A0A077YW79_TRITR Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A077YW79, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 632 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	41.4	Very low	47.2	Very low	168 Å²	168	98.2 Å²	98.2	83%	0.828	48%	0.482	S	S	*	.				0	142.7	0	-81.5	160.8	73.3	0	0	109.1	D5 I9	M1-D5 HydrophobicContact CB-CB 4.24Å; M1-D5 HydrophobicContact CE-CB 4.08Å; M1-D5 HydrophobicContact CG-CB 4.47Å; M1-I9 HydrophobicContact CE-CD1 3.34Å
2	K	56.5	Low	46.6	Very low	162 Å²	162	94.7 Å²	94.7	70%	0.704	47%	0.474	S	S	*	.			trans	-79.6	154	177.6	-67.8	177.1	179.2	176.8	0	108.7	K4 D5 L6	K2-K4 PolarHBondContact O-N 3.48Å; K2-D5 PolarHBondContact N-OD2 3.39Å; K2-D5 WeakPolarHBondContact O-CA 3.35Å; K2-D5 WeakPolarHBondContact O-CB 3.49Å; K2-D5 PolarHBondContact O-N 3.17Å; K2-L6 PolarHBondContact O-N 3.44Å
3	L	55.9	Low	46	Very low	96 Å²	96	90.7 Å²	90.7	50%	0.503	46%	0.455	S	S	.	.	H	α-helix	trans	-50.7	-33.2	179.5	-174.6	70.5	0	0	0	113.1	D5 L6 L7 L591	L3-D5 PolarHBondContact O-N 3.09Å; L3-L6 PolarHBondContact O-N 3.26Å; L3-L7 WeakPolarHBondContact O-CB 3.43Å; L3-L7 PolarHBondContact O-N 3.48Å; L3-L591 HydrophobicContact CD2-CD1 3.73Å; L3-L591 HydrophobicContact CD2-CD2 4.04Å; L3-L591 HydrophobicContact CD2-CG 3.86Å
4	K	54.4	Low	45.4	Very low	149 Å²	149	91.4 Å²	91.4	65%	0.648	46%	0.456	S	S	*	.	H	α-helix	trans	-55.8	-43.6	170.6	150.1	-179.8	165.7	175	0	113.2	K2 L7 F8	K2-K4 PolarHBondContact O-N 3.48Å; K4-L7 PolarHBondContact O-N 2.76Å; K4-F8 PolarHBondContact O-N 3.31Å
5	D	45.7	Very low	44.8	Very low	59 Å²	59	89.3 Å²	89.3	32%	0.316	45%	0.446	S	S	.	.	H	α-helix	trans	-72	-37.9	-174.4	-51	-37.5	0	0	0	110	M1 K2 L3 F8 I9	M1-D5 HydrophobicContact CB-CB 4.24Å; M1-D5 HydrophobicContact CE-CB 4.08Å; M1-D5 HydrophobicContact CG-CB 4.47Å; K2-D5 PolarHBondContact N-OD2 3.39Å; K2-D5 WeakPolarHBondContact O-CA 3.35Å; K2-D5 WeakPolarHBondContact O-CB 3.49Å; K2-D5 PolarHBondContact O-N 3.17Å; L3-D5 PolarHBondContact O-N 3.09Å; D5-F8 PolarHBondContact O-N 3.13Å; D5-I9 WeakPolarHBondContact O-CG1 3.35Å; D5-I9 PolarHBondContact O-N 3.19Å
6	L	43	Very low	44.2	Very low	72 Å²	72	90.9 Å²	90.9	38%	0.377	46%	0.455	S	S	.	.	H	α-helix	trans	-63.8	-43.3	171.1	-84.1	153.7	0	0	0	112.1	K2 L3 F8 I9 S10 E149	K2-L6 PolarHBondContact O-N 3.44Å; L3-L6 PolarHBondContact O-N 3.26Å; L6-F8 VanDerWaalsContact C-N 3.31Å; L6-F8 PolarHBondContact O-N 3.05Å; L6-I9 PolarHBondContact O-N 3.49Å; L6-S10 PolarHBondContact O-N 3.43Å; L6-E149 VanDerWaalsContact CD2-OE2 3.31Å; L6-E149 WeakPolarHBondContact CD2-OE2 3.48Å
7	L	46.8	Very low	43.7	Very low	30 Å²	30	89.9 Å²	89.9	16%	0.157	45%	0.451	C	S	.	.	H	α-helix	trans	-64.1	-37.6	178.6	-138.5	111.6	0	0	0	111.8	L3 K4 S10 I11 L591 L594 L598	L3-L7 WeakPolarHBondContact O-CB 3.43Å; L3-L7 PolarHBondContact O-N 3.48Å; K4-L7 PolarHBondContact O-N 2.76Å; L7-S10 PolarHBondContact O-N 3.47Å; L7-I11 HydrophobicContact CD2-CD1 3.78Å; L7-I11 WeakPolarHBondContact O-CB 3.33Å; L7-I11 VanDerWaalsContact O-CG1 3.24Å; L7-I11 WeakPolarHBondContact O-CG1 3.42Å; L7-I11 PolarHBondContact O-N 3.21Å; L7-L591 HydrophobicContact CD1-CD2 4.26Å; L7-L594 HydrophobicContact CD2-CD2 3.96Å; L7-L598 HydrophobicContact CD2-CD1 4.06Å
8	F	44	Very low	43.1	Very low	144 Å²	144	93.5 Å²	93.5	63%	0.632	47%	0.466	S	S	*	.	H	α-helix	trans	-67.8	-39.8	178.4	-148.2	-88.9	0	0	0	111.9	K4 D5 L6 C12	K4-F8 PolarHBondContact O-N 3.31Å; D5-F8 PolarHBondContact O-N 3.13Å; L6-F8 VanDerWaalsContact C-N 3.31Å; L6-F8 PolarHBondContact O-N 3.05Å; F8-C12 WeakPolarHBondContact O-CB 3.49Å; F8-C12 PolarHBondContact O-N 3.34Å
9	I	42.8	Very low	42.3	Very low	73 Å²	73	93.6 Å²	93.6	37%	0.374	48%	0.475	S	S	.	.	H	α-helix	trans	-66.8	-42	176.1	-67.6	167	0	0	0	110.9	M1 D5 L6 C12 N13	M1-I9 HydrophobicContact CE-CD1 3.34Å; D5-I9 WeakPolarHBondContact O-CG1 3.35Å; D5-I9 PolarHBondContact O-N 3.19Å; L6-I9 PolarHBondContact O-N 3.49Å; I9-C12 PolarHBondContact O-N 3.16Å; I9-N13 PolarHBondContact O-N 3.26Å
10	S	42.6	Very low	41.8	Very low	62 Å²	62	90.9 Å²	90.9	43%	0.434	47%	0.472	S	S	.	.	H	α-helix	trans	-64.1	-45	176.4	179	0	0	0	0	112.1	L6 L7 C12 N13 E14	L6-S10 PolarHBondContact O-N 3.43Å; L7-S10 PolarHBondContact O-N 3.47Å; S10-C12 PolarHBondContact O-N 3.4Å; S10-N13 PolarHBondContact O-N 3.12Å; S10-E14 PolarHBondContact O-N 3.46Å
11	I	46.6	Very low	41.6	Very low	65 Å²	65	91.9 Å²	91.9	33%	0.333	48%	0.482	S	S	.	.	H	α-helix	trans	-63.7	-40.6	175.7	-71.3	169.4	0	0	0	111.4	L7 L15 L598	L7-I11 HydrophobicContact CD2-CD1 3.78Å; L7-I11 WeakPolarHBondContact O-CB 3.33Å; L7-I11 VanDerWaalsContact O-CG1 3.24Å; L7-I11 WeakPolarHBondContact O-CG1 3.42Å; L7-I11 PolarHBondContact O-N 3.21Å; I11-L15 HydrophobicContact CG2-CD1 3.5Å; I11-L15 HydrophobicContact CG2-CG 4.38Å; I11-L15 VanDerWaalsContact O-CB 3.28Å; I11-L15 WeakPolarHBondContact O-CB 3.2Å; I11-L15 WeakPolarHBondContact O-CG 3.06Å; I11-L15 PolarHBondContact O-N 3.34Å; I11-L598 HydrophobicContact CD1-CD1 4.09Å
12	C	40.2	Very low	41.6	Very low	56 Å²	56	87 Å²	87	38%	0.378	47%	0.468	S	S	.	.	H	α-helix	trans	-64.4	-41.7	174.6	-87.1	0	0	0	0	111.9	F8 I9 S10 I16	F8-C12 WeakPolarHBondContact O-CB 3.49Å; F8-C12 PolarHBondContact O-N 3.34Å; I9-C12 PolarHBondContact O-N 3.16Å; S10-C12 PolarHBondContact O-N 3.4Å; C12-I16 VanDerWaalsContact O-CB 3.28Å; C12-I16 WeakPolarHBondContact O-CB 3.2Å; C12-I16 VanDerWaalsContact O-CD1 3.28Å; C12-I16 WeakPolarHBondContact O-CD1 3.34Å; C12-I16 WeakPolarHBondContact O-CG1 3.17Å; C12-I16 PolarHBondContact O-N 3.42Å
13	N	38.8	Very low	41.4	Very low	43 Å²	43	80.4 Å²	80.4	23%	0.23	44%	0.441	C	S	.	.	H	α-helix	trans	-64.8	-43.1	177.1	-97.2	-27.9	0	0	0	112.1	I9 S10 I16 L17 K143	I9-N13 PolarHBondContact O-N 3.26Å; S10-N13 PolarHBondContact O-N 3.12Å; N13-I16 PolarHBondContact O-N 3.26Å; N13-L17 WeakPolarHBondContact O-CD1 3.49Å; N13-L17 PolarHBondContact O-N 3.2Å; N13-L17 VanDerWaalsContact O-N 3.13Å; N13-K143 PolarHBondContact OD1-NZ 2.04Å
14	E	36.4	Very low	41.5	Very low	100 Å²	100	81.7 Å²	81.7	47%	0.467	44%	0.444	S	S	.	.	H	α-helix	trans	-69	-39.4	177.6	-79.2	-63	157.6	0	0	112.8	S10 L17 H18	S10-E14 PolarHBondContact O-N 3.46Å; E14-L17 PolarHBondContact O-N 2.89Å; E14-H18 PolarHBondContact O-N 2.99Å; E14-H18 VanDerWaalsContact O-N 3.14Å
15	L	36.4	Very low	42.1	Very low	60 Å²	60	75.9 Å²	75.9	31%	0.314	42%	0.422	S	S	.	.	H	α-helix	trans	-69.8	-33.2	175.7	-78.8	164.1	0	0	0	112.7	I11 L17 H18 C19	I11-L15 HydrophobicContact CG2-CD1 3.5Å; I11-L15 HydrophobicContact CG2-CG 4.38Å; I11-L15 VanDerWaalsContact O-CB 3.28Å; I11-L15 WeakPolarHBondContact O-CB 3.2Å; I11-L15 WeakPolarHBondContact O-CG 3.06Å; I11-L15 PolarHBondContact O-N 3.34Å; L15-L17 VanDerWaalsContact C-N 3.3Å; L15-H18 PolarHBondContact O-N 2.87Å; L15-C19 VanDerWaalsContact O-CB 3.31Å; L15-C19 WeakPolarHBondContact O-CB 3.24Å; L15-C19 PolarHBondContact O-N 2.68Å
16	I	35.1	Very low	43.1	Very low	115 Å²	115	74.1 Å²	74.1	59%	0.59	41%	0.414	S	S	*	.	H	α-helix	trans	-68.4	-32.5	174.2	-69.9	165.3	0	0	0	110.8	C12 N13	C12-I16 VanDerWaalsContact O-CB 3.28Å; C12-I16 WeakPolarHBondContact O-CB 3.2Å; C12-I16 VanDerWaalsContact O-CD1 3.28Å; C12-I16 WeakPolarHBondContact O-CD1 3.34Å; C12-I16 WeakPolarHBondContact O-CG1 3.17Å; C12-I16 PolarHBondContact O-N 3.42Å; N13-I16 PolarHBondContact O-N 3.26Å
17	L	36.3	Very low	44.3	Very low	74 Å²	74	78.7 Å²	78.7	39%	0.387	43%	0.431	S	S	.	.	H	α-helix	trans	-72.6	-32.8	176.4	-82.8	153.6	0	0	0	113.5	N13 E14 L15	N13-L17 WeakPolarHBondContact O-CD1 3.49Å; N13-L17 PolarHBondContact O-N 3.2Å; N13-L17 VanDerWaalsContact O-N 3.13Å; E14-L17 PolarHBondContact O-N 2.89Å; L15-L17 VanDerWaalsContact C-N 3.3Å
18	H	33.2	Very low	45.5	Very low	155 Å²	155	83.6 Å²	83.6	72%	0.718	45%	0.451	S	S	*	.	H	α-helix	trans	-100.6	-19	-175.6	-89.9	-67	0	0	0	116.1	E14 L15	E14-H18 PolarHBondContact O-N 2.99Å; E14-H18 VanDerWaalsContact O-N 3.14Å; L15-H18 PolarHBondContact O-N 2.87Å
19	C	27.7	Very low	46.6	Very low	95 Å²	95	77 Å²	77	64%	0.642	42%	0.422	S	S	*	.			trans	-99.9	11.9	-177.2	-71.1	0	0	0	0	115.4	L15 T21	L15-C19 VanDerWaalsContact O-CB 3.31Å; L15-C19 WeakPolarHBondContact O-CB 3.24Å; L15-C19 PolarHBondContact O-N 2.68Å; C19-T21 PolarHBondContact O-N 3.34Å; C19-T21 VanDerWaalsContact O-N 3.09Å
20	G	32.5	Very low	47.6	Very low	39 Å²	39	75.2 Å²	75.2	40%	0.402	42%	0.421	S	S	.	.	S	Bend	trans	-73.3	95.1	161	0	0	0	0	0	109.1	A22	G20-A22 PolarHBondContact O-N 3.08Å; G20-A22 VanDerWaalsContact O-N 3.16Å
21	T	38.4	Very low	48.4	Very low	112 Å²	112	76.9 Å²	76.9	69%	0.687	43%	0.43	S	S	*	.			trans	-41.5	125.9	170.1	49	0	0	0	0	109	C19 L23	C19-T21 PolarHBondContact O-N 3.34Å; C19-T21 VanDerWaalsContact O-N 3.09Å; T21-L23 PolarHBondContact O-N 3.39Å
22	A	40.9	Very low	49.4	Very low	66 Å²	66	79.3 Å²	79.3	55%	0.545	44%	0.436	S	S	.	.			trans	-45.1	107.8	-177.5	0	0	0	0	0	110	G20 E24	G20-A22 PolarHBondContact O-N 3.08Å; G20-A22 VanDerWaalsContact O-N 3.16Å; A22-E24 PolarHBondContact O-N 3.42Å
23	L	52.6	Low	50.9	Low	23 Å²	23	83.7 Å²	83.7	12%	0.12	45%	0.449	C	S	.	.			trans	-52.1	119.7	167.3	-103.9	67.7	0	0	0	107.2	T21 C25 T41 E221	T21-L23 PolarHBondContact O-N 3.39Å; L23-C25 VanDerWaalsContact C-N 3.29Å; L23-C25 PolarHBondContact O-N 3.44Å; L23-T41 WeakPolarHBondContact CD1-O 3.41Å; L23-T41 VanDerWaalsContact CD2-O 3.27Å; L23-T41 WeakPolarHBondContact CD2-O 3.09Å; L23-E221 VanDerWaalsContact CD2-CA 3.49Å; L23-E221 WeakPolarHBondContact CD2-O 3.44Å; L23-E221 VanDerWaalsContact CG-O 3.28Å; L23-E221 WeakPolarHBondContact CG-O 3.41Å
24	E	58.3	Low	52.8	Low	123 Å²	123	82.6 Å²	82.6	58%	0.575	44%	0.441	S	S	*	.			trans	-67.8	94.6	167.8	-72.9	-165.3	173.4	0	0	107.7	A22	A22-E24 PolarHBondContact O-N 3.42Å
25	C	66.4	Low	54.7	Low	28 Å²	28	83.5 Å²	83.5	19%	0.189	44%	0.444	C	S	.	.			trans	-85.8	117.5	174.2	-56.4	0	0	0	0	109	L23 T36 K38 C43	L23-C25 VanDerWaalsContact C-N 3.29Å; L23-C25 PolarHBondContact O-N 3.44Å; C25-T36 HydrophobicContact CB-CG2 4.39Å; C25-K38 HydrophobicContact CB-CB 4.17Å; C25-C43 WeakPolarHBondContact CA-SG 3.43Å; C25-C43 HydrophobicContact CB-CB 3.78Å; C25-C43 WeakPolarHBondContact CB-SG 3.46Å; C25-C43 WeakPolarHBondContact SG-CA 2.98Å; C25-C43 WeakPolarHBondContact SG-CB 3.45Å; C25-C43 CovalentContact SG-SG 2.03Å; C25-C43 PolarHBondContact SG-SG 2.06Å
26	P	66	Low	56.6	Low	22 Å²	22	80.9 Å²	80.9	14%	0.143	43%	0.43	C	S	.	.			trans	-65.3	141.4	175.4	29.3	-34.7	0	0	0	109.3	K28 W29 T36 Y258	P26-K28 PolarHBondContact O-N 2.99Å; P26-W29 HydrophobicContact CG-CE3 3.79Å; P26-W29 HydrophobicContact CG-CZ3 4.1Å; P26-T36 WeakPolarHBondContact O-CB 3.46Å; P26-T36 WeakPolarHBondContact O-CG2 3.28Å; P26-Y258 HydrophobicContact CB-CE1 4.35Å
27	K	69.2	Low	58.2	Low	168 Å²	168	76.6 Å²	76.6	73%	0.73	41%	0.408	S	S	*	.	S	Bend	trans	-61.8	-27.2	178.7	-69.6	-174.8	178.8	-177.7	0	113	T36	K27-T36 PolarHBondContact O-N 3.1Å
28	K	71	Confident	59.6	Low	133 Å²	133	77.9 Å²	77.9	58%	0.578	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	131.1	175.7	-68.2	-176.9	178.9	-179.2	0	108.6	P26 K33 W34	P26-K28 PolarHBondContact O-N 2.99Å; K28-K33 HydrophobicContact CD-CB 4.36Å; K28-W34 CarbonylContact C-O 3.42Å; K28-W34 VanDerWaalsContact CA-O 3.25Å; K28-W34 WeakPolarHBondContact CA-O 3.4Å
29	W	67.3	Low	61	Low	6 Å²	6	71.7 Å²	71.7	2%	0.023	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	115.6	-177.5	-175	-106.1	0	0	0	111.5	P26 K33 W34 T36 T45 L83 P84 H220 F224	P26-W29 HydrophobicContact CG-CE3 3.79Å; P26-W29 HydrophobicContact CG-CZ3 4.1Å; W29-K33 PolarHBondContact O-N 3.08Å; W29-W34 HydrophobicContact CB-CB 4.32Å; W29-W34 PolarHBondContact N-O 3.31Å; W29-W34 PolarHBondContact O-N 3.21Å; W29-T36 WeakPolarHBondContact CB-OG1 3.01Å; W29-T45 HydrophobicContact CB-CG2 3.77Å; W29-T45 HydrophobicContact CG-CG2 4.13Å; W29-L83 HydrophobicContact CD2-CD2 3.64Å; W29-L83 HydrophobicContact CE3-CD2 4.32Å; W29-L83 HydrophobicContact CG-CD2 4.02Å; W29-L83 HydrophobicContact CH2-CD2 4.24Å; W29-L83 HydrophobicContact CZ2-CD2 3.52Å; W29-P84 HydrophobicContact CH2-CG 3.76Å; W29-P84 VanDerWaalsContact CZ2-CD 3.49Å; W29-P84 HydrophobicContact CZ2-CG 4.33Å; W29-H220 AromaticContact CE3-CE1 3.5Å; W29-H220 AromaticContact CE3-NE2 3.83Å; W29-H220 AromaticContact CH2-CE1 3.75Å; W29-H220 AromaticContact CH2-ND1 3.86Å; W29-H220 AromaticContact CZ3-CE1 3.12Å; W29-H220 WeakPolarHBondContact CZ3-CE1 3.49Å; W29-H220 AromaticContact CZ3-ND1 3.7Å; W29-H220 AromaticContact CZ3-NE2 3.91Å; W29-F224 AromaticContact CE2-CZ 3.96Å; W29-F224 HydrophobicContact CH2-CD2 4.49Å; W29-F224 AromaticContact CH2-CE1 3.98Å; W29-F224 HydrophobicContact CH2-CE1 3.98Å; W29-F224 AromaticContact CH2-CE2 3.91Å; W29-F224 HydrophobicContact CH2-CE2 3.91Å; W29-F224 AromaticContact CH2-CZ 3.62Å; W29-F224 HydrophobicContact CH2-CZ 3.62Å; W29-F224 HydrophobicContact CZ2-CD1 4.46Å; W29-F224 AromaticContact CZ2-CE1 3.58Å; W29-F224 HydrophobicContact CZ2-CE1 3.58Å; W29-F224 HydrophobicContact CZ2-CE2 4.14Å; W29-F224 AromaticContact CZ2-CZ 3.37Å; W29-F224 HydrophobicContact CZ2-CZ 3.37Å; W29-F224 HydrophobicContact CZ3-CE2 4.4Å; W29-F224 HydrophobicContact CZ3-CZ 4.38Å
30	G	64.5	Low	62.6	Low	34 Å²	34	72.3 Å²	72.3	35%	0.351	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	-158.1	160.6	0	0	0	0	0	116.6	Y32 K33	G30-Y32 PolarHBondContact O-N 3.2Å; G30-K33 PolarHBondContact O-N 3.45Å; G30-K33 VanDerWaalsContact O-N 3.15Å
31	P	59.8	Low	63.7	Low	98 Å²	98	74 Å²	74	64%	0.636	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.5	-177.8	23	-31.8	0	0	0	112.8	K33	P31-K33 VanDerWaalsContact C-N 3.33Å; P31-K33 PolarHBondContact O-N 3.15Å
32	Y	66.6	Low	64.9	Low	115 Å²	115	69.7 Å²	69.7	45%	0.451	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-13.2	-178.7	-49.8	-72.6	0	0	0	114.1	G30 W34	G30-Y32 PolarHBondContact O-N 3.2Å; Y32-W34 HydrophobicContact CD1-CH2 4.49Å; Y32-W34 AromaticContact CD1-CZ2 3.95Å; Y32-W34 HydrophobicContact CD1-CZ2 3.95Å; Y32-W34 AromaticContact CD2-CH2 3.81Å; Y32-W34 HydrophobicContact CD2-CH2 3.81Å; Y32-W34 AromaticContact CD2-CZ2 3.94Å; Y32-W34 HydrophobicContact CD2-CZ2 3.94Å; Y32-W34 HydrophobicContact CD2-CZ3 4.13Å; Y32-W34 HydrophobicContact CE2-CH2 4.22Å; Y32-W34 HydrophobicContact CG-CD2 4.38Å; Y32-W34 AromaticContact CG-CE2 3.83Å; Y32-W34 AromaticContact CG-CH2 3.96Å; Y32-W34 HydrophobicContact CG-CH2 3.96Å; Y32-W34 AromaticContact CG-CZ2 3.59Å; Y32-W34 HydrophobicContact CG-CZ2 3.59Å; Y32-W34 PolarHBondContact O-N 3.2Å
33	K	70.9	Confident	66.6	Low	149 Å²	149	66.6 Å²	66.6	65%	0.648	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	27.4	179.1	-60	178.8	-179.3	174.2	0	114.3	K28 W29 G30 P31	K28-K33 HydrophobicContact CD-CB 4.36Å; W29-K33 PolarHBondContact O-N 3.08Å; G30-K33 PolarHBondContact O-N 3.45Å; G30-K33 VanDerWaalsContact O-N 3.15Å; P31-K33 VanDerWaalsContact C-N 3.33Å; P31-K33 PolarHBondContact O-N 3.15Å
34	W	78.5	Confident	67.8	Low	19 Å²	19	65.5 Å²	65.5	7%	0.072	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	140	179.8	-62.4	-23.7	0	0	0	112	K28 W29 Y32 T36 T45 A46 V47 P48 E51 Y78	K28-W34 CarbonylContact C-O 3.42Å; K28-W34 VanDerWaalsContact CA-O 3.25Å; K28-W34 WeakPolarHBondContact CA-O 3.4Å; W29-W34 HydrophobicContact CB-CB 4.32Å; W29-W34 PolarHBondContact N-O 3.31Å; W29-W34 PolarHBondContact O-N 3.21Å; Y32-W34 HydrophobicContact CD1-CH2 4.49Å; Y32-W34 AromaticContact CD1-CZ2 3.95Å; Y32-W34 HydrophobicContact CD1-CZ2 3.95Å; Y32-W34 AromaticContact CD2-CH2 3.81Å; Y32-W34 HydrophobicContact CD2-CH2 3.81Å; Y32-W34 AromaticContact CD2-CZ2 3.94Å; Y32-W34 HydrophobicContact CD2-CZ2 3.94Å; Y32-W34 HydrophobicContact CD2-CZ3 4.13Å; Y32-W34 HydrophobicContact CE2-CH2 4.22Å; Y32-W34 HydrophobicContact CG-CD2 4.38Å; Y32-W34 AromaticContact CG-CE2 3.83Å; Y32-W34 AromaticContact CG-CH2 3.96Å; Y32-W34 HydrophobicContact CG-CH2 3.96Å; Y32-W34 AromaticContact CG-CZ2 3.59Å; Y32-W34 HydrophobicContact CG-CZ2 3.59Å; Y32-W34 PolarHBondContact O-N 3.2Å; W34-T36 PolarHBondContact O-N 2.76Å; W34-T36 PolarHBondContact O-OG1 2.83Å; W34-T45 HydrophobicContact CB-CG2 3.74Å; W34-T45 HydrophobicContact CE3-CG2 4.01Å; W34-A46 WeakPolarHBondContact CB-O 3.28Å; W34-V47 HydrophobicContact CE3-CB 4.48Å; W34-V47 HydrophobicContact CE3-CG1 4.42Å; W34-V47 HydrophobicContact CE3-CG2 3.85Å; W34-V47 HydrophobicContact CH2-CG1 4.19Å; W34-V47 HydrophobicContact CZ2-CG1 4.41Å; W34-V47 HydrophobicContact CZ3-CG1 4.17Å; W34-V47 HydrophobicContact CZ3-CG2 3.94Å; W34-P48 VanDerWaalsContact NE1-CD 3.35Å; W34-E51 HydrophobicContact CH2-CG 4.3Å; W34-E51 HydrophobicContact CZ2-CG 3.61Å; W34-Y78 HydrophobicContact CH2-CE1 4.45Å; W34-Y78 WeakPolarHBondContact CH2-OH 3.22Å
35	K	77	Confident	68.9	Low	120 Å²	120	59.6 Å²	59.6	52%	0.522	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	131.5	-176.9	-72.2	-178.4	179.5	178	0	110.3	T45 A46 F107	K35-T45 WeakPolarHBondContact O-CA 3.47Å; K35-A46 PolarHBondContact O-N 2.96Å; K35-F107 HydrophobicContact CD-CD2 4.34Å
36	T	76.1	Confident	69.8	Low	5 Å²	5	58.6 Å²	58.6	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	139.6	179.5	-61.7	0	0	0	0	110.3	C25 P26 K27 W29 W34 C43 V44 T45	C25-T36 HydrophobicContact CB-CG2 4.39Å; P26-T36 WeakPolarHBondContact O-CB 3.46Å; P26-T36 WeakPolarHBondContact O-CG2 3.28Å; K27-T36 PolarHBondContact O-N 3.1Å; W29-T36 WeakPolarHBondContact CB-OG1 3.01Å; W34-T36 PolarHBondContact O-N 2.76Å; W34-T36 PolarHBondContact O-OG1 2.83Å; T36-C43 HydrophobicContact CG2-CB 4.21Å; T36-V44 CarbonylContact C-O 3.43Å; T36-V44 WeakPolarHBondContact CA-O 3.43Å; T36-T45 WeakPolarHBondContact OG1-CB 3.33Å; T36-T45 WeakPolarHBondContact OG1-CG2 3.3Å; T36-T45 PolarHBondContact OG1-OG1 3.25Å
37	F	69	Low	70.6	Confident	25 Å²	25	57.6 Å²	57.6	11%	0.11	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	159.1	178.8	64.8	-79.8	0	0	0	110.2	V44 W89 W109	F37-V44 HydrophobicContact CD1-CB 4.12Å; F37-V44 HydrophobicContact CD1-CG1 4.49Å; F37-V44 VanDerWaalsContact CD1-O 3.31Å; F37-V44 WeakPolarHBondContact CD1-O 3.48Å; F37-V44 HydrophobicContact CD2-CB 4.4Å; F37-V44 HydrophobicContact CE1-CB 3.52Å; F37-V44 HydrophobicContact CE1-CG1 3.5Å; F37-V44 VanDerWaalsContact CE1-CG1 3.5Å; F37-V44 HydrophobicContact CE2-CB 3.88Å; F37-V44 HydrophobicContact CE2-CG1 4.33Å; F37-V44 HydrophobicContact CE2-CG2 4.11Å; F37-V44 HydrophobicContact CZ-CB 3.38Å; F37-V44 HydrophobicContact CZ-CG1 3.4Å; F37-V44 VanDerWaalsContact CZ-CG1 3.4Å; F37-V44 HydrophobicContact CZ-CG2 3.99Å; F37-V44 PolarHBondContact N-O 2.96Å; F37-V44 PolarHBondContact O-N 3.47Å; F37-W89 HydrophobicContact CZ-CH2 4.05Å; F37-W89 HydrophobicContact CZ-CZ2 4.32Å; F37-W109 HydrophobicContact CD1-CH2 4.4Å; F37-W109 AromaticContact CE1-CH2 3.5Å; F37-W109 HydrophobicContact CE1-CH2 3.5Å; F37-W109 VanDerWaalsContact CE1-CH2 3.5Å; F37-W109 HydrophobicContact CE1-CZ2 4.26Å; F37-W109 HydrophobicContact CE1-CZ3 4.44Å; F37-W109 HydrophobicContact CE2-CH2 4.21Å; F37-W109 AromaticContact CZ-CH2 3.38Å; F37-W109 HydrophobicContact CZ-CH2 3.38Å; F37-W109 HydrophobicContact CZ-CZ2 4.22Å; F37-W109 HydrophobicContact CZ-CZ3 4.21Å
38	K	66.8	Low	71.4	Confident	100 Å²	100	51.5 Å²	51.5	44%	0.435	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.5	176.7	-176.4	-179	175.4	-168.3	0	109	C25 L40	C25-K38 HydrophobicContact CB-CB 4.17Å; K38-L40 WeakPolarHBondContact CE-O 3.3Å
39	Y	61.3	Low	71.8	Confident	26 Å²	26	47.2 Å²	47.2	10%	0.102	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	115.2	173.5	-176	-96.3	0	0	0	110	T41 S42 W89 W91	Y39-T41 PolarHBondContact O-N 3.13Å; Y39-T41 VanDerWaalsContact O-N 3.1Å; Y39-S42 PolarHBondContact N-O 2.8Å; Y39-S42 PolarHBondContact O-N 3.03Å; Y39-W89 HydrophobicContact CD1-CZ2 4.12Å; Y39-W89 HydrophobicContact CG-CZ2 4.18Å; Y39-W91 HydrophobicContact CD1-CD2 4.37Å; Y39-W91 HydrophobicContact CD1-CE3 4.08Å; Y39-W91 HydrophobicContact CD1-CZ3 4.27Å; Y39-W91 HydrophobicContact CD2-CE3 4.19Å; Y39-W91 HydrophobicContact CD2-CH2 4.12Å; Y39-W91 AromaticContact CD2-CZ3 3.62Å; Y39-W91 HydrophobicContact CD2-CZ3 3.62Å; Y39-W91 AromaticContact CE1-CD2 3.61Å; Y39-W91 HydrophobicContact CE1-CD2 3.61Å; Y39-W91 AromaticContact CE1-CE2 3.82Å; Y39-W91 AromaticContact CE1-CE3 3.61Å; Y39-W91 HydrophobicContact CE1-CE3 3.61Å; Y39-W91 HydrophobicContact CE1-CG 4.25Å; Y39-W91 AromaticContact CE1-CH2 3.9Å; Y39-W91 HydrophobicContact CE1-CH2 3.9Å; Y39-W91 HydrophobicContact CE1-CZ2 4.02Å; Y39-W91 AromaticContact CE1-CZ3 3.72Å; Y39-W91 HydrophobicContact CE1-CZ3 3.72Å; Y39-W91 HydrophobicContact CE2-CD2 4.43Å; Y39-W91 AromaticContact CE2-CE3 3.78Å; Y39-W91 HydrophobicContact CE2-CE3 3.78Å; Y39-W91 AromaticContact CE2-CH2 3.06Å; Y39-W91 HydrophobicContact CE2-CH2 3.06Å; Y39-W91 AromaticContact CE2-CZ2 3.92Å; Y39-W91 HydrophobicContact CE2-CZ2 3.92Å; Y39-W91 AromaticContact CE2-CZ3 3Å; Y39-W91 HydrophobicContact CE2-CZ3 3Å; Y39-W91 HydrophobicContact CG-CE3 4.37Å; Y39-W91 HydrophobicContact CG-CZ3 4.25Å; Y39-W91 AromaticContact CZ-CD2 3.71Å; Y39-W91 AromaticContact CZ-CE2 3.58Å; Y39-W91 AromaticContact CZ-CE3 3.52Å; Y39-W91 AromaticContact CZ-CH2 2.94Å; Y39-W91 AromaticContact CZ-CZ2 3.29Å; Y39-W91 AromaticContact CZ-CZ3 3.1Å; Y39-W91 VanDerWaalsContact OH-CE2 3.25Å; Y39-W91 WeakPolarHBondContact OH-CH2 3.35Å; Y39-W91 WeakPolarHBondContact OH-CZ2 3.28Å
40	L	60.6	Low	72.5	Confident	108 Å²	108	49.1 Å²	49.1	57%	0.565	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	-113.6	-169.7	-60.9	173.7	0	0	0	111.6	K38	K38-L40 WeakPolarHBondContact CE-O 3.3Å
41	T	57.5	Low	73.4	Confident	73 Å²	73	51.1 Å²	51.1	45%	0.448	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	4.8	-179.3	58.3	0	0	0	0	113.5	L23 Y39	L23-T41 WeakPolarHBondContact CD1-O 3.41Å; L23-T41 VanDerWaalsContact CD2-O 3.27Å; L23-T41 WeakPolarHBondContact CD2-O 3.09Å; Y39-T41 PolarHBondContact O-N 3.13Å; Y39-T41 VanDerWaalsContact O-N 3.1Å
42	S	63.1	Low	74.2	Confident	23 Å²	23	46.5 Å²	46.5	16%	0.161	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.5	-176.7	-62.1	0	0	0	0	111.6	Y39 Y87	Y39-S42 PolarHBondContact N-O 2.8Å; Y39-S42 PolarHBondContact O-N 3.03Å; S42-Y87 WeakPolarHBondContact CB-OH 3.22Å; S42-Y87 PolarHBondContact OG-OH 3.44Å
43	C	75.4	Confident	74.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	139.4	164.1	-58.5	0	0	0	0	109.1	C25 T36 G219 H220 G222	C25-C43 WeakPolarHBondContact CA-SG 3.43Å; C25-C43 HydrophobicContact CB-CB 3.78Å; C25-C43 WeakPolarHBondContact CB-SG 3.46Å; C25-C43 WeakPolarHBondContact SG-CA 2.98Å; C25-C43 WeakPolarHBondContact SG-CB 3.45Å; C25-C43 CovalentContact SG-SG 2.03Å; C25-C43 PolarHBondContact SG-SG 2.06Å; T36-C43 HydrophobicContact CG2-CB 4.21Å; C43-G219 CarbonylContact O-C 3.45Å; C43-G219 VanDerWaalsContact O-CA 3.25Å; C43-G219 WeakPolarHBondContact O-CA 3.37Å; C43-H220 WeakPolarHBondContact CB-CE1 2.96Å; C43-H220 WeakPolarHBondContact CB-NE2 3.28Å; C43-H220 PolarHBondContact N-O 3.06Å; C43-H220 PolarHBondContact O-CD2 3.46Å; C43-H220 VanDerWaalsContact O-CD2 3.32Å; C43-H220 PolarHBondContact O-N 3.43Å; C43-G222 VanDerWaalsContact SG-CA 3.57Å
44	V	77.8	Confident	75	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	119.6	-179.6	-174.2	0	0	0	0	109.1	T36 F37 W89 T217 C218	T36-V44 CarbonylContact C-O 3.43Å; T36-V44 WeakPolarHBondContact CA-O 3.43Å; F37-V44 HydrophobicContact CD1-CB 4.12Å; F37-V44 HydrophobicContact CD1-CG1 4.49Å; F37-V44 VanDerWaalsContact CD1-O 3.31Å; F37-V44 WeakPolarHBondContact CD1-O 3.48Å; F37-V44 HydrophobicContact CD2-CB 4.4Å; F37-V44 HydrophobicContact CE1-CB 3.52Å; F37-V44 HydrophobicContact CE1-CG1 3.5Å; F37-V44 VanDerWaalsContact CE1-CG1 3.5Å; F37-V44 HydrophobicContact CE2-CB 3.88Å; F37-V44 HydrophobicContact CE2-CG1 4.33Å; F37-V44 HydrophobicContact CE2-CG2 4.11Å; F37-V44 HydrophobicContact CZ-CB 3.38Å; F37-V44 HydrophobicContact CZ-CG1 3.4Å; F37-V44 VanDerWaalsContact CZ-CG1 3.4Å; F37-V44 HydrophobicContact CZ-CG2 3.99Å; F37-V44 PolarHBondContact N-O 2.96Å; F37-V44 PolarHBondContact O-N 3.47Å; V44-W89 HydrophobicContact CG1-CB 4.3Å; V44-W89 HydrophobicContact CG1-CD2 3.6Å; V44-W89 HydrophobicContact CG1-CE3 3.88Å; V44-W89 HydrophobicContact CG1-CG 3.86Å; V44-W89 HydrophobicContact CG1-CH2 4.45Å; V44-W89 HydrophobicContact CG1-CZ2 4.25Å; V44-W89 HydrophobicContact CG1-CZ3 4.28Å; V44-W89 HydrophobicContact CG2-CD2 4.08Å; V44-W89 HydrophobicContact CG2-CG 4.16Å; V44-W89 HydrophobicContact CG2-CZ2 3.92Å; V44-T217 HydrophobicContact CG1-CG2 4.41Å; V44-C218 CarbonylContact C-O 3.53Å; V44-C218 WeakPolarHBondContact CA-O 3.31Å
45	T	83.2	Confident	74.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.2	-178.9	-58.6	0	0	0	0	110.3	W29 W34 K35 T36 V47 T217 C218 H220	W29-T45 HydrophobicContact CB-CG2 3.77Å; W29-T45 HydrophobicContact CG-CG2 4.13Å; W34-T45 HydrophobicContact CB-CG2 3.74Å; W34-T45 HydrophobicContact CE3-CG2 4.01Å; K35-T45 WeakPolarHBondContact O-CA 3.47Å; T36-T45 WeakPolarHBondContact OG1-CB 3.33Å; T36-T45 WeakPolarHBondContact OG1-CG2 3.3Å; T36-T45 PolarHBondContact OG1-OG1 3.25Å; T45-V47 HydrophobicContact CG2-CG2 4.45Å; T45-V47 PolarHBondContact O-N 3.33Å; T45-T217 WeakPolarHBondContact O-CA 3.1Å; T45-C218 PolarHBondContact N-O 3.5Å; T45-C218 PolarHBondContact O-N 3.31Å; T45-H220 PolarHBondContact OG1-CD2 3.46Å; T45-H220 PolarHBondContact OG1-NE2 3.21Å; T45-H220 VanDerWaalsContact OG1-NE2 3.13Å
46	A	83.5	Confident	74.2	Confident	6 Å²	6	40.9 Å²	40.9	5%	0.05	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	105.7	173	0	0	0	0	0	110.2	W34 K35 F107 Y215	W34-A46 WeakPolarHBondContact CB-O 3.28Å; K35-A46 PolarHBondContact O-N 2.96Å; A46-F107 HydrophobicContact CB-CE2 3.91Å; A46-F107 HydrophobicContact CB-CZ 3.75Å; A46-Y215 HydrophobicContact CB-CD1 4.49Å
47	V	84	Confident	73.3	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.4	178.3	-177.8	0	0	0	0	109.4	W34 T45 E51 Y78 Y215 V216 C218	W34-V47 HydrophobicContact CE3-CB 4.48Å; W34-V47 HydrophobicContact CE3-CG1 4.42Å; W34-V47 HydrophobicContact CE3-CG2 3.85Å; W34-V47 HydrophobicContact CH2-CG1 4.19Å; W34-V47 HydrophobicContact CZ2-CG1 4.41Å; W34-V47 HydrophobicContact CZ3-CG1 4.17Å; W34-V47 HydrophobicContact CZ3-CG2 3.94Å; T45-V47 HydrophobicContact CG2-CG2 4.45Å; T45-V47 PolarHBondContact O-N 3.33Å; V47-E51 HydrophobicContact CG1-CB 3.78Å; V47-E51 HydrophobicContact CG1-CG 4.06Å; V47-Y78 HydrophobicContact CG1-CE1 3.77Å; V47-Y215 CarbonylContact O-C 3.44Å; V47-Y215 VanDerWaalsContact O-CA 3.23Å; V47-Y215 WeakPolarHBondContact O-CA 2.9Å; V47-V216 PolarHBondContact N-O 2.96Å; V47-V216 PolarHBondContact O-N 2.91Å; V47-C218 HydrophobicContact CG2-CB 4.36Å
48	P	85.7	Confident	72.4	Confident	40 Å²	40	55 Å²	55	26%	0.26	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	142.8	174.5	-22.8	33.6	0	0	0	112.5	W34 G50 E51 Y215	W34-P48 VanDerWaalsContact NE1-CD 3.35Å; P48-G50 PolarHBondContact O-N 3.37Å; P48-E51 HydrophobicContact CB-CG 4.45Å; P48-E51 WeakPolarHBondContact O-CB 3.13Å; P48-E51 PolarHBondContact O-N 3.42Å; P48-E51 VanDerWaalsContact O-N 3.09Å; P48-Y215 HydrophobicContact CG-CE1 4.5Å
49	I	79.3	Confident	71.2	Confident	43 Å²	43	57.2 Å²	57.2	22%	0.221	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-58.1	-33.2	-177.2	-170.5	47.9	0	0	0	113.6	E51 V52 E53 I56 Y213 K214 V216	I49-E51 PolarHBondContact O-N 3.45Å; I49-E51 VanDerWaalsContact O-N 3.13Å; I49-V52 HydrophobicContact CD1-CG2 3.76Å; I49-V52 CarbonylContact O-C 3.43Å; I49-V52 PolarHBondContact O-N 3.48Å; I49-E53 PolarHBondContact O-N 3.43Å; I49-I56 HydrophobicContact CD1-CD1 3.49Å; I49-I56 VanDerWaalsContact CD1-CD1 3.49Å; I49-I56 HydrophobicContact CG1-CD1 4.21Å; I49-Y213 HydrophobicContact CD1-CD2 3.55Å; I49-Y213 HydrophobicContact CD1-CE2 3.04Å; I49-Y213 HydrophobicContact CG1-CD2 4.07Å; I49-Y213 HydrophobicContact CG1-CE2 3.96Å; I49-K214 WeakPolarHBondContact CB-O 3.44Å; I49-K214 PolarHBondContact N-O 3.21Å; I49-V216 HydrophobicContact CD1-CG2 4.27Å
50	G	81.5	Confident	70.5	Confident	47 Å²	47	61.9 Å²	61.9	49%	0.485	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-58.7	-26.1	178.5	0	0	0	0	0	113.9	P48 V52	P48-G50 PolarHBondContact O-N 3.37Å; G50-V52 VanDerWaalsContact C-N 3.32Å; G50-V52 PolarHBondContact O-N 3.23Å
51	E	83	Confident	69.7	Low	75 Å²	75	64.3 Å²	64.3	35%	0.35	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-71.9	-28.3	177.7	-61.4	-66.7	155.3	0	0	112.6	W34 V47 P48 I49 H54 Y78	W34-E51 HydrophobicContact CH2-CG 4.3Å; W34-E51 HydrophobicContact CZ2-CG 3.61Å; V47-E51 HydrophobicContact CG1-CB 3.78Å; V47-E51 HydrophobicContact CG1-CG 4.06Å; P48-E51 HydrophobicContact CB-CG 4.45Å; P48-E51 WeakPolarHBondContact O-CB 3.13Å; P48-E51 PolarHBondContact O-N 3.42Å; P48-E51 VanDerWaalsContact O-N 3.09Å; I49-E51 PolarHBondContact O-N 3.45Å; I49-E51 VanDerWaalsContact O-N 3.13Å; E51-H54 PolarHBondContact O-CE1 2.01Å; E51-H54 VanDerWaalsContact O-CE1 3.23Å; E51-H54 PolarHBondContact O-ND1 3.23Å; E51-Y78 HydrophobicContact CB-CE1 4.47Å; E51-Y78 WeakPolarHBondContact CB-OH 3.21Å; E51-Y78 PolarHBondContact OE2-OH 3.3Å
52	V	78	Confident	68.9	Low	2 Å²	2	66.4 Å²	66.4	1%	0.012	35%	0.349	C	S	.	.	S	Bend	trans	-115.8	13.2	-178.1	-60.5	0	0	0	0	112.2	I49 G50 H54 C55 M75 Y78 V216	I49-V52 HydrophobicContact CD1-CG2 3.76Å; I49-V52 CarbonylContact O-C 3.43Å; I49-V52 PolarHBondContact O-N 3.48Å; G50-V52 VanDerWaalsContact C-N 3.32Å; G50-V52 PolarHBondContact O-N 3.23Å; V52-H54 PolarHBondContact O-N 3.36Å; V52-C55 WeakPolarHBondContact O-CB 2.99Å; V52-C55 PolarHBondContact O-N 3.19Å; V52-M75 HydrophobicContact CB-CG 4.24Å; V52-M75 HydrophobicContact CG2-CE 4.17Å; V52-M75 HydrophobicContact CG2-CG 4.36Å; V52-Y78 HydrophobicContact CG1-CD1 3.5Å; V52-Y78 VanDerWaalsContact CG1-CD1 3.5Å; V52-Y78 HydrophobicContact CG1-CD2 3.95Å; V52-Y78 HydrophobicContact CG1-CE1 3.84Å; V52-Y78 HydrophobicContact CG1-CE2 4.25Å; V52-Y78 HydrophobicContact CG1-CG 3.57Å; V52-V216 HydrophobicContact CG2-CB 4.39Å; V52-V216 HydrophobicContact CG2-CG2 3.76Å
53	E	77	Confident	67.6	Low	121 Å²	121	69.7 Å²	69.7	57%	0.565	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-62.4	-31	179.7	-172.6	172	-162.8	0	0	111.7	I49 C55 I56 Q57	I49-E53 PolarHBondContact O-N 3.43Å; E53-C55 PolarHBondContact O-N 3.34Å; E53-I56 WeakPolarHBondContact O-CB 3.46Å; E53-I56 PolarHBondContact O-N 3.27Å; E53-Q57 PolarHBondContact O-N 2.98Å
54	H	76.7	Confident	65.9	Low	100 Å²	100	80.5 Å²	80.5	46%	0.463	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-58.8	-30.8	172.5	68.6	-85.1	0	0	0	112.9	E51 V52 I56 Q57	E51-H54 PolarHBondContact O-CE1 2.01Å; E51-H54 VanDerWaalsContact O-CE1 3.23Å; E51-H54 PolarHBondContact O-ND1 3.23Å; V52-H54 PolarHBondContact O-N 3.36Å; H54-I56 PolarHBondContact O-N 2.86Å; H54-Q57 PolarHBondContact O-N 2.96Å
55	C	71.7	Confident	64.1	Low	13 Å²	13	82.1 Å²	82.1	9%	0.088	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-69.1	-19.6	175	-59.7	0	0	0	0	112.7	V52 E53 A71 C74 M75	V52-C55 WeakPolarHBondContact O-CB 2.99Å; V52-C55 PolarHBondContact O-N 3.19Å; E53-C55 PolarHBondContact O-N 3.34Å; C55-A71 WeakPolarHBondContact O-CA 3.38Å; C55-A71 VanDerWaalsContact O-CB 3.3Å; C55-A71 WeakPolarHBondContact O-CB 3.49Å; C55-C74 VanDerWaalsContact CA-SG 3.5Å; C55-C74 HydrophobicContact CB-CB 3.57Å; C55-C74 WeakPolarHBondContact CB-SG 2.95Å; C55-C74 VanDerWaalsContact SG-C 3.55Å; C55-C74 WeakPolarHBondContact SG-CB 3.44Å; C55-C74 CovalentContact SG-SG 2.04Å; C55-C74 PolarHBondContact SG-SG 3.41Å; C55-M75 HydrophobicContact CB-CE 4.43Å; C55-M75 HydrophobicContact CB-CG 4.3Å
56	I	66.1	Low	61.9	Low	51 Å²	51	86 Å²	86	26%	0.262	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-98.5	-10	-174.7	-57.3	166.4	0	0	0	111.1	I49 E53 H54 K58 M75 Y213	I49-I56 HydrophobicContact CD1-CD1 3.49Å; I49-I56 VanDerWaalsContact CD1-CD1 3.49Å; I49-I56 HydrophobicContact CG1-CD1 4.21Å; E53-I56 WeakPolarHBondContact O-CB 3.46Å; E53-I56 PolarHBondContact O-N 3.27Å; H54-I56 PolarHBondContact O-N 2.86Å; I56-K58 PolarHBondContact O-N 3.34Å; I56-M75 HydrophobicContact CD1-CE 3.95Å; I56-M75 HydrophobicContact CG1-CE 3.84Å; I56-Y213 HydrophobicContact CD1-CE2 4.44Å; I56-Y213 WeakPolarHBondContact CD1-OH 3.39Å
57	Q	58.4	Low	59.9	Low	149 Å²	149	87.1 Å²	87.1	70%	0.696	45%	0.454	S	S	*	.			trans	-57.9	130.3	-167.5	-79.6	-175.8	-3.3	0	0	113.9	E53 H54 N59	E53-Q57 PolarHBondContact O-N 2.98Å; H54-Q57 PolarHBondContact O-N 2.96Å; Q57-N59 PolarHBondContact O-N 2.71Å
58	K	49.7	Very low	58.3	Low	177 Å²	177	87.9 Å²	87.9	77%	0.77	46%	0.457	S	S	*	.			trans	-63.2	104.7	176.6	-74	169.6	174.3	169.1	0	110.4	I56 T60	I56-K58 PolarHBondContact O-N 3.34Å; K58-T60 HydrophobicContact CB-CG2 4.47Å; K58-T60 PolarHBondContact O-N 2.04Å; K58-T60 VanDerWaalsContact O-N 3.07Å
59	N	42.8	Very low	56.5	Low	147 Å²	147	90.5 Å²	90.5	79%	0.786	46%	0.464	S	S	*	.			trans	-68.3	107.3	154.1	-112.9	-7	0	0	0	107.5	Q57 N61	Q57-N59 PolarHBondContact O-N 2.71Å; N59-N61 PolarHBondContact O-N 3.49Å; N59-N61 VanDerWaalsContact O-N 3.17Å
60	T	46.1	Very low	55.3	Low	123 Å²	123	96.2 Å²	96.2	76%	0.755	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-10.7	-164.3	29.5	0	0	0	0	115.2	K58	K58-T60 HydrophobicContact CB-CG2 4.47Å; K58-T60 PolarHBondContact O-N 2.04Å; K58-T60 VanDerWaalsContact O-N 3.07Å
61	N	43.7	Very low	54.5	Low	159 Å²	159	94.1 Å²	94.1	85%	0.85	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-8.8	-176.2	-77.4	-6.5	0	0	0	115.3	N59	N59-N61 PolarHBondContact O-N 3.49Å; N59-N61 VanDerWaalsContact O-N 3.17Å
62	E	39.4	Very low	53.8	Low	117 Å²	117	91.3 Å²	91.3	55%	0.547	45%	0.45	S	S	.	.	S	Bend	trans	-122.5	79.7	177.3	-73.8	-172.2	167.1	0	0	110.5	R64 F66	E62-R64 PolarHBondContact O-N 2.77Å; E62-F66 HydrophobicContact CB-CD2 3.77Å; E62-F66 HydrophobicContact CB-CE2 3.7Å; E62-F66 HydrophobicContact CG-CE2 4.34Å; E62-F66 WeakPolarHBondContact OE2-CE2 3.03Å
63	S	37.7	Very low	53.2	Low	93 Å²	93	95.4 Å²	95.4	65%	0.65	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	22.2	76.5	150.8	60.3	0	0	0	0	116.2	S65	S63-S65 WeakPolarHBondContact O-CB 3.31Å; S63-S65 PolarHBondContact O-N 3.02Å; S63-S65 PolarHBondContact O-OG 3.48Å
64	R	39	Very low	53	Low	226 Å²	226	91.3 Å²	91.3	85%	0.853	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	43	-2	156.5	-73	-170.7	-176.1	-173.5	2.5	120.8	E62	E62-R64 PolarHBondContact O-N 2.77Å
65	S	39.7	Very low	53	Low	35 Å²	35	86.6 Å²	86.6	25%	0.245	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-10.9	-162.6	49.2	0	0	0	0	113.7	S63 R181	S63-S65 WeakPolarHBondContact O-CB 3.31Å; S63-S65 PolarHBondContact O-N 3.02Å; S63-S65 PolarHBondContact O-OG 3.48Å; S65-R181 PolarHBondContact OG-NH1 2.77Å
66	F	38	Very low	53.1	Low	81 Å²	81	88.7 Å²	88.7	36%	0.355	44%	0.441	S	S	.	.	S	Bend	trans	-87.5	-2.7	-174.2	-72.8	-85.5	0	0	0	114.9	E62 Q68 Y70 R181	E62-F66 HydrophobicContact CB-CD2 3.77Å; E62-F66 HydrophobicContact CB-CE2 3.7Å; E62-F66 HydrophobicContact CG-CE2 4.34Å; E62-F66 WeakPolarHBondContact OE2-CE2 3.03Å; F66-Q68 PolarHBondContact O-N 3.07Å; F66-Y70 WeakPolarHBondContact O-CD2 2.95Å; F66-R181 VanDerWaalsContact CZ-NH2 3.28Å
67	G	40.7	Very low	53.4	Low	30 Å²	30	92.3 Å²	92.3	31%	0.309	46%	0.455	S	S	.	.	H	α-helix	trans	-77.5	-21.3	-167	0	0	0	0	0	116.4	A71	G67-A71 WeakPolarHBondContact O-CA 3.45Å; G67-A71 WeakPolarHBondContact O-CB 3.03Å; G67-A71 PolarHBondContact O-N 2.99Å
68	Q	49.5	Very low	54.6	Low	16 Å²	16	86.2 Å²	86.2	8%	0.075	43%	0.426	C	S	.	.	H	α-helix	trans	-78.8	-50.2	-160	-65.1	-162.3	-56.2	0	0	116.1	F66 Y70 A71 I72 Y188 Y207 C208	F66-Q68 PolarHBondContact O-N 3.07Å; Q68-Y70 VanDerWaalsContact C-N 3.31Å; Q68-A71 PolarHBondContact O-N 3.38Å; Q68-I72 WeakPolarHBondContact O-CB 3.07Å; Q68-I72 WeakPolarHBondContact O-CG1 3.14Å; Q68-I72 PolarHBondContact O-N 3.12Å; Q68-Y188 PolarHBondContact NE2-O 3.4Å; Q68-Y188 PolarHBondContact OE1-O 3.13Å; Q68-Y207 HydrophobicContact CG-CD1 3.82Å; Q68-Y207 HydrophobicContact CG-CG 4Å; Q68-Y207 VanDerWaalsContact NE2-CA 3.32Å; Q68-Y207 VanDerWaalsContact NE2-CB 3.26Å; Q68-Y207 VanDerWaalsContact NE2-CD1 3.32Å; Q68-C208 VanDerWaalsContact NE2-N 3.18Å
69	K	47.8	Very low	56.1	Low	96 Å²	96	77.8 Å²	77.8	42%	0.417	39%	0.389	S	S	.	.	H	α-helix	trans	-59.5	-49.7	177.8	179	176.7	178.8	179.7	0	109.1	A71 E73 Y188	K69-A71 PolarHBondContact O-N 3.42Å; K69-E73 WeakPolarHBondContact CE-OE1 3.29Å; K69-E73 VanDerWaalsContact CG-CD 3.5Å; K69-E73 HydrophobicContact CG-CG 4.3Å; K69-E73 WeakPolarHBondContact CG-OE1 3.25Å; K69-E73 IonicContact NZ-OE1 3.59Å; K69-E73 WeakPolarHBondContact O-CB 3.46Å; K69-E73 WeakPolarHBondContact O-CG 3.46Å; K69-E73 PolarHBondContact O-N 3.17Å; K69-Y188 HydrophobicContact CB-CE2 4.27Å; K69-Y188 HydrophobicContact CG-CE2 4.33Å
70	Y	55.8	Low	57.6	Low	163 Å²	163	73.8 Å²	73.8	64%	0.639	37%	0.373	S	S	*	.	H	α-helix	trans	-64.1	-41	178.5	-65.6	-71.7	0	0	0	112.9	F66 Q68 C74	F66-Y70 WeakPolarHBondContact O-CD2 2.95Å; Q68-Y70 VanDerWaalsContact C-N 3.31Å; Y70-C74 WeakPolarHBondContact O-CA 3.01Å; Y70-C74 WeakPolarHBondContact O-CB 3.16Å; Y70-C74 PolarHBondContact O-N 2.89Å
71	A	64.8	Low	59.1	Low	2 Å²	2	72.8 Å²	72.8	2%	0.017	36%	0.363	C	S	.	.	H	α-helix	trans	-67.6	-47.5	180	0	0	0	0	0	111.9	C55 G67 Q68 K69 C74 M75 T209	C55-A71 WeakPolarHBondContact O-CA 3.38Å; C55-A71 VanDerWaalsContact O-CB 3.3Å; C55-A71 WeakPolarHBondContact O-CB 3.49Å; G67-A71 WeakPolarHBondContact O-CA 3.45Å; G67-A71 WeakPolarHBondContact O-CB 3.03Å; G67-A71 PolarHBondContact O-N 2.99Å; Q68-A71 PolarHBondContact O-N 3.38Å; K69-A71 PolarHBondContact O-N 3.42Å; A71-C74 PolarHBondContact O-N 2.82Å; A71-M75 WeakPolarHBondContact O-CB 3.3Å; A71-M75 WeakPolarHBondContact O-CG 3.49Å; A71-M75 PolarHBondContact O-N 3.29Å; A71-T209 HydrophobicContact CB-CG2 4.31Å
72	I	67.2	Low	60.8	Low	17 Å²	17	69.5 Å²	69.5	9%	0.087	34%	0.341	C	S	.	.	H	α-helix	trans	-67.5	-45	-179.9	-65	-59	0	0	0	110.8	Q68 C74 M75 D76 L88 I117	Q68-I72 WeakPolarHBondContact O-CB 3.07Å; Q68-I72 WeakPolarHBondContact O-CG1 3.14Å; Q68-I72 PolarHBondContact O-N 3.12Å; I72-C74 VanDerWaalsContact C-N 3.28Å; I72-C74 PolarHBondContact O-N 3.23Å; I72-M75 PolarHBondContact O-N 2.77Å; I72-D76 WeakPolarHBondContact O-CB 3.49Å; I72-D76 PolarHBondContact O-N 2.89Å; I72-L88 HydrophobicContact CD1-CD2 4.18Å; I72-L88 HydrophobicContact CG2-CD2 3.85Å; I72-I117 HydrophobicContact CD1-CD1 3.89Å; I72-I117 HydrophobicContact CG1-CD1 4.24Å; I72-I117 HydrophobicContact CG2-CD1 3.71Å
73	E	65.7	Low	62.6	Low	87 Å²	87	64.2 Å²	64.2	41%	0.407	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-38.3	174.8	-71.5	176.5	168.9	0	0	111.3	K69 K77	K69-E73 WeakPolarHBondContact CE-OE1 3.29Å; K69-E73 VanDerWaalsContact CG-CD 3.5Å; K69-E73 HydrophobicContact CG-CG 4.3Å; K69-E73 WeakPolarHBondContact CG-OE1 3.25Å; K69-E73 IonicContact NZ-OE1 3.59Å; K69-E73 WeakPolarHBondContact O-CB 3.46Å; K69-E73 WeakPolarHBondContact O-CG 3.46Å; K69-E73 PolarHBondContact O-N 3.17Å; E73-K77 WeakPolarHBondContact O-CB 3.2Å; E73-K77 PolarHBondContact O-N 2.97Å
74	C	72	Confident	63.9	Low	35 Å²	35	60.7 Å²	60.7	24%	0.236	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-42.3	174.4	178.9	0	0	0	0	111.8	C55 Y70 A71 I72 Y78	C55-C74 VanDerWaalsContact CA-SG 3.5Å; C55-C74 HydrophobicContact CB-CB 3.57Å; C55-C74 WeakPolarHBondContact CB-SG 2.95Å; C55-C74 VanDerWaalsContact SG-C 3.55Å; C55-C74 WeakPolarHBondContact SG-CB 3.44Å; C55-C74 CovalentContact SG-SG 2.04Å; C55-C74 PolarHBondContact SG-SG 3.41Å; Y70-C74 WeakPolarHBondContact O-CA 3.01Å; Y70-C74 WeakPolarHBondContact O-CB 3.16Å; Y70-C74 PolarHBondContact O-N 2.89Å; A71-C74 PolarHBondContact O-N 2.82Å; I72-C74 VanDerWaalsContact C-N 3.28Å; I72-C74 PolarHBondContact O-N 3.23Å; C74-Y78 VanDerWaalsContact O-CB 3.24Å; C74-Y78 WeakPolarHBondContact O-CB 3.49Å; C74-Y78 PolarHBondContact O-N 3.4Å
75	M	77.9	Confident	65.4	Low	2 Å²	2	52.9 Å²	52.9	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-41.1	177.2	-72.1	174	-172.6	0	0	112.3	V52 C55 I56 A71 I72 Y78 C79 L88 L113 Y213 V216	V52-M75 HydrophobicContact CB-CG 4.24Å; V52-M75 HydrophobicContact CG2-CE 4.17Å; V52-M75 HydrophobicContact CG2-CG 4.36Å; C55-M75 HydrophobicContact CB-CE 4.43Å; C55-M75 HydrophobicContact CB-CG 4.3Å; I56-M75 HydrophobicContact CD1-CE 3.95Å; I56-M75 HydrophobicContact CG1-CE 3.84Å; A71-M75 WeakPolarHBondContact O-CB 3.3Å; A71-M75 WeakPolarHBondContact O-CG 3.49Å; A71-M75 PolarHBondContact O-N 3.29Å; I72-M75 PolarHBondContact O-N 2.77Å; M75-Y78 WeakPolarHBondContact O-CB 3.19Å; M75-Y78 PolarHBondContact O-N 3.37Å; M75-C79 PolarHBondContact O-N 3.23Å; M75-C79 PolarHBondContact O-SG 2.95Å; M75-L88 HydrophobicContact CB-CD1 4.03Å; M75-L88 HydrophobicContact CB-CD2 4.31Å; M75-L113 HydrophobicContact SD-CD2 4.19Å; M75-Y213 HydrophobicContact CE-CE2 4.36Å; M75-Y213 WeakPolarHBondContact CE-OH 3.5Å; M75-V216 HydrophobicContact CE-CG2 4.36Å; M75-V216 HydrophobicContact SD-CG1 4.47Å; M75-V216 HydrophobicContact SD-CG2 4.02Å
76	D	74	Confident	67	Low	56 Å²	56	51.6 Å²	51.6	30%	0.299	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-45.1	175.1	-171.2	55.5	0	0	0	111	I72 Y78 C79 S80 L88	I72-D76 WeakPolarHBondContact O-CB 3.49Å; I72-D76 PolarHBondContact O-N 2.89Å; D76-Y78 VanDerWaalsContact C-N 3.3Å; D76-Y78 PolarHBondContact O-N 3.38Å; D76-C79 PolarHBondContact O-N 2.03Å; D76-S80 WeakPolarHBondContact O-CB 3.47Å; D76-S80 PolarHBondContact O-N 3.38Å; D76-L88 HydrophobicContact CB-CB 3.89Å; D76-L88 WeakPolarHBondContact OD1-CB 3.23Å; D76-L88 PolarHBondContact OD1-N 3.06Å
77	K	72.2	Confident	68.6	Low	127 Å²	127	48.3 Å²	48.3	55%	0.552	25%	0.246	S	C	*	.	H	α-helix	trans	-57.9	-43.6	171.1	-177.4	175.8	175.6	56.5	0	111.4	E73 S80 D81	E73-K77 WeakPolarHBondContact O-CB 3.2Å; E73-K77 PolarHBondContact O-N 2.97Å; K77-S80 PolarHBondContact O-N 3.01Å; K77-D81 WeakPolarHBondContact CE-OD2 3.06Å; K77-D81 WeakPolarHBondContact CG-OD2 3.12Å; K77-D81 IonicContact NZ-OD1 3.49Å; K77-D81 IonicContact NZ-OD2 2.6Å; K77-D81 PolarHBondContact NZ-OD2 2.03Å; K77-D81 WeakPolarHBondContact O-CB 3.18Å; K77-D81 PolarHBondContact O-N 2.88Å
78	Y	82	Confident	70.3	Confident	21 Å²	21	47.5 Å²	47.5	8%	0.082	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-48	176.9	-177.2	-86.8	0	0	0	111.5	W34 V47 E51 V52 C74 M75 D76 S80 D81 K82	W34-Y78 HydrophobicContact CH2-CE1 4.45Å; W34-Y78 WeakPolarHBondContact CH2-OH 3.22Å; V47-Y78 HydrophobicContact CG1-CE1 3.77Å; E51-Y78 HydrophobicContact CB-CE1 4.47Å; E51-Y78 WeakPolarHBondContact CB-OH 3.21Å; E51-Y78 PolarHBondContact OE2-OH 3.3Å; V52-Y78 HydrophobicContact CG1-CD1 3.5Å; V52-Y78 VanDerWaalsContact CG1-CD1 3.5Å; V52-Y78 HydrophobicContact CG1-CD2 3.95Å; V52-Y78 HydrophobicContact CG1-CE1 3.84Å; V52-Y78 HydrophobicContact CG1-CE2 4.25Å; V52-Y78 HydrophobicContact CG1-CG 3.57Å; C74-Y78 VanDerWaalsContact O-CB 3.24Å; C74-Y78 WeakPolarHBondContact O-CB 3.49Å; C74-Y78 PolarHBondContact O-N 3.4Å; M75-Y78 WeakPolarHBondContact O-CB 3.19Å; M75-Y78 PolarHBondContact O-N 3.37Å; D76-Y78 VanDerWaalsContact C-N 3.3Å; D76-Y78 PolarHBondContact O-N 3.38Å; Y78-S80 VanDerWaalsContact C-N 3.34Å; Y78-S80 PolarHBondContact O-N 3.3Å; Y78-D81 PolarHBondContact O-N 3.46Å; Y78-K82 HydrophobicContact CD1-CG 4.08Å; Y78-K82 HydrophobicContact CD2-CG 4.27Å; Y78-K82 HydrophobicContact CE1-CB 4.34Å; Y78-K82 HydrophobicContact CE1-CG 3.72Å; Y78-K82 HydrophobicContact CE2-CD 4.46Å; Y78-K82 HydrophobicContact CE2-CG 3.93Å; Y78-K82 HydrophobicContact CG-CG 4.32Å; Y78-K82 WeakPolarHBondContact O-CB 3Å; Y78-K82 VanDerWaalsContact O-CG 3.25Å; Y78-K82 WeakPolarHBondContact O-CG 3.47Å; Y78-K82 PolarHBondContact O-N 3.28Å
79	C	82.2	Confident	71.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.1	-46.3	175.6	-64.3	0	0	0	0	111	M75 D76 D81 K82 L83 G86 Y87 C218	M75-C79 PolarHBondContact O-N 3.23Å; M75-C79 PolarHBondContact O-SG 2.95Å; D76-C79 PolarHBondContact O-N 2.03Å; C79-D81 VanDerWaalsContact C-N 3.34Å; C79-D81 PolarHBondContact O-N 2.79Å; C79-K82 PolarHBondContact O-N 3.34Å; C79-L83 WeakPolarHBondContact O-CB 3.37Å; C79-L83 PolarHBondContact O-N 2.87Å; C79-G86 WeakPolarHBondContact O-CA 3.39Å; C79-Y87 VanDerWaalsContact CB-C 3.44Å; C79-C218 HydrophobicContact CB-CB 3.62Å; C79-C218 WeakPolarHBondContact CB-SG 3.27Å; C79-C218 WeakPolarHBondContact SG-CB 3.11Å; C79-C218 CovalentContact SG-SG 2.03Å; C79-C218 PolarHBondContact SG-SG 3.4Å
80	S	74.7	Confident	72	Confident	63 Å²	63	43.5 Å²	43.5	44%	0.441	22%	0.218	S	C	.	.	H	α-helix	trans	-60.8	-39.8	177.6	178.7	0	0	0	0	113	D76 K77 Y78 G86	D76-S80 WeakPolarHBondContact O-CB 3.47Å; D76-S80 PolarHBondContact O-N 3.38Å; K77-S80 PolarHBondContact O-N 3.01Å; Y78-S80 VanDerWaalsContact C-N 3.34Å; Y78-S80 PolarHBondContact O-N 3.3Å; S80-G86 WeakPolarHBondContact CA-O 3.4Å; S80-G86 WeakPolarHBondContact CB-O 3.49Å
81	D	77.4	Confident	72	Confident	102 Å²	102	37.2 Å²	37.2	55%	0.545	19%	0.193	S	C	.	.	H	α-helix	trans	-78.6	-28.3	-177.2	-69.1	-12.7	0	0	0	111.8	K77 Y78 C79	K77-D81 WeakPolarHBondContact CE-OD2 3.06Å; K77-D81 WeakPolarHBondContact CG-OD2 3.12Å; K77-D81 IonicContact NZ-OD1 3.49Å; K77-D81 IonicContact NZ-OD2 2.6Å; K77-D81 PolarHBondContact NZ-OD2 2.03Å; K77-D81 WeakPolarHBondContact O-CB 3.18Å; K77-D81 PolarHBondContact O-N 2.88Å; Y78-D81 PolarHBondContact O-N 3.46Å; C79-D81 VanDerWaalsContact C-N 3.34Å; C79-D81 PolarHBondContact O-N 2.79Å
82	K	79.1	Confident	71.4	Confident	91 Å²	91	38.4 Å²	38.4	40%	0.396	20%	0.199	S	C	.	.	H	α-helix	trans	-98.3	-19.4	-175.6	-63.4	-59.8	-175.6	-177.6	0	115.1	Y78 C79	Y78-K82 HydrophobicContact CD1-CG 4.08Å; Y78-K82 HydrophobicContact CD2-CG 4.27Å; Y78-K82 HydrophobicContact CE1-CB 4.34Å; Y78-K82 HydrophobicContact CE1-CG 3.72Å; Y78-K82 HydrophobicContact CE2-CD 4.46Å; Y78-K82 HydrophobicContact CE2-CG 3.93Å; Y78-K82 HydrophobicContact CG-CG 4.32Å; Y78-K82 WeakPolarHBondContact O-CB 3Å; Y78-K82 VanDerWaalsContact O-CG 3.25Å; Y78-K82 WeakPolarHBondContact O-CG 3.47Å; Y78-K82 PolarHBondContact O-N 3.28Å; C79-K82 PolarHBondContact O-N 3.34Å
83	L	77.2	Confident	70.4	Confident	6 Å²	6	38.2 Å²	38.2	3%	0.031	20%	0.199	C	C	.	.	S	Bend	trans	-127.9	145.3	-174	-61.8	158.6	0	0	0	110.8	W29 C79 V85 G86 C218 H220	W29-L83 HydrophobicContact CD2-CD2 3.64Å; W29-L83 HydrophobicContact CE3-CD2 4.32Å; W29-L83 HydrophobicContact CG-CD2 4.02Å; W29-L83 HydrophobicContact CH2-CD2 4.24Å; W29-L83 HydrophobicContact CZ2-CD2 3.52Å; C79-L83 WeakPolarHBondContact O-CB 3.37Å; C79-L83 PolarHBondContact O-N 2.87Å; L83-V85 PolarHBondContact O-N 3.44Å; L83-G86 PolarHBondContact O-N 3.42Å; L83-C218 HydrophobicContact CD1-CB 3.07Å; L83-H220 HydrophobicContact CB-CB 3.67Å; L83-H220 HydrophobicContact CG-CB 4.49Å
84	P	65.5	Low	69.3	Low	19 Å²	19	37.5 Å²	37.5	12%	0.123	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	110.9	-178.5	23.8	-30.3	0	0	0	109.9	W29 G86 H220 E221 G222	W29-P84 HydrophobicContact CH2-CG 3.76Å; W29-P84 VanDerWaalsContact CZ2-CD 3.49Å; W29-P84 HydrophobicContact CZ2-CG 4.33Å; P84-G86 PolarHBondContact O-N 2.88Å; P84-H220 WeakPolarHBondContact O-CB 3.23Å; P84-E221 PolarHBondContact O-N 3.31Å; P84-G222 WeakPolarHBondContact CG-O 3.25Å
85	V	69.2	Low	67.9	Low	62 Å²	62	40.3 Å²	40.3	38%	0.376	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	42	-172.8	-128.4	0	0	0	0	111.9	L83 R140 E221	L83-V85 PolarHBondContact O-N 3.44Å; V85-R140 VanDerWaalsContact CG1-NH2 3.33Å; V85-E221 HydrophobicContact CB-CG 4.32Å; V85-E221 HydrophobicContact CG2-CB 4.14Å; V85-E221 HydrophobicContact CG2-CG 4.23Å
86	G	74.6	Confident	66.2	Low	7 Å²	7	46.1 Å²	46.1	7%	0.072	25%	0.245	C	C	.	.			trans	-66.9	150.5	-179.4	0	0	0	0	0	112.9	C79 S80 L83 P84 G219	C79-G86 WeakPolarHBondContact O-CA 3.39Å; S80-G86 WeakPolarHBondContact CA-O 3.4Å; S80-G86 WeakPolarHBondContact CB-O 3.49Å; L83-G86 PolarHBondContact O-N 3.42Å; P84-G86 PolarHBondContact O-N 2.88Å; G86-G219 CarbonylContact C-O 3.5Å; G86-G219 WeakPolarHBondContact CA-O 3.35Å
87	Y	72.2	Confident	64.8	Low	13 Å²	13	47 Å²	47	5%	0.051	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	155.3	176	56.8	-85.2	0	0	0	109.4	S42 C79 W89 R140 C218 G219	S42-Y87 WeakPolarHBondContact CB-OH 3.22Å; S42-Y87 PolarHBondContact OG-OH 3.44Å; C79-Y87 VanDerWaalsContact CB-C 3.44Å; Y87-W89 PolarHBondContact O-N 2.98Å; Y87-W89 VanDerWaalsContact O-N 3.16Å; Y87-R140 HydrophobicContact CD1-CB 3.47Å; Y87-R140 VanDerWaalsContact CD1-CB 3.47Å; Y87-R140 HydrophobicContact CD1-CG 4.42Å; Y87-R140 HydrophobicContact CD2-CB 4.38Å; Y87-R140 HydrophobicContact CE1-CB 3.59Å; Y87-R140 HydrophobicContact CE2-CB 4.46Å; Y87-R140 VanDerWaalsContact CE2-O 3.31Å; Y87-R140 WeakPolarHBondContact CE2-O 3.34Å; Y87-R140 HydrophobicContact CG-CB 3.9Å; Y87-R140 PolarHBondContact OH-O 2.97Å; Y87-R140 VanDerWaalsContact OH-O 3.12Å; Y87-C218 CarbonylContact O-C 3.59Å; Y87-C218 WeakPolarHBondContact O-CA 3.42Å; Y87-G219 WeakPolarHBondContact CD1-O 3.34Å; Y87-G219 WeakPolarHBondContact CE1-O 2.99Å; Y87-G219 PolarHBondContact N-O 2.82Å; Y87-G219 PolarHBondContact O-N 3.09Å
88	L	75.3	Confident	63.4	Low	12 Å²	12	43.3 Å²	43.3	6%	0.063	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	117.4	172.9	-174	62.8	0	0	0	109.2	I72 M75 D76 T90 I117 V216	I72-L88 HydrophobicContact CD1-CD2 4.18Å; I72-L88 HydrophobicContact CG2-CD2 3.85Å; M75-L88 HydrophobicContact CB-CD1 4.03Å; M75-L88 HydrophobicContact CB-CD2 4.31Å; D76-L88 HydrophobicContact CB-CB 3.89Å; D76-L88 WeakPolarHBondContact OD1-CB 3.23Å; D76-L88 PolarHBondContact OD1-N 3.06Å; L88-T90 HydrophobicContact CD2-CG2 4.43Å; L88-T90 HydrophobicContact CG-CG2 4.19Å; L88-I117 HydrophobicContact CD2-CD1 4.12Å; L88-V216 HydrophobicContact CD1-CG1 3.35Å
89	W	72	Confident	61.6	Low	9 Å²	9	47.5 Å²	47.5	3%	0.034	26%	0.255	C	S	.	.			trans	-89.3	125	-179.2	-169.7	88	0	0	0	109.9	F37 Y39 V44 Y87 W91 W109 T217	F37-W89 HydrophobicContact CZ-CH2 4.05Å; F37-W89 HydrophobicContact CZ-CZ2 4.32Å; Y39-W89 HydrophobicContact CD1-CZ2 4.12Å; Y39-W89 HydrophobicContact CG-CZ2 4.18Å; V44-W89 HydrophobicContact CG1-CB 4.3Å; V44-W89 HydrophobicContact CG1-CD2 3.6Å; V44-W89 HydrophobicContact CG1-CE3 3.88Å; V44-W89 HydrophobicContact CG1-CG 3.86Å; V44-W89 HydrophobicContact CG1-CH2 4.45Å; V44-W89 HydrophobicContact CG1-CZ2 4.25Å; V44-W89 HydrophobicContact CG1-CZ3 4.28Å; V44-W89 HydrophobicContact CG2-CD2 4.08Å; V44-W89 HydrophobicContact CG2-CG 4.16Å; V44-W89 HydrophobicContact CG2-CZ2 3.92Å; Y87-W89 PolarHBondContact O-N 2.98Å; Y87-W89 VanDerWaalsContact O-N 3.16Å; W89-W91 HydrophobicContact CD2-CB 4.29Å; W89-W91 HydrophobicContact CH2-CB 4.35Å; W89-W91 AromaticContact CH2-CE3 3.74Å; W89-W91 HydrophobicContact CH2-CE3 3.74Å; W89-W91 WeakPolarHBondContact CH2-O 3.46Å; W89-W91 HydrophobicContact CZ2-CB 3.82Å; W89-W91 HydrophobicContact CZ2-CD2 4.25Å; W89-W91 AromaticContact CZ2-CE3 3.51Å; W89-W91 HydrophobicContact CZ2-CE3 3.51Å; W89-W91 HydrophobicContact CZ2-CG 4.42Å; W89-W91 HydrophobicContact CZ2-CZ3 4.4Å; W89-W91 WeakPolarHBondContact CZ3-O 3.15Å; W89-W109 HydrophobicContact CH2-CZ3 4.48Å; W89-W109 HydrophobicContact CZ3-CZ3 4.2Å; W89-T217 WeakPolarHBondContact CA-O 3Å; W89-T217 WeakPolarHBondContact CB-O 3.4Å; W89-T217 HydrophobicContact CE3-CG2 4.23Å; W89-T217 VanDerWaalsContact CE3-OG1 3.25Å; W89-T217 HydrophobicContact CZ3-CG2 4.45Å; W89-T217 PolarHBondContact N-O 2.86Å; W89-T217 PolarHBondContact O-OG1 3.47Å
90	T	60.5	Low	59.8	Low	19 Å²	19	54.8 Å²	54.8	12%	0.117	29%	0.293	C	S	.	.			trans	-127.1	6.2	-168.9	46.5	0	0	0	0	112.7	L88 G115 I117	L88-T90 HydrophobicContact CD2-CG2 4.43Å; L88-T90 HydrophobicContact CG-CG2 4.19Å; T90-G115 WeakPolarHBondContact CB-O 3.44Å; T90-G115 WeakPolarHBondContact CG2-O 3.34Å; T90-G115 CarbonylContact O-C 3.49Å; T90-I117 HydrophobicContact CG2-CD1 3.86Å; T90-I117 HydrophobicContact CG2-CG1 4.15Å
91	W	57.3	Low	58.5	Low	32 Å²	32	54.5 Å²	54.5	12%	0.121	29%	0.289	C	S	.	.			trans	-75.6	144.7	-175	-175	81.7	0	0	0	111.9	Y39 W89 P93 E97	Y39-W91 HydrophobicContact CD1-CD2 4.37Å; Y39-W91 HydrophobicContact CD1-CE3 4.08Å; Y39-W91 HydrophobicContact CD1-CZ3 4.27Å; Y39-W91 HydrophobicContact CD2-CE3 4.19Å; Y39-W91 HydrophobicContact CD2-CH2 4.12Å; Y39-W91 AromaticContact CD2-CZ3 3.62Å; Y39-W91 HydrophobicContact CD2-CZ3 3.62Å; Y39-W91 AromaticContact CE1-CD2 3.61Å; Y39-W91 HydrophobicContact CE1-CD2 3.61Å; Y39-W91 AromaticContact CE1-CE2 3.82Å; Y39-W91 AromaticContact CE1-CE3 3.61Å; Y39-W91 HydrophobicContact CE1-CE3 3.61Å; Y39-W91 HydrophobicContact CE1-CG 4.25Å; Y39-W91 AromaticContact CE1-CH2 3.9Å; Y39-W91 HydrophobicContact CE1-CH2 3.9Å; Y39-W91 HydrophobicContact CE1-CZ2 4.02Å; Y39-W91 AromaticContact CE1-CZ3 3.72Å; Y39-W91 HydrophobicContact CE1-CZ3 3.72Å; Y39-W91 HydrophobicContact CE2-CD2 4.43Å; Y39-W91 AromaticContact CE2-CE3 3.78Å; Y39-W91 HydrophobicContact CE2-CE3 3.78Å; Y39-W91 AromaticContact CE2-CH2 3.06Å; Y39-W91 HydrophobicContact CE2-CH2 3.06Å; Y39-W91 AromaticContact CE2-CZ2 3.92Å; Y39-W91 HydrophobicContact CE2-CZ2 3.92Å; Y39-W91 AromaticContact CE2-CZ3 3Å; Y39-W91 HydrophobicContact CE2-CZ3 3Å; Y39-W91 HydrophobicContact CG-CE3 4.37Å; Y39-W91 HydrophobicContact CG-CZ3 4.25Å; Y39-W91 AromaticContact CZ-CD2 3.71Å; Y39-W91 AromaticContact CZ-CE2 3.58Å; Y39-W91 AromaticContact CZ-CE3 3.52Å; Y39-W91 AromaticContact CZ-CH2 2.94Å; Y39-W91 AromaticContact CZ-CZ2 3.29Å; Y39-W91 AromaticContact CZ-CZ3 3.1Å; Y39-W91 VanDerWaalsContact OH-CE2 3.25Å; Y39-W91 WeakPolarHBondContact OH-CH2 3.35Å; Y39-W91 WeakPolarHBondContact OH-CZ2 3.28Å; W89-W91 HydrophobicContact CD2-CB 4.29Å; W89-W91 HydrophobicContact CH2-CB 4.35Å; W89-W91 AromaticContact CH2-CE3 3.74Å; W89-W91 HydrophobicContact CH2-CE3 3.74Å; W89-W91 WeakPolarHBondContact CH2-O 3.46Å; W89-W91 HydrophobicContact CZ2-CB 3.82Å; W89-W91 HydrophobicContact CZ2-CD2 4.25Å; W89-W91 AromaticContact CZ2-CE3 3.51Å; W89-W91 HydrophobicContact CZ2-CE3 3.51Å; W89-W91 HydrophobicContact CZ2-CG 4.42Å; W89-W91 HydrophobicContact CZ2-CZ3 4.4Å; W89-W91 WeakPolarHBondContact CZ3-O 3.15Å; W91-P93 HydrophobicContact CE3-CB 4.24Å; W91-P93 HydrophobicContact CE3-CG 4.17Å; W91-P93 HydrophobicContact CH2-CB 3.18Å; W91-P93 HydrophobicContact CH2-CG 3.99Å; W91-P93 VanDerWaalsContact CZ2-CA 3.47Å; W91-P93 HydrophobicContact CZ2-CB 4.13Å; W91-P93 HydrophobicContact CZ3-CB 3.22Å; W91-P93 HydrophobicContact CZ3-CG 3.46Å; W91-P93 VanDerWaalsContact CZ3-CG 3.46Å; W91-P93 VanDerWaalsContact CZ3-N 3.29Å; W91-E97 WeakPolarHBondContact CH2-OE2 3.13Å; W91-E97 VanDerWaalsContact CZ2-OE2 3.26Å; W91-E97 WeakPolarHBondContact CZ2-OE2 3.48Å
92	I	51.1	Low	57	Low	27 Å²	27	51.6 Å²	51.6	14%	0.138	27%	0.271	C	S	.	.			trans	-124.3	117.8	179.4	-49.6	-179	0	0	0	108	H114 M191 I193 L200	I92-H114 HydrophobicContact CD1-CB 4.16Å; I92-H114 HydrophobicContact CG1-CB 4.19Å; I92-M191 HydrophobicContact CD1-CE 3.84Å; I92-I193 HydrophobicContact CG2-CD1 4.27Å; I92-L200 HydrophobicContact CD1-CD1 4.23Å; I92-L200 HydrophobicContact CD1-CD2 3.57Å; I92-L200 HydrophobicContact CG2-CD1 3.85Å; I92-L200 HydrophobicContact CG2-CD2 4.09Å; I92-L200 HydrophobicContact CG2-CG 4.45Å
93	P	45.7	Very low	55.5	Low	12 Å²	12	56 Å²	56	8%	0.078	29%	0.293	C	S	.	.			trans	-61.4	141.6	174.8	12.8	-15.6	0	0	0	112.9	W91 E98 F102	W91-P93 HydrophobicContact CE3-CB 4.24Å; W91-P93 HydrophobicContact CE3-CG 4.17Å; W91-P93 HydrophobicContact CH2-CB 3.18Å; W91-P93 HydrophobicContact CH2-CG 3.99Å; W91-P93 VanDerWaalsContact CZ2-CA 3.47Å; W91-P93 HydrophobicContact CZ2-CB 4.13Å; W91-P93 HydrophobicContact CZ3-CB 3.22Å; W91-P93 HydrophobicContact CZ3-CG 3.46Å; W91-P93 VanDerWaalsContact CZ3-CG 3.46Å; W91-P93 VanDerWaalsContact CZ3-N 3.29Å; P93-E98 HydrophobicContact CB-CB 4.49Å; P93-E98 HydrophobicContact CB-CG 3.46Å; P93-E98 VanDerWaalsContact CB-CG 3.46Å; P93-E98 HydrophobicContact CG-CG 3.62Å; P93-F102 HydrophobicContact CB-CE2 4.44Å; P93-F102 HydrophobicContact CG-CE2 3.72Å; P93-F102 HydrophobicContact CG-CZ 4.07Å
94	N	42.7	Very low	54.2	Low	73 Å²	73	60.2 Å²	60.2	39%	0.39	32%	0.323	S	S	.	.			trans	-69.3	152.8	166.8	78.3	46.7	0	0	0	108.8	D96 E97 E98	N94-D96 PolarHBondContact O-N 2.74Å; N94-D96 VanDerWaalsContact O-N 3.1Å; N94-D96 WeakPolarHBondContact OD1-CA 3.24Å; N94-D96 WeakPolarHBondContact OD1-CB 3.32Å; N94-D96 PolarHBondContact OD1-N 2.89Å; N94-E97 WeakPolarHBondContact ND2-CG 3.27Å; N94-E97 PolarHBondContact ND2-OE1 3.05Å; N94-E97 VanDerWaalsContact ND2-OE1 3.13Å; N94-E97 CarbonylContact O-C 3.58Å; N94-E97 PolarHBondContact O-N 3.35Å; N94-E97 WeakPolarHBondContact OD1-CB 3.49Å; N94-E97 PolarHBondContact OD1-N 3.31Å; N94-E98 WeakPolarHBondContact O-CG 3.35Å; N94-E98 PolarHBondContact O-N 2.01Å
95	V	42.9	Very low	53.3	Low	94 Å²	94	64.5 Å²	64.5	57%	0.57	34%	0.338	S	S	*	.	H	α-helix	trans	-55.6	-32.4	-174.7	-178.4	0	0	0	0	112.8	E98 L99	V95-E98 WeakPolarHBondContact O-CB 3.04Å; V95-L99 WeakPolarHBondContact O-CG 3.01Å; V95-L99 PolarHBondContact O-N 3.31Å
96	D	43.1	Very low	52.3	Low	123 Å²	123	70.1 Å²	70.1	66%	0.658	37%	0.365	S	S	*	.	H	α-helix	trans	-75.9	-37.7	179.4	-60	-43.1	0	0	0	112.2	N94 L100	N94-D96 PolarHBondContact O-N 2.74Å; N94-D96 VanDerWaalsContact O-N 3.1Å; N94-D96 WeakPolarHBondContact OD1-CA 3.24Å; N94-D96 WeakPolarHBondContact OD1-CB 3.32Å; N94-D96 PolarHBondContact OD1-N 2.89Å; D96-L100 PolarHBondContact O-N 2.99Å
97	E	43	Very low	51.2	Low	76 Å²	76	71.2 Å²	71.2	36%	0.355	37%	0.367	S	S	.	.	H	α-helix	trans	-72.4	-34.5	173.1	-77.8	177	-164.5	0	0	111.3	W91 N94 L99 L100 V101	W91-E97 WeakPolarHBondContact CH2-OE2 3.13Å; W91-E97 VanDerWaalsContact CZ2-OE2 3.26Å; W91-E97 WeakPolarHBondContact CZ2-OE2 3.48Å; N94-E97 WeakPolarHBondContact ND2-CG 3.27Å; N94-E97 PolarHBondContact ND2-OE1 3.05Å; N94-E97 VanDerWaalsContact ND2-OE1 3.13Å; N94-E97 CarbonylContact O-C 3.58Å; N94-E97 PolarHBondContact O-N 3.35Å; N94-E97 WeakPolarHBondContact OD1-CB 3.49Å; N94-E97 PolarHBondContact OD1-N 3.31Å; E97-L99 VanDerWaalsContact C-N 3.34Å; E97-L99 PolarHBondContact O-N 3.03Å; E97-L100 PolarHBondContact O-N 3.37Å; E97-V101 WeakPolarHBondContact O-CG2 3.14Å; E97-V101 PolarHBondContact O-N 2.81Å
98	E	44.4	Very low	50.6	Low	48 Å²	48	76.6 Å²	76.6	22%	0.224	39%	0.393	C	S	.	.	H	α-helix	trans	-54.7	-51.4	171.9	-76.3	-156.4	146.4	0	0	110	P93 N94 V95 L100 V101 F102	P93-E98 HydrophobicContact CB-CB 4.49Å; P93-E98 HydrophobicContact CB-CG 3.46Å; P93-E98 VanDerWaalsContact CB-CG 3.46Å; P93-E98 HydrophobicContact CG-CG 3.62Å; N94-E98 WeakPolarHBondContact O-CG 3.35Å; N94-E98 PolarHBondContact O-N 2.01Å; V95-E98 WeakPolarHBondContact O-CB 3.04Å; E98-L100 VanDerWaalsContact C-N 3.26Å; E98-L100 PolarHBondContact O-N 2.94Å; E98-V101 PolarHBondContact O-N 2.83Å; E98-F102 VanDerWaalsContact CA-CD2 3.45Å; E98-F102 HydrophobicContact CB-CD2 3.67Å; E98-F102 HydrophobicContact CB-CE2 4Å; E98-F102 HydrophobicContact CG-CD2 3.96Å; E98-F102 HydrophobicContact CG-CE2 3.77Å; E98-F102 WeakPolarHBondContact O-CA 3.42Å; E98-F102 WeakPolarHBondContact O-CB 3.27Å; E98-F102 WeakPolarHBondContact O-CD2 3.35Å; E98-F102 WeakPolarHBondContact O-CG 3.32Å; E98-F102 PolarHBondContact O-N 2.9Å
99	L	43.3	Very low	49.8	Very low	109 Å²	109	77.5 Å²	77.5	57%	0.571	40%	0.396	S	S	*	.	H	α-helix	trans	-61.7	-34.6	-178.1	-73.6	167.6	0	0	0	112.8	V95 E97	V95-L99 WeakPolarHBondContact O-CG 3.01Å; V95-L99 PolarHBondContact O-N 3.31Å; E97-L99 VanDerWaalsContact C-N 3.34Å; E97-L99 PolarHBondContact O-N 3.03Å
100	L	44.5	Very low	49	Very low	153 Å²	153	80.1 Å²	80.1	80%	0.801	42%	0.415	S	S	*	.	H	α-helix	trans	-77.7	-34.4	-179.4	-70.8	168.8	0	0	0	113.1	D96 E97 E98	D96-L100 PolarHBondContact O-N 2.99Å; E97-L100 PolarHBondContact O-N 3.37Å; E98-L100 VanDerWaalsContact C-N 3.26Å; E98-L100 PolarHBondContact O-N 2.94Å
101	V	46.8	Very low	49.1	Very low	58 Å²	58	80.8 Å²	80.8	35%	0.352	42%	0.418	S	S	.	.	H	α-helix	trans	-85.8	-31.5	179.1	-180	0	0	0	0	111.7	E97 E98	E97-V101 WeakPolarHBondContact O-CG2 3.14Å; E97-V101 PolarHBondContact O-N 2.81Å; E98-V101 PolarHBondContact O-N 2.83Å
102	F	47	Very low	49.4	Very low	40 Å²	40	79.6 Å²	79.6	18%	0.175	42%	0.415	C	S	.	.	H	α-helix	trans	-98.2	-0.5	-164.2	-67.4	-52.8	0	0	0	118	P93 E98 S104 Y105 W109	P93-F102 HydrophobicContact CB-CE2 4.44Å; P93-F102 HydrophobicContact CG-CE2 3.72Å; P93-F102 HydrophobicContact CG-CZ 4.07Å; E98-F102 VanDerWaalsContact CA-CD2 3.45Å; E98-F102 HydrophobicContact CB-CD2 3.67Å; E98-F102 HydrophobicContact CB-CE2 4Å; E98-F102 HydrophobicContact CG-CD2 3.96Å; E98-F102 HydrophobicContact CG-CE2 3.77Å; E98-F102 WeakPolarHBondContact O-CA 3.42Å; E98-F102 WeakPolarHBondContact O-CB 3.27Å; E98-F102 WeakPolarHBondContact O-CD2 3.35Å; E98-F102 WeakPolarHBondContact O-CG 3.32Å; E98-F102 PolarHBondContact O-N 2.9Å; F102-S104 PolarHBondContact O-N 3.02Å; F102-Y105 PolarHBondContact O-N 3.17Å; F102-W109 HydrophobicContact CD1-CZ2 4.23Å; F102-W109 AromaticContact CD1-NE1 3.51Å; F102-W109 HydrophobicContact CE1-CD2 4.41Å; F102-W109 AromaticContact CE1-CE2 3.26Å; F102-W109 HydrophobicContact CE1-CH2 4.23Å; F102-W109 AromaticContact CE1-CZ2 3.17Å; F102-W109 HydrophobicContact CE1-CZ2 3.17Å; F102-W109 AromaticContact CE1-NE1 3.14Å; F102-W109 AromaticContact CE2-NE1 3.9Å; F102-W109 HydrophobicContact CZ-CD2 4.09Å; F102-W109 AromaticContact CZ-CE2 3.31Å; F102-W109 HydrophobicContact CZ-CH2 4.21Å; F102-W109 AromaticContact CZ-CZ2 3.44Å; F102-W109 HydrophobicContact CZ-CZ2 3.44Å; F102-W109 VanDerWaalsContact CZ-CZ2 3.44Å; F102-W109 AromaticContact CZ-NE1 3.35Å; F102-W109 VanDerWaalsContact CZ-NE1 3.35Å
103	Q	47.9	Very low	49.9	Very low	184 Å²	184	79 Å²	79	86%	0.86	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-4.1	176.5	-83.4	-174.7	-1	0	0	114.9
104	S	49.1	Very low	50.4	Low	94 Å²	94	78.8 Å²	78.8	66%	0.657	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.6	1.7	178.7	59.4	0	0	0	0	117	F102	F102-S104 PolarHBondContact O-N 3.02Å
105	Y	47.4	Very low	50.7	Low	109 Å²	109	75.4 Å²	75.4	43%	0.427	39%	0.393	S	S	.	.			trans	-127.4	100.4	-174.1	-71.7	-87.4	0	0	0	113	F102 F107	F102-Y105 PolarHBondContact O-N 3.17Å; Y105-F107 PolarHBondContact O-N 2.82Å
106	L	48	Very low	51	Low	181 Å²	181	72.5 Å²	72.5	95%	0.948	38%	0.378	S	S	*	.			trans	-67.2	71.5	167.1	-77.1	157.3	0	0	0	110.8
107	F	51.2	Low	51.4	Low	29 Å²	29	68 Å²	68	13%	0.127	35%	0.354	C	S	.	.			trans	-116.9	122.3	173	-168.2	-97.3	0	0	0	108.3	K35 A46 Y105 W109 A112 Y215	K35-F107 HydrophobicContact CD-CD2 4.34Å; A46-F107 HydrophobicContact CB-CE2 3.91Å; A46-F107 HydrophobicContact CB-CZ 3.75Å; Y105-F107 PolarHBondContact O-N 2.82Å; F107-W109 VanDerWaalsContact C-N 3.29Å; F107-W109 HydrophobicContact CB-CZ2 4.49Å; F107-W109 AromaticContact CD1-CD2 3.69Å; F107-W109 HydrophobicContact CD1-CD2 3.69Å; F107-W109 AromaticContact CD1-CE2 3.66Å; F107-W109 HydrophobicContact CD1-CE3 4.03Å; F107-W109 HydrophobicContact CD1-CG 4.07Å; F107-W109 HydrophobicContact CD1-CH2 4.19Å; F107-W109 AromaticContact CD1-CZ2 3.88Å; F107-W109 HydrophobicContact CD1-CZ2 3.88Å; F107-W109 HydrophobicContact CD1-CZ3 4.3Å; F107-W109 HydrophobicContact CE1-CD2 4.26Å; F107-W109 HydrophobicContact CE1-CE3 4.14Å; F107-W109 HydrophobicContact CE1-CH2 4.43Å; F107-W109 HydrophobicContact CE1-CZ3 4.26Å; F107-W109 HydrophobicContact CG-CZ2 4.46Å; F107-W109 PolarHBondContact O-N 3.48Å; F107-A112 HydrophobicContact CE1-CB 3.81Å; F107-A112 HydrophobicContact CZ-CB 4.28Å; F107-Y215 HydrophobicContact CE2-CD2 4.01Å; F107-Y215 HydrophobicContact CE2-CE2 4.06Å; F107-Y215 HydrophobicContact CE2-CG 4.32Å; F107-Y215 AromaticContact CZ-CD2 3.62Å; F107-Y215 HydrophobicContact CZ-CD2 3.62Å; F107-Y215 HydrophobicContact CZ-CE2 4.14Å; F107-Y215 AromaticContact CZ-CG 3.88Å; F107-Y215 HydrophobicContact CZ-CG 3.88Å
108	E	58.8	Low	51.8	Low	126 Å²	126	65.2 Å²	65.2	59%	0.589	34%	0.341	S	S	*	.			trans	-75.3	83.3	177	-72.5	176.2	-177.5	0	0	108.9	S110 L111	E108-S110 PolarHBondContact O-N 3.19Å; E108-S110 VanDerWaalsContact O-N 3.15Å; E108-L111 HydrophobicContact CB-CD1 3.9Å; E108-L111 HydrophobicContact CB-CG 4.02Å; E108-L111 WeakPolarHBondContact O-CB 3.45Å; E108-L111 PolarHBondContact O-N 3.48Å; E108-L111 WeakPolarHBondContact OE2-CD1 3.39Å
109	W	58.2	Low	52.2	Low	31 Å²	31	64 Å²	64	12%	0.117	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-54.6	-29.9	-179.7	-69.8	99.2	0	0	0	113.2	F37 W89 F102 F107 L111 A112 H114	F37-W109 HydrophobicContact CD1-CH2 4.4Å; F37-W109 AromaticContact CE1-CH2 3.5Å; F37-W109 HydrophobicContact CE1-CH2 3.5Å; F37-W109 VanDerWaalsContact CE1-CH2 3.5Å; F37-W109 HydrophobicContact CE1-CZ2 4.26Å; F37-W109 HydrophobicContact CE1-CZ3 4.44Å; F37-W109 HydrophobicContact CE2-CH2 4.21Å; F37-W109 AromaticContact CZ-CH2 3.38Å; F37-W109 HydrophobicContact CZ-CH2 3.38Å; F37-W109 HydrophobicContact CZ-CZ2 4.22Å; F37-W109 HydrophobicContact CZ-CZ3 4.21Å; W89-W109 HydrophobicContact CH2-CZ3 4.48Å; W89-W109 HydrophobicContact CZ3-CZ3 4.2Å; F102-W109 HydrophobicContact CD1-CZ2 4.23Å; F102-W109 AromaticContact CD1-NE1 3.51Å; F102-W109 HydrophobicContact CE1-CD2 4.41Å; F102-W109 AromaticContact CE1-CE2 3.26Å; F102-W109 HydrophobicContact CE1-CH2 4.23Å; F102-W109 AromaticContact CE1-CZ2 3.17Å; F102-W109 HydrophobicContact CE1-CZ2 3.17Å; F102-W109 AromaticContact CE1-NE1 3.14Å; F102-W109 AromaticContact CE2-NE1 3.9Å; F102-W109 HydrophobicContact CZ-CD2 4.09Å; F102-W109 AromaticContact CZ-CE2 3.31Å; F102-W109 HydrophobicContact CZ-CH2 4.21Å; F102-W109 AromaticContact CZ-CZ2 3.44Å; F102-W109 HydrophobicContact CZ-CZ2 3.44Å; F102-W109 VanDerWaalsContact CZ-CZ2 3.44Å; F102-W109 AromaticContact CZ-NE1 3.35Å; F102-W109 VanDerWaalsContact CZ-NE1 3.35Å; F107-W109 VanDerWaalsContact C-N 3.29Å; F107-W109 HydrophobicContact CB-CZ2 4.49Å; F107-W109 AromaticContact CD1-CD2 3.69Å; F107-W109 HydrophobicContact CD1-CD2 3.69Å; F107-W109 AromaticContact CD1-CE2 3.66Å; F107-W109 HydrophobicContact CD1-CE3 4.03Å; F107-W109 HydrophobicContact CD1-CG 4.07Å; F107-W109 HydrophobicContact CD1-CH2 4.19Å; F107-W109 AromaticContact CD1-CZ2 3.88Å; F107-W109 HydrophobicContact CD1-CZ2 3.88Å; F107-W109 HydrophobicContact CD1-CZ3 4.3Å; F107-W109 HydrophobicContact CE1-CD2 4.26Å; F107-W109 HydrophobicContact CE1-CE3 4.14Å; F107-W109 HydrophobicContact CE1-CH2 4.43Å; F107-W109 HydrophobicContact CE1-CZ3 4.26Å; F107-W109 HydrophobicContact CG-CZ2 4.46Å; F107-W109 PolarHBondContact O-N 3.48Å; W109-L111 PolarHBondContact O-N 3.22Å; W109-A112 PolarHBondContact O-N 3.46Å; W109-H114 AromaticContact CE3-CE1 3.47Å; W109-H114 VanDerWaalsContact CE3-CE1 3.47Å; W109-H114 AromaticContact CE3-NE2 3.35Å; W109-H114 VanDerWaalsContact CE3-NE2 3.35Å; W109-H114 AromaticContact CZ3-CE1 3.94Å; W109-H114 PolarHBondContact O-NE2 3.04Å
110	S	56	Low	52.7	Low	64 Å²	64	59 Å²	59	45%	0.448	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-56.9	-16.5	172	57.9	0	0	0	0	114.5	E108	E108-S110 PolarHBondContact O-N 3.19Å; E108-S110 VanDerWaalsContact O-N 3.15Å
111	L	61.9	Low	53	Low	34 Å²	34	54.7 Å²	54.7	18%	0.178	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-102.2	-3.8	177.6	-58.8	-177.4	0	0	0	114	E108 W109 Y213 K214 Y215	E108-L111 HydrophobicContact CB-CD1 3.9Å; E108-L111 HydrophobicContact CB-CG 4.02Å; E108-L111 WeakPolarHBondContact O-CB 3.45Å; E108-L111 PolarHBondContact O-N 3.48Å; E108-L111 WeakPolarHBondContact OE2-CD1 3.39Å; W109-L111 PolarHBondContact O-N 3.22Å; L111-Y213 CarbonylContact O-C 3.52Å; L111-Y213 VanDerWaalsContact O-CA 3.3Å; L111-Y213 WeakPolarHBondContact O-CA 3.26Å; L111-Y213 WeakPolarHBondContact O-CB 3.3Å; L111-K214 HydrophobicContact CB-CB 4.24Å; L111-K214 HydrophobicContact CB-CG 4.25Å; L111-K214 HydrophobicContact CD1-CD 3.65Å; L111-K214 VanDerWaalsContact CD1-CE 3.49Å; L111-K214 HydrophobicContact CD1-CG 4.1Å; L111-K214 VanDerWaalsContact CD1-NZ 3.32Å; L111-K214 PolarHBondContact O-N 3.31Å; L111-Y215 PolarHBondContact O-N 2.97Å
112	A	63.7	Low	53.2	Low	7 Å²	7	59.7 Å²	59.7	6%	0.058	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-95.6	138.5	173.6	0	0	0	0	0	109.3	F107 W109 H114 Y215 T217	F107-A112 HydrophobicContact CE1-CB 3.81Å; F107-A112 HydrophobicContact CZ-CB 4.28Å; W109-A112 PolarHBondContact O-N 3.46Å; A112-H114 WeakPolarHBondContact CB-CE1 3.36Å; A112-H114 PolarHBondContact O-N 3.48Å; A112-H114 PolarHBondContact O-ND1 3.26Å; A112-Y215 CarbonylContact C-O 3.54Å; A112-Y215 WeakPolarHBondContact CA-O 3.34Å; A112-T217 HydrophobicContact CB-CG2 4.47Å
113	L	62.6	Low	53.3	Low	14 Å²	14	59.6 Å²	59.6	7%	0.073	31%	0.306	C	S	.	.			trans	-63.4	115.5	173.2	-176.1	64.4	0	0	0	108	M75 I211 Y213 Y215 V216	M75-L113 HydrophobicContact SD-CD2 4.19Å; L113-I211 HydrophobicContact CD1-CD1 4.27Å; L113-Y213 HydrophobicContact CB-CD1 4.16Å; L113-Y213 HydrophobicContact CB-CD2 3.67Å; L113-Y213 HydrophobicContact CB-CE2 3.99Å; L113-Y213 HydrophobicContact CB-CG 3.77Å; L113-Y213 HydrophobicContact CD1-CD1 3.92Å; L113-Y213 HydrophobicContact CD1-CE1 4.02Å; L113-Y213 HydrophobicContact CD1-CG 4.39Å; L113-Y213 HydrophobicContact CD2-CD2 4.49Å; L113-Y213 HydrophobicContact CD2-CE1 4.33Å; L113-Y213 HydrophobicContact CD2-CE2 3.95Å; L113-Y213 HydrophobicContact CG-CD1 4.48Å; L113-Y213 HydrophobicContact CG-CE2 4.45Å; L113-Y215 PolarHBondContact N-O 2.96Å; L113-V216 HydrophobicContact CB-CG2 4.46Å; L113-V216 HydrophobicContact CD2-CG2 4.47Å
114	H	56.5	Low	53.2	Low	8 Å²	8	51.7 Å²	51.7	4%	0.037	27%	0.273	C	S	.	.			trans	-117.3	149.4	172.8	-59.4	-16.1	0	0	0	107.4	I92 W109 A112 M191	I92-H114 HydrophobicContact CD1-CB 4.16Å; I92-H114 HydrophobicContact CG1-CB 4.19Å; W109-H114 AromaticContact CE3-CE1 3.47Å; W109-H114 VanDerWaalsContact CE3-CE1 3.47Å; W109-H114 AromaticContact CE3-NE2 3.35Å; W109-H114 VanDerWaalsContact CE3-NE2 3.35Å; W109-H114 AromaticContact CZ3-CE1 3.94Å; W109-H114 PolarHBondContact O-NE2 3.04Å; A112-H114 WeakPolarHBondContact CB-CE1 3.36Å; A112-H114 PolarHBondContact O-N 3.48Å; A112-H114 PolarHBondContact O-ND1 3.26Å; H114-M191 CarbonylContact C-O 3.57Å
115	G	48.8	Very low	53	Low	2 Å²	2	52.4 Å²	52.4	2%	0.021	27%	0.269	C	S	.	.			trans	176	114.8	174.1	0	0	0	0	0	110.2	T90 I117	T90-G115 WeakPolarHBondContact CB-O 3.44Å; T90-G115 WeakPolarHBondContact CG2-O 3.34Å; T90-G115 CarbonylContact O-C 3.49Å; G115-I117 PolarHBondContact O-N 3.18Å
116	A	48.4	Very low	52.8	Low	32 Å²	32	51.6 Å²	51.6	26%	0.264	27%	0.272	S	S	.	.			trans	-58.1	95.6	150.2	0	0	0	0	0	106.5	L118 M191	A116-L118 PolarHBondContact O-N 3.4Å; A116-M191 HydrophobicContact CB-CE 4.16Å
117	I	51.6	Low	52.7	Low	29 Å²	29	48.1 Å²	48.1	15%	0.149	26%	0.263	C	S	.	.			trans	-69.4	105.8	179.6	-67.3	177.8	0	0	0	106.7	I72 L88 T90 G115 Y188	I72-I117 HydrophobicContact CD1-CD1 3.89Å; I72-I117 HydrophobicContact CG1-CD1 4.24Å; I72-I117 HydrophobicContact CG2-CD1 3.71Å; L88-I117 HydrophobicContact CD2-CD1 4.12Å; T90-I117 HydrophobicContact CG2-CD1 3.86Å; T90-I117 HydrophobicContact CG2-CG1 4.15Å; G115-I117 PolarHBondContact O-N 3.18Å; I117-Y188 HydrophobicContact CG2-CD1 3.05Å; I117-Y188 HydrophobicContact CG2-CE1 3.74Å; I117-Y188 HydrophobicContact CG2-CG 3.74Å
118	L	51.6	Low	52.4	Low	17 Å²	17	51 Å²	51	9%	0.089	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	129.8	174.9	-70.7	166.3	0	0	0	109	A116 C133 I135 Y188 V189 F202	A116-L118 PolarHBondContact O-N 3.4Å; L118-C133 HydrophobicContact CD2-CB 4.4Å; L118-I135 HydrophobicContact CD2-CG1 3.78Å; L118-Y188 WeakPolarHBondContact O-CA 3.18Å; L118-V189 PolarHBondContact N-O 3.22Å; L118-V189 PolarHBondContact O-N 2.73Å; L118-F202 HydrophobicContact CD1-CE1 3.79Å; L118-F202 HydrophobicContact CD1-CZ 3.68Å
119	K	52.1	Low	51.6	Low	24 Å²	24	45.9 Å²	45.9	10%	0.104	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	111.2	171.6	179.4	175.3	168.5	152.4	0	109.2	T121 V134 Q136 E186 H187 Y188	K119-T121 HydrophobicContact CD-CG2 4.37Å; K119-T121 HydrophobicContact CG-CG2 4.05Å; K119-V134 PolarHBondContact N-O 3.25Å; K119-V134 PolarHBondContact O-N 2.98Å; K119-Q136 HydrophobicContact CD-CB 4.4Å; K119-E186 WeakPolarHBondContact CE-OE1 3.49Å; K119-E186 VanDerWaalsContact CE-OE2 3.29Å; K119-E186 WeakPolarHBondContact CE-OE2 3.49Å; K119-E186 HydrophobicContact CG-CB 4.42Å; K119-E186 IonicContact NZ-OE1 3.94Å; K119-E186 PolarHBondContact NZ-OE1 2.81Å; K119-E186 IonicContact NZ-OE2 3.59Å; K119-E186 PolarHBondContact NZ-OE2 3.46Å; K119-H187 WeakPolarHBondContact CA-O 3.2Å; K119-Y188 HydrophobicContact CB-CE1 4.4Å
120	C	54.4	Low	50.8	Low	4 Å²	4	52.4 Å²	52.4	3%	0.027	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.1	169.4	-64.9	0	0	0	0	108.5	C172 F180 E186 H187	C120-C172 HydrophobicContact CB-CB 4.18Å; C120-C172 WeakPolarHBondContact CB-SG 3.17Å; C120-C172 WeakPolarHBondContact SG-CB 2.98Å; C120-C172 CovalentContact SG-SG 2.06Å; C120-C172 PolarHBondContact SG-SG 2.84Å; C120-F180 HydrophobicContact CB-CD1 4.47Å; C120-F180 HydrophobicContact CB-CE1 3.87Å; C120-E186 WeakPolarHBondContact O-CA 3.31Å; C120-H187 PolarHBondContact N-O 3Å; C120-H187 PolarHBondContact O-N 3.04Å
121	T	50.8	Low	50.2	Low	61 Å²	61	51.6 Å²	51.6	37%	0.374	28%	0.282	S	S	.	.			trans	-99.2	6	-170.8	50.5	0	0	0	0	115.2	K119 Y185	K119-T121 HydrophobicContact CD-CG2 4.37Å; K119-T121 HydrophobicContact CG-CG2 4.05Å; T121-Y185 CarbonylContact C-O 3.02Å; T121-Y185 VanDerWaalsContact CA-O 3.27Å; T121-Y185 WeakPolarHBondContact CA-O 2.99Å
122	R	51.3	Low	49.3	Very low	163 Å²	163	54.4 Å²	54.4	62%	0.615	30%	0.302	S	S	*	.	S	Bend	trans	-153.1	152.1	-177.7	-128.3	178.2	177.8	175.6	-1.6	116.8	D131	R122-D131 WeakPolarHBondContact CB-OD2 3.4Å; R122-D131 WeakPolarHBondContact CD-OD2 3.28Å
123	S	49	Very low	48.4	Very low	38 Å²	38	54.8 Å²	54.8	27%	0.266	31%	0.305	S	S	.	.			trans	-62.8	143.1	-159.9	-173.1	0	0	0	0	115.8	D125 N126	S123-D125 PolarHBondContact O-N 3.03Å; S123-N126 PolarHBondContact O-N 3.08Å
124	A	46.1	Very low	47.4	Very low	19 Å²	19	57.7 Å²	57.7	16%	0.157	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-18.8	176.1	0	0	0	0	0	117.5	S177 F180	A124-S177 VanDerWaalsContact CB-O 3.29Å; A124-S177 WeakPolarHBondContact CB-O 3.34Å; A124-S177 WeakPolarHBondContact O-CB 3.36Å; A124-F180 HydrophobicContact CB-CB 3.84Å; A124-F180 WeakPolarHBondContact CB-O 2.86Å
125	D	45.2	Very low	46.7	Very low	109 Å²	109	60.9 Å²	60.9	58%	0.583	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-15.4	-169.6	-98	1.2	0	0	0	114.8	S123 S127 K182	S123-D125 PolarHBondContact O-N 3.03Å; D125-S127 PolarHBondContact O-N 3.42Å; D125-K182 VanDerWaalsContact OD1-CE 3.27Å; D125-K182 WeakPolarHBondContact OD1-CE 3.32Å; D125-K182 IonicContact OD1-NZ 3.14Å; D125-K182 PolarHBondContact OD1-NZ 2.76Å; D125-K182 VanDerWaalsContact OD2-CE 3.3Å; D125-K182 WeakPolarHBondContact OD2-CE 3.45Å; D125-K182 IonicContact OD2-NZ 3.73Å; D125-K182 PolarHBondContact OD2-NZ 3.19Å
126	N	41.7	Very low	46.2	Very low	92 Å²	92	66.1 Å²	66.1	49%	0.492	36%	0.363	S	S	.	.			trans	-94.6	92.6	-179.1	-137.4	19.5	0	0	0	110.2	S123 T128 N129	S123-N126 PolarHBondContact O-N 3.08Å; N126-T128 PolarHBondContact ND2-OG1 3.25Å; N126-T128 PolarHBondContact O-N 2.76Å; N126-T128 PolarHBondContact OD1-OG1 3.33Å; N126-N129 VanDerWaalsContact O-CB 3.27Å; N126-N129 WeakPolarHBondContact O-CB 3.15Å; N126-N129 PolarHBondContact O-N 3.25Å
127	S	45.9	Very low	45.7	Very low	108 Å²	108	70.9 Å²	70.9	76%	0.755	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-13.3	174.9	57.5	0	0	0	0	113.5	D125 N129	D125-S127 PolarHBondContact O-N 3.42Å; S127-N129 VanDerWaalsContact C-N 3.3Å
128	T	45.4	Very low	45	Very low	88 Å²	88	71.3 Å²	71.3	54%	0.54	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	25.8	171.2	60.3	0	0	0	0	113	N126 E130	N126-T128 PolarHBondContact ND2-OG1 3.25Å; N126-T128 PolarHBondContact O-N 2.76Å; N126-T128 PolarHBondContact OD1-OG1 3.33Å; T128-E130 VanDerWaalsContact C-N 3.27Å; T128-E130 PolarHBondContact O-N 2.77Å
129	N	41.8	Very low	44.4	Very low	20 Å²	20	78.5 Å²	78.5	11%	0.107	42%	0.419	C	S	.	.			trans	-58.2	79.8	-176.5	-118.9	3.1	0	0	0	112.9	N126 S127 S171	N126-N129 VanDerWaalsContact O-CB 3.27Å; N126-N129 WeakPolarHBondContact O-CB 3.15Å; N126-N129 PolarHBondContact O-N 3.25Å; S127-N129 VanDerWaalsContact C-N 3.3Å; N129-S171 PolarHBondContact O-OG 3.46Å; N129-S171 VanDerWaalsContact O-OG 3.07Å
130	E	42.4	Very low	44	Very low	167 Å²	167	82.3 Å²	82.3	78%	0.78	43%	0.432	S	S	*	.			trans	-80.2	-0.6	165.7	-71.7	-177	169.1	0	0	111.7	T128	T128-E130 VanDerWaalsContact C-N 3.27Å; T128-E130 PolarHBondContact O-N 2.77Å
131	D	43.5	Very low	43.2	Very low	48 Å²	48	83 Å²	83	26%	0.257	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-62.5	123.5	-176.9	-75.4	-15.3	0	0	0	110.7	R122 C133	R122-D131 WeakPolarHBondContact CB-OD2 3.4Å; R122-D131 WeakPolarHBondContact CD-OD2 3.28Å; D131-C133 PolarHBondContact O-N 3.31Å
132	P	42	Very low	42.6	Very low	93 Å²	93	82.5 Å²	82.5	60%	0.604	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-69.3	128.6	-178.1	26.9	-32.6	0	0	0	109.7	V134	P132-V134 PolarHBondContact O-N 3.09Å
133	C	45	Very low	41.6	Very low	15 Å²	15	80.2 Å²	80.2	10%	0.101	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-64.5	127	165.9	53.7	0	0	0	0	108.9	L118 D131 C155 V170	L118-C133 HydrophobicContact CD2-CB 4.4Å; D131-C133 PolarHBondContact O-N 3.31Å; C133-C155 PolarHBondContact SG-SG 3.16Å; C133-V170 PolarHBondContact SG-O 2.03Å
134	V	41.4	Very low	40.7	Very low	74 Å²	74	84.6 Å²	84.6	45%	0.448	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-98.9	120.1	177.3	-175.9	0	0	0	0	108.1	K119 P132 Q136	K119-V134 PolarHBondContact N-O 3.25Å; K119-V134 PolarHBondContact O-N 2.98Å; P132-V134 PolarHBondContact O-N 3.09Å; V134-Q136 PolarHBondContact O-N 2.67Å; V134-Q136 VanDerWaalsContact O-N 3.12Å
135	I	42	Very low	39.7	Very low	75 Å²	75	88.8 Å²	88.8	39%	0.385	46%	0.462	S	S	.	.			trans	-74.3	98.6	164	-60.2	170.8	0	0	0	106	L118 R137 I142	L118-I135 HydrophobicContact CD2-CG1 3.78Å; I135-R137 PolarHBondContact O-N 3.43Å; I135-I142 HydrophobicContact CG2-CD1 3.46Å; I135-I142 VanDerWaalsContact CG2-CD1 3.46Å
136	Q	37.6	Very low	38.9	Very low	113 Å²	113	85.6 Å²	85.6	53%	0.528	45%	0.454	S	S	.	.			trans	-80.7	113.6	178.5	-166.2	174.5	-13	0	0	109.5	K119 V134	K119-Q136 HydrophobicContact CD-CB 4.4Å; V134-Q136 PolarHBondContact O-N 2.67Å; V134-Q136 VanDerWaalsContact O-N 3.12Å
137	R	38.5	Very low	38.4	Very low	131 Å²	131	93.9 Å²	93.9	49%	0.494	48%	0.479	S	S	.	.			trans	-62.4	130.5	165.6	-75.8	-168	167.7	150	5.9	109.5	I135 S141 I142	I135-R137 PolarHBondContact O-N 3.43Å; R137-S141 WeakPolarHBondContact CG-O 3.28Å; R137-I142 HydrophobicContact CG-CB 4.23Å; R137-I142 PolarHBondContact NE-O 3.33Å; R137-I142 PolarHBondContact NH2-O 3.35Å
138	S	37.8	Very low	37.5	Very low	39 Å²	39	93.5 Å²	93.5	27%	0.273	47%	0.468	S	S	.	.			trans	-70.2	150.7	143	78.9	0	0	0	0	106.3	R140 S141	S138-R140 PolarHBondContact O-N 2.86Å; S138-S141 PolarHBondContact O-N 3.44Å; S138-S141 VanDerWaalsContact O-N 3.15Å; S138-S141 PolarHBondContact OG-OG 3.01Å
139	N	37.6	Very low	36.9	Very low	168 Å²	168	94 Å²	94	90%	0.898	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	1.1	-173.9	-77	-20	0	0	0	115.3
140	R	45.1	Very low	36.4	Very low	103 Å²	103	100 Å²	100	39%	0.389	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.3	1.5	-172.9	-62.7	171.5	176.3	-97.7	-10.9	114.7	V85 Y87 S138 E221	V85-R140 VanDerWaalsContact CG1-NH2 3.33Å; Y87-R140 HydrophobicContact CD1-CB 3.47Å; Y87-R140 VanDerWaalsContact CD1-CB 3.47Å; Y87-R140 HydrophobicContact CD1-CG 4.42Å; Y87-R140 HydrophobicContact CD2-CB 4.38Å; Y87-R140 HydrophobicContact CE1-CB 3.59Å; Y87-R140 HydrophobicContact CE2-CB 4.46Å; Y87-R140 VanDerWaalsContact CE2-O 3.31Å; Y87-R140 WeakPolarHBondContact CE2-O 3.34Å; Y87-R140 HydrophobicContact CG-CB 3.9Å; Y87-R140 PolarHBondContact OH-O 2.97Å; Y87-R140 VanDerWaalsContact OH-O 3.12Å; S138-R140 PolarHBondContact O-N 2.86Å; R140-E221 IonicContact CZ-OE1 2.78Å; R140-E221 IonicContact NH1-OE1 3.64Å; R140-E221 PolarHBondContact NH1-OE1 2.04Å; R140-E221 IonicContact NH1-OE2 3.09Å; R140-E221 IonicContact NH2-OE1 3.26Å
141	S	36.7	Very low	35.7	Very low	18 Å²	18	95.6 Å²	95.6	13%	0.126	48%	0.481	C	S	.	.	S	Bend	trans	-123.5	148.1	171.2	60.9	0	0	0	0	113.2	R137 S138	R137-S141 WeakPolarHBondContact CG-O 3.28Å; S138-S141 PolarHBondContact O-N 3.44Å; S138-S141 VanDerWaalsContact O-N 3.15Å; S138-S141 PolarHBondContact OG-OG 3.01Å
142	I	38.8	Very low	35.1	Very low	51 Å²	51	99.7 Å²	99.7	26%	0.262	49%	0.494	S	S	.	.			trans	87.7	105.5	170.2	-45.9	169.7	0	0	0	116.4	I135 R137	I135-I142 HydrophobicContact CG2-CD1 3.46Å; I135-I142 VanDerWaalsContact CG2-CD1 3.46Å; R137-I142 HydrophobicContact CG-CB 4.23Å; R137-I142 PolarHBondContact NE-O 3.33Å; R137-I142 PolarHBondContact NH2-O 3.35Å
143	K	30	Very low	34.4	Very low	116 Å²	116	100.7 Å²	100.7	50%	0.504	50%	0.503	S	S	.	.			trans	-137.3	119.1	146.6	-107.3	-166	178.3	179.5	0	108.1	N13	N13-K143 PolarHBondContact OD1-NZ 2.04Å
144	I	30.5	Very low	33.7	Very low	130 Å²	130	101.8 Å²	101.8	67%	0.667	52%	0.517	S	S	*	.			trans	-108.1	113.3	166.1	-63.5	172.2	0	0	0	105.6
145	Q	25.8	Very low	33.1	Very low	107 Å²	107	99.7 Å²	99.7	50%	0.5	51%	0.505	S	S	.	.			trans	-86.5	109.9	178.1	-111.3	175.8	-26.8	0	0	109.2
146	G	26.7	Very low	32.7	Very low	42 Å²	42	100.7 Å²	100.7	43%	0.433	51%	0.505	S	S	.	.			trans	-100.1	147.4	163.7	0	0	0	0	0	110	N148 Y152	G146-N148 PolarHBondContact O-N 3.14Å; G146-Y152 PolarHBondContact N-OH 3.39Å; G146-Y152 PolarHBondContact O-OH 3.17Å
147	R	31	Very low	32.3	Very low	265 Å²	265	101.4 Å²	101.4	100%	1	52%	0.517	S	S	*	.	S	Bend	trans	-66.3	3.4	-171	-161.4	-177.3	-88.8	-157.3	-4	115.4
148	N	27.8	Very low	31.8	Very low	101 Å²	101	102 Å²	102	54%	0.54	52%	0.52	S	S	.	.			trans	-135.8	119.2	-175.3	-154.9	-3.3	0	0	0	112.5	G146 D150 V151 Y152	G146-N148 PolarHBondContact O-N 3.14Å; N148-D150 PolarHBondContact O-N 3.27Å; N148-V151 HydrophobicContact CB-CG2 4.25Å; N148-Y152 WeakPolarHBondContact O-CD2 3.15Å; N148-Y152 WeakPolarHBondContact O-CE2 3.47Å
149	E	32.1	Very low	31.5	Very low	97 Å²	97	110.6 Å²	110.6	45%	0.453	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-15	-172.7	-73.4	-175.7	159.8	0	0	114.7	L6 Y152	L6-E149 VanDerWaalsContact CD2-OE2 3.31Å; L6-E149 WeakPolarHBondContact CD2-OE2 3.48Å; E149-Y152 WeakPolarHBondContact O-CD2 3.38Å
150	D	31.8	Very low	31.2	Very low	146 Å²	146	109.8 Å²	109.8	78%	0.781	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	4.8	-174.7	-62.8	-37.8	0	0	0	114.7	N148	N148-D150 PolarHBondContact O-N 3.27Å
151	V	27.6	Very low	30.5	Very low	76 Å²	76	110.7 Å²	110.7	46%	0.461	55%	0.554	S	S	.	*			trans	-106	13.5	-177.9	-166	0	0	0	0	112.7	N148 S153	N148-V151 HydrophobicContact CB-CG2 4.25Å; V151-S153 VanDerWaalsContact C-N 3.3Å; V151-S153 PolarHBondContact O-N 2.89Å
152	Y	30.6	Very low	30.2	Very low	133 Å²	133	121.7 Å²	121.7	52%	0.522	59%	0.593	S	S	.	*			trans	-80.4	5.6	-170.1	-77.5	-82.4	0	0	0	116.3	G146 N148 E149	G146-Y152 PolarHBondContact N-OH 3.39Å; G146-Y152 PolarHBondContact O-OH 3.17Å; N148-Y152 WeakPolarHBondContact O-CD2 3.15Å; N148-Y152 WeakPolarHBondContact O-CE2 3.47Å; E149-Y152 WeakPolarHBondContact O-CD2 3.38Å
153	S	27.7	Very low	29.9	Very low	114 Å²	114	122.6 Å²	122.6	80%	0.797	60%	0.604	S	S	*	*	S	Bend	trans	-113.1	83.1	175	62.2	0	0	0	0	110.7	V151	V151-S153 VanDerWaalsContact C-N 3.3Å; V151-S153 PolarHBondContact O-N 2.89Å
154	G	30.2	Very low	29.7	Very low	38 Å²	38	127.8 Å²	127.8	39%	0.392	62%	0.62	S	S	.	*			trans	169.9	109.1	172.6	0	0	0	0	0	110.9	Y156	G154-Y156 WeakPolarHBondContact O-CD2 3.41Å; G154-Y156 WeakPolarHBondContact O-CE2 3.32Å
155	C	29.3	Very low	29.6	Very low	31 Å²	31	131.7 Å²	131.7	21%	0.209	63%	0.633	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-66.9	143.4	162.4	-59.8	0	0	0	0	107.3	C133 S169 V170	C133-C155 PolarHBondContact SG-SG 3.16Å; C155-S169 CarbonylContact O-C 3.44Å; C155-S169 WeakPolarHBondContact O-CA 3.39Å; C155-V170 HydrophobicContact CB-CB 4.21Å; C155-V170 PolarHBondContact O-N 3.06Å
156	Y	32.9	Very low	29.6	Very low	96 Å²	96	135.3 Å²	135.3	38%	0.376	65%	0.647	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-140.1	139.9	-176.7	-73.6	-101.1	0	0	0	110.7	G154 L167 H168 S169 V170	G154-Y156 WeakPolarHBondContact O-CD2 3.41Å; G154-Y156 WeakPolarHBondContact O-CE2 3.32Å; Y156-L167 HydrophobicContact CD1-CG 4.25Å; Y156-L167 HydrophobicContact CE1-CB 4.07Å; Y156-L167 HydrophobicContact CE1-CD2 4.28Å; Y156-L167 HydrophobicContact CE1-CG 4.05Å; Y156-H168 VanDerWaalsContact CD1-N 3.32Å; Y156-H168 WeakPolarHBondContact CD1-O 3.43Å; Y156-S169 VanDerWaalsContact CD1-N 3.32Å; Y156-V170 VanDerWaalsContact C-CG2 3.4Å
157	V	29.6	Very low	29.6	Very low	128 Å²	128	139.8 Å²	139.8	78%	0.776	66%	0.66	S	S	*	*			trans	-169.6	128.2	134.6	-179.2	0	0	0	0	108
158	Y	28.4	Very low	29.6	Very low	142 Å²	142	130.9 Å²	130.9	56%	0.557	63%	0.63	S	S	*	*			trans	-108.1	149.8	178.1	-165.5	-98.4	0	0	0	112	Q160 H168	Y158-Q160 HydrophobicContact CE1-CB 4.29Å; Y158-H168 AromaticContact CD1-CD2 3.61Å; Y158-H168 HydrophobicContact CD2-CB 3.43Å; Y158-H168 VanDerWaalsContact CD2-CB 3.43Å; Y158-H168 AromaticContact CD2-CD2 3.18Å; Y158-H168 WeakPolarHBondContact CD2-CD2 3.32Å; Y158-H168 AromaticContact CD2-CG 3.52Å; Y158-H168 AromaticContact CE1-CD2 3.67Å; Y158-H168 HydrophobicContact CE2-CB 4.19Å; Y158-H168 AromaticContact CE2-CD2 3.22Å; Y158-H168 WeakPolarHBondContact CE2-CD2 3.49Å; Y158-H168 AromaticContact CE2-CG 3.81Å; Y158-H168 AromaticContact CE2-NE2 3.81Å; Y158-H168 HydrophobicContact CG-CB 3.74Å; Y158-H168 AromaticContact CG-CD2 3.37Å; Y158-H168 AromaticContact CG-CG 3.91Å; Y158-H168 AromaticContact CZ-CD2 3.46Å; Y158-H168 VanDerWaalsContact CZ-CD2 3.46Å; Y158-H168 AromaticContact CZ-NE2 3.78Å
159	R	32.2	Very low	29.8	Very low	221 Å²	221	130.3 Å²	130.3	83%	0.834	63%	0.634	S	S	*	*			trans	-122.1	107.4	175.5	-159.3	-174.1	-160.2	-170.3	5.4	106.8
160	Q	29.6	Very low	30.4	Very low	151 Å²	151	127.6 Å²	127.6	71%	0.706	62%	0.624	S	S	*	*			trans	175.7	125.8	139.8	-100.8	172.3	2.6	0	0	113	Y158	Y158-Q160 HydrophobicContact CE1-CB 4.29Å
161	T	30.3	Very low	31	Very low	121 Å²	121	122.1 Å²	122.1	74%	0.742	60%	0.597	S	S	*	*			trans	30.1	113.6	140.4	52	0	0	0	0	119.4
162	R	32.1	Very low	32	Very low	250 Å²	250	119 Å²	119	94%	0.943	58%	0.578	S	S	*	*	S	Bend	trans	56	136.4	155.2	-77.6	-178.8	171.7	168.5	-2.5	117.3
163	S	31.7	Very low	32.7	Very low	70 Å²	70	120.9 Å²	120.9	49%	0.49	59%	0.585	S	S	.	*	S	Bend	trans	77.7	90.5	168.3	-81.2	0	0	0	0	118.2
164	W	26.5	Very low	33.8	Very low	224 Å²	224	118.6 Å²	118.6	85%	0.848	58%	0.579	S	S	*	*			trans	62.2	96.3	137.3	-30.7	-59.9	0	0	0	118.4	K166	W164-K166 PolarHBondContact O-N 2.83Å
165	F	27.4	Very low	34.7	Very low	213 Å²	213	118.6 Å²	118.6	93%	0.934	57%	0.569	S	S	*	*			trans	28.8	81.9	151.1	-68.3	-83	0	0	0	118.2
166	K	25.9	Very low	35.8	Very low	182 Å²	182	120.4 Å²	120.4	79%	0.791	58%	0.58	S	S	*	*			trans	-131.8	124.1	151.4	-83.1	-174.3	176.9	176.5	0	111.1	W164	W164-K166 PolarHBondContact O-N 2.83Å
167	L	27.4	Very low	36.7	Very low	136 Å²	136	119.5 Å²	119.5	71%	0.712	59%	0.588	S	S	*	*			trans	-68.1	125.6	-177	-127	73.9	0	0	0	110.9	Y156	Y156-L167 HydrophobicContact CD1-CG 4.25Å; Y156-L167 HydrophobicContact CE1-CB 4.07Å; Y156-L167 HydrophobicContact CE1-CD2 4.28Å; Y156-L167 HydrophobicContact CE1-CG 4.05Å
168	H	31.6	Very low	37.9	Very low	78 Å²	78	118.2 Å²	118.2	36%	0.361	58%	0.584	S	S	.	*			trans	-129.1	117.9	-173.8	-83.5	-28.5	0	0	0	115.3	Y156 Y158	Y156-H168 VanDerWaalsContact CD1-N 3.32Å; Y156-H168 WeakPolarHBondContact CD1-O 3.43Å; Y158-H168 AromaticContact CD1-CD2 3.61Å; Y158-H168 HydrophobicContact CD2-CB 3.43Å; Y158-H168 VanDerWaalsContact CD2-CB 3.43Å; Y158-H168 AromaticContact CD2-CD2 3.18Å; Y158-H168 WeakPolarHBondContact CD2-CD2 3.32Å; Y158-H168 AromaticContact CD2-CG 3.52Å; Y158-H168 AromaticContact CE1-CD2 3.67Å; Y158-H168 HydrophobicContact CE2-CB 4.19Å; Y158-H168 AromaticContact CE2-CD2 3.22Å; Y158-H168 WeakPolarHBondContact CE2-CD2 3.49Å; Y158-H168 AromaticContact CE2-CG 3.81Å; Y158-H168 AromaticContact CE2-NE2 3.81Å; Y158-H168 HydrophobicContact CG-CB 3.74Å; Y158-H168 AromaticContact CG-CD2 3.37Å; Y158-H168 AromaticContact CG-CG 3.91Å; Y158-H168 AromaticContact CZ-CD2 3.46Å; Y158-H168 VanDerWaalsContact CZ-CD2 3.46Å; Y158-H168 AromaticContact CZ-NE2 3.78Å
169	S	31.2	Very low	38.9	Very low	90 Å²	90	114.2 Å²	114.2	63%	0.629	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-65.9	149.3	-176.9	50.7	0	0	0	0	114.6	C155 Y156	C155-S169 CarbonylContact O-C 3.44Å; C155-S169 WeakPolarHBondContact O-CA 3.39Å; Y156-S169 VanDerWaalsContact CD1-N 3.32Å
170	V	44.8	Very low	39.9	Very low	39 Å²	39	104.3 Å²	104.3	24%	0.236	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120	-179.4	174.1	0	0	0	0	109.5	C133 C155 Y156	C133-V170 PolarHBondContact SG-O 2.03Å; C155-V170 HydrophobicContact CB-CB 4.21Å; C155-V170 PolarHBondContact O-N 3.06Å; Y156-V170 VanDerWaalsContact C-CG2 3.4Å
171	S	44.1	Very low	40.8	Very low	31 Å²	31	100.4 Å²	100.4	22%	0.217	51%	0.51	C	S	.	.			trans	-101.2	164	164.7	156.5	0	0	0	0	108	N129 R173	N129-S171 PolarHBondContact O-OG 3.46Å; N129-S171 VanDerWaalsContact O-OG 3.07Å; S171-R173 PolarHBondContact O-N 3.46Å; S171-R173 WeakPolarHBondContact OG-CB 3Å; S171-R173 PolarHBondContact OG-N 3.27Å
172	C	48.8	Very low	41.9	Very low	11 Å²	11	100.9 Å²	100.9	7%	0.074	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-56.6	-6.3	165.5	-55.5	0	0	0	0	112.2	C120 G174 F175 F180	C120-C172 HydrophobicContact CB-CB 4.18Å; C120-C172 WeakPolarHBondContact CB-SG 3.17Å; C120-C172 WeakPolarHBondContact SG-CB 2.98Å; C120-C172 CovalentContact SG-SG 2.06Å; C120-C172 PolarHBondContact SG-SG 2.84Å; C172-G174 PolarHBondContact O-N 2.96Å; C172-F175 PolarHBondContact O-N 3.41Å; C172-F180 HydrophobicContact CB-CZ 4.03Å
173	R	45.7	Very low	42.8	Very low	172 Å²	172	93.6 Å²	93.6	65%	0.649	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-54.5	0.2	176.1	-170.7	167.5	-175.2	167.8	3.8	117.5	S171	S171-R173 PolarHBondContact O-N 3.46Å; S171-R173 WeakPolarHBondContact OG-CB 3Å; S171-R173 PolarHBondContact OG-N 3.27Å
174	G	49.5	Very low	43.7	Very low	67 Å²	67	92.7 Å²	92.7	69%	0.691	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-102.6	-17.2	174	0	0	0	0	0	115	C172	C172-G174 PolarHBondContact O-N 2.96Å
175	F	50.5	Low	44.9	Very low	38 Å²	38	91.1 Å²	91.1	17%	0.167	47%	0.469	C	S	.	.	S	Bend	trans	-86.3	131	-177.2	-65.5	-77.8	0	0	0	109.7	C172 S177 F180 V189 F202	C172-F175 PolarHBondContact O-N 3.41Å; F175-S177 PolarHBondContact O-N 2.97Å; F175-F180 HydrophobicContact CB-CE2 3.51Å; F175-F180 HydrophobicContact CB-CZ 3.56Å; F175-F180 HydrophobicContact CD2-CZ 4.06Å; F175-F180 HydrophobicContact CG-CZ 4.08Å; F175-V189 HydrophobicContact CE1-CG1 3.92Å; F175-V189 HydrophobicContact CZ-CG1 3.79Å; F175-V189 HydrophobicContact CZ-CG2 4.46Å; F175-F202 HydrophobicContact CE1-CB 4.2Å; F175-F202 HydrophobicContact CE1-CD1 4.19Å; F175-F202 HydrophobicContact CE1-CG 4.05Å; F175-F202 HydrophobicContact CZ-CB 4.39Å; F175-F202 AromaticContact CZ-CD1 3.69Å; F175-F202 HydrophobicContact CZ-CD1 3.69Å; F175-F202 AromaticContact CZ-CD2 3.98Å; F175-F202 HydrophobicContact CZ-CD2 3.98Å; F175-F202 AromaticContact CZ-CE1 3.85Å; F175-F202 HydrophobicContact CZ-CE1 3.85Å; F175-F202 HydrophobicContact CZ-CE2 4.14Å; F175-F202 AromaticContact CZ-CG 3.74Å; F175-F202 HydrophobicContact CZ-CG 3.74Å; F175-F202 HydrophobicContact CZ-CZ 4.07Å
176	P	51.7	Low	46.2	Very low	69 Å²	69	83.9 Å²	83.9	45%	0.448	44%	0.438	S	S	.	.			trans	-53.4	140.4	175.3	-23.5	30.9	0	0	0	110.4	S178 Y179	P176-S178 PolarHBondContact O-N 3.01Å; P176-Y179 HydrophobicContact CB-CD2 3.75Å; P176-Y179 HydrophobicContact CB-CE2 3.96Å; P176-Y179 VanDerWaalsContact CD-CD2 3.48Å; P176-Y179 VanDerWaalsContact CD-CE2 3.5Å; P176-Y179 HydrophobicContact CG-CD2 3.8Å; P176-Y179 HydrophobicContact CG-CE2 3.57Å; P176-Y179 WeakPolarHBondContact O-CB 3.41Å; P176-Y179 WeakPolarHBondContact O-CD2 3.33Å; P176-Y179 PolarHBondContact O-N 2.74Å
177	S	53	Low	47.6	Very low	77 Å²	77	75.8 Å²	75.8	54%	0.538	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-55.2	-25.3	179.9	53.1	0	0	0	0	112.8	A124 F175 Y179 F180	A124-S177 VanDerWaalsContact CB-O 3.29Å; A124-S177 WeakPolarHBondContact CB-O 3.34Å; A124-S177 WeakPolarHBondContact O-CB 3.36Å; F175-S177 PolarHBondContact O-N 2.97Å; S177-Y179 PolarHBondContact O-N 3.25Å; S177-Y179 VanDerWaalsContact O-N 3.11Å; S177-F180 PolarHBondContact O-N 2.66Å
178	S	53.6	Low	49.1	Very low	100 Å²	100	70.8 Å²	70.8	70%	0.699	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-59.1	-17.7	171.9	60.9	0	0	0	0	114.8	P176	P176-S178 PolarHBondContact O-N 3.01Å
179	Y	50.1	Low	50.3	Low	58 Å²	58	68.1 Å²	68.1	23%	0.227	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-79.7	-23.9	175.5	-76.2	-108.2	0	0	0	112.7	P176 S177 N204	P176-Y179 HydrophobicContact CB-CD2 3.75Å; P176-Y179 HydrophobicContact CB-CE2 3.96Å; P176-Y179 VanDerWaalsContact CD-CD2 3.48Å; P176-Y179 VanDerWaalsContact CD-CE2 3.5Å; P176-Y179 HydrophobicContact CG-CD2 3.8Å; P176-Y179 HydrophobicContact CG-CE2 3.57Å; P176-Y179 WeakPolarHBondContact O-CB 3.41Å; P176-Y179 WeakPolarHBondContact O-CD2 3.33Å; P176-Y179 PolarHBondContact O-N 2.74Å; S177-Y179 PolarHBondContact O-N 3.25Å; S177-Y179 VanDerWaalsContact O-N 3.11Å; Y179-N204 PolarHBondContact OH-O 2.03Å
180	F	52	Low	51.6	Low	14 Å²	14	64 Å²	64	6%	0.061	34%	0.335	C	S	.	.	S	Bend	trans	-108.2	109.3	-175.6	-50.8	-75.7	0	0	0	110.8	C120 A124 C172 F175 S177 H187	C120-F180 HydrophobicContact CB-CD1 4.47Å; C120-F180 HydrophobicContact CB-CE1 3.87Å; A124-F180 HydrophobicContact CB-CB 3.84Å; A124-F180 WeakPolarHBondContact CB-O 2.86Å; C172-F180 HydrophobicContact CB-CZ 4.03Å; F175-F180 HydrophobicContact CB-CE2 3.51Å; F175-F180 HydrophobicContact CB-CZ 3.56Å; F175-F180 HydrophobicContact CD2-CZ 4.06Å; F175-F180 HydrophobicContact CG-CZ 4.08Å; S177-F180 PolarHBondContact O-N 2.66Å; F180-H187 HydrophobicContact CD1-CB 3.96Å; F180-H187 AromaticContact CD1-CG 3.65Å; F180-H187 AromaticContact CD1-ND1 3.56Å; F180-H187 HydrophobicContact CE1-CB 4.23Å
181	R	48.3	Very low	52	Low	68 Å²	68	64 Å²	64	26%	0.257	33%	0.333	S	S	.	.			trans	-70	138.3	171.2	-113.1	178.5	60.9	-177.1	-3.5	111.5	S65 F66 D183 V184 H187	S65-R181 PolarHBondContact OG-NH1 2.77Å; F66-R181 VanDerWaalsContact CZ-NH2 3.28Å; R181-D183 VanDerWaalsContact C-N 3.28Å; R181-D183 IonicContact CZ-OD1 2.72Å; R181-D183 IonicContact CZ-OD2 3.63Å; R181-D183 IonicContact NE-OD1 2.94Å; R181-D183 PolarHBondContact NE-OD1 2.89Å; R181-D183 IonicContact NE-OD2 3.32Å; R181-D183 VanDerWaalsContact NH2-CG 3.33Å; R181-D183 IonicContact NH2-OD1 2.64Å; R181-D183 PolarHBondContact NH2-OD1 3.24Å; R181-D183 IonicContact NH2-OD2 3.41Å; R181-D183 PolarHBondContact NH2-OD2 3.06Å; R181-D183 PolarHBondContact O-N 2.94Å; R181-V184 HydrophobicContact CB-CB 4.34Å; R181-V184 HydrophobicContact CB-CG2 4.08Å; R181-V184 PolarHBondContact O-N 2.69Å; R181-H187 PolarHBondContact N-NE2 2.78Å; R181-H187 VanDerWaalsContact N-NE2 3.16Å; R181-H187 PolarHBondContact O-CE1 3.26Å; R181-H187 PolarHBondContact O-NE2 2.98Å
182	K	54.1	Low	52.5	Low	132 Å²	132	64 Å²	64	57%	0.574	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.8	-173.9	-61.4	-172.2	-177.2	-167.1	0	114.2	D125	D125-K182 VanDerWaalsContact OD1-CE 3.27Å; D125-K182 WeakPolarHBondContact OD1-CE 3.32Å; D125-K182 IonicContact OD1-NZ 3.14Å; D125-K182 PolarHBondContact OD1-NZ 2.76Å; D125-K182 VanDerWaalsContact OD2-CE 3.3Å; D125-K182 WeakPolarHBondContact OD2-CE 3.45Å; D125-K182 IonicContact OD2-NZ 3.73Å; D125-K182 PolarHBondContact OD2-NZ 3.19Å
183	D	52.1	Low	52.6	Low	97 Å²	97	65.2 Å²	65.2	52%	0.519	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-4.5	-176.4	68.3	-53.5	0	0	0	113.3	R181	R181-D183 VanDerWaalsContact C-N 3.28Å; R181-D183 IonicContact CZ-OD1 2.72Å; R181-D183 IonicContact CZ-OD2 3.63Å; R181-D183 IonicContact NE-OD1 2.94Å; R181-D183 PolarHBondContact NE-OD1 2.89Å; R181-D183 IonicContact NE-OD2 3.32Å; R181-D183 VanDerWaalsContact NH2-CG 3.33Å; R181-D183 IonicContact NH2-OD1 2.64Å; R181-D183 PolarHBondContact NH2-OD1 3.24Å; R181-D183 IonicContact NH2-OD2 3.41Å; R181-D183 PolarHBondContact NH2-OD2 3.06Å; R181-D183 PolarHBondContact O-N 2.94Å
184	V	49	Very low	52.8	Low	50 Å²	50	59.1 Å²	59.1	30%	0.303	32%	0.319	S	S	.	.			trans	-102.1	117.1	175	177.8	0	0	0	0	107.7	R181 E186 H187	R181-V184 HydrophobicContact CB-CB 4.34Å; R181-V184 HydrophobicContact CB-CG2 4.08Å; R181-V184 PolarHBondContact O-N 2.69Å; V184-E186 VanDerWaalsContact C-N 3.3Å; V184-E186 WeakPolarHBondContact CG1-O 3.31Å; V184-H187 PolarHBondContact O-CE1 3.45Å
185	Y	52.6	Low	52.9	Low	192 Å²	192	60.3 Å²	60.3	75%	0.753	32%	0.322	S	S	*	.	S	Bend	trans	-76.5	-18.9	-179.6	-71.3	-80.9	0	0	0	113.3	T121	T121-Y185 CarbonylContact C-O 3.02Å; T121-Y185 VanDerWaalsContact CA-O 3.27Å; T121-Y185 WeakPolarHBondContact CA-O 2.99Å
186	E	53.8	Low	52.8	Low	61 Å²	61	67.7 Å²	67.7	29%	0.285	36%	0.357	S	S	.	.			trans	-138.4	115.6	-170.5	-53.4	-172.4	170.1	0	0	110.9	K119 C120 V184	K119-E186 WeakPolarHBondContact CE-OE1 3.49Å; K119-E186 VanDerWaalsContact CE-OE2 3.29Å; K119-E186 WeakPolarHBondContact CE-OE2 3.49Å; K119-E186 HydrophobicContact CG-CB 4.42Å; K119-E186 IonicContact NZ-OE1 3.94Å; K119-E186 PolarHBondContact NZ-OE1 2.81Å; K119-E186 IonicContact NZ-OE2 3.59Å; K119-E186 PolarHBondContact NZ-OE2 3.46Å; C120-E186 WeakPolarHBondContact O-CA 3.31Å; V184-E186 VanDerWaalsContact C-N 3.3Å; V184-E186 WeakPolarHBondContact CG1-O 3.31Å
187	H	55.4	Low	52.9	Low	12 Å²	12	67.2 Å²	67.2	6%	0.056	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.5	176.9	-54.2	86.2	0	0	0	110.7	K119 C120 F180 R181 V184	K119-H187 WeakPolarHBondContact CA-O 3.2Å; C120-H187 PolarHBondContact N-O 3Å; C120-H187 PolarHBondContact O-N 3.04Å; F180-H187 HydrophobicContact CD1-CB 3.96Å; F180-H187 AromaticContact CD1-CG 3.65Å; F180-H187 AromaticContact CD1-ND1 3.56Å; F180-H187 HydrophobicContact CE1-CB 4.23Å; R181-H187 PolarHBondContact N-NE2 2.78Å; R181-H187 VanDerWaalsContact N-NE2 3.16Å; R181-H187 PolarHBondContact O-CE1 3.26Å; R181-H187 PolarHBondContact O-NE2 2.98Å; V184-H187 PolarHBondContact O-CE1 3.45Å
188	Y	59.8	Low	52.6	Low	30 Å²	30	66.2 Å²	66.2	12%	0.118	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	118.7	-178.4	-66.9	-60.2	0	0	0	111.2	Q68 K69 I117 L118 K119	Q68-Y188 PolarHBondContact NE2-O 3.4Å; Q68-Y188 PolarHBondContact OE1-O 3.13Å; K69-Y188 HydrophobicContact CB-CE2 4.27Å; K69-Y188 HydrophobicContact CG-CE2 4.33Å; I117-Y188 HydrophobicContact CG2-CD1 3.05Å; I117-Y188 HydrophobicContact CG2-CE1 3.74Å; I117-Y188 HydrophobicContact CG2-CG 3.74Å; L118-Y188 WeakPolarHBondContact O-CA 3.18Å; K119-Y188 HydrophobicContact CB-CE1 4.4Å
189	V	56.4	Low	52.1	Low	23 Å²	23	62.5 Å²	62.5	14%	0.139	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.9	-179.8	-168.9	0	0	0	0	110.2	L118 F175 F202	L118-V189 PolarHBondContact N-O 3.22Å; L118-V189 PolarHBondContact O-N 2.73Å; F175-V189 HydrophobicContact CE1-CG1 3.92Å; F175-V189 HydrophobicContact CZ-CG1 3.79Å; F175-V189 HydrophobicContact CZ-CG2 4.46Å; V189-F202 HydrophobicContact CG1-CD1 3.51Å; V189-F202 HydrophobicContact CG1-CE1 3.82Å
190	C	58.9	Low	52	Low	3 Å²	3	63.4 Å²	63.4	2%	0.02	34%	0.343	C	S	.	.			trans	-105.7	152.7	177	-68.2	0	0	0	0	112.1	C208 I211	C190-C208 HydrophobicContact CB-CB 3.92Å; C190-C208 WeakPolarHBondContact CB-SG 3.22Å; C190-C208 PolarHBondContact N-SG 3.14Å; C190-C208 WeakPolarHBondContact SG-CB 3.45Å; C190-C208 CovalentContact SG-SG 2.02Å; C190-C208 PolarHBondContact SG-SG 3.39Å; C190-I211 HydrophobicContact CB-CD1 4.15Å
191	M	53.1	Low	51.9	Low	38 Å²	38	68.1 Å²	68.1	19%	0.187	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.1	172.7	-57.3	-169.8	-41.8	0	0	109.2	I92 H114 A116 L200 Y201 F202	I92-M191 HydrophobicContact CD1-CE 3.84Å; H114-M191 CarbonylContact C-O 3.57Å; A116-M191 HydrophobicContact CB-CE 4.16Å; M191-L200 HydrophobicContact CB-CD2 4.26Å; M191-L200 HydrophobicContact CE-CB 4.4Å; M191-L200 HydrophobicContact CE-CD1 4.14Å; M191-L200 HydrophobicContact CE-CD2 4.24Å; M191-Y201 WeakPolarHBondContact CA-O 3.32Å; M191-F202 HydrophobicContact CG-CD1 3.82Å; M191-F202 HydrophobicContact CG-CE1 3.59Å; M191-F202 HydrophobicContact CG-CZ 4.15Å; M191-F202 HydrophobicContact SD-CE1 4.12Å; M191-F202 HydrophobicContact SD-CZ 4.06Å
192	V	54	Low	52.1	Low	31 Å²	31	68.4 Å²	68.4	19%	0.188	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	147.3	175.6	-62.2	0	0	0	0	110.6	T194 Y201 T203 I211	V192-T194 HydrophobicContact CG2-CG2 4.2Å; V192-Y201 PolarHBondContact N-O 3.04Å; V192-Y201 PolarHBondContact O-N 3.19Å; V192-T203 HydrophobicContact CB-CG2 4.13Å; V192-T203 HydrophobicContact CG1-CG2 3.57Å; V192-T203 HydrophobicContact CG2-CG2 3.5Å; V192-I211 HydrophobicContact CG1-CD1 3.54Å; V192-I211 HydrophobicContact CG1-CG1 4.14Å; V192-I211 HydrophobicContact CG1-CG2 3.84Å
193	I	51.9	Low	51.9	Low	37 Å²	37	63 Å²	63	19%	0.19	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	118.4	166.8	-59.7	175.6	0	0	0	106.8	I92 G199 L200	I92-I193 HydrophobicContact CG2-CD1 4.27Å; I193-G199 WeakPolarHBondContact CA-O 3.05Å; I193-L200 HydrophobicContact CD1-CD2 4.38Å; I193-L200 HydrophobicContact CG1-CD2 3.46Å; I193-L200 VanDerWaalsContact CG1-CD2 3.46Å; I193-L200 HydrophobicContact CG1-CG 4.03Å
194	T	49.5	Very low	51.6	Low	44 Å²	44	65.4 Å²	65.4	27%	0.27	36%	0.355	S	S	.	.			trans	-87.8	131.2	175.2	69.7	0	0	0	0	109.6	V192 E196 S197 G198 G199 Y201	V192-T194 HydrophobicContact CG2-CG2 4.2Å; T194-E196 PolarHBondContact O-N 2.87Å; T194-S197 PolarHBondContact O-N 2.89Å; T194-S197 PolarHBondContact OG1-OG 3.09Å; T194-G198 PolarHBondContact O-N 2.98Å; T194-G199 PolarHBondContact N-O 3.1Å; T194-G199 VanDerWaalsContact N-O 3.16Å; T194-Y201 HydrophobicContact CG2-CD2 4.08Å
195	A	51.2	Low	51.5	Low	92 Å²	92	65.2 Å²	65.2	76%	0.76	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.9	179.1	0	0	0	0	0	112.5
196	E	49.3	Very low	51.3	Low	194 Å²	194	57.3 Å²	57.3	91%	0.907	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-30.8	-176.4	-65.8	175.2	178.1	0	0	113.8	T194	T194-E196 PolarHBondContact O-N 2.87Å
197	S	51.8	Low	51.2	Low	58 Å²	58	56.7 Å²	56.7	41%	0.406	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-17.1	-174	68.3	0	0	0	0	113.6	T194 G199 Y201	T194-S197 PolarHBondContact O-N 2.89Å; T194-S197 PolarHBondContact OG1-OG 3.09Å; S197-G199 PolarHBondContact O-N 2.98Å; S197-G199 PolarHBondContact OG-N 3.46Å; S197-Y201 WeakPolarHBondContact OG-CE2 3.42Å
198	G	47.6	Very low	51.3	Low	56 Å²	56	56.3 Å²	56.3	58%	0.577	33%	0.328	S	S	*	.	S	Bend	trans	62	4.6	-167.6	0	0	0	0	0	113.9	T194	T194-G198 PolarHBondContact O-N 2.98Å
199	G	43.2	Very low	51.1	Low	23 Å²	23	56.5 Å²	56.5	24%	0.237	33%	0.332	C	S	.	.	S	Bend	trans	-101.8	162	-178.4	0	0	0	0	0	112.3	I193 T194 S197 Y201	I193-G199 WeakPolarHBondContact CA-O 3.05Å; T194-G199 PolarHBondContact N-O 3.1Å; T194-G199 VanDerWaalsContact N-O 3.16Å; S197-G199 PolarHBondContact O-N 2.98Å; S197-G199 PolarHBondContact OG-N 3.46Å; G199-Y201 VanDerWaalsContact O-CD2 3.25Å; G199-Y201 WeakPolarHBondContact O-CD2 3.05Å; G199-Y201 WeakPolarHBondContact O-CE2 3.25Å
200	L	48.4	Very low	51	Low	77 Å²	77	59.7 Å²	59.7	40%	0.403	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127.6	172.3	-76.2	158.8	0	0	0	110.6	I92 M191 I193	I92-L200 HydrophobicContact CD1-CD1 4.23Å; I92-L200 HydrophobicContact CD1-CD2 3.57Å; I92-L200 HydrophobicContact CG2-CD1 3.85Å; I92-L200 HydrophobicContact CG2-CD2 4.09Å; I92-L200 HydrophobicContact CG2-CG 4.45Å; M191-L200 HydrophobicContact CB-CD2 4.26Å; M191-L200 HydrophobicContact CE-CB 4.4Å; M191-L200 HydrophobicContact CE-CD1 4.14Å; M191-L200 HydrophobicContact CE-CD2 4.24Å; I193-L200 HydrophobicContact CD1-CD2 4.38Å; I193-L200 HydrophobicContact CG1-CD2 3.46Å; I193-L200 VanDerWaalsContact CG1-CD2 3.46Å; I193-L200 HydrophobicContact CG1-CG 4.03Å
201	Y	49	Very low	50.9	Low	113 Å²	113	61 Å²	61	44%	0.443	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145	176.3	-64.4	-97.4	0	0	0	110.7	M191 V192 T194 S197 G199	M191-Y201 WeakPolarHBondContact CA-O 3.32Å; V192-Y201 PolarHBondContact N-O 3.04Å; V192-Y201 PolarHBondContact O-N 3.19Å; T194-Y201 HydrophobicContact CG2-CD2 4.08Å; S197-Y201 WeakPolarHBondContact OG-CE2 3.42Å; G199-Y201 VanDerWaalsContact O-CD2 3.25Å; G199-Y201 WeakPolarHBondContact O-CD2 3.05Å; G199-Y201 WeakPolarHBondContact O-CE2 3.25Å
202	F	52.1	Low	51.4	Low	73 Å²	73	68.9 Å²	68.9	32%	0.32	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	136.1	162.9	-71.6	-68.1	0	0	0	109.2	L118 F175 V189 M191 N204	L118-F202 HydrophobicContact CD1-CE1 3.79Å; L118-F202 HydrophobicContact CD1-CZ 3.68Å; F175-F202 HydrophobicContact CE1-CB 4.2Å; F175-F202 HydrophobicContact CE1-CD1 4.19Å; F175-F202 HydrophobicContact CE1-CG 4.05Å; F175-F202 HydrophobicContact CZ-CB 4.39Å; F175-F202 AromaticContact CZ-CD1 3.69Å; F175-F202 HydrophobicContact CZ-CD1 3.69Å; F175-F202 AromaticContact CZ-CD2 3.98Å; F175-F202 HydrophobicContact CZ-CD2 3.98Å; F175-F202 AromaticContact CZ-CE1 3.85Å; F175-F202 HydrophobicContact CZ-CE1 3.85Å; F175-F202 HydrophobicContact CZ-CE2 4.14Å; F175-F202 AromaticContact CZ-CG 3.74Å; F175-F202 HydrophobicContact CZ-CG 3.74Å; F175-F202 HydrophobicContact CZ-CZ 4.07Å; V189-F202 HydrophobicContact CG1-CD1 3.51Å; V189-F202 HydrophobicContact CG1-CE1 3.82Å; M191-F202 HydrophobicContact CG-CD1 3.82Å; M191-F202 HydrophobicContact CG-CE1 3.59Å; M191-F202 HydrophobicContact CG-CZ 4.15Å; M191-F202 HydrophobicContact SD-CE1 4.12Å; M191-F202 HydrophobicContact SD-CZ 4.06Å; F202-N204 PolarHBondContact O-N 2.78Å
203	T	49.7	Very low	52.2	Low	20 Å²	20	68.4 Å²	68.4	12%	0.123	38%	0.383	C	S	.	.			trans	-72.2	128.4	177.8	63.4	0	0	0	0	109.6	V192 S205 I211	V192-T203 HydrophobicContact CB-CG2 4.13Å; V192-T203 HydrophobicContact CG1-CG2 3.57Å; V192-T203 HydrophobicContact CG2-CG2 3.5Å; T203-S205 WeakPolarHBondContact CB-OG 3.15Å; T203-S205 PolarHBondContact O-N 3.37Å; T203-S205 PolarHBondContact OG1-O 3.31Å; T203-S205 PolarHBondContact OG1-OG 3.49Å; T203-I211 HydrophobicContact CG2-CD1 3.66Å; T203-I211 HydrophobicContact CG2-CG1 3.85Å
204	N	47.5	Very low	53.2	Low	146 Å²	146	72 Å²	72	78%	0.781	40%	0.397	S	S	*	.	S	Bend	trans	-64	-27.9	169.8	-82.5	-5.5	0	0	0	111.4	Y179 F202 G206	Y179-N204 PolarHBondContact OH-O 2.03Å; F202-N204 PolarHBondContact O-N 2.78Å; N204-G206 PolarHBondContact O-N 2.92Å
205	S	45.4	Very low	54.6	Low	46 Å²	46	73.6 Å²	73.6	32%	0.322	40%	0.399	S	S	.	.	S	Bend	trans	-63.8	128	172.2	54.7	0	0	0	0	109.3	T203 Y207	T203-S205 WeakPolarHBondContact CB-OG 3.15Å; T203-S205 PolarHBondContact O-N 3.37Å; T203-S205 PolarHBondContact OG1-O 3.31Å; T203-S205 PolarHBondContact OG1-OG 3.49Å; S205-Y207 PolarHBondContact O-N 3Å
206	G	48.2	Very low	55.9	Low	26 Å²	26	69.3 Å²	69.3	27%	0.268	36%	0.363	S	S	.	.	S	Bend	trans	-53.9	-22	-159.3	0	0	0	0	0	116.1	N204	N204-G206 PolarHBondContact O-N 2.92Å
207	Y	52.7	Low	57.3	Low	48 Å²	48	60 Å²	60	19%	0.188	32%	0.32	C	S	.	.	S	Bend	trans	-154.1	154.4	-168.4	-60	-62.3	0	0	0	112.4	Q68 S205 T209 D210	Q68-Y207 HydrophobicContact CG-CD1 3.82Å; Q68-Y207 HydrophobicContact CG-CG 4Å; Q68-Y207 VanDerWaalsContact NE2-CA 3.32Å; Q68-Y207 VanDerWaalsContact NE2-CB 3.26Å; Q68-Y207 VanDerWaalsContact NE2-CD1 3.32Å; S205-Y207 PolarHBondContact O-N 3Å; Y207-T209 PolarHBondContact O-N 3.17Å; Y207-D210 PolarHBondContact O-N 3.22Å
208	C	57.5	Low	58.7	Low	5 Å²	5	57.3 Å²	57.3	3%	0.034	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-51.2	-23.3	176.7	-55.6	0	0	0	0	114.6	Q68 C190	Q68-C208 VanDerWaalsContact NE2-N 3.18Å; C190-C208 HydrophobicContact CB-CB 3.92Å; C190-C208 WeakPolarHBondContact CB-SG 3.22Å; C190-C208 PolarHBondContact N-SG 3.14Å; C190-C208 WeakPolarHBondContact SG-CB 3.45Å; C190-C208 CovalentContact SG-SG 2.02Å; C190-C208 PolarHBondContact SG-SG 3.39Å
209	T	55.1	Low	60.2	Low	34 Å²	34	54.6 Å²	54.6	21%	0.209	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-76.6	-21.7	-179.6	49.8	0	0	0	0	114.1	A71 Y207 I211	A71-T209 HydrophobicContact CB-CG2 4.31Å; Y207-T209 PolarHBondContact O-N 3.17Å; T209-I211 VanDerWaalsContact C-N 3.29Å
210	D	53.8	Low	61.8	Low	90 Å²	90	53.5 Å²	53.5	48%	0.481	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-83.1	-9.4	-179.1	-76.5	-17.8	0	0	0	112.9	Y207	Y207-D210 PolarHBondContact O-N 3.22Å
211	I	57	Low	62.8	Low	31 Å²	31	53.9 Å²	53.9	16%	0.159	26%	0.261	C	S	.	.	S	Bend	trans	-76.9	129.7	179.4	-55	163.9	0	0	0	108.2	L113 C190 V192 T203 T209 Y213	L113-I211 HydrophobicContact CD1-CD1 4.27Å; C190-I211 HydrophobicContact CB-CD1 4.15Å; V192-I211 HydrophobicContact CG1-CD1 3.54Å; V192-I211 HydrophobicContact CG1-CG1 4.14Å; V192-I211 HydrophobicContact CG1-CG2 3.84Å; T203-I211 HydrophobicContact CG2-CD1 3.66Å; T203-I211 HydrophobicContact CG2-CG1 3.85Å; T209-I211 VanDerWaalsContact C-N 3.29Å; I211-Y213 HydrophobicContact CB-CD1 4.03Å; I211-Y213 HydrophobicContact CB-CE1 4.41Å; I211-Y213 HydrophobicContact CG2-CD1 4.16Å; I211-Y213 WeakPolarHBondContact O-CD1 3.34Å; I211-Y213 WeakPolarHBondContact O-CE1 3.4Å; I211-Y213 PolarHBondContact O-N 2.87Å; I211-Y213 VanDerWaalsContact O-N 3.13Å
212	K	64.2	Low	63.6	Low	203 Å²	203	48.5 Å²	48.5	88%	0.883	24%	0.24	S	C	*	.			trans	-81.8	87.7	172.6	-70.9	-173	180	-178.9	0	110.3
213	Y	70	Confident	63.9	Low	21 Å²	21	46.3 Å²	46.3	8%	0.082	24%	0.236	C	C	.	.			trans	-99.3	148.4	170.1	49.2	-80.1	0	0	0	110.9	I49 I56 M75 L111 L113 I211 V216	I49-Y213 HydrophobicContact CD1-CD2 3.55Å; I49-Y213 HydrophobicContact CD1-CE2 3.04Å; I49-Y213 HydrophobicContact CG1-CD2 4.07Å; I49-Y213 HydrophobicContact CG1-CE2 3.96Å; I56-Y213 HydrophobicContact CD1-CE2 4.44Å; I56-Y213 WeakPolarHBondContact CD1-OH 3.39Å; M75-Y213 HydrophobicContact CE-CE2 4.36Å; M75-Y213 WeakPolarHBondContact CE-OH 3.5Å; L111-Y213 CarbonylContact O-C 3.52Å; L111-Y213 VanDerWaalsContact O-CA 3.3Å; L111-Y213 WeakPolarHBondContact O-CA 3.26Å; L111-Y213 WeakPolarHBondContact O-CB 3.3Å; L113-Y213 HydrophobicContact CB-CD1 4.16Å; L113-Y213 HydrophobicContact CB-CD2 3.67Å; L113-Y213 HydrophobicContact CB-CE2 3.99Å; L113-Y213 HydrophobicContact CB-CG 3.77Å; L113-Y213 HydrophobicContact CD1-CD1 3.92Å; L113-Y213 HydrophobicContact CD1-CE1 4.02Å; L113-Y213 HydrophobicContact CD1-CG 4.39Å; L113-Y213 HydrophobicContact CD2-CD2 4.49Å; L113-Y213 HydrophobicContact CD2-CE1 4.33Å; L113-Y213 HydrophobicContact CD2-CE2 3.95Å; L113-Y213 HydrophobicContact CG-CD1 4.48Å; L113-Y213 HydrophobicContact CG-CE2 4.45Å; I211-Y213 HydrophobicContact CB-CD1 4.03Å; I211-Y213 HydrophobicContact CB-CE1 4.41Å; I211-Y213 HydrophobicContact CG2-CD1 4.16Å; I211-Y213 WeakPolarHBondContact O-CD1 3.34Å; I211-Y213 WeakPolarHBondContact O-CE1 3.4Å; I211-Y213 PolarHBondContact O-N 2.87Å; I211-Y213 VanDerWaalsContact O-N 3.13Å; Y213-V216 HydrophobicContact CD2-CG2 4.07Å; Y213-V216 HydrophobicContact CE2-CG2 3.72Å
214	K	74.8	Confident	64.2	Low	112 Å²	112	47.9 Å²	47.9	49%	0.487	24%	0.241	S	C	.	.	S	Bend	trans	-94.1	-20.7	172.2	-63.1	-166.7	-165.8	155.1	0	112.8	I49 L111	I49-K214 WeakPolarHBondContact CB-O 3.44Å; I49-K214 PolarHBondContact N-O 3.21Å; L111-K214 HydrophobicContact CB-CB 4.24Å; L111-K214 HydrophobicContact CB-CG 4.25Å; L111-K214 HydrophobicContact CD1-CD 3.65Å; L111-K214 VanDerWaalsContact CD1-CE 3.49Å; L111-K214 HydrophobicContact CD1-CG 4.1Å; L111-K214 VanDerWaalsContact CD1-NZ 3.32Å; L111-K214 PolarHBondContact O-N 3.31Å
215	Y	77.6	Confident	64.5	Low	77 Å²	77	45.5 Å²	45.5	30%	0.302	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	149.1	-175.6	-53.7	-81.8	0	0	0	112.5	A46 V47 P48 F107 L111 A112 L113	A46-Y215 HydrophobicContact CB-CD1 4.49Å; V47-Y215 CarbonylContact O-C 3.44Å; V47-Y215 VanDerWaalsContact O-CA 3.23Å; V47-Y215 WeakPolarHBondContact O-CA 2.9Å; P48-Y215 HydrophobicContact CG-CE1 4.5Å; F107-Y215 HydrophobicContact CE2-CD2 4.01Å; F107-Y215 HydrophobicContact CE2-CE2 4.06Å; F107-Y215 HydrophobicContact CE2-CG 4.32Å; F107-Y215 AromaticContact CZ-CD2 3.62Å; F107-Y215 HydrophobicContact CZ-CD2 3.62Å; F107-Y215 HydrophobicContact CZ-CE2 4.14Å; F107-Y215 AromaticContact CZ-CG 3.88Å; F107-Y215 HydrophobicContact CZ-CG 3.88Å; L111-Y215 PolarHBondContact O-N 2.97Å; A112-Y215 CarbonylContact C-O 3.54Å; A112-Y215 WeakPolarHBondContact CA-O 3.34Å; L113-Y215 PolarHBondContact N-O 2.96Å
216	V	79.8	Confident	65.4	Low	2 Å²	2	45.8 Å²	45.8	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	145.5	161.8	175	0	0	0	0	107.7	V47 I49 V52 M75 L88 L113 Y213	V47-V216 PolarHBondContact N-O 2.96Å; V47-V216 PolarHBondContact O-N 2.91Å; I49-V216 HydrophobicContact CD1-CG2 4.27Å; V52-V216 HydrophobicContact CG2-CB 4.39Å; V52-V216 HydrophobicContact CG2-CG2 3.76Å; M75-V216 HydrophobicContact CE-CG2 4.36Å; M75-V216 HydrophobicContact SD-CG1 4.47Å; M75-V216 HydrophobicContact SD-CG2 4.02Å; L88-V216 HydrophobicContact CD1-CG1 3.35Å; L113-V216 HydrophobicContact CB-CG2 4.46Å; L113-V216 HydrophobicContact CD2-CG2 4.47Å; Y213-V216 HydrophobicContact CD2-CG2 4.07Å; Y213-V216 HydrophobicContact CE2-CG2 3.72Å
217	T	78.7	Confident	66.3	Low	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.4	179.3	43.8	0	0	0	0	109.7	V44 T45 W89 A112	V44-T217 HydrophobicContact CG1-CG2 4.41Å; T45-T217 WeakPolarHBondContact O-CA 3.1Å; W89-T217 WeakPolarHBondContact CA-O 3Å; W89-T217 WeakPolarHBondContact CB-O 3.4Å; W89-T217 HydrophobicContact CE3-CG2 4.23Å; W89-T217 VanDerWaalsContact CE3-OG1 3.25Å; W89-T217 HydrophobicContact CZ3-CG2 4.45Å; W89-T217 PolarHBondContact N-O 2.86Å; W89-T217 PolarHBondContact O-OG1 3.47Å; A112-T217 HydrophobicContact CB-CG2 4.47Å
218	C	81	Confident	67.4	Low	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131	178	-64.5	0	0	0	0	110	V44 T45 V47 C79 L83 Y87	V44-C218 CarbonylContact C-O 3.53Å; V44-C218 WeakPolarHBondContact CA-O 3.31Å; T45-C218 PolarHBondContact N-O 3.5Å; T45-C218 PolarHBondContact O-N 3.31Å; V47-C218 HydrophobicContact CG2-CB 4.36Å; C79-C218 HydrophobicContact CB-CB 3.62Å; C79-C218 WeakPolarHBondContact CB-SG 3.27Å; C79-C218 WeakPolarHBondContact SG-CB 3.11Å; C79-C218 CovalentContact SG-SG 2.03Å; C79-C218 PolarHBondContact SG-SG 3.4Å; L83-C218 HydrophobicContact CD1-CB 3.07Å; Y87-C218 CarbonylContact O-C 3.59Å; Y87-C218 WeakPolarHBondContact O-CA 3.42Å
219	G	79.4	Confident	68.5	Low	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	144.6	177.2	0	0	0	0	0	109.7	C43 G86 Y87	C43-G219 CarbonylContact O-C 3.45Å; C43-G219 VanDerWaalsContact O-CA 3.25Å; C43-G219 WeakPolarHBondContact O-CA 3.37Å; G86-G219 CarbonylContact C-O 3.5Å; G86-G219 WeakPolarHBondContact CA-O 3.35Å; Y87-G219 WeakPolarHBondContact CD1-O 3.34Å; Y87-G219 WeakPolarHBondContact CE1-O 2.99Å; Y87-G219 PolarHBondContact N-O 2.82Å; Y87-G219 PolarHBondContact O-N 3.09Å
220	H	75.9	Confident	69.9	Low	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	164.1	-178.7	68.5	98.6	0	0	0	112.8	W29 C43 T45 L83 P84 G222	W29-H220 AromaticContact CE3-CE1 3.5Å; W29-H220 AromaticContact CE3-NE2 3.83Å; W29-H220 AromaticContact CH2-CE1 3.75Å; W29-H220 AromaticContact CH2-ND1 3.86Å; W29-H220 AromaticContact CZ3-CE1 3.12Å; W29-H220 WeakPolarHBondContact CZ3-CE1 3.49Å; W29-H220 AromaticContact CZ3-ND1 3.7Å; W29-H220 AromaticContact CZ3-NE2 3.91Å; C43-H220 WeakPolarHBondContact CB-CE1 2.96Å; C43-H220 WeakPolarHBondContact CB-NE2 3.28Å; C43-H220 PolarHBondContact N-O 3.06Å; C43-H220 PolarHBondContact O-CD2 3.46Å; C43-H220 VanDerWaalsContact O-CD2 3.32Å; C43-H220 PolarHBondContact O-N 3.43Å; T45-H220 PolarHBondContact OG1-CD2 3.46Å; T45-H220 PolarHBondContact OG1-NE2 3.21Å; T45-H220 VanDerWaalsContact OG1-NE2 3.13Å; L83-H220 HydrophobicContact CB-CB 3.67Å; L83-H220 HydrophobicContact CG-CB 4.49Å; P84-H220 WeakPolarHBondContact O-CB 3.23Å; H220-G222 PolarHBondContact ND1-N 3.11Å; H220-G222 VanDerWaalsContact ND1-N 3.14Å; H220-G222 PolarHBondContact ND1-O 3.25Å; H220-G222 PolarHBondContact O-N 3.48Å
221	E	69.8	Low	71.5	Confident	85 Å²	85	55.9 Å²	55.9	40%	0.397	27%	0.274	S	S	.	.			trans	-81.2	14.8	-176.2	-79.3	-168.9	177.6	0	0	114.9	L23 P84 V85 R140	L23-E221 VanDerWaalsContact CD2-CA 3.49Å; L23-E221 WeakPolarHBondContact CD2-O 3.44Å; L23-E221 VanDerWaalsContact CG-O 3.28Å; L23-E221 WeakPolarHBondContact CG-O 3.41Å; P84-E221 PolarHBondContact O-N 3.31Å; V85-E221 HydrophobicContact CB-CG 4.32Å; V85-E221 HydrophobicContact CG2-CB 4.14Å; V85-E221 HydrophobicContact CG2-CG 4.23Å; R140-E221 IonicContact CZ-OE1 2.78Å; R140-E221 IonicContact NH1-OE1 3.64Å; R140-E221 PolarHBondContact NH1-OE1 2.04Å; R140-E221 IonicContact NH1-OE2 3.09Å; R140-E221 IonicContact NH2-OE1 3.26Å
222	G	65.4	Low	72.9	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	83.2	-119	179	0	0	0	0	0	113	C43 P84 H220	C43-G222 VanDerWaalsContact SG-CA 3.57Å; P84-G222 WeakPolarHBondContact CG-O 3.25Å; H220-G222 PolarHBondContact ND1-N 3.11Å; H220-G222 VanDerWaalsContact ND1-N 3.14Å; H220-G222 PolarHBondContact ND1-O 3.25Å; H220-G222 PolarHBondContact O-N 3.48Å
223	A	59	Low	74.1	Confident	27 Å²	27	52.9 Å²	52.9	22%	0.223	26%	0.263	C	S	.	.	S	Bend	trans	-52	147.7	-170.1	0	0	0	0	0	115.7	Y258 R260	A223-Y258 CarbonylContact C-O 3.6Å; A223-Y258 WeakPolarHBondContact CA-O 3.49Å; A223-Y258 WeakPolarHBondContact CB-O 3.33Å; A223-R260 HydrophobicContact CB-CG 4.3Å
224	F	54.4	Low	75	Confident	52 Å²	52	53.6 Å²	53.6	23%	0.228	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	150.8	-176.3	-71.9	-85.4	0	0	0	113	W29 Y258 Q259 R260	W29-F224 AromaticContact CE2-CZ 3.96Å; W29-F224 HydrophobicContact CH2-CD2 4.49Å; W29-F224 AromaticContact CH2-CE1 3.98Å; W29-F224 HydrophobicContact CH2-CE1 3.98Å; W29-F224 AromaticContact CH2-CE2 3.91Å; W29-F224 HydrophobicContact CH2-CE2 3.91Å; W29-F224 AromaticContact CH2-CZ 3.62Å; W29-F224 HydrophobicContact CH2-CZ 3.62Å; W29-F224 HydrophobicContact CZ2-CD1 4.46Å; W29-F224 AromaticContact CZ2-CE1 3.58Å; W29-F224 HydrophobicContact CZ2-CE1 3.58Å; W29-F224 HydrophobicContact CZ2-CE2 4.14Å; W29-F224 AromaticContact CZ2-CZ 3.37Å; W29-F224 HydrophobicContact CZ2-CZ 3.37Å; W29-F224 HydrophobicContact CZ3-CE2 4.4Å; W29-F224 HydrophobicContact CZ3-CZ 4.38Å; F224-Y258 PolarHBondContact N-O 3.35Å; F224-Q259 HydrophobicContact CB-CG 4.42Å; F224-R260 PolarHBondContact O-N 3.32Å
225	P	54.4	Low	75.8	Confident	96 Å²	96	48.7 Å²	48.7	62%	0.623	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.6	147.4	165.4	25.9	-32.8	0	0	0	110.7	D227	P225-D227 PolarHBondContact O-N 3.05Å
226	C	64.6	Low	76.4	Confident	53 Å²	53	45.3 Å²	45.3	36%	0.358	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-62.3	123	179.1	-170.8	0	0	0	0	111	C261	C226-C261 HydrophobicContact CB-CB 3.83Å; C226-C261 WeakPolarHBondContact CB-SG 3.4Å; C226-C261 WeakPolarHBondContact SG-CB 3.47Å; C226-C261 CovalentContact SG-SG 2.03Å; C226-C261 PolarHBondContact SG-SG 3.33Å
227	D	66.4	Low	76.9	Confident	93 Å²	93	45.8 Å²	45.8	50%	0.497	24%	0.239	S	C	.	.			trans	-109.4	22.1	178	-165	20.8	0	0	0	111.2	P225 R255	P225-D227 PolarHBondContact O-N 3.05Å; D227-R255 IonicContact OD2-NH1 3.34Å
228	R	76.3	Confident	77.2	Confident	43 Å²	43	49.6 Å²	49.6	16%	0.162	26%	0.257	C	S	.	.			trans	-93.7	115.7	-179.3	-61.6	-176.8	-173.4	-153.6	-4.9	108.9	Y248 A251 E256	R228-Y248 HydrophobicContact CB-CD1 4.08Å; R228-A251 HydrophobicContact CG-CB 4.23Å; R228-E256 IonicContact CZ-OE1 3.81Å; R228-E256 IonicContact NH1-OE1 3.53Å; R228-E256 IonicContact NH2-OE1 3.87Å; R228-E256 PolarHBondContact NH2-OE1 3.41Å
229	N	79.9	Confident	77.3	Confident	111 Å²	111	56.3 Å²	56.3	59%	0.594	29%	0.293	S	S	*	.			trans	-76.3	134.8	176.5	-73.1	-27.4	0	0	0	109.9	Y248 T249	N229-Y248 WeakPolarHBondContact O-CA 3.48Å; N229-T249 PolarHBondContact N-OG1 3.07Å; N229-T249 PolarHBondContact O-N 3.14Å
230	R	85	Confident	77.6	Confident	120 Å²	120	59.8 Å²	59.8	45%	0.453	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	124.1	173.5	-173.1	175.7	68.6	176.7	-0.1	108.9	Y246 Y248 D264	R230-Y246 HydrophobicContact CG-CD1 3.72Å; R230-Y246 HydrophobicContact CG-CG 3.84Å; R230-Y248 HydrophobicContact CB-CD1 4.23Å; R230-Y248 HydrophobicContact CB-CE1 3.72Å; R230-Y248 HydrophobicContact CG-CE1 4.12Å; R230-Y248 HydrophobicContact CG-CE2 4.46Å; R230-D264 WeakPolarHBondContact CD-O 3.37Å; R230-D264 IonicContact NH1-OD2 2.81Å; R230-D264 PolarHBondContact NH1-OD2 3.22Å
231	T	87	Confident	78.2	Confident	47 Å²	47	63 Å²	63	29%	0.288	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	136.2	177.2	-52.4	0	0	0	0	109.6	Y246 Y247	T231-Y246 WeakPolarHBondContact O-CA 3.44Å; T231-Y247 HydrophobicContact CG2-CE1 3.82Å; T231-Y247 HydrophobicContact CG2-CE2 4.31Å; T231-Y247 WeakPolarHBondContact CG2-OH 3.39Å; T231-Y247 PolarHBondContact N-O 3.2Å; T231-Y247 PolarHBondContact O-N 3.08Å; T231-Y247 VanDerWaalsContact O-N 3.07Å
232	F	88.1	Confident	79.2	Confident	160 Å²	160	64.6 Å²	64.6	70%	0.702	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	127.3	174.8	179.9	-102.3	0	0	0	110	S245 Y246	F232-S245 WeakPolarHBondContact CD2-O 3.44Å; F232-Y246 HydrophobicContact CB-CD1 4.11Å; F232-Y246 HydrophobicContact CB-CE1 3.89Å; F232-Y246 HydrophobicContact CD2-CD1 4.11Å; F232-Y246 AromaticContact CD2-CE1 3.6Å; F232-Y246 HydrophobicContact CD2-CE1 3.6Å; F232-Y246 HydrophobicContact CG-CE1 4.24Å
233	G	87.7	Confident	80.4	Confident	11 Å²	11	65.5 Å²	65.5	11%	0.113	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.4	125.4	178.3	0	0	0	0	0	109	N235 S245	G233-N235 PolarHBondContact O-N 3Å; G233-N235 PolarHBondContact O-OD1 3.08Å; G233-S245 CarbonylContact C-O 3.34Å; G233-S245 PolarHBondContact N-O 2.03Å; G233-S245 CarbonylContact O-C 3.56Å
234	C	90.4	Very high	82	Confident	37 Å²	37	64.2 Å²	64.2	25%	0.25	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	115.7	178.8	-174.4	0	0	0	0	109.6	V244 C269 N270 P301	C234-V244 WeakPolarHBondContact CA-O 3.41Å; C234-C269 WeakPolarHBondContact CA-SG 3.16Å; C234-C269 HydrophobicContact CB-CB 3.88Å; C234-C269 WeakPolarHBondContact CB-SG 3.24Å; C234-C269 WeakPolarHBondContact SG-CB 3.08Å; C234-C269 CovalentContact SG-SG 2.02Å; C234-C269 PolarHBondContact SG-SG 2.76Å; C234-N270 PolarHBondContact SG-O 3.09Å; C234-P301 WeakPolarHBondContact O-CD 3.5Å
235	N	90.7	Very high	83.8	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.048	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	156.4	-175.2	78.7	-76.4	0	0	0	110.6	G233 N237 C243 V244 Y246 Y247 C271 Q300 P301 L305	G233-N235 PolarHBondContact O-N 3Å; G233-N235 PolarHBondContact O-OD1 3.08Å; N235-N237 PolarHBondContact O-N 2.78Å; N235-C243 WeakPolarHBondContact O-CA 2.91Å; N235-V244 PolarHBondContact N-O 3.39Å; N235-V244 PolarHBondContact O-N 3.11Å; N235-V244 PolarHBondContact OD1-O 2.02Å; N235-Y246 PolarHBondContact OD1-O 2.8Å; N235-Y247 WeakPolarHBondContact OD1-CB 3.49Å; N235-C271 VanDerWaalsContact C-SG 3.58Å; N235-Q300 VanDerWaalsContact CB-OE1 3.31Å; N235-P301 VanDerWaalsContact CB-CD 3.46Å; N235-P301 HydrophobicContact CB-CG 3.66Å; N235-L305 HydrophobicContact CB-CD1 3.91Å
236	F	90.9	Very high	85.5	Confident	5 Å²	5	60.5 Å²	60.5	2%	0.022	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	121.7	171.9	-170.2	-99.9	0	0	0	109.6	H238 N241 I298 Q300 V308 Q317	F236-H238 AromaticContact CE1-ND1 3.96Å; F236-N241 WeakPolarHBondContact CZ-OD1 3.34Å; F236-I298 HydrophobicContact CB-CD1 3.96Å; F236-I298 HydrophobicContact CB-CG2 4.1Å; F236-I298 HydrophobicContact CD2-CD1 3.49Å; F236-I298 VanDerWaalsContact CD2-CD1 3.49Å; F236-I298 HydrophobicContact CE2-CD1 4.24Å; F236-I298 HydrophobicContact CG-CD1 3.88Å; F236-Q300 PolarHBondContact O-NE2 3.47Å; F236-Q300 VanDerWaalsContact O-NE2 3.16Å; F236-V308 HydrophobicContact CB-CG2 3.98Å; F236-V308 HydrophobicContact CD1-CG1 4.47Å; F236-V308 HydrophobicContact CD1-CG2 4.31Å; F236-V308 HydrophobicContact CG-CG2 4.46Å; F236-Q317 HydrophobicContact CE1-CB 3.76Å; F236-Q317 HydrophobicContact CE1-CG 3.68Å; F236-Q317 HydrophobicContact CE2-CB 4.5Å; F236-Q317 HydrophobicContact CZ-CB 3.78Å; F236-Q317 HydrophobicContact CZ-CG 3.64Å
237	N	89.5	Confident	86.6	Confident	12 Å²	12	58.5 Å²	58.5	6%	0.064	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	116.9	174.5	-178.6	-44.9	0	0	0	109.3	N235 D239 L240 N241 R242 V244 Y265	N235-N237 PolarHBondContact O-N 2.78Å; N237-D239 WeakPolarHBondContact OD1-CA 3.42Å; N237-D239 WeakPolarHBondContact OD1-CB 3.33Å; N237-D239 PolarHBondContact OD1-N 3.19Å; N237-L240 HydrophobicContact CB-CB 4.37Å; N237-L240 PolarHBondContact OD1-N 3.01Å; N237-N241 WeakPolarHBondContact O-CA 3.49Å; N237-N241 PolarHBondContact O-N 2.98Å; N237-R242 PolarHBondContact N-O 3.44Å; N237-R242 PolarHBondContact O-N 3.37Å; N237-V244 HydrophobicContact CB-CG1 4.5Å; N237-V244 HydrophobicContact CB-CG2 3.69Å; N237-Y265 VanDerWaalsContact ND2-CD1 3.28Å; N237-Y265 WeakPolarHBondContact ND2-CD1 3.22Å; N237-Y265 WeakPolarHBondContact ND2-CE1 3.38Å; N237-Y265 VanDerWaalsContact ND2-CZ 3.34Å
238	H	85.3	Confident	87.5	Confident	80 Å²	80	55.8 Å²	55.8	37%	0.37	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-37.1	-178.9	-71.4	-82.1	0	0	0	113	F236 N241	F236-H238 AromaticContact CE1-ND1 3.96Å; H238-N241 PolarHBondContact O-N 2.97Å
239	D	82.7	Confident	87.5	Confident	142 Å²	142	55.8 Å²	55.8	76%	0.759	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-38.4	-178.3	-57	-36.8	0	0	0	111.7	N237	N237-D239 WeakPolarHBondContact OD1-CA 3.42Å; N237-D239 WeakPolarHBondContact OD1-CB 3.33Å; N237-D239 PolarHBondContact OD1-N 3.19Å
240	L	85.7	Confident	87.1	Confident	73 Å²	73	57.5 Å²	57.5	38%	0.382	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-5.6	177.2	-60	-179.5	0	0	0	113.1	N237 R242 V244 Y265	N237-L240 HydrophobicContact CB-CB 4.37Å; N237-L240 PolarHBondContact OD1-N 3.01Å; L240-R242 HydrophobicContact CB-CG 3.99Å; L240-R242 PolarHBondContact O-N 3.36Å; L240-V244 HydrophobicContact CD1-CG1 4.11Å; L240-Y265 HydrophobicContact CD1-CD2 3.59Å; L240-Y265 HydrophobicContact CD1-CE2 4.14Å; L240-Y265 HydrophobicContact CD1-CG 4.05Å
241	N	88.2	Confident	86.2	Confident	67 Å²	67	52.2 Å²	52.2	36%	0.358	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	41.5	-175.1	-161.1	44.9	0	0	0	113.6	F236 N237 H238 T316 Q317	F236-N241 WeakPolarHBondContact CZ-OD1 3.34Å; N237-N241 WeakPolarHBondContact O-CA 3.49Å; N237-N241 PolarHBondContact O-N 2.98Å; H238-N241 PolarHBondContact O-N 2.97Å; N241-T316 PolarHBondContact ND2-OG1 3.38Å; N241-T316 VanDerWaalsContact ND2-OG1 3.16Å; N241-Q317 WeakPolarHBondContact OD1-CG 3.41Å
242	R	91	Very high	85.2	Confident	118 Å²	118	52.9 Å²	52.9	45%	0.445	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	163	-179.2	70.1	-175.9	-178.5	164	-0.9	112.3	N237 L240 V244 T268	N237-R242 PolarHBondContact N-O 3.44Å; N237-R242 PolarHBondContact O-N 3.37Å; L240-R242 HydrophobicContact CB-CG 3.99Å; L240-R242 PolarHBondContact O-N 3.36Å; R242-V244 HydrophobicContact CG-CG1 4.15Å; R242-T268 PolarHBondContact NH1-OG1 2.86Å
243	C	92	Very high	84	Confident	19 Å²	19	51 Å²	51	13%	0.128	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	135.1	172.7	-69.2	0	0	0	0	112.3	N235 T268 C269 C271	N235-C243 WeakPolarHBondContact O-CA 2.91Å; C243-T268 WeakPolarHBondContact O-CA 3.39Å; C243-C269 WeakPolarHBondContact CB-O 3.31Å; C243-C269 PolarHBondContact O-N 2.98Å; C243-C271 HydrophobicContact CB-CB 4.21Å; C243-C271 WeakPolarHBondContact CB-SG 3.46Å; C243-C271 WeakPolarHBondContact SG-CB 3.23Å; C243-C271 CovalentContact SG-SG 2.02Å; C243-C271 PolarHBondContact SG-SG 3.5Å
244	V	92.7	Very high	82.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	151.5	-177.7	-65.6	0	0	0	0	111.2	C234 N235 N237 L240 R242 Y246 Y265 C269	C234-V244 WeakPolarHBondContact CA-O 3.41Å; N235-V244 PolarHBondContact N-O 3.39Å; N235-V244 PolarHBondContact O-N 3.11Å; N235-V244 PolarHBondContact OD1-O 2.02Å; N237-V244 HydrophobicContact CB-CG1 4.5Å; N237-V244 HydrophobicContact CB-CG2 3.69Å; L240-V244 HydrophobicContact CD1-CG1 4.11Å; R242-V244 HydrophobicContact CG-CG1 4.15Å; V244-Y246 PolarHBondContact O-N 2.06Å; V244-Y265 HydrophobicContact CG2-CD1 4.26Å; V244-Y265 HydrophobicContact CG2-CG 4.4Å; V244-C269 PolarHBondContact O-SG 2.69Å
245	S	91.5	Very high	81	Confident	9 Å²	9	58 Å²	58	6%	0.063	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-16.7	-170.9	51.3	0	0	0	0	115.4	F232 G233 Y265 G266 S267	F232-S245 WeakPolarHBondContact CD2-O 3.44Å; G233-S245 CarbonylContact C-O 3.34Å; G233-S245 PolarHBondContact N-O 2.03Å; G233-S245 CarbonylContact O-C 3.56Å; S245-Y265 PolarHBondContact N-O 3.04Å; S245-Y265 PolarHBondContact OG-O 3.34Å; S245-G266 WeakPolarHBondContact OG-CA 3.35Å; S245-S267 PolarHBondContact N-O 2.8Å; S245-S267 PolarHBondContact OG-N 3.18Å; S245-S267 PolarHBondContact OG-O 3.22Å
246	Y	90.3	Very high	79.5	Confident	62 Å²	62	62 Å²	62	24%	0.243	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.7	-178.5	-61.6	-74.9	0	0	0	112	R230 T231 F232 N235 V244 Y265	R230-Y246 HydrophobicContact CG-CD1 3.72Å; R230-Y246 HydrophobicContact CG-CG 3.84Å; T231-Y246 WeakPolarHBondContact O-CA 3.44Å; F232-Y246 HydrophobicContact CB-CD1 4.11Å; F232-Y246 HydrophobicContact CB-CE1 3.89Å; F232-Y246 HydrophobicContact CD2-CD1 4.11Å; F232-Y246 AromaticContact CD2-CE1 3.6Å; F232-Y246 HydrophobicContact CD2-CE1 3.6Å; F232-Y246 HydrophobicContact CG-CE1 4.24Å; N235-Y246 PolarHBondContact OD1-O 2.8Å; V244-Y246 PolarHBondContact O-N 2.06Å; Y246-Y265 PolarHBondContact N-O 3.09Å
247	Y	87.9	Confident	77.8	Confident	11 Å²	11	69 Å²	69	4%	0.043	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	168.2	168.2	67.2	-82.8	0	0	0	110.7	T231 N235 P301 N302 L305	T231-Y247 HydrophobicContact CG2-CE1 3.82Å; T231-Y247 HydrophobicContact CG2-CE2 4.31Å; T231-Y247 WeakPolarHBondContact CG2-OH 3.39Å; T231-Y247 PolarHBondContact N-O 3.2Å; T231-Y247 PolarHBondContact O-N 3.08Å; T231-Y247 VanDerWaalsContact O-N 3.07Å; N235-Y247 WeakPolarHBondContact OD1-CB 3.49Å; Y247-P301 HydrophobicContact CD1-CG 4.17Å; Y247-P301 HydrophobicContact CE1-CB 4.41Å; Y247-P301 HydrophobicContact CE1-CG 3.96Å; Y247-N302 PolarHBondContact OH-ND2 2.75Å; Y247-L305 HydrophobicContact CD1-CD1 4.4Å; Y247-L305 HydrophobicContact CD2-CD1 4.04Å; Y247-L305 HydrophobicContact CD2-CD2 4.24Å; Y247-L305 HydrophobicContact CD2-CG 4.33Å; Y247-L305 HydrophobicContact CE2-CD1 4.45Å; Y247-L305 HydrophobicContact CG-CD1 4.01Å
248	Y	84.3	Confident	76	Confident	36 Å²	36	72.3 Å²	72.3	14%	0.141	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.2	-176.8	-71.3	-91.9	0	0	0	109.8	R228 N229 R230 F263 D264 Y265	R228-Y248 HydrophobicContact CB-CD1 4.08Å; N229-Y248 WeakPolarHBondContact O-CA 3.48Å; R230-Y248 HydrophobicContact CB-CD1 4.23Å; R230-Y248 HydrophobicContact CB-CE1 3.72Å; R230-Y248 HydrophobicContact CG-CE1 4.12Å; R230-Y248 HydrophobicContact CG-CE2 4.46Å; Y248-F263 AromaticContact CD1-CD1 3.74Å; Y248-F263 HydrophobicContact CD1-CD1 3.74Å; Y248-F263 AromaticContact CD1-CE1 3.95Å; Y248-F263 HydrophobicContact CD1-CE1 3.95Å; Y248-F263 HydrophobicContact CD2-CB 4.38Å; Y248-F263 AromaticContact CD2-CD1 3.48Å; Y248-F263 HydrophobicContact CD2-CD1 3.48Å; Y248-F263 VanDerWaalsContact CD2-CD1 3.48Å; Y248-F263 HydrophobicContact CD2-CE1 4.12Å; Y248-F263 HydrophobicContact CD2-CG 4.28Å; Y248-F263 AromaticContact CE1-CD1 3.79Å; Y248-F263 HydrophobicContact CE1-CD1 3.79Å; Y248-F263 HydrophobicContact CE1-CE1 4.38Å; Y248-F263 HydrophobicContact CE2-CB 3.82Å; Y248-F263 AromaticContact CE2-CD1 3.56Å; Y248-F263 HydrophobicContact CE2-CD1 3.56Å; Y248-F263 HydrophobicContact CE2-CG 4.14Å; Y248-F263 AromaticContact CG-CD1 3.58Å; Y248-F263 HydrophobicContact CG-CD1 3.58Å; Y248-F263 AromaticContact CG-CE1 3.79Å; Y248-F263 HydrophobicContact CG-CE1 3.79Å; Y248-F263 AromaticContact CZ-CD1 3.71Å; Y248-D264 PolarHBondContact OH-N 3.41Å; Y248-D264 PolarHBondContact OH-O 3.18Å; Y248-Y265 HydrophobicContact CD2-CD1 4.23Å; Y248-Y265 AromaticContact CD2-CE1 3.92Å; Y248-Y265 HydrophobicContact CD2-CE1 3.92Å; Y248-Y265 HydrophobicContact CE2-CD1 4.11Å; Y248-Y265 HydrophobicContact CE2-CE1 4.1Å
249	T	77	Confident	74.7	Confident	43 Å²	43	69.5 Å²	69.5	26%	0.264	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-60.2	138.8	172.5	55.3	0	0	0	0	109.8	N229 A251	N229-T249 PolarHBondContact N-OG1 3.07Å; N229-T249 PolarHBondContact O-N 3.14Å; T249-A251 PolarHBondContact O-N 3.43Å
250	K	71.1	Confident	73.5	Confident	147 Å²	147	69.7 Å²	69.7	64%	0.639	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-62.9	132.4	175.3	-68.9	-175.5	-178.3	174.8	0	109
251	A	67.1	Low	72.7	Confident	9 Å²	9	67.5 Å²	67.5	7%	0.074	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-67.2	154.9	170.8	0	0	0	0	0	109.5	R228 T249 E256 Q259	R228-A251 HydrophobicContact CG-CB 4.23Å; T249-A251 PolarHBondContact O-N 3.43Å; A251-E256 HydrophobicContact CB-CB 4.38Å; A251-Q259 VanDerWaalsContact CB-OE1 3.32Å
252	P	65.8	Low	71.8	Confident	60 Å²	60	71.1 Å²	71.1	39%	0.39	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-48.7	137.9	166.5	-28.6	36.8	0	0	0	110.8	D254 R255 E256	P252-D254 WeakPolarHBondContact CB-OD1 3.28Å; P252-D254 PolarHBondContact O-N 3.22Å; P252-R255 HydrophobicContact CB-CG 4.48Å; P252-R255 PolarHBondContact O-N 3.26Å; P252-E256 PolarHBondContact O-N 2.91Å
253	P	63	Low	71.4	Confident	122 Å²	122	68.9 Å²	68.9	79%	0.792	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-29.4	-172.3	-26.7	33.4	0	0	0	114.3	R255	P253-R255 VanDerWaalsContact C-N 3.3Å; P253-R255 PolarHBondContact O-N 3.3Å
254	D	55.8	Low	71.1	Confident	106 Å²	106	72.1 Å²	72.1	57%	0.567	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-22.1	177	60.8	-51.6	0	0	0	113.6	P252 Y258	P252-D254 WeakPolarHBondContact CB-OD1 3.28Å; P252-D254 PolarHBondContact O-N 3.22Å; D254-Y258 WeakPolarHBondContact O-CD2 3.26Å; D254-Y258 WeakPolarHBondContact O-CE2 3.2Å
255	R	58.3	Low	70.9	Confident	87 Å²	87	74.4 Å²	74.4	33%	0.328	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-22.3	-175.8	-63.2	-171.4	-180	-165.3	-2.1	114.3	D227 P252 P253 K257 Y258 Q259	D227-R255 IonicContact OD2-NH1 3.34Å; P252-R255 HydrophobicContact CB-CG 4.48Å; P252-R255 PolarHBondContact O-N 3.26Å; P253-R255 VanDerWaalsContact C-N 3.3Å; P253-R255 PolarHBondContact O-N 3.3Å; R255-K257 VanDerWaalsContact C-N 3.28Å; R255-K257 PolarHBondContact O-N 2.77Å; R255-Y258 PolarHBondContact O-N 3.03Å; R255-Q259 PolarHBondContact O-N 3.03Å
256	E	60	Low	70.8	Confident	95 Å²	95	75.1 Å²	75.1	44%	0.444	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-52.2	-42.8	-172	170.6	145.6	-119.8	0	0	113.5	R228 A251 P252 Y258	R228-E256 IonicContact CZ-OE1 3.81Å; R228-E256 IonicContact NH1-OE1 3.53Å; R228-E256 IonicContact NH2-OE1 3.87Å; R228-E256 PolarHBondContact NH2-OE1 3.41Å; A251-E256 HydrophobicContact CB-CB 4.38Å; P252-E256 PolarHBondContact O-N 2.91Å; E256-Y258 VanDerWaalsContact C-N 3.31Å; E256-Y258 PolarHBondContact O-N 3.47Å
257	K	53.8	Low	70.9	Confident	151 Å²	151	76.3 Å²	76.3	66%	0.657	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-67.8	-26.8	179.6	-173.9	175	178.4	-179.3	0	113.9	R255	R255-K257 VanDerWaalsContact C-N 3.28Å; R255-K257 PolarHBondContact O-N 2.77Å
258	Y	51.9	Low	71	Confident	82 Å²	82	80 Å²	80	32%	0.322	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-104.8	5.5	-168.8	-52.3	-71	0	0	0	113.6	P26 A223 F224 D254 R255 E256	P26-Y258 HydrophobicContact CB-CE1 4.35Å; A223-Y258 CarbonylContact C-O 3.6Å; A223-Y258 WeakPolarHBondContact CA-O 3.49Å; A223-Y258 WeakPolarHBondContact CB-O 3.33Å; F224-Y258 PolarHBondContact N-O 3.35Å; D254-Y258 WeakPolarHBondContact O-CD2 3.26Å; D254-Y258 WeakPolarHBondContact O-CE2 3.2Å; R255-Y258 PolarHBondContact O-N 3.03Å; E256-Y258 VanDerWaalsContact C-N 3.31Å; E256-Y258 PolarHBondContact O-N 3.47Å
259	Q	58.3	Low	71.3	Confident	21 Å²	21	79.6 Å²	79.6	10%	0.098	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	129.2	178	-74.3	-179.3	-14.5	0	0	110.6	F224 A251 R255 C261	F224-Q259 HydrophobicContact CB-CG 4.42Å; A251-Q259 VanDerWaalsContact CB-OE1 3.32Å; R255-Q259 PolarHBondContact O-N 3.03Å; Q259-C261 PolarHBondContact O-N 3.38Å
260	R	59	Low	72	Confident	145 Å²	145	85.1 Å²	85.1	55%	0.547	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	97.5	165.9	-73.4	-176.3	-173.9	147.2	0.6	108.9	A223 F224	A223-R260 HydrophobicContact CB-CG 4.3Å; F224-R260 PolarHBondContact O-N 3.32Å
261	C	67.6	Low	72.9	Confident	27 Å²	27	79 Å²	79	18%	0.182	42%	0.42	C	S	.	.			trans	-103.6	129.5	175.9	-65.9	0	0	0	0	110.6	C226 Q259 F263	C226-C261 HydrophobicContact CB-CB 3.83Å; C226-C261 WeakPolarHBondContact CB-SG 3.4Å; C226-C261 WeakPolarHBondContact SG-CB 3.47Å; C226-C261 CovalentContact SG-SG 2.03Å; C226-C261 PolarHBondContact SG-SG 3.33Å; Q259-C261 PolarHBondContact O-N 3.38Å; C261-F263 HydrophobicContact CB-CD1 4.06Å; C261-F263 HydrophobicContact CB-CD2 4.27Å; C261-F263 HydrophobicContact CB-CE1 3.45Å; C261-F263 VanDerWaalsContact CB-CE1 3.45Å; C261-F263 HydrophobicContact CB-CE2 3.67Å; C261-F263 HydrophobicContact CB-CG 4.45Å; C261-F263 HydrophobicContact CB-CZ 3.23Å
262	T	70	Confident	74	Confident	144 Å²	144	81.5 Å²	81.5	88%	0.883	44%	0.44	S	S	*	.			trans	-93.9	112.8	161.5	-53.4	0	0	0	0	107.4
263	F	82.2	Confident	75.2	Confident	70 Å²	70	80.8 Å²	80.8	31%	0.307	44%	0.436	S	S	.	.			trans	-92.7	124.7	-177.1	-60.3	-66.3	0	0	0	111	Y248 C261 Y265	Y248-F263 AromaticContact CD1-CD1 3.74Å; Y248-F263 HydrophobicContact CD1-CD1 3.74Å; Y248-F263 AromaticContact CD1-CE1 3.95Å; Y248-F263 HydrophobicContact CD1-CE1 3.95Å; Y248-F263 HydrophobicContact CD2-CB 4.38Å; Y248-F263 AromaticContact CD2-CD1 3.48Å; Y248-F263 HydrophobicContact CD2-CD1 3.48Å; Y248-F263 VanDerWaalsContact CD2-CD1 3.48Å; Y248-F263 HydrophobicContact CD2-CE1 4.12Å; Y248-F263 HydrophobicContact CD2-CG 4.28Å; Y248-F263 AromaticContact CE1-CD1 3.79Å; Y248-F263 HydrophobicContact CE1-CD1 3.79Å; Y248-F263 HydrophobicContact CE1-CE1 4.38Å; Y248-F263 HydrophobicContact CE2-CB 3.82Å; Y248-F263 AromaticContact CE2-CD1 3.56Å; Y248-F263 HydrophobicContact CE2-CD1 3.56Å; Y248-F263 HydrophobicContact CE2-CG 4.14Å; Y248-F263 AromaticContact CG-CD1 3.58Å; Y248-F263 HydrophobicContact CG-CD1 3.58Å; Y248-F263 AromaticContact CG-CE1 3.79Å; Y248-F263 HydrophobicContact CG-CE1 3.79Å; Y248-F263 AromaticContact CZ-CD1 3.71Å; C261-F263 HydrophobicContact CB-CD1 4.06Å; C261-F263 HydrophobicContact CB-CD2 4.27Å; C261-F263 HydrophobicContact CB-CE1 3.45Å; C261-F263 VanDerWaalsContact CB-CE1 3.45Å; C261-F263 HydrophobicContact CB-CE2 3.67Å; C261-F263 HydrophobicContact CB-CG 4.45Å; C261-F263 HydrophobicContact CB-CZ 3.23Å; F263-Y265 HydrophobicContact CB-CD2 4.16Å; F263-Y265 HydrophobicContact CB-CE1 4.24Å; F263-Y265 HydrophobicContact CB-CE2 3.51Å; F263-Y265 HydrophobicContact CG-CE2 4.4Å
264	D	85.9	Confident	76.5	Confident	87 Å²	87	76.2 Å²	76.2	47%	0.465	41%	0.407	S	S	.	.			trans	-109.1	95	168	173.9	21.4	0	0	0	108.8	R230 Y248 G266	R230-D264 WeakPolarHBondContact CD-O 3.37Å; R230-D264 IonicContact NH1-OD2 2.81Å; R230-D264 PolarHBondContact NH1-OD2 3.22Å; Y248-D264 PolarHBondContact OH-N 3.41Å; Y248-D264 PolarHBondContact OH-O 3.18Å; D264-G266 PolarHBondContact O-N 3.15Å; D264-G266 WeakPolarHBondContact OD1-CA 3.24Å; D264-G266 PolarHBondContact OD1-N 3.02Å
265	Y	89	Confident	78.1	Confident	49 Å²	49	78.8 Å²	78.8	19%	0.192	42%	0.421	C	S	.	.			trans	-74.8	-5.7	178.1	-59.8	-77.2	0	0	0	113.1	N237 L240 V244 S245 Y246 Y248 F263	N237-Y265 VanDerWaalsContact ND2-CD1 3.28Å; N237-Y265 WeakPolarHBondContact ND2-CD1 3.22Å; N237-Y265 WeakPolarHBondContact ND2-CE1 3.38Å; N237-Y265 VanDerWaalsContact ND2-CZ 3.34Å; L240-Y265 HydrophobicContact CD1-CD2 3.59Å; L240-Y265 HydrophobicContact CD1-CE2 4.14Å; L240-Y265 HydrophobicContact CD1-CG 4.05Å; V244-Y265 HydrophobicContact CG2-CD1 4.26Å; V244-Y265 HydrophobicContact CG2-CG 4.4Å; S245-Y265 PolarHBondContact N-O 3.04Å; S245-Y265 PolarHBondContact OG-O 3.34Å; Y246-Y265 PolarHBondContact N-O 3.09Å; Y248-Y265 HydrophobicContact CD2-CD1 4.23Å; Y248-Y265 AromaticContact CD2-CE1 3.92Å; Y248-Y265 HydrophobicContact CD2-CE1 3.92Å; Y248-Y265 HydrophobicContact CE2-CD1 4.11Å; Y248-Y265 HydrophobicContact CE2-CE1 4.1Å; F263-Y265 HydrophobicContact CB-CD2 4.16Å; F263-Y265 HydrophobicContact CB-CE1 4.24Å; F263-Y265 HydrophobicContact CB-CE2 3.51Å; F263-Y265 HydrophobicContact CG-CE2 4.4Å
266	G	89.5	Confident	79.6	Confident	24 Å²	24	78.7 Å²	78.7	25%	0.247	43%	0.433	C	S	.	.			trans	72.5	-158.2	-178.2	0	0	0	0	0	114.2	S245 D264	S245-G266 WeakPolarHBondContact OG-CA 3.35Å; D264-G266 PolarHBondContact O-N 3.15Å; D264-G266 WeakPolarHBondContact OD1-CA 3.24Å; D264-G266 PolarHBondContact OD1-N 3.02Å
267	S	91.3	Very high	81.2	Confident	87 Å²	87	76.5 Å²	76.5	61%	0.608	42%	0.421	S	S	*	.	S	Bend	trans	-76.6	162.2	-177.8	57.4	0	0	0	0	112.1	S245	S245-S267 PolarHBondContact N-O 2.8Å; S245-S267 PolarHBondContact OG-N 3.18Å; S245-S267 PolarHBondContact OG-O 3.22Å
268	T	90	Very high	83	Confident	88 Å²	88	71.7 Å²	71.7	54%	0.54	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-62.6	137.8	168.1	-54.3	0	0	0	0	110	R242 C243	R242-T268 PolarHBondContact NH1-OG1 2.86Å; C243-T268 WeakPolarHBondContact O-CA 3.39Å
269	C	90.9	Very high	85	Confident	27 Å²	27	76.3 Å²	76.3	18%	0.182	43%	0.429	C	S	.	.			trans	-130.4	166.8	178.1	64.5	0	0	0	0	110.4	C234 C243 V244	C234-C269 WeakPolarHBondContact CA-SG 3.16Å; C234-C269 HydrophobicContact CB-CB 3.88Å; C234-C269 WeakPolarHBondContact CB-SG 3.24Å; C234-C269 WeakPolarHBondContact SG-CB 3.08Å; C234-C269 CovalentContact SG-SG 2.02Å; C234-C269 PolarHBondContact SG-SG 2.76Å; C243-C269 WeakPolarHBondContact CB-O 3.31Å; C243-C269 PolarHBondContact O-N 2.98Å; V244-C269 PolarHBondContact O-SG 2.69Å
270	N	90.7	Very high	86.7	Confident	160 Å²	160	79 Å²	79	86%	0.856	44%	0.438	S	S	*	.			trans	-93.2	107.8	176.7	-67.5	-19.8	0	0	0	109.5	C234	C234-N270 PolarHBondContact SG-O 3.09Å
271	C	90.6	Very high	88.4	Confident	19 Å²	19	74.1 Å²	74.1	13%	0.128	43%	0.425	C	S	.	.			trans	-66.9	146.6	176.1	-63.9	0	0	0	0	111.6	N235 C243 I298	N235-C271 VanDerWaalsContact C-SG 3.58Å; C243-C271 HydrophobicContact CB-CB 4.21Å; C243-C271 WeakPolarHBondContact CB-SG 3.46Å; C243-C271 WeakPolarHBondContact SG-CB 3.23Å; C243-C271 CovalentContact SG-SG 2.02Å; C243-C271 PolarHBondContact SG-SG 3.5Å; C271-I298 HydrophobicContact CB-CD1 4.39Å; C271-I298 HydrophobicContact CB-CG1 4.41Å; C271-I298 HydrophobicContact CB-CG2 3.44Å; C271-I298 VanDerWaalsContact CB-CG2 3.44Å
272	A	90.7	Very high	89.5	Confident	60 Å²	60	78.1 Å²	78.1	50%	0.496	45%	0.453	S	S	.	.			trans	-73.6	145.5	171.5	0	0	0	0	0	111	I299	A272-I299 HydrophobicContact CB-CB 4.41Å; A272-I299 HydrophobicContact CB-CD1 4.39Å; A272-I299 PolarHBondContact O-N 3Å
273	C	91.5	Very high	90.5	Very high	46 Å²	46	75.6 Å²	75.6	31%	0.311	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-106.6	144	-177.6	-54.6	0	0	0	0	110.3	I299 C319	C273-I299 VanDerWaalsContact O-CD1 3.32Å; C273-I299 WeakPolarHBondContact O-CD1 3.03Å; C273-C319 WeakPolarHBondContact CA-SG 3.42Å; C273-C319 HydrophobicContact CB-CB 3.57Å; C273-C319 WeakPolarHBondContact CB-SG 3.41Å; C273-C319 WeakPolarHBondContact SG-CB 3.4Å; C273-C319 CovalentContact SG-SG 2.02Å; C273-C319 PolarHBondContact SG-SG 3.14Å
274	S	90.4	Very high	90.8	Very high	26 Å²	26	74 Å²	74	18%	0.182	43%	0.425	C	S	.	.			trans	-67	147.8	168.5	-173.5	0	0	0	0	110.7	S276 Y277 A296 P297	S274-S276 PolarHBondContact O-N 3.4Å; S274-S276 WeakPolarHBondContact OG-CB 2.99Å; S274-S276 PolarHBondContact OG-N 3.43Å; S274-S276 PolarHBondContact OG-OG 3.47Å; S274-Y277 VanDerWaalsContact O-CE2 3.31Å; S274-Y277 WeakPolarHBondContact O-CE2 3.22Å; S274-A296 WeakPolarHBondContact O-CB 3.26Å; S274-P297 PolarHBondContact N-O 3.5Å
275	D	89.2	Confident	90.8	Very high	160 Å²	160	74.5 Å²	74.5	86%	0.856	44%	0.435	S	S	*	.	S	Bend	trans	-70.9	-8.7	170.1	-64	-42.7	0	0	0	112.7	Y277	D275-Y277 PolarHBondContact O-N 2.85Å
276	S	90.2	Very high	90.6	Very high	84 Å²	84	75.3 Å²	75.3	59%	0.587	45%	0.445	S	S	*	.			trans	-75.6	55.5	-179.9	-40.3	0	0	0	0	112.8	S274	S274-S276 PolarHBondContact O-N 3.4Å; S274-S276 WeakPolarHBondContact OG-CB 2.99Å; S274-S276 PolarHBondContact OG-N 3.43Å; S274-S276 PolarHBondContact OG-OG 3.47Å
277	Y	92.7	Very high	90.5	Very high	50 Å²	50	75 Å²	75	20%	0.196	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-69.2	143.7	178.6	-81.3	-89.3	0	0	0	112.3	S274 D275 R294 I295 A296 Q321	S274-Y277 VanDerWaalsContact O-CE2 3.31Å; S274-Y277 WeakPolarHBondContact O-CE2 3.22Å; D275-Y277 PolarHBondContact O-N 2.85Å; Y277-R294 HydrophobicContact CD1-CB 4.37Å; Y277-R294 HydrophobicContact CD1-CG 3.7Å; Y277-R294 HydrophobicContact CE1-CG 4.41Å; Y277-R294 HydrophobicContact CG-CG 4.38Å; Y277-I295 WeakPolarHBondContact CA-O 3.45Å; Y277-A296 HydrophobicContact CD1-CB 3.55Å; Y277-A296 HydrophobicContact CD2-CB 3.88Å; Y277-A296 HydrophobicContact CE1-CB 3.51Å; Y277-A296 HydrophobicContact CE2-CB 3.83Å; Y277-A296 HydrophobicContact CG-CB 3.75Å; Y277-Q321 HydrophobicContact CE1-CB 4.17Å; Y277-Q321 HydrophobicContact CE1-CG 3.64Å; Y277-Q321 VanDerWaalsContact CZ-CD 3.44Å; Y277-Q321 PolarHBondContact OH-NE2 3.49Å
278	T	92.4	Very high	90.4	Very high	49 Å²	49	74.3 Å²	74.3	30%	0.301	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-62.7	164.2	167.4	65.7	0	0	0	0	111	I295	T278-I295 HydrophobicContact CG2-CG1 3.72Å; T278-I295 PolarHBondContact N-O 3.46Å; T278-I295 PolarHBondContact OG1-N 3.42Å; T278-I295 PolarHBondContact OG1-O 3.26Å
279	Q	92.8	Very high	90.4	Very high	180 Å²	180	73.1 Å²	73.1	84%	0.841	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-56.9	148.4	164	-65.9	-174.4	-14.6	0	0	110.3
280	W	94.9	Very high	90.2	Very high	76 Å²	76	72.1 Å²	72.1	29%	0.288	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-62.1	138.9	174.3	-74.8	101.6	0	0	0	110.5	R292 R294 Q321 E323	W280-R292 HydrophobicContact CD2-CG 4.37Å; W280-R292 HydrophobicContact CE3-CB 4.27Å; W280-R292 HydrophobicContact CE3-CG 3.63Å; W280-R292 HydrophobicContact CZ3-CG 4.05Å; W280-R294 HydrophobicContact CD2-CB 4.05Å; W280-R294 HydrophobicContact CD2-CG 3.86Å; W280-R294 HydrophobicContact CE3-CB 4.01Å; W280-R294 HydrophobicContact CE3-CG 3.88Å; W280-R294 HydrophobicContact CG-CB 4.44Å; W280-R294 HydrophobicContact CH2-CG 3.89Å; W280-R294 HydrophobicContact CZ2-CG 3.87Å; W280-R294 HydrophobicContact CZ3-CB 4.43Å; W280-R294 HydrophobicContact CZ3-CG 3.9Å; W280-Q321 HydrophobicContact CH2-CB 4.22Å; W280-E323 HydrophobicContact CH2-CB 3.81Å; W280-E323 HydrophobicContact CZ3-CB 3.87Å
281	T	93	Very high	90.3	Very high	44 Å²	44	67.5 Å²	67.5	27%	0.27	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-64.7	161.7	166.7	63.4	0	0	0	0	110.6	R292 M293 F312	T281-R292 WeakPolarHBondContact O-CB 3.01Å; T281-M293 HydrophobicContact CG2-CE 4.16Å; T281-M293 HydrophobicContact CG2-CG 4.17Å; T281-M293 WeakPolarHBondContact CG2-O 3.37Å; T281-M293 PolarHBondContact N-O 3.34Å; T281-M293 PolarHBondContact OG1-N 3.48Å; T281-M293 VanDerWaalsContact OG1-N 3.13Å; T281-M293 PolarHBondContact OG1-O 3.19Å; T281-F312 HydrophobicContact CG2-CE1 3.71Å; T281-F312 HydrophobicContact CG2-CZ 3.71Å
282	S	91.3	Very high	90.4	Very high	110 Å²	110	69.4 Å²	69.4	77%	0.769	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-54.8	149	165.5	-54.9	0	0	0	0	111
283	W	91.2	Very high	90.5	Very high	91 Å²	91	68.4 Å²	68.4	35%	0.345	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-59.2	138.4	171.1	-73	105.5	0	0	0	111	S285 S290 R292 E323 N325	W283-S285 PolarHBondContact O-N 2.87Å; W283-S290 WeakPolarHBondContact CB-OG 3.49Å; W283-S290 WeakPolarHBondContact CZ3-O 3.29Å; W283-R292 HydrophobicContact CD2-CB 4.25Å; W283-R292 HydrophobicContact CD2-CG 3.98Å; W283-R292 HydrophobicContact CE3-CB 4.1Å; W283-R292 HydrophobicContact CE3-CG 3.85Å; W283-R292 HydrophobicContact CH2-CG 3.94Å; W283-R292 HydrophobicContact CZ2-CG 4.08Å; W283-R292 VanDerWaalsContact CZ2-NE 3.35Å; W283-R292 HydrophobicContact CZ3-CB 4.48Å; W283-R292 HydrophobicContact CZ3-CG 3.81Å; W283-E323 HydrophobicContact CH2-CB 4.29Å; W283-E323 HydrophobicContact CH2-CG 3.95Å; W283-N325 HydrophobicContact CE3-CB 4.05Å; W283-N325 HydrophobicContact CH2-CB 3.68Å; W283-N325 HydrophobicContact CZ2-CB 4.38Å; W283-N325 HydrophobicContact CZ3-CB 3.49Å; W283-N325 VanDerWaalsContact CZ3-CB 3.49Å
284	S	89.2	Confident	90.7	Very high	37 Å²	37	69.7 Å²	69.7	26%	0.259	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-66	129.2	175.1	68.8	0	0	0	0	110.3	S290 T291	S284-S290 PolarHBondContact N-OG 3.44Å; S284-S290 WeakPolarHBondContact O-CB 3.06Å; S284-S290 PolarHBondContact O-OG 2.92Å; S284-S290 WeakPolarHBondContact OG-CA 3.5Å; S284-T291 WeakPolarHBondContact CB-O 2.99Å; S284-T291 PolarHBondContact N-O 3.18Å; S284-T291 PolarHBondContact OG-N 3.44Å; S284-T291 PolarHBondContact OG-O 2.83Å
285	S	85.7	Confident	90.9	Very high	98 Å²	98	68.5 Å²	68.5	69%	0.685	37%	0.37	S	S	*	.			trans	-102.6	4	-176.3	55.3	0	0	0	0	114.1	W283 L330	W283-S285 PolarHBondContact O-N 2.87Å; S285-L330 WeakPolarHBondContact O-CD1 2.97Å; S285-L330 VanDerWaalsContact O-CD2 3.28Å; S285-L330 WeakPolarHBondContact O-CD2 3.26Å
286	T	85	Confident	91	Very high	65 Å²	65	60.9 Å²	60.9	40%	0.399	33%	0.329	S	S	.	.	S	Bend	trans	-79.5	-49	-174	-48.8	0	0	0	0	112.9	Y336 N341	T286-Y336 HydrophobicContact CG2-CD1 4.27Å; T286-Y336 HydrophobicContact CG2-CE1 4.03Å; T286-Y336 PolarHBondContact O-OH 3.27Å; T286-Y336 VanDerWaalsContact O-OH 3.08Å; T286-N341 HydrophobicContact CG2-CB 4.24Å
287	C	87	Confident	91	Very high	18 Å²	18	58.5 Å²	58.5	12%	0.122	31%	0.311	C	S	.	.	S	Bend	trans	-156.2	164	-173.8	59.5	0	0	0	0	110.8	E331 C333 Y336	C287-E331 CarbonylContact C-O 3.41Å; C287-E331 WeakPolarHBondContact CA-O 3.31Å; C287-E331 VanDerWaalsContact CB-O 3.25Å; C287-E331 WeakPolarHBondContact CB-O 3.04Å; C287-C333 VanDerWaalsContact C-SG 3.59Å; C287-C333 HydrophobicContact CB-CB 3.85Å; C287-C333 WeakPolarHBondContact CB-SG 3.44Å; C287-C333 WeakPolarHBondContact SG-CA 3.06Å; C287-C333 WeakPolarHBondContact SG-CB 3.36Å; C287-C333 CovalentContact SG-SG 2.03Å; C287-C333 PolarHBondContact SG-SG 3.46Å; C287-Y336 HydrophobicContact CB-CD2 3.73Å; C287-Y336 HydrophobicContact CB-CE2 3.64Å
288	K	88.7	Confident	90.9	Very high	72 Å²	72	56.8 Å²	56.8	31%	0.313	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-93.9	147.1	175.4	72.5	175.3	175.8	-171.9	0	112.2	L330 E331 E332 C333	K288-L330 HydrophobicContact CB-CB 4.26Å; K288-L330 WeakPolarHBondContact CD-O 3.48Å; K288-L330 WeakPolarHBondContact CG-O 3.01Å; K288-E331 PolarHBondContact N-O 3.16Å; K288-E332 HydrophobicContact CD-CG 4.3Å; K288-E332 HydrophobicContact CG-CG 4.1Å; K288-C333 PolarHBondContact O-N 3.39Å; K288-C333 PolarHBondContact O-SG 2.91Å
289	P	90.1	Very high	90.8	Very high	64 Å²	64	58.6 Å²	58.6	42%	0.416	31%	0.312	S	S	.	.	S	Bend	cis	-70.2	139.3	-2	29.9	-34.3	0	0	0	111.2	T291	P289-T291 PolarHBondContact O-N 3.04Å
290	S	88	Confident	90.5	Very high	6 Å²	6	51.1 Å²	51.1	4%	0.042	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	137.4	175.7	-177.6	0	0	0	0	108.5	W283 S284 T324 N325	W283-S290 WeakPolarHBondContact CB-OG 3.49Å; W283-S290 WeakPolarHBondContact CZ3-O 3.29Å; S284-S290 PolarHBondContact N-OG 3.44Å; S284-S290 WeakPolarHBondContact O-CB 3.06Å; S284-S290 PolarHBondContact O-OG 2.92Å; S284-S290 WeakPolarHBondContact OG-CA 3.5Å; S290-T324 CarbonylContact O-C 3.46Å; S290-T324 WeakPolarHBondContact O-CA 3.48Å; S290-N325 PolarHBondContact N-O 2.79Å; S290-N325 VanDerWaalsContact N-O 3.14Å; S290-N325 PolarHBondContact O-N 3.08Å
291	T	91.3	Very high	89.8	Confident	62 Å²	62	48.9 Å²	48.9	38%	0.38	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.7	-178.7	62.5	0	0	0	0	110.7	S284 P289 E323 T324	S284-T291 WeakPolarHBondContact CB-O 2.99Å; S284-T291 PolarHBondContact N-O 3.18Å; S284-T291 PolarHBondContact OG-N 3.44Å; S284-T291 PolarHBondContact OG-O 2.83Å; P289-T291 PolarHBondContact O-N 3.04Å; T291-E323 VanDerWaalsContact CA-O 3.26Å; T291-E323 WeakPolarHBondContact CA-O 3.14Å; T291-T324 HydrophobicContact CG2-CG2 3.94Å
292	R	93.6	Very high	88.7	Confident	60 Å²	60	51.9 Å²	51.9	23%	0.226	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	159.8	165.3	61.3	176.5	-173.5	-174.8	-3.2	109	W280 T281 W283 T322 E323	W280-R292 HydrophobicContact CD2-CG 4.37Å; W280-R292 HydrophobicContact CE3-CB 4.27Å; W280-R292 HydrophobicContact CE3-CG 3.63Å; W280-R292 HydrophobicContact CZ3-CG 4.05Å; T281-R292 WeakPolarHBondContact O-CB 3.01Å; W283-R292 HydrophobicContact CD2-CB 4.25Å; W283-R292 HydrophobicContact CD2-CG 3.98Å; W283-R292 HydrophobicContact CE3-CB 4.1Å; W283-R292 HydrophobicContact CE3-CG 3.85Å; W283-R292 HydrophobicContact CH2-CG 3.94Å; W283-R292 HydrophobicContact CZ2-CG 4.08Å; W283-R292 VanDerWaalsContact CZ2-NE 3.35Å; W283-R292 HydrophobicContact CZ3-CB 4.48Å; W283-R292 HydrophobicContact CZ3-CG 3.81Å; R292-T322 WeakPolarHBondContact O-CA 3.35Å; R292-E323 HydrophobicContact CG-CB 4.09Å; R292-E323 IonicContact CZ-OE2 3.55Å; R292-E323 PolarHBondContact N-O 2.02Å; R292-E323 VanDerWaalsContact N-O 3.08Å; R292-E323 IonicContact NE-OE2 2.65Å; R292-E323 PolarHBondContact NE-OE2 3.2Å; R292-E323 IonicContact NH2-OE1 3.52Å; R292-E323 IonicContact NH2-OE2 2.74Å; R292-E323 PolarHBondContact NH2-OE2 2.79Å; R292-E323 PolarHBondContact O-N 3.31Å
293	M	93.2	Very high	87.7	Confident	39 Å²	39	55 Å²	55	19%	0.192	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	159.6	-179.9	65.4	178.3	-179.5	0	0	111.5	T281 F312 K315 V320 Q321 T322	T281-M293 HydrophobicContact CG2-CE 4.16Å; T281-M293 HydrophobicContact CG2-CG 4.17Å; T281-M293 WeakPolarHBondContact CG2-O 3.37Å; T281-M293 PolarHBondContact N-O 3.34Å; T281-M293 PolarHBondContact OG1-N 3.48Å; T281-M293 VanDerWaalsContact OG1-N 3.13Å; T281-M293 PolarHBondContact OG1-O 3.19Å; M293-F312 HydrophobicContact CE-CD1 3.74Å; M293-F312 HydrophobicContact CE-CE1 3.75Å; M293-K315 HydrophobicContact CE-CD 4Å; M293-K315 HydrophobicContact SD-CD 4.13Å; M293-V320 HydrophobicContact CB-CG1 4.19Å; M293-V320 HydrophobicContact SD-CG1 4.45Å; M293-Q321 CarbonylContact C-O 3.56Å; M293-Q321 WeakPolarHBondContact CA-O 3.34Å; M293-Q321 WeakPolarHBondContact CB-O 3.41Å; M293-T322 HydrophobicContact CB-CG2 4.08Å
294	R	94.6	Very high	86.7	Confident	72 Å²	72	56.7 Å²	56.7	27%	0.272	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	155.1	165.7	59.5	177.5	-174.2	-179.4	-0.1	109	Y277 W280 Q321	Y277-R294 HydrophobicContact CD1-CB 4.37Å; Y277-R294 HydrophobicContact CD1-CG 3.7Å; Y277-R294 HydrophobicContact CE1-CG 4.41Å; Y277-R294 HydrophobicContact CG-CG 4.38Å; W280-R294 HydrophobicContact CD2-CB 4.05Å; W280-R294 HydrophobicContact CD2-CG 3.86Å; W280-R294 HydrophobicContact CE3-CB 4.01Å; W280-R294 HydrophobicContact CE3-CG 3.88Å; W280-R294 HydrophobicContact CG-CB 4.44Å; W280-R294 HydrophobicContact CH2-CG 3.89Å; W280-R294 HydrophobicContact CZ2-CG 3.87Å; W280-R294 HydrophobicContact CZ3-CB 4.43Å; W280-R294 HydrophobicContact CZ3-CG 3.9Å; R294-Q321 HydrophobicContact CG-CB 4.04Å; R294-Q321 PolarHBondContact N-O 2.91Å; R294-Q321 PolarHBondContact O-N 2.97Å
295	I	94.1	Very high	86.2	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	153	-175.9	62.3	174.9	0	0	0	111.3	Y277 T278 S311 F312 C318 C319 V320	Y277-I295 WeakPolarHBondContact CA-O 3.45Å; T278-I295 HydrophobicContact CG2-CG1 3.72Å; T278-I295 PolarHBondContact N-O 3.46Å; T278-I295 PolarHBondContact OG1-N 3.42Å; T278-I295 PolarHBondContact OG1-O 3.26Å; I295-S311 VanDerWaalsContact CD1-C 3.45Å; I295-F312 HydrophobicContact CD1-CD1 3.93Å; I295-F312 HydrophobicContact CD1-CD2 4.12Å; I295-F312 HydrophobicContact CD1-CE1 4.08Å; I295-F312 HydrophobicContact CD1-CE2 4.24Å; I295-F312 HydrophobicContact CD1-CG 3.98Å; I295-F312 HydrophobicContact CD1-CZ 4.23Å; I295-F312 HydrophobicContact CG1-CD1 4.45Å; I295-F312 HydrophobicContact CG1-CE1 4.1Å; I295-F312 HydrophobicContact CG1-CE2 4.42Å; I295-F312 HydrophobicContact CG1-CZ 4.09Å; I295-F312 HydrophobicContact CG2-CD1 4.33Å; I295-F312 HydrophobicContact CG2-CE1 4.04Å; I295-C318 HydrophobicContact CB-CB 4.1Å; I295-C318 HydrophobicContact CG2-CB 4.37Å; I295-C319 CarbonylContact C-O 3.58Å; I295-C319 WeakPolarHBondContact CA-O 3.28Å; I295-V320 HydrophobicContact CG2-CG2 4.11Å
296	A	92.3	Very high	85.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.5	171.7	0	0	0	0	0	110.3	S274 Y277 C319	S274-A296 WeakPolarHBondContact O-CB 3.26Å; Y277-A296 HydrophobicContact CD1-CB 3.55Å; Y277-A296 HydrophobicContact CD2-CB 3.88Å; Y277-A296 HydrophobicContact CE1-CB 3.51Å; Y277-A296 HydrophobicContact CE2-CB 3.83Å; Y277-A296 HydrophobicContact CG-CB 3.75Å; A296-C319 HydrophobicContact CB-CB 4.36Å; A296-C319 PolarHBondContact N-O 3.46Å; A296-C319 PolarHBondContact O-N 2Å
297	P	90.8	Very high	85.6	Confident	33 Å²	33	56 Å²	56	21%	0.214	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	148.1	174.7	28.4	-31.7	0	0	0	110.9	S274 V308 C310	S274-P297 PolarHBondContact N-O 3.5Å; P297-V308 VanDerWaalsContact CB-O 3.25Å; P297-V308 WeakPolarHBondContact CB-O 3.49Å; P297-C310 HydrophobicContact CB-CB 4.31Å; P297-C310 VanDerWaalsContact CD-SG 3.51Å; P297-C310 VanDerWaalsContact N-SG 3.42Å
298	I	90.6	Very high	85.4	Confident	14 Å²	14	55.4 Å²	55.4	7%	0.072	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-76.1	132.5	173	-68.5	172	0	0	0	109	F236 C271 Q300 V308 Q317	F236-I298 HydrophobicContact CB-CD1 3.96Å; F236-I298 HydrophobicContact CB-CG2 4.1Å; F236-I298 HydrophobicContact CD2-CD1 3.49Å; F236-I298 VanDerWaalsContact CD2-CD1 3.49Å; F236-I298 HydrophobicContact CE2-CD1 4.24Å; F236-I298 HydrophobicContact CG-CD1 3.88Å; C271-I298 HydrophobicContact CB-CD1 4.39Å; C271-I298 HydrophobicContact CB-CG1 4.41Å; C271-I298 HydrophobicContact CB-CG2 3.44Å; C271-I298 VanDerWaalsContact CB-CG2 3.44Å; I298-Q300 PolarHBondContact O-N 3Å; I298-V308 HydrophobicContact CB-CB 4.3Å; I298-V308 HydrophobicContact CB-CG1 4.48Å; I298-V308 HydrophobicContact CB-CG2 4.24Å; I298-Q317 VanDerWaalsContact CD1-O 3.31Å; I298-Q317 WeakPolarHBondContact CD1-O 3.46Å
299	I	88.6	Confident	85.3	Confident	87 Å²	87	59.1 Å²	59.1	45%	0.446	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-76.7	118.5	173.3	-57.4	171.8	0	0	0	107.7	A272 C273	A272-I299 HydrophobicContact CB-CB 4.41Å; A272-I299 HydrophobicContact CB-CD1 4.39Å; A272-I299 PolarHBondContact O-N 3Å; C273-I299 VanDerWaalsContact O-CD1 3.32Å; C273-I299 WeakPolarHBondContact O-CD1 3.03Å
300	Q	87	Confident	85	Confident	24 Å²	24	57.9 Å²	57.9	11%	0.112	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-80.7	143.9	172	-63.9	-75.3	32.5	0	0	110	N235 F236 I298 N302 L305 V308	N235-Q300 VanDerWaalsContact CB-OE1 3.31Å; F236-Q300 PolarHBondContact O-NE2 3.47Å; F236-Q300 VanDerWaalsContact O-NE2 3.16Å; I298-Q300 PolarHBondContact O-N 3Å; Q300-N302 PolarHBondContact O-N 2.93Å; Q300-L305 HydrophobicContact CB-CB 3.94Å; Q300-L305 HydrophobicContact CB-CD1 4.38Å; Q300-L305 HydrophobicContact CG-CB 4.21Å; Q300-V308 HydrophobicContact CG-CG2 3.94Å; Q300-V308 VanDerWaalsContact NE2-CG2 3.31Å
301	P	80	Confident	85.1	Confident	29 Å²	29	59.5 Å²	59.5	19%	0.188	32%	0.318	C	S	.	.	S	Bend	trans	-70.2	122	174	27.1	-30.7	0	0	0	109.7	C234 N235 Y247 L305	C234-P301 WeakPolarHBondContact O-CD 3.5Å; N235-P301 VanDerWaalsContact CB-CD 3.46Å; N235-P301 HydrophobicContact CB-CG 3.66Å; Y247-P301 HydrophobicContact CD1-CG 4.17Å; Y247-P301 HydrophobicContact CE1-CB 4.41Å; Y247-P301 HydrophobicContact CE1-CG 3.96Å; P301-L305 HydrophobicContact CG-CD1 4.04Å
302	N	71.2	Confident	84.7	Confident	106 Å²	106	60.8 Å²	60.8	57%	0.567	32%	0.318	S	S	*	.	S	Bend	trans	63.1	154	-178	-54.5	-23.2	0	0	0	114.5	Y247 Q300 E304	Y247-N302 PolarHBondContact OH-ND2 2.75Å; Q300-N302 PolarHBondContact O-N 2.93Å; N302-E304 PolarHBondContact O-N 2.74Å
303	D	70.4	Confident	84.2	Confident	177 Å²	177	66.5 Å²	66.5	95%	0.947	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	4.7	-178.2	-61	-42.2	0	0	0	114.2
304	E	70.1	Confident	83.8	Confident	125 Å²	125	68 Å²	68	58%	0.584	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-25.1	-179.3	-65	-174	163.3	0	0	113.3	N302	N302-E304 PolarHBondContact O-N 2.74Å
305	L	77.6	Confident	83.3	Confident	35 Å²	35	68.5 Å²	68.5	18%	0.183	36%	0.36	C	S	.	.	S	Bend	trans	-92.5	145.6	-179.6	-68.6	171.9	0	0	0	110.4	N235 Y247 Q300 P301	N235-L305 HydrophobicContact CB-CD1 3.91Å; Y247-L305 HydrophobicContact CD1-CD1 4.4Å; Y247-L305 HydrophobicContact CD2-CD1 4.04Å; Y247-L305 HydrophobicContact CD2-CD2 4.24Å; Y247-L305 HydrophobicContact CD2-CG 4.33Å; Y247-L305 HydrophobicContact CE2-CD1 4.45Å; Y247-L305 HydrophobicContact CG-CD1 4.01Å; Q300-L305 HydrophobicContact CB-CB 3.94Å; Q300-L305 HydrophobicContact CB-CD1 4.38Å; Q300-L305 HydrophobicContact CG-CB 4.21Å; P301-L305 HydrophobicContact CG-CD1 4.04Å
306	S	78.5	Confident	82.7	Confident	62 Å²	62	73 Å²	73	43%	0.434	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-63.6	135.1	177.4	48.4	0	0	0	0	110.7
307	P	80.7	Confident	82.5	Confident	89 Å²	89	74.9 Å²	74.9	58%	0.578	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-62.3	143.3	179.3	25.4	-33.3	0	0	0	110.9	H309	P307-H309 PolarHBondContact O-N 2.94Å
308	V	83.1	Confident	82.5	Confident	5 Å²	5	73.9 Å²	73.9	3%	0.03	39%	0.39	C	S	.	.			trans	-84.2	107.4	178.4	-176.9	0	0	0	0	109.1	F236 P297 I298 Q300 C310 Q317	F236-V308 HydrophobicContact CB-CG2 3.98Å; F236-V308 HydrophobicContact CD1-CG1 4.47Å; F236-V308 HydrophobicContact CD1-CG2 4.31Å; F236-V308 HydrophobicContact CG-CG2 4.46Å; P297-V308 VanDerWaalsContact CB-O 3.25Å; P297-V308 WeakPolarHBondContact CB-O 3.49Å; I298-V308 HydrophobicContact CB-CB 4.3Å; I298-V308 HydrophobicContact CB-CG1 4.48Å; I298-V308 HydrophobicContact CB-CG2 4.24Å; Q300-V308 HydrophobicContact CG-CG2 3.94Å; Q300-V308 VanDerWaalsContact NE2-CG2 3.31Å; V308-C310 PolarHBondContact O-N 3.24Å; V308-Q317 HydrophobicContact CG1-CB 4.12Å; V308-Q317 WeakPolarHBondContact CG1-O 3.07Å
309	H	85.1	Confident	82.5	Confident	150 Å²	150	73.9 Å²	73.9	69%	0.694	39%	0.392	S	S	*	.			trans	-79.7	109.5	175.2	-70.6	-76.8	0	0	0	110.6	P307	P307-H309 PolarHBondContact O-N 2.94Å
310	C	85.3	Confident	82.7	Confident	39 Å²	39	72.8 Å²	72.8	26%	0.264	39%	0.389	S	S	.	.			trans	-86.1	132.2	179.6	60.3	0	0	0	0	112.2	P297 V308 C318	P297-C310 HydrophobicContact CB-CB 4.31Å; P297-C310 VanDerWaalsContact CD-SG 3.51Å; P297-C310 VanDerWaalsContact N-SG 3.42Å; V308-C310 PolarHBondContact O-N 3.24Å; C310-C318 WeakPolarHBondContact CA-SG 3.28Å; C310-C318 HydrophobicContact CB-CB 3.91Å; C310-C318 WeakPolarHBondContact CB-SG 3.42Å
311	S	88.2	Confident	83	Confident	40 Å²	40	75 Å²	75	28%	0.28	40%	0.399	S	S	.	.			trans	-137	165	168.1	78.9	0	0	0	0	110.4	I295 E313 N314 K315	I295-S311 VanDerWaalsContact CD1-C 3.45Å; S311-E313 PolarHBondContact O-N 3.41Å; S311-E313 PolarHBondContact OG-N 2.03Å; S311-N314 CarbonylContact O-C 3.58Å; S311-N314 PolarHBondContact O-N 3.04Å; S311-N314 PolarHBondContact OG-N 2.91Å; S311-K315 PolarHBondContact O-N 2.87Å
312	F	84.2	Confident	83.6	Confident	89 Å²	89	78.5 Å²	78.5	39%	0.39	42%	0.42	S	S	.	.	S	Bend	trans	-70.8	-11.1	173.7	-75.4	-71.6	0	0	0	113.4	T281 M293 I295 K315	T281-F312 HydrophobicContact CG2-CE1 3.71Å; T281-F312 HydrophobicContact CG2-CZ 3.71Å; M293-F312 HydrophobicContact CE-CD1 3.74Å; M293-F312 HydrophobicContact CE-CE1 3.75Å; I295-F312 HydrophobicContact CD1-CD1 3.93Å; I295-F312 HydrophobicContact CD1-CD2 4.12Å; I295-F312 HydrophobicContact CD1-CE1 4.08Å; I295-F312 HydrophobicContact CD1-CE2 4.24Å; I295-F312 HydrophobicContact CD1-CG 3.98Å; I295-F312 HydrophobicContact CD1-CZ 4.23Å; I295-F312 HydrophobicContact CG1-CD1 4.45Å; I295-F312 HydrophobicContact CG1-CE1 4.1Å; I295-F312 HydrophobicContact CG1-CE2 4.42Å; I295-F312 HydrophobicContact CG1-CZ 4.09Å; I295-F312 HydrophobicContact CG2-CD1 4.33Å; I295-F312 HydrophobicContact CG2-CE1 4.04Å; F312-K315 WeakPolarHBondContact O-CE 3.39Å; F312-K315 VanDerWaalsContact O-CG 3.26Å; F312-K315 WeakPolarHBondContact O-CG 3.46Å
313	E	83.5	Confident	84.7	Confident	179 Å²	179	77 Å²	77	84%	0.836	41%	0.41	S	S	*	.	S	Bend	trans	-80.4	-38	170.7	-62.7	176.3	174.2	0	0	110.3	S311	S311-E313 PolarHBondContact O-N 3.41Å; S311-E313 PolarHBondContact OG-N 2.03Å
314	N	84.4	Confident	85.7	Confident	70 Å²	70	72.6 Å²	72.6	37%	0.374	39%	0.389	S	S	.	.	S	Bend	trans	-105.1	40.2	-176	-64	-7.2	0	0	0	112.8	S311 T316 Q317 C318	S311-N314 CarbonylContact O-C 3.58Å; S311-N314 PolarHBondContact O-N 3.04Å; S311-N314 PolarHBondContact OG-N 2.91Å; N314-T316 PolarHBondContact O-N 3.18Å; N314-Q317 HydrophobicContact CB-CG 4.36Å; N314-Q317 WeakPolarHBondContact O-CB 3.34Å; N314-Q317 PolarHBondContact O-N 3Å; N314-C318 PolarHBondContact O-SG 2.82Å
315	K	83.6	Confident	86.6	Confident	84 Å²	84	69.4 Å²	69.4	37%	0.365	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-54.6	-26.8	-173.1	-59.3	-179.2	-161.3	173.4	0	114.7	M293 S311 F312 Q317 C318	M293-K315 HydrophobicContact CE-CD 4Å; M293-K315 HydrophobicContact SD-CD 4.13Å; S311-K315 PolarHBondContact O-N 2.87Å; F312-K315 WeakPolarHBondContact O-CE 3.39Å; F312-K315 VanDerWaalsContact O-CG 3.26Å; F312-K315 WeakPolarHBondContact O-CG 3.46Å; K315-Q317 PolarHBondContact O-N 2.83Å; K315-C318 WeakPolarHBondContact O-CB 3.28Å; K315-C318 PolarHBondContact O-N 2.76Å; K315-C318 VanDerWaalsContact O-N 3.13Å
316	T	82.1	Confident	86.9	Confident	97 Å²	97	72.3 Å²	72.3	60%	0.595	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-67.7	-18.5	178.9	50.4	0	0	0	0	113.2	N241 N314 C318	N241-T316 PolarHBondContact ND2-OG1 3.38Å; N241-T316 VanDerWaalsContact ND2-OG1 3.16Å; N314-T316 PolarHBondContact O-N 3.18Å; T316-C318 VanDerWaalsContact C-N 3.34Å
317	Q	87.5	Confident	87.1	Confident	38 Å²	38	74.6 Å²	74.6	18%	0.178	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-94.3	3.4	176.3	-48.2	-176.8	6.6	0	0	112	F236 N241 I298 V308 N314 K315	F236-Q317 HydrophobicContact CE1-CB 3.76Å; F236-Q317 HydrophobicContact CE1-CG 3.68Å; F236-Q317 HydrophobicContact CE2-CB 4.5Å; F236-Q317 HydrophobicContact CZ-CB 3.78Å; F236-Q317 HydrophobicContact CZ-CG 3.64Å; N241-Q317 WeakPolarHBondContact OD1-CG 3.41Å; I298-Q317 VanDerWaalsContact CD1-O 3.31Å; I298-Q317 WeakPolarHBondContact CD1-O 3.46Å; V308-Q317 HydrophobicContact CG1-CB 4.12Å; V308-Q317 WeakPolarHBondContact CG1-O 3.07Å; N314-Q317 HydrophobicContact CB-CG 4.36Å; N314-Q317 WeakPolarHBondContact O-CB 3.34Å; N314-Q317 PolarHBondContact O-N 3Å; K315-Q317 PolarHBondContact O-N 2.83Å
318	C	91.1	Very high	86.9	Confident	12 Å²	12	71.5 Å²	71.5	8%	0.081	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	152.1	-171.3	-47.6	0	0	0	0	109.9	I295 C310 N314 K315 T316 V320	I295-C318 HydrophobicContact CB-CB 4.1Å; I295-C318 HydrophobicContact CG2-CB 4.37Å; C310-C318 WeakPolarHBondContact CA-SG 3.28Å; C310-C318 HydrophobicContact CB-CB 3.91Å; C310-C318 WeakPolarHBondContact CB-SG 3.42Å; N314-C318 PolarHBondContact O-SG 2.82Å; K315-C318 WeakPolarHBondContact O-CB 3.28Å; K315-C318 PolarHBondContact O-N 2.76Å; K315-C318 VanDerWaalsContact O-N 3.13Å; T316-C318 VanDerWaalsContact C-N 3.34Å; C318-V320 PolarHBondContact O-N 2.95Å
319	C	91.3	Very high	86.9	Confident	14 Å²	14	81 Å²	81	10%	0.095	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	124.2	159.4	-72.6	0	0	0	0	108.9	C273 I295 A296	C273-C319 WeakPolarHBondContact CA-SG 3.42Å; C273-C319 HydrophobicContact CB-CB 3.57Å; C273-C319 WeakPolarHBondContact CB-SG 3.41Å; C273-C319 WeakPolarHBondContact SG-CB 3.4Å; C273-C319 CovalentContact SG-SG 2.02Å; C273-C319 PolarHBondContact SG-SG 3.14Å; I295-C319 CarbonylContact C-O 3.58Å; I295-C319 WeakPolarHBondContact CA-O 3.28Å; A296-C319 HydrophobicContact CB-CB 4.36Å; A296-C319 PolarHBondContact N-O 3.46Å; A296-C319 PolarHBondContact O-N 2Å
320	V	92	Very high	86.9	Confident	65 Å²	65	76.4 Å²	76.4	39%	0.394	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.4	179.8	-173.3	0	0	0	0	108.7	M293 I295 C318 T322	M293-V320 HydrophobicContact CB-CG1 4.19Å; M293-V320 HydrophobicContact SD-CG1 4.45Å; I295-V320 HydrophobicContact CG2-CG2 4.11Å; C318-V320 PolarHBondContact O-N 2.95Å; V320-T322 HydrophobicContact CG1-CG2 4.18Å
321	Q	92.7	Very high	86.9	Confident	69 Å²	69	77.2 Å²	77.2	32%	0.322	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.8	167	-73.4	-176.3	-9.6	0	0	109	Y277 W280 M293 R294	Y277-Q321 HydrophobicContact CE1-CB 4.17Å; Y277-Q321 HydrophobicContact CE1-CG 3.64Å; Y277-Q321 VanDerWaalsContact CZ-CD 3.44Å; Y277-Q321 PolarHBondContact OH-NE2 3.49Å; W280-Q321 HydrophobicContact CH2-CB 4.22Å; M293-Q321 CarbonylContact C-O 3.56Å; M293-Q321 WeakPolarHBondContact CA-O 3.34Å; M293-Q321 WeakPolarHBondContact CB-O 3.41Å; R294-Q321 HydrophobicContact CG-CB 4.04Å; R294-Q321 PolarHBondContact N-O 2.91Å; R294-Q321 PolarHBondContact O-N 2.97Å
322	T	92.4	Very high	86.9	Confident	103 Å²	103	79.7 Å²	79.7	63%	0.632	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	139.3	177.6	50.5	0	0	0	0	109.6	R292 M293 V320	R292-T322 WeakPolarHBondContact O-CA 3.35Å; M293-T322 HydrophobicContact CB-CG2 4.08Å; V320-T322 HydrophobicContact CG1-CG2 4.18Å
323	E	94.2	Very high	87	Confident	75 Å²	75	77.9 Å²	77.9	35%	0.35	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	140.7	173.3	-166.5	179.5	-177.5	0	0	108.5	W280 W283 T291 R292	W280-E323 HydrophobicContact CH2-CB 3.81Å; W280-E323 HydrophobicContact CZ3-CB 3.87Å; W283-E323 HydrophobicContact CH2-CB 4.29Å; W283-E323 HydrophobicContact CH2-CG 3.95Å; T291-E323 VanDerWaalsContact CA-O 3.26Å; T291-E323 WeakPolarHBondContact CA-O 3.14Å; R292-E323 HydrophobicContact CG-CB 4.09Å; R292-E323 IonicContact CZ-OE2 3.55Å; R292-E323 PolarHBondContact N-O 2.02Å; R292-E323 VanDerWaalsContact N-O 3.08Å; R292-E323 IonicContact NE-OE2 2.65Å; R292-E323 PolarHBondContact NE-OE2 3.2Å; R292-E323 IonicContact NH2-OE1 3.52Å; R292-E323 IonicContact NH2-OE2 2.74Å; R292-E323 PolarHBondContact NH2-OE2 2.79Å; R292-E323 PolarHBondContact O-N 3.31Å
324	T	92.2	Very high	87.1	Confident	84 Å²	84	71.8 Å²	71.8	52%	0.515	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.5	-178.8	56.8	0	0	0	0	109.1	S290 T291	S290-T324 CarbonylContact O-C 3.46Å; S290-T324 WeakPolarHBondContact O-CA 3.48Å; T291-T324 HydrophobicContact CG2-CG2 3.94Å
325	N	89.2	Confident	87.3	Confident	58 Å²	58	70 Å²	70	31%	0.31	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	104.3	172.3	-177.6	-0.7	0	0	0	109.1	W283 S290 S327	W283-N325 HydrophobicContact CE3-CB 4.05Å; W283-N325 HydrophobicContact CH2-CB 3.68Å; W283-N325 HydrophobicContact CZ2-CB 4.38Å; W283-N325 HydrophobicContact CZ3-CB 3.49Å; W283-N325 VanDerWaalsContact CZ3-CB 3.49Å; S290-N325 PolarHBondContact N-O 2.79Å; S290-N325 VanDerWaalsContact N-O 3.14Å; S290-N325 PolarHBondContact O-N 3.08Å; N325-S327 VanDerWaalsContact C-N 3.33Å; N325-S327 PolarHBondContact O-N 2.64Å; N325-S327 PolarHBondContact OD1-N 2.81Å; N325-S327 VanDerWaalsContact OD1-N 3.09Å
326	P	83.6	Confident	87.4	Confident	96 Å²	96	68 Å²	68	62%	0.623	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-30	178.9	-20.2	32.4	0	0	0	113.7	S328	P326-S328 PolarHBondContact O-N 3.34Å
327	S	82	Confident	87.6	Confident	110 Å²	110	63.8 Å²	63.8	77%	0.769	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	31.1	-170	-54.8	0	0	0	0	113.8	N325	N325-S327 VanDerWaalsContact C-N 3.33Å; N325-S327 PolarHBondContact O-N 2.64Å; N325-S327 PolarHBondContact OD1-N 2.81Å; N325-S327 VanDerWaalsContact OD1-N 3.09Å
328	S	77.1	Confident	87.4	Confident	25 Å²	25	69.1 Å²	69.1	18%	0.175	37%	0.373	C	S	.	.			trans	-84.9	133.8	179.5	-179.6	0	0	0	0	111	P326 L330	P326-S328 PolarHBondContact O-N 3.34Å; S328-L330 PolarHBondContact O-N 2.89Å; S328-L330 VanDerWaalsContact OG-CD1 3.26Å; S328-L330 WeakPolarHBondContact OG-CD1 3.45Å; S328-L330 WeakPolarHBondContact OG-CG 3.43Å
329	E	84	Confident	87	Confident	205 Å²	205	72.2 Å²	72.2	96%	0.958	41%	0.407	S	S	*	.			trans	-69.5	4.3	176	-62.1	-175.6	166.1	0	0	113.9
330	L	84.8	Confident	86.4	Confident	52 Å²	52	74 Å²	74	27%	0.272	42%	0.417	S	S	.	.	S	Bend	trans	-74.5	160.7	-179.3	-61.9	171.1	0	0	0	112.7	S285 K288 S328	S285-L330 WeakPolarHBondContact O-CD1 2.97Å; S285-L330 VanDerWaalsContact O-CD2 3.28Å; S285-L330 WeakPolarHBondContact O-CD2 3.26Å; K288-L330 HydrophobicContact CB-CB 4.26Å; K288-L330 WeakPolarHBondContact CD-O 3.48Å; K288-L330 WeakPolarHBondContact CG-O 3.01Å; S328-L330 PolarHBondContact O-N 2.89Å; S328-L330 VanDerWaalsContact OG-CD1 3.26Å; S328-L330 WeakPolarHBondContact OG-CD1 3.45Å; S328-L330 WeakPolarHBondContact OG-CG 3.43Å
331	E	85.3	Confident	85.8	Confident	56 Å²	56	77.1 Å²	77.1	26%	0.262	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-66.3	149.3	171	176.4	170.2	-151.3	0	0	111.2	C287 K288 N335 Y336 S343 V345	C287-E331 CarbonylContact C-O 3.41Å; C287-E331 WeakPolarHBondContact CA-O 3.31Å; C287-E331 VanDerWaalsContact CB-O 3.25Å; C287-E331 WeakPolarHBondContact CB-O 3.04Å; K288-E331 PolarHBondContact N-O 3.16Å; E331-N335 HydrophobicContact CG-CB 3.84Å; E331-N335 WeakPolarHBondContact OE1-CB 3.03Å; E331-N335 PolarHBondContact OE1-ND2 3.5Å; E331-Y336 HydrophobicContact CB-CE2 4Å; E331-Y336 HydrophobicContact CG-CE2 3.97Å; E331-S343 PolarHBondContact OE1-OG 2.89Å; E331-S343 WeakPolarHBondContact OE2-CB 3.43Å; E331-S343 PolarHBondContact OE2-OG 2.92Å; E331-V345 WeakPolarHBondContact OE1-CB 3.45Å; E331-V345 WeakPolarHBondContact OE1-CG2 3.48Å
332	E	87.9	Confident	85.4	Confident	92 Å²	92	76 Å²	76	43%	0.43	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-62	137	179.3	-68.6	-177.3	-172.2	0	0	112.4	K288 T334 N335	K288-E332 HydrophobicContact CD-CG 4.3Å; K288-E332 HydrophobicContact CG-CG 4.1Å; E332-T334 VanDerWaalsContact CB-OG1 3.28Å; E332-T334 WeakPolarHBondContact CB-OG1 2.91Å; E332-T334 PolarHBondContact O-N 2.96Å; E332-T334 PolarHBondContact OE2-OG1 3.49Å; E332-N335 WeakPolarHBondContact O-CB 3.45Å; E332-N335 PolarHBondContact O-N 3.26Å
333	C	85.7	Confident	85.2	Confident	51 Å²	51	71.6 Å²	71.6	35%	0.345	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-59.9	-22.1	176.1	-62.9	0	0	0	0	112.9	C287 K288 N335 Y336	C287-C333 VanDerWaalsContact C-SG 3.59Å; C287-C333 HydrophobicContact CB-CB 3.85Å; C287-C333 WeakPolarHBondContact CB-SG 3.44Å; C287-C333 WeakPolarHBondContact SG-CA 3.06Å; C287-C333 WeakPolarHBondContact SG-CB 3.36Å; C287-C333 CovalentContact SG-SG 2.03Å; C287-C333 PolarHBondContact SG-SG 3.46Å; K288-C333 PolarHBondContact O-N 3.39Å; K288-C333 PolarHBondContact O-SG 2.91Å; C333-N335 PolarHBondContact O-N 3.28Å; C333-Y336 PolarHBondContact O-N 2.77Å; C333-Y336 VanDerWaalsContact O-N 3.13Å
334	T	85.5	Confident	84.7	Confident	51 Å²	51	68.3 Å²	68.3	31%	0.313	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-60.7	-25.2	173	58.7	0	0	0	0	112.3	E332 R356 F364	E332-T334 VanDerWaalsContact CB-OG1 3.28Å; E332-T334 WeakPolarHBondContact CB-OG1 2.91Å; E332-T334 PolarHBondContact O-N 2.96Å; E332-T334 PolarHBondContact OE2-OG1 3.49Å; T334-R356 PolarHBondContact O-NH2 2.89Å; T334-F364 HydrophobicContact CG2-CE2 3.72Å; T334-F364 HydrophobicContact CG2-CZ 4.18Å; T334-F364 VanDerWaalsContact O-CD2 3.28Å; T334-F364 WeakPolarHBondContact O-CD2 3.49Å; T334-F364 WeakPolarHBondContact O-CG 3.35Å
335	N	88.4	Confident	84.3	Confident	32 Å²	32	68.4 Å²	68.4	17%	0.171	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-87.9	0.1	178.9	-68	-18.7	0	0	0	113.7	E331 E332 C333 S343 L344 V345 R356	E331-N335 HydrophobicContact CG-CB 3.84Å; E331-N335 WeakPolarHBondContact OE1-CB 3.03Å; E331-N335 PolarHBondContact OE1-ND2 3.5Å; E332-N335 WeakPolarHBondContact O-CB 3.45Å; E332-N335 PolarHBondContact O-N 3.26Å; C333-N335 PolarHBondContact O-N 3.28Å; N335-S343 CarbonylContact O-C 3.51Å; N335-L344 VanDerWaalsContact O-CB 3.27Å; N335-L344 WeakPolarHBondContact O-CB 3.04Å; N335-L344 PolarHBondContact O-N 2.78Å; N335-V345 HydrophobicContact CB-CG2 3.86Å; N335-R356 PolarHBondContact OD1-NH2 2.68Å
336	Y	87.1	Confident	84.1	Confident	42 Å²	42	73.4 Å²	73.4	17%	0.165	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-101	149.8	176.7	-75.1	-100.3	0	0	0	111.3	T286 C287 E331 C333 Y338 N341 I342	T286-Y336 HydrophobicContact CG2-CD1 4.27Å; T286-Y336 HydrophobicContact CG2-CE1 4.03Å; T286-Y336 PolarHBondContact O-OH 3.27Å; T286-Y336 VanDerWaalsContact O-OH 3.08Å; C287-Y336 HydrophobicContact CB-CD2 3.73Å; C287-Y336 HydrophobicContact CB-CE2 3.64Å; E331-Y336 HydrophobicContact CB-CE2 4Å; E331-Y336 HydrophobicContact CG-CE2 3.97Å; C333-Y336 PolarHBondContact O-N 2.77Å; C333-Y336 VanDerWaalsContact O-N 3.13Å; Y336-Y338 PolarHBondContact O-N 2.92Å; Y336-N341 WeakPolarHBondContact CE1-O 2.96Å; Y336-I342 WeakPolarHBondContact CA-O 3.04Å
337	V	85	Confident	84.1	Confident	9 Å²	9	73.7 Å²	73.7	6%	0.055	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-70.8	124.8	166.7	179.9	0	0	0	0	108.5	G339 T340 I342 L344 V375 L376	V337-G339 PolarHBondContact O-N 3.01Å; V337-T340 WeakPolarHBondContact CB-OG1 3.01Å; V337-T340 HydrophobicContact CG1-CG2 4.33Å; V337-T340 PolarHBondContact O-N 3.25Å; V337-T340 PolarHBondContact O-OG1 2.92Å; V337-I342 PolarHBondContact N-O 2.97Å; V337-L344 HydrophobicContact CG2-CD1 4.16Å; V337-L344 HydrophobicContact CG2-CD2 3.45Å; V337-L344 VanDerWaalsContact CG2-CD2 3.45Å; V337-L344 HydrophobicContact CG2-CG 3.66Å; V337-V375 HydrophobicContact CB-CG1 4.35Å; V337-V375 HydrophobicContact CG1-CG1 3.79Å; V337-V375 HydrophobicContact CG2-CG1 4.41Å; V337-L376 HydrophobicContact CG2-CD2 4.26Å
338	Y	83.7	Confident	84.1	Confident	151 Å²	151	73 Å²	73	59%	0.592	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	131.7	-178.2	178.5	-99	0	0	0	112.7	Y336 T340 H363 F364	Y336-Y338 PolarHBondContact O-N 2.92Å; Y338-T340 VanDerWaalsContact C-N 3.3Å; Y338-H363 HydrophobicContact CD1-CB 4.34Å; Y338-H363 HydrophobicContact CD2-CB 3.81Å; Y338-H363 AromaticContact CD2-CD2 3.34Å; Y338-H363 WeakPolarHBondContact CD2-CD2 3.28Å; Y338-H363 AromaticContact CD2-CG 3.46Å; Y338-H363 VanDerWaalsContact CD2-CG 3.46Å; Y338-H363 AromaticContact CD2-ND1 3.99Å; Y338-H363 AromaticContact CD2-NE2 3.81Å; Y338-H363 AromaticContact CE1-ND1 3.97Å; Y338-H363 HydrophobicContact CE2-CB 4.49Å; Y338-H363 AromaticContact CE2-CD2 3.3Å; Y338-H363 WeakPolarHBondContact CE2-CD2 3.41Å; Y338-H363 AromaticContact CE2-CE1 3.56Å; Y338-H363 AromaticContact CE2-CG 3.67Å; Y338-H363 AromaticContact CE2-ND1 3.84Å; Y338-H363 AromaticContact CE2-NE2 3.22Å; Y338-H363 WeakPolarHBondContact CE2-NE2 3.48Å; Y338-H363 HydrophobicContact CG-CB 3.7Å; Y338-H363 AromaticContact CG-CG 3.73Å; Y338-H363 AromaticContact CZ-CE1 3.49Å; Y338-H363 VanDerWaalsContact CZ-CE1 3.49Å; Y338-H363 AromaticContact CZ-ND1 3.81Å; Y338-H363 AromaticContact CZ-NE2 3.64Å; Y338-F364 PolarHBondContact N-O 3.45Å
339	G	81.9	Confident	84.4	Confident	77 Å²	77	72.3 Å²	72.3	79%	0.794	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	8.1	-178.5	0	0	0	0	0	114.9	V337	V337-G339 PolarHBondContact O-N 3.01Å
340	T	80.1	Confident	84.2	Confident	52 Å²	52	64.9 Å²	64.9	32%	0.319	35%	0.351	S	S	.	.	S	Bend	trans	-134.4	169	179.9	79.2	0	0	0	0	111.8	V337 Y338 I342 V375	V337-T340 WeakPolarHBondContact CB-OG1 3.01Å; V337-T340 HydrophobicContact CG1-CG2 4.33Å; V337-T340 PolarHBondContact O-N 3.25Å; V337-T340 PolarHBondContact O-OG1 2.92Å; Y338-T340 VanDerWaalsContact C-N 3.3Å; T340-I342 PolarHBondContact OG1-N 3.13Å; T340-V375 HydrophobicContact CG2-CG1 4.44Å
341	N	79.3	Confident	83.3	Confident	130 Å²	130	71.2 Å²	71.2	70%	0.695	38%	0.376	S	S	*	.	S	Bend	trans	-97.2	21.8	169.7	64.9	-12.1	0	0	0	112.6	T286 Y336	T286-N341 HydrophobicContact CG2-CB 4.24Å; Y336-N341 WeakPolarHBondContact CE1-O 2.96Å
342	I	84.2	Confident	82.7	Confident	45 Å²	45	73.9 Å²	73.9	23%	0.231	40%	0.398	C	S	.	.			trans	-92.4	115.3	-176.6	-56.4	172.4	0	0	0	109.8	Y336 V337 T340 H347 V375 L376	Y336-I342 WeakPolarHBondContact CA-O 3.04Å; V337-I342 PolarHBondContact N-O 2.97Å; T340-I342 PolarHBondContact OG1-N 3.13Å; I342-H347 HydrophobicContact CG2-CB 4.39Å; I342-V375 HydrophobicContact CD1-CG1 4.15Å; I342-L376 HydrophobicContact CG2-CD1 4.16Å; I342-L376 HydrophobicContact CG2-CD2 4.01Å; I342-L376 HydrophobicContact CG2-CG 4.43Å
343	S	87.4	Confident	82	Confident	11 Å²	11	69.5 Å²	69.5	8%	0.077	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-76.9	120.7	174.3	171.9	0	0	0	0	110.9	E331 N335 V345 K346 H347	E331-S343 PolarHBondContact OE1-OG 2.89Å; E331-S343 WeakPolarHBondContact OE2-CB 3.43Å; E331-S343 PolarHBondContact OE2-OG 2.92Å; N335-S343 CarbonylContact O-C 3.51Å; S343-V345 PolarHBondContact O-N 3.48Å; S343-V345 PolarHBondContact OG-N 2.98Å; S343-K346 PolarHBondContact O-N 3.18Å; S343-K346 PolarHBondContact OG-N 3.16Å; S343-H347 PolarHBondContact O-N 3.47Å
344	L	84	Confident	82	Confident	6 Å²	6	67.7 Å²	67.7	3%	0.031	37%	0.368	C	S	.	.	H	α-helix	trans	-66.6	-24.1	173.5	-72.1	168.5	0	0	0	112.3	N335 V337 N348 R356 F364 C366 L376	N335-L344 VanDerWaalsContact O-CB 3.27Å; N335-L344 WeakPolarHBondContact O-CB 3.04Å; N335-L344 PolarHBondContact O-N 2.78Å; V337-L344 HydrophobicContact CG2-CD1 4.16Å; V337-L344 HydrophobicContact CG2-CD2 3.45Å; V337-L344 VanDerWaalsContact CG2-CD2 3.45Å; V337-L344 HydrophobicContact CG2-CG 3.66Å; L344-N348 VanDerWaalsContact O-CA 3.24Å; L344-N348 WeakPolarHBondContact O-CA 3.22Å; L344-N348 PolarHBondContact O-N 3.29Å; L344-N348 PolarHBondContact O-OD1 3.09Å; L344-R356 HydrophobicContact CD1-CG 4.14Å; L344-F364 HydrophobicContact CD1-CB 4.13Å; L344-C366 VanDerWaalsContact CD2-SG 3.54Å; L344-L376 HydrophobicContact CD2-CD2 4.35Å
345	V	84.1	Confident	82.2	Confident	85 Å²	85	73.1 Å²	73.1	52%	0.515	38%	0.383	S	S	.	.	H	α-helix	trans	-72.1	-39.1	175.5	175.5	0	0	0	0	110.5	E331 N335 S343	E331-V345 WeakPolarHBondContact OE1-CB 3.45Å; E331-V345 WeakPolarHBondContact OE1-CG2 3.48Å; N335-V345 HydrophobicContact CB-CG2 3.86Å; S343-V345 PolarHBondContact O-N 3.48Å; S343-V345 PolarHBondContact OG-N 2.98Å
346	K	84.7	Confident	82.2	Confident	164 Å²	164	77 Å²	77	71%	0.713	40%	0.395	S	S	*	.	H	α-helix	trans	-77.4	-45.2	179.6	-173.2	176	-179.5	-179.5	0	113.1	S343	S343-K346 PolarHBondContact O-N 3.18Å; S343-K346 PolarHBondContact OG-N 3.16Å
347	H	83.2	Confident	82.4	Confident	101 Å²	101	76.4 Å²	76.4	47%	0.468	40%	0.396	S	S	.	.	H	α-helix	trans	-99.1	-19.4	-170.6	-65.4	-75.2	0	0	0	114.1	I342 S343 L376	I342-H347 HydrophobicContact CG2-CB 4.39Å; S343-H347 PolarHBondContact O-N 3.47Å; H347-L376 HydrophobicContact CB-CD1 3.63Å
348	N	82.8	Confident	82.6	Confident	97 Å²	97	79.7 Å²	79.7	52%	0.519	42%	0.416	S	S	.	.			trans	50.3	168.3	-168.8	-79.1	-44.7	0	0	0	113.2	L344	L344-N348 VanDerWaalsContact O-CA 3.24Å; L344-N348 WeakPolarHBondContact O-CA 3.22Å; L344-N348 PolarHBondContact O-N 3.29Å; L344-N348 PolarHBondContact O-OD1 3.09Å
349	C	84.1	Confident	82.6	Confident	9 Å²	9	74.6 Å²	74.6	6%	0.061	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-77.6	125.5	160.4	-54.4	0	0	0	0	106.6	K351 R355 C366	C349-K351 PolarHBondContact O-N 3.13Å; C349-R355 VanDerWaalsContact SG-C 3.59Å; C349-C366 WeakPolarHBondContact CA-SG 3.49Å; C349-C366 HydrophobicContact CB-CB 3.84Å; C349-C366 WeakPolarHBondContact CB-SG 3.33Å; C349-C366 VanDerWaalsContact SG-CA 3.52Å; C349-C366 WeakPolarHBondContact SG-CB 3.31Å; C349-C366 CovalentContact SG-SG 2.04Å; C349-C366 PolarHBondContact SG-SG 3.14Å
350	S	79.1	Confident	82.7	Confident	49 Å²	49	80.9 Å²	80.9	34%	0.343	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-48.4	117.1	-178.3	-84.5	0	0	0	0	109.6	G353 G354 L376	S350-G353 CarbonylContact O-C 3.49Å; S350-G353 VanDerWaalsContact O-C 3.31Å; S350-G353 WeakPolarHBondContact O-CA 3.15Å; S350-G353 PolarHBondContact O-N 2.98Å; S350-G354 PolarHBondContact O-N 3.47Å; S350-L376 PolarHBondContact N-O 3.28Å
351	K	66.4	Low	82.8	Confident	185 Å²	185	86.6 Å²	86.6	80%	0.804	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	137.1	176.7	-67.2	-172.8	-179.2	178.6	0	109.2	C349	C349-K351 PolarHBondContact O-N 3.13Å
352	P	71.5	Confident	82.9	Confident	112 Å²	112	82.4 Å²	82.4	73%	0.727	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	cis	-83.5	1.6	4	33.8	-35.5	0	0	0	115	G354	P352-G354 VanDerWaalsContact C-N 3.34Å; P352-G354 PolarHBondContact O-N 3.47Å
353	G	73.9	Confident	83	Confident	1 Å²	1	82.6 Å²	82.6	1%	0.01	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.5	-170.2	0	0	0	0	0	117.8	S350 C368 A369 Y372 C377	S350-G353 CarbonylContact O-C 3.49Å; S350-G353 VanDerWaalsContact O-C 3.31Å; S350-G353 WeakPolarHBondContact O-CA 3.15Å; S350-G353 PolarHBondContact O-N 2.98Å; G353-C368 CarbonylContact O-C 3.57Å; G353-C368 WeakPolarHBondContact O-CA 2.98Å; G353-A369 PolarHBondContact O-N 2.95Å; G353-Y372 WeakPolarHBondContact O-CB 3.31Å; G353-C377 WeakPolarHBondContact O-CB 3.5Å
354	G	86	Confident	82.9	Confident	13 Å²	13	84.5 Å²	84.5	13%	0.134	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	166.7	177.6	0	0	0	0	0	116.1	S350 P352 Q367	S350-G354 PolarHBondContact O-N 3.47Å; P352-G354 VanDerWaalsContact C-N 3.34Å; P352-G354 PolarHBondContact O-N 3.47Å; G354-Q367 CarbonylContact C-O 3.6Å; G354-Q367 WeakPolarHBondContact CA-O 3.32Å
355	R	89.7	Confident	83.1	Confident	164 Å²	164	88.8 Å²	88.8	62%	0.619	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.4	176.1	66.8	177.9	-174.2	167.2	1	111.7	C349 V357 Q367	C349-R355 VanDerWaalsContact SG-C 3.59Å; R355-V357 HydrophobicContact CG-CG1 4.13Å; R355-Q367 HydrophobicContact CG-CB 4.37Å; R355-Q367 PolarHBondContact N-O 2.02Å; R355-Q367 VanDerWaalsContact NE-OE1 3.13Å; R355-Q367 PolarHBondContact O-N 3.14Å
356	R	88.5	Confident	83.3	Confident	113 Å²	113	85.5 Å²	85.5	43%	0.426	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	131.1	175	-176.7	176.9	-178.9	-170.3	1.8	110	T334 N335 L344	T334-R356 PolarHBondContact O-NH2 2.89Å; N335-R356 PolarHBondContact OD1-NH2 2.68Å; L344-R356 HydrophobicContact CD1-CG 4.14Å
357	V	90.5	Very high	83.6	Confident	30 Å²	30	82 Å²	82	18%	0.182	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	164.3	175.8	-59.8	0	0	0	0	111.2	R355 F364 K365 Q367	R355-V357 HydrophobicContact CG-CG1 4.13Å; V357-F364 WeakPolarHBondContact O-CA 3.47Å; V357-K365 HydrophobicContact CG2-CG 3.78Å; V357-K365 PolarHBondContact N-O 2.02Å; V357-K365 PolarHBondContact O-N 3.06Å; V357-K365 VanDerWaalsContact O-O 3.09Å; V357-Q367 HydrophobicContact CB-CB 4.33Å; V357-Q367 HydrophobicContact CG1-CB 3.64Å; V357-Q367 HydrophobicContact CG2-CB 3.69Å
358	V	89.1	Confident	83.7	Confident	78 Å²	78	79.3 Å²	79.3	47%	0.473	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.8	173.8	-171.3	0	0	0	0	108.2	G362 H363 F364	V358-G362 VanDerWaalsContact CG1-CA 3.44Å; V358-H363 CarbonylContact C-O 3.42Å; V358-H363 WeakPolarHBondContact CA-O 3.2Å; V358-F364 HydrophobicContact CG2-CD1 3.57Å; V358-F364 HydrophobicContact CG2-CE1 3.39Å; V358-F364 HydrophobicContact CG2-CG 4.35Å; V358-F364 HydrophobicContact CG2-CZ 4.02Å
359	D	84.4	Confident	83.8	Confident	44 Å²	44	76.8 Å²	76.8	24%	0.235	39%	0.392	C	S	.	.			trans	-77.3	175.5	174.9	78.3	5.1	0	0	0	112.6	K361 G362 H363	D359-K361 PolarHBondContact O-N 3.23Å; D359-K361 VanDerWaalsContact O-N 3.1Å; D359-K361 VanDerWaalsContact OD1-CA 3.32Å; D359-K361 WeakPolarHBondContact OD1-CA 3.44Å; D359-K361 WeakPolarHBondContact OD1-CB 3.47Å; D359-K361 PolarHBondContact OD1-N 2.92Å; D359-G362 PolarHBondContact O-N 3.2Å; D359-G362 PolarHBondContact OD1-N 3.45Å; D359-H363 PolarHBondContact N-O 3.17Å; D359-H363 WeakPolarHBondContact OD1-CB 3.46Å; D359-H363 IonicContact OD1-CG 3.85Å; D359-H363 PolarHBondContact OD1-N 2.02Å; D359-H363 IonicContact OD1-ND1 3.67Å; D359-H363 WeakPolarHBondContact OD2-CB 3.06Å; D359-H363 IonicContact OD2-CG 3.55Å; D359-H363 IonicContact OD2-ND1 2.85Å; D359-H363 PolarHBondContact OD2-ND1 2.73Å; D359-H363 VanDerWaalsContact OD2-ND1 3.09Å
360	E	84.1	Confident	83.5	Confident	209 Å²	209	85.7 Å²	85.7	98%	0.977	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.3	179.5	-63.4	176.4	-179.3	0	0	113.8
361	K	81.1	Confident	83.1	Confident	173 Å²	173	85.3 Å²	85.3	75%	0.752	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	1.6	178.1	-62.4	-178.1	-180	-178.6	0	112.6	D359	D359-K361 PolarHBondContact O-N 3.23Å; D359-K361 VanDerWaalsContact O-N 3.1Å; D359-K361 VanDerWaalsContact OD1-CA 3.32Å; D359-K361 WeakPolarHBondContact OD1-CA 3.44Å; D359-K361 WeakPolarHBondContact OD1-CB 3.47Å; D359-K361 PolarHBondContact OD1-N 2.92Å
362	G	83.4	Confident	83.6	Confident	42 Å²	42	80.2 Å²	80.2	43%	0.433	41%	0.413	S	S	.	.	S	Bend	trans	86.8	10.6	-178.5	0	0	0	0	0	114.5	V358 D359	V358-G362 VanDerWaalsContact CG1-CA 3.44Å; D359-G362 PolarHBondContact O-N 3.2Å; D359-G362 PolarHBondContact OD1-N 3.45Å
363	H	85.4	Confident	83.9	Confident	48 Å²	48	76.1 Å²	76.1	22%	0.222	39%	0.39	C	S	.	.			trans	-87.5	135.8	-177.9	-53.2	138.7	0	0	0	112.6	Y338 V358 D359	Y338-H363 HydrophobicContact CD1-CB 4.34Å; Y338-H363 HydrophobicContact CD2-CB 3.81Å; Y338-H363 AromaticContact CD2-CD2 3.34Å; Y338-H363 WeakPolarHBondContact CD2-CD2 3.28Å; Y338-H363 AromaticContact CD2-CG 3.46Å; Y338-H363 VanDerWaalsContact CD2-CG 3.46Å; Y338-H363 AromaticContact CD2-ND1 3.99Å; Y338-H363 AromaticContact CD2-NE2 3.81Å; Y338-H363 AromaticContact CE1-ND1 3.97Å; Y338-H363 HydrophobicContact CE2-CB 4.49Å; Y338-H363 AromaticContact CE2-CD2 3.3Å; Y338-H363 WeakPolarHBondContact CE2-CD2 3.41Å; Y338-H363 AromaticContact CE2-CE1 3.56Å; Y338-H363 AromaticContact CE2-CG 3.67Å; Y338-H363 AromaticContact CE2-ND1 3.84Å; Y338-H363 AromaticContact CE2-NE2 3.22Å; Y338-H363 WeakPolarHBondContact CE2-NE2 3.48Å; Y338-H363 HydrophobicContact CG-CB 3.7Å; Y338-H363 AromaticContact CG-CG 3.73Å; Y338-H363 AromaticContact CZ-CE1 3.49Å; Y338-H363 VanDerWaalsContact CZ-CE1 3.49Å; Y338-H363 AromaticContact CZ-ND1 3.81Å; Y338-H363 AromaticContact CZ-NE2 3.64Å; V358-H363 CarbonylContact C-O 3.42Å; V358-H363 WeakPolarHBondContact CA-O 3.2Å; D359-H363 PolarHBondContact N-O 3.17Å; D359-H363 WeakPolarHBondContact OD1-CB 3.46Å; D359-H363 IonicContact OD1-CG 3.85Å; D359-H363 PolarHBondContact OD1-N 2.02Å; D359-H363 IonicContact OD1-ND1 3.67Å; D359-H363 WeakPolarHBondContact OD2-CB 3.06Å; D359-H363 IonicContact OD2-CG 3.55Å; D359-H363 IonicContact OD2-ND1 2.85Å; D359-H363 PolarHBondContact OD2-ND1 2.73Å; D359-H363 VanDerWaalsContact OD2-ND1 3.09Å
364	F	85.8	Confident	84.1	Confident	51 Å²	51	77.7 Å²	77.7	22%	0.224	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	132.3	-179.8	-63.8	-93.4	0	0	0	111.9	T334 Y338 L344 V357 V358	T334-F364 HydrophobicContact CG2-CE2 3.72Å; T334-F364 HydrophobicContact CG2-CZ 4.18Å; T334-F364 VanDerWaalsContact O-CD2 3.28Å; T334-F364 WeakPolarHBondContact O-CD2 3.49Å; T334-F364 WeakPolarHBondContact O-CG 3.35Å; Y338-F364 PolarHBondContact N-O 3.45Å; L344-F364 HydrophobicContact CD1-CB 4.13Å; V357-F364 WeakPolarHBondContact O-CA 3.47Å; V358-F364 HydrophobicContact CG2-CD1 3.57Å; V358-F364 HydrophobicContact CG2-CE1 3.39Å; V358-F364 HydrophobicContact CG2-CG 4.35Å; V358-F364 HydrophobicContact CG2-CZ 4.02Å
365	K	88.3	Confident	84	Confident	97 Å²	97	80.5 Å²	80.5	42%	0.422	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	167.2	176.9	65	-175.9	180	-173.8	0	111.7	V357	V357-K365 HydrophobicContact CG2-CG 3.78Å; V357-K365 PolarHBondContact N-O 2.02Å; V357-K365 PolarHBondContact O-N 3.06Å; V357-K365 VanDerWaalsContact O-O 3.09Å
366	C	88.5	Confident	83.7	Confident	16 Å²	16	73.9 Å²	73.9	11%	0.108	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	132.9	167.5	-67	0	0	0	0	110.5	L344 C349 V375	L344-C366 VanDerWaalsContact CD2-SG 3.54Å; C349-C366 WeakPolarHBondContact CA-SG 3.49Å; C349-C366 HydrophobicContact CB-CB 3.84Å; C349-C366 WeakPolarHBondContact CB-SG 3.33Å; C349-C366 VanDerWaalsContact SG-CA 3.52Å; C349-C366 WeakPolarHBondContact SG-CB 3.31Å; C349-C366 CovalentContact SG-SG 2.04Å; C349-C366 PolarHBondContact SG-SG 3.14Å; C366-V375 WeakPolarHBondContact CB-O 3.38Å
367	Q	89.1	Confident	83.5	Confident	91 Å²	91	68.5 Å²	68.5	43%	0.425	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.2	166.5	-179.8	174.7	40.4	0	0	108.4	G354 R355 V357	G354-Q367 CarbonylContact C-O 3.6Å; G354-Q367 WeakPolarHBondContact CA-O 3.32Å; R355-Q367 HydrophobicContact CG-CB 4.37Å; R355-Q367 PolarHBondContact N-O 2.02Å; R355-Q367 VanDerWaalsContact NE-OE1 3.13Å; R355-Q367 PolarHBondContact O-N 3.14Å; V357-Q367 HydrophobicContact CB-CB 4.33Å; V357-Q367 HydrophobicContact CG1-CB 3.64Å; V357-Q367 HydrophobicContact CG2-CB 3.69Å
368	C	86.5	Confident	82.9	Confident	43 Å²	43	71.7 Å²	71.7	29%	0.291	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	143	-178.1	-51	0	0	0	0	111.6	G353 Y372 C377	G353-C368 CarbonylContact O-C 3.57Å; G353-C368 WeakPolarHBondContact O-CA 2.98Å; C368-Y372 VanDerWaalsContact CB-O 3.27Å; C368-Y372 WeakPolarHBondContact CB-O 3.47Å; C368-C377 WeakPolarHBondContact CA-SG 3.27Å; C368-C377 HydrophobicContact CB-CB 3.63Å; C368-C377 WeakPolarHBondContact CB-SG 3.45Å; C368-C377 PolarHBondContact N-SG 3.4Å; C368-C377 WeakPolarHBondContact SG-CA 3.25Å; C368-C377 WeakPolarHBondContact SG-CB 3Å; C368-C377 CovalentContact SG-SG 2.04Å; C368-C377 PolarHBondContact SG-SG 2.99Å
369	A	84.1	Confident	82.2	Confident	44 Å²	44	72 Å²	72	36%	0.364	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-64.7	161.7	167.6	0	0	0	0	0	109.9	G353 G371 Y372	G353-A369 PolarHBondContact O-N 2.95Å; A369-G371 PolarHBondContact O-N 2.89Å; A369-Y372 HydrophobicContact CB-CD2 4.04Å; A369-Y372 PolarHBondContact O-N 3.24Å
370	E	78	Confident	81.4	Confident	197 Å²	197	72.5 Å²	72.5	92%	0.921	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	124.8	-176.5	-168.8	175.4	176.1	0	0	111.4	Y372	E370-Y372 VanDerWaalsContact C-N 3.31Å; E370-Y372 PolarHBondContact O-N 3.04Å
371	G	70.6	Confident	80.7	Confident	40 Å²	40	64.8 Å²	64.8	41%	0.412	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	-13.7	179.7	0	0	0	0	0	115.8	A369 P381	A369-G371 PolarHBondContact O-N 2.89Å; G371-P381 WeakPolarHBondContact O-CA 3.35Å; G371-P381 WeakPolarHBondContact O-CB 3.31Å
372	Y	77.4	Confident	80.1	Confident	79 Å²	79	59.9 Å²	59.9	31%	0.31	35%	0.348	S	S	.	.			trans	-80.8	143.5	171.5	-73.9	-97.4	0	0	0	111.5	G353 C368 A369 E370 D379 A380 P381	G353-Y372 WeakPolarHBondContact O-CB 3.31Å; C368-Y372 VanDerWaalsContact CB-O 3.27Å; C368-Y372 WeakPolarHBondContact CB-O 3.47Å; A369-Y372 HydrophobicContact CB-CD2 4.04Å; A369-Y372 PolarHBondContact O-N 3.24Å; E370-Y372 VanDerWaalsContact C-N 3.31Å; E370-Y372 PolarHBondContact O-N 3.04Å; Y372-D379 CarbonylContact C-O 3.57Å; Y372-D379 WeakPolarHBondContact CA-O 3.38Å; Y372-D379 WeakPolarHBondContact CD1-O 3.44Å; Y372-A380 HydrophobicContact CE1-CB 4.31Å; Y372-P381 HydrophobicContact CD2-CG 4.4Å; Y372-P381 HydrophobicContact CE2-CG 4.2Å
373	G	76.6	Confident	79.4	Confident	25 Å²	25	58.9 Å²	58.9	26%	0.258	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-131.1	173.5	-178	0	0	0	0	0	113.8	C377 Q378 D379	G373-C377 CarbonylContact O-C 3.54Å; G373-C377 WeakPolarHBondContact O-CA 3.39Å; G373-Q378 PolarHBondContact O-N 3.39Å; G373-Q378 VanDerWaalsContact O-N 3.16Å; G373-D379 VanDerWaalsContact C-OD2 3.26Å; G373-D379 PolarHBondContact N-O 3.25Å; G373-D379 WeakPolarHBondContact O-CB 3.5Å; G373-D379 PolarHBondContact O-N 3.2Å
374	G	79.3	Confident	78.9	Confident	35 Å²	35	57.6 Å²	57.6	36%	0.361	33%	0.33	S	S	.	.	S	Bend	trans	93.3	165.9	178.9	0	0	0	0	0	114.3	L376 C377 D379	G374-L376 PolarHBondContact O-N 3.02Å; G374-C377 PolarHBondContact O-N 2.96Å; G374-C377 VanDerWaalsContact O-N 3.14Å; G374-D379 VanDerWaalsContact CA-OD2 3.27Å; G374-D379 WeakPolarHBondContact CA-OD2 3.47Å; G374-D379 PolarHBondContact N-OD2 3.36Å
375	V	82.7	Confident	78.3	Confident	71 Å²	71	60.9 Å²	60.9	43%	0.43	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-31.9	-175.3	-179.5	0	0	0	0	112.1	V337 T340 I342 C366	V337-V375 HydrophobicContact CB-CG1 4.35Å; V337-V375 HydrophobicContact CG1-CG1 3.79Å; V337-V375 HydrophobicContact CG2-CG1 4.41Å; T340-V375 HydrophobicContact CG2-CG1 4.44Å; I342-V375 HydrophobicContact CD1-CG1 4.15Å; C366-V375 WeakPolarHBondContact CB-O 3.38Å
376	L	83.8	Confident	77.5	Confident	26 Å²	26	60.8 Å²	60.8	14%	0.136	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	10.4	178.3	-60.6	177.3	0	0	0	112.8	V337 I342 L344 H347 S350 G374 Q378	V337-L376 HydrophobicContact CG2-CD2 4.26Å; I342-L376 HydrophobicContact CG2-CD1 4.16Å; I342-L376 HydrophobicContact CG2-CD2 4.01Å; I342-L376 HydrophobicContact CG2-CG 4.43Å; L344-L376 HydrophobicContact CD2-CD2 4.35Å; H347-L376 HydrophobicContact CB-CD1 3.63Å; S350-L376 PolarHBondContact N-O 3.28Å; G374-L376 PolarHBondContact O-N 3.02Å; L376-Q378 PolarHBondContact O-N 3.49Å
377	C	83.9	Confident	77	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	39%	0.391	C	S	.	.	S	Bend	trans	60.3	32.4	-174.3	-47	0	0	0	0	113.3	G353 C368 G373 G374	G353-C377 WeakPolarHBondContact O-CB 3.5Å; C368-C377 WeakPolarHBondContact CA-SG 3.27Å; C368-C377 HydrophobicContact CB-CB 3.63Å; C368-C377 WeakPolarHBondContact CB-SG 3.45Å; C368-C377 PolarHBondContact N-SG 3.4Å; C368-C377 WeakPolarHBondContact SG-CA 3.25Å; C368-C377 WeakPolarHBondContact SG-CB 3Å; C368-C377 CovalentContact SG-SG 2.04Å; C368-C377 PolarHBondContact SG-SG 2.99Å; G373-C377 CarbonylContact O-C 3.54Å; G373-C377 WeakPolarHBondContact O-CA 3.39Å; G374-C377 PolarHBondContact O-N 2.96Å; G374-C377 VanDerWaalsContact O-N 3.14Å
378	Q	79.7	Confident	76.6	Confident	96 Å²	96	64.1 Å²	64.1	45%	0.449	37%	0.373	S	S	.	.			trans	-81.9	-18.6	-178.2	76	-71.7	-15.5	0	0	113.4	G373 L376 A380	G373-Q378 PolarHBondContact O-N 3.39Å; G373-Q378 VanDerWaalsContact O-N 3.16Å; L376-Q378 PolarHBondContact O-N 3.49Å; Q378-A380 PolarHBondContact O-N 3.23Å
379	D	73.6	Confident	76.3	Confident	84 Å²	84	63 Å²	63	45%	0.449	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-83	118.4	-179.3	-48.4	-30.4	0	0	0	108.2	Y372 G373 G374	Y372-D379 CarbonylContact C-O 3.57Å; Y372-D379 WeakPolarHBondContact CA-O 3.38Å; Y372-D379 WeakPolarHBondContact CD1-O 3.44Å; G373-D379 VanDerWaalsContact C-OD2 3.26Å; G373-D379 PolarHBondContact N-O 3.25Å; G373-D379 WeakPolarHBondContact O-CB 3.5Å; G373-D379 PolarHBondContact O-N 3.2Å; G374-D379 VanDerWaalsContact CA-OD2 3.27Å; G374-D379 WeakPolarHBondContact CA-OD2 3.47Å; G374-D379 PolarHBondContact N-OD2 3.36Å
380	A	68.2	Low	76.3	Confident	55 Å²	55	66.1 Å²	66.1	46%	0.455	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-74.7	154.8	-179.9	0	0	0	0	0	112.1	Y372 Q378	Y372-A380 HydrophobicContact CE1-CB 4.31Å; Q378-A380 PolarHBondContact O-N 3.23Å
381	P	67.9	Low	76.4	Confident	48 Å²	48	60.5 Å²	60.5	31%	0.312	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-57.5	138.2	173.8	15.1	-25.9	0	0	0	113.2	G371 Y372 L385	G371-P381 WeakPolarHBondContact O-CA 3.35Å; G371-P381 WeakPolarHBondContact O-CB 3.31Å; Y372-P381 HydrophobicContact CD2-CG 4.4Å; Y372-P381 HydrophobicContact CE2-CG 4.2Å; P381-L385 HydrophobicContact CB-CD1 4.07Å
382	H	69.3	Low	76.8	Confident	69 Å²	69	60.7 Å²	60.7	32%	0.319	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-59.5	126.1	178	-171.8	-71.4	0	0	0	110.5	C384 L385 G397 R508	H382-C384 VanDerWaalsContact CE1-SG 3.56Å; H382-C384 WeakPolarHBondContact ND1-CB 3.18Å; H382-C384 PolarHBondContact ND1-N 3.39Å; H382-C384 PolarHBondContact O-N 3.13Å; H382-L385 HydrophobicContact CB-CD1 4.4Å; H382-L385 HydrophobicContact CB-CG 4.41Å; H382-L385 WeakPolarHBondContact O-CB 3.37Å; H382-L385 VanDerWaalsContact O-CG 3.3Å; H382-L385 WeakPolarHBondContact O-CG 3.33Å; H382-L385 PolarHBondContact O-N 3.32Å; H382-G397 PolarHBondContact CE1-N 2.9Å; H382-R508 PolarHBondContact NE2-NH1 2.93Å
383	P	69	Low	77.1	Confident	21 Å²	21	57.6 Å²	57.6	14%	0.136	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-64.6	-25	-166.1	21.2	-32	0	0	0	113.5	L385 S386 G399 F401	P383-L385 PolarHBondContact O-N 3.26Å; P383-S386 PolarHBondContact O-OG 2.85Å; P383-G399 VanDerWaalsContact CD-O 3.23Å; P383-G399 WeakPolarHBondContact CD-O 3.26Å; P383-G399 WeakPolarHBondContact CG-O 2.74Å; P383-F401 WeakPolarHBondContact CG-O 2.84Å
384	C	73.7	Confident	77.3	Confident	21 Å²	21	60.7 Å²	60.7	14%	0.142	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-67.5	-10.5	173.5	-63.3	0	0	0	0	115.7	H382 S386 K387 C395 T396	H382-C384 VanDerWaalsContact CE1-SG 3.56Å; H382-C384 WeakPolarHBondContact ND1-CB 3.18Å; H382-C384 PolarHBondContact ND1-N 3.39Å; H382-C384 PolarHBondContact O-N 3.13Å; C384-S386 PolarHBondContact O-N 3.24Å; C384-K387 WeakPolarHBondContact O-CA 2.89Å; C384-K387 PolarHBondContact O-N 2.99Å; C384-C395 WeakPolarHBondContact CA-SG 3.37Å; C384-C395 HydrophobicContact CB-CB 3.66Å; C384-C395 WeakPolarHBondContact CB-SG 2.97Å; C384-C395 WeakPolarHBondContact SG-CB 3.35Å; C384-C395 CovalentContact SG-SG 2.03Å; C384-C395 PolarHBondContact SG-SG 3.32Å; C384-T396 VanDerWaalsContact SG-C 3.53Å
385	L	73.4	Confident	77.3	Confident	121 Å²	121	60.4 Å²	60.4	63%	0.634	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-62.1	-29.1	177.2	-73.2	170.8	0	0	0	112.3	P381 H382 P383 K387	P381-L385 HydrophobicContact CB-CD1 4.07Å; H382-L385 HydrophobicContact CB-CD1 4.4Å; H382-L385 HydrophobicContact CB-CG 4.41Å; H382-L385 WeakPolarHBondContact O-CB 3.37Å; H382-L385 VanDerWaalsContact O-CG 3.3Å; H382-L385 WeakPolarHBondContact O-CG 3.33Å; H382-L385 PolarHBondContact O-N 3.32Å; P383-L385 PolarHBondContact O-N 3.26Å; L385-K387 PolarHBondContact O-N 3.34Å
386	S	72.9	Confident	76.8	Confident	95 Å²	95	60 Å²	60	66%	0.664	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-73.7	-2.3	173.6	62.7	0	0	0	0	113.9	P383 C384	P383-S386 PolarHBondContact O-OG 2.85Å; C384-S386 PolarHBondContact O-N 3.24Å
387	K	77.9	Confident	75.6	Confident	169 Å²	169	60 Å²	60	74%	0.735	35%	0.351	S	S	*	.			trans	47.5	60.9	-175.1	-61.5	-179.9	-177.8	176.2	0	112.9	C384 L385 C389	C384-K387 WeakPolarHBondContact O-CA 2.89Å; C384-K387 PolarHBondContact O-N 2.99Å; L385-K387 PolarHBondContact O-N 3.34Å; K387-C389 VanDerWaalsContact C-N 3.34Å; K387-C389 PolarHBondContact O-N 3.16Å
388	P	79.8	Confident	74.1	Confident	8 Å²	8	66.6 Å²	66.6	5%	0.052	39%	0.386	C	S	.	.			trans	-68.9	-31.2	-176.7	27.2	-33.2	0	0	0	112.9	Y402 Q414	P388-Y402 HydrophobicContact CB-CD1 4.12Å; P388-Y402 HydrophobicContact CB-CD2 3.78Å; P388-Y402 HydrophobicContact CB-CE1 3.77Å; P388-Y402 HydrophobicContact CB-CE2 3.44Å; P388-Y402 VanDerWaalsContact CB-CE2 3.44Å; P388-Y402 HydrophobicContact CB-CG 4.11Å; P388-Y402 VanDerWaalsContact CB-CZ 3.41Å; P388-Y402 HydrophobicContact CG-CD1 3.82Å; P388-Y402 HydrophobicContact CG-CD2 3.42Å; P388-Y402 VanDerWaalsContact CG-CD2 3.42Å; P388-Y402 HydrophobicContact CG-CE1 4.02Å; P388-Y402 HydrophobicContact CG-CE2 3.68Å; P388-Y402 HydrophobicContact CG-CG 3.5Å; P388-Q414 WeakPolarHBondContact O-CB 3.31Å; P388-Q414 VanDerWaalsContact O-CD 3.23Å; P388-Q414 VanDerWaalsContact O-CG 3.28Å; P388-Q414 WeakPolarHBondContact O-CG 3.29Å; P388-Q414 PolarHBondContact O-NE2 3.34Å
389	C	81.4	Confident	73.1	Confident	20 Å²	20	64.9 Å²	64.9	14%	0.135	40%	0.395	C	S	.	.			trans	-76.3	126.7	-177.6	-47.7	0	0	0	0	112.8	K387 C395 C404	K387-C389 VanDerWaalsContact C-N 3.34Å; K387-C389 PolarHBondContact O-N 3.16Å; C389-C395 HydrophobicContact CB-CB 4.33Å; C389-C395 WeakPolarHBondContact SG-CA 3.01Å; C389-C395 WeakPolarHBondContact SG-CB 3.09Å; C389-C395 VanDerWaalsContact SG-SG 3.66Å; C389-C404 WeakPolarHBondContact CA-SG 3.34Å; C389-C404 HydrophobicContact CB-CB 3.7Å; C389-C404 WeakPolarHBondContact CB-SG 3.13Å; C389-C404 WeakPolarHBondContact SG-CA 3.15Å; C389-C404 WeakPolarHBondContact SG-CB 3.28Å; C389-C404 CovalentContact SG-SG 2.01Å; C389-C404 PolarHBondContact SG-SG 3Å
390	K	82.5	Confident	72.4	Confident	109 Å²	109	68.6 Å²	68.6	47%	0.474	41%	0.409	S	S	.	.			trans	-94.6	174.2	177.6	-53.7	-58.8	-178.6	-173.8	0	111.5	G392 G393 Q414 E416	K390-G392 PolarHBondContact O-N 3.29Å; K390-G393 PolarHBondContact O-N 2.94Å; K390-Q414 WeakPolarHBondContact CA-O 3.22Å; K390-Q414 WeakPolarHBondContact CB-O 3.18Å; K390-Q414 HydrophobicContact CG-CB 4.28Å; K390-Q414 PolarHBondContact N-O 3.26Å; K390-E416 HydrophobicContact CB-CB 4.47Å; K390-E416 HydrophobicContact CG-CB 4.48Å
391	N	81.3	Confident	71.7	Confident	78 Å²	78	73.8 Å²	73.8	42%	0.417	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	29.3	176.3	-58.8	-36.5	0	0	0	115	G393 F410 C415 E416	N391-G393 VanDerWaalsContact C-N 3.3Å; N391-G393 PolarHBondContact O-N 2.98Å; N391-F410 HydrophobicContact CB-CD1 3.65Å; N391-F410 HydrophobicContact CB-CD2 4.33Å; N391-F410 HydrophobicContact CB-CE1 3.72Å; N391-F410 HydrophobicContact CB-CE2 4.4Å; N391-F410 HydrophobicContact CB-CG 3.97Å; N391-F410 HydrophobicContact CB-CZ 4.11Å; N391-F410 WeakPolarHBondContact ND2-CD1 3.37Å; N391-C415 WeakPolarHBondContact CB-O 3.14Å; N391-C415 PolarHBondContact ND2-O 2.65Å; N391-E416 WeakPolarHBondContact ND2-CA 3.4Å; N391-E416 PolarHBondContact ND2-O 3.12Å
392	G	79.3	Confident	71.9	Confident	45 Å²	45	74.2 Å²	74.2	46%	0.464	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	21.8	-179.9	0	0	0	0	0	114.5	K390 K407	K390-G392 PolarHBondContact O-N 3.29Å; G392-K407 WeakPolarHBondContact O-CD 3.33Å; G392-K407 WeakPolarHBondContact O-CE 3.48Å
393	G	82.3	Confident	72	Confident	14 Å²	14	76.1 Å²	76.1	14%	0.144	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-61.7	145.9	168.8	0	0	0	0	0	111.9	K390 N391 A405	K390-G393 PolarHBondContact O-N 2.94Å; N391-G393 VanDerWaalsContact C-N 3.3Å; N391-G393 PolarHBondContact O-N 2.98Å; G393-A405 CarbonylContact C-O 3.46Å; G393-A405 VanDerWaalsContact CA-O 3.25Å; G393-A405 WeakPolarHBondContact CA-O 3.25Å
394	T	82	Confident	72.2	Confident	90 Å²	90	75.8 Å²	75.8	55%	0.552	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	119.6	178.7	-53	0	0	0	0	108.9	A405	T394-A405 PolarHBondContact N-O 2.96Å; T394-A405 PolarHBondContact O-N 2.88Å
395	C	78	Confident	72.4	Confident	29 Å²	29	77.4 Å²	77.4	20%	0.196	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.9	175.8	-168.9	0	0	0	0	111	C384 C389 L403	C384-C395 WeakPolarHBondContact CA-SG 3.37Å; C384-C395 HydrophobicContact CB-CB 3.66Å; C384-C395 WeakPolarHBondContact CB-SG 2.97Å; C384-C395 WeakPolarHBondContact SG-CB 3.35Å; C384-C395 CovalentContact SG-SG 2.03Å; C384-C395 PolarHBondContact SG-SG 3.32Å; C389-C395 HydrophobicContact CB-CB 4.33Å; C389-C395 WeakPolarHBondContact SG-CA 3.01Å; C389-C395 WeakPolarHBondContact SG-CB 3.09Å; C389-C395 VanDerWaalsContact SG-SG 3.66Å; C395-L403 WeakPolarHBondContact CA-O 3.45Å
396	T	73.6	Confident	72.3	Confident	63 Å²	63	73.7 Å²	73.7	39%	0.387	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.3	167.8	52.4	0	0	0	0	108.8	C384 L403	C384-T396 VanDerWaalsContact SG-C 3.53Å; T396-L403 PolarHBondContact N-O 3.21Å; T396-L403 PolarHBondContact O-N 2.7Å; T396-L403 PolarHBondContact OG1-O 2.87Å
397	G	58.4	Low	72.4	Confident	25 Å²	25	74.7 Å²	74.7	26%	0.258	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	144.6	177.9	0	0	0	0	0	111.2	H382 F401	H382-G397 PolarHBondContact CE1-N 2.9Å; G397-F401 CarbonylContact C-O 3.39Å; G397-F401 VanDerWaalsContact CA-O 3.31Å; G397-F401 WeakPolarHBondContact CA-O 3.34Å
398	D	52.7	Low	71.8	Confident	139 Å²	139	72.1 Å²	72.1	74%	0.743	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	109.6	167.2	-175.1	18.4	0	0	0	108.4	E400 F401	D398-E400 PolarHBondContact O-N 3.21Å; D398-F401 PolarHBondContact N-O 2.85Å; D398-F401 PolarHBondContact O-N 3.16Å
399	G	58.8	Low	71.2	Confident	60 Å²	60	73 Å²	73	62%	0.619	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	-120	-172.4	0	0	0	0	0	112.7	P383	P383-G399 VanDerWaalsContact CD-O 3.23Å; P383-G399 WeakPolarHBondContact CD-O 3.26Å; P383-G399 WeakPolarHBondContact CG-O 2.74Å
400	E	58	Low	70.7	Confident	161 Å²	161	75.3 Å²	75.3	75%	0.752	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-7.9	177.5	-61	-159.7	145.9	0	0	113.7	D398	D398-E400 PolarHBondContact O-N 3.21Å
401	F	53.8	Low	70	Confident	165 Å²	165	73.8 Å²	73.8	72%	0.724	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	147.6	-175.4	-58	-78.1	0	0	0	111.6	P383 G397 D398	P383-F401 WeakPolarHBondContact CG-O 2.84Å; G397-F401 CarbonylContact C-O 3.39Å; G397-F401 VanDerWaalsContact CA-O 3.31Å; G397-F401 WeakPolarHBondContact CA-O 3.34Å; D398-F401 PolarHBondContact N-O 2.85Å; D398-F401 PolarHBondContact O-N 3.16Å
402	Y	71.4	Confident	69.5	Low	57 Å²	57	71.5 Å²	71.5	22%	0.224	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	150.6	170.9	68.6	-94.6	0	0	0	110.8	P388 F413 Q414	P388-Y402 HydrophobicContact CB-CD1 4.12Å; P388-Y402 HydrophobicContact CB-CD2 3.78Å; P388-Y402 HydrophobicContact CB-CE1 3.77Å; P388-Y402 HydrophobicContact CB-CE2 3.44Å; P388-Y402 VanDerWaalsContact CB-CE2 3.44Å; P388-Y402 HydrophobicContact CB-CG 4.11Å; P388-Y402 VanDerWaalsContact CB-CZ 3.41Å; P388-Y402 HydrophobicContact CG-CD1 3.82Å; P388-Y402 HydrophobicContact CG-CD2 3.42Å; P388-Y402 VanDerWaalsContact CG-CD2 3.42Å; P388-Y402 HydrophobicContact CG-CE1 4.02Å; P388-Y402 HydrophobicContact CG-CE2 3.68Å; P388-Y402 HydrophobicContact CG-CG 3.5Å; Y402-F413 HydrophobicContact CD2-CE1 4.25Å; Y402-F413 HydrophobicContact CD2-CZ 4.34Å; Y402-F413 HydrophobicContact CE1-CE1 4.21Å; Y402-F413 AromaticContact CE2-CD1 3.94Å; Y402-F413 HydrophobicContact CE2-CD1 3.94Å; Y402-F413 AromaticContact CE2-CE1 3.35Å; Y402-F413 HydrophobicContact CE2-CE1 3.35Å; Y402-F413 AromaticContact CE2-CZ 3.85Å; Y402-F413 HydrophobicContact CE2-CZ 3.85Å; Y402-F413 AromaticContact CZ-CE1 3.34Å; Y402-F413 VanDerWaalsContact OH-CE1 3.24Å; Y402-F413 WeakPolarHBondContact OH-CE1 2.93Å; Y402-Q414 HydrophobicContact CE2-CG 4.3Å; Y402-Q414 PolarHBondContact OH-NE2 2.82Å; Y402-Q414 VanDerWaalsContact OH-NE2 3.09Å
403	L	70.7	Confident	69.3	Low	109 Å²	109	75.5 Å²	75.5	57%	0.571	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.8	173.3	-172.3	74.9	0	0	0	108.7	C395 T396	C395-L403 WeakPolarHBondContact CA-O 3.45Å; T396-L403 PolarHBondContact N-O 3.21Å; T396-L403 PolarHBondContact O-N 2.7Å; T396-L403 PolarHBondContact OG1-O 2.87Å
404	C	73.4	Confident	69.1	Low	14 Å²	14	77.9 Å²	77.9	10%	0.095	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.1	175.7	-61.8	0	0	0	0	110.6	C389 C406 F413 C415	C389-C404 WeakPolarHBondContact CA-SG 3.34Å; C389-C404 HydrophobicContact CB-CB 3.7Å; C389-C404 WeakPolarHBondContact CB-SG 3.13Å; C389-C404 WeakPolarHBondContact SG-CA 3.15Å; C389-C404 WeakPolarHBondContact SG-CB 3.28Å; C389-C404 CovalentContact SG-SG 2.01Å; C389-C404 PolarHBondContact SG-SG 3Å; C404-C406 PolarHBondContact O-N 2.93Å; C404-F413 VanDerWaalsContact CB-O 3.28Å; C404-F413 WeakPolarHBondContact CB-O 3.16Å; C404-F413 PolarHBondContact SG-O 3.28Å; C404-F413 VanDerWaalsContact SG-O 3.34Å; C404-C415 VanDerWaalsContact CB-SG 3.55Å
405	A	79.1	Confident	69.1	Low	54 Å²	54	73.6 Å²	73.6	45%	0.446	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	107.6	167.9	0	0	0	0	0	109.2	G393 T394	G393-A405 CarbonylContact C-O 3.46Å; G393-A405 VanDerWaalsContact CA-O 3.25Å; G393-A405 WeakPolarHBondContact CA-O 3.25Å; T394-A405 PolarHBondContact N-O 2.96Å; T394-A405 PolarHBondContact O-N 2.88Å
406	C	71.9	Confident	69.1	Low	44 Å²	44	75.9 Å²	75.9	30%	0.297	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-74.8	138.4	-175.9	-53.1	0	0	0	0	112	C404 F410 G412 C415	C404-C406 PolarHBondContact O-N 2.93Å; C406-F410 HydrophobicContact CB-CB 4.39Å; C406-F410 WeakPolarHBondContact CB-O 3Å; C406-G412 PolarHBondContact SG-O 3.2Å; C406-C415 WeakPolarHBondContact CA-SG 3.48Å; C406-C415 HydrophobicContact CB-CB 3.6Å; C406-C415 WeakPolarHBondContact CB-SG 3.12Å; C406-C415 PolarHBondContact N-SG 3.05Å; C406-C415 WeakPolarHBondContact SG-CA 3.37Å; C406-C415 WeakPolarHBondContact SG-CB 3.01Å; C406-C415 CovalentContact SG-SG 2.04Å; C406-C415 PolarHBondContact SG-SG 3.36Å
407	K	73.7	Confident	68.8	Low	115 Å²	115	77.1 Å²	77.1	50%	0.5	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-62.3	149.1	169.3	-79.3	-177.2	174.4	176.4	0	109.8	G392 G409 F410	G392-K407 WeakPolarHBondContact O-CD 3.33Å; G392-K407 WeakPolarHBondContact O-CE 3.48Å; K407-G409 PolarHBondContact O-N 3.07Å; K407-F410 HydrophobicContact CB-CD2 4.4Å; K407-F410 PolarHBondContact O-N 3.43Å
408	P	66.6	Low	69.3	Low	116 Å²	116	79.5 Å²	79.5	75%	0.753	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	135.7	175.3	-25.9	33.9	0	0	0	111.2
409	G	65.3	Low	69.4	Low	25 Å²	25	77.7 Å²	77.7	26%	0.258	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-6.2	-173.6	0	0	0	0	0	114.9	K407 P418 Y419	K407-G409 PolarHBondContact O-N 3.07Å; G409-P418 CarbonylContact O-C 3.53Å; G409-P418 WeakPolarHBondContact O-CA 3.45Å; G409-Y419 PolarHBondContact O-N 3.4Å
410	F	71.9	Confident	69.2	Low	69 Å²	69	82.8 Å²	82.8	30%	0.303	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	155.3	174.3	-61.1	-88.5	0	0	0	112.8	N391 C406 K407 Q417 P418	N391-F410 HydrophobicContact CB-CD1 3.65Å; N391-F410 HydrophobicContact CB-CD2 4.33Å; N391-F410 HydrophobicContact CB-CE1 3.72Å; N391-F410 HydrophobicContact CB-CE2 4.4Å; N391-F410 HydrophobicContact CB-CG 3.97Å; N391-F410 HydrophobicContact CB-CZ 4.11Å; N391-F410 WeakPolarHBondContact ND2-CD1 3.37Å; C406-F410 HydrophobicContact CB-CB 4.39Å; C406-F410 WeakPolarHBondContact CB-O 3Å; K407-F410 HydrophobicContact CB-CD2 4.4Å; K407-F410 PolarHBondContact O-N 3.43Å; F410-Q417 CarbonylContact C-O 3.37Å; F410-Q417 WeakPolarHBondContact CA-O 3.16Å; F410-P418 HydrophobicContact CD1-CB 4.17Å; F410-P418 HydrophobicContact CE1-CB 4.14Å
411	K	66.8	Low	69.1	Low	78 Å²	78	79 Å²	79	34%	0.339	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	174.7	179.7	67.7	177.5	176.6	168.2	0	110.9	C415 E416 Q417 Y419	K411-C415 CarbonylContact O-C 3.22Å; K411-C415 VanDerWaalsContact O-C 3.22Å; K411-C415 WeakPolarHBondContact O-CA 3.33Å; K411-E416 PolarHBondContact O-N 3.15Å; K411-Q417 HydrophobicContact CG-CB 3.77Å; K411-Q417 PolarHBondContact N-O 3.1Å; K411-Q417 WeakPolarHBondContact O-CB 3.03Å; K411-Q417 PolarHBondContact O-N 3.47Å; K411-Y419 HydrophobicContact CB-CD2 4.41Å; K411-Y419 HydrophobicContact CB-CE2 3.64Å; K411-Y419 HydrophobicContact CD-CD1 4.2Å; K411-Y419 HydrophobicContact CD-CE1 3.71Å; K411-Y419 HydrophobicContact CD-CE2 4.29Å; K411-Y419 HydrophobicContact CG-CE1 4.49Å; K411-Y419 HydrophobicContact CG-CE2 4.2Å
412	G	71.1	Confident	69.4	Low	30 Å²	30	73.2 Å²	73.2	31%	0.309	39%	0.39	S	S	.	.	S	Bend	trans	105.8	161.5	-176.2	0	0	0	0	0	111.7	C406 Q414 C415 E416	C406-G412 PolarHBondContact SG-O 3.2Å; G412-Q414 PolarHBondContact O-N 3.16Å; G412-C415 PolarHBondContact O-N 3.5Å; G412-E416 WeakPolarHBondContact CA-OE1 3.27Å
413	F	75	Confident	68.7	Low	129 Å²	129	73.5 Å²	73.5	57%	0.566	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.9	-176.8	-176.1	-112.3	0	0	0	112.3	Y402 C404 E416	Y402-F413 HydrophobicContact CD2-CE1 4.25Å; Y402-F413 HydrophobicContact CD2-CZ 4.34Å; Y402-F413 HydrophobicContact CE1-CE1 4.21Å; Y402-F413 AromaticContact CE2-CD1 3.94Å; Y402-F413 HydrophobicContact CE2-CD1 3.94Å; Y402-F413 AromaticContact CE2-CE1 3.35Å; Y402-F413 HydrophobicContact CE2-CE1 3.35Å; Y402-F413 AromaticContact CE2-CZ 3.85Å; Y402-F413 HydrophobicContact CE2-CZ 3.85Å; Y402-F413 AromaticContact CZ-CE1 3.34Å; Y402-F413 VanDerWaalsContact OH-CE1 3.24Å; Y402-F413 WeakPolarHBondContact OH-CE1 2.93Å; C404-F413 VanDerWaalsContact CB-O 3.28Å; C404-F413 WeakPolarHBondContact CB-O 3.16Å; C404-F413 PolarHBondContact SG-O 3.28Å; C404-F413 VanDerWaalsContact SG-O 3.34Å; F413-E416 PolarHBondContact N-OE2 2.92Å
414	Q	78.9	Confident	67.9	Low	63 Å²	63	76 Å²	76	29%	0.294	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	16.4	173.2	-67.6	-178	-29.6	0	0	111.6	P388 K390 Y402 G412 E416	P388-Q414 WeakPolarHBondContact O-CB 3.31Å; P388-Q414 VanDerWaalsContact O-CD 3.23Å; P388-Q414 VanDerWaalsContact O-CG 3.28Å; P388-Q414 WeakPolarHBondContact O-CG 3.29Å; P388-Q414 PolarHBondContact O-NE2 3.34Å; K390-Q414 WeakPolarHBondContact CA-O 3.22Å; K390-Q414 WeakPolarHBondContact CB-O 3.18Å; K390-Q414 HydrophobicContact CG-CB 4.28Å; K390-Q414 PolarHBondContact N-O 3.26Å; Y402-Q414 HydrophobicContact CE2-CG 4.3Å; Y402-Q414 PolarHBondContact OH-NE2 2.82Å; Y402-Q414 VanDerWaalsContact OH-NE2 3.09Å; G412-Q414 PolarHBondContact O-N 3.16Å; Q414-E416 VanDerWaalsContact CA-OE2 3.28Å; Q414-E416 WeakPolarHBondContact CA-OE2 3.28Å; Q414-E416 WeakPolarHBondContact CB-OE2 3.11Å; Q414-E416 PolarHBondContact N-OE2 3.5Å; Q414-E416 PolarHBondContact O-N 2.68Å
415	C	81.2	Confident	67	Low	0 Å²	0	76.3 Å²	76.3	0%	0	42%	0.422	C	S	.	.	S	Bend	trans	58.7	28.8	-176.6	-49.9	0	0	0	0	114.3	N391 C404 C406 K411 G412 Q417	N391-C415 WeakPolarHBondContact CB-O 3.14Å; N391-C415 PolarHBondContact ND2-O 2.65Å; C404-C415 VanDerWaalsContact CB-SG 3.55Å; C406-C415 WeakPolarHBondContact CA-SG 3.48Å; C406-C415 HydrophobicContact CB-CB 3.6Å; C406-C415 WeakPolarHBondContact CB-SG 3.12Å; C406-C415 PolarHBondContact N-SG 3.05Å; C406-C415 WeakPolarHBondContact SG-CA 3.37Å; C406-C415 WeakPolarHBondContact SG-CB 3.01Å; C406-C415 CovalentContact SG-SG 2.04Å; C406-C415 PolarHBondContact SG-SG 3.36Å; K411-C415 CarbonylContact O-C 3.22Å; K411-C415 VanDerWaalsContact O-C 3.22Å; K411-C415 WeakPolarHBondContact O-CA 3.33Å; G412-C415 PolarHBondContact O-N 3.5Å; C415-Q417 PolarHBondContact O-N 2.64Å
416	E	78.1	Confident	65.8	Low	78 Å²	78	80.6 Å²	80.6	36%	0.364	43%	0.433	S	S	.	.			trans	-78.9	-14.1	-171.1	70.5	-68.6	164.5	0	0	114.3	K390 N391 K411 G412 F413 Q414	K390-E416 HydrophobicContact CB-CB 4.47Å; K390-E416 HydrophobicContact CG-CB 4.48Å; N391-E416 WeakPolarHBondContact ND2-CA 3.4Å; N391-E416 PolarHBondContact ND2-O 3.12Å; K411-E416 PolarHBondContact O-N 3.15Å; G412-E416 WeakPolarHBondContact CA-OE1 3.27Å; F413-E416 PolarHBondContact N-OE2 2.92Å; Q414-E416 VanDerWaalsContact CA-OE2 3.28Å; Q414-E416 WeakPolarHBondContact CA-OE2 3.28Å; Q414-E416 WeakPolarHBondContact CB-OE2 3.11Å; Q414-E416 PolarHBondContact N-OE2 3.5Å; Q414-E416 PolarHBondContact O-N 2.68Å
417	Q	68.8	Low	65.4	Low	88 Å²	88	86.3 Å²	86.3	41%	0.411	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.3	-171.8	-53.2	175	17.3	0	0	112	F410 K411 C415	F410-Q417 CarbonylContact C-O 3.37Å; F410-Q417 WeakPolarHBondContact CA-O 3.16Å; K411-Q417 HydrophobicContact CG-CB 3.77Å; K411-Q417 PolarHBondContact N-O 3.1Å; K411-Q417 WeakPolarHBondContact O-CB 3.03Å; K411-Q417 PolarHBondContact O-N 3.47Å; C415-Q417 PolarHBondContact O-N 2.64Å
418	P	67.2	Low	65.2	Low	76 Å²	76	81.8 Å²	81.8	49%	0.494	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	163.3	172.3	30.4	-32.5	0	0	0	113.6	G409 F410	G409-P418 CarbonylContact O-C 3.53Å; G409-P418 WeakPolarHBondContact O-CA 3.45Å; F410-P418 HydrophobicContact CD1-CB 4.17Å; F410-P418 HydrophobicContact CE1-CB 4.14Å
419	Y	54.9	Low	65.5	Low	101 Å²	101	81.5 Å²	81.5	40%	0.396	42%	0.424	S	S	.	.			trans	-95.7	127.6	169.6	-78.6	-78.8	0	0	0	111	G409 K411 K424	G409-Y419 PolarHBondContact O-N 3.4Å; K411-Y419 HydrophobicContact CB-CD2 4.41Å; K411-Y419 HydrophobicContact CB-CE2 3.64Å; K411-Y419 HydrophobicContact CD-CD1 4.2Å; K411-Y419 HydrophobicContact CD-CE1 3.71Å; K411-Y419 HydrophobicContact CD-CE2 4.29Å; K411-Y419 HydrophobicContact CG-CE1 4.49Å; K411-Y419 HydrophobicContact CG-CE2 4.2Å; Y419-K424 HydrophobicContact CD1-CB 4.36Å
420	E	54.7	Low	66.1	Low	167 Å²	167	83.3 Å²	83.3	78%	0.78	43%	0.428	S	S	*	.			trans	-93.2	-15.3	-168.1	-65.1	177.7	166	0	0	115.8
421	T	56.5	Low	66.2	Low	81 Å²	81	83.3 Å²	83.3	50%	0.497	45%	0.447	S	S	.	.			trans	-147.4	146.9	-171.1	50.2	0	0	0	0	114.4	G423 K424	T421-G423 PolarHBondContact O-N 3.42Å; T421-K424 PolarHBondContact O-N 3.13Å; T421-K424 VanDerWaalsContact O-N 3.13Å
422	C	60.4	Low	66.7	Low	44 Å²	44	80.2 Å²	80.2	30%	0.297	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-25.6	172.3	-86.8	0	0	0	0	113.4	C434	C422-C434 HydrophobicContact CB-CB 3.98Å; C422-C434 WeakPolarHBondContact CB-SG 3.42Å; C422-C434 WeakPolarHBondContact SG-CB 3.44Å; C422-C434 CovalentContact SG-SG 2.06Å; C422-C434 PolarHBondContact SG-SG 2.69Å
423	G	56.3	Low	67.1	Low	63 Å²	63	83.2 Å²	83.2	65%	0.649	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.8	-177.2	0	0	0	0	0	115	T421	T421-G423 PolarHBondContact O-N 3.42Å
424	K	53.5	Low	67	Low	160 Å²	160	79.2 Å²	79.2	70%	0.696	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-5.3	-177.5	-67.8	-173.7	179.3	178.8	0	114.1	Y419 T421	Y419-K424 HydrophobicContact CD1-CB 4.36Å; T421-K424 PolarHBondContact O-N 3.13Å; T421-K424 VanDerWaalsContact O-N 3.13Å
425	G	54.3	Low	66.7	Low	21 Å²	21	79.6 Å²	79.6	22%	0.216	44%	0.444	C	S	.	.	S	Bend	trans	-84.2	176.9	167.6	0	0	0	0	0	112	K427	G425-K427 PolarHBondContact O-N 2.64Å
426	Q	55	Low	65.7	Low	144 Å²	144	88.2 Å²	88.2	67%	0.673	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-61.9	125.1	167.4	-75.9	-179.4	-20.6	0	0	108.5	Y441 H453	Q426-Y441 PolarHBondContact O-OH 3.31Å; Q426-H453 PolarHBondContact OE1-CE1 3.45Å
427	K	64.4	Low	64.6	Low	164 Å²	164	87.7 Å²	87.7	71%	0.713	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-64.5	150.2	-178.4	-70.5	177.9	179.2	175.8	0	110.2	G425 E429	G425-K427 PolarHBondContact O-N 2.64Å; K427-E429 PolarHBondContact O-N 2.78Å
428	C	68.9	Low	64	Low	20 Å²	20	92.7 Å²	92.7	14%	0.135	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-62.6	122.8	164.3	-49.8	0	0	0	0	108.7	G432 C434 C443 H453	C428-G432 VanDerWaalsContact CB-O 3.23Å; C428-G432 WeakPolarHBondContact CB-O 3.36Å; C428-C434 VanDerWaalsContact SG-CA 3.58Å; C428-C434 VanDerWaalsContact SG-CB 3.57Å; C428-C443 WeakPolarHBondContact CA-SG 3.2Å; C428-C443 HydrophobicContact CB-CB 3.65Å; C428-C443 WeakPolarHBondContact CB-SG 3.34Å; C428-C443 WeakPolarHBondContact SG-CA 3.48Å; C428-C443 WeakPolarHBondContact SG-CB 3.43Å; C428-C443 CovalentContact SG-SG 2.01Å; C428-C443 PolarHBondContact SG-SG 2.83Å; C428-H453 CarbonylContact C-O 3.52Å
429	E	72	Confident	63.4	Low	110 Å²	110	98 Å²	98	51%	0.514	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-84.7	170.3	179.4	-59.8	-162.8	177	0	0	110.9	K427 G431 G432 H453 C454	K427-E429 PolarHBondContact O-N 2.78Å; E429-G431 PolarHBondContact O-N 3.35Å; E429-G432 PolarHBondContact O-N 3.43Å; E429-H453 PolarHBondContact N-O 3.23Å; E429-C454 WeakPolarHBondContact O-CB 3.05Å
430	N	78.9	Confident	63.5	Low	64 Å²	64	97.3 Å²	97.3	34%	0.342	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	35.3	172.7	-57	-45.5	0	0	0	115.9	Y449 C454	N430-Y449 HydrophobicContact CB-CD1 3.33Å; N430-Y449 HydrophobicContact CB-CD2 3.67Å; N430-Y449 HydrophobicContact CB-CE1 3.43Å; N430-Y449 VanDerWaalsContact CB-CE1 3.43Å; N430-Y449 HydrophobicContact CB-CE2 3.75Å; N430-Y449 HydrophobicContact CB-CG 3.46Å; N430-Y449 VanDerWaalsContact CB-CG 3.46Å; N430-Y449 VanDerWaalsContact ND2-CD1 3.34Å; N430-Y449 WeakPolarHBondContact ND2-CD1 3.44Å; N430-C454 WeakPolarHBondContact CB-O 3.1Å; N430-C454 PolarHBondContact ND2-O 3.21Å
431	G	72.5	Confident	64	Low	68 Å²	68	92 Å²	92	70%	0.701	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	14	177.6	0	0	0	0	0	114.9	E429	E429-G431 PolarHBondContact O-N 3.35Å
432	G	78.5	Confident	64.3	Low	14 Å²	14	90 Å²	90	14%	0.144	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-63.9	141.4	175.5	0	0	0	0	0	113.4	C428 E429 N444	C428-G432 VanDerWaalsContact CB-O 3.23Å; C428-G432 WeakPolarHBondContact CB-O 3.36Å; E429-G432 PolarHBondContact O-N 3.43Å; G432-N444 CarbonylContact C-O 3.55Å; G432-N444 WeakPolarHBondContact CA-O 3.12Å
433	V	78.8	Confident	64.9	Low	93 Å²	93	89 Å²	89	56%	0.564	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	117.4	-179.4	-178.3	0	0	0	0	110.4	C443 N444	V433-C443 WeakPolarHBondContact O-CA 3.46Å; V433-N444 HydrophobicContact CB-CB 4.46Å; V433-N444 PolarHBondContact N-O 3.39Å; V433-N444 PolarHBondContact O-N 2.86Å
434	C	72.3	Confident	65.9	Low	45 Å²	45	91.6 Å²	91.6	30%	0.304	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128.6	176.3	-163.8	0	0	0	0	111.4	C422 C428 A442	C422-C434 HydrophobicContact CB-CB 3.98Å; C422-C434 WeakPolarHBondContact CB-SG 3.42Å; C422-C434 WeakPolarHBondContact SG-CB 3.44Å; C422-C434 CovalentContact SG-SG 2.06Å; C422-C434 PolarHBondContact SG-SG 2.69Å; C428-C434 VanDerWaalsContact SG-CA 3.58Å; C428-C434 VanDerWaalsContact SG-CB 3.57Å; C434-A442 CarbonylContact C-O 3.36Å; C434-A442 WeakPolarHBondContact CA-O 3.2Å
435	T	74.3	Confident	66.9	Low	71 Å²	71	86 Å²	86	44%	0.436	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.3	176.9	57.3	0	0	0	0	110.4	S437 Y441 A442	T435-S437 PolarHBondContact O-N 3.35Å; T435-Y441 CarbonylContact O-C 3.44Å; T435-Y441 WeakPolarHBondContact O-CA 3.45Å; T435-A442 PolarHBondContact N-O 2.74Å; T435-A442 PolarHBondContact O-N 2.03Å; T435-A442 PolarHBondContact OG1-O 3.35Å; T435-A442 VanDerWaalsContact OG1-O 3.12Å
436	K	60.5	Low	68.1	Low	181 Å²	181	88.1 Å²	88.1	79%	0.787	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	110.9	176.8	-174.4	-179.6	-179.4	-179.5	0	109.2
437	S	54.5	Low	69	Low	66 Å²	66	86.1 Å²	86.1	46%	0.462	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	155.1	162.3	-172	0	0	0	0	108.8	T435 E439 T440	T435-S437 PolarHBondContact O-N 3.35Å; S437-E439 PolarHBondContact O-N 3.22Å; S437-T440 CarbonylContact C-O 3.57Å; S437-T440 WeakPolarHBondContact CA-O 3.42Å; S437-T440 WeakPolarHBondContact CB-O 3.43Å; S437-T440 PolarHBondContact N-O 3.33Å; S437-T440 PolarHBondContact O-N 3.37Å; S437-T440 VanDerWaalsContact O-N 3.1Å
438	Q	55.6	Low	69.3	Low	194 Å²	194	84 Å²	84	91%	0.907	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-18.5	-161.6	-69.5	-175.2	-2.1	0	0	115.8
439	E	54.8	Low	69.6	Low	187 Å²	187	86.4 Å²	86.4	87%	0.874	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.5	-0.5	174.5	-62.7	-178.3	169	0	0	114	S437	S437-E439 PolarHBondContact O-N 3.22Å
440	T	56.5	Low	69.4	Low	87 Å²	87	83.4 Å²	83.4	53%	0.534	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	169.1	-173.3	61.9	0	0	0	0	112.3	S437	S437-T440 CarbonylContact C-O 3.57Å; S437-T440 WeakPolarHBondContact CA-O 3.42Å; S437-T440 WeakPolarHBondContact CB-O 3.43Å; S437-T440 PolarHBondContact N-O 3.33Å; S437-T440 PolarHBondContact O-N 3.37Å; S437-T440 VanDerWaalsContact O-N 3.1Å
441	Y	65	Low	68.5	Low	54 Å²	54	81.6 Å²	81.6	21%	0.212	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	153.5	171.2	76	-86	0	0	0	111.5	Q426 T435 H453	Q426-Y441 PolarHBondContact O-OH 3.31Å; T435-Y441 CarbonylContact O-C 3.44Å; T435-Y441 WeakPolarHBondContact O-CA 3.45Å; Y441-H453 AromaticContact CE2-NE2 3.82Å; Y441-H453 AromaticContact CZ-NE2 3.7Å; Y441-H453 PolarHBondContact OH-CE1 3.47Å; Y441-H453 PolarHBondContact OH-NE2 3.14Å
442	A	63.1	Low	68	Low	40 Å²	40	84.3 Å²	84.3	33%	0.331	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	141.1	176.5	0	0	0	0	0	111.7	C434 T435	C434-A442 CarbonylContact C-O 3.36Å; C434-A442 WeakPolarHBondContact CA-O 3.2Å; T435-A442 PolarHBondContact N-O 2.74Å; T435-A442 PolarHBondContact O-N 2.03Å; T435-A442 PolarHBondContact OG1-O 3.35Å; T435-A442 VanDerWaalsContact OG1-O 3.12Å
443	C	72.9	Confident	67.6	Low	23 Å²	23	85.1 Å²	85.1	16%	0.155	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.3	179.4	-61.2	0	0	0	0	112.1	C428 V433 L452	C428-C443 WeakPolarHBondContact CA-SG 3.2Å; C428-C443 HydrophobicContact CB-CB 3.65Å; C428-C443 WeakPolarHBondContact CB-SG 3.34Å; C428-C443 WeakPolarHBondContact SG-CA 3.48Å; C428-C443 WeakPolarHBondContact SG-CB 3.43Å; C428-C443 CovalentContact SG-SG 2.01Å; C428-C443 PolarHBondContact SG-SG 2.83Å; V433-C443 WeakPolarHBondContact O-CA 3.46Å; C443-L452 VanDerWaalsContact CB-O 3.29Å; C443-L452 WeakPolarHBondContact CB-O 3.47Å
444	N	78.1	Confident	67.4	Low	117 Å²	117	80.7 Å²	80.7	63%	0.626	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.2	174.7	-154.2	6.6	0	0	0	110.2	G432 V433	G432-N444 CarbonylContact C-O 3.55Å; G432-N444 WeakPolarHBondContact CA-O 3.12Å; V433-N444 HydrophobicContact CB-CB 4.46Å; V433-N444 PolarHBondContact N-O 3.39Å; V433-N444 PolarHBondContact O-N 2.86Å
445	C	74.6	Confident	67.1	Low	43 Å²	43	81.1 Å²	81.1	29%	0.291	44%	0.439	S	S	.	.			trans	-96.2	149.6	-166.8	-51.8	0	0	0	0	113.8	Y449 C454	C445-Y449 WeakPolarHBondContact CB-O 2.83Å; C445-C454 WeakPolarHBondContact CA-SG 3.4Å; C445-C454 HydrophobicContact CB-CB 3.69Å; C445-C454 WeakPolarHBondContact CB-SG 3.4Å; C445-C454 WeakPolarHBondContact SG-CA 3.41Å; C445-C454 WeakPolarHBondContact SG-CB 3.33Å; C445-C454 CovalentContact SG-SG 2.03Å; C445-C454 PolarHBondContact SG-SG 2.96Å
446	S	79.4	Confident	66.5	Low	66 Å²	66	83.2 Å²	83.2	46%	0.462	44%	0.44	S	S	.	.			trans	-70.1	159.8	168.3	-174.2	0	0	0	0	111.1	E448 Y449	S446-E448 PolarHBondContact O-N 2.96Å; S446-E448 VanDerWaalsContact O-N 3.09Å; S446-Y449 PolarHBondContact O-N 3.38Å
447	S	73.8	Confident	66.6	Low	101 Å²	101	80.5 Å²	80.5	71%	0.706	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.8	-176.2	55.3	0	0	0	0	114.6	Y449	S447-Y449 VanDerWaalsContact C-N 3.33Å
448	E	70.7	Confident	67	Low	119 Å²	119	77.9 Å²	77.9	56%	0.556	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-3.1	179.2	-58.3	-57.9	137	0	0	113.4	S446 E457 A458	S446-E448 PolarHBondContact O-N 2.96Å; S446-E448 VanDerWaalsContact O-N 3.09Å; E448-E457 CarbonylContact O-C 3.59Å; E448-E457 WeakPolarHBondContact O-CA 3.4Å; E448-A458 WeakPolarHBondContact O-CB 3.19Å; E448-A458 PolarHBondContact O-N 3.18Å
449	Y	74.4	Confident	67.1	Low	72 Å²	72	70.9 Å²	70.9	28%	0.282	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	152	-174.4	-62.1	-83.4	0	0	0	113.1	N430 C445 S446 S447 Y456 E457	N430-Y449 HydrophobicContact CB-CD1 3.33Å; N430-Y449 HydrophobicContact CB-CD2 3.67Å; N430-Y449 HydrophobicContact CB-CE1 3.43Å; N430-Y449 VanDerWaalsContact CB-CE1 3.43Å; N430-Y449 HydrophobicContact CB-CE2 3.75Å; N430-Y449 HydrophobicContact CB-CG 3.46Å; N430-Y449 VanDerWaalsContact CB-CG 3.46Å; N430-Y449 VanDerWaalsContact ND2-CD1 3.34Å; N430-Y449 WeakPolarHBondContact ND2-CD1 3.44Å; C445-Y449 WeakPolarHBondContact CB-O 2.83Å; S446-Y449 PolarHBondContact O-N 3.38Å; S447-Y449 VanDerWaalsContact C-N 3.33Å; Y449-Y456 CarbonylContact C-O 3.51Å; Y449-Y456 WeakPolarHBondContact CA-O 3.27Å; Y449-E457 HydrophobicContact CD1-CG 4.22Å; Y449-E457 HydrophobicContact CE1-CG 3.73Å
450	T	67.5	Low	67.6	Low	46 Å²	46	67 Å²	67	28%	0.282	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	161	-179.9	-175.5	0	0	0	0	110.5	C454 E455 Y456	T450-C454 CarbonylContact O-C 3.46Å; T450-E455 PolarHBondContact O-N 2.82Å; T450-Y456 PolarHBondContact N-O 2.92Å; T450-Y456 WeakPolarHBondContact O-CB 3.46Å; T450-Y456 WeakPolarHBondContact O-CD2 3.4Å; T450-Y456 PolarHBondContact O-N 2.91Å
451	G	60.8	Low	68	Low	26 Å²	26	64.2 Å²	64.2	27%	0.268	34%	0.343	S	S	.	.	S	Bend	trans	124.8	169.7	-178.8	0	0	0	0	0	112	H453 C454 E455	G451-H453 PolarHBondContact O-N 3.32Å; G451-C454 PolarHBondContact O-N 2.99Å; G451-E455 WeakPolarHBondContact CA-OE2 3.16Å
452	L	62.5	Low	68.1	Low	126 Å²	126	69.4 Å²	69.4	66%	0.66	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-28.9	-179.9	-177.7	65.9	0	0	0	111.4	C443 E455	C443-L452 VanDerWaalsContact CB-O 3.29Å; C443-L452 WeakPolarHBondContact CB-O 3.47Å; L452-E455 PolarHBondContact N-OE2 3.05Å
453	H	69.5	Low	68.2	Low	30 Å²	30	74.7 Å²	74.7	14%	0.139	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	17.7	175	-55.7	152.5	0	0	0	111.6	Q426 C428 E429 Y441 G451 E455	Q426-H453 PolarHBondContact OE1-CE1 3.45Å; C428-H453 CarbonylContact C-O 3.52Å; E429-H453 PolarHBondContact N-O 3.23Å; Y441-H453 AromaticContact CE2-NE2 3.82Å; Y441-H453 AromaticContact CZ-NE2 3.7Å; Y441-H453 PolarHBondContact OH-CE1 3.47Å; Y441-H453 PolarHBondContact OH-NE2 3.14Å; G451-H453 PolarHBondContact O-N 3.32Å; H453-E455 VanDerWaalsContact CA-OE2 3.25Å; H453-E455 WeakPolarHBondContact CA-OE2 3.2Å; H453-E455 PolarHBondContact N-OE2 2.03Å; H453-E455 PolarHBondContact O-N 3.32Å
454	C	74.2	Confident	68	Low	0 Å²	0	78.8 Å²	78.8	0%	0	41%	0.405	C	S	.	.	S	Bend	trans	58.3	28.1	-176.2	-44	0	0	0	0	113.8	E429 N430 C445 T450 G451 Y456	E429-C454 WeakPolarHBondContact O-CB 3.05Å; N430-C454 WeakPolarHBondContact CB-O 3.1Å; N430-C454 PolarHBondContact ND2-O 3.21Å; C445-C454 WeakPolarHBondContact CA-SG 3.4Å; C445-C454 HydrophobicContact CB-CB 3.69Å; C445-C454 WeakPolarHBondContact CB-SG 3.4Å; C445-C454 WeakPolarHBondContact SG-CA 3.41Å; C445-C454 WeakPolarHBondContact SG-CB 3.33Å; C445-C454 CovalentContact SG-SG 2.03Å; C445-C454 PolarHBondContact SG-SG 2.96Å; T450-C454 CarbonylContact O-C 3.46Å; G451-C454 PolarHBondContact O-N 2.99Å; C454-Y456 VanDerWaalsContact C-N 3.28Å; C454-Y456 PolarHBondContact O-N 3.28Å
455	E	67	Low	67.6	Low	55 Å²	55	75.3 Å²	75.3	26%	0.257	39%	0.388	S	S	.	.			trans	-75.1	-9.7	-170.5	66.3	-83.6	-163.8	0	0	114.3	T450 G451 L452 H453	T450-E455 PolarHBondContact O-N 2.82Å; G451-E455 WeakPolarHBondContact CA-OE2 3.16Å; L452-E455 PolarHBondContact N-OE2 3.05Å; H453-E455 VanDerWaalsContact CA-OE2 3.25Å; H453-E455 WeakPolarHBondContact CA-OE2 3.2Å; H453-E455 PolarHBondContact N-OE2 2.03Å; H453-E455 PolarHBondContact O-N 3.32Å
456	Y	60.5	Low	67.7	Low	114 Å²	114	73.3 Å²	73.3	45%	0.447	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.2	-173	-51.2	-63.7	0	0	0	113.4	Y449 T450 C454	Y449-Y456 CarbonylContact C-O 3.51Å; Y449-Y456 WeakPolarHBondContact CA-O 3.27Å; T450-Y456 PolarHBondContact N-O 2.92Å; T450-Y456 WeakPolarHBondContact O-CB 3.46Å; T450-Y456 WeakPolarHBondContact O-CD2 3.4Å; T450-Y456 PolarHBondContact O-N 2.91Å; C454-Y456 VanDerWaalsContact C-N 3.28Å; C454-Y456 PolarHBondContact O-N 3.28Å
457	E	64.1	Low	67.4	Low	124 Å²	124	75.3 Å²	75.3	58%	0.579	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	136.1	170.8	-67.9	175.7	-170.6	0	0	112	E448 Y449 N459	E448-E457 CarbonylContact O-C 3.59Å; E448-E457 WeakPolarHBondContact O-CA 3.4Å; Y449-E457 HydrophobicContact CD1-CG 4.22Å; Y449-E457 HydrophobicContact CE1-CG 3.73Å; E457-N459 PolarHBondContact O-N 2.65Å; E457-N459 VanDerWaalsContact O-N 3.11Å
458	A	61	Low	67.6	Low	11 Å²	11	75.6 Å²	75.6	9%	0.091	38%	0.379	C	S	.	.			trans	-83.9	60.6	174.3	0	0	0	0	0	110.5	E448	E448-A458 WeakPolarHBondContact O-CB 3.19Å; E448-A458 PolarHBondContact O-N 3.18Å
459	N	58.4	Low	68.1	Low	48 Å²	48	71.7 Å²	71.7	26%	0.257	36%	0.362	S	S	.	.			trans	-87.9	131.7	177.4	-135.7	-31.9	0	0	0	110.8	E457 Y481	E457-N459 PolarHBondContact O-N 2.65Å; E457-N459 VanDerWaalsContact O-N 3.11Å; N459-Y481 WeakPolarHBondContact O-CD1 3.18Å; N459-Y481 WeakPolarHBondContact O-CE1 3.08Å
460	Y	64.7	Low	68.5	Low	104 Å²	104	68.8 Å²	68.8	41%	0.408	35%	0.354	S	S	.	.			trans	-72	170.5	173.9	-63.9	-84.2	0	0	0	110.2	E462 N474	Y460-E462 PolarHBondContact O-N 2.81Å; Y460-N474 HydrophobicContact CD1-CB 4.41Å
461	C	66.8	Low	69.1	Low	29 Å²	29	69.4 Å²	69.4	20%	0.196	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-61.6	28.2	-179	-67.8	0	0	0	0	116	C472 Q473 N474	C461-C472 VanDerWaalsContact CA-SG 3.5Å; C461-C472 HydrophobicContact CB-CB 3.65Å; C461-C472 WeakPolarHBondContact CB-SG 3.17Å; C461-C472 WeakPolarHBondContact SG-CB 3.14Å; C461-C472 CovalentContact SG-SG 2.02Å; C461-C472 PolarHBondContact SG-SG 3.42Å; C461-Q473 PolarHBondContact SG-N 3.49Å; C461-N474 WeakPolarHBondContact CB-OD1 3.5Å; C461-N474 PolarHBondContact N-OD1 2.91Å; C461-N474 PolarHBondContact SG-OD1 2.89Å
462	E	66.7	Low	70	Confident	163 Å²	163	70.3 Å²	70.3	76%	0.762	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-77.6	-26.7	-176.2	-104.9	176.6	178.7	0	0	114.1	Y460	Y460-E462 PolarHBondContact O-N 2.81Å
463	K	65.2	Low	70.7	Confident	152 Å²	152	69 Å²	69	66%	0.661	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-104.2	24.3	-173.7	-72	-175.2	-179.9	174.1	0	114.6	T465	K463-T465 PolarHBondContact O-N 3.12Å
464	D	67.3	Low	70.8	Confident	108 Å²	108	71.1 Å²	71.1	58%	0.578	37%	0.368	S	S	*	.			trans	52.5	29.6	-179.8	-70.1	-35.5	0	0	0	113.6	C466 L467	D464-C466 PolarHBondContact O-N 3.33Å; D464-L467 HydrophobicContact CB-CB 4.36Å; D464-L467 HydrophobicContact CB-CD1 3.89Å; D464-L467 WeakPolarHBondContact O-CB 3.22Å; D464-L467 PolarHBondContact O-N 3.33Å
465	T	70.3	Confident	70.2	Confident	45 Å²	45	73.4 Å²	73.4	28%	0.276	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.6	-165.5	-51.7	0	0	0	0	114.8	K463 Y481 N493	K463-T465 PolarHBondContact O-N 3.12Å; T465-Y481 HydrophobicContact CG2-CE2 4.32Å; T465-N493 HydrophobicContact CG2-CB 4.32Å; T465-N493 WeakPolarHBondContact CG2-ND2 3.2Å
466	C	76.2	Confident	69.7	Low	1 Å²	1	76.7 Å²	76.7	1%	0.007	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-15	178.7	-47.3	0	0	0	0	113.7	D464 N469 G470 C472 C483	D464-C466 PolarHBondContact O-N 3.33Å; C466-N469 CarbonylContact O-C 3.51Å; C466-N469 PolarHBondContact O-N 3.35Å; C466-G470 CarbonylContact C-O 3.51Å; C466-G470 PolarHBondContact O-N 3.44Å; C466-C472 HydrophobicContact CB-CB 4.15Å; C466-C472 WeakPolarHBondContact SG-CA 3.43Å; C466-C472 WeakPolarHBondContact SG-CB 3.31Å; C466-C472 PolarHBondContact SG-SG 3.42Å; C466-C483 HydrophobicContact CB-CB 3.66Å; C466-C483 WeakPolarHBondContact CB-SG 3.5Å; C466-C483 WeakPolarHBondContact SG-CA 3.38Å; C466-C483 WeakPolarHBondContact SG-CB 3.12Å; C466-C483 CovalentContact SG-SG 2Å; C466-C483 PolarHBondContact SG-SG 3.1Å
467	L	72.6	Confident	69.4	Low	107 Å²	107	76.1 Å²	76.1	56%	0.56	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	147.7	-176.9	-73.2	167.7	0	0	0	110.5	D464	D464-L467 HydrophobicContact CB-CB 4.36Å; D464-L467 HydrophobicContact CB-CD1 3.89Å; D464-L467 WeakPolarHBondContact O-CB 3.22Å; D464-L467 PolarHBondContact O-N 3.33Å
468	P	79.2	Confident	68.5	Low	107 Å²	107	76.6 Å²	76.6	70%	0.695	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85.8	-2.4	3.1	33.9	-34.9	0	0	0	114.5	G470	P468-G470 PolarHBondContact O-N 2.06Å
469	N	81.6	Confident	68.3	Low	38 Å²	38	77.1 Å²	77.1	20%	0.203	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	2.6	-165.8	-63	-23.9	0	0	0	114.7	C466 R486 Y489 C494	C466-N469 CarbonylContact O-C 3.51Å; C466-N469 PolarHBondContact O-N 3.35Å; N469-R486 PolarHBondContact O-N 3.48Å; N469-Y489 HydrophobicContact CB-CD1 4.08Å; N469-Y489 HydrophobicContact CB-CD2 4.01Å; N469-Y489 HydrophobicContact CB-CE2 4.48Å; N469-Y489 HydrophobicContact CB-CG 3.8Å; N469-Y489 WeakPolarHBondContact ND2-CD1 3.33Å; N469-Y489 WeakPolarHBondContact ND2-CE1 3.42Å; N469-C494 HydrophobicContact CB-CB 3.72Å; N469-C494 VanDerWaalsContact CB-O 3.23Å; N469-C494 WeakPolarHBondContact CB-O 3.42Å; N469-C494 PolarHBondContact ND2-O 3.31Å
470	G	82.1	Confident	68.5	Low	10 Å²	10	75.7 Å²	75.7	10%	0.103	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.1	170.7	-179.9	0	0	0	0	0	114	C466 P468 H484	C466-G470 CarbonylContact C-O 3.51Å; C466-G470 PolarHBondContact O-N 3.44Å; P468-G470 PolarHBondContact O-N 2.06Å; G470-H484 CarbonylContact C-O 3.22Å; G470-H484 WeakPolarHBondContact CA-O 3.04Å
471	A	80.9	Confident	68.7	Low	60 Å²	60	71.9 Å²	71.9	50%	0.496	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	132.8	176.8	0	0	0	0	0	110.9	H484	A471-H484 HydrophobicContact CB-CB 4.48Å; A471-H484 PolarHBondContact N-O 2.79Å; A471-H484 PolarHBondContact O-N 2.72Å
472	C	80	Confident	68.9	Low	45 Å²	45	77.6 Å²	77.6	30%	0.304	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	139.7	-178.3	-163.1	0	0	0	0	112.2	C461 C466	C461-C472 VanDerWaalsContact CA-SG 3.5Å; C461-C472 HydrophobicContact CB-CB 3.65Å; C461-C472 WeakPolarHBondContact CB-SG 3.17Å; C461-C472 WeakPolarHBondContact SG-CB 3.14Å; C461-C472 CovalentContact SG-SG 2.02Å; C461-C472 PolarHBondContact SG-SG 3.42Å; C466-C472 HydrophobicContact CB-CB 4.15Å; C466-C472 WeakPolarHBondContact SG-CA 3.43Å; C466-C472 WeakPolarHBondContact SG-CB 3.31Å; C466-C472 PolarHBondContact SG-SG 3.42Å
473	Q	75.4	Confident	69.2	Low	99 Å²	99	70.6 Å²	70.6	46%	0.463	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.1	172.8	-177.2	-180	17.4	0	0	111.4	C461 Y481 R482 H484	C461-Q473 PolarHBondContact SG-N 3.49Å; Q473-Y481 CarbonylContact O-C 3.44Å; Q473-Y481 WeakPolarHBondContact O-CA 3.41Å; Q473-R482 PolarHBondContact N-O 3.01Å; Q473-R482 PolarHBondContact O-N 2.87Å; Q473-H484 PolarHBondContact OE1-NE2 3.05Å
474	N	72.8	Confident	69.6	Low	74 Å²	74	67.4 Å²	67.4	40%	0.396	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	135.3	172.2	-72.6	-29.7	0	0	0	111.3	Y460 C461	Y460-N474 HydrophobicContact CD1-CB 4.41Å; C461-N474 WeakPolarHBondContact CB-OD1 3.5Å; C461-N474 PolarHBondContact N-OD1 2.91Å; C461-N474 PolarHBondContact SG-OD1 2.89Å
475	I	62.2	Low	69.6	Low	48 Å²	48	64.3 Å²	64.3	25%	0.246	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	88.7	174.9	-55	179	0	0	0	107.9	S477 L478 G479 T480 R482	I475-S477 VanDerWaalsContact C-N 3.29Å; I475-S477 PolarHBondContact O-N 3.28Å; I475-L478 HydrophobicContact CG2-CB 4.33Å; I475-L478 HydrophobicContact CG2-CD1 4.32Å; I475-L478 HydrophobicContact CG2-CG 4.48Å; I475-L478 PolarHBondContact O-N 3.01Å; I475-G479 PolarHBondContact O-N 3.01Å; I475-T480 CarbonylContact C-O 3.47Å; I475-T480 WeakPolarHBondContact CA-O 3.34Å; I475-T480 HydrophobicContact CB-CG2 4.03Å; I475-T480 HydrophobicContact CD1-CG2 4.38Å; I475-T480 PolarHBondContact N-O 3.06Å; I475-T480 PolarHBondContact O-N 3.07Å; I475-R482 HydrophobicContact CD1-CB 3.69Å; I475-R482 HydrophobicContact CG1-CB 4.33Å
476	T	56.6	Low	69.8	Low	123 Å²	123	71.1 Å²	71.1	76%	0.755	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-63.5	-29.6	-175.1	43	0	0	0	0	114	L478	T476-L478 PolarHBondContact O-N 3.31Å
477	S	53.1	Low	68.9	Low	102 Å²	102	76.8 Å²	76.8	71%	0.713	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-67.7	-18.6	-179	55.8	0	0	0	0	114.6	I475	I475-S477 VanDerWaalsContact C-N 3.29Å; I475-S477 PolarHBondContact O-N 3.28Å
478	L	45.5	Very low	68.3	Low	134 Å²	134	74.4 Å²	74.4	70%	0.702	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-123.6	2.8	-176	-67.9	172.4	0	0	0	112.7	I475 T476 T480	I475-L478 HydrophobicContact CG2-CB 4.33Å; I475-L478 HydrophobicContact CG2-CD1 4.32Å; I475-L478 HydrophobicContact CG2-CG 4.48Å; I475-L478 PolarHBondContact O-N 3.01Å; T476-L478 PolarHBondContact O-N 3.31Å; L478-T480 HydrophobicContact CB-CG2 3.97Å; L478-T480 PolarHBondContact O-N 2.95Å
479	G	57.6	Low	67.8	Low	23 Å²	23	73.1 Å²	73.1	24%	0.237	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	43.7	-174	0	0	0	0	0	112.7	I475	I475-G479 PolarHBondContact O-N 3.01Å
480	T	62.6	Low	66.6	Low	18 Å²	18	72.9 Å²	72.9	11%	0.11	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	-179.3	-176.5	-158.6	0	0	0	0	112.8	I475 L478 R492	I475-T480 CarbonylContact C-O 3.47Å; I475-T480 WeakPolarHBondContact CA-O 3.34Å; I475-T480 HydrophobicContact CB-CG2 4.03Å; I475-T480 HydrophobicContact CD1-CG2 4.38Å; I475-T480 PolarHBondContact N-O 3.06Å; I475-T480 PolarHBondContact O-N 3.07Å; L478-T480 HydrophobicContact CB-CG2 3.97Å; L478-T480 PolarHBondContact O-N 2.95Å; T480-R492 PolarHBondContact OG1-NH2 2.85Å
481	Y	69.2	Low	65.3	Low	24 Å²	24	74.2 Å²	74.2	9%	0.094	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	163	175	73.3	-77.3	0	0	0	111.6	N459 T465 Q473 N493	N459-Y481 WeakPolarHBondContact O-CD1 3.18Å; N459-Y481 WeakPolarHBondContact O-CE1 3.08Å; T465-Y481 HydrophobicContact CG2-CE2 4.32Å; Q473-Y481 CarbonylContact O-C 3.44Å; Q473-Y481 WeakPolarHBondContact O-CA 3.41Å; Y481-N493 PolarHBondContact OH-OD1 2.87Å
482	R	69.7	Low	64.5	Low	149 Å²	149	75.1 Å²	75.1	56%	0.562	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	131.6	174	172.4	177.8	179.3	160.7	1.2	110	Q473 I475	Q473-R482 PolarHBondContact N-O 3.01Å; Q473-R482 PolarHBondContact O-N 2.87Å; I475-R482 HydrophobicContact CD1-CB 3.69Å; I475-R482 HydrophobicContact CG1-CB 4.33Å
483	C	73.4	Confident	64.2	Low	15 Å²	15	75.4 Å²	75.4	10%	0.101	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	137.6	169.2	-59.7	0	0	0	0	111.7	C466 R492 C494	C466-C483 HydrophobicContact CB-CB 3.66Å; C466-C483 WeakPolarHBondContact CB-SG 3.5Å; C466-C483 WeakPolarHBondContact SG-CA 3.38Å; C466-C483 WeakPolarHBondContact SG-CB 3.12Å; C466-C483 CovalentContact SG-SG 2Å; C466-C483 PolarHBondContact SG-SG 3.1Å; C483-R492 WeakPolarHBondContact CB-O 3.45Å; C483-R492 PolarHBondContact SG-O 3.05Å; C483-C494 VanDerWaalsContact CB-SG 3.51Å
484	H	73.1	Confident	64.3	Low	86 Å²	86	70.7 Å²	70.7	40%	0.398	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	96.9	167.4	-64.5	-76.4	0	0	0	109	G470 A471 Q473	G470-H484 CarbonylContact C-O 3.22Å; G470-H484 WeakPolarHBondContact CA-O 3.04Å; A471-H484 HydrophobicContact CB-CB 4.48Å; A471-H484 PolarHBondContact N-O 2.79Å; A471-H484 PolarHBondContact O-N 2.72Å; Q473-H484 PolarHBondContact OE1-NE2 3.05Å
485	C	68.9	Low	64.3	Low	42 Å²	42	71.7 Å²	71.7	28%	0.284	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.5	-173.8	-53.6	0	0	0	0	112.9	Y489 C494	C485-Y489 WeakPolarHBondContact CB-O 3.25Å; C485-C494 WeakPolarHBondContact CA-SG 3.5Å; C485-C494 HydrophobicContact CB-CB 3.68Å; C485-C494 WeakPolarHBondContact CB-SG 3.42Å; C485-C494 WeakPolarHBondContact SG-CA 3.32Å; C485-C494 WeakPolarHBondContact SG-CB 3.24Å; C485-C494 CovalentContact SG-SG 2.03Å; C485-C494 PolarHBondContact SG-SG 3.26Å
486	R	73.7	Confident	64.2	Low	189 Å²	189	76.6 Å²	76.6	71%	0.713	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-73.6	131.2	169.2	-177.2	177.7	-91.2	177	-6.1	108.1	N469 Y489	N469-R486 PolarHBondContact O-N 3.48Å; R486-Y489 WeakPolarHBondContact O-CB 3.1Å; R486-Y489 WeakPolarHBondContact O-CD2 3.4Å; R486-Y489 PolarHBondContact O-N 3.37Å
487	L	57.7	Low	64	Low	119 Å²	119	75.3 Å²	75.3	62%	0.623	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	139.7	179.8	-61.1	165.6	0	0	0	109.9	Y500	L487-Y500 WeakPolarHBondContact CD2-OH 3.38Å
488	P	59.3	Low	64.1	Low	58 Å²	58	72.6 Å²	72.6	38%	0.377	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	cis	-97.4	27.4	9.8	38.8	-35.4	0	0	0	115.3	V498 Y500	P488-V498 PolarHBondContact O-N 3.27Å; P488-Y500 HydrophobicContact CB-CE2 4.21Å
489	Y	68.2	Low	64.6	Low	79 Å²	79	73.2 Å²	73.2	31%	0.31	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	150.2	-177	-61.6	-90.7	0	0	0	113.7	N469 C485 R486 Y496 T497	N469-Y489 HydrophobicContact CB-CD1 4.08Å; N469-Y489 HydrophobicContact CB-CD2 4.01Å; N469-Y489 HydrophobicContact CB-CE2 4.48Å; N469-Y489 HydrophobicContact CB-CG 3.8Å; N469-Y489 WeakPolarHBondContact ND2-CD1 3.33Å; N469-Y489 WeakPolarHBondContact ND2-CE1 3.42Å; C485-Y489 WeakPolarHBondContact CB-O 3.25Å; R486-Y489 WeakPolarHBondContact O-CB 3.1Å; R486-Y489 WeakPolarHBondContact O-CD2 3.4Å; R486-Y489 PolarHBondContact O-N 3.37Å; Y489-Y496 CarbonylContact C-O 3.59Å; Y489-Y496 VanDerWaalsContact CA-O 3.24Å; Y489-Y496 WeakPolarHBondContact CA-O 2.89Å; Y489-T497 HydrophobicContact CD1-CG2 3.62Å; Y489-T497 HydrophobicContact CE1-CG2 3.35Å; Y489-T497 HydrophobicContact CG-CG2 4.42Å
490	A	56.1	Low	64.7	Low	34 Å²	34	75.2 Å²	75.2	28%	0.281	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	-177.1	169.6	0	0	0	0	0	112.2	C494 H495 Y496 V498	A490-C494 CarbonylContact O-C 3.58Å; A490-C494 WeakPolarHBondContact O-CA 3.19Å; A490-H495 PolarHBondContact O-N 3.21Å; A490-Y496 PolarHBondContact N-O 3.03Å; A490-Y496 PolarHBondContact O-N 3.46Å; A490-Y496 VanDerWaalsContact O-O 3.13Å; A490-V498 HydrophobicContact CB-CG2 3.17Å
491	G	56.5	Low	64.7	Low	37 Å²	37	75.6 Å²	75.6	38%	0.381	37%	0.367	S	S	.	.	S	Bend	trans	99.7	164.8	-168.3	0	0	0	0	0	111.2	N493 C494	G491-N493 PolarHBondContact O-N 3.48Å; G491-N493 VanDerWaalsContact O-N 3.15Å; G491-C494 PolarHBondContact O-N 3.45Å; G491-C494 VanDerWaalsContact O-N 3.09Å
492	R	64.1	Low	64.1	Low	79 Å²	79	81 Å²	81	30%	0.298	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-37	-175.4	-171.5	176	-177.9	177.6	-3.7	112.8	T480 C483	T480-R492 PolarHBondContact OG1-NH2 2.85Å; C483-R492 WeakPolarHBondContact CB-O 3.45Å; C483-R492 PolarHBondContact SG-O 3.05Å
493	N	73.5	Confident	63.6	Low	51 Å²	51	78.6 Å²	78.6	27%	0.273	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	17.2	-179.5	-56.8	-2.5	0	0	0	112.9	T465 Y481 G491 H495	T465-N493 HydrophobicContact CG2-CB 4.32Å; T465-N493 WeakPolarHBondContact CG2-ND2 3.2Å; Y481-N493 PolarHBondContact OH-OD1 2.87Å; G491-N493 PolarHBondContact O-N 3.48Å; G491-N493 VanDerWaalsContact O-N 3.15Å; N493-H495 VanDerWaalsContact C-N 3.27Å; N493-H495 PolarHBondContact O-N 2.81Å
494	C	76.3	Confident	63.1	Low	0 Å²	0	81.7 Å²	81.7	0%	0	42%	0.418	C	S	.	.	S	Bend	trans	57.3	35.7	-178.3	-46.4	0	0	0	0	114.4	N469 C483 C485 A490 G491	N469-C494 HydrophobicContact CB-CB 3.72Å; N469-C494 VanDerWaalsContact CB-O 3.23Å; N469-C494 WeakPolarHBondContact CB-O 3.42Å; N469-C494 PolarHBondContact ND2-O 3.31Å; C483-C494 VanDerWaalsContact CB-SG 3.51Å; C485-C494 WeakPolarHBondContact CA-SG 3.5Å; C485-C494 HydrophobicContact CB-CB 3.68Å; C485-C494 WeakPolarHBondContact CB-SG 3.42Å; C485-C494 WeakPolarHBondContact SG-CA 3.32Å; C485-C494 WeakPolarHBondContact SG-CB 3.24Å; C485-C494 CovalentContact SG-SG 2.03Å; C485-C494 PolarHBondContact SG-SG 3.26Å; A490-C494 CarbonylContact O-C 3.58Å; A490-C494 WeakPolarHBondContact O-CA 3.19Å; G491-C494 PolarHBondContact O-N 3.45Å; G491-C494 VanDerWaalsContact O-N 3.09Å
495	H	73.1	Confident	63	Low	95 Å²	95	79 Å²	79	44%	0.44	41%	0.41	S	S	.	.			trans	-93.7	-14.8	-174.1	54.8	-83.8	0	0	0	114	A490 N493	A490-H495 PolarHBondContact O-N 3.21Å; N493-H495 VanDerWaalsContact C-N 3.27Å; N493-H495 PolarHBondContact O-N 2.81Å
496	Y	59.6	Low	63.1	Low	152 Å²	152	77.1 Å²	77.1	60%	0.596	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	142.5	176.5	-55.4	-59.5	0	0	0	110.6	Y489 A490	Y489-Y496 CarbonylContact C-O 3.59Å; Y489-Y496 VanDerWaalsContact CA-O 3.24Å; Y489-Y496 WeakPolarHBondContact CA-O 2.89Å; A490-Y496 PolarHBondContact N-O 3.03Å; A490-Y496 PolarHBondContact O-N 3.46Å; A490-Y496 VanDerWaalsContact O-O 3.13Å
497	T	53.3	Low	63	Low	96 Å²	96	70.2 Å²	70.2	59%	0.589	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	133.7	166.5	46.4	0	0	0	0	109.6	Y489	Y489-T497 HydrophobicContact CD1-CG2 3.62Å; Y489-T497 HydrophobicContact CE1-CG2 3.35Å; Y489-T497 HydrophobicContact CG-CG2 4.42Å
498	V	54.5	Low	63.4	Low	44 Å²	44	69.7 Å²	69.7	27%	0.267	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-97.5	117	178.4	-179.6	0	0	0	0	110	P488 A490 Y500	P488-V498 PolarHBondContact O-N 3.27Å; A490-V498 HydrophobicContact CB-CG2 3.17Å; V498-Y500 HydrophobicContact CG1-CD1 4.24Å; V498-Y500 HydrophobicContact CG1-CE1 4.32Å
499	E	55.5	Low	64.1	Low	147 Å²	147	69.9 Å²	69.9	69%	0.687	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-83.1	117.8	161.9	-162.1	171.7	-165.2	0	0	108.8
500	Y	61.5	Low	64.6	Low	65 Å²	65	66.6 Å²	66.6	26%	0.255	35%	0.352	S	S	.	.	S	Bend	trans	-74.9	-31	-168.8	-60.9	-81.4	0	0	0	113.9	L487 P488 V498 K502 S505 N514	L487-Y500 WeakPolarHBondContact CD2-OH 3.38Å; P488-Y500 HydrophobicContact CB-CE2 4.21Å; V498-Y500 HydrophobicContact CG1-CD1 4.24Å; V498-Y500 HydrophobicContact CG1-CE1 4.32Å; Y500-K502 PolarHBondContact O-N 3.25Å; Y500-S505 PolarHBondContact O-OG 2.86Å; Y500-N514 WeakPolarHBondContact CB-OD1 3.48Å
501	C	61.7	Low	65.7	Low	27 Å²	27	68.2 Å²	68.2	18%	0.182	36%	0.359	C	S	.	.			trans	-90.5	97.2	169.6	-82.5	0	0	0	0	110.1	C512 L513 N514	C501-C512 WeakPolarHBondContact CA-SG 3.42Å; C501-C512 HydrophobicContact CB-CB 3.86Å; C501-C512 WeakPolarHBondContact CB-SG 3.38Å; C501-C512 WeakPolarHBondContact SG-CB 3.32Å; C501-C512 PolarHBondContact SG-O 3.42Å; C501-C512 CovalentContact SG-SG 2.06Å; C501-C512 PolarHBondContact SG-SG 3.06Å; C501-L513 VanDerWaalsContact SG-C 3.51Å; C501-N514 WeakPolarHBondContact CB-OD1 3.37Å; C501-N514 PolarHBondContact N-OD1 2.88Å; C501-N514 PolarHBondContact SG-N 3.48Å; C501-N514 VanDerWaalsContact SG-N 3.44Å; C501-N514 PolarHBondContact SG-OD1 2.78Å
502	K	57.4	Low	66.4	Low	138 Å²	138	67.9 Å²	67.9	60%	0.6	35%	0.35	S	S	*	.			trans	-89	154.1	163.3	-61.7	-176.6	-180	-177.8	0	108.3	Y500 D504 S505	Y500-K502 PolarHBondContact O-N 3.25Å; K502-D504 PolarHBondContact O-N 2.97Å; K502-S505 PolarHBondContact N-OG 2.89Å; K502-S505 VanDerWaalsContact N-OG 3.08Å; K502-S505 VanDerWaalsContact O-CB 3.31Å; K502-S505 WeakPolarHBondContact O-CB 3.43Å; K502-S505 PolarHBondContact O-N 2.82Å; K502-S505 PolarHBondContact O-OG 3.4Å
503	A	59.4	Low	66.6	Low	97 Å²	97	67.9 Å²	67.9	80%	0.802	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-28.8	-177	0	0	0	0	0	113.8
504	D	62.5	Low	66.1	Low	81 Å²	81	69.7 Å²	69.7	43%	0.433	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	1	-174.9	-63.5	-2.4	0	0	0	114	K502 C506 S507 R508	K502-D504 PolarHBondContact O-N 2.97Å; D504-C506 PolarHBondContact O-N 3.5Å; D504-S507 WeakPolarHBondContact O-CA 3.44Å; D504-S507 PolarHBondContact O-N 2.82Å; D504-R508 HydrophobicContact CB-CG 4.33Å; D504-R508 VanDerWaalsContact OD1-CG 3.26Å; D504-R508 WeakPolarHBondContact OD1-CG 3.04Å; D504-R508 IonicContact OD1-CZ 3.36Å; D504-R508 IonicContact OD1-NE 2.66Å; D504-R508 PolarHBondContact OD1-NE 3.01Å; D504-R508 IonicContact OD1-NH2 2.77Å; D504-R508 PolarHBondContact OD1-NH2 2.78Å; D504-R508 IonicContact OD2-CZ 3.45Å; D504-R508 IonicContact OD2-NE 3.25Å; D504-R508 PolarHBondContact OD2-NE 2.85Å; D504-R508 IonicContact OD2-NH2 2.68Å; D504-R508 PolarHBondContact OD2-NH2 3.16Å
505	S	71	Confident	65.2	Low	30 Å²	30	73.8 Å²	73.8	21%	0.21	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-25.5	-174.2	-76	0	0	0	0	113.8	Y500 K502 F532	Y500-S505 PolarHBondContact O-OG 2.86Å; K502-S505 PolarHBondContact N-OG 2.89Å; K502-S505 VanDerWaalsContact N-OG 3.08Å; K502-S505 VanDerWaalsContact O-CB 3.31Å; K502-S505 WeakPolarHBondContact O-CB 3.43Å; K502-S505 PolarHBondContact O-N 2.82Å; K502-S505 PolarHBondContact O-OG 3.4Å; S505-F532 VanDerWaalsContact O-CD1 3.31Å; S505-F532 WeakPolarHBondContact O-CD1 3.25Å
506	C	70.8	Confident	63.9	Low	2 Å²	2	75.3 Å²	75.3	1%	0.014	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	33.9	176.7	-57.9	0	0	0	0	113	D504 R508 H509 G510 C512 C522 F532	D504-C506 PolarHBondContact O-N 3.5Å; C506-R508 PolarHBondContact O-N 3.21Å; C506-H509 PolarHBondContact O-N 2.93Å; C506-G510 WeakPolarHBondContact CB-O 3.27Å; C506-G510 PolarHBondContact O-N 3.39Å; C506-C512 WeakPolarHBondContact SG-CA 3.29Å; C506-C512 VanDerWaalsContact SG-CB 3.51Å; C506-C522 WeakPolarHBondContact CA-SG 3.4Å; C506-C522 HydrophobicContact CB-CB 3.53Å; C506-C522 WeakPolarHBondContact CB-SG 3.46Å; C506-C522 WeakPolarHBondContact SG-CA 3.05Å; C506-C522 WeakPolarHBondContact SG-CB 3.49Å; C506-C522 CovalentContact SG-SG 2.02Å; C506-C522 PolarHBondContact SG-SG 3.34Å; C506-F532 CarbonylContact C-O 3.56Å; C506-F532 VanDerWaalsContact O-O 3.1Å
507	S	71.6	Confident	63.5	Low	43 Å²	43	74.3 Å²	74.3	30%	0.301	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	21.5	-173.4	-47.2	0	0	0	0	113.2	D504 H509 F532	D504-S507 WeakPolarHBondContact O-CA 3.44Å; D504-S507 PolarHBondContact O-N 2.82Å; S507-H509 PolarHBondContact O-CE1 3.29Å; S507-H509 VanDerWaalsContact O-CE1 3.27Å; S507-H509 PolarHBondContact O-N 3.13Å; S507-H509 PolarHBondContact O-ND1 2.84Å; S507-F532 WeakPolarHBondContact CB-O 3.47Å; S507-F532 PolarHBondContact N-O 3.48Å; S507-F532 PolarHBondContact OG-O 2.77Å
508	R	65.4	Low	63.4	Low	109 Å²	109	71.4 Å²	71.4	41%	0.411	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	-2.5	-164.7	-54.1	179	-174.4	-173.1	-1.6	115.8	H382 D504 C506 G510 Y525	H382-R508 PolarHBondContact NE2-NH1 2.93Å; D504-R508 HydrophobicContact CB-CG 4.33Å; D504-R508 VanDerWaalsContact OD1-CG 3.26Å; D504-R508 WeakPolarHBondContact OD1-CG 3.04Å; D504-R508 IonicContact OD1-CZ 3.36Å; D504-R508 IonicContact OD1-NE 2.66Å; D504-R508 PolarHBondContact OD1-NE 3.01Å; D504-R508 IonicContact OD1-NH2 2.77Å; D504-R508 PolarHBondContact OD1-NH2 2.78Å; D504-R508 IonicContact OD2-CZ 3.45Å; D504-R508 IonicContact OD2-NE 3.25Å; D504-R508 PolarHBondContact OD2-NE 2.85Å; D504-R508 IonicContact OD2-NH2 2.68Å; D504-R508 PolarHBondContact OD2-NH2 3.16Å; C506-R508 PolarHBondContact O-N 3.21Å; R508-G510 PolarHBondContact O-N 3.23Å; R508-Y525 VanDerWaalsContact O-CE2 3.32Å; R508-Y525 WeakPolarHBondContact O-CE2 3.43Å
509	H	73.5	Confident	63.4	Low	62 Å²	62	74.9 Å²	74.9	29%	0.287	41%	0.414	S	S	.	.	S	Bend	trans	-90.4	25.7	177.7	-55.4	113.3	0	0	0	111.7	C506 S507 C524 Y525 Y528 C533	C506-H509 PolarHBondContact O-N 2.93Å; S507-H509 PolarHBondContact O-CE1 3.29Å; S507-H509 VanDerWaalsContact O-CE1 3.27Å; S507-H509 PolarHBondContact O-N 3.13Å; S507-H509 PolarHBondContact O-ND1 2.84Å; H509-C524 CarbonylContact O-C 3.42Å; H509-C524 WeakPolarHBondContact O-CA 3.23Å; H509-Y525 PolarHBondContact O-N 2.96Å; H509-Y528 HydrophobicContact CB-CD1 3.93Å; H509-Y528 HydrophobicContact CB-CD2 3.93Å; H509-Y528 HydrophobicContact CB-CE1 4.38Å; H509-Y528 HydrophobicContact CB-CE2 4.38Å; H509-Y528 HydrophobicContact CB-CG 3.7Å; H509-Y528 AromaticContact CD2-CE1 3.69Å; H509-Y528 AromaticContact CD2-CE2 3.56Å; H509-Y528 AromaticContact CD2-CZ 3.38Å; H509-Y528 AromaticContact CE1-CE1 3.67Å; H509-Y528 AromaticContact CE1-CZ 3.98Å; H509-Y528 AromaticContact CG-CD1 3.67Å; H509-Y528 AromaticContact CG-CE1 3.64Å; H509-Y528 AromaticContact CG-CE2 3.98Å; H509-Y528 AromaticContact CG-CG 3.86Å; H509-Y528 AromaticContact CG-CZ 3.8Å; H509-Y528 AromaticContact ND1-CD1 3.77Å; H509-Y528 AromaticContact ND1-CE1 3.61Å; H509-Y528 AromaticContact NE2-CE1 3.71Å; H509-Y528 AromaticContact NE2-CZ 3.51Å; H509-Y528 PolarHBondContact NE2-OH 2.99Å; H509-C533 HydrophobicContact CB-CB 3.8Å; H509-C533 WeakPolarHBondContact CB-O 3Å; H509-C533 PolarHBondContact ND1-O 3.02Å; H509-C533 WeakPolarHBondContact O-CB 3.41Å
510	G	78.8	Confident	63.9	Low	9 Å²	9	69.6 Å²	69.6	9%	0.093	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.9	168.8	176.8	0	0	0	0	0	113.1	C506 R508 L523	C506-G510 WeakPolarHBondContact CB-O 3.27Å; C506-G510 PolarHBondContact O-N 3.39Å; R508-G510 PolarHBondContact O-N 3.23Å; G510-L523 CarbonylContact C-O 3.31Å; G510-L523 WeakPolarHBondContact CA-O 3.3Å
511	V	78.9	Confident	64.5	Low	68 Å²	68	69.9 Å²	69.9	41%	0.412	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.6	177.2	-179.2	0	0	0	0	109.2	L513 C522 L523 Y525	V511-L513 HydrophobicContact CG1-CD2 4.46Å; V511-C522 WeakPolarHBondContact O-CA 3.14Å; V511-L523 HydrophobicContact CB-CB 4.46Å; V511-L523 PolarHBondContact N-O 3.26Å; V511-L523 PolarHBondContact O-N 2.77Å; V511-Y525 HydrophobicContact CG2-CE1 4.19Å
512	C	72	Confident	64.9	Low	31 Å²	31	69.2 Å²	69.2	21%	0.209	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	124.8	175.9	-173.8	0	0	0	0	110.7	C501 C506	C501-C512 WeakPolarHBondContact CA-SG 3.42Å; C501-C512 HydrophobicContact CB-CB 3.86Å; C501-C512 WeakPolarHBondContact CB-SG 3.38Å; C501-C512 WeakPolarHBondContact SG-CB 3.32Å; C501-C512 PolarHBondContact SG-O 3.42Å; C501-C512 CovalentContact SG-SG 2.06Å; C501-C512 PolarHBondContact SG-SG 3.06Å; C506-C512 WeakPolarHBondContact SG-CA 3.29Å; C506-C512 VanDerWaalsContact SG-CB 3.51Å
513	L	68	Low	65.6	Low	78 Å²	78	66.9 Å²	66.9	41%	0.408	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.8	172.9	-61.4	172.6	0	0	0	109	C501 V511 L515 I520 K521 L523	C501-L513 VanDerWaalsContact SG-C 3.51Å; V511-L513 HydrophobicContact CG1-CD2 4.46Å; L513-L515 PolarHBondContact O-N 2.82Å; L513-I520 CarbonylContact O-C 3.45Å; L513-I520 WeakPolarHBondContact O-CA 3.47Å; L513-K521 PolarHBondContact N-O 2.93Å; L513-K521 PolarHBondContact O-N 3.18Å; L513-L523 HydrophobicContact CD1-CD1 3.78Å; L513-L523 HydrophobicContact CD1-CG 4.16Å
514	N	62.6	Low	66.3	Low	90 Å²	90	64.7 Å²	64.7	48%	0.481	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	113.2	168.4	-73.9	-35.1	0	0	0	107.9	Y500 C501	Y500-N514 WeakPolarHBondContact CB-OD1 3.48Å; C501-N514 WeakPolarHBondContact CB-OD1 3.37Å; C501-N514 PolarHBondContact N-OD1 2.88Å; C501-N514 PolarHBondContact SG-N 3.48Å; C501-N514 VanDerWaalsContact SG-N 3.44Å; C501-N514 PolarHBondContact SG-OD1 2.78Å
515	L	57.5	Low	66.7	Low	86 Å²	86	66.9 Å²	66.9	45%	0.45	36%	0.362	S	S	.	.			trans	-86	164.2	167.2	-65.2	172.3	0	0	0	109.2	L513 T517 K519 K521	L513-L515 PolarHBondContact O-N 2.82Å; L515-T517 PolarHBondContact O-N 2.84Å; L515-K519 WeakPolarHBondContact CA-O 2.93Å; L515-K519 HydrophobicContact CB-CB 4.38Å; L515-K519 WeakPolarHBondContact CB-O 3.25Å; L515-K519 PolarHBondContact N-O 3.24Å; L515-K521 HydrophobicContact CD1-CB 3.69Å; L515-K521 HydrophobicContact CG-CB 4.02Å
516	T	46.9	Very low	66.6	Low	127 Å²	127	71.5 Å²	71.5	78%	0.779	40%	0.395	S	S	*	.	S	Bend	trans	-53.4	137.8	171.5	14.2	0	0	0	0	110.8
517	T	50.5	Low	65.9	Low	131 Å²	131	73.1 Å²	73.1	80%	0.804	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	60.8	176.3	57.7	0	0	0	0	117.1	L515 K519	L515-T517 PolarHBondContact O-N 2.84Å; T517-K519 VanDerWaalsContact C-N 3.26Å; T517-K519 PolarHBondContact O-N 3.32Å
518	G	50.7	Low	65.6	Low	35 Å²	35	74.2 Å²	74.2	36%	0.361	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	2.9	161.1	0	0	0	0	0	115.9
519	K	55.9	Low	65.5	Low	117 Å²	117	72.3 Å²	72.3	51%	0.509	41%	0.411	S	S	.	.			trans	-92	138.5	170.7	-68.2	-176.9	-178.1	178	0	109.7	L515 T517	L515-K519 WeakPolarHBondContact CA-O 2.93Å; L515-K519 HydrophobicContact CB-CB 4.38Å; L515-K519 WeakPolarHBondContact CB-O 3.25Å; L515-K519 PolarHBondContact N-O 3.24Å; T517-K519 VanDerWaalsContact C-N 3.26Å; T517-K519 PolarHBondContact O-N 3.32Å
520	I	65.6	Low	64.9	Low	35 Å²	35	71.2 Å²	71.2	18%	0.179	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	145.8	168.8	59.2	165.1	0	0	0	110.4	L513 F532	L513-I520 CarbonylContact O-C 3.45Å; L513-I520 WeakPolarHBondContact O-CA 3.47Å; I520-F532 HydrophobicContact CD1-CD1 4.23Å; I520-F532 HydrophobicContact CD1-CE1 3.84Å; I520-F532 HydrophobicContact CG1-CE1 4.03Å
521	K	73.7	Confident	64.3	Low	72 Å²	72	71.9 Å²	71.9	31%	0.313	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.4	171.1	-176.3	171.5	-176.7	172.9	0	109.6	L513 L515 D611	L513-K521 PolarHBondContact N-O 2.93Å; L513-K521 PolarHBondContact O-N 3.18Å; L515-K521 HydrophobicContact CD1-CB 3.69Å; L515-K521 HydrophobicContact CG-CB 4.02Å; K521-D611 IonicContact NZ-OD2 2.65Å
522	C	70	Confident	64	Low	12 Å²	12	72.3 Å²	72.3	8%	0.081	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.3	177.4	-67.6	0	0	0	0	110.8	C506 V511 S531	C506-C522 WeakPolarHBondContact CA-SG 3.4Å; C506-C522 HydrophobicContact CB-CB 3.53Å; C506-C522 WeakPolarHBondContact CB-SG 3.46Å; C506-C522 WeakPolarHBondContact SG-CA 3.05Å; C506-C522 WeakPolarHBondContact SG-CB 3.49Å; C506-C522 CovalentContact SG-SG 2.02Å; C506-C522 PolarHBondContact SG-SG 3.34Å; V511-C522 WeakPolarHBondContact O-CA 3.14Å; C522-S531 WeakPolarHBondContact CB-O 3.43Å
523	L	73.1	Confident	64	Low	90 Å²	90	70.8 Å²	70.8	47%	0.471	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	107.4	171.2	-66.1	174.6	0	0	0	109.2	G510 V511 L513	G510-L523 CarbonylContact C-O 3.31Å; G510-L523 WeakPolarHBondContact CA-O 3.3Å; V511-L523 HydrophobicContact CB-CB 4.46Å; V511-L523 PolarHBondContact N-O 3.26Å; V511-L523 PolarHBondContact O-N 2.77Å; L513-L523 HydrophobicContact CD1-CD1 3.78Å; L513-L523 HydrophobicContact CD1-CG 4.16Å
524	C	72.6	Confident	64.2	Low	50 Å²	50	70.9 Å²	70.9	34%	0.338	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	138.5	-170.8	-54	0	0	0	0	113.8	H509 Y528 G530 C533	H509-C524 CarbonylContact O-C 3.42Å; H509-C524 WeakPolarHBondContact O-CA 3.23Å; C524-Y528 WeakPolarHBondContact CB-O 3.06Å; C524-G530 PolarHBondContact SG-O 3.41Å; C524-G530 VanDerWaalsContact SG-O 3.37Å; C524-C533 WeakPolarHBondContact CA-SG 3.2Å; C524-C533 HydrophobicContact CB-CB 3.65Å; C524-C533 WeakPolarHBondContact CB-SG 3.38Å; C524-C533 WeakPolarHBondContact SG-CA 3.37Å; C524-C533 WeakPolarHBondContact SG-CB 3.3Å; C524-C533 CovalentContact SG-SG 2.03Å; C524-C533 PolarHBondContact SG-SG 3.42Å
525	Y	71.8	Confident	63.9	Low	127 Å²	127	73 Å²	73	50%	0.498	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-67.5	155.2	167.4	-57.7	-41.1	0	0	0	110.6	R508 H509 V511 G527 Y528	R508-Y525 VanDerWaalsContact O-CE2 3.32Å; R508-Y525 WeakPolarHBondContact O-CE2 3.43Å; H509-Y525 PolarHBondContact O-N 2.96Å; V511-Y525 HydrophobicContact CG2-CE1 4.19Å; Y525-G527 PolarHBondContact O-N 3.25Å; Y525-Y528 PolarHBondContact O-N 2.89Å
526	S	68.2	Low	63.9	Low	127 Å²	127	71.7 Å²	71.7	89%	0.888	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	135.3	-173.9	-69.3	0	0	0	0	112.5	Y528	S526-Y528 VanDerWaalsContact C-N 3.34Å
527	G	57.2	Low	64.4	Low	37 Å²	37	70.1 Å²	70.1	38%	0.381	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	-10.1	-178.5	0	0	0	0	0	114.9	Y525 L537	Y525-G527 PolarHBondContact O-N 3.25Å; G527-L537 PolarHBondContact O-N 3.23Å
528	Y	64.8	Low	64.3	Low	66 Å²	66	72.4 Å²	72.4	26%	0.259	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	138.4	173.1	-66.8	-91	0	0	0	110.9	H509 C524 Y525 S526 F535 N536	H509-Y528 HydrophobicContact CB-CD1 3.93Å; H509-Y528 HydrophobicContact CB-CD2 3.93Å; H509-Y528 HydrophobicContact CB-CE1 4.38Å; H509-Y528 HydrophobicContact CB-CE2 4.38Å; H509-Y528 HydrophobicContact CB-CG 3.7Å; H509-Y528 AromaticContact CD2-CE1 3.69Å; H509-Y528 AromaticContact CD2-CE2 3.56Å; H509-Y528 AromaticContact CD2-CZ 3.38Å; H509-Y528 AromaticContact CE1-CE1 3.67Å; H509-Y528 AromaticContact CE1-CZ 3.98Å; H509-Y528 AromaticContact CG-CD1 3.67Å; H509-Y528 AromaticContact CG-CE1 3.64Å; H509-Y528 AromaticContact CG-CE2 3.98Å; H509-Y528 AromaticContact CG-CG 3.86Å; H509-Y528 AromaticContact CG-CZ 3.8Å; H509-Y528 AromaticContact ND1-CD1 3.77Å; H509-Y528 AromaticContact ND1-CE1 3.61Å; H509-Y528 AromaticContact NE2-CE1 3.71Å; H509-Y528 AromaticContact NE2-CZ 3.51Å; H509-Y528 PolarHBondContact NE2-OH 2.99Å; C524-Y528 WeakPolarHBondContact CB-O 3.06Å; Y525-Y528 PolarHBondContact O-N 2.89Å; S526-Y528 VanDerWaalsContact C-N 3.34Å; Y528-F535 CarbonylContact C-O 3.57Å; Y528-F535 WeakPolarHBondContact CA-O 2.93Å; Y528-N536 HydrophobicContact CD1-CB 4.32Å; Y528-N536 HydrophobicContact CE1-CB 3.95Å
529	V	63.9	Low	64.4	Low	69 Å²	69	75.7 Å²	75.7	42%	0.418	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	163.1	177.1	-62.6	0	0	0	0	109.8	F535 L537	V529-F535 HydrophobicContact CG2-CB 3.92Å; V529-F535 PolarHBondContact N-O 2.83Å; V529-F535 WeakPolarHBondContact O-CB 3.5Å; V529-F535 PolarHBondContact O-N 2.82Å; V529-L537 HydrophobicContact CG1-CD1 4.47Å; V529-L537 HydrophobicContact CG2-CD1 4.23Å
530	G	59.9	Low	64.3	Low	39 Å²	39	73.3 Å²	73.3	40%	0.402	40%	0.401	S	S	.	.	S	Bend	trans	111	164.2	179.8	0	0	0	0	0	113.2	C524 F532 C533	C524-G530 PolarHBondContact SG-O 3.41Å; C524-G530 VanDerWaalsContact SG-O 3.37Å; G530-F532 PolarHBondContact O-N 3.41Å; G530-C533 PolarHBondContact O-N 2.92Å; G530-C533 VanDerWaalsContact O-N 3.14Å
531	S	66.6	Low	63.6	Low	22 Å²	22	76.7 Å²	76.7	15%	0.154	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.7	-173.7	45.5	0	0	0	0	114.7	C522 K614	C522-S531 WeakPolarHBondContact CB-O 3.43Å; S531-K614 VanDerWaalsContact CB-CE 3.47Å; S531-K614 PolarHBondContact O-NZ 2.61Å
532	F	72.7	Confident	62.3	Low	77 Å²	77	79 Å²	79	34%	0.338	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	21.4	176.4	-56.6	-77.1	0	0	0	112	S505 C506 S507 I520 G530 N534	S505-F532 VanDerWaalsContact O-CD1 3.31Å; S505-F532 WeakPolarHBondContact O-CD1 3.25Å; C506-F532 CarbonylContact C-O 3.56Å; C506-F532 VanDerWaalsContact O-O 3.1Å; S507-F532 WeakPolarHBondContact CB-O 3.47Å; S507-F532 PolarHBondContact N-O 3.48Å; S507-F532 PolarHBondContact OG-O 2.77Å; I520-F532 HydrophobicContact CD1-CD1 4.23Å; I520-F532 HydrophobicContact CD1-CE1 3.84Å; I520-F532 HydrophobicContact CG1-CE1 4.03Å; G530-F532 PolarHBondContact O-N 3.41Å; F532-N534 PolarHBondContact O-N 3.35Å
533	C	72.7	Confident	61.3	Low	0 Å²	0	80.8 Å²	80.8	0%	0	45%	0.445	C	S	.	.	S	Bend	trans	56.9	36.4	177.4	-42.8	0	0	0	0	113.9	H509 C524 G530	H509-C533 HydrophobicContact CB-CB 3.8Å; H509-C533 WeakPolarHBondContact CB-O 3Å; H509-C533 PolarHBondContact ND1-O 3.02Å; H509-C533 WeakPolarHBondContact O-CB 3.41Å; C524-C533 WeakPolarHBondContact CA-SG 3.2Å; C524-C533 HydrophobicContact CB-CB 3.65Å; C524-C533 WeakPolarHBondContact CB-SG 3.38Å; C524-C533 WeakPolarHBondContact SG-CA 3.37Å; C524-C533 WeakPolarHBondContact SG-CB 3.3Å; C524-C533 CovalentContact SG-SG 2.03Å; C524-C533 PolarHBondContact SG-SG 3.42Å; G530-C533 PolarHBondContact O-N 2.92Å; G530-C533 VanDerWaalsContact O-N 3.14Å
534	N	71.2	Confident	60.2	Low	80 Å²	80	81.4 Å²	81.4	43%	0.428	45%	0.452	S	S	.	.			trans	-94.8	-13.6	-173.3	60.2	-30.8	0	0	0	114	F532	F532-N534 PolarHBondContact O-N 3.35Å
535	F	55.4	Low	59.4	Low	133 Å²	133	83.2 Å²	83.2	58%	0.583	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.8	-179.3	-74	-82.5	0	0	0	111.6	Y528 V529	Y528-F535 CarbonylContact C-O 3.57Å; Y528-F535 WeakPolarHBondContact CA-O 2.93Å; V529-F535 HydrophobicContact CG2-CB 3.92Å; V529-F535 PolarHBondContact N-O 2.83Å; V529-F535 WeakPolarHBondContact O-CB 3.5Å; V529-F535 PolarHBondContact O-N 2.82Å
536	N	58.2	Low	58.3	Low	59 Å²	59	82.3 Å²	82.3	32%	0.316	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120	170.3	-173.9	-40.3	0	0	0	109.4	Y528 Y538 V539	Y528-N536 HydrophobicContact CD1-CB 4.32Å; Y528-N536 HydrophobicContact CE1-CB 3.95Å; N536-Y538 PolarHBondContact O-N 3.27Å; N536-Y538 WeakPolarHBondContact OD1-CB 3.42Å; N536-Y538 PolarHBondContact OD1-N 2.03Å; N536-V539 HydrophobicContact CB-CG2 4.27Å; N536-V539 PolarHBondContact O-N 3.47Å
537	L	57.1	Low	57.5	Low	95 Å²	95	77.5 Å²	77.5	50%	0.497	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-61.4	-27	-173.4	-163.3	70.2	0	0	0	113.2	G527 V529 V539 A540	G527-L537 PolarHBondContact O-N 3.23Å; V529-L537 HydrophobicContact CG1-CD1 4.47Å; V529-L537 HydrophobicContact CG2-CD1 4.23Å; L537-V539 PolarHBondContact O-N 2.81Å; L537-A540 PolarHBondContact O-N 3.36Å
538	Y	50	Low	57.6	Low	179 Å²	179	78.5 Å²	78.5	70%	0.702	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-69.7	-30.8	-179.1	-89.2	-88	0	0	0	113.8	N536 A540 I541	N536-Y538 PolarHBondContact O-N 3.27Å; N536-Y538 WeakPolarHBondContact OD1-CB 3.42Å; N536-Y538 PolarHBondContact OD1-N 2.03Å; Y538-A540 PolarHBondContact O-N 2.74Å; Y538-I541 PolarHBondContact O-N 3.38Å
539	V	52.2	Low	57.8	Low	103 Å²	103	78.1 Å²	78.1	62%	0.624	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-68.8	-25	-178.4	-177.8	0	0	0	0	111.5	N536 L537 I541 P543	N536-V539 HydrophobicContact CB-CG2 4.27Å; N536-V539 PolarHBondContact O-N 3.47Å; L537-V539 PolarHBondContact O-N 2.81Å; V539-I541 VanDerWaalsContact C-N 3.31Å; V539-I541 PolarHBondContact O-N 2.6Å; V539-P543 WeakPolarHBondContact O-CD 3.18Å
540	A	54	Low	58	Low	67 Å²	67	77.9 Å²	77.9	55%	0.554	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-73.8	-20.8	176.9	0	0	0	0	0	113.4	L537 Y538	L537-A540 PolarHBondContact O-N 3.36Å; Y538-A540 PolarHBondContact O-N 2.74Å
541	I	49.5	Very low	58.1	Low	106 Å²	106	80.8 Å²	80.8	54%	0.544	45%	0.45	S	S	.	.	H	α-helix	trans	-86.4	-31.8	-172.1	-56	173.9	0	0	0	111.4	Y538 V539	Y538-I541 PolarHBondContact O-N 3.38Å; V539-I541 VanDerWaalsContact C-N 3.31Å; V539-I541 PolarHBondContact O-N 2.6Å
542	L	47.2	Very low	58.3	Low	122 Å²	122	85.1 Å²	85.1	64%	0.639	47%	0.47	S	S	*	.	H	α-helix	trans	-65.3	-43.8	-177.2	-85.9	155.6	0	0	0	115.5	V544 S545	L542-V544 VanDerWaalsContact C-N 3.31Å; L542-V544 PolarHBondContact O-N 3.32Å; L542-S545 PolarHBondContact O-N 3.34Å
543	P	48.4	Very low	58.4	Low	49 Å²	49	85.3 Å²	85.3	32%	0.318	48%	0.478	S	S	.	.	H	α-helix	trans	-66.3	-32.6	-178.5	-20.5	31.6	0	0	0	113.2	V539 S545 I546 C547	V539-P543 WeakPolarHBondContact O-CD 3.18Å; P543-S545 VanDerWaalsContact C-N 3.28Å; P543-S545 PolarHBondContact O-N 2.97Å; P543-I546 PolarHBondContact O-N 2.74Å; P543-C547 PolarHBondContact O-N 2.87Å; P543-C547 PolarHBondContact O-SG 2.72Å
544	V	51.5	Low	58.1	Low	102 Å²	102	87.8 Å²	87.8	62%	0.618	49%	0.492	S	S	*	.	H	α-helix	trans	-63.3	-37.5	-178.5	-176.9	0	0	0	0	110.9	L542 A548	L542-V544 VanDerWaalsContact C-N 3.31Å; L542-V544 PolarHBondContact O-N 3.32Å; V544-A548 PolarHBondContact O-N 3.4Å
545	S	54.7	Low	57.9	Low	88 Å²	88	89.9 Å²	89.9	62%	0.615	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-43	175.2	177	0	0	0	0	112.4	L542 P543 A548	L542-S545 PolarHBondContact O-N 3.34Å; P543-S545 VanDerWaalsContact C-N 3.28Å; P543-S545 PolarHBondContact O-N 2.97Å; S545-A548 PolarHBondContact O-N 2.88Å
546	I	48.4	Very low	58.7	Low	109 Å²	109	89.2 Å²	89.2	56%	0.559	50%	0.502	S	S	*	.	H	α-helix	trans	-71.5	-39.5	-177.4	-59.9	171.4	0	0	0	111.1	P543 A548 A549 V550	P543-I546 PolarHBondContact O-N 2.74Å; I546-A548 VanDerWaalsContact C-N 3.29Å; I546-A548 PolarHBondContact O-N 3.48Å; I546-A549 PolarHBondContact O-N 3.43Å; I546-V550 PolarHBondContact O-N 3.28Å
547	C	52.8	Low	58.8	Low	25 Å²	25	91.2 Å²	91.2	17%	0.169	51%	0.513	C	S	.	.	H	α-helix	trans	-60.9	-37.5	177.4	-68.4	0	0	0	0	112.8	P543 A549 V550 F551 M578 C579	P543-C547 PolarHBondContact O-N 2.87Å; P543-C547 PolarHBondContact O-SG 2.72Å; C547-A549 VanDerWaalsContact C-N 3.34Å; C547-A549 PolarHBondContact O-N 3.16Å; C547-V550 PolarHBondContact O-N 2.87Å; C547-F551 PolarHBondContact O-N 2.02Å; C547-M578 PolarHBondContact SG-O 3.03Å; C547-C579 WeakPolarHBondContact CA-SG 3.23Å; C547-C579 HydrophobicContact CB-CB 3.94Å; C547-C579 WeakPolarHBondContact CB-SG 3.17Å; C547-C579 VanDerWaalsContact SG-CA 3.59Å; C547-C579 WeakPolarHBondContact SG-CB 3.36Å; C547-C579 CovalentContact SG-SG 2.03Å; C547-C579 PolarHBondContact SG-SG 3.24Å
548	A	58.5	Low	58.8	Low	58 Å²	58	94.9 Å²	94.9	48%	0.479	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-40.1	178	0	0	0	0	0	111.9	V544 S545 I546 I552	V544-A548 PolarHBondContact O-N 3.4Å; S545-A548 PolarHBondContact O-N 2.88Å; I546-A548 VanDerWaalsContact C-N 3.29Å; I546-A548 PolarHBondContact O-N 3.48Å; A548-I552 WeakPolarHBondContact O-CG1 2.97Å
549	A	68.7	Low	59.2	Low	58 Å²	58	95.4 Å²	95.4	48%	0.479	53%	0.526	S	S	.	.	H	α-helix	trans	-66.6	-43	178.3	0	0	0	0	0	112.5	I546 C547 F551 I552 V553	I546-A549 PolarHBondContact O-N 3.43Å; C547-A549 VanDerWaalsContact C-N 3.34Å; C547-A549 PolarHBondContact O-N 3.16Å; A549-F551 VanDerWaalsContact C-N 3.33Å; A549-F551 PolarHBondContact O-N 3.48Å; A549-I552 PolarHBondContact O-N 3.38Å; A549-V553 PolarHBondContact O-N 3.05Å
550	V	67.6	Low	59.3	Low	65 Å²	65	101 Å²	101	39%	0.394	54%	0.536	S	S	.	.	H	α-helix	trans	-64	-38	-180	176.4	0	0	0	0	111.6	I546 C547 I552 V553 V554	I546-V550 PolarHBondContact O-N 3.28Å; C547-V550 PolarHBondContact O-N 2.87Å; V550-I552 VanDerWaalsContact C-N 3.31Å; V550-I552 PolarHBondContact O-N 3.06Å; V550-V553 PolarHBondContact O-N 3.11Å; V550-V554 HydrophobicContact CG1-CG2 4.43Å; V550-V554 WeakPolarHBondContact O-CG2 3.37Å; V550-V554 PolarHBondContact O-N 2.92Å; V550-V554 VanDerWaalsContact O-N 3.12Å
551	F	62.6	Low	58.9	Low	100 Å²	100	109.9 Å²	109.9	44%	0.439	56%	0.555	S	S	.	*	H	α-helix	trans	-60.3	-39.6	178.8	-122.7	-81.8	0	0	0	112.8	C547 A549 V553 V554 M555 V582	C547-F551 PolarHBondContact O-N 2.02Å; A549-F551 VanDerWaalsContact C-N 3.33Å; A549-F551 PolarHBondContact O-N 3.48Å; F551-V553 VanDerWaalsContact C-N 3.33Å; F551-V553 PolarHBondContact O-N 2.84Å; F551-V554 PolarHBondContact O-N 3.05Å; F551-M555 VanDerWaalsContact O-CG 3.3Å; F551-M555 WeakPolarHBondContact O-CG 3.32Å; F551-M555 PolarHBondContact O-N 2.98Å; F551-M555 VanDerWaalsContact O-N 3.16Å; F551-V582 HydrophobicContact CD2-CG2 4.27Å; F551-V582 HydrophobicContact CE2-CG2 3.27Å; F551-V582 HydrophobicContact CZ-CG2 3.54Å
552	I	71.2	Confident	58.4	Low	112 Å²	112	115.9 Å²	115.9	57%	0.574	57%	0.571	S	S	*	*	H	α-helix	trans	-63.6	-41.3	178.8	-64.3	170.7	0	0	0	110.3	A548 A549 V550 M555 I556	A548-I552 WeakPolarHBondContact O-CG1 2.97Å; A549-I552 PolarHBondContact O-N 3.38Å; V550-I552 VanDerWaalsContact C-N 3.31Å; V550-I552 PolarHBondContact O-N 3.06Å; I552-M555 PolarHBondContact O-N 2.64Å; I552-I556 HydrophobicContact CG2-CD1 4.22Å; I552-I556 WeakPolarHBondContact O-CG1 3.3Å; I552-I556 PolarHBondContact O-N 2.94Å
553	V	74.5	Confident	58.1	Low	82 Å²	82	115.5 Å²	115.5	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-66.1	-43.7	179.1	179.3	0	0	0	0	111.8	A549 V550 F551 M555 I556 L557	A549-V553 PolarHBondContact O-N 3.05Å; V550-V553 PolarHBondContact O-N 3.11Å; F551-V553 VanDerWaalsContact C-N 3.33Å; F551-V553 PolarHBondContact O-N 2.84Å; V553-M555 VanDerWaalsContact C-N 3.31Å; V553-M555 PolarHBondContact O-N 2.94Å; V553-I556 PolarHBondContact O-N 2.84Å; V553-L557 HydrophobicContact CG1-CD1 4.22Å; V553-L557 PolarHBondContact O-N 3.41Å
554	V	65.8	Low	57.9	Low	51 Å²	51	121.7 Å²	121.7	31%	0.309	59%	0.594	S	S	.	*	H	α-helix	trans	-62.4	-39.2	179	173.9	0	0	0	0	111.4	V550 F551 I556 L557 R558	V550-V554 HydrophobicContact CG1-CG2 4.43Å; V550-V554 WeakPolarHBondContact O-CG2 3.37Å; V550-V554 PolarHBondContact O-N 2.92Å; V550-V554 VanDerWaalsContact O-N 3.12Å; F551-V554 PolarHBondContact O-N 3.05Å; V554-I556 PolarHBondContact O-N 2.99Å; V554-L557 PolarHBondContact O-N 2.92Å; V554-R558 PolarHBondContact O-N 3.16Å
555	M	68.2	Low	57.5	Low	125 Å²	125	125.2 Å²	125.2	62%	0.616	60%	0.596	S	S	*	*	H	α-helix	trans	-65.1	-37.6	178.3	-71.2	-71.9	-93.1	0	0	112.4	F551 I552 V553	F551-M555 VanDerWaalsContact O-CG 3.3Å; F551-M555 WeakPolarHBondContact O-CG 3.32Å; F551-M555 PolarHBondContact O-N 2.98Å; F551-M555 VanDerWaalsContact O-N 3.16Å; I552-M555 PolarHBondContact O-N 2.64Å; V553-M555 VanDerWaalsContact C-N 3.31Å; V553-M555 PolarHBondContact O-N 2.94Å
556	I	71.1	Confident	57.1	Low	118 Å²	118	125.6 Å²	125.6	61%	0.605	59%	0.587	S	S	*	*	H	α-helix	trans	-64.6	-43.3	176.3	-66.4	165.8	0	0	0	110.7	I552 V553 V554 K559	I552-I556 HydrophobicContact CG2-CD1 4.22Å; I552-I556 WeakPolarHBondContact O-CG1 3.3Å; I552-I556 PolarHBondContact O-N 2.94Å; V553-I556 PolarHBondContact O-N 2.84Å; V554-I556 PolarHBondContact O-N 2.99Å; I556-K559 PolarHBondContact O-N 3.45Å
557	L	61.3	Low	57	Low	102 Å²	102	123.8 Å²	123.8	53%	0.534	58%	0.581	S	S	.	*	H	α-helix	trans	-71	-34.9	-177.9	-68	172.4	0	0	0	112.8	V553 V554 K559 R560	V553-L557 HydrophobicContact CG1-CD1 4.22Å; V553-L557 PolarHBondContact O-N 3.41Å; V554-L557 PolarHBondContact O-N 2.92Å; L557-K559 PolarHBondContact O-N 3.02Å; L557-K559 VanDerWaalsContact O-N 3.13Å; L557-R560 PolarHBondContact O-N 3.05Å
558	R	55.8	Low	56.5	Low	171 Å²	171	131.5 Å²	131.5	65%	0.645	61%	0.606	S	S	*	*	H	α-helix	trans	-60.9	-21.8	177.7	-112.4	-179	160.3	151.6	-2.8	113.9	V554 R560	V554-R558 PolarHBondContact O-N 3.16Å; R558-R560 VanDerWaalsContact C-N 3.33Å; R558-R560 PolarHBondContact O-N 2.99Å
559	K	58.4	Low	55.9	Low	191 Å²	191	132.7 Å²	132.7	83%	0.83	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-21.4	179.3	-153.5	172.8	-176.7	179.7	0	113.1	I556 L557	I556-K559 PolarHBondContact O-N 3.45Å; L557-K559 PolarHBondContact O-N 3.02Å; L557-K559 VanDerWaalsContact O-N 3.13Å
560	R	54.8	Low	54.6	Low	220 Å²	220	132.3 Å²	132.3	83%	0.83	59%	0.593	S	S	*	*	S	Bend	trans	-90.6	101.8	171.5	-85	-179.7	170.4	173.8	-2.4	109.3	L557 R558 R562	L557-R560 PolarHBondContact O-N 3.05Å; R558-R560 VanDerWaalsContact C-N 3.33Å; R558-R560 PolarHBondContact O-N 2.99Å; R560-R562 PolarHBondContact O-N 2.65Å
561	R	45.9	Very low	53.2	Low	253 Å²	253	135.7 Å²	135.7	96%	0.955	61%	0.605	S	S	*	*			trans	-61	26.3	-170.8	-90.5	-174	179.1	176.7	0.1	118
562	R	39	Very low	52.3	Low	233 Å²	233	141.9 Å²	141.9	88%	0.879	63%	0.625	S	S	*	*			trans	-124.1	102.9	171.8	-79.9	-177.5	176.9	173.7	-1.1	108.6	R560	R560-R562 PolarHBondContact O-N 2.65Å
563	M	40.3	Very low	51.1	Low	113 Å²	113	139.6 Å²	139.6	56%	0.557	62%	0.62	S	S	*	*			trans	155.2	93.8	141.7	-89.1	-169.1	177.4	0	0	110.7	W565 F566	M563-W565 HydrophobicContact CB-CB 4.37Å; M563-W565 HydrophobicContact CG-CB 4.09Å; M563-W565 PolarHBondContact O-N 2.04Å; M563-W565 HydrophobicContact SD-CB 4.41Å; M563-F566 HydrophobicContact CB-CB 3.9Å; M563-F566 HydrophobicContact CG-CB 4.46Å; M563-F566 HydrophobicContact SD-CB 3.71Å; M563-F566 HydrophobicContact SD-CD2 3.7Å; M563-F566 HydrophobicContact SD-CG 4.15Å
564	M	44.7	Very low	49.4	Very low	180 Å²	180	138 Å²	138	89%	0.887	62%	0.619	S	S	*	*	H	α-helix	trans	-60.7	-16.8	146	-85.1	-171.9	-83.5	0	0	111.4
565	W	43.7	Very low	48.1	Very low	176 Å²	176	141.2 Å²	141.2	67%	0.667	63%	0.634	S	S	*	*	H	α-helix	trans	-75.5	-31.1	-177.1	-144.3	77.4	0	0	0	114.2	M563 L569	M563-W565 HydrophobicContact CB-CB 4.37Å; M563-W565 HydrophobicContact CG-CB 4.09Å; M563-W565 PolarHBondContact O-N 2.04Å; M563-W565 HydrophobicContact SD-CB 4.41Å; W565-L569 HydrophobicContact CD2-CD1 4.45Å; W565-L569 HydrophobicContact CE3-CD1 3.73Å; W565-L569 HydrophobicContact CH2-CD1 3.89Å; W565-L569 HydrophobicContact CZ3-CD1 3.42Å; W565-L569 VanDerWaalsContact CZ3-CD1 3.42Å; W565-L569 PolarHBondContact O-N 3.23Å
566	F	45.3	Very low	46.3	Very low	96 Å²	96	139.2 Å²	139.2	42%	0.421	62%	0.622	S	S	.	*	H	α-helix	trans	-79.8	-31.3	-178.4	-144.4	-98.3	0	0	0	112.4	M563 R568 L569 I570	M563-F566 HydrophobicContact CB-CB 3.9Å; M563-F566 HydrophobicContact CG-CB 4.46Å; M563-F566 HydrophobicContact SD-CB 3.71Å; M563-F566 HydrophobicContact SD-CD2 3.7Å; M563-F566 HydrophobicContact SD-CG 4.15Å; F566-R568 PolarHBondContact O-N 3.38Å; F566-L569 PolarHBondContact O-N 3.42Å; F566-L569 VanDerWaalsContact O-N 3.08Å; F566-I570 HydrophobicContact CD1-CD1 3.65Å; F566-I570 HydrophobicContact CD1-CG1 3.91Å; F566-I570 HydrophobicContact CE1-CD1 3.76Å; F566-I570 HydrophobicContact CE1-CG1 3.94Å; F566-I570 PolarHBondContact O-N 3.18Å
567	V	46.7	Very low	44.7	Very low	71 Å²	71	143.3 Å²	143.3	43%	0.43	64%	0.636	S	S	.	*	H	α-helix	trans	-59.7	-41	173.1	-179.7	0	0	0	0	110	L569 I570 E571	V567-L569 VanDerWaalsContact C-N 3.34Å; V567-L569 PolarHBondContact O-N 3.5Å; V567-I570 PolarHBondContact O-N 3.15Å; V567-E571 PolarHBondContact O-N 3.19Å; V567-E571 VanDerWaalsContact O-N 3.08Å
568	R	43.1	Very low	43.4	Very low	186 Å²	186	145.5 Å²	145.5	70%	0.702	65%	0.645	S	S	*	*	H	α-helix	trans	-68.5	-28.2	174.7	-75.3	-173.8	175	176.3	-0.5	114	F566 R572	F566-R568 PolarHBondContact O-N 3.38Å; R568-R572 PolarHBondContact O-N 3.26Å
569	L	44.2	Very low	42	Very low	83 Å²	83	138.5 Å²	138.5	44%	0.435	62%	0.622	S	S	.	*	H	α-helix	trans	-75.5	-38.3	176	-119.6	95.6	0	0	0	112.1	W565 F566 V567 R572 S573	W565-L569 HydrophobicContact CD2-CD1 4.45Å; W565-L569 HydrophobicContact CE3-CD1 3.73Å; W565-L569 HydrophobicContact CH2-CD1 3.89Å; W565-L569 HydrophobicContact CZ3-CD1 3.42Å; W565-L569 VanDerWaalsContact CZ3-CD1 3.42Å; W565-L569 PolarHBondContact O-N 3.23Å; F566-L569 PolarHBondContact O-N 3.42Å; F566-L569 VanDerWaalsContact O-N 3.08Å; V567-L569 VanDerWaalsContact C-N 3.34Å; V567-L569 PolarHBondContact O-N 3.5Å; L569-R572 PolarHBondContact O-N 3.49Å; L569-S573 PolarHBondContact O-N 2.78Å
570	I	42.2	Very low	40.7	Very low	50 Å²	50	135 Å²	135	26%	0.256	62%	0.619	S	S	.	*	H	α-helix	trans	-70	-37.4	177.5	-64.3	176.7	0	0	0	110.7	F566 V567 R572 S573 F576	F566-I570 HydrophobicContact CD1-CD1 3.65Å; F566-I570 HydrophobicContact CD1-CG1 3.91Å; F566-I570 HydrophobicContact CE1-CD1 3.76Å; F566-I570 HydrophobicContact CE1-CG1 3.94Å; F566-I570 PolarHBondContact O-N 3.18Å; V567-I570 PolarHBondContact O-N 3.15Å; I570-R572 PolarHBondContact O-N 3.01Å; I570-S573 PolarHBondContact O-N 2.96Å; I570-S573 VanDerWaalsContact O-N 3.15Å; I570-S573 PolarHBondContact O-OG 3.18Å; I570-F576 HydrophobicContact CG2-CD2 4.1Å; I570-F576 HydrophobicContact CG2-CE2 3.92Å
571	E	39.1	Very low	39.6	Very low	136 Å²	136	133.3 Å²	133.3	64%	0.636	62%	0.618	S	S	*	*	H	α-helix	trans	-57.2	-30.7	171.2	-82.8	179.6	157.1	0	0	112.9	V567	V567-E571 PolarHBondContact O-N 3.19Å; V567-E571 VanDerWaalsContact O-N 3.08Å
572	R	44.1	Very low	38.6	Very low	230 Å²	230	123.4 Å²	123.4	87%	0.868	59%	0.585	S	S	*	*	H	α-helix	trans	-82.6	-26	177.5	-110.2	178.1	179.3	177.9	-0.6	114.5	R568 L569 I570 G574	R568-R572 PolarHBondContact O-N 3.26Å; L569-R572 PolarHBondContact O-N 3.49Å; I570-R572 PolarHBondContact O-N 3.01Å; R572-G574 VanDerWaalsContact C-N 3.28Å; R572-G574 PolarHBondContact O-N 3.18Å
573	S	44.2	Very low	37.8	Very low	65 Å²	65	117.9 Å²	117.9	46%	0.455	57%	0.572	S	S	.	*	S	Bend	trans	-80.5	2.8	-174.9	61.3	0	0	0	0	115.6	L569 I570 L575	L569-S573 PolarHBondContact O-N 2.78Å; I570-S573 PolarHBondContact O-N 2.96Å; I570-S573 VanDerWaalsContact O-N 3.15Å; I570-S573 PolarHBondContact O-OG 3.18Å; S573-L575 PolarHBondContact O-N 3.09Å
574	G	39.6	Very low	37.1	Very low	47 Å²	47	117.6 Å²	117.6	49%	0.485	58%	0.577	S	S	.	*			trans	66.7	-2.8	169.9	0	0	0	0	0	116.3	R572 F576 K577	R572-G574 VanDerWaalsContact C-N 3.28Å; R572-G574 PolarHBondContact O-N 3.18Å; G574-F576 PolarHBondContact O-N 2.79Å; G574-F576 VanDerWaalsContact O-N 3.07Å; G574-K577 PolarHBondContact O-N 3.32Å; G574-K577 VanDerWaalsContact O-N 3.17Å
575	L	38.8	Very low	36.1	Very low	120 Å²	120	116.1 Å²	116.1	63%	0.628	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-62.2	-15.9	176.8	-96.4	107.5	0	0	0	113.3	S573 K577	S573-L575 PolarHBondContact O-N 3.09Å; L575-K577 VanDerWaalsContact C-N 3.32Å; L575-K577 PolarHBondContact O-N 3.48Å
576	F	30.7	Very low	35.3	Very low	83 Å²	83	114.4 Å²	114.4	36%	0.364	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-73.2	-15.8	175.8	-99.7	-61.8	0	0	0	115.5	I570 G574 M578 C579 V582	I570-F576 HydrophobicContact CG2-CD2 4.1Å; I570-F576 HydrophobicContact CG2-CE2 3.92Å; G574-F576 PolarHBondContact O-N 2.79Å; G574-F576 VanDerWaalsContact O-N 3.07Å; F576-M578 PolarHBondContact O-N 2.95Å; F576-M578 VanDerWaalsContact O-N 3.09Å; F576-C579 PolarHBondContact O-N 3.02Å; F576-V582 HydrophobicContact CD1-CB 3.99Å; F576-V582 HydrophobicContact CD1-CG2 4.42Å; F576-V582 HydrophobicContact CE1-CB 3.15Å; F576-V582 HydrophobicContact CE1-CG1 3.71Å; F576-V582 HydrophobicContact CE1-CG2 3.29Å; F576-V582 HydrophobicContact CE2-CG1 4.31Å; F576-V582 HydrophobicContact CZ-CB 3.5Å; F576-V582 HydrophobicContact CZ-CG1 3.47Å; F576-V582 VanDerWaalsContact CZ-CG1 3.47Å; F576-V582 HydrophobicContact CZ-CG2 3.64Å
577	K	37.1	Very low	34.3	Very low	204 Å²	204	113.5 Å²	113.5	89%	0.887	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-68.5	-6.1	175.8	-78.5	-171.9	176.5	-179.8	0	114	G574 L575	G574-K577 PolarHBondContact O-N 3.32Å; G574-K577 VanDerWaalsContact O-N 3.17Å; L575-K577 VanDerWaalsContact C-N 3.32Å; L575-K577 PolarHBondContact O-N 3.48Å
578	M	34	Very low	33.3	Very low	148 Å²	148	113.4 Å²	113.4	73%	0.729	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-108.5	-3.3	175.6	-80.4	-177	149.4	0	0	115.4	C547 F576	C547-M578 PolarHBondContact SG-O 3.03Å; F576-M578 PolarHBondContact O-N 2.95Å; F576-M578 VanDerWaalsContact O-N 3.09Å
579	C	27.2	Very low	32.6	Very low	24 Å²	24	112.3 Å²	112.3	16%	0.162	62%	0.615	C	S	.	*			trans	-140.2	83	179.6	-56.1	0	0	0	0	111.6	C547 F576 F581	C547-C579 WeakPolarHBondContact CA-SG 3.23Å; C547-C579 HydrophobicContact CB-CB 3.94Å; C547-C579 WeakPolarHBondContact CB-SG 3.17Å; C547-C579 VanDerWaalsContact SG-CA 3.59Å; C547-C579 WeakPolarHBondContact SG-CB 3.36Å; C547-C579 CovalentContact SG-SG 2.03Å; C547-C579 PolarHBondContact SG-SG 3.24Å; F576-C579 PolarHBondContact O-N 3.02Å; C579-F581 PolarHBondContact O-N 2.83Å
580	P	30.5	Very low	32	Very low	118 Å²	118	112.4 Å²	112.4	77%	0.766	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	19.1	-169.8	32.2	-35.5	0	0	0	115.3
581	F	31	Very low	31.3	Very low	183 Å²	183	113.9 Å²	113.9	80%	0.803	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	18.1	177.4	-76.8	-74.1	0	0	0	114.5	C579	C579-F581 PolarHBondContact O-N 2.83Å
582	V	24.8	Very low	31.2	Very low	46 Å²	46	112.2 Å²	112.2	28%	0.279	63%	0.634	S	S	.	*	S	Bend	trans	-117.7	116.5	176.7	-177	0	0	0	0	110.8	F551 F576	F551-V582 HydrophobicContact CD2-CG2 4.27Å; F551-V582 HydrophobicContact CE2-CG2 3.27Å; F551-V582 HydrophobicContact CZ-CG2 3.54Å; F576-V582 HydrophobicContact CD1-CB 3.99Å; F576-V582 HydrophobicContact CD1-CG2 4.42Å; F576-V582 HydrophobicContact CE1-CB 3.15Å; F576-V582 HydrophobicContact CE1-CG1 3.71Å; F576-V582 HydrophobicContact CE1-CG2 3.29Å; F576-V582 HydrophobicContact CE2-CG1 4.31Å; F576-V582 HydrophobicContact CZ-CB 3.5Å; F576-V582 HydrophobicContact CZ-CG1 3.47Å; F576-V582 VanDerWaalsContact CZ-CG1 3.47Å; F576-V582 HydrophobicContact CZ-CG2 3.64Å
583	L	23.5	Very low	30.8	Very low	116 Å²	116	103.6 Å²	103.6	61%	0.607	61%	0.609	S	S	*	*			trans	70.2	78	163.1	-62.6	164.2	0	0	0	115.4	D585	L583-D585 PolarHBondContact O-N 2.96Å
584	V	25.2	Very low	30.4	Very low	108 Å²	108	104.1 Å²	104.1	66%	0.655	61%	0.606	S	S	*	*			trans	-58.2	96.6	136.5	176.7	0	0	0	0	106.3	L586	V584-L586 PolarHBondContact O-N 2.7Å
585	D	24.2	Very low	30.1	Very low	149 Å²	149	107.8 Å²	107.8	80%	0.797	61%	0.611	S	S	*	*			trans	-73.9	121.7	168.1	-156.1	-2.5	0	0	0	108.2	L583 G587	L583-D585 PolarHBondContact O-N 2.96Å; D585-G587 PolarHBondContact O-N 2.85Å; D585-G587 VanDerWaalsContact O-N 3.08Å
586	L	26.2	Very low	29.8	Very low	139 Å²	139	108.6 Å²	108.6	73%	0.728	61%	0.613	S	S	*	*			trans	-83.2	80.9	-170	-76.7	157.3	0	0	0	108.8	V584	V584-L586 PolarHBondContact O-N 2.7Å
587	G	24	Very low	30	Very low	77 Å²	77	109.8 Å²	109.8	79%	0.794	62%	0.623	S	S	*	*			trans	-110	86.9	171.9	0	0	0	0	0	112.1	D585	D585-G587 PolarHBondContact O-N 2.85Å; D585-G587 VanDerWaalsContact O-N 3.08Å
588	G	26.4	Very low	30.1	Very low	69 Å²	69	103.4 Å²	103.4	71%	0.711	60%	0.598	S	S	*	*	S	Bend	trans	88.3	107.3	159.9	0	0	0	0	0	116.6
589	N	28.2	Very low	30.3	Very low	163 Å²	163	98.9 Å²	98.9	87%	0.872	58%	0.584	S	S	*	*			trans	69.5	74.1	167.3	-60.6	-7.7	0	0	0	115.7	L591	N589-L591 PolarHBondContact O-N 3.44Å
590	S	30.6	Very low	30.7	Very low	85 Å²	85	103.2 Å²	103.2	59%	0.594	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	92.2	179.7	60.3	0	0	0	0	113.8
591	L	29	Very low	31	Very low	82 Å²	82	103 Å²	103	43%	0.429	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-154.2	-13.9	160.4	-101.4	126.5	0	0	0	115.2	L3 L7 N589	L3-L591 HydrophobicContact CD2-CD1 3.73Å; L3-L591 HydrophobicContact CD2-CD2 4.04Å; L3-L591 HydrophobicContact CD2-CG 3.86Å; L7-L591 HydrophobicContact CD1-CD2 4.26Å; N589-L591 PolarHBondContact O-N 3.44Å
592	S	36.2	Very low	31.2	Very low	100 Å²	100	100 Å²	100	70%	0.699	58%	0.58	S	S	*	*	H	α-helix	trans	-77	-24.5	-178.1	60.1	0	0	0	0	114.6
593	S	35	Very low	31.6	Very low	50 Å²	50	102.6 Å²	102.6	35%	0.35	59%	0.592	S	S	.	*	H	α-helix	trans	-76.3	-26.8	-179.2	42.6	0	0	0	0	113.8	M596 L597	S593-M596 PolarHBondContact O-N 3Å; S593-L597 PolarHBondContact O-N 2.9Å
594	L	35.7	Very low	32	Very low	76 Å²	76	106.4 Å²	106.4	40%	0.398	60%	0.6	S	S	.	*	H	α-helix	trans	-73.1	-32.9	177.9	-157.3	73.8	0	0	0	111.9	L7 M596 L598	L7-L594 HydrophobicContact CD2-CD2 3.96Å; L594-M596 VanDerWaalsContact C-N 3.35Å; L594-L598 HydrophobicContact CG-CD1 4.33Å; L594-L598 PolarHBondContact O-N 3.29Å
595	H	33.4	Very low	32.6	Very low	123 Å²	123	109.2 Å²	109.2	57%	0.569	60%	0.603	S	S	*	*	H	α-helix	trans	-69.4	-30.2	174.4	-85.1	-91.6	0	0	0	112.9	A599	H595-A599 WeakPolarHBondContact O-CB 3.35Å; H595-A599 PolarHBondContact O-N 3.48Å
596	M	33.3	Very low	33.2	Very low	137 Å²	137	108 Å²	108	68%	0.675	60%	0.597	S	S	*	*	H	α-helix	trans	-70.6	-40.6	176.2	-125	-146.2	-73.4	0	0	112.3	S593 L594 L600	S593-M596 PolarHBondContact O-N 3Å; L594-M596 VanDerWaalsContact C-N 3.35Å; M596-L600 WeakPolarHBondContact O-CG 2.95Å; M596-L600 PolarHBondContact O-N 3.22Å
597	L	34.9	Very low	33.4	Very low	109 Å²	109	110 Å²	110	57%	0.571	60%	0.6	S	S	*	*	H	α-helix	trans	-71.3	-41.5	-179.9	-93.8	150.1	0	0	0	112.6	S593 A599 L600 E601	S593-L597 PolarHBondContact O-N 2.9Å; L597-A599 PolarHBondContact O-N 3.15Å; L597-L600 PolarHBondContact O-N 2.84Å; L597-E601 PolarHBondContact O-N 3.37Å
598	L	38.1	Very low	33.8	Very low	69 Å²	69	117.4 Å²	117.4	36%	0.361	60%	0.603	S	S	.	*	H	α-helix	trans	-69.1	-32.6	177.7	-73.8	166.5	0	0	0	112.5	L7 I11 L594 K602	L7-L598 HydrophobicContact CD2-CD1 4.06Å; I11-L598 HydrophobicContact CD1-CD1 4.09Å; L594-L598 HydrophobicContact CG-CD1 4.33Å; L594-L598 PolarHBondContact O-N 3.29Å; L598-K602 WeakPolarHBondContact O-CB 3.45Å; L598-K602 PolarHBondContact O-N 3.18Å; L598-K602 VanDerWaalsContact O-N 3.14Å
599	A	38.3	Very low	34	Very low	54 Å²	54	122.4 Å²	122.4	45%	0.446	61%	0.608	S	S	.	*	H	α-helix	trans	-65.2	-40.9	173.2	0	0	0	0	0	111.8	H595 L597 L603	H595-A599 WeakPolarHBondContact O-CB 3.35Å; H595-A599 PolarHBondContact O-N 3.48Å; L597-A599 PolarHBondContact O-N 3.15Å; A599-L603 WeakPolarHBondContact O-CB 3.45Å; A599-L603 WeakPolarHBondContact O-CD1 3.47Å; A599-L603 WeakPolarHBondContact O-CG 3.41Å; A599-L603 PolarHBondContact O-N 3.47Å
600	L	36.1	Very low	34.1	Very low	114 Å²	114	121 Å²	121	60%	0.597	61%	0.606	S	S	*	*	H	α-helix	trans	-71.4	-38.9	178.1	-75.4	166.1	0	0	0	112.7	M596 L597 L603 Y604	M596-L600 WeakPolarHBondContact O-CG 2.95Å; M596-L600 PolarHBondContact O-N 3.22Å; L597-L600 PolarHBondContact O-N 2.84Å; L600-L603 PolarHBondContact O-N 3.38Å; L600-Y604 PolarHBondContact O-N 3.34Å; L600-Y604 VanDerWaalsContact O-N 3.11Å
601	E	36.1	Very low	34.1	Very low	115 Å²	115	123.3 Å²	123.3	54%	0.537	61%	0.612	S	S	.	*	H	α-helix	trans	-71.4	-35.1	-178.8	-157.7	178.9	179.1	0	0	112.1	L597 Y604 K605	L597-E601 PolarHBondContact O-N 3.37Å; E601-Y604 PolarHBondContact O-N 2.94Å; E601-K605 PolarHBondContact O-N 2.93Å
602	K	35.7	Very low	34.3	Very low	119 Å²	119	124.3 Å²	124.3	52%	0.517	63%	0.626	S	S	.	*	H	α-helix	trans	-71.2	-35.2	174.9	-152.1	172.8	-173.8	-177.5	0	112.2	L598 Y604	L598-K602 WeakPolarHBondContact O-CB 3.45Å; L598-K602 PolarHBondContact O-N 3.18Å; L598-K602 VanDerWaalsContact O-N 3.14Å; K602-Y604 VanDerWaalsContact C-N 3.3Å; K602-Y604 PolarHBondContact O-N 3.27Å
603	L	32.9	Very low	34.1	Very low	100 Å²	100	124.3 Å²	124.3	52%	0.524	62%	0.621	S	S	.	*	H	α-helix	trans	-69.2	-25.3	173.7	-81.6	164.6	0	0	0	113.5	A599 L600	A599-L603 WeakPolarHBondContact O-CB 3.45Å; A599-L603 WeakPolarHBondContact O-CD1 3.47Å; A599-L603 WeakPolarHBondContact O-CG 3.41Å; A599-L603 PolarHBondContact O-N 3.47Å; L600-L603 PolarHBondContact O-N 3.38Å
604	Y	33.1	Very low	34	Very low	196 Å²	196	127 Å²	127	77%	0.769	63%	0.626	S	S	*	*	H	α-helix	trans	-81	-28.2	179	-135.9	-85.9	0	0	0	113.1	L600 E601 K602	L600-Y604 PolarHBondContact O-N 3.34Å; L600-Y604 VanDerWaalsContact O-N 3.11Å; E601-Y604 PolarHBondContact O-N 2.94Å; K602-Y604 VanDerWaalsContact C-N 3.3Å; K602-Y604 PolarHBondContact O-N 3.27Å
605	K	37.9	Very low	33.8	Very low	168 Å²	168	130.8 Å²	130.8	73%	0.73	64%	0.64	S	S	*	*	H	α-helix	trans	-82.4	-32.2	-179.7	-84	-178.9	176.5	170.6	0	114.3	E601 K607	E601-K605 PolarHBondContact O-N 2.93Å; K605-K607 PolarHBondContact O-N 3.13Å
606	D	35.9	Very low	33.6	Very low	124 Å²	124	130.1 Å²	130.1	66%	0.663	64%	0.636	S	S	*	*	S	Bend	trans	-92.6	15	-177.4	-97	-1.2	0	0	0	114.8	R608	D606-R608 PolarHBondContact O-N 2.76Å
607	K	31.4	Very low	33.3	Very low	181 Å²	181	129 Å²	129	79%	0.787	64%	0.636	S	S	*	*			trans	-78.2	3.4	178.5	-118.5	-178.5	-176.2	-179.7	0	115.1	K605	K605-K607 PolarHBondContact O-N 3.13Å
608	R	31.8	Very low	33	Very low	231 Å²	231	130.5 Å²	130.5	87%	0.872	64%	0.639	S	S	*	*	S	Bend	trans	-93.9	105.6	161	-71.4	-171.6	-167.2	-168.6	4.3	106.5	D606	D606-R608 PolarHBondContact O-N 2.76Å
609	E	30.7	Very low	32.6	Very low	174 Å²	174	131 Å²	131	81%	0.813	65%	0.648	S	S	*	*	S	Bend	trans	83	79.6	174	-53.8	178.7	171.2	0	0	115.9
610	T	29.4	Very low	32.3	Very low	133 Å²	133	136.7 Å²	136.7	82%	0.816	67%	0.665	S	S	*	*				168.1	138.3	121.9	43	0	0	0	0	111.3
611	D	31.4	Very low	32.1	Very low	135 Å²	135	134 Å²	134	72%	0.722	66%	0.657	S	S	*	*			trans	-112.5	44.2	-146.9	-154.8	25.3	0	0	0	111.8	K521	K521-D611 IonicContact NZ-OD2 2.65Å
612	S	33.7	Very low	32.5	Very low	103 Å²	103	139.4 Å²	139.4	72%	0.72	68%	0.678	S	S	*	*			trans	-146.3	31.9	-166	54	0	0	0	0	118.1
613	V	31.4	Very low	32.7	Very low	99 Å²	99	139 Å²	139	60%	0.6	69%	0.69	S	S	*	*			trans	-127	102.4	166.8	-172.8	0	0	0	0	110	F616	V613-F616 HydrophobicContact CG1-CE1 4.27Å; V613-F616 HydrophobicContact CG1-CE2 4.25Å; V613-F616 HydrophobicContact CG1-CZ 3.79Å
614	K	33.1	Very low	32.8	Very low	107 Å²	107	135.6 Å²	135.6	47%	0.465	68%	0.68	S	S	.	*			trans	-101.8	-25.6	-172.7	-82	-174.5	174.1	-173	0	116	S531	S531-K614 VanDerWaalsContact CB-CE 3.47Å; S531-K614 PolarHBondContact O-NZ 2.61Å
615	F	30.3	Very low	32.9	Very low	156 Å²	156	130.5 Å²	130.5	68%	0.684	67%	0.669	S	S	*	*			trans	-153.9	150.5	178.6	-68	-77.6	0	0	0	113.2
616	F	29.1	Very low	32.5	Very low	109 Å²	109	130.9 Å²	130.9	48%	0.478	67%	0.666	S	S	.	*			trans	-118.7	125.2	173.7	-59.8	-90.2	0	0	0	108.5	V613 F618	V613-F616 HydrophobicContact CG1-CE1 4.27Å; V613-F616 HydrophobicContact CG1-CE2 4.25Å; V613-F616 HydrophobicContact CG1-CZ 3.79Å; F616-F618 HydrophobicContact CB-CE2 3.91Å; F616-F618 HydrophobicContact CB-CZ 4.42Å
617	T	28	Very low	32.4	Very low	113 Å²	113	129.8 Å²	129.8	69%	0.693	66%	0.659	S	S	*	*			trans	-117.2	121.8	170.4	-33.4	0	0	0	0	108.1
618	F	28.4	Very low	32.4	Very low	140 Å²	140	126.5 Å²	126.5	61%	0.614	65%	0.654	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.2	117.4	179	-66.2	-91.7	0	0	0	108.6	F616 T625 I627	F616-F618 HydrophobicContact CB-CE2 3.91Å; F616-F618 HydrophobicContact CB-CZ 4.42Å; F618-T625 HydrophobicContact CD1-CG2 4.41Å; F618-I627 HydrophobicContact CD1-CG1 4.4Å; F618-I627 HydrophobicContact CE1-CD1 4.24Å; F618-I627 HydrophobicContact CE1-CG1 4.13Å
619	S	29.2	Very low	32.2	Very low	81 Å²	81	121.8 Å²	121.8	57%	0.566	65%	0.646	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.7	127.5	170.3	175.7	0	0	0	0	109.3	W626	S619-W626 PolarHBondContact O-N 3.07Å
620	Q	32.8	Very low	32.2	Very low	172 Å²	172	122.8 Å²	122.8	80%	0.804	65%	0.65	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.9	114.8	-175.4	-145.2	176.6	27.7	0	0	108.8
621	S	32.1	Very low	32.2	Very low	59 Å²	59	119.9 Å²	119.9	41%	0.413	65%	0.647	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.1	153.2	168.2	165.7	0	0	0	0	109.3	S623 G624	S621-S623 PolarHBondContact O-N 2.87Å; S621-S623 PolarHBondContact OG-OG 3.13Å; S621-G624 PolarHBondContact N-O 3.02Å; S621-G624 PolarHBondContact O-N 3.17Å
622	K	45.1	Very low	32.3	Very low	228 Å²	228	121.5 Å²	121.5	99%	0.991	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-12.7	178.3	-81.6	-174.2	176	179.8	0	114.2
623	S	39.3	Very low	32.2	Very low	109 Å²	109	122.5 Å²	122.5	76%	0.762	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	2.9	175.4	56.8	0	0	0	0	115	S621	S621-S623 PolarHBondContact O-N 2.87Å; S621-S623 PolarHBondContact OG-OG 3.13Å
624	G	35.1	Very low	32.3	Very low	30 Å²	30	123.7 Å²	123.7	31%	0.309	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	156.4	157.7	177.9	0	0	0	0	0	114.4	S621	S621-G624 PolarHBondContact N-O 3.02Å; S621-G624 PolarHBondContact O-N 3.17Å
625	T	34.7	Very low	32.2	Very low	88 Å²	88	124.6 Å²	124.6	54%	0.54	68%	0.681	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.3	119.9	174	-44.1	0	0	0	0	107.6	F618	F618-T625 HydrophobicContact CD1-CG2 4.41Å
626	W	30.9	Very low	32.3	Very low	176 Å²	176	122.8 Å²	122.8	67%	0.667	68%	0.681	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.7	132.7	178.8	-61.1	83.9	0	0	0	109.2	S619	S619-W626 PolarHBondContact O-N 3.07Å
627	I	32	Very low	32.5	Very low	102 Å²	102	123.6 Å²	123.6	52%	0.523	69%	0.693	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.6	103.1	169.9	-59.9	170.6	0	0	0	105.8	F618 L629	F618-I627 HydrophobicContact CD1-CG1 4.4Å; F618-I627 HydrophobicContact CE1-CD1 4.24Å; F618-I627 HydrophobicContact CE1-CG1 4.13Å; I627-L629 HydrophobicContact CG2-CD2 4.48Å; I627-L629 HydrophobicContact CG2-CG 4.4Å
628	T	31.4	Very low	32.8	Very low	111 Å²	111	124.3 Å²	124.3	68%	0.681	69%	0.693	S	S	*	*			trans	-84.9	114.7	173	7.7	0	0	0	0	109.1
629	L	28.4	Very low	33.2	Very low	133 Å²	133	123.2 Å²	123.2	70%	0.696	70%	0.699	S	S	*	*			trans	-92.9	94.5	173	-67	162.7	0	0	0	107.8	I627 G631	I627-L629 HydrophobicContact CG2-CD2 4.48Å; I627-L629 HydrophobicContact CG2-CG 4.4Å; L629-G631 PolarHBondContact O-N 3.32Å
630	E	30.3	Very low	33.5	Very low	195 Å²	195	126.5 Å²	126.5	91%	0.911	71%	0.709	S	S	*	*			trans	-82.8	98.5	170.6	-80.1	-171.9	168	0	0	109.9
631	G	29.7	Very low	33.5	Very low	72 Å²	72	122.7 Å²	122.7	74%	0.742	70%	0.701	S	S	*	*			trans	-95.2	139	163.6	0	0	0	0	0	109.9	L629	L629-G631 PolarHBondContact O-N 3.32Å
632	S	33.4	Very low	33.6	Very low	169 Å²	169	128.5 Å²	128.5	100%	1.182	73%	0.728	S	S	*	*			trans	-88.5	0	162.2	54.9	0	0	0	0	110.1

Retrieved 632 of 632 residues in 497.2 ms (Link to these results)

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