A0A5K4FDS8_SCHMA Loading...

Pur_ac_phosph_N domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FDS8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 267 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	27	Very low	28.4	Very low	249 Å²	249	163.4 Å²	163.4	100%	1.227	80%	0.795	S	S	*	*				0	90.7	0	-150	173.7	-173.5	0	0	106.4
2	I	27.8	Very low	28.6	Very low	168 Å²	168	160.8 Å²	160.8	86%	0.862	79%	0.787	S	S	*	*			trans	-115	122.2	175	-65.6	176.1	0	0	0	106
3	R	23.6	Very low	28.6	Very low	211 Å²	211	155.2 Å²	155.2	80%	0.796	78%	0.782	S	S	*	*			trans	-84.4	123.4	171.2	179.3	179.9	178.7	-174.3	-2.8	106.8	D5	R3-D5 IonicContact CZ-OD2 3.23Å; R3-D5 VanDerWaalsContact CZ-OD2 3.23Å; R3-D5 IonicContact NE-OD2 2.76Å; R3-D5 PolarHBondContact NE-OD2 2.81Å; R3-D5 IonicContact NH2-OD2 2.81Å; R3-D5 PolarHBondContact NH2-OD2 2.76Å
4	S	30.4	Very low	28.5	Very low	111 Å²	111	150.3 Å²	150.3	78%	0.776	76%	0.764	S	S	*	*			trans	-122.7	87.6	158.7	63.7	0	0	0	0	107
5	D	28.2	Very low	28.2	Very low	105 Å²	105	151.7 Å²	151.7	56%	0.561	77%	0.769	S	S	*	*			trans	-69.6	151.9	149	-69.7	-40.7	0	0	0	107	R3	R3-D5 IonicContact CZ-OD2 3.23Å; R3-D5 VanDerWaalsContact CZ-OD2 3.23Å; R3-D5 IonicContact NE-OD2 2.76Å; R3-D5 PolarHBondContact NE-OD2 2.81Å; R3-D5 IonicContact NH2-OD2 2.81Å; R3-D5 PolarHBondContact NH2-OD2 2.76Å
6	E	27.8	Very low	28.5	Very low	171 Å²	171	147.9 Å²	147.9	80%	0.799	75%	0.75	S	S	*	*			trans	121.5	103.5	159.6	-62.7	-172.3	170.2	0	0	117.3
7	Y	28.2	Very low	28.4	Very low	204 Å²	204	146.5 Å²	146.5	80%	0.8	75%	0.75	S	S	*	*			trans	51.6	87.4	133.6	-66.2	-87.2	0	0	0	119.2	S9	Y7-S9 VanDerWaalsContact C-N 3.3Å; Y7-S9 PolarHBondContact O-N 3.16Å
8	I	31.1	Very low	28.5	Very low	170 Å²	170	144.8 Å²	144.8	87%	0.872	74%	0.737	S	S	*	*			trans	-90	89.3	136	-60.5	-178.4	0	0	0	106.7	I10	I8-I10 PolarHBondContact O-N 3.21Å
9	S	28.3	Very low	28.5	Very low	54 Å²	54	141.6 Å²	141.6	38%	0.378	73%	0.725	S	S	.	*			trans	-42.7	122.3	175	-168.3	0	0	0	0	112.7	Y7 F11 L12	Y7-S9 VanDerWaalsContact C-N 3.3Å; Y7-S9 PolarHBondContact O-N 3.16Å; S9-F11 PolarHBondContact O-N 2.83Å; S9-F11 WeakPolarHBondContact OG-CB 3.27Å; S9-F11 PolarHBondContact OG-N 3.01Å; S9-L12 PolarHBondContact O-N 3.5Å
10	I	31.5	Very low	28.7	Very low	168 Å²	168	136.1 Å²	136.1	86%	0.862	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-4.2	162.2	-70.2	167.3	0	0	0	111.6	I8	I8-I10 PolarHBondContact O-N 3.21Å
11	F	28.8	Very low	28.9	Very low	186 Å²	186	133.8 Å²	133.8	82%	0.816	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	13.8	175	-80.8	-85.9	0	0	0	116.3	S9 A13	S9-F11 PolarHBondContact O-N 2.83Å; S9-F11 WeakPolarHBondContact OG-CB 3.27Å; S9-F11 PolarHBondContact OG-N 3.01Å; F11-A13 PolarHBondContact O-N 2.91Å; F11-A13 VanDerWaalsContact O-N 3.07Å
12	L	31.1	Very low	29	Very low	133 Å²	133	127.9 Å²	127.9	70%	0.696	66%	0.656	S	S	*	*			trans	-83.2	59.4	155.9	-92.5	150.1	0	0	0	109.5	S9 V14	S9-L12 PolarHBondContact O-N 3.5Å; L12-V14 HydrophobicContact CB-CG2 4.06Å; L12-V14 HydrophobicContact CD2-CG2 3.49Å; L12-V14 VanDerWaalsContact CD2-CG2 3.49Å; L12-V14 HydrophobicContact CG-CG2 4.39Å; L12-V14 PolarHBondContact O-N 2.75Å
13	A	27.4	Very low	28.9	Very low	88 Å²	88	124.4 Å²	124.4	73%	0.727	64%	0.643	S	S	*	*			trans	-60.6	76.8	140	0	0	0	0	0	105.8	F11 M15	F11-A13 PolarHBondContact O-N 2.91Å; F11-A13 VanDerWaalsContact O-N 3.07Å; A13-M15 PolarHBondContact O-N 3.23Å
14	V	27.9	Very low	29.3	Very low	86 Å²	86	118.7 Å²	118.7	52%	0.521	63%	0.632	S	S	.	*			trans	-54.9	113.8	175.5	174.2	0	0	0	0	104.9	L12 I16	L12-V14 HydrophobicContact CB-CG2 4.06Å; L12-V14 HydrophobicContact CD2-CG2 3.49Å; L12-V14 VanDerWaalsContact CD2-CG2 3.49Å; L12-V14 HydrophobicContact CG-CG2 4.39Å; L12-V14 PolarHBondContact O-N 2.75Å; V14-I16 HydrophobicContact CB-CG1 4.25Å; V14-I16 HydrophobicContact CG1-CG1 3.91Å; V14-I16 PolarHBondContact O-N 3.36Å
15	M	23.7	Very low	29.5	Very low	171 Å²	171	121.5 Å²	121.5	84%	0.842	64%	0.638	S	S	*	*			trans	-52.2	91.3	152.5	-77	-89.1	-80.5	0	0	105.5	A13 V17	A13-M15 PolarHBondContact O-N 3.23Å; M15-V17 PolarHBondContact O-N 3.2Å
16	I	32.5	Very low	29.7	Very low	91 Å²	91	119.7 Å²	119.7	47%	0.467	64%	0.644	S	S	.	*			trans	-67.9	96.5	177.7	-66.7	175.7	0	0	0	105	V14 F18 M218 N254	V14-I16 HydrophobicContact CB-CG1 4.25Å; V14-I16 HydrophobicContact CG1-CG1 3.91Å; V14-I16 PolarHBondContact O-N 3.36Å; I16-F18 PolarHBondContact O-N 3.18Å; I16-M218 HydrophobicContact CD1-CE 4.44Å; I16-N254 WeakPolarHBondContact CG2-ND2 3.44Å
17	V	27.7	Very low	29.6	Very low	124 Å²	124	118.8 Å²	118.8	75%	0.752	64%	0.64	S	S	*	*			trans	-62.5	119.9	173.2	173.8	0	0	0	0	107.6	M15	M15-V17 PolarHBondContact O-N 3.2Å
18	F	30.4	Very low	30	Very low	117 Å²	117	114.6 Å²	114.6	51%	0.513	63%	0.631	S	S	.	*			trans	-39.4	130.6	172.9	-63.9	-94.7	0	0	0	114.3	I16 I50 I93	I16-F18 PolarHBondContact O-N 3.18Å; F18-I50 HydrophobicContact CD1-CD1 4.3Å; F18-I50 HydrophobicContact CE1-CD1 3.69Å; F18-I93 HydrophobicContact CD1-CD1 4.48Å; F18-I93 HydrophobicContact CE1-CD1 4.33Å; F18-I93 HydrophobicContact CE1-CG2 4.27Å; F18-I93 HydrophobicContact CZ-CG2 4.15Å
19	T	28.2	Very low	30.3	Very low	84 Å²	84	113 Å²	113	52%	0.515	62%	0.62	S	S	.	*			trans	173.6	102.1	131.4	35.5	0	0	0	0	110.5	I21 L30	T19-I21 PolarHBondContact O-N 3.05Å; T19-L30 HydrophobicContact CG2-CD2 4.17Å
20	P	32.2	Very low	31.2	Very low	30 Å²	30	112.9 Å²	112.9	20%	0.195	62%	0.615	C	S	.	*			trans	-65.3	113.1	158.9	22.3	-32	0	0	0	109.8	L30 I255	P20-L30 HydrophobicContact CG-CB 4.5Å; P20-L30 HydrophobicContact CG-CD2 3.55Å; P20-I255 HydrophobicContact CB-CD1 3.81Å; P20-I255 HydrophobicContact CB-CG1 4.38Å
21	I	32.5	Very low	32.7	Very low	89 Å²	89	107 Å²	107	46%	0.456	59%	0.591	S	S	.	*			trans	-94.2	112.8	-175.5	-59.6	164.7	0	0	0	108.5	T19	T19-I21 PolarHBondContact O-N 3.05Å
22	H	30	Very low	34.7	Very low	124 Å²	124	101.3 Å²	101.3	57%	0.574	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.1	128.7	154.6	-117.1	-83.2	0	0	0	108.9	E29	H22-E29 PolarHBondContact N-O 2.82Å; H22-E29 PolarHBondContact O-N 3.04Å
23	T	24.9	Very low	36.9	Very low	95 Å²	95	97 Å²	97	58%	0.583	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	114	179.4	1.9	0	0	0	0	109.6
24	V	32.1	Very low	39.6	Very low	92 Å²	92	95.6 Å²	95.6	56%	0.558	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.4	160.1	-178.6	0	0	0	0	106.9	G26 Q27	V24-G26 VanDerWaalsContact C-N 3.27Å; V24-G26 PolarHBondContact O-N 2.78Å; V24-G26 VanDerWaalsContact O-N 3.17Å; V24-Q27 PolarHBondContact N-O 2.73Å; V24-Q27 PolarHBondContact O-N 3.49Å
25	N	34.3	Very low	42.5	Very low	169 Å²	169	92.7 Å²	92.7	90%	0.904	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	35.9	-177.9	-84.4	-5.1	0	0	0	116.2	Q27	N25-Q27 PolarHBondContact O-N 2.91Å
26	G	32.9	Very low	45.7	Very low	67 Å²	67	86 Å²	86	69%	0.691	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	7.3	173.6	0	0	0	0	0	115	V24	V24-G26 VanDerWaalsContact C-N 3.27Å; V24-G26 PolarHBondContact O-N 2.78Å; V24-G26 VanDerWaalsContact O-N 3.17Å
27	Q	27	Very low	48.2	Very low	153 Å²	153	85 Å²	85	72%	0.715	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.6	167.5	-73.8	180	-28.2	0	0	109.3	V24 N25 E29	V24-Q27 PolarHBondContact N-O 2.73Å; V24-Q27 PolarHBondContact O-N 3.49Å; N25-Q27 PolarHBondContact O-N 2.91Å; Q27-E29 PolarHBondContact O-N 3.46Å
28	N	36	Very low	50.9	Low	115 Å²	115	83.4 Å²	83.4	62%	0.615	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	110	177.7	-62	-26.7	0	0	0	108.5
29	E	36.8	Very low	53.3	Low	136 Å²	136	88.4 Å²	88.4	64%	0.636	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	129	165.4	-76.1	-169.4	160.2	0	0	109.1	H22 Q27 A31	H22-E29 PolarHBondContact N-O 2.82Å; H22-E29 PolarHBondContact O-N 3.04Å; Q27-E29 PolarHBondContact O-N 3.46Å; E29-A31 PolarHBondContact O-N 3.09Å
30	L	47.9	Very low	55.7	Low	53 Å²	53	91.7 Å²	91.7	28%	0.277	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-66.5	126.6	172.6	-68.7	161.3	0	0	0	108.3	T19 P20 Y32	T19-L30 HydrophobicContact CG2-CD2 4.17Å; P20-L30 HydrophobicContact CG-CB 4.5Å; P20-L30 HydrophobicContact CG-CD2 3.55Å; L30-Y32 HydrophobicContact CB-CE1 3.83Å; L30-Y32 HydrophobicContact CB-CE2 4.32Å; L30-Y32 HydrophobicContact CD1-CE1 4.29Å; L30-Y32 WeakPolarHBondContact O-CD2 3.19Å; L30-Y32 VanDerWaalsContact O-CE2 3.29Å; L30-Y32 WeakPolarHBondContact O-CE2 3.46Å; L30-Y32 PolarHBondContact O-N 3.38Å
31	A	62.1	Low	58.2	Low	44 Å²	44	93.5 Å²	93.5	36%	0.364	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-73.6	118.2	167.4	0	0	0	0	0	108.6	E29 I255	E29-A31 PolarHBondContact O-N 3.09Å; A31-I255 HydrophobicContact CB-CD1 4.36Å
32	Y	72.2	Confident	60.5	Low	66 Å²	66	93.6 Å²	93.6	26%	0.259	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-94.8	148	174.5	-54.7	-69.9	0	0	0	109.9	L30 T35 R48 I50 E60	L30-Y32 HydrophobicContact CB-CE1 3.83Å; L30-Y32 HydrophobicContact CB-CE2 4.32Å; L30-Y32 HydrophobicContact CD1-CE1 4.29Å; L30-Y32 WeakPolarHBondContact O-CD2 3.19Å; L30-Y32 VanDerWaalsContact O-CE2 3.29Å; L30-Y32 WeakPolarHBondContact O-CE2 3.46Å; L30-Y32 PolarHBondContact O-N 3.38Å; Y32-T35 HydrophobicContact CD2-CG2 3.99Å; Y32-T35 HydrophobicContact CG-CG2 4.01Å; Y32-R48 HydrophobicContact CD1-CB 3.81Å; Y32-R48 VanDerWaalsContact CD1-CD 3.5Å; Y32-R48 HydrophobicContact CD1-CG 4.21Å; Y32-R48 HydrophobicContact CE1-CB 4.36Å; Y32-R48 HydrophobicContact CE1-CG 4.46Å; Y32-R48 HydrophobicContact CG-CB 4.15Å; Y32-R48 HydrophobicContact CG-CG 4.32Å; Y32-R48 VanDerWaalsContact CZ-CD 3.45Å; Y32-R48 PolarHBondContact OH-NH1 2.79Å; Y32-I50 HydrophobicContact CD1-CG2 4.02Å; Y32-I50 HydrophobicContact CE1-CG2 4.15Å; Y32-E60 WeakPolarHBondContact CE1-OE2 3.07Å; Y32-E60 PolarHBondContact OH-OE2 3.08Å
33	L	76.5	Confident	63.1	Low	42 Å²	42	93.6 Å²	93.6	22%	0.22	50%	0.504	C	S	.	.	S	Bend	trans	-76.5	-36.8	178.2	-60.4	166.6	0	0	0	111.5	V49 E52 L215	L33-V49 HydrophobicContact CB-CB 4.1Å; L33-V49 HydrophobicContact CB-CG1 4.3Å; L33-V49 HydrophobicContact CD1-CB 4.45Å; L33-V49 HydrophobicContact CD1-CG1 3.81Å; L33-V49 PolarHBondContact N-O 2.72Å; L33-E52 HydrophobicContact CD1-CB 4.37Å; L33-L215 HydrophobicContact CD1-CD1 3.25Å; L33-L215 HydrophobicContact CD2-CD1 3.47Å; L33-L215 VanDerWaalsContact CD2-CD1 3.47Å; L33-L215 HydrophobicContact CD2-CD2 3.64Å; L33-L215 HydrophobicContact CD2-CG 3.95Å; L33-L215 HydrophobicContact CG-CD1 3.94Å
34	E	84.4	Confident	66	Low	59 Å²	59	91 Å²	91	28%	0.276	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	150.6	175.2	-172.9	58.4	-96.6	0	0	108.8	R48 V49 M127 Y129	E34-R48 VanDerWaalsContact O-CA 3.31Å; E34-R48 WeakPolarHBondContact O-CA 3.38Å; E34-V49 HydrophobicContact CB-CG2 4.15Å; E34-V49 PolarHBondContact O-N 3.37Å; E34-M127 HydrophobicContact CB-SD 4.12Å; E34-M127 HydrophobicContact CG-CG 4.15Å; E34-M127 HydrophobicContact CG-SD 3.77Å; E34-Y129 HydrophobicContact CB-CD2 3.51Å; E34-Y129 HydrophobicContact CB-CE2 3.88Å; E34-Y129 HydrophobicContact CG-CD2 3.93Å
35	T	87.5	Confident	68.6	Low	26 Å²	26	87.7 Å²	87.7	16%	0.16	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	151	176.4	73.5	0	0	0	0	110.5	Y32 M37 N45 R48 M127	Y32-T35 HydrophobicContact CD2-CG2 3.99Å; Y32-T35 HydrophobicContact CG-CG2 4.01Å; T35-M37 PolarHBondContact O-N 2.79Å; T35-M37 WeakPolarHBondContact OG1-CB 3.22Å; T35-M37 PolarHBondContact OG1-N 3.14Å; T35-N45 WeakPolarHBondContact CB-OD1 2.79Å; T35-R48 HydrophobicContact CG2-CB 4.36Å; T35-R48 HydrophobicContact CG2-CG 3.97Å; T35-M127 VanDerWaalsContact C-SD 3.56Å
36	N	90.8	Very high	71.4	Confident	30 Å²	30	80.5 Å²	80.5	16%	0.16	43%	0.429	C	S	.	.			trans	-78.2	21.8	171.3	76.2	-23.3	0	0	0	114	V38 T44 T46 F47 Q126 M127	N36-V38 PolarHBondContact O-N 2.66Å; N36-T44 PolarHBondContact OD1-O 3.31Å; N36-T46 PolarHBondContact ND2-OG1 2.75Å; N36-T46 PolarHBondContact OD1-N 2.86Å; N36-T46 PolarHBondContact OD1-OG1 2.68Å; N36-F47 PolarHBondContact N-O 3.23Å; N36-F47 PolarHBondContact OD1-N 3.26Å; N36-F47 PolarHBondContact OD1-O 3.12Å; N36-Q126 WeakPolarHBondContact CB-O 3.39Å; N36-Q126 PolarHBondContact ND2-O 3.5Å; N36-M127 HydrophobicContact CB-CB 4.07Å; N36-M127 HydrophobicContact CB-CG 4.26Å
37	M	86.2	Confident	74.3	Confident	70 Å²	70	77.3 Å²	77.3	35%	0.345	40%	0.396	S	S	.	.			trans	-62.5	128.6	178.3	-172.8	170.6	60.3	0	0	110	T35 D41 T44 N45	T35-M37 PolarHBondContact O-N 2.79Å; T35-M37 WeakPolarHBondContact OG1-CB 3.22Å; T35-M37 PolarHBondContact OG1-N 3.14Å; M37-D41 WeakPolarHBondContact CG-O 3.47Å; M37-T44 WeakPolarHBondContact CA-OG1 2.93Å; M37-N45 HydrophobicContact CB-CB 4.16Å; M37-N45 HydrophobicContact CG-CB 4.41Å
38	V	84.6	Confident	77.3	Confident	90 Å²	90	72.3 Å²	72.3	55%	0.545	37%	0.371	S	S	.	.			trans	-89.7	116.3	175.9	-179	0	0	0	0	108.1	N36 N40 D41 T44	N36-V38 PolarHBondContact O-N 2.66Å; V38-N40 PolarHBondContact O-N 3.36Å; V38-D41 PolarHBondContact O-N 3.45Å; V38-T44 HydrophobicContact CB-CG2 4.22Å; V38-T44 HydrophobicContact CG2-CG2 4.45Å; V38-T44 PolarHBondContact N-OG1 2.87Å
39	R	81.2	Confident	79.6	Confident	223 Å²	223	66.9 Å²	66.9	84%	0.842	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	-135.3	-175.1	-54.3	173.9	178.1	-170.7	-2	109.5
40	N	78.3	Confident	81.8	Confident	153 Å²	153	62 Å²	62	82%	0.818	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	26.6	178.1	-62.2	-16.3	0	0	0	112.3	V38 P42	V38-N40 PolarHBondContact O-N 3.36Å; N40-P42 WeakPolarHBondContact O-CD 3.29Å
41	D	84.4	Confident	83.3	Confident	67 Å²	67	62 Å²	62	36%	0.358	32%	0.318	S	S	.	.			trans	-91.8	101.6	178.3	-178.2	6.1	0	0	0	111.5	M37 V38 N43 T44	M37-D41 WeakPolarHBondContact CG-O 3.47Å; V38-D41 PolarHBondContact O-N 3.45Å; D41-N43 PolarHBondContact O-N 3.42Å; D41-N43 VanDerWaalsContact OD1-CB 3.28Å; D41-N43 WeakPolarHBondContact OD1-CB 3.43Å; D41-N43 PolarHBondContact OD1-N 3.31Å; D41-N43 PolarHBondContact OD1-ND2 2.75Å; D41-T44 HydrophobicContact CB-CG2 4.19Å; D41-T44 PolarHBondContact O-N 3.25Å; D41-T44 VanDerWaalsContact O-N 3.1Å; D41-T44 PolarHBondContact O-OG1 2.83Å
42	P	80.1	Confident	84.1	Confident	91 Å²	91	60.3 Å²	60.3	59%	0.591	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-62.9	-18.1	-177.5	28.3	-36.5	0	0	0	113.2	N40 T44 N45	N40-P42 WeakPolarHBondContact O-CD 3.29Å; P42-T44 PolarHBondContact O-N 3.26Å; P42-N45 WeakPolarHBondContact O-CB 3.06Å; P42-N45 PolarHBondContact O-N 2.91Å
43	N	84.6	Confident	84.4	Confident	125 Å²	125	60.2 Å²	60.2	67%	0.668	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-69.2	-21.6	178.5	-61.8	-61.4	0	0	0	113.1	D41	D41-N43 PolarHBondContact O-N 3.42Å; D41-N43 VanDerWaalsContact OD1-CB 3.28Å; D41-N43 WeakPolarHBondContact OD1-CB 3.43Å; D41-N43 PolarHBondContact OD1-N 3.31Å; D41-N43 PolarHBondContact OD1-ND2 2.75Å
44	T	86.4	Confident	84.5	Confident	40 Å²	40	62.5 Å²	62.5	25%	0.245	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-83.2	-16.1	178.4	62.8	0	0	0	0	112.9	N36 M37 V38 D41 P42 T46	N36-T44 PolarHBondContact OD1-O 3.31Å; M37-T44 WeakPolarHBondContact CA-OG1 2.93Å; V38-T44 HydrophobicContact CB-CG2 4.22Å; V38-T44 HydrophobicContact CG2-CG2 4.45Å; V38-T44 PolarHBondContact N-OG1 2.87Å; D41-T44 HydrophobicContact CB-CG2 4.19Å; D41-T44 PolarHBondContact O-N 3.25Å; D41-T44 VanDerWaalsContact O-N 3.1Å; D41-T44 PolarHBondContact O-OG1 2.83Å; P42-T44 PolarHBondContact O-N 3.26Å; T44-T46 PolarHBondContact O-N 3.05Å; T44-T46 PolarHBondContact O-OG1 3.05Å; T44-T46 VanDerWaalsContact O-OG1 3.05Å
45	N	86.9	Confident	84.5	Confident	22 Å²	22	63.1 Å²	63.1	12%	0.118	34%	0.336	C	S	.	.			trans	-70.9	88.7	-176.7	-172.7	-0.5	0	0	0	111.4	T35 M37 P42 R48	T35-N45 WeakPolarHBondContact CB-OD1 2.79Å; M37-N45 HydrophobicContact CB-CB 4.16Å; M37-N45 HydrophobicContact CG-CB 4.41Å; P42-N45 WeakPolarHBondContact O-CB 3.06Å; P42-N45 PolarHBondContact O-N 2.91Å; N45-R48 PolarHBondContact ND2-NE 2.75Å; N45-R48 VanDerWaalsContact ND2-NE 3.19Å; N45-R48 PolarHBondContact ND2-NH2 3.01Å; N45-R48 PolarHBondContact O-NH2 3.17Å; N45-R48 WeakPolarHBondContact OD1-CD 3.16Å; N45-R48 WeakPolarHBondContact OD1-CG 3.4Å; N45-R48 PolarHBondContact OD1-NE 2.74Å
46	T	92.6	Very high	84.4	Confident	18 Å²	18	62.2 Å²	62.2	11%	0.11	33%	0.331	C	S	.	.			trans	-118.6	-16	-170.1	46.3	0	0	0	0	113.6	N36 T44 W61 K62 Y125	N36-T46 PolarHBondContact ND2-OG1 2.75Å; N36-T46 PolarHBondContact OD1-N 2.86Å; N36-T46 PolarHBondContact OD1-OG1 2.68Å; T44-T46 PolarHBondContact O-N 3.05Å; T44-T46 PolarHBondContact O-OG1 3.05Å; T44-T46 VanDerWaalsContact O-OG1 3.05Å; T46-W61 CarbonylContact O-C 3.48Å; T46-W61 WeakPolarHBondContact O-CA 3.4Å; T46-W61 WeakPolarHBondContact O-CB 3.24Å; T46-K62 HydrophobicContact CG2-CB 4.18Å; T46-K62 HydrophobicContact CG2-CD 4.06Å; T46-K62 PolarHBondContact O-N 3.3Å; T46-Y125 HydrophobicContact CG2-CD1 4.39Å; T46-Y125 HydrophobicContact CG2-CE1 3.89Å; T46-Y125 WeakPolarHBondContact O-CD2 3.44Å
47	F	94.6	Very high	84.2	Confident	1 Å²	1	60.8 Å²	60.8	0%	0.004	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	134.2	178.6	-175.4	-133.8	0	0	0	110.2	N36 F59 E60 W61 L74 A110 Y125 M127	N36-F47 PolarHBondContact N-O 3.23Å; N36-F47 PolarHBondContact OD1-N 3.26Å; N36-F47 PolarHBondContact OD1-O 3.12Å; F47-F59 HydrophobicContact CD2-CB 4.43Å; F47-F59 HydrophobicContact CD2-CD1 4.5Å; F47-F59 HydrophobicContact CE1-CD1 4.05Å; F47-F59 HydrophobicContact CE1-CE1 4.23Å; F47-F59 HydrophobicContact CE2-CB 3.55Å; F47-F59 AromaticContact CE2-CD1 3.57Å; F47-F59 HydrophobicContact CE2-CD1 3.57Å; F47-F59 HydrophobicContact CE2-CE1 4.47Å; F47-F59 AromaticContact CE2-CG 3.77Å; F47-F59 HydrophobicContact CE2-CG 3.77Å; F47-F59 HydrophobicContact CZ-CB 4.1Å; F47-F59 AromaticContact CZ-CD1 3.28Å; F47-F59 HydrophobicContact CZ-CD1 3.28Å; F47-F59 AromaticContact CZ-CE1 3.76Å; F47-F59 HydrophobicContact CZ-CE1 3.76Å; F47-F59 AromaticContact CZ-CG 3.77Å; F47-F59 HydrophobicContact CZ-CG 3.77Å; F47-E60 WeakPolarHBondContact CA-O 3.49Å; F47-E60 WeakPolarHBondContact CD2-O 3.44Å; F47-W61 HydrophobicContact CD2-CB 4.04Å; F47-W61 HydrophobicContact CE2-CE3 4.42Å; F47-L74 HydrophobicContact CE2-CD2 3.82Å; F47-L74 HydrophobicContact CZ-CD2 4.07Å; F47-A110 HydrophobicContact CD2-CB 3.92Å; F47-A110 HydrophobicContact CE2-CB 3.75Å; F47-A110 HydrophobicContact CG-CB 4.48Å; F47-A110 HydrophobicContact CZ-CB 4.21Å; F47-Y125 HydrophobicContact CB-CG 4.47Å; F47-M127 HydrophobicContact CD1-CB 3.71Å; F47-M127 HydrophobicContact CD1-CE 4.08Å; F47-M127 HydrophobicContact CE1-CB 4.15Å; F47-M127 HydrophobicContact CE1-CE 4.1Å
48	R	88.8	Confident	84.2	Confident	48 Å²	48	57.7 Å²	57.7	18%	0.181	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	145.3	-164.2	-49.7	175	-173.4	160.1	-8.8	110.9	Y32 E34 T35 N45 F59 E60	Y32-R48 HydrophobicContact CD1-CB 3.81Å; Y32-R48 VanDerWaalsContact CD1-CD 3.5Å; Y32-R48 HydrophobicContact CD1-CG 4.21Å; Y32-R48 HydrophobicContact CE1-CB 4.36Å; Y32-R48 HydrophobicContact CE1-CG 4.46Å; Y32-R48 HydrophobicContact CG-CB 4.15Å; Y32-R48 HydrophobicContact CG-CG 4.32Å; Y32-R48 VanDerWaalsContact CZ-CD 3.45Å; Y32-R48 PolarHBondContact OH-NH1 2.79Å; E34-R48 VanDerWaalsContact O-CA 3.31Å; E34-R48 WeakPolarHBondContact O-CA 3.38Å; T35-R48 HydrophobicContact CG2-CB 4.36Å; T35-R48 HydrophobicContact CG2-CG 3.97Å; N45-R48 PolarHBondContact ND2-NE 2.75Å; N45-R48 VanDerWaalsContact ND2-NE 3.19Å; N45-R48 PolarHBondContact ND2-NH2 3.01Å; N45-R48 PolarHBondContact O-NH2 3.17Å; N45-R48 WeakPolarHBondContact OD1-CD 3.16Å; N45-R48 WeakPolarHBondContact OD1-CG 3.4Å; N45-R48 PolarHBondContact OD1-NE 2.74Å; R48-F59 VanDerWaalsContact O-CA 3.26Å; R48-F59 WeakPolarHBondContact O-CA 3.37Å; R48-E60 WeakPolarHBondContact CD-OE2 3.33Å; R48-E60 IonicContact CZ-OE2 3.98Å; R48-E60 PolarHBondContact N-O 2.77Å; R48-E60 IonicContact NE-OE2 3.66Å; R48-E60 IonicContact NH1-OE2 3.83Å; R48-E60 PolarHBondContact NH1-OE2 3.49Å; R48-E60 PolarHBondContact O-N 2.96Å
49	V	85.6	Confident	84.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	122.3	163.8	-168.6	0	0	0	0	108.2	L33 E34 M57 F59 M127 Y129	L33-V49 HydrophobicContact CB-CB 4.1Å; L33-V49 HydrophobicContact CB-CG1 4.3Å; L33-V49 HydrophobicContact CD1-CB 4.45Å; L33-V49 HydrophobicContact CD1-CG1 3.81Å; L33-V49 PolarHBondContact N-O 2.72Å; E34-V49 HydrophobicContact CB-CG2 4.15Å; E34-V49 PolarHBondContact O-N 3.37Å; V49-M57 HydrophobicContact CG1-SD 4.2Å; V49-F59 HydrophobicContact CG2-CD1 4.19Å; V49-F59 HydrophobicContact CG2-CE1 3.87Å; V49-M127 HydrophobicContact CB-CE 4.45Å; V49-M127 HydrophobicContact CG2-CE 3.28Å; V49-M127 HydrophobicContact CG2-SD 4.45Å; V49-Y129 HydrophobicContact CG2-CD2 4.14Å; V49-Y129 HydrophobicContact CG2-CE2 4.5Å; V49-Y129 HydrophobicContact CG2-CG 4.24Å
50	I	82.5	Confident	85	Confident	34 Å²	34	44.7 Å²	44.7	17%	0.174	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-29.2	177.9	60.4	176.7	0	0	0	112	F18 Y32 A58 E60 I93	F18-I50 HydrophobicContact CD1-CD1 4.3Å; F18-I50 HydrophobicContact CE1-CD1 3.69Å; Y32-I50 HydrophobicContact CD1-CG2 4.02Å; Y32-I50 HydrophobicContact CE1-CG2 4.15Å; I50-A58 HydrophobicContact CD1-CB 3.92Å; I50-A58 HydrophobicContact CG1-CB 3.59Å; I50-A58 WeakPolarHBondContact CG1-O 3.37Å; I50-A58 PolarHBondContact N-O 2.83Å; I50-E60 HydrophobicContact CG2-CB 3.56Å; I50-I93 HydrophobicContact CD1-CD1 4.5Å; I50-I93 HydrophobicContact CD1-CG1 4.46Å; I50-I93 HydrophobicContact CD1-CG2 3.73Å
51	Q	79.4	Confident	85.8	Confident	52 Å²	52	37.6 Å²	37.6	24%	0.243	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	139.5	-180	-165.3	-178.2	9.3	0	0	111	Q53 A58	Q51-Q53 HydrophobicContact CG-CG 4.41Å; Q51-A58 HydrophobicContact CB-CB 3.98Å; Q51-A58 PolarHBondContact N-O 3.22Å; Q51-A58 PolarHBondContact O-N 2.74Å
52	E	78.7	Confident	86.2	Confident	9 Å²	9	40.2 Å²	40.2	4%	0.042	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132.7	165.9	-166.7	-169.3	102.7	0	0	109.5	L33 M57 V99 Y129 R131 R134 L215	L33-E52 HydrophobicContact CD1-CB 4.37Å; E52-M57 HydrophobicContact CG-CG 4.16Å; E52-M57 HydrophobicContact CG-SD 4.4Å; E52-V99 HydrophobicContact CG-CG1 4.44Å; E52-Y129 WeakPolarHBondContact OE2-CE1 3.38Å; E52-Y129 PolarHBondContact OE2-OH 2.79Å; E52-Y129 VanDerWaalsContact OE2-OH 3.1Å; E52-R131 VanDerWaalsContact CD-CD 3.43Å; E52-R131 WeakPolarHBondContact OE1-CD 3.4Å; E52-R131 WeakPolarHBondContact OE2-CD 3.47Å; E52-R131 VanDerWaalsContact OE2-CG 3.24Å; E52-R131 WeakPolarHBondContact OE2-CG 3.34Å; E52-R134 IonicContact OE1-CZ 3.15Å; E52-R134 VanDerWaalsContact OE1-CZ 3.31Å; E52-R134 IonicContact OE1-NE 2.72Å; E52-R134 PolarHBondContact OE1-NE 3.26Å; E52-R134 IonicContact OE1-NH2 2.68Å; E52-R134 PolarHBondContact OE1-NH2 2.8Å; E52-L215 HydrophobicContact CB-CD1 3.47Å; E52-L215 VanDerWaalsContact CB-CD1 3.47Å
53	Q	79.2	Confident	86.8	Confident	64 Å²	64	41.7 Å²	41.7	30%	0.299	22%	0.221	S	C	.	.			trans	-121.2	173.4	174.6	-55.1	-179.3	12.4	0	0	110.1	Q51 A55 A56 R134	Q51-Q53 HydrophobicContact CG-CG 4.41Å; Q53-A55 VanDerWaalsContact C-N 3.3Å; Q53-A55 PolarHBondContact O-N 2.94Å; Q53-A56 CarbonylContact C-O 3.52Å; Q53-A56 WeakPolarHBondContact CA-O 3.4Å; Q53-A56 HydrophobicContact CB-CB 4.41Å; Q53-A56 WeakPolarHBondContact CB-O 3.38Å; Q53-A56 PolarHBondContact N-O 2.71Å; Q53-R134 PolarHBondContact O-NH2 3.32Å
54	T	77.2	Confident	87.2	Confident	91 Å²	91	36.1 Å²	36.1	56%	0.558	19%	0.191	S	C	*	.	S	Bend	trans	-52.4	-46.9	-175.3	-53.6	0	0	0	0	113.1	R134	T54-R134 VanDerWaalsContact CA-NH1 3.33Å; T54-R134 PolarHBondContact O-NH1 2.9Å
55	A	84.7	Confident	87.5	Confident	71 Å²	71	39 Å²	39	59%	0.587	21%	0.209	S	C	*	.	S	Bend	trans	-127.8	10.3	-177.3	0	0	0	0	0	113.8	Q53 E97	Q53-A55 VanDerWaalsContact C-N 3.3Å; Q53-A55 PolarHBondContact O-N 2.94Å; A55-E97 CarbonylContact O-C 3.55Å; A55-E97 VanDerWaalsContact O-C 3.32Å
56	A	86.2	Confident	87.7	Confident	7 Å²	7	41.4 Å²	41.4	6%	0.058	22%	0.219	C	C	.	.			trans	-143.8	156.5	-179.1	0	0	0	0	0	112.2	Q53 L95 L96 V99	Q53-A56 CarbonylContact C-O 3.52Å; Q53-A56 WeakPolarHBondContact CA-O 3.4Å; Q53-A56 HydrophobicContact CB-CB 4.41Å; Q53-A56 WeakPolarHBondContact CB-O 3.38Å; Q53-A56 PolarHBondContact N-O 2.71Å; A56-L95 HydrophobicContact CB-CD1 3.78Å; A56-L95 HydrophobicContact CB-CD2 4.29Å; A56-L95 HydrophobicContact CB-CG 4Å; A56-L96 CarbonylContact C-O 3.57Å; A56-L96 VanDerWaalsContact CA-O 3.23Å; A56-L96 WeakPolarHBondContact CA-O 3.33Å; A56-L96 WeakPolarHBondContact CB-O 3.1Å; A56-V99 VanDerWaalsContact N-CG2 3.26Å
57	M	86.2	Confident	87.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.1	169.4	-75.9	-157.8	-68.3	0	0	111	V49 E52 F59 L95 L96 V99 Y108 Y129	V49-M57 HydrophobicContact CG1-SD 4.2Å; E52-M57 HydrophobicContact CG-CG 4.16Å; E52-M57 HydrophobicContact CG-SD 4.4Å; M57-F59 HydrophobicContact CB-CD2 4.37Å; M57-F59 HydrophobicContact CB-CE2 3.58Å; M57-F59 HydrophobicContact CB-CZ 3.84Å; M57-F59 HydrophobicContact CE-CE1 4.49Å; M57-F59 HydrophobicContact CE-CE2 4.38Å; M57-F59 HydrophobicContact CE-CZ 3.67Å; M57-F59 HydrophobicContact SD-CZ 4.41Å; M57-L95 WeakPolarHBondContact O-CA 3.24Å; M57-L96 PolarHBondContact N-O 2.81Å; M57-L96 PolarHBondContact O-N 3.33Å; M57-V99 HydrophobicContact CG-CG1 4.29Å; M57-V99 HydrophobicContact CG-CG2 4.13Å; M57-Y108 HydrophobicContact CE-CD1 4.07Å; M57-Y108 HydrophobicContact CE-CD2 4.19Å; M57-Y108 HydrophobicContact CE-CE1 3.28Å; M57-Y108 HydrophobicContact CE-CE2 3.47Å; M57-Y108 VanDerWaalsContact CE-CE2 3.47Å; M57-Y108 HydrophobicContact CE-CG 4.47Å; M57-Y108 WeakPolarHBondContact CE-OH 3.38Å; M57-Y129 HydrophobicContact CE-CD1 4.26Å; M57-Y129 HydrophobicContact SD-CD1 3.76Å; M57-Y129 HydrophobicContact SD-CE1 3.79Å
58	A	87.2	Confident	87.7	Confident	6 Å²	6	51.8 Å²	51.8	5%	0.05	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	136.6	173.5	0	0	0	0	0	109.6	I50 Q51 G94 L95	I50-A58 HydrophobicContact CD1-CB 3.92Å; I50-A58 HydrophobicContact CG1-CB 3.59Å; I50-A58 WeakPolarHBondContact CG1-O 3.37Å; I50-A58 PolarHBondContact N-O 2.83Å; Q51-A58 HydrophobicContact CB-CB 3.98Å; Q51-A58 PolarHBondContact N-O 3.22Å; Q51-A58 PolarHBondContact O-N 2.74Å; A58-G94 WeakPolarHBondContact CA-O 3.12Å; A58-L95 HydrophobicContact CB-CD1 4Å
59	F	90.8	Very high	87.9	Confident	1 Å²	1	52.6 Å²	52.6	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	152	-178.3	-62.1	-90.6	0	0	0	111.1	F47 R48 V49 M57 L74 I93 G94 L96 Y108 M127	F47-F59 HydrophobicContact CD2-CB 4.43Å; F47-F59 HydrophobicContact CD2-CD1 4.5Å; F47-F59 HydrophobicContact CE1-CD1 4.05Å; F47-F59 HydrophobicContact CE1-CE1 4.23Å; F47-F59 HydrophobicContact CE2-CB 3.55Å; F47-F59 AromaticContact CE2-CD1 3.57Å; F47-F59 HydrophobicContact CE2-CD1 3.57Å; F47-F59 HydrophobicContact CE2-CE1 4.47Å; F47-F59 AromaticContact CE2-CG 3.77Å; F47-F59 HydrophobicContact CE2-CG 3.77Å; F47-F59 HydrophobicContact CZ-CB 4.1Å; F47-F59 AromaticContact CZ-CD1 3.28Å; F47-F59 HydrophobicContact CZ-CD1 3.28Å; F47-F59 AromaticContact CZ-CE1 3.76Å; F47-F59 HydrophobicContact CZ-CE1 3.76Å; F47-F59 AromaticContact CZ-CG 3.77Å; F47-F59 HydrophobicContact CZ-CG 3.77Å; R48-F59 VanDerWaalsContact O-CA 3.26Å; R48-F59 WeakPolarHBondContact O-CA 3.37Å; V49-F59 HydrophobicContact CG2-CD1 4.19Å; V49-F59 HydrophobicContact CG2-CE1 3.87Å; M57-F59 HydrophobicContact CB-CD2 4.37Å; M57-F59 HydrophobicContact CB-CE2 3.58Å; M57-F59 HydrophobicContact CB-CZ 3.84Å; M57-F59 HydrophobicContact CE-CE1 4.49Å; M57-F59 HydrophobicContact CE-CE2 4.38Å; M57-F59 HydrophobicContact CE-CZ 3.67Å; M57-F59 HydrophobicContact SD-CZ 4.41Å; F59-L74 HydrophobicContact CB-CD1 4.42Å; F59-L74 HydrophobicContact CB-CD2 4.17Å; F59-L74 HydrophobicContact CD2-CD1 4.05Å; F59-L74 HydrophobicContact CD2-CD2 4.42Å; F59-L74 HydrophobicContact CG-CD2 4.4Å; F59-I93 VanDerWaalsContact O-CA 3.23Å; F59-I93 WeakPolarHBondContact O-CA 3.37Å; F59-G94 PolarHBondContact N-O 3.24Å; F59-G94 PolarHBondContact O-N 3.09Å; F59-L96 HydrophobicContact CD2-CB 4.41Å; F59-L96 HydrophobicContact CE2-CB 3.97Å; F59-L96 HydrophobicContact CE2-CD2 4.21Å; F59-Y108 HydrophobicContact CE1-CD1 4.19Å; F59-Y108 HydrophobicContact CE1-CD2 4.46Å; F59-Y108 AromaticContact CE1-CG 3.94Å; F59-Y108 HydrophobicContact CE1-CG 3.94Å; F59-Y108 HydrophobicContact CE2-CD1 4.27Å; F59-Y108 AromaticContact CZ-CD1 3.46Å; F59-Y108 HydrophobicContact CZ-CD1 3.46Å; F59-Y108 VanDerWaalsContact CZ-CD1 3.46Å; F59-Y108 HydrophobicContact CZ-CD2 4.35Å; F59-Y108 AromaticContact CZ-CE1 3.97Å; F59-Y108 HydrophobicContact CZ-CE1 3.97Å; F59-Y108 AromaticContact CZ-CG 3.69Å; F59-Y108 HydrophobicContact CZ-CG 3.69Å; F59-M127 HydrophobicContact CD1-CE 4.26Å; F59-M127 HydrophobicContact CE1-CE 4.08Å
60	E	91.4	Very high	88.3	Confident	39 Å²	39	53.3 Å²	53.3	18%	0.182	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	142.9	165.2	-177.2	-167.9	-148.5	0	0	109.2	Y32 F47 R48 I50 N92 I93	Y32-E60 WeakPolarHBondContact CE1-OE2 3.07Å; Y32-E60 PolarHBondContact OH-OE2 3.08Å; F47-E60 WeakPolarHBondContact CA-O 3.49Å; F47-E60 WeakPolarHBondContact CD2-O 3.44Å; R48-E60 WeakPolarHBondContact CD-OE2 3.33Å; R48-E60 IonicContact CZ-OE2 3.98Å; R48-E60 PolarHBondContact N-O 2.77Å; R48-E60 IonicContact NE-OE2 3.66Å; R48-E60 IonicContact NH1-OE2 3.83Å; R48-E60 PolarHBondContact NH1-OE2 3.49Å; R48-E60 PolarHBondContact O-N 2.96Å; I50-E60 HydrophobicContact CG2-CB 3.56Å; E60-N92 CarbonylContact C-O 3.57Å; E60-N92 VanDerWaalsContact CA-O 3.26Å; E60-N92 WeakPolarHBondContact CA-O 3.15Å; E60-I93 HydrophobicContact CB-CG1 4.28Å; E60-I93 HydrophobicContact CG-CG1 4.19Å
61	W	94.5	Very high	88.9	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.015	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	156.4	170	55.6	91.9	0	0	0	112.6	T46 F47 Q63 V72 L74 V88 N92 A110 Y125	T46-W61 CarbonylContact O-C 3.48Å; T46-W61 WeakPolarHBondContact O-CA 3.4Å; T46-W61 WeakPolarHBondContact O-CB 3.24Å; F47-W61 HydrophobicContact CD2-CB 4.04Å; F47-W61 HydrophobicContact CE2-CE3 4.42Å; W61-Q63 PolarHBondContact O-N 2.94Å; W61-V72 HydrophobicContact CH2-CG1 4.49Å; W61-V72 HydrophobicContact CZ2-CB 4Å; W61-V72 HydrophobicContact CZ2-CG1 3.99Å; W61-V72 HydrophobicContact CZ2-CG2 4.21Å; W61-L74 HydrophobicContact CE3-CD2 3.92Å; W61-L74 HydrophobicContact CH2-CD1 4.41Å; W61-L74 HydrophobicContact CH2-CD2 4.38Å; W61-L74 HydrophobicContact CH2-CG 4.37Å; W61-L74 HydrophobicContact CZ3-CD1 3.96Å; W61-L74 HydrophobicContact CZ3-CD2 3.62Å; W61-L74 HydrophobicContact CZ3-CG 3.99Å; W61-V88 HydrophobicContact CH2-CB 4.12Å; W61-V88 HydrophobicContact CH2-CG1 3.98Å; W61-V88 HydrophobicContact CH2-CG2 4.07Å; W61-V88 HydrophobicContact CZ2-CB 4.32Å; W61-V88 HydrophobicContact CZ2-CG1 4.09Å; W61-N92 PolarHBondContact N-O 3.24Å; W61-N92 WeakPolarHBondContact O-CB 3.35Å; W61-A110 HydrophobicContact CB-CB 4.45Å; W61-A110 HydrophobicContact CD2-CB 4.48Å; W61-A110 HydrophobicContact CG-CB 4.47Å; W61-Y125 HydrophobicContact CB-CD2 4.03Å; W61-Y125 HydrophobicContact CB-CE2 4.35Å
62	K	93.2	Very high	89.7	Confident	121 Å²	121	50.5 Å²	50.5	53%	0.526	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-62.8	132.6	168.4	-174.8	172	-173.2	168.8	0	109.2	T46 M64 Y125	T46-K62 HydrophobicContact CG2-CB 4.18Å; T46-K62 HydrophobicContact CG2-CD 4.06Å; T46-K62 PolarHBondContact O-N 3.3Å; K62-M64 PolarHBondContact O-N 2.8Å; K62-M64 VanDerWaalsContact O-N 3.14Å; K62-Y125 HydrophobicContact CB-CE2 4.34Å; K62-Y125 WeakPolarHBondContact O-CE2 3.41Å
63	Q	92.8	Very high	90.5	Very high	123 Å²	123	52.6 Å²	52.6	58%	0.575	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-49.2	123.7	-177.8	-169.1	170.9	-1.3	0	0	112.4	W61 T65 N92	W61-Q63 PolarHBondContact O-N 2.94Å; Q63-T65 HydrophobicContact CG-CG2 4.45Å; Q63-N92 VanDerWaalsContact CA-OD1 3.26Å; Q63-N92 WeakPolarHBondContact CA-OD1 3.43Å; Q63-N92 WeakPolarHBondContact CB-OD1 3.46Å; Q63-N92 WeakPolarHBondContact CG-OD1 3.41Å
64	M	92.7	Very high	91.3	Very high	7 Å²	7	49.6 Å²	49.6	3%	0.034	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-86.5	125.3	175.3	-61.5	-174.5	-171.5	0	0	109.2	K62 V72 A110 G112 F122 R123 Y125	K62-M64 PolarHBondContact O-N 2.8Å; K62-M64 VanDerWaalsContact O-N 3.14Å; M64-V72 HydrophobicContact CE-CG1 4.33Å; M64-V72 HydrophobicContact SD-CG2 3.9Å; M64-A110 HydrophobicContact CE-CB 3.76Å; M64-A110 VanDerWaalsContact CE-O 3.29Å; M64-A110 WeakPolarHBondContact CE-O 3.34Å; M64-G112 VanDerWaalsContact SD-CA 3.51Å; M64-G112 PolarHBondContact SD-N 2.65Å; M64-G112 VanDerWaalsContact SD-N 3.4Å; M64-F122 HydrophobicContact CB-CE2 4.02Å; M64-F122 HydrophobicContact CB-CZ 4.08Å; M64-R123 HydrophobicContact SD-CB 4.32Å; M64-Y125 HydrophobicContact CE-CD2 3.33Å; M64-Y125 HydrophobicContact CE-CE2 3.56Å; M64-Y125 HydrophobicContact CE-CG 4.13Å; M64-Y125 HydrophobicContact CG-CE2 3.88Å
65	T	91.7	Very high	92.1	Very high	101 Å²	101	45.4 Å²	45.4	62%	0.62	23%	0.234	S	C	*	.			trans	-114.6	130.5	-179.3	54.9	0	0	0	0	110.6	Q63	Q63-T65 HydrophobicContact CG-CG2 4.45Å
66	H	92.2	Very high	92.5	Very high	72 Å²	72	42.9 Å²	42.9	33%	0.333	21%	0.21	S	C	.	.			trans	-154.2	146.2	173.3	-171	-95	0	0	0	109.4	S68 F69 T114 F122	H66-S68 PolarHBondContact ND1-N 2.83Å; H66-S68 PolarHBondContact O-N 2.8Å; H66-S68 VanDerWaalsContact O-N 3.1Å; H66-F69 PolarHBondContact O-N 2.76Å; H66-F69 VanDerWaalsContact O-N 3.14Å; H66-T114 VanDerWaalsContact CE1-CG2 3.44Å; H66-T114 WeakPolarHBondContact CE1-CG2 3.27Å; H66-T114 WeakPolarHBondContact ND1-CG2 3.41Å; H66-F122 HydrophobicContact CB-CD1 3.97Å; H66-F122 HydrophobicContact CB-CD2 3.84Å; H66-F122 HydrophobicContact CB-CE1 3.83Å; H66-F122 HydrophobicContact CB-CE2 3.73Å; H66-F122 HydrophobicContact CB-CG 3.99Å; H66-F122 HydrophobicContact CB-CZ 3.75Å; H66-F122 AromaticContact CD2-CG 3.89Å; H66-F122 AromaticContact CG-CD1 3.99Å; H66-F122 AromaticContact CG-CG 3.92Å
67	K	93.5	Very high	92.5	Very high	196 Å²	196	45 Å²	45	85%	0.852	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.9	-177.2	64.5	176.8	-177.8	-179.7	0	114.2
68	S	92.6	Very high	92.2	Very high	42 Å²	42	46.7 Å²	46.7	29%	0.294	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.6	42.3	-178.8	-57.8	0	0	0	0	109.6	H66 G70 T114 N115	H66-S68 PolarHBondContact ND1-N 2.83Å; H66-S68 PolarHBondContact O-N 2.8Å; H66-S68 VanDerWaalsContact O-N 3.1Å; S68-G70 PolarHBondContact O-N 2.79Å; S68-T114 CarbonylContact O-C 3.44Å; S68-T114 WeakPolarHBondContact O-CA 3.37Å; S68-T114 WeakPolarHBondContact O-CB 3.21Å; S68-N115 WeakPolarHBondContact CB-OD1 3.47Å; S68-N115 PolarHBondContact O-N 2.81Å; S68-N115 PolarHBondContact O-OD1 2.79Å
69	F	93.9	Very high	91.6	Very high	65 Å²	65	54.6 Å²	54.6	29%	0.285	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	133	178.2	176.2	-90.5	0	0	0	110.6	H66 V72 F122	H66-F69 PolarHBondContact O-N 2.76Å; H66-F69 VanDerWaalsContact O-N 3.14Å; F69-V72 HydrophobicContact CE2-CG2 3.97Å; F69-V72 HydrophobicContact CZ-CG2 4.1Å; F69-F122 HydrophobicContact CD2-CE1 4.2Å; F69-F122 AromaticContact CD2-CZ 3.85Å; F69-F122 HydrophobicContact CD2-CZ 3.85Å; F69-F122 HydrophobicContact CE2-CZ 4.36Å
70	G	93.5	Very high	90.5	Very high	15 Å²	15	62.9 Å²	62.9	16%	0.155	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	-63.3	174.5	0	0	0	0	0	112.4	S68 Y113	S68-G70 PolarHBondContact O-N 2.79Å; G70-Y113 WeakPolarHBondContact CA-O 3.23Å; G70-Y113 PolarHBondContact N-O 2.8Å
71	Y	95.3	Very high	89.3	Confident	25 Å²	25	71.8 Å²	71.8	10%	0.098	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	169	-175.8	54.3	-93.8	0	0	0	110.6	Y73 K87 V88 Y89 Y113 P119	Y71-Y73 HydrophobicContact CD2-CD2 4.28Å; Y71-Y73 HydrophobicContact CD2-CE2 4.46Å; Y71-Y73 AromaticContact CE2-CD2 3.59Å; Y71-Y73 HydrophobicContact CE2-CD2 3.59Å; Y71-Y73 AromaticContact CE2-CE2 3.47Å; Y71-Y73 HydrophobicContact CE2-CE2 3.47Å; Y71-Y73 VanDerWaalsContact CE2-CE2 3.47Å; Y71-Y73 HydrophobicContact CE2-CG 4.21Å; Y71-K87 HydrophobicContact CD2-CD 4.4Å; Y71-K87 HydrophobicContact CD2-CG 4.2Å; Y71-K87 HydrophobicContact CE2-CD 4.4Å; Y71-K87 HydrophobicContact CE2-CG 4.41Å; Y71-V88 WeakPolarHBondContact CA-O 3.33Å; Y71-V88 WeakPolarHBondContact CB-O 3.24Å; Y71-Y89 HydrophobicContact CD1-CE1 4.28Å; Y71-Y113 AromaticContact CE2-CD2 3.95Å; Y71-Y113 HydrophobicContact CE2-CD2 3.95Å; Y71-Y113 AromaticContact CE2-CG 3.85Å; Y71-Y113 HydrophobicContact CE2-CG 3.85Å; Y71-Y113 PolarHBondContact N-O 3.38Å; Y71-Y113 PolarHBondContact O-N 3.3Å; Y71-P119 WeakPolarHBondContact OH-CB 3.33Å
72	V	96.5	Very high	88.4	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.5	167.4	177.2	0	0	0	0	108.7	W61 M64 F69 V88 A110 E111	W61-V72 HydrophobicContact CH2-CG1 4.49Å; W61-V72 HydrophobicContact CZ2-CB 4Å; W61-V72 HydrophobicContact CZ2-CG1 3.99Å; W61-V72 HydrophobicContact CZ2-CG2 4.21Å; M64-V72 HydrophobicContact CE-CG1 4.33Å; M64-V72 HydrophobicContact SD-CG2 3.9Å; F69-V72 HydrophobicContact CE2-CG2 3.97Å; F69-V72 HydrophobicContact CZ-CG2 4.1Å; V72-V88 PolarHBondContact N-O 3.08Å; V72-V88 PolarHBondContact O-N 2.74Å; V72-A110 HydrophobicContact CG1-CB 4.1Å; V72-E111 CarbonylContact C-O 3.52Å; V72-E111 VanDerWaalsContact CA-O 3.23Å; V72-E111 WeakPolarHBondContact CA-O 3.16Å
73	Y	95.4	Very high	88	Confident	54 Å²	54	71.1 Å²	71.1	21%	0.212	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	127.5	160.9	-85.3	-62.5	0	0	0	109.1	Y71 V86 K87 A110 E111 Y113	Y71-Y73 HydrophobicContact CD2-CD2 4.28Å; Y71-Y73 HydrophobicContact CD2-CE2 4.46Å; Y71-Y73 AromaticContact CE2-CD2 3.59Å; Y71-Y73 HydrophobicContact CE2-CD2 3.59Å; Y71-Y73 AromaticContact CE2-CE2 3.47Å; Y71-Y73 HydrophobicContact CE2-CE2 3.47Å; Y71-Y73 VanDerWaalsContact CE2-CE2 3.47Å; Y71-Y73 HydrophobicContact CE2-CG 4.21Å; Y73-V86 WeakPolarHBondContact CA-O 3.1Å; Y73-K87 HydrophobicContact CD1-CG 3.6Å; Y73-K87 HydrophobicContact CE1-CB 4.44Å; Y73-K87 HydrophobicContact CE1-CD 3.96Å; Y73-K87 HydrophobicContact CE1-CG 3.17Å; Y73-K87 WeakPolarHBondContact OH-CE 3.36Å; Y73-K87 PolarHBondContact OH-NZ 2.79Å; Y73-A110 CarbonylContact O-C 3.53Å; Y73-A110 WeakPolarHBondContact O-CA 3.37Å; Y73-E111 PolarHBondContact N-O 3.13Å; Y73-E111 PolarHBondContact O-N 3.07Å; Y73-Y113 AromaticContact CD2-CD2 3.71Å; Y73-Y113 HydrophobicContact CD2-CD2 3.71Å; Y73-Y113 AromaticContact CD2-CE2 3.52Å; Y73-Y113 HydrophobicContact CD2-CE2 3.52Å; Y73-Y113 HydrophobicContact CE2-CD2 4.42Å; Y73-Y113 HydrophobicContact CE2-CE2 4.28Å; Y73-Y113 HydrophobicContact CG-CE2 4.47Å
74	L	95.5	Very high	87.7	Confident	1 Å²	1	69 Å²	69	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	134.8	155.5	-68.1	174.6	0	0	0	107.9	F47 F59 W61 T85 V86 V88 L96 R109 A110	F47-L74 HydrophobicContact CE2-CD2 3.82Å; F47-L74 HydrophobicContact CZ-CD2 4.07Å; F59-L74 HydrophobicContact CB-CD1 4.42Å; F59-L74 HydrophobicContact CB-CD2 4.17Å; F59-L74 HydrophobicContact CD2-CD1 4.05Å; F59-L74 HydrophobicContact CD2-CD2 4.42Å; F59-L74 HydrophobicContact CG-CD2 4.4Å; W61-L74 HydrophobicContact CE3-CD2 3.92Å; W61-L74 HydrophobicContact CH2-CD1 4.41Å; W61-L74 HydrophobicContact CH2-CD2 4.38Å; W61-L74 HydrophobicContact CH2-CG 4.37Å; W61-L74 HydrophobicContact CZ3-CD1 3.96Å; W61-L74 HydrophobicContact CZ3-CD2 3.62Å; W61-L74 HydrophobicContact CZ3-CG 3.99Å; L74-T85 WeakPolarHBondContact O-CA 3.12Å; L74-V86 HydrophobicContact CB-CG1 3.67Å; L74-V86 HydrophobicContact CD1-CG1 4.09Å; L74-V86 HydrophobicContact CG-CG1 4.33Å; L74-V86 PolarHBondContact N-O 2.96Å; L74-V86 PolarHBondContact O-N 2.79Å; L74-V88 HydrophobicContact CD1-CG2 4.43Å; L74-L96 HydrophobicContact CB-CB 4.43Å; L74-L96 HydrophobicContact CD1-CB 4.46Å; L74-R109 CarbonylContact C-O 3.46Å; L74-R109 WeakPolarHBondContact CA-O 3.36Å; L74-A110 HydrophobicContact CD2-CB 4Å
75	V	94.6	Very high	87.7	Confident	3 Å²	3	72.1 Å²	72.1	2%	0.018	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128.7	-172.7	-176.9	0	0	0	0	109.4	D83 N84 T85 Y108 R109 E111	V75-D83 HydrophobicContact CG1-CB 3.69Å; V75-D83 WeakPolarHBondContact CG1-OD2 3.16Å; V75-N84 WeakPolarHBondContact CA-O 3.35Å; V75-T85 HydrophobicContact CB-CG2 4.25Å; V75-T85 HydrophobicContact CG1-CG2 3.99Å; V75-T85 HydrophobicContact CG2-CG2 3.85Å; V75-Y108 CarbonylContact O-C 3.49Å; V75-Y108 VanDerWaalsContact O-CA 3.25Å; V75-Y108 WeakPolarHBondContact O-CA 3.34Å; V75-R109 HydrophobicContact CB-CB 4.17Å; V75-R109 PolarHBondContact N-O 2.81Å; V75-R109 PolarHBondContact O-N 2.99Å; V75-E111 HydrophobicContact CG2-CG 4.42Å
76	H	92.8	Very high	87.8	Confident	18 Å²	18	69.5 Å²	69.5	8%	0.083	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.2	163.2	167.9	-143.1	0	0	0	107.5	V78 D83 N84 L96 A98 T106 Y108	H76-V78 VanDerWaalsContact CE1-CG2 3.47Å; H76-V78 WeakPolarHBondContact CE1-CG2 3.46Å; H76-V78 WeakPolarHBondContact ND1-CG2 3.35Å; H76-V78 PolarHBondContact O-N 3.04Å; H76-D83 WeakPolarHBondContact O-CA 3.28Å; H76-N84 HydrophobicContact CB-CB 4.1Å; H76-N84 PolarHBondContact N-O 3.13Å; H76-N84 PolarHBondContact O-N 3.04Å; H76-L96 HydrophobicContact CB-CD2 3.59Å; H76-A98 HydrophobicContact CB-CB 3.96Å; H76-A98 VanDerWaalsContact ND1-CB 3.34Å; H76-A98 WeakPolarHBondContact ND1-CB 3.42Å; H76-T106 WeakPolarHBondContact CD2-CG2 3.29Å; H76-T106 WeakPolarHBondContact NE2-CG2 3.37Å; H76-Y108 HydrophobicContact CB-CD1 3.94Å; H76-Y108 HydrophobicContact CB-CE1 3.66Å; H76-Y108 AromaticContact CD2-CE1 3.56Å; H76-Y108 AromaticContact CD2-CZ 3.73Å; H76-Y108 AromaticContact CG-CE1 3.75Å
77	D	86.2	Confident	87.9	Confident	50 Å²	50	70.1 Å²	70.1	27%	0.267	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	102.8	-178.2	-176.6	-11.6	0	0	0	108.8	K107 R109	D77-K107 HydrophobicContact CB-CB 3.98Å; D77-K107 PolarHBondContact N-O 3.26Å; D77-R109 IonicContact OD2-NH1 2.74Å
78	V	80.7	Confident	87.9	Confident	36 Å²	36	61.8 Å²	61.8	22%	0.218	31%	0.305	C	S	.	.			trans	-103.3	100.6	178.4	-166.4	0	0	0	0	108.4	H76 F80 W81	H76-V78 VanDerWaalsContact CE1-CG2 3.47Å; H76-V78 WeakPolarHBondContact CE1-CG2 3.46Å; H76-V78 WeakPolarHBondContact ND1-CG2 3.35Å; H76-V78 PolarHBondContact O-N 3.04Å; V78-F80 PolarHBondContact O-N 3.47Å; V78-W81 HydrophobicContact CB-CB 4.32Å; V78-W81 HydrophobicContact CG1-CB 3.74Å; V78-W81 HydrophobicContact CG1-CG 4.18Å; V78-W81 PolarHBondContact O-N 2.99Å; V78-W81 VanDerWaalsContact O-N 3.13Å
79	Y	73.2	Confident	87.7	Confident	173 Å²	173	67.6 Å²	67.6	68%	0.678	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	126.4	178.3	-164.5	-116.5	0	0	0	110.8	W81	Y79-W81 VanDerWaalsContact C-N 3.31Å; Y79-W81 PolarHBondContact O-N 3.15Å
80	F	67.6	Low	87.2	Confident	174 Å²	174	66.7 Å²	66.7	76%	0.763	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	-20.7	-174.8	-64.3	-69.6	0	0	0	119.2	V78	V78-F80 PolarHBondContact O-N 3.47Å
81	W	66.3	Low	86.8	Confident	227 Å²	227	68.6 Å²	68.6	86%	0.86	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-2.6	-170.1	-62	90.5	0	0	0	114.8	V78 Y79	V78-W81 HydrophobicContact CB-CB 4.32Å; V78-W81 HydrophobicContact CG1-CB 3.74Å; V78-W81 HydrophobicContact CG1-CG 4.18Å; V78-W81 PolarHBondContact O-N 2.99Å; V78-W81 VanDerWaalsContact O-N 3.13Å; Y79-W81 VanDerWaalsContact C-N 3.31Å; Y79-W81 PolarHBondContact O-N 3.15Å
82	G	76.3	Confident	86.6	Confident	46 Å²	46	69.9 Å²	69.9	47%	0.474	36%	0.359	S	S	.	.			trans	86.3	140.5	-173.6	0	0	0	0	0	111.2	N84	G82-N84 PolarHBondContact O-N 3.49Å
83	D	84.5	Confident	86.3	Confident	64 Å²	64	73 Å²	73	34%	0.342	38%	0.375	S	S	.	.			trans	-62.6	128.4	-177.2	-76	3.2	0	0	0	110.9	V75 H76 T85 R109	V75-D83 HydrophobicContact CG1-CB 3.69Å; V75-D83 WeakPolarHBondContact CG1-OD2 3.16Å; H76-D83 WeakPolarHBondContact O-CA 3.28Å; D83-T85 HydrophobicContact CB-CG2 3.89Å; D83-T85 PolarHBondContact O-N 2.88Å; D83-R109 IonicContact OD2-CZ 3.73Å; D83-R109 IonicContact OD2-NH1 3.52Å; D83-R109 IonicContact OD2-NH2 2.87Å; D83-R109 PolarHBondContact OD2-NH2 3.37Å
84	N	87.9	Confident	86.1	Confident	79 Å²	79	70.9 Å²	70.9	42%	0.422	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	121.7	166.7	-78.5	-21.7	0	0	0	107.9	V75 H76 G82 A98	V75-N84 WeakPolarHBondContact CA-O 3.35Å; H76-N84 HydrophobicContact CB-CB 4.1Å; H76-N84 PolarHBondContact N-O 3.13Å; H76-N84 PolarHBondContact O-N 3.04Å; G82-N84 PolarHBondContact O-N 3.49Å; N84-A98 HydrophobicContact CB-CB 3.83Å
85	T	92.3	Very high	85.9	Confident	72 Å²	72	74.3 Å²	74.3	44%	0.442	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148	-173.8	66.2	0	0	0	0	113.1	L74 V75 D83	L74-T85 WeakPolarHBondContact O-CA 3.12Å; V75-T85 HydrophobicContact CB-CG2 4.25Å; V75-T85 HydrophobicContact CG1-CG2 3.99Å; V75-T85 HydrophobicContact CG2-CG2 3.85Å; D83-T85 HydrophobicContact CB-CG2 3.89Å; D83-T85 PolarHBondContact O-N 2.88Å
86	V	93.8	Very high	85.7	Confident	46 Å²	46	74.4 Å²	74.4	28%	0.279	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	138.2	170.6	63.5	0	0	0	0	109.8	Y73 L74 L95 L96	Y73-V86 WeakPolarHBondContact CA-O 3.1Å; L74-V86 HydrophobicContact CB-CG1 3.67Å; L74-V86 HydrophobicContact CD1-CG1 4.09Å; L74-V86 HydrophobicContact CG-CG1 4.33Å; L74-V86 PolarHBondContact N-O 2.96Å; L74-V86 PolarHBondContact O-N 2.79Å; V86-L95 WeakPolarHBondContact CG1-O 3.32Å; V86-L96 HydrophobicContact CB-CD1 4.23Å; V86-L96 HydrophobicContact CG1-CB 4.22Å; V86-L96 HydrophobicContact CG1-CD1 3.76Å
87	K	93.1	Very high	85.5	Confident	85 Å²	85	81.5 Å²	81.5	37%	0.37	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	130.6	175.6	-70.3	-176.1	-179.3	176.2	0	110.7	Y71 Y73 Y89	Y71-K87 HydrophobicContact CD2-CD 4.4Å; Y71-K87 HydrophobicContact CD2-CG 4.2Å; Y71-K87 HydrophobicContact CE2-CD 4.4Å; Y71-K87 HydrophobicContact CE2-CG 4.41Å; Y73-K87 HydrophobicContact CD1-CG 3.6Å; Y73-K87 HydrophobicContact CE1-CB 4.44Å; Y73-K87 HydrophobicContact CE1-CD 3.96Å; Y73-K87 HydrophobicContact CE1-CG 3.17Å; Y73-K87 WeakPolarHBondContact OH-CE 3.36Å; Y73-K87 PolarHBondContact OH-NZ 2.79Å; K87-Y89 HydrophobicContact CB-CE2 4.09Å
88	V	93.3	Very high	85.3	Confident	21 Å²	21	79.4 Å²	79.4	13%	0.127	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	109.5	172.8	-175.2	0	0	0	0	108.3	W61 Y71 V72 L74 G90	W61-V88 HydrophobicContact CH2-CB 4.12Å; W61-V88 HydrophobicContact CH2-CG1 3.98Å; W61-V88 HydrophobicContact CH2-CG2 4.07Å; W61-V88 HydrophobicContact CZ2-CB 4.32Å; W61-V88 HydrophobicContact CZ2-CG1 4.09Å; Y71-V88 WeakPolarHBondContact CA-O 3.33Å; Y71-V88 WeakPolarHBondContact CB-O 3.24Å; V72-V88 PolarHBondContact N-O 3.08Å; V72-V88 PolarHBondContact O-N 2.74Å; L74-V88 HydrophobicContact CD1-CG2 4.43Å; V88-G90 VanDerWaalsContact C-N 3.33Å; V88-G90 VanDerWaalsContact CG1-O 3.29Å; V88-G90 WeakPolarHBondContact CG1-O 3.36Å
89	Y	88.7	Confident	85.5	Confident	164 Å²	164	79.2 Å²	79.2	64%	0.643	41%	0.409	S	S	*	.			trans	-79.5	-12.3	-174.8	-70.4	-83.7	0	0	0	114.1	Y71 K87	Y71-Y89 HydrophobicContact CD1-CE1 4.28Å; K87-Y89 HydrophobicContact CB-CE2 4.09Å
90	G	82.8	Confident	86.1	Confident	47 Å²	47	71.2 Å²	71.2	49%	0.485	38%	0.379	S	S	.	.	S	Bend	trans	-168	159.3	178.8	0	0	0	0	0	112.4	V88	V88-G90 VanDerWaalsContact C-N 3.33Å; V88-G90 VanDerWaalsContact CG1-O 3.29Å; V88-G90 WeakPolarHBondContact CG1-O 3.36Å
91	G	87.1	Confident	87.1	Confident	54 Å²	54	70 Å²	70	56%	0.557	37%	0.374	S	S	*	.	S	Bend	trans	86	-176.9	-175.7	0	0	0	0	0	113.8
92	N	90.9	Very high	88.3	Confident	52 Å²	52	60.2 Å²	60.2	28%	0.278	34%	0.34	S	S	.	.	S	Bend	trans	-121.4	8.5	-173.5	-67	-19.1	0	0	0	112.3	E60 W61 Q63	E60-N92 CarbonylContact C-O 3.57Å; E60-N92 VanDerWaalsContact CA-O 3.26Å; E60-N92 WeakPolarHBondContact CA-O 3.15Å; W61-N92 PolarHBondContact N-O 3.24Å; W61-N92 WeakPolarHBondContact O-CB 3.35Å; Q63-N92 VanDerWaalsContact CA-OD1 3.26Å; Q63-N92 WeakPolarHBondContact CA-OD1 3.43Å; Q63-N92 WeakPolarHBondContact CB-OD1 3.46Å; Q63-N92 WeakPolarHBondContact CG-OD1 3.41Å
93	I	90.4	Very high	89	Confident	67 Å²	67	59.6 Å²	59.6	34%	0.344	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	142.1	-178.3	-64.6	172.6	0	0	0	107.7	F18 I50 F59 E60	F18-I93 HydrophobicContact CD1-CD1 4.48Å; F18-I93 HydrophobicContact CE1-CD1 4.33Å; F18-I93 HydrophobicContact CE1-CG2 4.27Å; F18-I93 HydrophobicContact CZ-CG2 4.15Å; I50-I93 HydrophobicContact CD1-CD1 4.5Å; I50-I93 HydrophobicContact CD1-CG1 4.46Å; I50-I93 HydrophobicContact CD1-CG2 3.73Å; F59-I93 VanDerWaalsContact O-CA 3.23Å; F59-I93 WeakPolarHBondContact O-CA 3.37Å; E60-I93 HydrophobicContact CB-CG1 4.28Å; E60-I93 HydrophobicContact CG-CG1 4.19Å
94	G	90.1	Very high	89.3	Confident	9 Å²	9	60.7 Å²	60.7	9%	0.093	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	156.6	176	0	0	0	0	0	112	A58 F59	A58-G94 WeakPolarHBondContact CA-O 3.12Å; F59-G94 PolarHBondContact N-O 3.24Å; F59-G94 PolarHBondContact O-N 3.09Å
95	L	90.5	Very high	89.5	Confident	74 Å²	74	61.4 Å²	61.4	39%	0.387	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.3	178.3	-174.9	77.1	0	0	0	108.8	A56 M57 A58 V86	A56-L95 HydrophobicContact CB-CD1 3.78Å; A56-L95 HydrophobicContact CB-CD2 4.29Å; A56-L95 HydrophobicContact CB-CG 4Å; M57-L95 WeakPolarHBondContact O-CA 3.24Å; A58-L95 HydrophobicContact CB-CD1 4Å; V86-L95 WeakPolarHBondContact CG1-O 3.32Å
96	L	90.3	Very high	89.4	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.3	174.4	178.9	64.9	0	0	0	108.8	A56 M57 F59 L74 H76 V86 A98 Y108	A56-L96 CarbonylContact C-O 3.57Å; A56-L96 VanDerWaalsContact CA-O 3.23Å; A56-L96 WeakPolarHBondContact CA-O 3.33Å; A56-L96 WeakPolarHBondContact CB-O 3.1Å; M57-L96 PolarHBondContact N-O 2.81Å; M57-L96 PolarHBondContact O-N 3.33Å; F59-L96 HydrophobicContact CD2-CB 4.41Å; F59-L96 HydrophobicContact CE2-CB 3.97Å; F59-L96 HydrophobicContact CE2-CD2 4.21Å; L74-L96 HydrophobicContact CB-CB 4.43Å; L74-L96 HydrophobicContact CD1-CB 4.46Å; H76-L96 HydrophobicContact CB-CD2 3.59Å; V86-L96 HydrophobicContact CB-CD1 4.23Å; V86-L96 HydrophobicContact CG1-CB 4.22Å; V86-L96 HydrophobicContact CG1-CD1 3.76Å; L96-A98 HydrophobicContact CD2-CB 4.41Å; L96-A98 HydrophobicContact CG-CB 4.06Å; L96-A98 PolarHBondContact O-N 2.83Å; L96-Y108 HydrophobicContact CD2-CD1 4.03Å; L96-Y108 HydrophobicContact CD2-CE1 4.2Å
97	E	89.4	Confident	89.4	Confident	167 Å²	167	62.3 Å²	62.3	78%	0.78	34%	0.335	S	S	*	.	S	Bend	trans	-75.9	50.9	175.8	-63.8	-176	163.8	0	0	111.6	A55	A55-E97 CarbonylContact O-C 3.55Å; A55-E97 VanDerWaalsContact O-C 3.32Å
98	A	82.9	Confident	89.5	Confident	6 Å²	6	58.3 Å²	58.3	5%	0.05	32%	0.318	C	S	.	.			trans	-149.6	129.6	173.9	0	0	0	0	0	109.4	H76 N84 L96	H76-A98 HydrophobicContact CB-CB 3.96Å; H76-A98 VanDerWaalsContact ND1-CB 3.34Å; H76-A98 WeakPolarHBondContact ND1-CB 3.42Å; N84-A98 HydrophobicContact CB-CB 3.83Å; L96-A98 HydrophobicContact CD2-CB 4.41Å; L96-A98 HydrophobicContact CG-CB 4.06Å; L96-A98 PolarHBondContact O-N 2.83Å
99	V	83.7	Confident	89.6	Confident	33 Å²	33	60 Å²	60	20%	0.2	32%	0.322	C	S	.	.			trans	-123.9	137.1	176.4	-168.3	0	0	0	0	107.7	E52 A56 M57	E52-V99 HydrophobicContact CG-CG1 4.44Å; A56-V99 VanDerWaalsContact N-CG2 3.26Å; M57-V99 HydrophobicContact CG-CG1 4.29Å; M57-V99 HydrophobicContact CG-CG2 4.13Å
100	G	86.1	Confident	90	Very high	5 Å²	5	52.2 Å²	52.2	5%	0.052	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-62.1	159.5	174.8	0	0	0	0	0	111.9	T106 Y108 R131	G100-T106 WeakPolarHBondContact CA-OG1 3.31Å; G100-Y108 PolarHBondContact N-OH 3.41Å; G100-R131 PolarHBondContact O-NE 2.78Å; G100-R131 PolarHBondContact O-NH2 2.96Å
101	K	89.8	Confident	90.6	Very high	147 Å²	147	50.7 Å²	50.7	64%	0.639	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-64.6	149.8	171.1	-76.4	-175.7	-178.3	-177.8	0	110.4	D104	K101-D104 HydrophobicContact CB-CB 4.02Å; K101-D104 VanDerWaalsContact CB-OD2 3.27Å; K101-D104 WeakPolarHBondContact CB-OD2 3.44Å; K101-D104 WeakPolarHBondContact CD-OD2 3.34Å; K101-D104 PolarHBondContact O-N 2.69Å
102	P	89.9	Confident	91.1	Very high	23 Å²	23	48.1 Å²	48.1	15%	0.149	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-64.2	146.6	174.3	29	-28.3	0	0	0	109.4	D104 P133 T156	P102-D104 PolarHBondContact O-N 2.83Å; P102-P133 HydrophobicContact CB-CB 4.33Å; P102-P133 HydrophobicContact CB-CG 4.1Å; P102-T156 HydrophobicContact CB-CG2 3.61Å; P102-T156 HydrophobicContact CG-CG2 3.3Å
103	C	91.4	Very high	91.4	Very high	32 Å²	32	47.8 Å²	47.8	22%	0.216	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	-14.2	-175.7	-52.4	0	0	0	0	116.6	K130 R131 P133 C159	C103-K130 VanDerWaalsContact O-CE 3.27Å; C103-K130 WeakPolarHBondContact O-CE 3.29Å; C103-R131 PolarHBondContact N-O 3.19Å; C103-P133 VanDerWaalsContact SG-CG 3.5Å; C103-C159 WeakPolarHBondContact CA-SG 3.4Å; C103-C159 HydrophobicContact CB-CB 3.69Å; C103-C159 WeakPolarHBondContact CB-SG 3.4Å; C103-C159 WeakPolarHBondContact SG-CA 3.14Å; C103-C159 WeakPolarHBondContact SG-CB 3.32Å; C103-C159 PolarHBondContact SG-N 2.92Å; C103-C159 CovalentContact SG-SG 2.04Å; C103-C159 PolarHBondContact SG-SG 2.76Å
104	D	91.1	Very high	91.6	Very high	87 Å²	87	44.8 Å²	44.8	47%	0.465	23%	0.226	S	C	.	.	S	Bend	trans	-87.2	128.4	177.8	-73.4	-24.9	0	0	0	111.5	K101 P102 T106	K101-D104 HydrophobicContact CB-CB 4.02Å; K101-D104 VanDerWaalsContact CB-OD2 3.27Å; K101-D104 WeakPolarHBondContact CB-OD2 3.44Å; K101-D104 WeakPolarHBondContact CD-OD2 3.34Å; K101-D104 PolarHBondContact O-N 2.69Å; P102-D104 PolarHBondContact O-N 2.83Å; D104-T106 PolarHBondContact O-N 2.83Å; D104-T106 PolarHBondContact O-OG1 3.38Å
105	V	90.9	Very high	91.7	Very high	94 Å²	94	49.5 Å²	49.5	57%	0.57	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	114.6	171.5	-179	0	0	0	0	108.8	T128 K130	V105-T128 HydrophobicContact CG1-CG2 3.96Å; V105-K130 HydrophobicContact CG2-CB 4.23Å; V105-K130 HydrophobicContact CG2-CD 4.2Å; V105-K130 HydrophobicContact CG2-CG 4.24Å
106	T	91.7	Very high	91.7	Very high	13 Å²	13	48.3 Å²	48.3	8%	0.08	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	140.5	-175	-55.4	0	0	0	0	110.9	H76 G100 D104 Y108 T128 Y129	H76-T106 WeakPolarHBondContact CD2-CG2 3.29Å; H76-T106 WeakPolarHBondContact NE2-CG2 3.37Å; G100-T106 WeakPolarHBondContact CA-OG1 3.31Å; D104-T106 PolarHBondContact O-N 2.83Å; D104-T106 PolarHBondContact O-OG1 3.38Å; T106-Y108 HydrophobicContact CG2-CD2 4.37Å; T106-Y108 HydrophobicContact CG2-CE1 4.33Å; T106-Y108 HydrophobicContact CG2-CE2 3.46Å; T106-Y108 VanDerWaalsContact CG2-CE2 3.46Å; T106-Y108 VanDerWaalsContact CG2-CZ 3.41Å; T106-Y108 VanDerWaalsContact CG2-OH 3.23Å; T106-Y108 WeakPolarHBondContact CG2-OH 3.41Å; T106-T128 CarbonylContact O-C 3.53Å; T106-T128 VanDerWaalsContact O-CA 3.29Å; T106-T128 WeakPolarHBondContact O-CA 3.49Å; T106-Y129 PolarHBondContact N-O 3.02Å; T106-Y129 PolarHBondContact O-N 2.98Å
107	K	93.7	Very high	91.4	Very high	124 Å²	124	57.2 Å²	57.2	54%	0.539	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	133.2	-179.4	-71.8	175.1	-174.8	174.2	0	111.3	D77 T128	D77-K107 HydrophobicContact CB-CB 3.98Å; D77-K107 PolarHBondContact N-O 3.26Å; K107-T128 HydrophobicContact CG-CG2 3.93Å
108	Y	95.2	Very high	91.4	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.1	175.1	-62	-85.8	0	0	0	110.6	M57 F59 V75 H76 L96 G100 T106 Q126 M127	M57-Y108 HydrophobicContact CE-CD1 4.07Å; M57-Y108 HydrophobicContact CE-CD2 4.19Å; M57-Y108 HydrophobicContact CE-CE1 3.28Å; M57-Y108 HydrophobicContact CE-CE2 3.47Å; M57-Y108 VanDerWaalsContact CE-CE2 3.47Å; M57-Y108 HydrophobicContact CE-CG 4.47Å; M57-Y108 WeakPolarHBondContact CE-OH 3.38Å; F59-Y108 HydrophobicContact CE1-CD1 4.19Å; F59-Y108 HydrophobicContact CE1-CD2 4.46Å; F59-Y108 AromaticContact CE1-CG 3.94Å; F59-Y108 HydrophobicContact CE1-CG 3.94Å; F59-Y108 HydrophobicContact CE2-CD1 4.27Å; F59-Y108 AromaticContact CZ-CD1 3.46Å; F59-Y108 HydrophobicContact CZ-CD1 3.46Å; F59-Y108 VanDerWaalsContact CZ-CD1 3.46Å; F59-Y108 HydrophobicContact CZ-CD2 4.35Å; F59-Y108 AromaticContact CZ-CE1 3.97Å; F59-Y108 HydrophobicContact CZ-CE1 3.97Å; F59-Y108 AromaticContact CZ-CG 3.69Å; F59-Y108 HydrophobicContact CZ-CG 3.69Å; V75-Y108 CarbonylContact O-C 3.49Å; V75-Y108 VanDerWaalsContact O-CA 3.25Å; V75-Y108 WeakPolarHBondContact O-CA 3.34Å; H76-Y108 HydrophobicContact CB-CD1 3.94Å; H76-Y108 HydrophobicContact CB-CE1 3.66Å; H76-Y108 AromaticContact CD2-CE1 3.56Å; H76-Y108 AromaticContact CD2-CZ 3.73Å; H76-Y108 AromaticContact CG-CE1 3.75Å; L96-Y108 HydrophobicContact CD2-CD1 4.03Å; L96-Y108 HydrophobicContact CD2-CE1 4.2Å; G100-Y108 PolarHBondContact N-OH 3.41Å; T106-Y108 HydrophobicContact CG2-CD2 4.37Å; T106-Y108 HydrophobicContact CG2-CE1 4.33Å; T106-Y108 HydrophobicContact CG2-CE2 3.46Å; T106-Y108 VanDerWaalsContact CG2-CE2 3.46Å; T106-Y108 VanDerWaalsContact CG2-CZ 3.41Å; T106-Y108 VanDerWaalsContact CG2-OH 3.23Å; T106-Y108 WeakPolarHBondContact CG2-OH 3.41Å; Y108-Q126 WeakPolarHBondContact O-CA 3.11Å; Y108-M127 PolarHBondContact N-O 2.74Å; Y108-M127 PolarHBondContact O-N 3.43Å
109	R	95.4	Very high	91.7	Very high	56 Å²	56	59.9 Å²	59.9	21%	0.211	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.1	175.8	-48.2	-172.9	-57.9	-113	-1.1	111	L74 V75 D77 D83 E111 T124 Y125 Q126	L74-R109 CarbonylContact C-O 3.46Å; L74-R109 WeakPolarHBondContact CA-O 3.36Å; V75-R109 HydrophobicContact CB-CB 4.17Å; V75-R109 PolarHBondContact N-O 2.81Å; V75-R109 PolarHBondContact O-N 2.99Å; D77-R109 IonicContact OD2-NH1 2.74Å; D83-R109 IonicContact OD2-CZ 3.73Å; D83-R109 IonicContact OD2-NH1 3.52Å; D83-R109 IonicContact OD2-NH2 2.87Å; D83-R109 PolarHBondContact OD2-NH2 3.37Å; R109-E111 HydrophobicContact CB-CG 4.2Å; R109-E111 IonicContact CZ-OE1 3.19Å; R109-E111 IonicContact NE-OE1 2.73Å; R109-E111 PolarHBondContact NE-OE1 3.11Å; R109-E111 IonicContact NH2-OE1 2.86Å; R109-E111 PolarHBondContact NH2-OE1 3Å; R109-T124 HydrophobicContact CB-CG2 4.23Å; R109-Y125 CarbonylContact C-O 3.55Å; R109-Y125 WeakPolarHBondContact CA-O 3.45Å; R109-Q126 HydrophobicContact CG-CB 4.31Å
110	A	96.4	Very high	92.2	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.9	160.9	0	0	0	0	0	107.6	F47 W61 M64 V72 Y73 L74 T124 Y125	F47-A110 HydrophobicContact CD2-CB 3.92Å; F47-A110 HydrophobicContact CE2-CB 3.75Å; F47-A110 HydrophobicContact CG-CB 4.48Å; F47-A110 HydrophobicContact CZ-CB 4.21Å; W61-A110 HydrophobicContact CB-CB 4.45Å; W61-A110 HydrophobicContact CD2-CB 4.48Å; W61-A110 HydrophobicContact CG-CB 4.47Å; M64-A110 HydrophobicContact CE-CB 3.76Å; M64-A110 VanDerWaalsContact CE-O 3.29Å; M64-A110 WeakPolarHBondContact CE-O 3.34Å; V72-A110 HydrophobicContact CG1-CB 4.1Å; Y73-A110 CarbonylContact O-C 3.53Å; Y73-A110 WeakPolarHBondContact O-CA 3.37Å; L74-A110 HydrophobicContact CD2-CB 4Å; A110-T124 CarbonylContact O-C 3.58Å; A110-T124 WeakPolarHBondContact O-CA 2.94Å; A110-Y125 PolarHBondContact N-O 3.1Å; A110-Y125 PolarHBondContact O-N 3.33Å
111	E	96.5	Very high	92.7	Very high	16 Å²	16	64 Å²	64	8%	0.075	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	117	-173.7	-66.7	-177.6	-162.3	0	0	111.2	V72 Y73 V75 R109 Y113 N121 R123 T124	V72-E111 CarbonylContact C-O 3.52Å; V72-E111 VanDerWaalsContact CA-O 3.23Å; V72-E111 WeakPolarHBondContact CA-O 3.16Å; Y73-E111 PolarHBondContact N-O 3.13Å; Y73-E111 PolarHBondContact O-N 3.07Å; V75-E111 HydrophobicContact CG2-CG 4.42Å; R109-E111 HydrophobicContact CB-CG 4.2Å; R109-E111 IonicContact CZ-OE1 3.19Å; R109-E111 IonicContact NE-OE1 2.73Å; R109-E111 PolarHBondContact NE-OE1 3.11Å; R109-E111 IonicContact NH2-OE1 2.86Å; R109-E111 PolarHBondContact NH2-OE1 3Å; E111-Y113 HydrophobicContact CB-CD2 4.16Å; E111-Y113 HydrophobicContact CB-CE2 3.52Å; E111-Y113 WeakPolarHBondContact O-CD2 3.33Å; E111-Y113 VanDerWaalsContact OE2-CE2 3.25Å; E111-Y113 WeakPolarHBondContact OE2-CE2 3.35Å; E111-Y113 PolarHBondContact OE2-OH 3.48Å; E111-N121 WeakPolarHBondContact CB-ND2 3.13Å; E111-R123 CarbonylContact C-O 3.47Å; E111-R123 WeakPolarHBondContact CA-O 3.47Å; E111-T124 HydrophobicContact CG-CG2 3.9Å
112	G	96.8	Very high	93	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	128	176.4	0	0	0	0	0	112	M64 N121 F122 R123	M64-G112 VanDerWaalsContact SD-CA 3.51Å; M64-G112 PolarHBondContact SD-N 2.65Å; M64-G112 VanDerWaalsContact SD-N 3.4Å; G112-N121 WeakPolarHBondContact O-CA 3.28Å; G112-F122 VanDerWaalsContact C-CD1 3.5Å; G112-F122 WeakPolarHBondContact O-CD1 3.17Å; G112-F122 WeakPolarHBondContact O-CE1 3.38Å; G112-F122 PolarHBondContact O-N 3.26Å; G112-R123 PolarHBondContact N-O 3.26Å
113	Y	97.1	Very high	93.3	Very high	44 Å²	44	63.5 Å²	63.5	17%	0.173	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	148.4	179.9	-77.7	-96.8	0	0	0	113	G70 Y71 Y73 E111 P119 S120 N121 F122	G70-Y113 WeakPolarHBondContact CA-O 3.23Å; G70-Y113 PolarHBondContact N-O 2.8Å; Y71-Y113 AromaticContact CE2-CD2 3.95Å; Y71-Y113 HydrophobicContact CE2-CD2 3.95Å; Y71-Y113 AromaticContact CE2-CG 3.85Å; Y71-Y113 HydrophobicContact CE2-CG 3.85Å; Y71-Y113 PolarHBondContact N-O 3.38Å; Y71-Y113 PolarHBondContact O-N 3.3Å; Y73-Y113 AromaticContact CD2-CD2 3.71Å; Y73-Y113 HydrophobicContact CD2-CD2 3.71Å; Y73-Y113 AromaticContact CD2-CE2 3.52Å; Y73-Y113 HydrophobicContact CD2-CE2 3.52Å; Y73-Y113 HydrophobicContact CE2-CD2 4.42Å; Y73-Y113 HydrophobicContact CE2-CE2 4.28Å; Y73-Y113 HydrophobicContact CG-CE2 4.47Å; E111-Y113 HydrophobicContact CB-CD2 4.16Å; E111-Y113 HydrophobicContact CB-CE2 3.52Å; E111-Y113 WeakPolarHBondContact O-CD2 3.33Å; E111-Y113 VanDerWaalsContact OE2-CE2 3.25Å; E111-Y113 WeakPolarHBondContact OE2-CE2 3.35Å; E111-Y113 PolarHBondContact OE2-OH 3.48Å; Y113-P119 HydrophobicContact CD1-CB 4.1Å; Y113-S120 WeakPolarHBondContact CA-O 3.36Å; Y113-N121 HydrophobicContact CD1-CB 4.31Å; Y113-N121 HydrophobicContact CE1-CB 3.76Å; Y113-N121 HydrophobicContact CE2-CB 4.32Å; Y113-F122 VanDerWaalsContact N-CE1 3.34Å; Y113-F122 WeakPolarHBondContact O-CE1 3.34Å
114	T	95.8	Very high	93.5	Very high	5 Å²	5	64.9 Å²	64.9	3%	0.031	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	154.6	174.7	61.9	0	0	0	0	112.4	H66 S68 A116 P119 S120 F122	H66-T114 VanDerWaalsContact CE1-CG2 3.44Å; H66-T114 WeakPolarHBondContact CE1-CG2 3.27Å; H66-T114 WeakPolarHBondContact ND1-CG2 3.41Å; S68-T114 CarbonylContact O-C 3.44Å; S68-T114 WeakPolarHBondContact O-CA 3.37Å; S68-T114 WeakPolarHBondContact O-CB 3.21Å; T114-A116 PolarHBondContact O-N 3.02Å; T114-P119 WeakPolarHBondContact O-CB 3.04Å; T114-S120 WeakPolarHBondContact CG2-OG 3.42Å; T114-S120 PolarHBondContact N-O 2.79Å; T114-S120 PolarHBondContact OG1-N 2.74Å; T114-S120 PolarHBondContact OG1-OG 3.42Å; T114-F122 HydrophobicContact CG2-CD1 3.85Å
115	N	92.2	Very high	93.7	Very high	108 Å²	108	61.4 Å²	61.4	58%	0.578	31%	0.308	S	S	*	.			trans	-85.1	20.5	175.4	67.8	-9.3	0	0	0	114.2	S68	S68-N115 WeakPolarHBondContact CB-OD1 3.47Å; S68-N115 PolarHBondContact O-N 2.81Å; S68-N115 PolarHBondContact O-OD1 2.79Å
116	A	88.6	Confident	93.9	Very high	49 Å²	49	63.6 Å²	63.6	41%	0.405	31%	0.312	S	S	.	.	S	Bend	trans	-73.1	164.9	178.3	0	0	0	0	0	111.9	T114 F118 P119	T114-A116 PolarHBondContact O-N 3.02Å; A116-F118 CarbonylContact O-C 3.59Å; A116-F118 PolarHBondContact O-N 3.2Å; A116-P119 WeakPolarHBondContact O-CD 3.24Å
117	F	85.8	Confident	94	Very high	191 Å²	191	63.5 Å²	63.5	84%	0.838	31%	0.311	S	S	*	.	S	Bend	trans	-56	-34.3	175.4	-174.6	-94.7	0	0	0	112.7	P119	F117-P119 WeakPolarHBondContact O-CD 3.27Å
118	F	88.4	Confident	93.9	Very high	168 Å²	168	61.2 Å²	61.2	74%	0.737	31%	0.307	S	S	*	.	S	Bend	trans	-108.7	96.4	162.8	-63.7	-74.2	0	0	0	108.5	A116 S120	A116-F118 CarbonylContact O-C 3.59Å; A116-F118 PolarHBondContact O-N 3.2Å; F118-S120 PolarHBondContact O-N 2.71Å
119	P	89.9	Confident	93.6	Very high	61 Å²	61	61.8 Å²	61.8	40%	0.396	31%	0.31	S	S	.	.			trans	-57.5	124	176.5	-26.2	35.8	0	0	0	110.5	Y71 Y113 T114 A116 F117	Y71-P119 WeakPolarHBondContact OH-CB 3.33Å; Y113-P119 HydrophobicContact CD1-CB 4.1Å; T114-P119 WeakPolarHBondContact O-CB 3.04Å; A116-P119 WeakPolarHBondContact O-CD 3.24Å; F117-P119 WeakPolarHBondContact O-CD 3.27Å
120	S	94.1	Very high	93.3	Very high	61 Å²	61	61 Å²	61	43%	0.427	31%	0.308	S	S	.	.			trans	-107.5	133.6	177.1	63.3	0	0	0	0	109.9	Y113 T114 F118 F122	Y113-S120 WeakPolarHBondContact CA-O 3.36Å; T114-S120 WeakPolarHBondContact CG2-OG 3.42Å; T114-S120 PolarHBondContact N-O 2.79Å; T114-S120 PolarHBondContact OG1-N 2.74Å; T114-S120 PolarHBondContact OG1-OG 3.42Å; F118-S120 PolarHBondContact O-N 2.71Å; S120-F122 PolarHBondContact O-N 3.05Å
121	N	95.5	Very high	92.9	Very high	64 Å²	64	61.5 Å²	61.5	34%	0.342	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	128.6	167.4	-179.1	-70.8	0	0	0	108.8	E111 G112 Y113 R123 T124	E111-N121 WeakPolarHBondContact CB-ND2 3.13Å; G112-N121 WeakPolarHBondContact O-CA 3.28Å; Y113-N121 HydrophobicContact CD1-CB 4.31Å; Y113-N121 HydrophobicContact CE1-CB 3.76Å; Y113-N121 HydrophobicContact CE2-CB 4.32Å; N121-R123 PolarHBondContact OD1-N 2.77Å; N121-T124 PolarHBondContact ND2-OG1 2.84Å; N121-T124 PolarHBondContact OD1-OG1 2.74Å
122	F	95.9	Very high	92.5	Very high	54 Å²	54	61 Å²	61	24%	0.237	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-15.1	176.3	67.6	-99.7	0	0	0	112.9	M64 H66 F69 G112 Y113 T114 S120	M64-F122 HydrophobicContact CB-CE2 4.02Å; M64-F122 HydrophobicContact CB-CZ 4.08Å; H66-F122 HydrophobicContact CB-CD1 3.97Å; H66-F122 HydrophobicContact CB-CD2 3.84Å; H66-F122 HydrophobicContact CB-CE1 3.83Å; H66-F122 HydrophobicContact CB-CE2 3.73Å; H66-F122 HydrophobicContact CB-CG 3.99Å; H66-F122 HydrophobicContact CB-CZ 3.75Å; H66-F122 AromaticContact CD2-CG 3.89Å; H66-F122 AromaticContact CG-CD1 3.99Å; H66-F122 AromaticContact CG-CG 3.92Å; F69-F122 HydrophobicContact CD2-CE1 4.2Å; F69-F122 AromaticContact CD2-CZ 3.85Å; F69-F122 HydrophobicContact CD2-CZ 3.85Å; F69-F122 HydrophobicContact CE2-CZ 4.36Å; G112-F122 VanDerWaalsContact C-CD1 3.5Å; G112-F122 WeakPolarHBondContact O-CD1 3.17Å; G112-F122 WeakPolarHBondContact O-CE1 3.38Å; G112-F122 PolarHBondContact O-N 3.26Å; Y113-F122 VanDerWaalsContact N-CE1 3.34Å; Y113-F122 WeakPolarHBondContact O-CE1 3.34Å; T114-F122 HydrophobicContact CG2-CD1 3.85Å; S120-F122 PolarHBondContact O-N 3.05Å
123	R	96.1	Very high	92.2	Very high	104 Å²	104	61 Å²	61	39%	0.392	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	140.4	178.8	-165.3	167.5	-148.8	167.5	5.6	110.4	M64 E111 G112 N121 Y125	M64-R123 HydrophobicContact SD-CB 4.32Å; E111-R123 CarbonylContact C-O 3.47Å; E111-R123 WeakPolarHBondContact CA-O 3.47Å; G112-R123 PolarHBondContact N-O 3.26Å; N121-R123 PolarHBondContact OD1-N 2.77Å; R123-Y125 WeakPolarHBondContact CD-OH 3.24Å; R123-Y125 HydrophobicContact CG-CE1 4.14Å; R123-Y125 PolarHBondContact NE-OH 2.99Å; R123-Y125 VanDerWaalsContact NE-OH 3.15Å; R123-Y125 PolarHBondContact NH1-OH 2.04Å
124	T	96.3	Very high	91.6	Very high	61 Å²	61	59.3 Å²	59.3	37%	0.374	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	130.5	172.7	-59.9	0	0	0	0	109.4	R109 A110 E111 N121	R109-T124 HydrophobicContact CB-CG2 4.23Å; A110-T124 CarbonylContact O-C 3.58Å; A110-T124 WeakPolarHBondContact O-CA 2.94Å; E111-T124 HydrophobicContact CG-CG2 3.9Å; N121-T124 PolarHBondContact ND2-OG1 2.84Å; N121-T124 PolarHBondContact OD1-OG1 2.74Å
125	Y	96.5	Very high	91	Very high	15 Å²	15	59.4 Å²	59.4	6%	0.059	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	145.1	161.3	-55.6	-44.5	0	0	0	108.8	T46 F47 W61 K62 M64 R109 A110 R123	T46-Y125 HydrophobicContact CG2-CD1 4.39Å; T46-Y125 HydrophobicContact CG2-CE1 3.89Å; T46-Y125 WeakPolarHBondContact O-CD2 3.44Å; F47-Y125 HydrophobicContact CB-CG 4.47Å; W61-Y125 HydrophobicContact CB-CD2 4.03Å; W61-Y125 HydrophobicContact CB-CE2 4.35Å; K62-Y125 HydrophobicContact CB-CE2 4.34Å; K62-Y125 WeakPolarHBondContact O-CE2 3.41Å; M64-Y125 HydrophobicContact CE-CD2 3.33Å; M64-Y125 HydrophobicContact CE-CE2 3.56Å; M64-Y125 HydrophobicContact CE-CG 4.13Å; M64-Y125 HydrophobicContact CG-CE2 3.88Å; R109-Y125 CarbonylContact C-O 3.55Å; R109-Y125 WeakPolarHBondContact CA-O 3.45Å; A110-Y125 PolarHBondContact N-O 3.1Å; A110-Y125 PolarHBondContact O-N 3.33Å; R123-Y125 WeakPolarHBondContact CD-OH 3.24Å; R123-Y125 HydrophobicContact CG-CE1 4.14Å; R123-Y125 PolarHBondContact NE-OH 2.99Å; R123-Y125 VanDerWaalsContact NE-OH 3.15Å; R123-Y125 PolarHBondContact NH1-OH 2.04Å
126	Q	95	Very high	90.6	Very high	139 Å²	139	57.6 Å²	57.6	65%	0.65	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.7	-177.3	64.2	-174.8	-2.6	0	0	110.3	N36 Y108 R109	N36-Q126 WeakPolarHBondContact CB-O 3.39Å; N36-Q126 PolarHBondContact ND2-O 3.5Å; Y108-Q126 WeakPolarHBondContact O-CA 3.11Å; R109-Q126 HydrophobicContact CG-CB 4.31Å
127	M	92.6	Very high	90.4	Very high	12 Å²	12	59.2 Å²	59.2	6%	0.059	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	154.1	178.2	-173.9	171.5	60.6	0	0	109.6	E34 T35 N36 F47 V49 F59 Y108	E34-M127 HydrophobicContact CB-SD 4.12Å; E34-M127 HydrophobicContact CG-CG 4.15Å; E34-M127 HydrophobicContact CG-SD 3.77Å; T35-M127 VanDerWaalsContact C-SD 3.56Å; N36-M127 HydrophobicContact CB-CB 4.07Å; N36-M127 HydrophobicContact CB-CG 4.26Å; F47-M127 HydrophobicContact CD1-CB 3.71Å; F47-M127 HydrophobicContact CD1-CE 4.08Å; F47-M127 HydrophobicContact CE1-CB 4.15Å; F47-M127 HydrophobicContact CE1-CE 4.1Å; V49-M127 HydrophobicContact CB-CE 4.45Å; V49-M127 HydrophobicContact CG2-CE 3.28Å; V49-M127 HydrophobicContact CG2-SD 4.45Å; F59-M127 HydrophobicContact CD1-CE 4.26Å; F59-M127 HydrophobicContact CE1-CE 4.08Å; Y108-M127 PolarHBondContact N-O 2.74Å; Y108-M127 PolarHBondContact O-N 3.43Å
128	T	91.8	Very high	90.2	Very high	76 Å²	76	50.7 Å²	50.7	47%	0.466	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	138	166.5	47.8	0	0	0	0	109	V105 T106 K107	V105-T128 HydrophobicContact CG1-CG2 3.96Å; T106-T128 CarbonylContact O-C 3.53Å; T106-T128 VanDerWaalsContact O-CA 3.29Å; T106-T128 WeakPolarHBondContact O-CA 3.49Å; K107-T128 HydrophobicContact CG-CG2 3.93Å
129	Y	89.4	Confident	89.9	Confident	13 Å²	13	47.6 Å²	47.6	5%	0.051	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.4	176.4	-176.9	-116.5	0	0	0	109.4	E34 V49 E52 M57 T106 R131	E34-Y129 HydrophobicContact CB-CD2 3.51Å; E34-Y129 HydrophobicContact CB-CE2 3.88Å; E34-Y129 HydrophobicContact CG-CD2 3.93Å; V49-Y129 HydrophobicContact CG2-CD2 4.14Å; V49-Y129 HydrophobicContact CG2-CE2 4.5Å; V49-Y129 HydrophobicContact CG2-CG 4.24Å; E52-Y129 WeakPolarHBondContact OE2-CE1 3.38Å; E52-Y129 PolarHBondContact OE2-OH 2.79Å; E52-Y129 VanDerWaalsContact OE2-OH 3.1Å; M57-Y129 HydrophobicContact CE-CD1 4.26Å; M57-Y129 HydrophobicContact SD-CD1 3.76Å; M57-Y129 HydrophobicContact SD-CE1 3.79Å; T106-Y129 PolarHBondContact N-O 3.02Å; T106-Y129 PolarHBondContact O-N 2.98Å; Y129-R131 HydrophobicContact CE1-CB 4.25Å
130	K	88.8	Confident	89.3	Confident	40 Å²	40	46 Å²	46	17%	0.174	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	118	174.6	-171.1	-179.9	-174.4	179.3	0	107.6	C103 V105 H209 E210 L212	C103-K130 VanDerWaalsContact O-CE 3.27Å; C103-K130 WeakPolarHBondContact O-CE 3.29Å; V105-K130 HydrophobicContact CG2-CB 4.23Å; V105-K130 HydrophobicContact CG2-CD 4.2Å; V105-K130 HydrophobicContact CG2-CG 4.24Å; K130-H209 WeakPolarHBondContact CE-NE2 3.23Å; K130-H209 PolarHBondContact NZ-CE1 2.83Å; K130-H209 PolarHBondContact NZ-NE2 3.24Å; K130-E210 IonicContact NZ-OE1 2.89Å; K130-L212 HydrophobicContact CB-CD1 4.26Å
131	R	87.4	Confident	88.6	Confident	11 Å²	11	47.4 Å²	47.4	4%	0.042	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-86.9	132.9	179.5	-176.2	167.3	70.8	85.5	-11.6	110.4	E52 G100 C103 Y129 E155	E52-R131 VanDerWaalsContact CD-CD 3.43Å; E52-R131 WeakPolarHBondContact OE1-CD 3.4Å; E52-R131 WeakPolarHBondContact OE2-CD 3.47Å; E52-R131 VanDerWaalsContact OE2-CG 3.24Å; E52-R131 WeakPolarHBondContact OE2-CG 3.34Å; G100-R131 PolarHBondContact O-NE 2.78Å; G100-R131 PolarHBondContact O-NH2 2.96Å; C103-R131 PolarHBondContact N-O 3.19Å; Y129-R131 HydrophobicContact CE1-CB 4.25Å; R131-E155 IonicContact CZ-OE1 3.31Å; R131-E155 IonicContact CZ-OE2 3.55Å; R131-E155 IonicContact NH1-OE1 3.84Å; R131-E155 PolarHBondContact NH1-OE1 3.05Å; R131-E155 IonicContact NH1-OE2 3.7Å; R131-E155 PolarHBondContact NH1-OE2 3.01Å; R131-E155 IonicContact NH2-OE1 3.05Å; R131-E155 PolarHBondContact NH2-OE1 2.95Å; R131-E155 IonicContact NH2-OE2 3.32Å; R131-E155 PolarHBondContact NH2-OE2 3.39Å
132	V	88.2	Confident	87.8	Confident	4 Å²	4	48 Å²	48	2%	0.024	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-82.4	137.7	173	-174.3	0	0	0	0	109.1	R134 N207 H209 L212	V132-R134 PolarHBondContact O-N 3.11Å; V132-N207 HydrophobicContact CG1-CB 3.8Å; V132-H209 HydrophobicContact CG1-CB 3.94Å; V132-H209 HydrophobicContact CG2-CB 3.96Å; V132-L212 HydrophobicContact CG2-CB 3.59Å
133	P	90.1	Very high	86.8	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.013	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-50.5	133.4	176.8	-26.9	32.6	0	0	0	111.7	P102 C103 T156 C159 N207 S214	P102-P133 HydrophobicContact CB-CB 4.33Å; P102-P133 HydrophobicContact CB-CG 4.1Å; C103-P133 VanDerWaalsContact SG-CG 3.5Å; P133-T156 HydrophobicContact CB-CG2 3.66Å; P133-T156 HydrophobicContact CG-CG2 3.56Å; P133-C159 WeakPolarHBondContact CD-SG 3.31Å; P133-N207 PolarHBondContact O-ND2 2.85Å; P133-S214 WeakPolarHBondContact O-CB 3.5Å
134	R	84.8	Confident	85.7	Confident	8 Å²	8	48.9 Å²	48.9	3%	0.03	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-78.5	153.5	178.8	-68.3	164.2	178.7	168.1	-1.1	110.9	E52 Q53 T54 V132 R154 E155	E52-R134 IonicContact OE1-CZ 3.15Å; E52-R134 VanDerWaalsContact OE1-CZ 3.31Å; E52-R134 IonicContact OE1-NE 2.72Å; E52-R134 PolarHBondContact OE1-NE 3.26Å; E52-R134 IonicContact OE1-NH2 2.68Å; E52-R134 PolarHBondContact OE1-NH2 2.8Å; Q53-R134 PolarHBondContact O-NH2 3.32Å; T54-R134 VanDerWaalsContact CA-NH1 3.33Å; T54-R134 PolarHBondContact O-NH1 2.9Å; V132-R134 PolarHBondContact O-N 3.11Å; R134-R154 WeakPolarHBondContact O-CA 3.29Å; R134-E155 HydrophobicContact CB-CB 4.47Å; R134-E155 PolarHBondContact O-N 2.95Å
135	I	84.5	Confident	84.5	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.036	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	131.4	167.1	-64.4	-177	0	0	0	108.4	V138 W152 E153 T165 L205 N207	I135-V138 HydrophobicContact CG2-CG2 3.55Å; I135-W152 HydrophobicContact CG2-CB 3.67Å; I135-W152 HydrophobicContact CG2-CG 3.99Å; I135-E153 WeakPolarHBondContact CA-O 3.33Å; I135-T165 HydrophobicContact CD1-CG2 3.79Å; I135-L205 HydrophobicContact CD1-CB 3.66Å; I135-L205 HydrophobicContact CG2-CB 4.44Å; I135-N207 WeakPolarHBondContact CG1-ND2 3.38Å
136	E	83.2	Confident	83.3	Confident	69 Å²	69	52.7 Å²	52.7	32%	0.322	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	166.4	-178.9	-61.4	-170.1	165.5	0	0	109.8	V138 E153 E155	E136-V138 VanDerWaalsContact C-N 3.25Å; E136-V138 PolarHBondContact O-N 2.87Å; E136-V138 VanDerWaalsContact O-N 3.08Å; E136-E153 PolarHBondContact N-O 3.25Å; E136-E153 PolarHBondContact O-N 2.9Å; E136-E155 HydrophobicContact CG-CB 4.45Å
137	N	83.2	Confident	82.5	Confident	84 Å²	84	50.2 Å²	50.2	45%	0.449	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.4	47	171.9	-57	-29.2	0	0	0	113.8	E139 E153	N137-E139 PolarHBondContact O-N 2.68Å; N137-E153 HydrophobicContact CB-CB 4.15Å; N137-E153 HydrophobicContact CB-CG 4.07Å; N137-E153 PolarHBondContact ND2-OE2 2.84Å
138	V	81.7	Confident	81.9	Confident	12 Å²	12	49.9 Å²	49.9	7%	0.073	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	116.2	175.1	-176.8	0	0	0	0	108.5	I135 E136 V150 S151 W152 L205 I259	I135-V138 HydrophobicContact CG2-CG2 3.55Å; E136-V138 VanDerWaalsContact C-N 3.25Å; E136-V138 PolarHBondContact O-N 2.87Å; E136-V138 VanDerWaalsContact O-N 3.08Å; V138-V150 HydrophobicContact CG1-CG1 4.18Å; V138-S151 CarbonylContact C-O 3.53Å; V138-S151 WeakPolarHBondContact CA-O 3.44Å; V138-W152 HydrophobicContact CG2-CB 4.05Å; V138-L205 HydrophobicContact CG1-CD1 4.26Å; V138-L205 HydrophobicContact CG1-CD2 4.34Å; V138-L205 HydrophobicContact CG2-CD2 4.47Å; V138-I259 HydrophobicContact CG1-CD1 3.98Å
139	E	81.8	Confident	81.6	Confident	103 Å²	103	47.1 Å²	47.1	48%	0.481	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140.6	175.2	-65.9	-168.7	175.4	0	0	110.1	N137 Q141 V150 S151	N137-E139 PolarHBondContact O-N 2.68Å; E139-Q141 PolarHBondContact OE2-NE2 2.87Å; E139-V150 CarbonylContact O-C 3.54Å; E139-V150 WeakPolarHBondContact O-CA 3.25Å; E139-S151 PolarHBondContact N-O 3.1Å; E139-S151 PolarHBondContact O-N 3.42Å
140	I	79.3	Confident	81.5	Confident	27 Å²	27	46.5 Å²	46.5	14%	0.138	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	110.9	172.9	-55.4	177.8	0	0	0	107.3	P148 H149 V150 F203 V224 I259 V261	I140-P148 HydrophobicContact CG2-CB 3.88Å; I140-H149 CarbonylContact C-O 3.58Å; I140-H149 WeakPolarHBondContact CA-O 3.06Å; I140-V150 HydrophobicContact CG1-CG1 4.26Å; I140-V150 HydrophobicContact CG1-CG2 4.18Å; I140-V150 HydrophobicContact CG2-CG2 4.4Å; I140-F203 HydrophobicContact CD1-CD2 3.81Å; I140-F203 HydrophobicContact CD1-CE2 4.27Å; I140-F203 HydrophobicContact CD1-CG 4.45Å; I140-V224 HydrophobicContact CB-CG2 4.23Å; I140-I259 HydrophobicContact CD1-CG2 3.77Å; I140-V261 HydrophobicContact CD1-CG2 4.18Å
141	Q	79.1	Confident	81.6	Confident	91 Å²	91	45.8 Å²	45.8	43%	0.425	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.8	178.4	-59.3	-173.3	15.7	0	0	109.4	E139 M143 H149	E139-Q141 PolarHBondContact OE2-NE2 2.87Å; Q141-M143 HydrophobicContact CB-CE 3.71Å; Q141-M143 PolarHBondContact O-N 3.13Å; Q141-H149 PolarHBondContact N-O 3.3Å; Q141-H149 PolarHBondContact O-N 2.89Å
142	L	77	Confident	81.7	Confident	76 Å²	76	45.6 Å²	45.6	40%	0.398	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118	174.9	-165	71.7	0	0	0	109.3	L146 Y226	L142-L146 WeakPolarHBondContact CD1-O 3.49Å; L142-L146 HydrophobicContact CD2-CD2 3.89Å; L142-Y226 HydrophobicContact CB-CE1 4.43Å; L142-Y226 HydrophobicContact CD1-CE1 4Å; L142-Y226 HydrophobicContact CD2-CD1 4.29Å; L142-Y226 HydrophobicContact CD2-CE1 4.33Å
143	M	75.6	Confident	81.7	Confident	47 Å²	47	50.7 Å²	50.7	23%	0.232	26%	0.259	C	S	.	.			trans	-74.7	159.6	177.6	-67.2	-64.5	109.6	0	0	111.1	Q141 N145 L146 Y147 H149	Q141-M143 HydrophobicContact CB-CE 3.71Å; Q141-M143 PolarHBondContact O-N 3.13Å; M143-N145 WeakPolarHBondContact CB-OD1 3.27Å; M143-N145 PolarHBondContact O-N 2.86Å; M143-L146 WeakPolarHBondContact O-CA 3Å; M143-L146 PolarHBondContact O-N 3.43Å; M143-Y147 WeakPolarHBondContact CB-O 3.27Å; M143-Y147 PolarHBondContact N-O 2.85Å; M143-H149 HydrophobicContact CE-CB 3.75Å; M143-H149 HydrophobicContact CG-CB 3.74Å; M143-H149 HydrophobicContact SD-CB 4.18Å
144	P	73.5	Confident	81.6	Confident	130 Å²	130	53 Å²	53	84%	0.844	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23	-177.8	-27.6	35.5	0	0	0	115.2	L146	P144-L146 VanDerWaalsContact C-N 3.29Å
145	N	71.5	Confident	81.7	Confident	96 Å²	96	55.8 Å²	55.8	51%	0.513	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	17.6	175	56.4	-3.2	0	0	0	113.4	M143 Y147	M143-N145 WeakPolarHBondContact CB-OD1 3.27Å; M143-N145 PolarHBondContact O-N 2.86Å; N145-Y147 HydrophobicContact CB-CD2 3.99Å; N145-Y147 HydrophobicContact CB-CE2 4.01Å; N145-Y147 VanDerWaalsContact ND2-CD2 3.29Å; N145-Y147 WeakPolarHBondContact ND2-CD2 3.38Å; N145-Y147 PolarHBondContact O-N 3.02Å; N145-Y147 WeakPolarHBondContact OD1-CD2 3.34Å
146	L	70.6	Confident	82	Confident	59 Å²	59	58 Å²	58	31%	0.309	30%	0.295	S	S	.	.	S	Bend	trans	63.7	14.5	177.4	-56.7	173.8	0	0	0	115.6	L142 M143 P144	L142-L146 WeakPolarHBondContact CD1-O 3.49Å; L142-L146 HydrophobicContact CD2-CD2 3.89Å; M143-L146 WeakPolarHBondContact O-CA 3Å; M143-L146 PolarHBondContact O-N 3.43Å; P144-L146 VanDerWaalsContact C-N 3.29Å
147	Y	77.5	Confident	82.4	Confident	87 Å²	87	59.1 Å²	59.1	34%	0.341	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-90.7	140.7	170.8	-55	-60.7	0	0	0	110.6	M143 N145 H149 N191	M143-Y147 WeakPolarHBondContact CB-O 3.27Å; M143-Y147 PolarHBondContact N-O 2.85Å; N145-Y147 HydrophobicContact CB-CD2 3.99Å; N145-Y147 HydrophobicContact CB-CE2 4.01Å; N145-Y147 VanDerWaalsContact ND2-CD2 3.29Å; N145-Y147 WeakPolarHBondContact ND2-CD2 3.38Å; N145-Y147 PolarHBondContact O-N 3.02Å; N145-Y147 WeakPolarHBondContact OD1-CD2 3.34Å; Y147-H149 PolarHBondContact O-N 3.45Å; Y147-N191 HydrophobicContact CD1-CB 4.16Å; Y147-N191 HydrophobicContact CD2-CB 3.83Å; Y147-N191 HydrophobicContact CE1-CB 4.39Å; Y147-N191 HydrophobicContact CE2-CB 4.13Å; Y147-N191 HydrophobicContact CG-CB 3.87Å
148	P	81.8	Confident	82.7	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.039	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.5	172.9	26.9	-26	0	0	0	109.6	I140 A190 F203	I140-P148 HydrophobicContact CG2-CB 3.88Å; P148-A190 HydrophobicContact CG-CB 3.75Å; P148-A190 WeakPolarHBondContact O-CB 3.4Å; P148-A190 PolarHBondContact O-N 3.3Å; P148-F203 HydrophobicContact CB-CZ 4.36Å; P148-F203 HydrophobicContact CG-CZ 3.94Å
149	H	84.7	Confident	83.2	Confident	17 Å²	17	57.6 Å²	57.6	8%	0.079	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.9	162	168.7	-119.8	0	0	0	106.8	I140 Q141 M143 Y147 E187 Y189	I140-H149 CarbonylContact C-O 3.58Å; I140-H149 WeakPolarHBondContact CA-O 3.06Å; Q141-H149 PolarHBondContact N-O 3.3Å; Q141-H149 PolarHBondContact O-N 2.89Å; M143-H149 HydrophobicContact CE-CB 3.75Å; M143-H149 HydrophobicContact CG-CB 3.74Å; M143-H149 HydrophobicContact SD-CB 4.18Å; Y147-H149 PolarHBondContact O-N 3.45Å; H149-E187 IonicContact CD2-OE2 3.48Å; H149-E187 IonicContact CE1-OE2 3.84Å; H149-E187 IonicContact NE2-OE2 3.5Å; H149-E187 PolarHBondContact NE2-OE2 2.75Å; H149-Y189 HydrophobicContact CB-CD1 4.24Å; H149-Y189 HydrophobicContact CB-CE1 4.31Å; H149-Y189 AromaticContact CD2-CD1 3.75Å; H149-Y189 AromaticContact CD2-CE1 3.38Å; H149-Y189 WeakPolarHBondContact CD2-CE1 3.41Å; H149-Y189 AromaticContact CD2-CZ 3.53Å; H149-Y189 AromaticContact CG-CE1 3.98Å; H149-Y189 AromaticContact NE2-CZ 3.75Å
150	V	87.7	Confident	83.7	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.9	178.8	-174.9	0	0	0	0	107.3	V138 E139 I140 W152 E187 Y188 F203 L205	V138-V150 HydrophobicContact CG1-CG1 4.18Å; E139-V150 CarbonylContact O-C 3.54Å; E139-V150 WeakPolarHBondContact O-CA 3.25Å; I140-V150 HydrophobicContact CG1-CG1 4.26Å; I140-V150 HydrophobicContact CG1-CG2 4.18Å; I140-V150 HydrophobicContact CG2-CG2 4.4Å; V150-W152 HydrophobicContact CG1-CE3 4.41Å; V150-E187 CarbonylContact O-C 3.43Å; V150-E187 VanDerWaalsContact O-CA 3.24Å; V150-E187 WeakPolarHBondContact O-CA 3.42Å; V150-Y188 PolarHBondContact N-O 3.29Å; V150-Y188 PolarHBondContact O-N 3.17Å; V150-F203 HydrophobicContact CG2-CD1 3.99Å; V150-F203 HydrophobicContact CG2-CE1 3.65Å; V150-F203 HydrophobicContact CG2-CE2 4.38Å; V150-F203 HydrophobicContact CG2-CG 4.48Å; V150-F203 HydrophobicContact CG2-CZ 3.88Å; V150-L205 HydrophobicContact CG1-CD2 4.22Å
151	S	89.4	Confident	84.1	Confident	25 Å²	25	61.4 Å²	61.4	18%	0.175	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	154.6	173.1	54.8	0	0	0	0	110.2	V138 E139 A186	V138-S151 CarbonylContact C-O 3.53Å; V138-S151 WeakPolarHBondContact CA-O 3.44Å; E139-S151 PolarHBondContact N-O 3.1Å; E139-S151 PolarHBondContact O-N 3.42Å; S151-A186 WeakPolarHBondContact CA-O 2.98Å
152	W	89.7	Confident	84.7	Confident	7 Å²	7	62.3 Å²	62.3	3%	0.027	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	158.8	-179.8	63.9	90.6	0	0	0	111.4	I135 V138 V150 T165 I167 Q185 A186 L205	I135-W152 HydrophobicContact CG2-CB 3.67Å; I135-W152 HydrophobicContact CG2-CG 3.99Å; V138-W152 HydrophobicContact CG2-CB 4.05Å; V150-W152 HydrophobicContact CG1-CE3 4.41Å; W152-T165 HydrophobicContact CZ2-CG2 3.74Å; W152-I167 HydrophobicContact CE3-CD1 4.43Å; W152-I167 HydrophobicContact CH2-CD1 3.87Å; W152-I167 HydrophobicContact CZ3-CD1 3.72Å; W152-Q185 VanDerWaalsContact CZ2-O 3.29Å; W152-Q185 WeakPolarHBondContact CZ2-O 3.36Å; W152-A186 PolarHBondContact N-O 2.97Å; W152-L205 HydrophobicContact CB-CD2 4.26Å; W152-L205 HydrophobicContact CD2-CD2 3.89Å; W152-L205 HydrophobicContact CE3-CD2 3.72Å; W152-L205 HydrophobicContact CG-CD2 4.13Å; W152-L205 HydrophobicContact CZ3-CD2 4.4Å
153	E	89.6	Confident	85.4	Confident	112 Å²	112	59.1 Å²	59.1	52%	0.523	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	173.7	170.8	-62.9	-176	173.8	0	0	110.2	I135 E136 N137	I135-E153 WeakPolarHBondContact CA-O 3.33Å; E136-E153 PolarHBondContact N-O 3.25Å; E136-E153 PolarHBondContact O-N 2.9Å; N137-E153 HydrophobicContact CB-CB 4.15Å; N137-E153 HydrophobicContact CB-CG 4.07Å; N137-E153 PolarHBondContact ND2-OE2 2.84Å
154	R	87.4	Confident	86.1	Confident	49 Å²	49	57.3 Å²	57.3	19%	0.185	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.5	173.9	-60.3	-175.9	-172.5	87.5	0.4	109.1	R134 T156 T165 S183 Q185 N207	R134-R154 WeakPolarHBondContact O-CA 3.29Å; R154-T156 WeakPolarHBondContact CB-O 3.23Å; R154-T156 PolarHBondContact O-N 3.2Å; R154-T156 VanDerWaalsContact O-N 3.13Å; R154-T165 PolarHBondContact NH2-OG1 2.86Å; R154-S183 PolarHBondContact NH1-O 3.49Å; R154-S183 PolarHBondContact NH2-O 3Å; R154-Q185 PolarHBondContact NH2-O 3.4Å; R154-N207 PolarHBondContact NE-OD1 2.72Å; R154-N207 VanDerWaalsContact NE-OD1 3.08Å
155	E	87.7	Confident	86.9	Confident	68 Å²	68	51.1 Å²	51.1	32%	0.318	29%	0.286	S	S	.	.	S	Bend	trans	-53.9	-33.3	175.1	-176.7	-173.4	175.2	0	0	112.2	R131 R134 E136	R131-E155 IonicContact CZ-OE1 3.31Å; R131-E155 IonicContact CZ-OE2 3.55Å; R131-E155 IonicContact NH1-OE1 3.84Å; R131-E155 PolarHBondContact NH1-OE1 3.05Å; R131-E155 IonicContact NH1-OE2 3.7Å; R131-E155 PolarHBondContact NH1-OE2 3.01Å; R131-E155 IonicContact NH2-OE1 3.05Å; R131-E155 PolarHBondContact NH2-OE1 2.95Å; R131-E155 IonicContact NH2-OE2 3.32Å; R131-E155 PolarHBondContact NH2-OE2 3.39Å; R134-E155 HydrophobicContact CB-CB 4.47Å; R134-E155 PolarHBondContact O-N 2.95Å; E136-E155 HydrophobicContact CG-CB 4.45Å
156	T	90.5	Very high	87.5	Confident	53 Å²	53	46.7 Å²	46.7	33%	0.325	26%	0.262	S	S	.	.	S	Bend	trans	-150.3	171.3	172.4	-176.3	0	0	0	0	110	P102 P133 R154	P102-T156 HydrophobicContact CB-CG2 3.61Å; P102-T156 HydrophobicContact CG-CG2 3.3Å; P133-T156 HydrophobicContact CB-CG2 3.66Å; P133-T156 HydrophobicContact CG-CG2 3.56Å; R154-T156 WeakPolarHBondContact CB-O 3.23Å; R154-T156 PolarHBondContact O-N 3.2Å; R154-T156 VanDerWaalsContact O-N 3.13Å
157	S	90.5	Very high	88.2	Confident	93 Å²	93	43.9 Å²	43.9	65%	0.65	25%	0.247	S	C	*	.			trans	-54.4	155.4	166.5	60.3	0	0	0	0	111.8
158	A	91	Very high	88.4	Confident	30 Å²	30	40.8 Å²	40.8	25%	0.248	24%	0.236	C	C	.	.			trans	-52	151.7	170.4	0	0	0	0	0	112.3	D163	A158-D163 HydrophobicContact CB-CB 3.87Å
159	C	91.2	Very high	88.5	Confident	34 Å²	34	40.6 Å²	40.6	23%	0.23	23%	0.234	C	C	.	.	S	Bend	trans	-71.3	-40	179.1	-54.4	0	0	0	0	110.6	C103 P133 D163	C103-C159 WeakPolarHBondContact CA-SG 3.4Å; C103-C159 HydrophobicContact CB-CB 3.69Å; C103-C159 WeakPolarHBondContact CB-SG 3.4Å; C103-C159 WeakPolarHBondContact SG-CA 3.14Å; C103-C159 WeakPolarHBondContact SG-CB 3.32Å; C103-C159 PolarHBondContact SG-N 2.92Å; C103-C159 CovalentContact SG-SG 2.04Å; C103-C159 PolarHBondContact SG-SG 2.76Å; P133-C159 WeakPolarHBondContact CD-SG 3.31Å; C159-D163 WeakPolarHBondContact CA-OD2 3.26Å; C159-D163 WeakPolarHBondContact CB-OD2 3.26Å; C159-D163 PolarHBondContact N-OD2 2.89Å
160	E	92.1	Very high	88.2	Confident	91 Å²	91	39.8 Å²	39.8	43%	0.425	23%	0.231	S	C	.	.	S	Bend	trans	-137.6	158.7	176.3	-63.6	-171.2	173.5	0	0	111.3	T162 D163	E160-T162 PolarHBondContact O-N 3.25Å; E160-D163 PolarHBondContact N-OD2 3.39Å; E160-D163 VanDerWaalsContact O-CB 3.28Å; E160-D163 WeakPolarHBondContact O-CB 3.44Å; E160-D163 PolarHBondContact O-N 2.81Å; E160-D163 VanDerWaalsContact O-N 3.11Å
161	S	88.7	Confident	87.7	Confident	119 Å²	119	40.1 Å²	40.1	83%	0.832	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.5	177.9	55.9	0	0	0	0	113.7	D163	S161-D163 VanDerWaalsContact C-N 3.3Å
162	T	90.7	Very high	86.7	Confident	109 Å²	109	40.4 Å²	40.4	67%	0.669	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-9	176.1	42.5	0	0	0	0	113.3	E160	E160-T162 PolarHBondContact O-N 3.25Å
163	D	91.3	Very high	85.6	Confident	9 Å²	9	50.3 Å²	50.3	5%	0.048	27%	0.272	C	S	.	.			trans	-63.9	152.1	178.9	-63.8	-2.4	0	0	0	110.5	A158 C159 E160 S161 S183 E208 H209	A158-D163 HydrophobicContact CB-CB 3.87Å; C159-D163 WeakPolarHBondContact CA-OD2 3.26Å; C159-D163 WeakPolarHBondContact CB-OD2 3.26Å; C159-D163 PolarHBondContact N-OD2 2.89Å; E160-D163 PolarHBondContact N-OD2 3.39Å; E160-D163 VanDerWaalsContact O-CB 3.28Å; E160-D163 WeakPolarHBondContact O-CB 3.44Å; E160-D163 PolarHBondContact O-N 2.81Å; E160-D163 VanDerWaalsContact O-N 3.11Å; S161-D163 VanDerWaalsContact C-N 3.3Å; D163-S183 WeakPolarHBondContact O-CB 3.25Å; D163-S183 PolarHBondContact O-N 2.87Å; D163-S183 VanDerWaalsContact O-N 3.11Å; D163-S183 PolarHBondContact O-OG 2.85Å; D163-S183 VanDerWaalsContact O-OG 3.1Å; D163-E208 WeakPolarHBondContact CA-O 2.8Å; D163-E208 WeakPolarHBondContact CB-O 3.25Å; D163-H209 VanDerWaalsContact CG-ND1 3.32Å; D163-H209 IonicContact OD1-CE1 3.53Å; D163-H209 IonicContact OD1-CG 3.55Å; D163-H209 IonicContact OD1-ND1 3.81Å; D163-H209 PolarHBondContact OD1-ND1 3.13Å; D163-H209 IonicContact OD2-CG 2.71Å; D163-H209 IonicContact OD2-ND1 2.68Å; D163-H209 PolarHBondContact OD2-ND1 3.4Å
164	S	90.4	Very high	84.7	Confident	9 Å²	9	48.8 Å²	48.8	6%	0.063	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	158.6	-175.9	93.8	0	0	0	0	111	F181 N207 E208	S164-F181 CarbonylContact C-O 3.54Å; S164-F181 VanDerWaalsContact CA-O 3.23Å; S164-F181 WeakPolarHBondContact CA-O 3.22Å; S164-F181 WeakPolarHBondContact CB-O 3.45Å; S164-N207 CarbonylContact O-C 3.6Å; S164-N207 WeakPolarHBondContact O-CA 3.18Å; S164-E208 PolarHBondContact N-O 3.47Å; S164-E208 PolarHBondContact O-N 3.04Å; S164-E208 WeakPolarHBondContact OG-CB 3.32Å; S164-E208 PolarHBondContact OG-OE2 2.82Å
165	T	90.1	Very high	84	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.3	163.9	-65.4	0	0	0	0	108.3	I135 W152 R154 I167 F181 F206 N207	I135-T165 HydrophobicContact CD1-CG2 3.79Å; W152-T165 HydrophobicContact CZ2-CG2 3.74Å; R154-T165 PolarHBondContact NH2-OG1 2.86Å; T165-I167 HydrophobicContact CG2-CG1 4.36Å; T165-F181 PolarHBondContact N-O 3.04Å; T165-F181 PolarHBondContact O-N 2.8Å; T165-F206 CarbonylContact C-O 3.47Å; T165-F206 WeakPolarHBondContact CA-O 3.29Å; T165-N207 PolarHBondContact OG1-OD1 3.21Å
166	I	84.9	Confident	83.5	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.9	176.8	-58	-176.1	0	0	0	108.6	F168 M178 F179 I180 L205 F206 E208 F213	I166-F168 HydrophobicContact CG2-CD2 4.1Å; I166-F168 HydrophobicContact CG2-CE2 3.8Å; I166-F168 HydrophobicContact CG2-CZ 4.31Å; I166-M178 HydrophobicContact CG2-CE 4.49Å; I166-M178 HydrophobicContact CG2-CG 3.63Å; I166-M178 HydrophobicContact CG2-SD 4.34Å; I166-F179 CarbonylContact C-O 3.55Å; I166-F179 WeakPolarHBondContact CA-O 3.23Å; I166-I180 HydrophobicContact CG1-CG1 4.41Å; I166-L205 WeakPolarHBondContact O-CA 3.46Å; I166-F206 PolarHBondContact N-O 3.23Å; I166-F206 PolarHBondContact O-N 3.05Å; I166-E208 HydrophobicContact CD1-CB 3.94Å; I166-E208 HydrophobicContact CD1-CG 4.36Å; I166-E208 HydrophobicContact CG1-CB 4.2Å; I166-F213 HydrophobicContact CD1-CD1 4.08Å; I166-F213 HydrophobicContact CD1-CE1 3.54Å
167	I	85.6	Confident	83	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116.4	171	-51	-170	0	0	0	108.1	W152 T165 R169 M178 F179 F181 Y188 F203 I204 L205	W152-I167 HydrophobicContact CE3-CD1 4.43Å; W152-I167 HydrophobicContact CH2-CD1 3.87Å; W152-I167 HydrophobicContact CZ3-CD1 3.72Å; T165-I167 HydrophobicContact CG2-CG1 4.36Å; I167-R169 HydrophobicContact CG2-CB 4.46Å; I167-M178 CarbonylContact O-C 3.53Å; I167-F179 HydrophobicContact CB-CB 4.42Å; I167-F179 PolarHBondContact N-O 2.82Å; I167-F179 PolarHBondContact O-N 3.07Å; I167-F181 HydrophobicContact CB-CE2 4.1Å; I167-F181 HydrophobicContact CD1-CD2 3.93Å; I167-F181 HydrophobicContact CD1-CE2 3.57Å; I167-F181 HydrophobicContact CG1-CD2 3.88Å; I167-F181 HydrophobicContact CG1-CE2 3.71Å; I167-Y188 HydrophobicContact CD1-CD1 4Å; I167-Y188 HydrophobicContact CD1-CG 4.35Å; I167-F203 HydrophobicContact CG2-CD1 4.03Å; I167-I204 CarbonylContact C-O 3.56Å; I167-I204 WeakPolarHBondContact CA-O 3.43Å; I167-L205 HydrophobicContact CD1-CD2 4.02Å; I167-L205 HydrophobicContact CD1-CG 4.22Å; I167-L205 HydrophobicContact CG1-CD2 4.25Å; I167-L205 HydrophobicContact CG1-CG 3.99Å; I167-L205 HydrophobicContact CG2-CD1 4.48Å; I167-L205 HydrophobicContact CG2-CG 4.28Å
168	F	82.5	Confident	82.6	Confident	22 Å²	22	49.3 Å²	49.3	10%	0.096	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	128.3	161.3	-65.9	-88	0	0	0	109.1	I166 L176 R177 M178 F203 I204 F206 L246	I166-F168 HydrophobicContact CG2-CD2 4.1Å; I166-F168 HydrophobicContact CG2-CE2 3.8Å; I166-F168 HydrophobicContact CG2-CZ 4.31Å; F168-L176 HydrophobicContact CB-CB 3.93Å; F168-L176 HydrophobicContact CB-CD1 3.84Å; F168-L176 HydrophobicContact CD1-CB 4.33Å; F168-R177 CarbonylContact C-O 3.42Å; F168-R177 WeakPolarHBondContact CA-O 3.22Å; F168-M178 HydrophobicContact CD1-CB 4.06Å; F168-M178 HydrophobicContact CD1-CG 4.48Å; F168-M178 HydrophobicContact CE1-CB 3.9Å; F168-M178 HydrophobicContact CE1-CE 3.47Å; F168-M178 VanDerWaalsContact CE1-CE 3.47Å; F168-M178 HydrophobicContact CE1-CG 4.11Å; F168-M178 HydrophobicContact CE2-CE 4.33Å; F168-M178 HydrophobicContact CZ-CE 3.3Å; F168-M178 HydrophobicContact CZ-CG 4.37Å; F168-F203 CarbonylContact O-C 3.59Å; F168-F203 WeakPolarHBondContact O-CA 3.26Å; F168-I204 HydrophobicContact CB-CB 4.1Å; F168-I204 HydrophobicContact CB-CG1 4.46Å; F168-I204 PolarHBondContact N-O 3.4Å; F168-I204 PolarHBondContact O-N 3.4Å; F168-F206 HydrophobicContact CD2-CD2 4.44Å; F168-F206 HydrophobicContact CD2-CE2 4.34Å; F168-F206 HydrophobicContact CE2-CD2 4.42Å; F168-F206 HydrophobicContact CE2-CE2 4.46Å; F168-L246 HydrophobicContact CD1-CB 4.34Å; F168-L246 HydrophobicContact CE1-CB 4.11Å
169	R	82	Confident	82.4	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	139.7	-178.5	177.8	-167.8	179	-159.5	4.5	111.6	I167 L176 R177 F179 Y188 A190 D192 E201 V202 F203	I167-R169 HydrophobicContact CG2-CB 4.46Å; R169-L176 CarbonylContact O-C 3.58Å; R169-L176 WeakPolarHBondContact O-CA 3.39Å; R169-R177 PolarHBondContact N-O 2.95Å; R169-R177 PolarHBondContact O-N 2.88Å; R169-F179 HydrophobicContact CB-CD2 4.19Å; R169-F179 HydrophobicContact CB-CE2 3.9Å; R169-Y188 PolarHBondContact NH1-OH 3.37Å; R169-A190 VanDerWaalsContact NH1-CB 3.26Å; R169-A190 VanDerWaalsContact NH2-CB 3.34Å; R169-A190 PolarHBondContact NH2-O 3.41Å; R169-D192 IonicContact CZ-OD1 2.87Å; R169-D192 IonicContact NH1-OD1 2.71Å; R169-D192 PolarHBondContact NH1-OD1 3.22Å; R169-D192 IonicContact NH1-OD2 2.65Å; R169-E201 IonicContact CZ-OE1 3.69Å; R169-E201 IonicContact NE-OE1 3.43Å; R169-E201 PolarHBondContact NE-OE1 3.34Å; R169-E201 IonicContact NH2-OE1 2.73Å; R169-E201 PolarHBondContact NH2-OE1 3.01Å; R169-V202 VanDerWaalsContact CA-O 3.24Å; R169-V202 WeakPolarHBondContact CA-O 3.2Å; R169-F203 HydrophobicContact CB-CD1 4.16Å; R169-F203 HydrophobicContact CB-CE1 4.25Å; R169-F203 HydrophobicContact CG-CD1 3.97Å; R169-F203 HydrophobicContact CG-CE1 3.63Å; R169-F203 HydrophobicContact CG-CZ 4.13Å
170	G	78.8	Confident	82.2	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.9	-159.6	173	0	0	0	0	0	111.2	E201 V202	G170-E201 CarbonylContact O-C 3.32Å; G170-E201 WeakPolarHBondContact O-CA 3.44Å; G170-V202 PolarHBondContact N-O 2.86Å; G170-V202 VanDerWaalsContact N-O 3.12Å; G170-V202 PolarHBondContact O-N 2.86Å
171	F	77.2	Confident	82.2	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	152.4	173.9	-61.3	-58.9	0	0	0	111.6	R173 Q174 F193 M199 E200 E201	F171-R173 PolarHBondContact O-N 2.84Å; F171-Q174 HydrophobicContact CB-CB 4.41Å; F171-Q174 HydrophobicContact CB-CG 4.18Å; F171-Q174 WeakPolarHBondContact O-CB 3.47Å; F171-Q174 PolarHBondContact O-N 2.88Å; F171-F193 AromaticContact CD2-CE1 3.78Å; F171-F193 HydrophobicContact CD2-CE1 3.78Å; F171-F193 HydrophobicContact CD2-CZ 4.47Å; F171-F193 HydrophobicContact CE1-CD1 4.49Å; F171-F193 AromaticContact CE2-CD1 3.56Å; F171-F193 HydrophobicContact CE2-CD1 3.56Å; F171-F193 AromaticContact CE2-CE1 3.13Å; F171-F193 HydrophobicContact CE2-CE1 3.13Å; F171-F193 HydrophobicContact CE2-CZ 4.19Å; F171-F193 AromaticContact CZ-CD1 3.47Å; F171-F193 HydrophobicContact CZ-CD1 3.47Å; F171-F193 VanDerWaalsContact CZ-CD1 3.47Å; F171-F193 AromaticContact CZ-CE1 3.57Å; F171-F193 HydrophobicContact CZ-CE1 3.57Å; F171-M199 HydrophobicContact CB-CB 4.2Å; F171-M199 HydrophobicContact CB-SD 4.12Å; F171-M199 HydrophobicContact CD1-CB 3.57Å; F171-M199 HydrophobicContact CD2-CB 4.29Å; F171-M199 HydrophobicContact CD2-CE 3.56Å; F171-M199 HydrophobicContact CD2-SD 3.99Å; F171-M199 HydrophobicContact CE1-CB 4Å; F171-M199 HydrophobicContact CE2-CE 3.73Å; F171-M199 HydrophobicContact CG-CB 3.77Å; F171-M199 HydrophobicContact CG-CE 4.22Å; F171-M199 HydrophobicContact CG-SD 4.08Å; F171-E200 CarbonylContact C-O 3.54Å; F171-E200 VanDerWaalsContact CA-O 3.24Å; F171-E200 WeakPolarHBondContact CA-O 3.46Å; F171-E201 HydrophobicContact CD1-CB 4.24Å; F171-E201 HydrophobicContact CE1-CB 4.22Å; F171-E201 HydrophobicContact CE1-CG 4.48Å
172	S	68.1	Low	82.4	Confident	31 Å²	31	47.3 Å²	47.3	22%	0.217	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	134.1	170.9	71.9	0	0	0	0	109.6	Q174 E200	S172-Q174 PolarHBondContact O-N 2.83Å; S172-E200 PolarHBondContact N-O 2.87Å
173	R	68.1	Low	82.2	Confident	216 Å²	216	42.9 Å²	42.9	82%	0.815	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.3	7.7	-177.1	-44.4	172.2	-179.5	176.7	-0.8	115.6	F171	F171-R173 PolarHBondContact O-N 2.84Å
174	Q	70.9	Confident	82.1	Confident	80 Å²	80	49.2 Å²	49.2	37%	0.374	23%	0.234	S	C	.	.	S	Bend	trans	-112.2	168.5	172.1	-60.3	-171.1	15.2	0	0	111.3	F171 S172 L176 M199 V248	F171-Q174 HydrophobicContact CB-CB 4.41Å; F171-Q174 HydrophobicContact CB-CG 4.18Å; F171-Q174 WeakPolarHBondContact O-CB 3.47Å; F171-Q174 PolarHBondContact O-N 2.88Å; S172-Q174 PolarHBondContact O-N 2.83Å; Q174-L176 PolarHBondContact O-N 2.9Å; Q174-M199 VanDerWaalsContact NE2-CE 3.32Å; Q174-M199 PolarHBondContact NE2-SD 2.83Å; Q174-V248 WeakPolarHBondContact O-CG2 3.44Å
175	H	72.7	Confident	82.3	Confident	111 Å²	111	51.8 Å²	51.8	51%	0.514	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	131	170.7	-72.6	-71.4	0	0	0	110.6	C245 L246	H175-C245 HydrophobicContact CB-CB 4.04Å; H175-L246 VanDerWaalsContact CA-O 3.29Å; H175-L246 WeakPolarHBondContact CA-O 3.2Å; H175-L246 PolarHBondContact ND1-O 3.38Å
176	L	76.1	Confident	82.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	136.4	172	-52	-179.8	0	0	0	109.2	F168 R169 Q174 V202 I204 L246 V248 L251	F168-L176 HydrophobicContact CB-CB 3.93Å; F168-L176 HydrophobicContact CB-CD1 3.84Å; F168-L176 HydrophobicContact CD1-CB 4.33Å; R169-L176 CarbonylContact O-C 3.58Å; R169-L176 WeakPolarHBondContact O-CA 3.39Å; Q174-L176 PolarHBondContact O-N 2.9Å; L176-V202 HydrophobicContact CD1-CG1 4.35Å; L176-V202 HydrophobicContact CD2-CB 4.21Å; L176-V202 HydrophobicContact CD2-CG1 4.33Å; L176-I204 HydrophobicContact CD1-CD1 3.58Å; L176-I204 HydrophobicContact CD1-CG1 4.16Å; L176-L246 PolarHBondContact N-O 2.83Å; L176-L246 PolarHBondContact O-N 2.79Å; L176-V248 HydrophobicContact CD1-CG2 3.84Å; L176-V248 HydrophobicContact CD2-CG2 3.94Å; L176-V248 HydrophobicContact CG-CG2 3.61Å; L176-L251 HydrophobicContact CD1-CD1 4.43Å
177	R	80.2	Confident	82.7	Confident	113 Å²	113	57.5 Å²	57.5	43%	0.426	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	134.9	168.6	-66.6	-175.8	-178.7	174.9	1.7	109.1	F168 R169 F179	F168-R177 CarbonylContact C-O 3.42Å; F168-R177 WeakPolarHBondContact CA-O 3.22Å; R169-R177 PolarHBondContact N-O 2.95Å; R169-R177 PolarHBondContact O-N 2.88Å; R177-F179 HydrophobicContact CB-CD2 4.43Å; R177-F179 HydrophobicContact CB-CE2 3.66Å; R177-F179 HydrophobicContact CB-CZ 4.13Å
178	M	82.5	Confident	82.8	Confident	49 Å²	49	58.3 Å²	58.3	24%	0.241	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131.7	174.1	-176.4	-168.8	-79.1	0	0	110.3	I166 I167 F168 I180	I166-M178 HydrophobicContact CG2-CE 4.49Å; I166-M178 HydrophobicContact CG2-CG 3.63Å; I166-M178 HydrophobicContact CG2-SD 4.34Å; I167-M178 CarbonylContact O-C 3.53Å; F168-M178 HydrophobicContact CD1-CB 4.06Å; F168-M178 HydrophobicContact CD1-CG 4.48Å; F168-M178 HydrophobicContact CE1-CB 3.9Å; F168-M178 HydrophobicContact CE1-CE 3.47Å; F168-M178 VanDerWaalsContact CE1-CE 3.47Å; F168-M178 HydrophobicContact CE1-CG 4.11Å; F168-M178 HydrophobicContact CE2-CE 4.33Å; F168-M178 HydrophobicContact CZ-CE 3.3Å; F168-M178 HydrophobicContact CZ-CG 4.37Å; M178-I180 HydrophobicContact CG-CG1 4.26Å; M178-I180 HydrophobicContact SD-CD1 4.14Å; M178-I180 HydrophobicContact SD-CG1 4.21Å
179	F	85.7	Confident	83.1	Confident	40 Å²	40	63 Å²	63	18%	0.175	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.4	171.4	-61	-95	0	0	0	108.3	I166 I167 R169 R177 F181 D192	I166-F179 CarbonylContact C-O 3.55Å; I166-F179 WeakPolarHBondContact CA-O 3.23Å; I167-F179 HydrophobicContact CB-CB 4.42Å; I167-F179 PolarHBondContact N-O 2.82Å; I167-F179 PolarHBondContact O-N 3.07Å; R169-F179 HydrophobicContact CB-CD2 4.19Å; R169-F179 HydrophobicContact CB-CE2 3.9Å; R177-F179 HydrophobicContact CB-CD2 4.43Å; R177-F179 HydrophobicContact CB-CE2 3.66Å; R177-F179 HydrophobicContact CB-CZ 4.13Å; F179-F181 HydrophobicContact CB-CD2 4.39Å; F179-F181 HydrophobicContact CB-CE2 3.49Å; F179-F181 VanDerWaalsContact CB-CE2 3.49Å; F179-F181 HydrophobicContact CB-CZ 3.78Å; F179-D192 WeakPolarHBondContact CE1-OD2 3.16Å; F179-D192 VanDerWaalsContact CZ-OD2 3.28Å; F179-D192 WeakPolarHBondContact CZ-OD2 3.44Å
180	I	88.4	Confident	83.2	Confident	95 Å²	95	62.9 Å²	62.9	49%	0.487	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.1	-178.6	-54.7	176.6	0	0	0	107.8	I166 M178	I166-I180 HydrophobicContact CG1-CG1 4.41Å; M178-I180 HydrophobicContact CG-CG1 4.26Å; M178-I180 HydrophobicContact SD-CD1 4.14Å; M178-I180 HydrophobicContact SD-CG1 4.21Å
181	F	90.9	Very high	83.2	Confident	25 Å²	25	67.7 Å²	67.7	11%	0.11	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.7	-179.5	-59.3	-78.3	0	0	0	110.2	S164 T165 I167 F179 Q185 Y188	S164-F181 CarbonylContact C-O 3.54Å; S164-F181 VanDerWaalsContact CA-O 3.23Å; S164-F181 WeakPolarHBondContact CA-O 3.22Å; S164-F181 WeakPolarHBondContact CB-O 3.45Å; T165-F181 PolarHBondContact N-O 3.04Å; T165-F181 PolarHBondContact O-N 2.8Å; I167-F181 HydrophobicContact CB-CE2 4.1Å; I167-F181 HydrophobicContact CD1-CD2 3.93Å; I167-F181 HydrophobicContact CD1-CE2 3.57Å; I167-F181 HydrophobicContact CG1-CD2 3.88Å; I167-F181 HydrophobicContact CG1-CE2 3.71Å; F179-F181 HydrophobicContact CB-CD2 4.39Å; F179-F181 HydrophobicContact CB-CE2 3.49Å; F179-F181 VanDerWaalsContact CB-CE2 3.49Å; F179-F181 HydrophobicContact CB-CZ 3.78Å; F181-Q185 HydrophobicContact CB-CB 4.32Å; F181-Q185 VanDerWaalsContact CD1-CD 3.45Å; F181-Y188 AromaticContact CE1-CD2 3.91Å; F181-Y188 HydrophobicContact CE1-CD2 3.91Å; F181-Y188 HydrophobicContact CE1-CE2 4.45Å; F181-Y188 HydrophobicContact CE1-CG 4.41Å; F181-Y188 HydrophobicContact CE2-CD2 4.42Å; F181-Y188 HydrophobicContact CE2-CG 4.26Å; F181-Y188 HydrophobicContact CZ-CD1 4.27Å; F181-Y188 AromaticContact CZ-CD2 3.45Å; F181-Y188 HydrophobicContact CZ-CD2 3.45Å; F181-Y188 VanDerWaalsContact CZ-CD2 3.45Å; F181-Y188 AromaticContact CZ-CE2 3.85Å; F181-Y188 HydrophobicContact CZ-CE2 3.85Å; F181-Y188 AromaticContact CZ-CG 3.71Å; F181-Y188 HydrophobicContact CZ-CG 3.71Å
182	P	92.4	Very high	82.9	Confident	72 Å²	72	70.6 Å²	70.6	47%	0.468	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	151.5	168.6	-26.4	38	0	0	0	112.3	D184 Q185	P182-D184 WeakPolarHBondContact CB-OD1 3.29Å; P182-D184 PolarHBondContact O-N 2.86Å; P182-Q185 WeakPolarHBondContact O-CB 3.37Å; P182-Q185 PolarHBondContact O-N 2.95Å; P182-Q185 VanDerWaalsContact O-N 3.09Å
183	S	88.5	Confident	82.9	Confident	17 Å²	17	70.9 Å²	70.9	12%	0.119	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-18.7	-179.6	48.5	0	0	0	0	115.3	R154 D163 Q185	R154-S183 PolarHBondContact NH1-O 3.49Å; R154-S183 PolarHBondContact NH2-O 3Å; D163-S183 WeakPolarHBondContact O-CB 3.25Å; D163-S183 PolarHBondContact O-N 2.87Å; D163-S183 VanDerWaalsContact O-N 3.11Å; D163-S183 PolarHBondContact O-OG 2.85Å; D163-S183 VanDerWaalsContact O-OG 3.1Å; S183-Q185 VanDerWaalsContact C-N 3.32Å
184	D	89.1	Confident	82.8	Confident	142 Å²	142	65.8 Å²	65.8	76%	0.759	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.4	174.4	63.7	-32.1	0	0	0	112.9	P182	P182-D184 WeakPolarHBondContact CB-OD1 3.29Å; P182-D184 PolarHBondContact O-N 2.86Å
185	Q	93	Very high	82.5	Confident	63 Å²	63	66.2 Å²	66.2	29%	0.294	33%	0.334	S	S	.	.			trans	-80.1	134.6	174.3	-167.3	173.1	-28.2	0	0	110.7	W152 R154 F181 P182 S183 E187	W152-Q185 VanDerWaalsContact CZ2-O 3.29Å; W152-Q185 WeakPolarHBondContact CZ2-O 3.36Å; R154-Q185 PolarHBondContact NH2-O 3.4Å; F181-Q185 HydrophobicContact CB-CB 4.32Å; F181-Q185 VanDerWaalsContact CD1-CD 3.45Å; P182-Q185 WeakPolarHBondContact O-CB 3.37Å; P182-Q185 PolarHBondContact O-N 2.95Å; P182-Q185 VanDerWaalsContact O-N 3.09Å; S183-Q185 VanDerWaalsContact C-N 3.32Å; Q185-E187 WeakPolarHBondContact CG-O 3.44Å; Q185-E187 PolarHBondContact NE2-O 3.28Å
186	A	91.4	Very high	82	Confident	41 Å²	41	62 Å²	62	34%	0.339	32%	0.32	S	S	.	.			trans	-130.3	7.9	-177.8	0	0	0	0	0	113	S151 W152	S151-A186 WeakPolarHBondContact CA-O 2.98Å; W152-A186 PolarHBondContact N-O 2.97Å
187	E	92.6	Very high	81.3	Confident	82 Å²	82	68.8 Å²	68.8	38%	0.383	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	154.7	178.4	60.2	170.7	-160.2	0	0	112.1	H149 V150 Q185 Y189	H149-E187 IonicContact CD2-OE2 3.48Å; H149-E187 IonicContact CE1-OE2 3.84Å; H149-E187 IonicContact NE2-OE2 3.5Å; H149-E187 PolarHBondContact NE2-OE2 2.75Å; V150-E187 CarbonylContact O-C 3.43Å; V150-E187 VanDerWaalsContact O-CA 3.24Å; V150-E187 WeakPolarHBondContact O-CA 3.42Å; Q185-E187 WeakPolarHBondContact CG-O 3.44Å; Q185-E187 PolarHBondContact NE2-O 3.28Å; E187-Y189 HydrophobicContact CG-CE2 4.35Å; E187-Y189 WeakPolarHBondContact OE1-CE2 3.4Å; E187-Y189 PolarHBondContact OE1-OH 3.39Å; E187-Y189 PolarHBondContact OE2-OH 3.28Å
188	Y	88.6	Confident	80.5	Confident	17 Å²	17	65.5 Å²	65.5	7%	0.067	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	123.9	179.9	169.7	-131.7	0	0	0	110.3	V150 I167 R169 F181 A190 D192 F203	V150-Y188 PolarHBondContact N-O 3.29Å; V150-Y188 PolarHBondContact O-N 3.17Å; I167-Y188 HydrophobicContact CD1-CD1 4Å; I167-Y188 HydrophobicContact CD1-CG 4.35Å; R169-Y188 PolarHBondContact NH1-OH 3.37Å; F181-Y188 AromaticContact CE1-CD2 3.91Å; F181-Y188 HydrophobicContact CE1-CD2 3.91Å; F181-Y188 HydrophobicContact CE1-CE2 4.45Å; F181-Y188 HydrophobicContact CE1-CG 4.41Å; F181-Y188 HydrophobicContact CE2-CD2 4.42Å; F181-Y188 HydrophobicContact CE2-CG 4.26Å; F181-Y188 HydrophobicContact CZ-CD1 4.27Å; F181-Y188 AromaticContact CZ-CD2 3.45Å; F181-Y188 HydrophobicContact CZ-CD2 3.45Å; F181-Y188 VanDerWaalsContact CZ-CD2 3.45Å; F181-Y188 AromaticContact CZ-CE2 3.85Å; F181-Y188 HydrophobicContact CZ-CE2 3.85Å; F181-Y188 AromaticContact CZ-CG 3.71Å; F181-Y188 HydrophobicContact CZ-CG 3.71Å; Y188-A190 HydrophobicContact CD1-CB 4.14Å; Y188-A190 HydrophobicContact CE1-CB 3.58Å; Y188-D192 PolarHBondContact OH-OD1 2.87Å; Y188-F203 HydrophobicContact CE1-CE1 4.44Å
189	Y	88.6	Confident	79.8	Confident	119 Å²	119	65.9 Å²	65.9	47%	0.467	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	108.8	173.3	-62	-90.3	0	0	0	109.2	H149 E187 N191	H149-Y189 HydrophobicContact CB-CD1 4.24Å; H149-Y189 HydrophobicContact CB-CE1 4.31Å; H149-Y189 AromaticContact CD2-CD1 3.75Å; H149-Y189 AromaticContact CD2-CE1 3.38Å; H149-Y189 WeakPolarHBondContact CD2-CE1 3.41Å; H149-Y189 AromaticContact CD2-CZ 3.53Å; H149-Y189 AromaticContact CG-CE1 3.98Å; H149-Y189 AromaticContact NE2-CZ 3.75Å; E187-Y189 HydrophobicContact CG-CE2 4.35Å; E187-Y189 WeakPolarHBondContact OE1-CE2 3.4Å; E187-Y189 PolarHBondContact OE1-OH 3.39Å; E187-Y189 PolarHBondContact OE2-OH 3.28Å; Y189-N191 VanDerWaalsContact C-N 3.28Å; Y189-N191 PolarHBondContact O-N 3.41Å
190	A	83.4	Confident	79	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.348	C	S	.	.			trans	-90.3	58.5	-170.4	0	0	0	0	0	112.1	P148 R169 Y188 D192 F203	P148-A190 HydrophobicContact CG-CB 3.75Å; P148-A190 WeakPolarHBondContact O-CB 3.4Å; P148-A190 PolarHBondContact O-N 3.3Å; R169-A190 VanDerWaalsContact NH1-CB 3.26Å; R169-A190 VanDerWaalsContact NH2-CB 3.34Å; R169-A190 PolarHBondContact NH2-O 3.41Å; Y188-A190 HydrophobicContact CD1-CB 4.14Å; Y188-A190 HydrophobicContact CE1-CB 3.58Å; A190-D192 VanDerWaalsContact C-N 3.31Å; A190-D192 PolarHBondContact O-N 3.19Å; A190-F203 HydrophobicContact CB-CE1 4.4Å; A190-F203 HydrophobicContact CB-CZ 4.44Å
191	N	78.8	Confident	78.4	Confident	103 Å²	103	60.5 Å²	60.5	55%	0.551	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-1.4	-175.8	67.4	-8.7	0	0	0	115.3	Y147 Y189	Y147-N191 HydrophobicContact CD1-CB 4.16Å; Y147-N191 HydrophobicContact CD2-CB 3.83Å; Y147-N191 HydrophobicContact CE1-CB 4.39Å; Y147-N191 HydrophobicContact CE2-CB 4.13Å; Y147-N191 HydrophobicContact CG-CB 3.87Å; Y189-N191 VanDerWaalsContact C-N 3.28Å; Y189-N191 PolarHBondContact O-N 3.41Å
192	D	71.4	Confident	77.7	Confident	67 Å²	67	59.4 Å²	59.4	36%	0.358	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	9.2	-172.5	59.8	-56.1	0	0	0	114.5	R169 F179 Y188 A190	R169-D192 IonicContact CZ-OD1 2.87Å; R169-D192 IonicContact NH1-OD1 2.71Å; R169-D192 PolarHBondContact NH1-OD1 3.22Å; R169-D192 IonicContact NH1-OD2 2.65Å; F179-D192 WeakPolarHBondContact CE1-OD2 3.16Å; F179-D192 VanDerWaalsContact CZ-OD2 3.28Å; F179-D192 WeakPolarHBondContact CZ-OD2 3.44Å; Y188-D192 PolarHBondContact OH-OD1 2.87Å; A190-D192 VanDerWaalsContact C-N 3.31Å; A190-D192 PolarHBondContact O-N 3.19Å
193	F	68	Low	77.1	Confident	36 Å²	36	56 Å²	56	16%	0.158	30%	0.301	C	S	.	.			trans	-133	133.9	-177.5	-126.9	-78.4	0	0	0	111.8	F171	F171-F193 AromaticContact CD2-CE1 3.78Å; F171-F193 HydrophobicContact CD2-CE1 3.78Å; F171-F193 HydrophobicContact CD2-CZ 4.47Å; F171-F193 HydrophobicContact CE1-CD1 4.49Å; F171-F193 AromaticContact CE2-CD1 3.56Å; F171-F193 HydrophobicContact CE2-CD1 3.56Å; F171-F193 AromaticContact CE2-CE1 3.13Å; F171-F193 HydrophobicContact CE2-CE1 3.13Å; F171-F193 HydrophobicContact CE2-CZ 4.19Å; F171-F193 AromaticContact CZ-CD1 3.47Å; F171-F193 HydrophobicContact CZ-CD1 3.47Å; F171-F193 VanDerWaalsContact CZ-CD1 3.47Å; F171-F193 AromaticContact CZ-CE1 3.57Å; F171-F193 HydrophobicContact CZ-CE1 3.57Å
194	E	66.3	Low	76.7	Confident	109 Å²	109	55.4 Å²	55.4	51%	0.509	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-92.7	118	168.9	-71.6	-174.6	147	0	0	108.7	G196 R234 H235	E194-G196 PolarHBondContact O-N 2.64Å; E194-R234 WeakPolarHBondContact OE1-CA 3.29Å; E194-R234 PolarHBondContact OE1-N 3.1Å; E194-R234 VanDerWaalsContact OE1-N 3.16Å; E194-H235 PolarHBondContact OE1-N 3.05Å
195	P	64.7	Low	76.5	Confident	89 Å²	89	48.7 Å²	48.7	58%	0.578	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-62.5	122.9	175.7	24.1	-30.8	0	0	0	110
196	G	62.2	Low	76	Confident	22 Å²	22	46.2 Å²	46.2	23%	0.227	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-70.5	142.1	164.4	0	0	0	0	0	109.2	E194 G198 M199	E194-G196 PolarHBondContact O-N 2.64Å; G196-G198 PolarHBondContact O-N 2.86Å; G196-M199 WeakPolarHBondContact O-CB 3.21Å; G196-M199 PolarHBondContact O-N 2.73Å
197	E	60.3	Low	75.8	Confident	144 Å²	144	44.6 Å²	44.6	67%	0.673	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	126.1	176.5	-111.1	-140	139.5	0	0	108.5	M199 L265	E197-M199 VanDerWaalsContact C-N 3.29Å; E197-M199 PolarHBondContact O-N 2.97Å; E197-L265 VanDerWaalsContact CA-CD2 3.45Å; E197-L265 HydrophobicContact CB-CD1 3.24Å; E197-L265 HydrophobicContact CB-CD2 3.49Å; E197-L265 VanDerWaalsContact CB-CD2 3.49Å; E197-L265 HydrophobicContact CB-CG 3.77Å; E197-L265 VanDerWaalsContact CD-CD1 3.42Å; E197-L265 VanDerWaalsContact CD-CD2 3.41Å; E197-L265 HydrophobicContact CG-CD1 3.65Å; E197-L265 HydrophobicContact CG-CD2 3.13Å; E197-L265 HydrophobicContact CG-CG 3.8Å; E197-L265 VanDerWaalsContact OE1-CD2 3.27Å; E197-L265 WeakPolarHBondContact OE1-CD2 3.44Å
198	G	63.8	Low	75.4	Confident	43 Å²	43	43.3 Å²	43.3	44%	0.443	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-3.2	172.1	0	0	0	0	0	115	G196 P263 L265	G196-G198 PolarHBondContact O-N 2.86Å; G198-P263 CarbonylContact C-O 3.57Å; G198-P263 WeakPolarHBondContact CA-O 3.35Å; G198-L265 VanDerWaalsContact N-CD1 3.25Å; G198-L265 VanDerWaalsContact N-CD2 3.25Å
199	M	67.7	Low	75.2	Confident	58 Å²	58	42.5 Å²	42.5	29%	0.286	23%	0.226	S	C	.	.			trans	-90.3	114.6	-170	-65.5	-126.1	-97.9	0	0	112.6	F171 Q174 G196 E197 E201 P263	F171-M199 HydrophobicContact CB-CB 4.2Å; F171-M199 HydrophobicContact CB-SD 4.12Å; F171-M199 HydrophobicContact CD1-CB 3.57Å; F171-M199 HydrophobicContact CD2-CB 4.29Å; F171-M199 HydrophobicContact CD2-CE 3.56Å; F171-M199 HydrophobicContact CD2-SD 3.99Å; F171-M199 HydrophobicContact CE1-CB 4Å; F171-M199 HydrophobicContact CE2-CE 3.73Å; F171-M199 HydrophobicContact CG-CB 3.77Å; F171-M199 HydrophobicContact CG-CE 4.22Å; F171-M199 HydrophobicContact CG-SD 4.08Å; Q174-M199 VanDerWaalsContact NE2-CE 3.32Å; Q174-M199 PolarHBondContact NE2-SD 2.83Å; G196-M199 WeakPolarHBondContact O-CB 3.21Å; G196-M199 PolarHBondContact O-N 2.73Å; E197-M199 VanDerWaalsContact C-N 3.29Å; E197-M199 PolarHBondContact O-N 2.97Å; M199-E201 PolarHBondContact O-N 3.34Å; M199-E201 VanDerWaalsContact O-N 3.14Å; M199-P263 WeakPolarHBondContact O-CD 3.43Å; M199-P263 WeakPolarHBondContact O-CG 3.28Å
200	E	69.1	Low	75	Confident	8 Å²	8	42.6 Å²	42.6	4%	0.037	23%	0.23	C	C	.	.			trans	-66.2	111.4	177.6	178.1	151.7	-127.5	0	0	111.2	F171 S172 V202 R260 V261 R262	F171-E200 CarbonylContact C-O 3.54Å; F171-E200 VanDerWaalsContact CA-O 3.24Å; F171-E200 WeakPolarHBondContact CA-O 3.46Å; S172-E200 PolarHBondContact N-O 2.87Å; E200-V202 HydrophobicContact CG-CG2 4.5Å; E200-R260 HydrophobicContact CG-CB 4.1Å; E200-R260 HydrophobicContact CG-CG 4.17Å; E200-R260 WeakPolarHBondContact OE1-CB 3.44Å; E200-V261 CarbonylContact C-O 3.32Å; E200-V261 WeakPolarHBondContact CA-O 3.09Å; E200-V261 VanDerWaalsContact CG-N 3.33Å; E200-V261 PolarHBondContact OE1-N 3.21Å; E200-R262 HydrophobicContact CB-CG 4.03Å; E200-R262 HydrophobicContact CG-CG 4.01Å; E200-R262 WeakPolarHBondContact OE1-CG 3.5Å; E200-R262 IonicContact OE1-NE 3.45Å; E200-R262 IonicContact OE2-NE 2.66Å; E200-R262 PolarHBondContact OE2-NE 2.99Å
201	E	75.2	Confident	74.6	Confident	13 Å²	13	48.5 Å²	48.5	6%	0.061	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	138.6	174.3	-168.2	171.8	-158.8	0	0	109.5	R169 G170 F171 M199 F203 V261	R169-E201 IonicContact CZ-OE1 3.69Å; R169-E201 IonicContact NE-OE1 3.43Å; R169-E201 PolarHBondContact NE-OE1 3.34Å; R169-E201 IonicContact NH2-OE1 2.73Å; R169-E201 PolarHBondContact NH2-OE1 3.01Å; G170-E201 CarbonylContact O-C 3.32Å; G170-E201 WeakPolarHBondContact O-CA 3.44Å; F171-E201 HydrophobicContact CD1-CB 4.24Å; F171-E201 HydrophobicContact CE1-CB 4.22Å; F171-E201 HydrophobicContact CE1-CG 4.48Å; M199-E201 PolarHBondContact O-N 3.34Å; M199-E201 VanDerWaalsContact O-N 3.14Å; E201-F203 HydrophobicContact CB-CE2 4.43Å; E201-F203 VanDerWaalsContact CD-CE2 3.48Å; E201-F203 VanDerWaalsContact CD-CZ 3.48Å; E201-F203 HydrophobicContact CG-CD2 4.31Å; E201-F203 HydrophobicContact CG-CE2 3.6Å; E201-F203 HydrophobicContact CG-CZ 3.99Å; E201-F203 WeakPolarHBondContact OE1-CZ 3.38Å; E201-V261 HydrophobicContact CB-CB 4.21Å; E201-V261 PolarHBondContact N-O 2.89Å; E201-V261 WeakPolarHBondContact O-CA 3.44Å; E201-V261 WeakPolarHBondContact O-CB 3.4Å; E201-V261 WeakPolarHBondContact O-CG2 3.18Å; E201-V261 PolarHBondContact O-N 3.1Å
202	V	76.4	Confident	74.7	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.018	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.7	-176.1	174.4	0	0	0	0	109.1	R169 G170 L176 E200 I204 D258 I259 R260	R169-V202 VanDerWaalsContact CA-O 3.24Å; R169-V202 WeakPolarHBondContact CA-O 3.2Å; G170-V202 PolarHBondContact N-O 2.86Å; G170-V202 VanDerWaalsContact N-O 3.12Å; G170-V202 PolarHBondContact O-N 2.86Å; L176-V202 HydrophobicContact CD1-CG1 4.35Å; L176-V202 HydrophobicContact CD2-CB 4.21Å; L176-V202 HydrophobicContact CD2-CG1 4.33Å; E200-V202 HydrophobicContact CG-CG2 4.5Å; V202-I204 HydrophobicContact CG1-CD1 4.43Å; V202-I204 HydrophobicContact CG1-CG1 4.01Å; V202-D258 WeakPolarHBondContact CG1-OD1 3.32Å; V202-I259 WeakPolarHBondContact CA-O 3.45Å; V202-I259 WeakPolarHBondContact CG1-O 3.35Å; V202-R260 HydrophobicContact CG2-CG 4.2Å
203	F	79.8	Confident	75	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.7	171	-64.5	-92.4	0	0	0	109.1	I140 P148 V150 I167 F168 R169 Y188 A190 E201 L205 I259 V261	I140-F203 HydrophobicContact CD1-CD2 3.81Å; I140-F203 HydrophobicContact CD1-CE2 4.27Å; I140-F203 HydrophobicContact CD1-CG 4.45Å; P148-F203 HydrophobicContact CB-CZ 4.36Å; P148-F203 HydrophobicContact CG-CZ 3.94Å; V150-F203 HydrophobicContact CG2-CD1 3.99Å; V150-F203 HydrophobicContact CG2-CE1 3.65Å; V150-F203 HydrophobicContact CG2-CE2 4.38Å; V150-F203 HydrophobicContact CG2-CG 4.48Å; V150-F203 HydrophobicContact CG2-CZ 3.88Å; I167-F203 HydrophobicContact CG2-CD1 4.03Å; F168-F203 CarbonylContact O-C 3.59Å; F168-F203 WeakPolarHBondContact O-CA 3.26Å; R169-F203 HydrophobicContact CB-CD1 4.16Å; R169-F203 HydrophobicContact CB-CE1 4.25Å; R169-F203 HydrophobicContact CG-CD1 3.97Å; R169-F203 HydrophobicContact CG-CE1 3.63Å; R169-F203 HydrophobicContact CG-CZ 4.13Å; Y188-F203 HydrophobicContact CE1-CE1 4.44Å; A190-F203 HydrophobicContact CB-CE1 4.4Å; A190-F203 HydrophobicContact CB-CZ 4.44Å; E201-F203 HydrophobicContact CB-CE2 4.43Å; E201-F203 VanDerWaalsContact CD-CE2 3.48Å; E201-F203 VanDerWaalsContact CD-CZ 3.48Å; E201-F203 HydrophobicContact CG-CD2 4.31Å; E201-F203 HydrophobicContact CG-CE2 3.6Å; E201-F203 HydrophobicContact CG-CZ 3.99Å; E201-F203 WeakPolarHBondContact OE1-CZ 3.38Å; F203-L205 HydrophobicContact CB-CD1 3.84Å; F203-I259 HydrophobicContact CB-CB 4.29Å; F203-I259 HydrophobicContact CB-CD1 4.22Å; F203-I259 PolarHBondContact N-O 2.89Å; F203-I259 WeakPolarHBondContact O-CB 3.2Å; F203-I259 WeakPolarHBondContact O-CG1 3.39Å; F203-I259 PolarHBondContact O-N 2.88Å; F203-V261 HydrophobicContact CD2-CG2 4.45Å
204	I	79.9	Confident	75.4	Confident	4 Å²	4	45 Å²	45	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	117.1	171.8	-45.7	179.7	0	0	0	107.7	I167 F168 L176 V202 F206 L251 Q257	I167-I204 CarbonylContact C-O 3.56Å; I167-I204 WeakPolarHBondContact CA-O 3.43Å; F168-I204 HydrophobicContact CB-CB 4.1Å; F168-I204 HydrophobicContact CB-CG1 4.46Å; F168-I204 PolarHBondContact N-O 3.4Å; F168-I204 PolarHBondContact O-N 3.4Å; L176-I204 HydrophobicContact CD1-CD1 3.58Å; L176-I204 HydrophobicContact CD1-CG1 4.16Å; V202-I204 HydrophobicContact CG1-CD1 4.43Å; V202-I204 HydrophobicContact CG1-CG1 4.01Å; I204-F206 HydrophobicContact CB-CE2 4.19Å; I204-F206 HydrophobicContact CB-CZ 4.44Å; I204-F206 HydrophobicContact CG2-CD2 4.07Å; I204-F206 HydrophobicContact CG2-CE1 3.96Å; I204-F206 HydrophobicContact CG2-CE2 3.11Å; I204-F206 HydrophobicContact CG2-CZ 3.04Å; I204-L251 HydrophobicContact CD1-CD1 4.47Å; I204-Q257 WeakPolarHBondContact CD1-O 3.37Å; I204-Q257 VanDerWaalsContact CG1-O 3.31Å; I204-Q257 WeakPolarHBondContact CG1-O 3.36Å; I204-Q257 HydrophobicContact CG2-CB 4.33Å; I204-Q257 WeakPolarHBondContact CG2-O 3.46Å
205	L	84.8	Confident	75.5	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132	-173.9	-65.2	81	0	0	0	109.9	I135 V138 V150 W152 I166 I167 F203 I259	I135-L205 HydrophobicContact CD1-CB 3.66Å; I135-L205 HydrophobicContact CG2-CB 4.44Å; V138-L205 HydrophobicContact CG1-CD1 4.26Å; V138-L205 HydrophobicContact CG1-CD2 4.34Å; V138-L205 HydrophobicContact CG2-CD2 4.47Å; V150-L205 HydrophobicContact CG1-CD2 4.22Å; W152-L205 HydrophobicContact CB-CD2 4.26Å; W152-L205 HydrophobicContact CD2-CD2 3.89Å; W152-L205 HydrophobicContact CE3-CD2 3.72Å; W152-L205 HydrophobicContact CG-CD2 4.13Å; W152-L205 HydrophobicContact CZ3-CD2 4.4Å; I166-L205 WeakPolarHBondContact O-CA 3.46Å; I167-L205 HydrophobicContact CD1-CD2 4.02Å; I167-L205 HydrophobicContact CD1-CG 4.22Å; I167-L205 HydrophobicContact CG1-CD2 4.25Å; I167-L205 HydrophobicContact CG1-CG 3.99Å; I167-L205 HydrophobicContact CG2-CD1 4.48Å; I167-L205 HydrophobicContact CG2-CG 4.28Å; F203-L205 HydrophobicContact CB-CD1 3.84Å; L205-I259 HydrophobicContact CD1-CD1 3.76Å
206	F	82.8	Confident	75.2	Confident	11 Å²	11	37.7 Å²	37.7	5%	0.048	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	151	170.8	-50	-70.5	0	0	0	110.1	T165 I166 F168 I204 S214 P216 F256	T165-F206 CarbonylContact C-O 3.47Å; T165-F206 WeakPolarHBondContact CA-O 3.29Å; I166-F206 PolarHBondContact N-O 3.23Å; I166-F206 PolarHBondContact O-N 3.05Å; F168-F206 HydrophobicContact CD2-CD2 4.44Å; F168-F206 HydrophobicContact CD2-CE2 4.34Å; F168-F206 HydrophobicContact CE2-CD2 4.42Å; F168-F206 HydrophobicContact CE2-CE2 4.46Å; I204-F206 HydrophobicContact CB-CE2 4.19Å; I204-F206 HydrophobicContact CB-CZ 4.44Å; I204-F206 HydrophobicContact CG2-CD2 4.07Å; I204-F206 HydrophobicContact CG2-CE1 3.96Å; I204-F206 HydrophobicContact CG2-CE2 3.11Å; I204-F206 HydrophobicContact CG2-CZ 3.04Å; F206-S214 WeakPolarHBondContact CD1-O 3.4Å; F206-P216 HydrophobicContact CE1-CB 3.95Å; F206-P216 HydrophobicContact CE1-CG 3.77Å; F206-P216 HydrophobicContact CZ-CG 4.46Å; F206-F256 AromaticContact CE2-CD1 3.87Å; F206-F256 HydrophobicContact CE2-CD1 3.87Å; F206-F256 HydrophobicContact CE2-CE1 4.31Å; F206-F256 AromaticContact CZ-CD1 3.66Å; F206-F256 HydrophobicContact CZ-CD1 3.66Å; F206-F256 HydrophobicContact CZ-CE1 4.4Å
207	N	86.8	Confident	74.7	Confident	8 Å²	8	37.2 Å²	37.2	4%	0.043	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	145.7	162	-65.5	-45.6	0	0	0	109.6	V132 P133 I135 R154 S164 T165 F213 S214	V132-N207 HydrophobicContact CG1-CB 3.8Å; P133-N207 PolarHBondContact O-ND2 2.85Å; I135-N207 WeakPolarHBondContact CG1-ND2 3.38Å; R154-N207 PolarHBondContact NE-OD1 2.72Å; R154-N207 VanDerWaalsContact NE-OD1 3.08Å; S164-N207 CarbonylContact O-C 3.6Å; S164-N207 WeakPolarHBondContact O-CA 3.18Å; T165-N207 PolarHBondContact OG1-OD1 3.21Å; N207-F213 CarbonylContact O-C 3.59Å; N207-F213 VanDerWaalsContact O-CA 3.27Å; N207-F213 WeakPolarHBondContact O-CA 3.34Å; N207-S214 PolarHBondContact N-OG 3.3Å; N207-S214 PolarHBondContact O-N 2.7Å
208	E	85	Confident	73.9	Confident	54 Å²	54	35.4 Å²	35.4	25%	0.252	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.1	172.3	176.6	-173.1	-135.9	0	0	108.2	D163 S164 I166 L212 F213	D163-E208 WeakPolarHBondContact CA-O 2.8Å; D163-E208 WeakPolarHBondContact CB-O 3.25Å; S164-E208 PolarHBondContact N-O 3.47Å; S164-E208 PolarHBondContact O-N 3.04Å; S164-E208 WeakPolarHBondContact OG-CB 3.32Å; S164-E208 PolarHBondContact OG-OE2 2.82Å; I166-E208 HydrophobicContact CD1-CB 3.94Å; I166-E208 HydrophobicContact CD1-CG 4.36Å; I166-E208 HydrophobicContact CG1-CB 4.2Å; E208-L212 WeakPolarHBondContact CA-O 3.34Å; E208-F213 HydrophobicContact CB-CD1 3.88Å; E208-F213 HydrophobicContact CB-CE1 3.91Å; E208-F213 HydrophobicContact CG-CD1 4.05Å; E208-F213 HydrophobicContact CG-CE1 3.66Å; E208-F213 HydrophobicContact CG-CZ 4.44Å
209	H	85.3	Confident	72.6	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	118.8	175.7	170.5	65.1	0	0	0	108.4	K130 V132 D163 N211 L212	K130-H209 WeakPolarHBondContact CE-NE2 3.23Å; K130-H209 PolarHBondContact NZ-CE1 2.83Å; K130-H209 PolarHBondContact NZ-NE2 3.24Å; V132-H209 HydrophobicContact CG1-CB 3.94Å; V132-H209 HydrophobicContact CG2-CB 3.96Å; D163-H209 VanDerWaalsContact CG-ND1 3.32Å; D163-H209 IonicContact OD1-CE1 3.53Å; D163-H209 IonicContact OD1-CG 3.55Å; D163-H209 IonicContact OD1-ND1 3.81Å; D163-H209 PolarHBondContact OD1-ND1 3.13Å; D163-H209 IonicContact OD2-CG 2.71Å; D163-H209 IonicContact OD2-ND1 2.68Å; D163-H209 PolarHBondContact OD2-ND1 3.4Å; H209-N211 PolarHBondContact O-N 2.88Å; H209-N211 VanDerWaalsContact O-N 3.13Å; H209-L212 PolarHBondContact N-O 2.84Å; H209-L212 WeakPolarHBondContact O-CA 3.36Å; H209-L212 WeakPolarHBondContact O-CB 3.49Å; H209-L212 PolarHBondContact O-N 3.38Å
210	E	82.6	Confident	71.2	Confident	120 Å²	120	36.1 Å²	36.1	56%	0.561	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	-113.4	-172.6	-60.7	173.1	-155.7	0	0	111.8	K130	K130-E210 IonicContact NZ-OE1 2.89Å
211	N	76.2	Confident	69.6	Low	124 Å²	124	40.7 Å²	40.7	66%	0.663	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	12.4	176.3	67.5	-55	0	0	0	113.1	H209	H209-N211 PolarHBondContact O-N 2.88Å; H209-N211 VanDerWaalsContact O-N 3.13Å
212	L	79.7	Confident	67.6	Low	24 Å²	24	44 Å²	44	13%	0.126	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	149.7	-175.5	-60.1	173.3	0	0	0	110.7	K130 V132 E208 H209	K130-L212 HydrophobicContact CB-CD1 4.26Å; V132-L212 HydrophobicContact CG2-CB 3.59Å; E208-L212 WeakPolarHBondContact CA-O 3.34Å; H209-L212 PolarHBondContact N-O 2.84Å; H209-L212 WeakPolarHBondContact O-CA 3.36Å; H209-L212 WeakPolarHBondContact O-CB 3.49Å; H209-L212 PolarHBondContact O-N 3.38Å
213	F	78.8	Confident	65.3	Low	107 Å²	107	49.6 Å²	49.6	47%	0.469	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	144.9	172	-56.4	-81.3	0	0	0	109.6	I166 N207 E208 L215	I166-F213 HydrophobicContact CD1-CD1 4.08Å; I166-F213 HydrophobicContact CD1-CE1 3.54Å; N207-F213 CarbonylContact O-C 3.59Å; N207-F213 VanDerWaalsContact O-CA 3.27Å; N207-F213 WeakPolarHBondContact O-CA 3.34Å; E208-F213 HydrophobicContact CB-CD1 3.88Å; E208-F213 HydrophobicContact CB-CE1 3.91Å; E208-F213 HydrophobicContact CG-CD1 4.05Å; E208-F213 HydrophobicContact CG-CE1 3.66Å; E208-F213 HydrophobicContact CG-CZ 4.44Å; F213-L215 PolarHBondContact O-N 3.48Å
214	S	76.3	Confident	62.7	Low	3 Å²	3	51.4 Å²	51.4	2%	0.021	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-64.8	132.4	168.2	69.8	0	0	0	0	108.9	P133 F206 N207	P133-S214 WeakPolarHBondContact O-CB 3.5Å; F206-S214 WeakPolarHBondContact CD1-O 3.4Å; N207-S214 PolarHBondContact N-OG 3.3Å; N207-S214 PolarHBondContact O-N 2.7Å
215	L	68.5	Low	60.1	Low	25 Å²	25	56.4 Å²	56.4	13%	0.131	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-78.7	147.2	174.4	-74	-176.4	0	0	0	112.3	L33 E52 F213 I255	L33-L215 HydrophobicContact CD1-CD1 3.25Å; L33-L215 HydrophobicContact CD2-CD1 3.47Å; L33-L215 VanDerWaalsContact CD2-CD1 3.47Å; L33-L215 HydrophobicContact CD2-CD2 3.64Å; L33-L215 HydrophobicContact CD2-CG 3.95Å; L33-L215 HydrophobicContact CG-CD1 3.94Å; E52-L215 HydrophobicContact CB-CD1 3.47Å; E52-L215 VanDerWaalsContact CB-CD1 3.47Å; F213-L215 PolarHBondContact O-N 3.48Å; L215-I255 HydrophobicContact CD2-CG2 4.18Å
216	P	57.6	Low	57.4	Low	18 Å²	18	60.2 Å²	60.2	12%	0.117	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-66.5	133.9	167.2	25.8	-26.7	0	0	0	110.5	F206 I255 Q257	F206-P216 HydrophobicContact CE1-CB 3.95Å; F206-P216 HydrophobicContact CE1-CG 3.77Å; F206-P216 HydrophobicContact CZ-CG 4.46Å; P216-I255 VanDerWaalsContact CD-O 3.27Å; P216-I255 WeakPolarHBondContact CD-O 3.46Å; P216-I255 WeakPolarHBondContact CG-O 3.23Å; P216-Q257 VanDerWaalsContact CA-NE2 3.27Å; P216-Q257 HydrophobicContact CB-CB 3.53Å; P216-Q257 HydrophobicContact CB-CG 3.21Å; P216-Q257 VanDerWaalsContact CB-NE2 3.34Å; P216-Q257 HydrophobicContact CG-CB 4.36Å; P216-Q257 HydrophobicContact CG-CG 4.42Å
217	T	51.7	Low	54.7	Low	13 Å²	13	64.5 Å²	64.5	8%	0.08	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-75.4	129.9	165.5	41.9	0	0	0	0	109.8	G219 N220 Q257	T217-G219 PolarHBondContact O-N 3.28Å; T217-N220 PolarHBondContact O-N 3.14Å; T217-Q257 PolarHBondContact O-NE2 3.34Å
218	M	44.2	Very low	52.1	Low	105 Å²	105	72 Å²	72	52%	0.517	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	99.2	165.6	-82.3	-173.3	172.3	0	0	108.2	I16 N254	I16-M218 HydrophobicContact CD1-CE 4.44Å; M218-N254 HydrophobicContact CE-CB 4.45Å
219	G	36.7	Very low	49.2	Very low	64 Å²	64	78.2 Å²	78.2	66%	0.66	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	156.8	-32	-178.9	0	0	0	0	0	114	T217 I221	T217-G219 PolarHBondContact O-N 3.28Å; G219-I221 VanDerWaalsContact C-N 3.31Å; G219-I221 PolarHBondContact O-N 3.15Å
220	N	37.6	Very low	46.3	Very low	53 Å²	53	80.5 Å²	80.5	28%	0.283	45%	0.448	S	S	.	.			trans	-93.5	45.1	-178.2	-68.6	-8.2	0	0	0	112.7	T217 F222	T217-N220 PolarHBondContact O-N 3.14Å; N220-F222 HydrophobicContact CB-CE2 4.09Å; N220-F222 PolarHBondContact O-N 3.26Å
221	I	35	Very low	43.4	Very low	103 Å²	103	82.8 Å²	82.8	53%	0.528	46%	0.456	S	S	.	.			trans	-85.6	95.9	171.6	-60.6	172.6	0	0	0	107.5	G219	G219-I221 VanDerWaalsContact C-N 3.31Å; G219-I221 PolarHBondContact O-N 3.15Å
222	F	32.8	Very low	40.8	Very low	84 Å²	84	85.4 Å²	85.4	37%	0.368	46%	0.462	S	S	.	.			trans	-83.5	120.2	172.5	-66.3	-82	0	0	0	109.7	N220 I259	N220-F222 HydrophobicContact CB-CE2 4.09Å; N220-F222 PolarHBondContact O-N 3.26Å; F222-I259 WeakPolarHBondContact O-CG2 3.44Å
223	H	28.6	Very low	37.9	Very low	119 Å²	119	88.2 Å²	88.2	55%	0.551	48%	0.483	S	S	*	.	B	Isolated β-bridge	trans	-97.7	106.3	164.1	-90.4	-75.8	0	0	0	108	R260	H223-R260 WeakPolarHBondContact CE1-CB 3.45Å; H223-R260 PolarHBondContact ND1-O 3.31Å; H223-R260 VanDerWaalsContact ND1-O 3.09Å
224	V	26.7	Very low	35	Very low	39 Å²	39	92.8 Å²	92.8	24%	0.236	50%	0.497	C	S	.	.			trans	-89.4	115.4	171.3	179	0	0	0	0	108	I140 V261	I140-V224 HydrophobicContact CB-CG2 4.23Å; V224-V261 HydrophobicContact CB-CG1 4.28Å; V224-V261 HydrophobicContact CB-CG2 4.33Å; V224-V261 WeakPolarHBondContact O-CA 3.49Å
225	S	24	Very low	32.2	Very low	108 Å²	108	99.8 Å²	99.8	76%	0.755	53%	0.529	S	S	*	.			trans	-108.9	123.3	175.2	40.5	0	0	0	0	109.1
226	Y	29.4	Very low	29.9	Very low	81 Å²	81	105.3 Å²	105.3	32%	0.318	56%	0.564	S	S	.	*			trans	-80.2	139.3	-169.1	-67.4	-73.2	0	0	0	114	L142 V261	L142-Y226 HydrophobicContact CB-CE1 4.43Å; L142-Y226 HydrophobicContact CD1-CE1 4Å; L142-Y226 HydrophobicContact CD2-CD1 4.29Å; L142-Y226 HydrophobicContact CD2-CE1 4.33Å; Y226-V261 HydrophobicContact CD2-CG1 3.98Å; Y226-V261 HydrophobicContact CE1-CG1 4.32Å; Y226-V261 HydrophobicContact CE2-CB 4.41Å; Y226-V261 HydrophobicContact CE2-CG1 3.03Å; Y226-V261 WeakPolarHBondContact OH-CG1 3.37Å
227	A	24.7	Very low	28.1	Very low	101 Å²	101	110.7 Å²	110.7	84%	0.835	60%	0.6	S	S	*	*			trans	-127.5	95.7	160.5	0	0	0	0	0	111.3
228	L	31.8	Very low	26.5	Very low	166 Å²	166	113.8 Å²	113.8	87%	0.869	64%	0.635	S	S	*	*			trans	40	122.3	150.5	-81.4	155.4	0	0	0	123.6
229	K	25.5	Very low	25.5	Very low	185 Å²	185	114.1 Å²	114.1	80%	0.804	65%	0.648	S	S	*	*				-173.6	122.7	102.7	-106.3	-177.1	179.8	178.2	0	113.6
230	G	23.8	Very low	24.8	Very low	49 Å²	49	116.7 Å²	116.7	51%	0.505	66%	0.655	S	S	.	*			trans	90.7	93.7	133.3	0	0	0	0	0	123.1
231	F	21.9	Very low	24.3	Very low	167 Å²	167	122.2 Å²	122.2	73%	0.732	68%	0.677	S	S	*	*				59.6	133.1	129.9	-93	-82.4	0	0	0	126
232	F	22.2	Very low	23.6	Very low	179 Å²	179	126.9 Å²	126.9	79%	0.785	70%	0.699	S	S	*	*			trans	76.7	147.3	159.1	-67.7	-72.4	0	0	0	117.3
233	S	18.6	Very low	23.2	Very low	83 Å²	83	126.2 Å²	126.2	58%	0.58	70%	0.704	S	S	*	*			cis	170.6	142.6	-7.6	143.4	0	0	0	0	108.4
234	R	17.7	Very low	23	Very low	204 Å²	204	125.2 Å²	125.2	77%	0.77	71%	0.706	S	S	*	*			trans	74.8	117.2	151	-80.8	178	177.6	-168.6	1.7	120.7	E194	E194-R234 WeakPolarHBondContact OE1-CA 3.29Å; E194-R234 PolarHBondContact OE1-N 3.1Å; E194-R234 VanDerWaalsContact OE1-N 3.16Å
235	H	18.4	Very low	22.8	Very low	149 Å²	149	127 Å²	127	69%	0.69	72%	0.719	S	S	*	*				49.2	130.5	129.6	-70.5	-53.3	0	0	0	119.1	E194	E194-H235 PolarHBondContact OE1-N 3.05Å
236	V	18.3	Very low	23	Very low	142 Å²	142	124.9 Å²	124.9	86%	0.861	70%	0.699	S	S	*	*				172.9	136.4	113.7	155.8	0	0	0	0	110.7
237	C	20.1	Very low	22.8	Very low	130 Å²	130	123.1 Å²	123.1	88%	0.878	70%	0.699	S	S	*	*			trans	-68.1	148.7	166.7	-76.8	0	0	0	0	112.8
238	G	19.3	Very low	22.9	Very low	78 Å²	78	119.5 Å²	119.5	80%	0.804	67%	0.666	S	S	*	*			trans	145.4	111.5	147.1	0	0	0	0	0	115
239	S	22.3	Very low	22.8	Very low	113 Å²	113	116.9 Å²	116.9	79%	0.79	65%	0.654	S	S	*	*			trans	168.8	133.8	133.4	176.3	0	0	0	0	109.6	K241	S239-K241 PolarHBondContact O-N 3Å; S239-K241 VanDerWaalsContact O-N 3.13Å
240	S	21.8	Very low	22.8	Very low	117 Å²	117	114.7 Å²	114.7	82%	0.818	65%	0.651	S	S	*	*			trans	-67.3	99	177.3	55.2	0	0	0	0	111.6
241	K	26.6	Very low	23.2	Very low	170 Å²	170	113.6 Å²	113.6	74%	0.739	63%	0.633	S	S	*	*			trans	-121.9	136.3	146.6	-80.2	-173.7	174.6	-177.7	0	107.1	S239 C243	S239-K241 PolarHBondContact O-N 3Å; S239-K241 VanDerWaalsContact O-N 3.13Å; K241-C243 PolarHBondContact O-N 3.21Å; K241-C243 PolarHBondContact O-SG 3.07Å
242	M	21.4	Very low	23.5	Very low	200 Å²	200	114.7 Å²	114.7	99%	0.985	64%	0.637	S	S	*	*			trans	-55.8	105.4	177.7	-81.7	-179.3	169.2	0	0	108.7
243	C	24.6	Very low	24	Very low	70 Å²	70	107 Å²	107	47%	0.473	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-101.5	118.8	177.1	-67.3	0	0	0	0	108.4	K241	K241-C243 PolarHBondContact O-N 3.21Å; K241-C243 PolarHBondContact O-SG 3.07Å
244	T	23.9	Very low	24.7	Very low	98 Å²	98	107.5 Å²	107.5	60%	0.601	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-93.2	133.1	165.3	-53	0	0	0	0	108.4
245	C	23.6	Very low	25.4	Very low	76 Å²	76	99.9 Å²	99.9	51%	0.514	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.9	132.4	-177.5	-67.8	0	0	0	0	110.3	H175	H175-C245 HydrophobicContact CB-CB 4.04Å
246	L	26.6	Very low	25.9	Very low	64 Å²	64	96.7 Å²	96.7	34%	0.335	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.6	138.5	171.9	-152.9	90.4	0	0	0	110	F168 H175 L176 L251	F168-L246 HydrophobicContact CD1-CB 4.34Å; F168-L246 HydrophobicContact CE1-CB 4.11Å; H175-L246 VanDerWaalsContact CA-O 3.29Å; H175-L246 WeakPolarHBondContact CA-O 3.2Å; H175-L246 PolarHBondContact ND1-O 3.38Å; L176-L246 PolarHBondContact N-O 2.83Å; L176-L246 PolarHBondContact O-N 2.79Å; L246-L251 HydrophobicContact CD2-CD1 3.5Å; L246-L251 VanDerWaalsContact CD2-CD1 3.5Å; L246-L251 HydrophobicContact CD2-CD2 3.71Å; L246-L251 HydrophobicContact CD2-CG 3.75Å
247	S	25.1	Very low	26.8	Very low	45 Å²	45	90.6 Å²	90.6	32%	0.315	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	125.5	176	-174.4	0	0	0	0	111.3	D249	S247-D249 VanDerWaalsContact C-N 3.34Å; S247-D249 PolarHBondContact O-N 3.28Å
248	V	28.2	Very low	27.3	Very low	24 Å²	24	86.3 Å²	86.3	15%	0.145	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-72.7	-23.5	-178.1	-177.9	0	0	0	0	113	Q174 L176 N250 L251	Q174-V248 WeakPolarHBondContact O-CG2 3.44Å; L176-V248 HydrophobicContact CD1-CG2 3.84Å; L176-V248 HydrophobicContact CD2-CG2 3.94Å; L176-V248 HydrophobicContact CG-CG2 3.61Å; V248-N250 PolarHBondContact O-N 3.03Å; V248-N250 VanDerWaalsContact O-N 3.15Å; V248-L251 HydrophobicContact CB-CD1 4.26Å; V248-L251 HydrophobicContact CG1-CD1 4.45Å; V248-L251 HydrophobicContact CG2-CD1 4.03Å; V248-L251 WeakPolarHBondContact O-CB 3.15Å; V248-L251 PolarHBondContact O-N 3.21Å
249	D	29.4	Very low	28	Very low	112 Å²	112	82.7 Å²	82.7	60%	0.599	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-66.5	-20.3	-178.7	-72.1	-29.9	0	0	0	113.2	S247	S247-D249 VanDerWaalsContact C-N 3.34Å; S247-D249 PolarHBondContact O-N 3.28Å
250	N	25.9	Very low	28.2	Very low	139 Å²	139	81.8 Å²	81.8	74%	0.743	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-98.5	-3.3	173.4	-73.4	-20.2	0	0	0	113.9	V248 K252	V248-N250 PolarHBondContact O-N 3.03Å; V248-N250 VanDerWaalsContact O-N 3.15Å; N250-K252 VanDerWaalsContact C-N 3.26Å; N250-K252 PolarHBondContact O-N 3.35Å
251	L	31.9	Very low	28.6	Very low	26 Å²	26	76.2 Å²	76.2	14%	0.136	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	2.9	179.9	-85.7	164.4	0	0	0	113.8	L176 I204 L246 V248 S253 F256	L176-L251 HydrophobicContact CD1-CD1 4.43Å; I204-L251 HydrophobicContact CD1-CD1 4.47Å; L246-L251 HydrophobicContact CD2-CD1 3.5Å; L246-L251 VanDerWaalsContact CD2-CD1 3.5Å; L246-L251 HydrophobicContact CD2-CD2 3.71Å; L246-L251 HydrophobicContact CD2-CG 3.75Å; V248-L251 HydrophobicContact CB-CD1 4.26Å; V248-L251 HydrophobicContact CG1-CD1 4.45Å; V248-L251 HydrophobicContact CG2-CD1 4.03Å; V248-L251 WeakPolarHBondContact O-CB 3.15Å; V248-L251 PolarHBondContact O-N 3.21Å; L251-S253 PolarHBondContact O-N 2.99Å; L251-S253 VanDerWaalsContact O-O 3.1Å; L251-F256 HydrophobicContact CD2-CB 3.96Å; L251-F256 HydrophobicContact CD2-CD1 3.75Å; L251-F256 HydrophobicContact CD2-CD2 3.09Å; L251-F256 HydrophobicContact CD2-CE1 4.01Å; L251-F256 HydrophobicContact CD2-CE2 3.36Å; L251-F256 HydrophobicContact CD2-CG 3.3Å; L251-F256 HydrophobicContact CD2-CZ 3.82Å; L251-F256 HydrophobicContact CG-CD2 4.49Å
252	K	27.9	Very low	28.5	Very low	189 Å²	189	75.4 Å²	75.4	82%	0.822	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	1.9	173.1	-78.4	-174.9	177.7	176.9	0	114.1	N250	N250-K252 VanDerWaalsContact C-N 3.26Å; N250-K252 PolarHBondContact O-N 3.35Å
253	S	32.4	Very low	28.7	Very low	19 Å²	19	67.2 Å²	67.2	13%	0.133	35%	0.348	C	S	.	.	S	Bend	trans	-75.6	132.2	165.7	66.5	0	0	0	0	109	L251 I255	L251-S253 PolarHBondContact O-N 2.99Å; L251-S253 VanDerWaalsContact O-O 3.1Å; S253-I255 PolarHBondContact O-N 2.78Å
254	N	32.3	Very low	28.8	Very low	93 Å²	93	71.1 Å²	71.1	50%	0.497	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	41	-170.7	-70.8	-46.4	0	0	0	115.7	I16 M218	I16-N254 WeakPolarHBondContact CG2-ND2 3.44Å; M218-N254 HydrophobicContact CE-CB 4.45Å
255	I	32.8	Very low	28.8	Very low	44 Å²	44	69.5 Å²	69.5	23%	0.226	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-12.4	-176.4	-60.4	177.9	0	0	0	111.8	P20 A31 L215 P216 S253	P20-I255 HydrophobicContact CB-CD1 3.81Å; P20-I255 HydrophobicContact CB-CG1 4.38Å; A31-I255 HydrophobicContact CB-CD1 4.36Å; L215-I255 HydrophobicContact CD2-CG2 4.18Å; P216-I255 VanDerWaalsContact CD-O 3.27Å; P216-I255 WeakPolarHBondContact CD-O 3.46Å; P216-I255 WeakPolarHBondContact CG-O 3.23Å; S253-I255 PolarHBondContact O-N 2.78Å
256	F	29.1	Very low	29.3	Very low	82 Å²	82	72.6 Å²	72.6	36%	0.36	36%	0.361	S	S	.	.			trans	-118	134.6	-169.2	-62	-87.4	0	0	0	113.4	F206 L251	F206-F256 AromaticContact CE2-CD1 3.87Å; F206-F256 HydrophobicContact CE2-CD1 3.87Å; F206-F256 HydrophobicContact CE2-CE1 4.31Å; F206-F256 AromaticContact CZ-CD1 3.66Å; F206-F256 HydrophobicContact CZ-CD1 3.66Å; F206-F256 HydrophobicContact CZ-CE1 4.4Å; L251-F256 HydrophobicContact CD2-CB 3.96Å; L251-F256 HydrophobicContact CD2-CD1 3.75Å; L251-F256 HydrophobicContact CD2-CD2 3.09Å; L251-F256 HydrophobicContact CD2-CE1 4.01Å; L251-F256 HydrophobicContact CD2-CE2 3.36Å; L251-F256 HydrophobicContact CD2-CG 3.3Å; L251-F256 HydrophobicContact CD2-CZ 3.82Å; L251-F256 HydrophobicContact CG-CD2 4.49Å
257	Q	36.6	Very low	30.2	Very low	14 Å²	14	78.7 Å²	78.7	7%	0.065	40%	0.404	C	S	.	.			trans	-63.2	137.3	159.1	-103.8	153.8	18.9	0	0	107.4	I204 P216 T217	I204-Q257 WeakPolarHBondContact CD1-O 3.37Å; I204-Q257 VanDerWaalsContact CG1-O 3.31Å; I204-Q257 WeakPolarHBondContact CG1-O 3.36Å; I204-Q257 HydrophobicContact CG2-CB 4.33Å; I204-Q257 WeakPolarHBondContact CG2-O 3.46Å; P216-Q257 VanDerWaalsContact CA-NE2 3.27Å; P216-Q257 HydrophobicContact CB-CB 3.53Å; P216-Q257 HydrophobicContact CB-CG 3.21Å; P216-Q257 VanDerWaalsContact CB-NE2 3.34Å; P216-Q257 HydrophobicContact CG-CB 4.36Å; P216-Q257 HydrophobicContact CG-CG 4.42Å; T217-Q257 PolarHBondContact O-NE2 3.34Å
258	D	31.8	Very low	30.4	Very low	39 Å²	39	80.4 Å²	80.4	21%	0.209	41%	0.409	C	S	.	.			trans	-126.8	96.9	176.5	-172.1	1.7	0	0	0	105.5	V202 R260	V202-D258 WeakPolarHBondContact CG1-OD1 3.32Å; D258-R260 WeakPolarHBondContact OD1-CG 3.39Å; D258-R260 IonicContact OD1-NE 3.57Å; D258-R260 IonicContact OD2-CZ 3.93Å; D258-R260 IonicContact OD2-NE 3.94Å; D258-R260 PolarHBondContact OD2-NE 3.18Å; D258-R260 IonicContact OD2-NH2 3.12Å; D258-R260 PolarHBondContact OD2-NH2 3.14Å
259	I	33.1	Very low	30.5	Very low	2 Å²	2	83.3 Å²	83.3	1%	0.01	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	122.8	172	-58.7	170.2	0	0	0	106	V138 I140 V202 F203 L205 F222 V261	V138-I259 HydrophobicContact CG1-CD1 3.98Å; I140-I259 HydrophobicContact CD1-CG2 3.77Å; V202-I259 WeakPolarHBondContact CA-O 3.45Å; V202-I259 WeakPolarHBondContact CG1-O 3.35Å; F203-I259 HydrophobicContact CB-CB 4.29Å; F203-I259 HydrophobicContact CB-CD1 4.22Å; F203-I259 PolarHBondContact N-O 2.89Å; F203-I259 WeakPolarHBondContact O-CB 3.2Å; F203-I259 WeakPolarHBondContact O-CG1 3.39Å; F203-I259 PolarHBondContact O-N 2.88Å; L205-I259 HydrophobicContact CD1-CD1 3.76Å; F222-I259 WeakPolarHBondContact O-CG2 3.44Å; I259-V261 HydrophobicContact CG2-CG2 4.21Å
260	R	27.8	Very low	30.6	Very low	95 Å²	95	81.7 Å²	81.7	36%	0.358	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	114.7	-168.8	-95.7	-164.9	-158.1	-159.6	9.2	110.2	E200 V202 H223 D258	E200-R260 HydrophobicContact CG-CB 4.1Å; E200-R260 HydrophobicContact CG-CG 4.17Å; E200-R260 WeakPolarHBondContact OE1-CB 3.44Å; V202-R260 HydrophobicContact CG2-CG 4.2Å; H223-R260 WeakPolarHBondContact CE1-CB 3.45Å; H223-R260 PolarHBondContact ND1-O 3.31Å; H223-R260 VanDerWaalsContact ND1-O 3.09Å; D258-R260 WeakPolarHBondContact OD1-CG 3.39Å; D258-R260 IonicContact OD1-NE 3.57Å; D258-R260 IonicContact OD2-CZ 3.93Å; D258-R260 IonicContact OD2-NE 3.94Å; D258-R260 PolarHBondContact OD2-NE 3.18Å; D258-R260 IonicContact OD2-NH2 3.12Å; D258-R260 PolarHBondContact OD2-NH2 3.14Å
261	V	28.9	Very low	30.9	Very low	0 Å²	0	78.4 Å²	78.4	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	94.6	-172.5	-173.3	0	0	0	0	112.1	I140 E200 E201 F203 V224 Y226 I259 P263	I140-V261 HydrophobicContact CD1-CG2 4.18Å; E200-V261 CarbonylContact C-O 3.32Å; E200-V261 WeakPolarHBondContact CA-O 3.09Å; E200-V261 VanDerWaalsContact CG-N 3.33Å; E200-V261 PolarHBondContact OE1-N 3.21Å; E201-V261 HydrophobicContact CB-CB 4.21Å; E201-V261 PolarHBondContact N-O 2.89Å; E201-V261 WeakPolarHBondContact O-CA 3.44Å; E201-V261 WeakPolarHBondContact O-CB 3.4Å; E201-V261 WeakPolarHBondContact O-CG2 3.18Å; E201-V261 PolarHBondContact O-N 3.1Å; F203-V261 HydrophobicContact CD2-CG2 4.45Å; V224-V261 HydrophobicContact CB-CG1 4.28Å; V224-V261 HydrophobicContact CB-CG2 4.33Å; V224-V261 WeakPolarHBondContact O-CA 3.49Å; Y226-V261 HydrophobicContact CD2-CG1 3.98Å; Y226-V261 HydrophobicContact CE1-CG1 4.32Å; Y226-V261 HydrophobicContact CE2-CB 4.41Å; Y226-V261 HydrophobicContact CE2-CG1 3.03Å; Y226-V261 WeakPolarHBondContact OH-CG1 3.37Å; I259-V261 HydrophobicContact CG2-CG2 4.21Å; V261-P263 WeakPolarHBondContact O-CD 3.42Å
262	R	24.3	Very low	30.8	Very low	152 Å²	152	81.6 Å²	81.6	57%	0.574	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-79.9	123.4	179	-62.1	-158.3	-178.2	-178.6	7.7	113.7	E200	E200-R262 HydrophobicContact CB-CG 4.03Å; E200-R262 HydrophobicContact CG-CG 4.01Å; E200-R262 WeakPolarHBondContact OE1-CG 3.5Å; E200-R262 IonicContact OE1-NE 3.45Å; E200-R262 IonicContact OE2-NE 2.66Å; E200-R262 PolarHBondContact OE2-NE 2.99Å
263	P	25.5	Very low	31	Very low	29 Å²	29	74.5 Å²	74.5	19%	0.188	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-84.5	116.1	156.1	24.8	-14.9	0	0	0	108.8	G198 M199 V261	G198-P263 CarbonylContact C-O 3.57Å; G198-P263 WeakPolarHBondContact CA-O 3.35Å; M199-P263 WeakPolarHBondContact O-CD 3.43Å; M199-P263 WeakPolarHBondContact O-CG 3.28Å; V261-P263 WeakPolarHBondContact O-CD 3.42Å
264	N	26.7	Very low	30.9	Very low	151 Å²	151	78.4 Å²	78.4	81%	0.807	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-80.5	146.9	167.5	-86.2	-23.4	0	0	0	110.4
265	L	25.7	Very low	30.8	Very low	64 Å²	64	77.3 Å²	77.3	34%	0.335	39%	0.392	S	S	.	.			trans	-120.7	161.1	-177.9	-55.2	176.2	0	0	0	113.2	E197 G198	E197-L265 VanDerWaalsContact CA-CD2 3.45Å; E197-L265 HydrophobicContact CB-CD1 3.24Å; E197-L265 HydrophobicContact CB-CD2 3.49Å; E197-L265 VanDerWaalsContact CB-CD2 3.49Å; E197-L265 HydrophobicContact CB-CG 3.77Å; E197-L265 VanDerWaalsContact CD-CD1 3.42Å; E197-L265 VanDerWaalsContact CD-CD2 3.41Å; E197-L265 HydrophobicContact CG-CD1 3.65Å; E197-L265 HydrophobicContact CG-CD2 3.13Å; E197-L265 HydrophobicContact CG-CG 3.8Å; E197-L265 VanDerWaalsContact OE1-CD2 3.27Å; E197-L265 WeakPolarHBondContact OE1-CD2 3.44Å; G198-L265 VanDerWaalsContact N-CD1 3.25Å; G198-L265 VanDerWaalsContact N-CD2 3.25Å
266	I	33.5	Very low	30.6	Very low	141 Å²	141	80.1 Å²	80.1	72%	0.723	41%	0.406	S	S	*	.			trans	91	143.1	158	-50.6	159.2	0	0	0	114.8
267	P	44.2	Very low	30.7	Very low	192 Å²	192	79.9 Å²	79.9	100%	1.247	41%	0.411	S	S	*	.			cis	-113	0	-33.4	28.6	-11.8	0	0	0	113

Retrieved 267 of 267 residues in 472.8 ms (Link to these results)

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