.4	Very low	38	Very low	150 Å²	150	128.1 Å²	128.1	70%	0.701	67%	0.669	S	S	*	*	H	α-helix	trans	-68.3	-34.4	175.1	-76.8	-171.4	157.3	0	0	113.2	R530 A538	R530-E534 PolarHBondContact O-N 3.07Å; E534-A538 PolarHBondContact O-N 3.12Å
535	R	43.4	Very low	38.1	Very low	178 Å²	178	124.6 Å²	124.6	67%	0.672	66%	0.658	S	S	*	*	H	α-helix	trans	-68	-38.4	173.5	-99.7	-176.9	170.3	169.9	-1	112.3	I531 K532	I531-R535 PolarHBondContact O-N 3.33Å; K532-R535 PolarHBondContact O-N 3.32Å
536	E	42.5	Very low	38	Very low	109 Å²	109	118.6 Å²	118.6	51%	0.509	65%	0.652	S	S	.	*	H	α-helix	trans	-72.5	-35.5	176.3	-72.3	176.5	-172.4	0	0	111.3	K532 E533 A538 I539	K532-E536 WeakPolarHBondContact O-CG 3.32Å; K532-E536 PolarHBondContact O-N 2.93Å; E533-E536 PolarHBondContact O-N 3.45Å; E536-A538 VanDerWaalsContact C-N 3.34Å; E536-A538 PolarHBondContact O-N 2.96Å; E536-I539 PolarHBondContact O-N 2.91Å
537	A	45.3	Very low	37.6	Very low	59 Å²	59	123 Å²	123	49%	0.488	65%	0.653	S	S	.	*	H	α-helix	trans	-66.9	-30.9	174.1	0	0	0	0	0	113.1	E533 I539 L540	E533-A537 VanDerWaalsContact O-CB 3.29Å; E533-A537 WeakPolarHBondContact O-CB 3.49Å; E533-A537 PolarHBondContact O-N 3.34Å; A537-I539 PolarHBondContact O-N 2.97Å; A537-L540 PolarHBondContact O-N 2.88Å
538	A	40.7	Very low	37.1	Very low	87 Å²	87	124.6 Å²	124.6	72%	0.719	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-16.8	175.8	0	0	0	0	0	114	E534 E536	E534-A538 PolarHBondContact O-N 3.12Å; E536-A538 VanDerWaalsContact C-N 3.34Å; E536-A538 PolarHBondContact O-N 2.96Å
539	I	41.6	Very low	36.7	Very low	147 Å²	147	126.1 Å²	126.1	75%	0.754	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-23.1	175.1	-61.8	172.2	0	0	0	110.8	E536 A537	E536-I539 PolarHBondContact O-N 2.91Å; A537-I539 PolarHBondContact O-N 2.97Å
540	L	31.6	Very low	35.9	Very low	138 Å²	138	131 Å²	131	72%	0.723	69%	0.687	S	S	*	*	S	Bend	trans	-92.5	122	176.7	-72.4	160.4	0	0	0	109.2	A537	A537-L540 PolarHBondContact O-N 2.88Å
541	G	32.8	Very low	35.2	Very low	60 Å²	60	129.2 Å²	129.2	62%	0.619	68%	0.684	S	S	*	*			trans	-52.6	163.9	-171.9	0	0	0	0	0	115.2	T543	G541-T543 PolarHBondContact O-N 3.28Å; G541-T543 VanDerWaalsContact O-N 3.09Å
542	P	35.2	Very low	34.3	Very low	110 Å²	110	134 Å²	134	71%	0.714	70%	0.701	S	S	*	*			trans	-74.1	106.7	-157.6	30.1	-34.7	0	0	0	112.3	I544	P542-I544 VanDerWaalsContact C-N 3.34Å; P542-I544 HydrophobicContact CB-CG1 4.21Å; P542-I544 PolarHBondContact O-N 2.84Å
543	T	28.2	Very low	33.8	Very low	141 Å²	141	131.8 Å²	131.8	87%	0.865	70%	0.7	S	S	*	*			trans	-76.6	89	154	34.2	0	0	0	0	108.8	G541 S545	G541-T543 PolarHBondContact O-N 3.28Å; G541-T543 VanDerWaalsContact O-N 3.09Å; T543-S545 PolarHBondContact O-N 2.87Å
544	I	34.8	Very low	32.9	Very low	124 Å²	124	134.3 Å²	134.3	64%	0.636	71%	0.712	S	S	*	*			trans	-71.4	96.6	168.7	-59.5	177.3	0	0	0	107	T135 P542 S546	T135-I544 HydrophobicContact CG2-CD1 3.86Å; P542-I544 VanDerWaalsContact C-N 3.34Å; P542-I544 HydrophobicContact CB-CG1 4.21Å; P542-I544 PolarHBondContact O-N 2.84Å; I544-S546 PolarHBondContact O-N 3.29Å; I544-S546 VanDerWaalsContact O-N 3.08Å
545	S	28.8	Very low	32.2	Very low	93 Å²	93	135.4 Å²	135.4	65%	0.65	72%	0.715	S	S	*	*			trans	-61.9	107.1	163.5	153.7	0	0	0	0	107.8	T543 R547	T543-S545 PolarHBondContact O-N 2.87Å; S545-R547 PolarHBondContact O-N 3.45Å
546	S	28.1	Very low	31.4	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	72%	0.719	S	S	*	*			trans	-62.5	79.8	167.7	59.5	0	0	0	0	110.1	I544 E548	I544-S546 PolarHBondContact O-N 3.29Å; I544-S546 VanDerWaalsContact O-N 3.08Å; S546-E548 PolarHBondContact O-N 2.96Å
547	R	26.8	Very low	30.6	Very low	230 Å²	230	131.9 Å²	131.9	87%	0.868	73%	0.729	S	S	*	*			trans	-82.9	97.2	159.8	-90.1	-175.1	172.5	-177.2	-1.2	106.4	S545 S549	S545-R547 PolarHBondContact O-N 3.45Å; R547-S549 PolarHBondContact O-N 3.33Å; R547-S549 VanDerWaalsContact O-N 3.14Å
548	E	25.5	Very low	29.8	Very low	179 Å²	179	134.4 Å²	134.4	84%	0.836	74%	0.741	S	S	*	*			trans	-46.1	118.7	166.9	-69.4	178.9	158.8	0	0	108.8	S546 K550	S546-E548 PolarHBondContact O-N 2.96Å; E548-K550 PolarHBondContact O-N 2.91Å; E548-K550 VanDerWaalsContact O-N 3.17Å
549	S	29.5	Very low	29.2	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	75%	0.747	S	S	*	*			trans	-64.8	119.3	174.3	72.8	0	0	0	0	107.4	R547 F551	R547-S549 PolarHBondContact O-N 3.33Å; R547-S549 VanDerWaalsContact O-N 3.14Å; S549-F551 PolarHBondContact O-N 3.46Å
550	K	25.1	Very low	28.5	Very low	209 Å²	209	138.5 Å²	138.5	91%	0.909	75%	0.75	S	S	*	*			trans	-73.9	24	173.8	-74.6	-172.6	176.7	-179.6	0	112.6	E548 K552	E548-K550 PolarHBondContact O-N 2.91Å; E548-K550 VanDerWaalsContact O-N 3.17Å; K550-K552 PolarHBondContact O-N 3.34Å
551	F	27.1	Very low	28.3	Very low	136 Å²	136	140.5 Å²	140.5	60%	0.596	76%	0.757	S	S	*	*			trans	-90.7	87.9	175.6	-83.7	-84.4	0	0	0	109	S549 P553	S549-F551 PolarHBondContact O-N 3.46Å; F551-P553 WeakPolarHBondContact O-CD 3.41Å
552	K	24.7	Very low	28.2	Very low	189 Å²	189	143 Å²	143	82%	0.822	76%	0.763	S	S	*	*			trans	-69.9	119.6	161.1	-79.6	-174.1	176.1	-177.7	0	107.4	K550 H554	K550-K552 PolarHBondContact O-N 3.34Å; K552-H554 PolarHBondContact O-N 3.13Å; K552-H554 VanDerWaalsContact O-N 3.15Å
553	P	29	Very low	28.1	Very low	85 Å²	85	143.4 Å²	143.4	55%	0.552	77%	0.766	S	S	*	*			trans	-58.6	123	173.9	21.5	-30.1	0	0	0	108.8	F551 F555	F551-P553 WeakPolarHBondContact O-CD 3.41Å; P553-F555 VanDerWaalsContact C-N 3.27Å; P553-F555 HydrophobicContact CB-CE2 4.32Å; P553-F555 HydrophobicContact CG-CD2 4.32Å; P553-F555 HydrophobicContact CG-CE2 3.82Å; P553-F555 PolarHBondContact O-N 3.01Å
554	H	27.6	Very low	28.3	Very low	195 Å²	195	145 Å²	145	90%	0.903	77%	0.768	S	S	*	*			trans	-65.9	90.1	171.6	-89.8	-72.1	0	0	0	108.6	K552 A556	K552-H554 PolarHBondContact O-N 3.13Å; K552-H554 VanDerWaalsContact O-N 3.15Å; H554-A556 VanDerWaalsContact C-N 3.25Å; H554-A556 PolarHBondContact O-N 3.29Å
555	F	27.8	Very low	28.3	Very low	173 Å²	173	148 Å²	148	76%	0.759	78%	0.779	S	S	*	*			trans	-68.9	87.7	162.5	-74.4	-81.6	0	0	0	108.2	P553 V557	P553-F555 VanDerWaalsContact C-N 3.27Å; P553-F555 HydrophobicContact CB-CE2 4.32Å; P553-F555 HydrophobicContact CG-CD2 4.32Å; P553-F555 HydrophobicContact CG-CE2 3.82Å; P553-F555 PolarHBondContact O-N 3.01Å; F555-V557 HydrophobicContact CB-CG2 4.46Å; F555-V557 PolarHBondContact O-N 2.95Å
556	A	26.5	Very low	28.6	Very low	92 Å²	92	155 Å²	155	76%	0.76	79%	0.791	S	S	*	*			trans	-70.5	83.7	158.3	0	0	0	0	0	107.4	H554 P558	H554-A556 VanDerWaalsContact C-N 3.25Å; H554-A556 PolarHBondContact O-N 3.29Å; A556-P558 VanDerWaalsContact O-CD 3.28Å; A556-P558 WeakPolarHBondContact O-CD 3.5Å
557	V	26.1	Very low	28.9	Very low	120 Å²	120	159 Å²	159	73%	0.727	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-58.6	117.6	167.2	-179.9	0	0	0	0	106.6	F555 K559	F555-V557 HydrophobicContact CB-CG2 4.46Å; F555-V557 PolarHBondContact O-N 2.95Å; V557-K559 PolarHBondContact O-N 2.96Å; V557-K559 VanDerWaalsContact O-N 3.15Å
558	P	28.2	Very low	29.4	Very low	113 Å²	113	159.5 Å²	159.5	73%	0.734	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-62.1	121.6	-179.5	-17.1	29.2	0	0	0	108.6	A556	A556-P558 VanDerWaalsContact O-CD 3.28Å; A556-P558 WeakPolarHBondContact O-CD 3.5Å
559	K	27.7	Very low	30.1	Very low	195 Å²	195	155.5 Å²	155.5	85%	0.848	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-58.6	129.6	170.9	-78	-178	177	178	0	108.2	V557 M561	V557-K559 PolarHBondContact O-N 2.96Å; V557-K559 VanDerWaalsContact O-N 3.15Å; K559-M561 PolarHBondContact O-N 3.27Å
560	P	28.5	Very low	30.5	Very low	125 Å²	125	163 Å²	163	81%	0.812	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-59.8	130.7	-179.2	21.8	-30.1	0	0	0	110.2
561	M	27.4	Very low	31.1	Very low	179 Å²	179	163 Å²	163	88%	0.882	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-57.2	135.9	178.9	-85.1	-161.9	-79.4	0	0	110.9	K559	K559-M561 PolarHBondContact O-N 3.27Å
562	P	29.2	Very low	31.5	Very low	112 Å²	112	159.9 Å²	159.9	73%	0.727	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-63.5	145.8	174.7	-15.4	28.2	0	0	0	111.1	L564	P562-L564 PolarHBondContact O-N 3.29Å
563	P	33.1	Very low	32	Very low	120 Å²	120	162.9 Å²	162.9	78%	0.779	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-63.8	128.7	-176.1	24.5	-31.4	0	0	0	111.3	H565	P563-H565 PolarHBondContact O-N 3.41Å
564	L	33.8	Very low	32.2	Very low	174 Å²	174	166.8 Å²	166.8	91%	0.911	86%	0.857	S	S	*	*			trans	-51	106.7	175.2	-82.3	139.5	0	0	0	110.9	P562 R566	P562-L564 PolarHBondContact O-N 3.29Å; L564-R566 PolarHBondContact O-N 3.09Å; L564-R566 VanDerWaalsContact O-N 3.09Å
565	H	34.7	Very low	32.4	Very low	186 Å²	186	165.3 Å²	165.3	86%	0.861	86%	0.855	S	S	*	*			trans	-61.7	113.4	167	-94.7	-50	0	0	0	108.9	P563 M567	P563-H565 PolarHBondContact O-N 3.41Å; H565-M567 PolarHBondContact O-N 3.18Å
566	R	34.4	Very low	32.7	Very low	242 Å²	242	164.8 Å²	164.8	91%	0.913	86%	0.86	S	S	*	*			trans	-48.4	104.5	167.6	-84.7	179.6	169.3	176.6	-3.2	109.4	L564 R568	L564-R566 PolarHBondContact O-N 3.09Å; L564-R566 VanDerWaalsContact O-N 3.09Å; R566-R568 PolarHBondContact O-N 3.18Å; R566-R568 VanDerWaalsContact O-N 3.07Å
567	M	35.3	Very low	33	Very low	191 Å²	191	169.1 Å²	169.1	94%	0.941	87%	0.866	S	S	*	*			trans	-58.1	111.4	166.1	-87	-179.8	149.2	0	0	108.4	H565 A569	H565-M567 PolarHBondContact O-N 3.18Å; M567-A569 PolarHBondContact O-N 3.32Å
568	R	36.9	Very low	33.5	Very low	240 Å²	240	172.2 Å²	172.2	91%	0.906	88%	0.875	S	S	*	*			trans	-61	119.4	170.7	-80.4	179.4	170.4	178.4	-3.1	108.6	R566 R570	R566-R568 PolarHBondContact O-N 3.18Å; R566-R568 VanDerWaalsContact O-N 3.07Å; R568-R570 PolarHBondContact O-N 3.02Å
569	A	40.6	Very low	33.8	Very low	95 Å²	95	176.1 Å²	176.1	79%	0.785	88%	0.884	S	S	*	*			trans	-56.4	110.3	168.3	0	0	0	0	0	109.4	M567 K571	M567-A569 PolarHBondContact O-N 3.32Å; A569-K571 PolarHBondContact O-N 2.75Å
570	R	37.7	Very low	34.3	Very low	251 Å²	251	174.8 Å²	174.8	95%	0.947	89%	0.887	S	S	*	*			trans	-67.5	98.3	166.5	-82.6	-178.8	170.3	177.9	-3	107.7	R568	R568-R570 PolarHBondContact O-N 3.02Å
571	K	36.4	Very low	34.7	Very low	211 Å²	211	178.6 Å²	178.6	92%	0.917	89%	0.892	S	S	*	*			trans	-77.9	117.8	155	-80	-174.6	173	-175.3	0	107	A569	A569-K571 PolarHBondContact O-N 2.75Å
572	G	36	Very low	35.3	Very low	69 Å²	69	178.6 Å²	178.6	71%	0.711	89%	0.893	S	S	*	*			trans	-167.9	58.9	-177.3	0	0	0	0	0	111.3
573	L	35.6	Very low	35.9	Very low	252 Å²	252	184.6 Å²	184.6	100%	1.319	91%	0.908	S	S	*	*			trans	-168.3	0	137	-101.1	156.5	0	0	0	107.5

Retrieved 573 of 573 residues in 413.8 ms (Link to these results)

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