A0A096MA78_POEFO Loading...

Fibronectin type III domain containing 4b

AlphaFold DB , UniProt , Accession A0A096MA78, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 218 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	38.2	Very low	52.8	Low	252 Å²	252	121.2 Å²	121.2	100%	1.241	70%	0.703	S	S	*	*				0	95.9	0	-79	159.3	164.5	0	0	107.4
2	A	36.9	Very low	53.4	Low	99 Å²	99	119.9 Å²	119.9	82%	0.818	69%	0.691	S	S	*	*			trans	-105.7	111	175.5	0	0	0	0	0	107.2	S4	A2-S4 PolarHBondContact O-N 3.27Å
3	A	39.8	Very low	53.9	Low	83 Å²	83	120.5 Å²	120.5	69%	0.686	69%	0.689	S	S	*	*			trans	-80.3	105.1	177.6	0	0	0	0	0	108.6	H5	A3-H5 PolarHBondContact O-N 3.3Å
4	S	41.9	Very low	54.3	Low	118 Å²	118	119.9 Å²	119.9	83%	0.825	68%	0.681	S	S	*	*			trans	-75.2	105.9	168.9	-62.3	0	0	0	0	108.4	A2 H6	A2-S4 PolarHBondContact O-N 3.27Å; S4-H6 PolarHBondContact O-N 3.22Å
5	H	49.9	Very low	54.5	Low	169 Å²	169	119.3 Å²	119.3	78%	0.782	68%	0.675	S	S	*	*			trans	-71.8	99.6	172.1	-71.5	-87.3	0	0	0	109	A3 L7	A3-H5 PolarHBondContact O-N 3.3Å; H5-L7 PolarHBondContact O-N 3.09Å
6	H	58.2	Low	54.7	Low	165 Å²	165	116.9 Å²	116.9	76%	0.764	66%	0.659	S	S	*	*			trans	-69.2	96.3	171.9	-174	-87.2	0	0	0	108.6	S4 D8	S4-H6 PolarHBondContact O-N 3.22Å; H6-D8 PolarHBondContact O-N 2.78Å
7	L	59.4	Low	54.7	Low	145 Å²	145	113.1 Å²	113.1	76%	0.759	65%	0.646	S	S	*	*			trans	-66.3	115.2	172.3	-78.4	150.6	0	0	0	108.4	H5	H5-L7 PolarHBondContact O-N 3.09Å
8	D	68.2	Low	54.5	Low	92 Å²	92	112.6 Å²	112.6	49%	0.492	65%	0.649	S	S	.	*			trans	-60.4	125.4	-177.8	-179.1	-99.9	0	0	0	111.2	H6 G10 L11 L12	H6-D8 PolarHBondContact O-N 2.78Å; D8-G10 PolarHBondContact O-N 3.3Å; D8-G10 VanDerWaalsContact O-N 3.17Å; D8-G10 WeakPolarHBondContact OD1-CA 3.39Å; D8-G10 PolarHBondContact OD1-N 3.12Å; D8-L11 HydrophobicContact CB-CB 4.26Å; D8-L11 WeakPolarHBondContact O-CB 3.49Å; D8-L11 PolarHBondContact O-N 3.31Å; D8-L11 PolarHBondContact OD1-N 2.72Å; D8-L12 PolarHBondContact O-N 2.96Å
9	P	61.3	Low	54.1	Low	82 Å²	82	116.2 Å²	116.2	53%	0.532	65%	0.651	S	S	.	*	H	α-helix	trans	-58.5	-26.4	177.6	-24.1	33.1	0	0	0	113.5	L12 L13	P9-L12 PolarHBondContact O-N 2.76Å; P9-L13 PolarHBondContact O-N 2.69Å
10	G	65.8	Low	54	Low	32 Å²	32	121 Å²	121	33%	0.33	66%	0.658	S	S	.	*	H	α-helix	trans	-70.9	-36.1	175.3	0	0	0	0	0	113	D8 L12 L13 L14	D8-G10 PolarHBondContact O-N 3.3Å; D8-G10 VanDerWaalsContact O-N 3.17Å; D8-G10 WeakPolarHBondContact OD1-CA 3.39Å; D8-G10 PolarHBondContact OD1-N 3.12Å; G10-L12 VanDerWaalsContact C-N 3.33Å; G10-L13 PolarHBondContact O-N 2.85Å; G10-L14 PolarHBondContact O-N 2.57Å
11	L	61.2	Low	54.1	Low	96 Å²	96	120.7 Å²	120.7	50%	0.503	66%	0.66	S	S	.	*	H	α-helix	trans	-66.3	-37.1	171.9	-166.7	71.1	0	0	0	111.3	D8 L14 L15	D8-L11 HydrophobicContact CB-CB 4.26Å; D8-L11 WeakPolarHBondContact O-CB 3.49Å; D8-L11 PolarHBondContact O-N 3.31Å; D8-L11 PolarHBondContact OD1-N 2.72Å; L11-L14 PolarHBondContact O-N 3.17Å; L11-L15 HydrophobicContact CG-CD1 4.37Å; L11-L15 WeakPolarHBondContact O-CB 2.95Å; L11-L15 VanDerWaalsContact O-CG 3.24Å; L11-L15 WeakPolarHBondContact O-CG 3.3Å; L11-L15 PolarHBondContact O-N 3.05Å
12	L	60.1	Low	55	Low	106 Å²	106	114.1 Å²	114.1	56%	0.555	64%	0.637	S	S	*	*	H	α-helix	trans	-65.1	-40	174	-154.7	83.2	0	0	0	111.4	D8 P9 G10 L15 L16	D8-L12 PolarHBondContact O-N 2.96Å; P9-L12 PolarHBondContact O-N 2.76Å; G10-L12 VanDerWaalsContact C-N 3.33Å; L12-L15 PolarHBondContact O-N 2.81Å; L12-L16 HydrophobicContact CD2-CD1 4.47Å; L12-L16 HydrophobicContact CG-CD1 4.34Å; L12-L16 VanDerWaalsContact O-CB 3.3Å; L12-L16 WeakPolarHBondContact O-CB 3.46Å; L12-L16 WeakPolarHBondContact O-CD1 3.46Å; L12-L16 WeakPolarHBondContact O-CG 3.45Å; L12-L16 PolarHBondContact O-N 2.99Å
13	L	60.2	Low	55.9	Low	127 Å²	127	113.7 Å²	113.7	67%	0.665	63%	0.633	S	S	*	*	H	α-helix	trans	-67.3	-34.4	174.3	-108.5	116.1	0	0	0	113.2	P9 G10 L16 A17	P9-L13 PolarHBondContact O-N 2.69Å; G10-L13 PolarHBondContact O-N 2.85Å; L13-L16 CarbonylContact O-C 3.23Å; L13-L16 VanDerWaalsContact O-C 3.23Å; L13-L16 PolarHBondContact O-N 3.26Å; L13-A17 WeakPolarHBondContact O-CB 3.39Å; L13-A17 PolarHBondContact O-N 2.88Å
14	L	58.7	Low	56.4	Low	112 Å²	112	117.7 Å²	117.7	59%	0.586	64%	0.64	S	S	*	*	H	α-helix	trans	-69.6	-41.3	174.1	-103.5	145.8	0	0	0	111.8	G10 L11 L16 A17 C18	G10-L14 PolarHBondContact O-N 2.57Å; L11-L14 PolarHBondContact O-N 3.17Å; L14-L16 VanDerWaalsContact C-N 3.32Å; L14-L16 PolarHBondContact O-N 2.97Å; L14-A17 WeakPolarHBondContact O-CA 3.33Å; L14-A17 WeakPolarHBondContact O-CB 3.31Å; L14-A17 PolarHBondContact O-N 3.24Å; L14-C18 PolarHBondContact O-N 3.35Å; L14-C18 PolarHBondContact O-SG 2.93Å
15	L	57.1	Low	57	Low	111 Å²	111	118.8 Å²	118.8	58%	0.581	64%	0.641	S	S	*	*	H	α-helix	trans	-66.2	-36.1	173.2	-67	168.2	0	0	0	111.6	L11 L12 A17 C18	L11-L15 HydrophobicContact CG-CD1 4.37Å; L11-L15 WeakPolarHBondContact O-CB 2.95Å; L11-L15 VanDerWaalsContact O-CG 3.24Å; L11-L15 WeakPolarHBondContact O-CG 3.3Å; L11-L15 PolarHBondContact O-N 3.05Å; L12-L15 PolarHBondContact O-N 2.81Å; L15-A17 PolarHBondContact O-N 2.95Å; L15-C18 PolarHBondContact O-N 2.93Å
16	L	58.5	Low	57.2	Low	82 Å²	82	112.7 Å²	112.7	43%	0.429	62%	0.624	S	S	.	*	H	α-helix	trans	-79.9	8.5	167.7	-63.6	167.2	0	0	0	113.2	L12 L13 L14 W19	L12-L16 HydrophobicContact CD2-CD1 4.47Å; L12-L16 HydrophobicContact CG-CD1 4.34Å; L12-L16 VanDerWaalsContact O-CB 3.3Å; L12-L16 WeakPolarHBondContact O-CB 3.46Å; L12-L16 WeakPolarHBondContact O-CD1 3.46Å; L12-L16 WeakPolarHBondContact O-CG 3.45Å; L12-L16 PolarHBondContact O-N 2.99Å; L13-L16 CarbonylContact O-C 3.23Å; L13-L16 VanDerWaalsContact O-C 3.23Å; L13-L16 PolarHBondContact O-N 3.26Å; L14-L16 VanDerWaalsContact C-N 3.32Å; L14-L16 PolarHBondContact O-N 2.97Å; L16-W19 VanDerWaalsContact C-NE1 3.27Å; L16-W19 HydrophobicContact CB-CZ2 4.45Å; L16-W19 HydrophobicContact CD2-CD2 4.21Å; L16-W19 HydrophobicContact CD2-CE3 4.41Å; L16-W19 HydrophobicContact CD2-CH2 3.88Å; L16-W19 HydrophobicContact CD2-CZ2 3.64Å; L16-W19 HydrophobicContact CD2-CZ3 4.27Å; L16-W19 PolarHBondContact O-NE1 3.02Å
17	A	54.7	Low	57.6	Low	52 Å²	52	106.1 Å²	106.1	43%	0.43	60%	0.6	S	S	.	*	H	α-helix	trans	-106.4	-27.4	166.1	0	0	0	0	0	110	L13 L14 L15 W19 R20	L13-A17 WeakPolarHBondContact O-CB 3.39Å; L13-A17 PolarHBondContact O-N 2.88Å; L14-A17 WeakPolarHBondContact O-CA 3.33Å; L14-A17 WeakPolarHBondContact O-CB 3.31Å; L14-A17 PolarHBondContact O-N 3.24Å; L15-A17 PolarHBondContact O-N 2.95Å; A17-W19 VanDerWaalsContact C-N 3.33Å; A17-W19 PolarHBondContact O-N 2.71Å; A17-R20 WeakPolarHBondContact O-CB 3.47Å; A17-R20 PolarHBondContact O-N 2.85Å
18	C	51	Low	58.7	Low	103 Å²	103	104.5 Å²	104.5	70%	0.696	60%	0.597	S	S	*	*	H	α-helix	trans	-73.8	-16	175.9	-63.8	0	0	0	0	114.7	L14 L15 R20	L14-C18 PolarHBondContact O-N 3.35Å; L14-C18 PolarHBondContact O-SG 2.93Å; L15-C18 PolarHBondContact O-N 2.93Å; C18-R20 VanDerWaalsContact C-N 3.32Å
19	W	46.1	Very low	59.8	Low	182 Å²	182	103.7 Å²	103.7	69%	0.689	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-2.5	169.9	74.6	-22.1	0	0	0	114.1	L16 A17 T21	L16-W19 VanDerWaalsContact C-NE1 3.27Å; L16-W19 HydrophobicContact CB-CZ2 4.45Å; L16-W19 HydrophobicContact CD2-CD2 4.21Å; L16-W19 HydrophobicContact CD2-CE3 4.41Å; L16-W19 HydrophobicContact CD2-CH2 3.88Å; L16-W19 HydrophobicContact CD2-CZ2 3.64Å; L16-W19 HydrophobicContact CD2-CZ3 4.27Å; L16-W19 PolarHBondContact O-NE1 3.02Å; A17-W19 VanDerWaalsContact C-N 3.33Å; A17-W19 PolarHBondContact O-N 2.71Å; W19-T21 PolarHBondContact O-N 3.2Å
20	R	52.6	Low	61.3	Low	211 Å²	211	100.2 Å²	100.2	80%	0.796	57%	0.572	S	S	*	*	S	Bend	trans	-73.6	89.3	168.8	-80.7	-176.6	148.2	-158.6	-5.4	107	A17 C18	A17-R20 WeakPolarHBondContact O-CB 3.47Å; A17-R20 PolarHBondContact O-N 2.85Å; C18-R20 VanDerWaalsContact C-N 3.32Å
21	T	56.2	Low	62.7	Low	115 Å²	115	100.5 Å²	100.5	71%	0.706	57%	0.572	S	S	*	*			trans	-9	122	164.2	53.2	0	0	0	0	112.2	W19 A23	W19-T21 PolarHBondContact O-N 3.2Å; T21-A23 PolarHBondContact O-N 2.79Å; T21-A23 VanDerWaalsContact O-N 3.09Å
22	P	56.9	Low	64.4	Low	115 Å²	115	97.4 Å²	97.4	75%	0.747	56%	0.56	S	S	*	*			trans	-50.9	128.9	154.6	24.5	-30.4	0	0	0	105.2	M24	P22-M24 PolarHBondContact O-N 2.61Å
23	A	55.8	Low	66.2	Low	90 Å²	90	92.6 Å²	92.6	74%	0.744	54%	0.535	S	S	*	.			trans	-54.5	99.1	167.6	0	0	0	0	0	105.2	T21 V25	T21-A23 PolarHBondContact O-N 2.79Å; T21-A23 VanDerWaalsContact O-N 3.09Å; A23-V25 VanDerWaalsContact C-N 3.28Å; A23-V25 PolarHBondContact O-N 3.37Å
24	M	51.2	Low	68	Low	167 Å²	167	89.5 Å²	89.5	82%	0.823	52%	0.521	S	S	*	.			trans	-55	110.9	159.7	-78.1	176.8	69.1	0	0	102.1	P22 G26	P22-M24 PolarHBondContact O-N 2.61Å; M24-G26 PolarHBondContact O-N 3.26Å
25	V	54.3	Low	69.8	Low	141 Å²	141	89.9 Å²	89.9	86%	0.855	52%	0.524	S	S	*	.			trans	-64.4	72.1	148	178.4	0	0	0	0	103.7	A23 G27	A23-V25 VanDerWaalsContact C-N 3.28Å; A23-V25 PolarHBondContact O-N 3.37Å; V25-G27 VanDerWaalsContact C-N 3.33Å; V25-G27 PolarHBondContact O-N 2.78Å
26	G	54.2	Low	71.8	Confident	41 Å²	41	85.7 Å²	85.7	42%	0.423	50%	0.503	S	S	.	.			trans	-69.6	102	173.8	0	0	0	0	0	102.9	M24 T28	M24-G26 PolarHBondContact O-N 3.26Å; G26-T28 PolarHBondContact O-N 3.14Å; G26-T28 VanDerWaalsContact O-N 3.07Å
27	G	65.4	Low	73.6	Confident	26 Å²	26	83.9 Å²	83.9	27%	0.268	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-58.9	123.6	179.1	0	0	0	0	0	107.9	V25 H107	V25-G27 VanDerWaalsContact C-N 3.33Å; V25-G27 PolarHBondContact O-N 2.78Å; G27-H107 WeakPolarHBondContact CA-CE1 3.5Å; G27-H107 WeakPolarHBondContact CA-ND1 3.39Å; G27-H107 WeakPolarHBondContact O-CB 3.35Å
28	T	82.6	Confident	75.7	Confident	112 Å²	112	83.1 Å²	83.1	69%	0.687	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-74.7	143.1	-177.8	51.4	0	0	0	0	108.5	G26	G26-T28 PolarHBondContact O-N 3.14Å; G26-T28 VanDerWaalsContact O-N 3.07Å
29	V	91.5	Very high	77.9	Confident	75 Å²	75	80.8 Å²	80.8	46%	0.455	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-58	133.4	164.5	175.5	0	0	0	0	107.4	D109	V29-D109 WeakPolarHBondContact CG1-O 3.41Å
30	P	94.4	Very high	80.3	Confident	8 Å²	8	78 Å²	78	5%	0.052	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-64.6	158.6	-178	26.7	-35	0	0	0	111.6	D56 V58 G108 S110	P30-D56 HydrophobicContact CB-CB 4.26Å; P30-V58 HydrophobicContact CB-CG2 3.87Å; P30-G108 WeakPolarHBondContact CD-O 3.33Å; P30-S110 WeakPolarHBondContact O-CA 3.33Å; P30-S110 WeakPolarHBondContact O-CB 3.15Å
31	A	94.9	Very high	82.4	Confident	39 Å²	39	70.7 Å²	70.7	32%	0.322	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-73.6	160.2	173.3	0	0	0	0	0	112	P53 D56 S103 S110	A31-P53 HydrophobicContact CB-CG 3.98Å; A31-D56 WeakPolarHBondContact CB-OD2 3.47Å; A31-D56 PolarHBondContact N-OD2 3.44Å; A31-S103 WeakPolarHBondContact O-CB 3.42Å; A31-S103 PolarHBondContact O-OG 3.33Å; A31-S110 WeakPolarHBondContact O-CB 3.44Å
32	A	96.9	Very high	84.3	Confident	30 Å²	30	72.7 Å²	72.7	25%	0.248	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-63.6	140.7	175.1	0	0	0	0	0	111	Q111	A32-Q111 WeakPolarHBondContact CB-O 3.17Å
33	P	97.3	Very high	86.2	Confident	5 Å²	5	68 Å²	68	3%	0.032	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-56.9	142.1	172.3	-24.3	34	0	0	0	112.2	V36 W50 N51 I52 V101 S103 S113	P33-V36 HydrophobicContact CB-CG2 4.4Å; P33-W50 HydrophobicContact CB-CB 4.06Å; P33-W50 HydrophobicContact CB-CG 4.11Å; P33-N51 WeakPolarHBondContact CA-O 3.49Å; P33-I52 HydrophobicContact CB-CD1 4.06Å; P33-I52 HydrophobicContact CG-CD1 4.07Å; P33-V101 HydrophobicContact CB-CB 4.27Å; P33-V101 HydrophobicContact CB-CG1 4.28Å; P33-V101 WeakPolarHBondContact CD-O 3.5Å; P33-V101 HydrophobicContact CG-CB 4.09Å; P33-V101 HydrophobicContact CG-CG1 3.83Å; P33-S103 WeakPolarHBondContact CD-OG 3.45Å; P33-S103 WeakPolarHBondContact CG-OG 3.46Å; P33-S113 WeakPolarHBondContact O-CB 3.35Å
34	V	97.2	Very high	88.2	Confident	62 Å²	62	67.5 Å²	67.5	38%	0.376	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	164	-179.2	-61.8	0	0	0	0	110.8	V36 N51 P53	V34-V36 PolarHBondContact O-N 2.82Å; V34-N51 HydrophobicContact CG2-CB 3.98Å; V34-N51 PolarHBondContact N-O 2.83Å; V34-N51 PolarHBondContact O-N 2.9Å; V34-P53 HydrophobicContact CG1-CG 4.26Å
35	N	97.1	Very high	90.4	Very high	120 Å²	120	60.9 Å²	60.9	64%	0.642	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.1	39.6	-179.7	-58.4	-34.6	0	0	0	112.8	S37 N51	N35-S37 PolarHBondContact O-N 2.86Å; N35-N51 HydrophobicContact CB-CB 4.34Å
36	V	98.3	Very high	92.5	Very high	23 Å²	23	54.2 Å²	54.2	14%	0.139	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	127.1	173.8	-175.2	0	0	0	0	108.2	P33 V34 V48 T49 W50 V101 V116	P33-V36 HydrophobicContact CB-CG2 4.4Å; V34-V36 PolarHBondContact O-N 2.82Å; V36-V48 HydrophobicContact CG1-CG1 3.94Å; V36-T49 CarbonylContact C-O 3.53Å; V36-T49 VanDerWaalsContact CA-O 3.27Å; V36-T49 WeakPolarHBondContact CA-O 3.5Å; V36-W50 HydrophobicContact CG2-CB 4Å; V36-V101 HydrophobicContact CG1-CG2 3.88Å; V36-V101 HydrophobicContact CG2-CB 4.41Å; V36-V101 HydrophobicContact CG2-CG2 4.21Å; V36-V116 HydrophobicContact CB-CG2 3.91Å; V36-V116 HydrophobicContact CG1-CG2 3.82Å; V36-V116 WeakPolarHBondContact O-CG2 3.41Å
37	S	98	Very high	94.6	Very high	45 Å²	45	53.9 Å²	53.9	32%	0.315	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	153	179.6	70.3	0	0	0	0	111.1	N35 V48 T49	N35-S37 PolarHBondContact O-N 2.86Å; S37-V48 CarbonylContact O-C 3.52Å; S37-V48 WeakPolarHBondContact O-CA 3.43Å; S37-T49 PolarHBondContact N-O 2.99Å; S37-T49 PolarHBondContact O-N 3.35Å; S37-T49 PolarHBondContact OG-OG1 2.85Å
38	V	98.3	Very high	96.1	Very high	35 Å²	35	52.6 Å²	52.6	21%	0.212	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128	176.6	-176.5	0	0	0	0	108.2	A46 M47 V48 V99 V116 F118	V38-A46 HydrophobicContact CG1-CB 3.74Å; V38-M47 CarbonylContact C-O 3.54Å; V38-M47 WeakPolarHBondContact CA-O 3.42Å; V38-V48 HydrophobicContact CG2-CG2 4.36Å; V38-V99 HydrophobicContact CG2-CG1 3.79Å; V38-V116 HydrophobicContact CG2-CG1 3.93Å; V38-F118 HydrophobicContact CB-CB 4.39Å; V38-F118 HydrophobicContact CB-CD1 4.41Å; V38-F118 HydrophobicContact CB-CG 4.41Å; V38-F118 HydrophobicContact CG1-CB 4.25Å; V38-F118 HydrophobicContact CG1-CD1 4.16Å; V38-F118 HydrophobicContact CG1-CD2 4.18Å; V38-F118 HydrophobicContact CG1-CG 3.94Å; V38-F118 HydrophobicContact CG2-CD1 3.8Å; V38-F118 HydrophobicContact CG2-CE1 4.3Å; V38-F118 HydrophobicContact CG2-CG 4.29Å
39	T	96.9	Very high	96.9	Very high	54 Å²	54	49.1 Å²	49.1	33%	0.331	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	175.6	-176.6	61.6	0	0	0	0	109.5	L41 M47	T39-L41 PolarHBondContact O-N 2.93Å; T39-L41 VanDerWaalsContact O-N 3.14Å; T39-M47 PolarHBondContact N-O 3.48Å; T39-M47 PolarHBondContact O-N 2.9Å; T39-M47 WeakPolarHBondContact OG1-CE 3.5Å; T39-M47 PolarHBondContact OG1-O 2.83Å
40	Q	96.5	Very high	97.2	Very high	123 Å²	123	45.7 Å²	45.7	58%	0.575	25%	0.251	S	S	*	.	S	Bend	trans	48.8	43.9	179.4	-61.6	-176.3	-19.9	0	0	113	R42 M47	Q40-R42 PolarHBondContact O-N 2.84Å; Q40-M47 HydrophobicContact CB-CB 4.06Å; Q40-M47 VanDerWaalsContact CD-CE 3.42Å; Q40-M47 HydrophobicContact CG-CB 4.48Å; Q40-M47 HydrophobicContact CG-CE 3.95Å; Q40-M47 PolarHBondContact OE1-SD 3.23Å
41	L	97.1	Very high	97.3	Very high	58 Å²	58	48.7 Å²	48.7	30%	0.304	27%	0.266	S	S	.	.			trans	-65.4	130.8	-178.8	-169.9	75.9	0	0	0	110.4	T39 A46 F118 R119 L121	T39-L41 PolarHBondContact O-N 2.93Å; T39-L41 VanDerWaalsContact O-N 3.14Å; L41-A46 HydrophobicContact CD1-CB 4.06Å; L41-F118 HydrophobicContact CD1-CD2 3.58Å; L41-F118 HydrophobicContact CD1-CE2 4.16Å; L41-F118 HydrophobicContact CD1-CG 4.5Å; L41-R119 WeakPolarHBondContact CD1-O 3.36Å; L41-R119 WeakPolarHBondContact CD2-O 3.24Å; L41-L121 HydrophobicContact CD2-CD2 3.64Å; L41-L121 HydrophobicContact CD2-CG 3.92Å; L41-L121 HydrophobicContact CG-CD2 4.36Å; L41-L121 HydrophobicContact CG-CG 4.08Å; L41-L121 VanDerWaalsContact O-CD1 3.3Å; L41-L121 WeakPolarHBondContact O-CD1 3.29Å
42	R	96.3	Very high	97.3	Very high	158 Å²	158	48.2 Å²	48.2	60%	0.596	26%	0.258	S	S	*	.			trans	-130.8	-179.1	176.3	-57.8	-168.9	-177.7	-166.6	-1.4	109.8	Q40 H44 S45 L121	Q40-R42 PolarHBondContact O-N 2.84Å; R42-H44 VanDerWaalsContact C-N 3.33Å; R42-S45 WeakPolarHBondContact CA-O 3.39Å; R42-S45 WeakPolarHBondContact CD-OG 3.43Å; R42-S45 PolarHBondContact N-O 2.97Å; R42-L121 PolarHBondContact O-N 3.47Å; R42-L121 VanDerWaalsContact O-N 3.12Å
43	A	96.6	Very high	96.8	Very high	16 Å²	16	49 Å²	49	13%	0.132	26%	0.261	C	S	.	.	S	Bend	trans	-64	-38	174.5	0	0	0	0	0	112.5	E93 T120 L121 R123	A43-E93 HydrophobicContact CB-CB 4.27Å; A43-E93 WeakPolarHBondContact O-CA 3.4Å; A43-T120 WeakPolarHBondContact O-CB 3.44Å; A43-L121 VanDerWaalsContact CA-O 3.29Å; A43-L121 WeakPolarHBondContact CA-O 3.29Å; A43-R123 HydrophobicContact CB-CB 4.28Å
44	H	96.8	Very high	96.2	Very high	79 Å²	79	58.5 Å²	58.5	37%	0.366	30%	0.304	S	S	.	.	S	Bend	trans	-124.6	8.3	-173.8	-52.9	-55.5	0	0	0	114.8	R42 D90 L91 E93	R42-H44 VanDerWaalsContact C-N 3.33Å; H44-D90 PolarHBondContact O-N 3.19Å; H44-D90 VanDerWaalsContact O-N 3.16Å; H44-L91 WeakPolarHBondContact CA-O 3.45Å; H44-L91 PolarHBondContact ND1-O 3.43Å; H44-L91 PolarHBondContact O-N 2.74Å; H44-E93 IonicContact CE1-OE2 3.81Å
45	S	97.6	Very high	95.2	Very high	29 Å²	29	59.4 Å²	59.4	20%	0.203	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	160.2	179.7	64	0	0	0	0	112.9	R42 L88	R42-S45 WeakPolarHBondContact CA-O 3.39Å; R42-S45 WeakPolarHBondContact CD-OG 3.43Å; R42-S45 PolarHBondContact N-O 2.97Å; S45-L88 WeakPolarHBondContact CA-O 3.37Å; S45-L88 WeakPolarHBondContact CB-O 3.49Å
46	A	97.9	Very high	94.6	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.008	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	151	173.7	0	0	0	0	0	109.5	V38 L41 V87 L88 L91 F118	V38-A46 HydrophobicContact CG1-CB 3.74Å; L41-A46 HydrophobicContact CD1-CB 4.06Å; A46-V87 CarbonylContact O-C 3.57Å; A46-V87 WeakPolarHBondContact O-CA 3.3Å; A46-L88 PolarHBondContact N-O 2.91Å; A46-L88 VanDerWaalsContact N-O 3.08Å; A46-L88 PolarHBondContact O-N 2.8Å; A46-L91 HydrophobicContact CB-CD1 4.25Å; A46-F118 HydrophobicContact CB-CD2 4.49Å; A46-F118 HydrophobicContact CB-CE2 3.94Å; A46-F118 HydrophobicContact CB-CZ 4.34Å
47	M	98.3	Very high	94.2	Very high	33 Å²	33	59.8 Å²	59.8	16%	0.163	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.5	174.3	-174.2	167.9	68.9	0	0	110.5	V38 T39 Q40 T49 W85 V87	V38-M47 CarbonylContact C-O 3.54Å; V38-M47 WeakPolarHBondContact CA-O 3.42Å; T39-M47 PolarHBondContact N-O 3.48Å; T39-M47 PolarHBondContact O-N 2.9Å; T39-M47 WeakPolarHBondContact OG1-CE 3.5Å; T39-M47 PolarHBondContact OG1-O 2.83Å; Q40-M47 HydrophobicContact CB-CB 4.06Å; Q40-M47 VanDerWaalsContact CD-CE 3.42Å; Q40-M47 HydrophobicContact CG-CB 4.48Å; Q40-M47 HydrophobicContact CG-CE 3.95Å; Q40-M47 PolarHBondContact OE1-SD 3.23Å; M47-T49 HydrophobicContact CE-CG2 4.26Å; M47-T49 HydrophobicContact CG-CG2 4.21Å; M47-W85 HydrophobicContact SD-CE3 4.12Å; M47-V87 HydrophobicContact CG-CG2 4.46Å
48	V	98.5	Very high	94	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	133.5	176.1	-171.9	0	0	0	0	108	V36 S37 V38 W50 W85 C86 L88 V99 V101	V36-V48 HydrophobicContact CG1-CG1 3.94Å; S37-V48 CarbonylContact O-C 3.52Å; S37-V48 WeakPolarHBondContact O-CA 3.43Å; V38-V48 HydrophobicContact CG2-CG2 4.36Å; V48-W50 HydrophobicContact CB-CZ3 4.26Å; V48-W50 HydrophobicContact CG1-CE3 4.04Å; V48-W50 HydrophobicContact CG1-CZ3 4.12Å; V48-W85 CarbonylContact O-C 3.56Å; V48-W85 WeakPolarHBondContact O-CA 3.38Å; V48-C86 PolarHBondContact N-O 2.78Å; V48-C86 PolarHBondContact O-N 3.22Å; V48-L88 HydrophobicContact CG2-CD1 3.67Å; V48-L88 HydrophobicContact CG2-CD2 4.29Å; V48-L88 HydrophobicContact CG2-CG 3.72Å; V48-V99 HydrophobicContact CG1-CG1 4.31Å; V48-V99 HydrophobicContact CG1-CG2 4.31Å; V48-V99 HydrophobicContact CG2-CG1 4.33Å; V48-V99 HydrophobicContact CG2-CG2 4.12Å; V48-V101 HydrophobicContact CG1-CG2 4.13Å
49	T	98.4	Very high	93.9	Very high	38 Å²	38	59.9 Å²	59.9	23%	0.233	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	153.8	176.6	68.8	0	0	0	0	110.6	V36 S37 M47 R84 W85	V36-T49 CarbonylContact C-O 3.53Å; V36-T49 VanDerWaalsContact CA-O 3.27Å; V36-T49 WeakPolarHBondContact CA-O 3.5Å; S37-T49 PolarHBondContact N-O 2.99Å; S37-T49 PolarHBondContact O-N 3.35Å; S37-T49 PolarHBondContact OG-OG1 2.85Å; M47-T49 HydrophobicContact CE-CG2 4.26Å; M47-T49 HydrophobicContact CG-CG2 4.21Å; T49-R84 WeakPolarHBondContact CA-O 3.1Å; T49-W85 HydrophobicContact CG2-CB 3.9Å
50	W	98.1	Very high	93.9	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.015	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	173.7	-178.8	57.1	89.8	0	0	0	112.2	P33 V36 V48 Y61 I63 R84 W85 C86 V101	P33-W50 HydrophobicContact CB-CB 4.06Å; P33-W50 HydrophobicContact CB-CG 4.11Å; V36-W50 HydrophobicContact CG2-CB 4Å; V48-W50 HydrophobicContact CB-CZ3 4.26Å; V48-W50 HydrophobicContact CG1-CE3 4.04Å; V48-W50 HydrophobicContact CG1-CZ3 4.12Å; W50-Y61 AromaticContact CE2-CD1 3.89Å; W50-Y61 AromaticContact CE2-CG 3.79Å; W50-Y61 HydrophobicContact CZ2-CD1 4.09Å; W50-Y61 AromaticContact CZ2-CD2 3.6Å; W50-Y61 HydrophobicContact CZ2-CD2 3.6Å; W50-Y61 HydrophobicContact CZ2-CE2 4.26Å; W50-Y61 AromaticContact CZ2-CG 3.49Å; W50-Y61 HydrophobicContact CZ2-CG 3.49Å; W50-Y61 VanDerWaalsContact CZ2-CG 3.49Å; W50-Y61 AromaticContact NE1-CD1 3.26Å; W50-Y61 VanDerWaalsContact NE1-CD1 3.26Å; W50-Y61 AromaticContact NE1-CD2 3.91Å; W50-Y61 AromaticContact NE1-CE1 3.27Å; W50-Y61 VanDerWaalsContact NE1-CE1 3.27Å; W50-Y61 AromaticContact NE1-CE2 3.9Å; W50-Y61 AromaticContact NE1-CG 3.59Å; W50-Y61 AromaticContact NE1-CZ 3.59Å; W50-I63 HydrophobicContact CH2-CD1 3.92Å; W50-I63 HydrophobicContact CH2-CG1 3.9Å; W50-I63 HydrophobicContact CZ3-CG1 4.05Å; W50-R84 PolarHBondContact N-O 3.33Å; W50-R84 VanDerWaalsContact O-CB 3.29Å; W50-R84 WeakPolarHBondContact O-CB 3.47Å; W50-W85 VanDerWaalsContact CH2-C 3.44Å; W50-C86 HydrophobicContact CH2-CB 3.74Å; W50-C86 HydrophobicContact CZ3-CB 3.98Å; W50-V101 HydrophobicContact CD2-CG1 3.84Å; W50-V101 HydrophobicContact CD2-CG2 4.35Å; W50-V101 HydrophobicContact CE3-CG1 4.06Å; W50-V101 HydrophobicContact CE3-CG2 3.9Å; W50-V101 HydrophobicContact CG-CG1 4.26Å; W50-V101 HydrophobicContact CH2-CG1 4.47Å; W50-V101 HydrophobicContact CZ2-CG1 4.28Å; W50-V101 HydrophobicContact CZ3-CG1 4.36Å; W50-V101 HydrophobicContact CZ3-CG2 4.32Å
51	N	96.6	Very high	94	Very high	71 Å²	71	51.8 Å²	51.8	38%	0.38	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	158.2	175.1	-74.6	-49	0	0	0	110.8	P33 V34 N35	P33-N51 WeakPolarHBondContact CA-O 3.49Å; V34-N51 HydrophobicContact CG2-CB 3.98Å; V34-N51 PolarHBondContact N-O 2.83Å; V34-N51 PolarHBondContact O-N 2.9Å; N35-N51 HydrophobicContact CB-CB 4.34Å
52	I	93.7	Very high	94	Very high	28 Å²	28	49.4 Å²	49.4	14%	0.144	28%	0.275	C	S	.	.			trans	-117.5	134.2	179.7	-53.9	-60.3	0	0	0	109.5	P33 D56 V58 Y61	P33-I52 HydrophobicContact CB-CD1 4.06Å; P33-I52 HydrophobicContact CG-CD1 4.07Å; I52-D56 HydrophobicContact CG2-CB 4.04Å; I52-V58 HydrophobicContact CG2-CG2 3.88Å; I52-Y61 HydrophobicContact CD1-CD1 4.39Å; I52-Y61 HydrophobicContact CD1-CE1 3.47Å; I52-Y61 VanDerWaalsContact CD1-CE1 3.47Å; I52-Y61 HydrophobicContact CG1-CE1 3.97Å
53	P	88.1	Confident	94.1	Very high	48 Å²	48	42 Å²	42	31%	0.312	25%	0.247	S	C	.	.			trans	-55	147.6	170.9	-25.4	37.1	0	0	0	112	A31 V34	A31-P53 HydrophobicContact CB-CG 3.98Å; V34-P53 HydrophobicContact CG1-CG 4.26Å
54	Q	83.3	Confident	94.2	Very high	203 Å²	203	42.2 Å²	42.2	95%	0.949	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	138	-179.7	-67.4	-180	13.1	0	0	111
55	G	77.9	Confident	94.2	Very high	82 Å²	82	38.5 Å²	38.5	85%	0.845	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	99	-4.7	174.6	0	0	0	0	0	115.6
56	D	83.3	Confident	94.2	Very high	45 Å²	45	40.9 Å²	40.9	24%	0.241	24%	0.238	C	C	.	.			trans	-86.1	130.9	178.6	-73	-27	0	0	0	112.9	P30 A31 I52 V58	P30-D56 HydrophobicContact CB-CB 4.26Å; A31-D56 WeakPolarHBondContact CB-OD2 3.47Å; A31-D56 PolarHBondContact N-OD2 3.44Å; I52-D56 HydrophobicContact CG2-CB 4.04Å; D56-V58 HydrophobicContact CB-CG2 4.06Å; D56-V58 PolarHBondContact O-N 3.47Å
57	T	89.6	Confident	94.1	Very high	105 Å²	105	43.3 Å²	43.3	64%	0.644	25%	0.247	S	C	*	.			trans	-86.3	96.7	170.2	-58.7	0	0	0	0	109.5
58	V	94.4	Very high	93.9	Very high	33 Å²	33	48.5 Å²	48.5	20%	0.2	27%	0.271	C	S	.	.			trans	-104.6	130.8	178	-176.9	0	0	0	0	109.7	P30 I52 D56 G60 Y61	P30-V58 HydrophobicContact CB-CG2 3.87Å; I52-V58 HydrophobicContact CG2-CG2 3.88Å; D56-V58 HydrophobicContact CB-CG2 4.06Å; D56-V58 PolarHBondContact O-N 3.47Å; V58-G60 WeakPolarHBondContact CG1-O 3.5Å; V58-Y61 HydrophobicContact CG1-CD1 4.16Å; V58-Y61 HydrophobicContact CG1-CE1 3.53Å
59	I	95.7	Very high	93.6	Very high	50 Å²	50	52.5 Å²	52.5	26%	0.256	29%	0.292	S	S	.	.			trans	-103.9	-5.8	178.3	62.3	165.5	0	0	0	112.8	V79 N80 V104 L106	I59-V79 CarbonylContact O-C 3.59Å; I59-N80 PolarHBondContact O-N 2.87Å; I59-V104 HydrophobicContact CD1-CG1 4.13Å; I59-V104 HydrophobicContact CG1-CB 4.44Å; I59-V104 HydrophobicContact CG1-CG1 3.92Å; I59-V104 WeakPolarHBondContact CG1-O 3.4Å; I59-V104 PolarHBondContact N-O 3.23Å; I59-L106 HydrophobicContact CD1-CD2 4.14Å; I59-L106 HydrophobicContact CG2-CD2 4.08Å; I59-L106 HydrophobicContact CG2-CG 3.92Å
60	G	97	Very high	93.2	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.9	-169.5	-178.4	0	0	0	0	0	112.8	V58 E78 V104	V58-G60 WeakPolarHBondContact CG1-O 3.5Å; G60-E78 CarbonylContact C-O 3.59Å; G60-E78 WeakPolarHBondContact CA-O 3.27Å; G60-V104 PolarHBondContact N-O 3.38Å; G60-V104 WeakPolarHBondContact O-CB 3.36Å; G60-V104 PolarHBondContact O-N 3.03Å
61	Y	98.1	Very high	92.8	Very high	7 Å²	7	59.2 Å²	59.2	3%	0.027	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	150.1	-177.6	-53.4	-76	0	0	0	111.4	W50 I52 V58 R77 E78 T81 S83 Q102	W50-Y61 AromaticContact CE2-CD1 3.89Å; W50-Y61 AromaticContact CE2-CG 3.79Å; W50-Y61 HydrophobicContact CZ2-CD1 4.09Å; W50-Y61 AromaticContact CZ2-CD2 3.6Å; W50-Y61 HydrophobicContact CZ2-CD2 3.6Å; W50-Y61 HydrophobicContact CZ2-CE2 4.26Å; W50-Y61 AromaticContact CZ2-CG 3.49Å; W50-Y61 HydrophobicContact CZ2-CG 3.49Å; W50-Y61 VanDerWaalsContact CZ2-CG 3.49Å; W50-Y61 AromaticContact NE1-CD1 3.26Å; W50-Y61 VanDerWaalsContact NE1-CD1 3.26Å; W50-Y61 AromaticContact NE1-CD2 3.91Å; W50-Y61 AromaticContact NE1-CE1 3.27Å; W50-Y61 VanDerWaalsContact NE1-CE1 3.27Å; W50-Y61 AromaticContact NE1-CE2 3.9Å; W50-Y61 AromaticContact NE1-CG 3.59Å; W50-Y61 AromaticContact NE1-CZ 3.59Å; I52-Y61 HydrophobicContact CD1-CD1 4.39Å; I52-Y61 HydrophobicContact CD1-CE1 3.47Å; I52-Y61 VanDerWaalsContact CD1-CE1 3.47Å; I52-Y61 HydrophobicContact CG1-CE1 3.97Å; V58-Y61 HydrophobicContact CG1-CD1 4.16Å; V58-Y61 HydrophobicContact CG1-CE1 3.53Å; Y61-R77 WeakPolarHBondContact O-CA 3.47Å; Y61-E78 PolarHBondContact N-O 2.87Å; Y61-E78 PolarHBondContact O-N 3.35Å; Y61-T81 HydrophobicContact CD2-CG2 4.14Å; Y61-T81 HydrophobicContact CE2-CG2 4.49Å; Y61-S83 WeakPolarHBondContact CD2-O 3.13Å; Y61-S83 WeakPolarHBondContact CE2-O 3.11Å; Y61-Q102 CarbonylContact C-O 3.56Å; Y61-Q102 VanDerWaalsContact CA-O 3.29Å; Y61-Q102 WeakPolarHBondContact CA-O 3.01Å
62	S	98.1	Very high	92.7	Very high	8 Å²	8	57.9 Å²	57.9	6%	0.056	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.1	169.6	-171.1	0	0	0	0	109.1	S75 I76 V101 Q102	S62-S75 PolarHBondContact OG-OG 3.01Å; S62-I76 CarbonylContact C-O 3.42Å; S62-I76 WeakPolarHBondContact CA-O 3.08Å; S62-V101 CarbonylContact O-C 3.59Å; S62-V101 WeakPolarHBondContact O-CA 3.5Å; S62-Q102 PolarHBondContact N-O 2.89Å; S62-Q102 PolarHBondContact O-N 2.84Å
63	I	98.3	Very high	92.8	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.7	-177.9	-54.6	81.8	0	0	0	107.4	W50 S75 I76 C86 L88 V99 Q100 V101	W50-I63 HydrophobicContact CH2-CD1 3.92Å; W50-I63 HydrophobicContact CH2-CG1 3.9Å; W50-I63 HydrophobicContact CZ3-CG1 4.05Å; I63-S75 CarbonylContact O-C 3.54Å; I63-S75 VanDerWaalsContact O-CA 3.28Å; I63-S75 WeakPolarHBondContact O-CA 3.36Å; I63-I76 HydrophobicContact CB-CB 4.46Å; I63-I76 PolarHBondContact N-O 2.83Å; I63-I76 PolarHBondContact O-N 2.76Å; I63-C86 HydrophobicContact CD1-CB 3.93Å; I63-C86 HydrophobicContact CG1-CB 4.02Å; I63-L88 HydrophobicContact CG2-CD2 4.03Å; I63-V99 HydrophobicContact CG2-CG2 3.51Å; I63-Q100 WeakPolarHBondContact CA-O 3.49Å; I63-V101 HydrophobicContact CG1-CG1 4.28Å; I63-V101 HydrophobicContact CG1-CG2 4.46Å
64	S	97.9	Very high	93.2	Very high	21 Å²	21	64.4 Å²	64.4	15%	0.147	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.2	175.3	57.7	0	0	0	0	110.1	R74 V99 Q100	S64-R74 CarbonylContact C-O 3.58Å; S64-R74 WeakPolarHBondContact CA-O 3.06Å; S64-V99 WeakPolarHBondContact O-CA 3.36Å; S64-Q100 PolarHBondContact N-O 2.82Å; S64-Q100 PolarHBondContact O-N 2.82Å; S64-Q100 PolarHBondContact OG-O 2.91Å
65	Q	96.9	Very high	93.8	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.009	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	143	170.2	68.1	175.5	81.2	0	0	110.3	M72 Q73 R74 L88 L91 S98	Q65-M72 HydrophobicContact CG-CE 4.43Å; Q65-M72 HydrophobicContact CG-SD 4.39Å; Q65-Q73 CarbonylContact O-C 3.54Å; Q65-Q73 WeakPolarHBondContact O-CA 3.49Å; Q65-R74 HydrophobicContact CG-CB 3.66Å; Q65-R74 HydrophobicContact CG-CG 4.41Å; Q65-R74 WeakPolarHBondContact CG-O 3.29Å; Q65-R74 PolarHBondContact N-O 3.33Å; Q65-R74 PolarHBondContact O-N 3.08Å; Q65-L88 HydrophobicContact CB-CD1 4.37Å; Q65-L91 VanDerWaalsContact NE2-CD2 3.32Å; Q65-S98 WeakPolarHBondContact CA-O 3.33Å
66	Q	97.6	Very high	94.7	Very high	78 Å²	78	55.3 Å²	55.3	36%	0.364	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	132.7	176	-177.1	176.9	16.3	0	0	109.4	M72 Q73 Y97 S98	Q66-M72 WeakPolarHBondContact CA-O 3.44Å; Q66-Q73 HydrophobicContact CB-CG 4.48Å; Q66-Y97 CarbonylContact O-C 3.52Å; Q66-Y97 VanDerWaalsContact O-CA 3.3Å; Q66-Y97 WeakPolarHBondContact O-CA 3.45Å; Q66-S98 PolarHBondContact N-O 3.49Å; Q66-S98 PolarHBondContact O-N 2.97Å; Q66-S98 PolarHBondContact O-OG 2.82Å
67	R	96.6	Very high	95.4	Very high	53 Å²	53	60.1 Å²	60.1	20%	0.2	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	141	172.6	-158.7	169.1	94.3	170.3	7.1	109	D69 G70 L71 M72 D92 T95 Y97	R67-D69 WeakPolarHBondContact CB-OD1 3.34Å; R67-D69 WeakPolarHBondContact CG-OD1 3.44Å; R67-D69 IonicContact CZ-OD1 3.75Å; R67-D69 IonicContact CZ-OD2 3.07Å; R67-D69 IonicContact NE-OD1 2.85Å; R67-D69 PolarHBondContact NE-OD1 2.87Å; R67-D69 IonicContact NE-OD2 2.79Å; R67-D69 PolarHBondContact NE-OD2 3.16Å; R67-D69 IonicContact NH2-OD1 3.83Å; R67-D69 IonicContact NH2-OD2 2.61Å; R67-D69 PolarHBondContact NH2-OD2 3.23Å; R67-D69 PolarHBondContact O-N 3Å; R67-G70 PolarHBondContact O-N 2.81Å; R67-L71 VanDerWaalsContact NH2-CD1 3.28Å; R67-M72 HydrophobicContact CB-CB 3.91Å; R67-M72 PolarHBondContact N-O 2.98Å; R67-D92 IonicContact CZ-OD2 3.78Å; R67-D92 IonicContact NH1-OD2 2.74Å; R67-D92 PolarHBondContact NH1-OD2 2.81Å; R67-T95 HydrophobicContact CG-CG2 3.65Å; R67-Y97 HydrophobicContact CB-CD1 4Å; R67-Y97 HydrophobicContact CB-CE1 3.72Å; R67-Y97 HydrophobicContact CG-CD1 4.22Å; R67-Y97 HydrophobicContact CG-CE1 3.73Å
68	Q	94.4	Very high	95.7	Very high	141 Å²	141	57.9 Å²	57.9	66%	0.659	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.1	-171.2	-173.5	176.6	7.1	0	0	113.6	G70 H96	Q68-G70 PolarHBondContact O-N 2.84Å; Q68-H96 HydrophobicContact CB-CB 3.91Å; Q68-H96 PolarHBondContact N-O 2.72Å
69	D	91.8	Very high	95.8	Very high	85 Å²	85	59.8 Å²	59.8	46%	0.455	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-2.6	175.3	63	4.5	0	0	0	114	R67 L71	R67-D69 WeakPolarHBondContact CB-OD1 3.34Å; R67-D69 WeakPolarHBondContact CG-OD1 3.44Å; R67-D69 IonicContact CZ-OD1 3.75Å; R67-D69 IonicContact CZ-OD2 3.07Å; R67-D69 IonicContact NE-OD1 2.85Å; R67-D69 PolarHBondContact NE-OD1 2.87Å; R67-D69 IonicContact NE-OD2 2.79Å; R67-D69 PolarHBondContact NE-OD2 3.16Å; R67-D69 IonicContact NH2-OD1 3.83Å; R67-D69 IonicContact NH2-OD2 2.61Å; R67-D69 PolarHBondContact NH2-OD2 3.23Å; R67-D69 PolarHBondContact O-N 3Å; D69-L71 HydrophobicContact CB-CG 4.31Å; D69-L71 PolarHBondContact O-N 3.44Å; D69-L71 WeakPolarHBondContact OD1-CB 3.46Å; D69-L71 PolarHBondContact OD1-N 2.93Å; D69-L71 WeakPolarHBondContact OD2-CD1 3.33Å
70	G	90.6	Very high	95.7	Very high	47 Å²	47	64.8 Å²	64.8	49%	0.485	33%	0.332	S	S	.	.	S	Bend	trans	74.2	2	178.8	0	0	0	0	0	114.6	R67 Q68 M72	R67-G70 PolarHBondContact O-N 2.81Å; Q68-G70 PolarHBondContact O-N 2.84Å; G70-M72 VanDerWaalsContact C-N 3.28Å; G70-M72 PolarHBondContact O-N 2.9Å
71	L	89.8	Confident	95.5	Very high	135 Å²	135	66.1 Å²	66.1	71%	0.707	34%	0.341	S	S	*	.	S	Bend	trans	-76.8	-17.5	-176.6	-62.3	-177.4	0	0	0	113	R67 D69	R67-L71 VanDerWaalsContact NH2-CD1 3.28Å; D69-L71 HydrophobicContact CB-CG 4.31Å; D69-L71 PolarHBondContact O-N 3.44Å; D69-L71 WeakPolarHBondContact OD1-CB 3.46Å; D69-L71 PolarHBondContact OD1-N 2.93Å; D69-L71 WeakPolarHBondContact OD2-CD1 3.33Å
72	M	93.8	Very high	95.3	Very high	43 Å²	43	70.5 Å²	70.5	21%	0.212	37%	0.372	C	S	.	.			trans	-138.2	130.1	-177.8	-174.2	-80	-176.2	0	0	111	Q65 Q66 R67 G70 R74 Y97	Q65-M72 HydrophobicContact CG-CE 4.43Å; Q65-M72 HydrophobicContact CG-SD 4.39Å; Q66-M72 WeakPolarHBondContact CA-O 3.44Å; R67-M72 HydrophobicContact CB-CB 3.91Å; R67-M72 PolarHBondContact N-O 2.98Å; G70-M72 VanDerWaalsContact C-N 3.28Å; G70-M72 PolarHBondContact O-N 2.9Å; M72-R74 HydrophobicContact CE-CB 3.45Å; M72-R74 VanDerWaalsContact CE-CB 3.45Å; M72-R74 HydrophobicContact CE-CG 4.43Å; M72-R74 HydrophobicContact SD-CB 4.27Å; M72-Y97 HydrophobicContact SD-CE1 4.49Å
73	Q	95.4	Very high	95.2	Very high	142 Å²	142	72.2 Å²	72.2	66%	0.664	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	132.9	168.4	-175.5	177.6	-15.5	0	0	108.7	Q65 Q66	Q65-Q73 CarbonylContact O-C 3.54Å; Q65-Q73 WeakPolarHBondContact O-CA 3.49Å; Q66-Q73 HydrophobicContact CB-CG 4.48Å
74	R	96.2	Very high	95.1	Very high	72 Å²	72	78.1 Å²	78.1	27%	0.272	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	144.4	176.4	172.4	-174.3	-79.6	179.1	3.7	109.4	S64 Q65 M72 W89 D90	S64-R74 CarbonylContact C-O 3.58Å; S64-R74 WeakPolarHBondContact CA-O 3.06Å; Q65-R74 HydrophobicContact CG-CB 3.66Å; Q65-R74 HydrophobicContact CG-CG 4.41Å; Q65-R74 WeakPolarHBondContact CG-O 3.29Å; Q65-R74 PolarHBondContact N-O 3.33Å; Q65-R74 PolarHBondContact O-N 3.08Å; M72-R74 HydrophobicContact CE-CB 3.45Å; M72-R74 VanDerWaalsContact CE-CB 3.45Å; M72-R74 HydrophobicContact CE-CG 4.43Å; M72-R74 HydrophobicContact SD-CB 4.27Å; R74-W89 PolarHBondContact NH1-O 3.37Å; R74-D90 IonicContact CZ-OD2 3.91Å; R74-D90 IonicContact NH1-OD2 3.96Å; R74-D90 IonicContact NH2-OD2 3.01Å; R74-D90 PolarHBondContact NH2-OD2 3.27Å
75	S	96.6	Very high	95.1	Very high	76 Å²	76	83.5 Å²	83.5	53%	0.531	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132	171.6	-163.1	0	0	0	0	109.3	S62 I63	S62-S75 PolarHBondContact OG-OG 3.01Å; I63-S75 CarbonylContact O-C 3.54Å; I63-S75 VanDerWaalsContact O-CA 3.28Å; I63-S75 WeakPolarHBondContact O-CA 3.36Å
76	I	97.5	Very high	95.2	Very high	18 Å²	18	83.5 Å²	83.5	9%	0.092	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125	172.8	-58.2	168	0	0	0	106.4	S62 I63 E78 L88 W89	S62-I76 CarbonylContact C-O 3.42Å; S62-I76 WeakPolarHBondContact CA-O 3.08Å; I63-I76 HydrophobicContact CB-CB 4.46Å; I63-I76 PolarHBondContact N-O 2.83Å; I63-I76 PolarHBondContact O-N 2.76Å; I76-E78 HydrophobicContact CG2-CG 4.32Å; I76-L88 HydrophobicContact CD1-CD2 3.81Å; I76-W89 HydrophobicContact CD1-CH2 3.83Å; I76-W89 HydrophobicContact CD1-CZ2 4.18Å; I76-W89 HydrophobicContact CD1-CZ3 4.09Å; I76-W89 HydrophobicContact CG1-CH2 4.37Å; I76-W89 HydrophobicContact CG2-CH2 4.27Å
77	R	97.5	Very high	95.2	Very high	146 Å²	146	82.3 Å²	82.3	55%	0.551	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.8	179.3	-165.1	177.8	-166.1	-148.7	7.4	109.6	Y61 V104 D109	Y61-R77 WeakPolarHBondContact O-CA 3.47Å; R77-V104 HydrophobicContact CG-CG2 4.43Å; R77-D109 IonicContact NH2-OD1 3Å; R77-D109 PolarHBondContact NH2-OD1 2.94Å; R77-D109 IonicContact NH2-OD2 3.33Å; R77-D109 PolarHBondContact NH2-OD2 3.5Å
78	E	96.3	Very high	95.2	Very high	58 Å²	58	79.8 Å²	79.8	27%	0.271	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.6	179.1	-63.7	179.7	-162	0	0	108.9	G60 Y61 I76 T81 C86	G60-E78 CarbonylContact C-O 3.59Å; G60-E78 WeakPolarHBondContact CA-O 3.27Å; Y61-E78 PolarHBondContact N-O 2.87Å; Y61-E78 PolarHBondContact O-N 3.35Å; I76-E78 HydrophobicContact CG2-CG 4.32Å; E78-T81 HydrophobicContact CB-CG2 3.71Å; E78-C86 PolarHBondContact OE1-SG 2.8Å; E78-C86 VanDerWaalsContact OE1-SG 3.37Å
79	V	95.2	Very high	95.3	Very high	73 Å²	73	79 Å²	79	44%	0.442	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	158.1	177.5	-64.5	0	0	0	0	110.2	I59 T81 V104	I59-V79 CarbonylContact O-C 3.59Å; V79-T81 PolarHBondContact O-N 2.94Å; V79-V104 HydrophobicContact CG1-CG1 4.29Å
80	N	94.9	Very high	95.5	Very high	154 Å²	154	80.3 Å²	80.3	82%	0.824	41%	0.41	S	S	*	.	S	Bend	trans	60.8	34.4	-172.4	-51.6	-49.8	0	0	0	112.7	I59	I59-N80 PolarHBondContact O-N 2.87Å
81	T	92.8	Very high	95.8	Very high	29 Å²	29	78.3 Å²	78.3	18%	0.178	39%	0.388	C	S	.	.			trans	-127.4	145.2	178.3	-173.3	0	0	0	0	110.6	Y61 E78 V79 S83	Y61-T81 HydrophobicContact CD2-CG2 4.14Å; Y61-T81 HydrophobicContact CE2-CG2 4.49Å; E78-T81 HydrophobicContact CB-CG2 3.71Å; V79-T81 PolarHBondContact O-N 2.94Å; T81-S83 WeakPolarHBondContact OG1-CB 3.45Å; T81-S83 PolarHBondContact OG1-N 3.02Å; T81-S83 VanDerWaalsContact OG1-N 3.11Å; T81-S83 PolarHBondContact OG1-OG 2.84Å
82	S	93.6	Very high	96.1	Very high	98 Å²	98	75.3 Å²	75.3	69%	0.685	37%	0.373	S	S	*	.			trans	-107.8	-1.4	167.7	60.3	0	0	0	0	112.1	R84	S82-R84 WeakPolarHBondContact O-CG 3.18Å; S82-R84 PolarHBondContact O-N 2.91Å
83	S	95.8	Very high	96.2	Very high	44 Å²	44	77.5 Å²	77.5	31%	0.308	38%	0.382	S	S	.	.			trans	-59.6	127.3	178.1	-64.8	0	0	0	0	110.2	Y61 T81 W85	Y61-S83 WeakPolarHBondContact CD2-O 3.13Å; Y61-S83 WeakPolarHBondContact CE2-O 3.11Å; T81-S83 WeakPolarHBondContact OG1-CB 3.45Å; T81-S83 PolarHBondContact OG1-N 3.02Å; T81-S83 VanDerWaalsContact OG1-N 3.11Å; T81-S83 PolarHBondContact OG1-OG 2.84Å; S83-W85 VanDerWaalsContact C-N 3.3Å; S83-W85 PolarHBondContact O-N 2.87Å
84	R	96.9	Very high	96.2	Very high	125 Å²	125	74 Å²	74	47%	0.472	37%	0.368	S	S	.	.			trans	-102.6	36.1	-177.4	-52.3	179.2	-176.6	162.8	-0.4	111.8	T49 W50 S82	T49-R84 WeakPolarHBondContact CA-O 3.1Å; W50-R84 PolarHBondContact N-O 3.33Å; W50-R84 VanDerWaalsContact O-CB 3.29Å; W50-R84 WeakPolarHBondContact O-CB 3.47Å; S82-R84 WeakPolarHBondContact O-CG 3.18Å; S82-R84 PolarHBondContact O-N 2.91Å
85	W	97.8	Very high	96.3	Very high	134 Å²	134	72 Å²	72	51%	0.508	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	151.4	-179.5	61.8	-86	0	0	0	109.8	M47 V48 T49 W50 S83 V87	M47-W85 HydrophobicContact SD-CE3 4.12Å; V48-W85 CarbonylContact O-C 3.56Å; V48-W85 WeakPolarHBondContact O-CA 3.38Å; T49-W85 HydrophobicContact CG2-CB 3.9Å; W50-W85 VanDerWaalsContact CH2-C 3.44Å; S83-W85 VanDerWaalsContact C-N 3.3Å; S83-W85 PolarHBondContact O-N 2.87Å; W85-V87 HydrophobicContact CE3-CG2 4.32Å; W85-V87 HydrophobicContact CZ3-CG2 4.02Å
86	C	97.6	Very high	96.3	Very high	2 Å²	2	72.2 Å²	72.2	1%	0.014	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	139.7	173.7	-178.3	0	0	0	0	108.3	V48 W50 I63 E78	V48-C86 PolarHBondContact N-O 2.78Å; V48-C86 PolarHBondContact O-N 3.22Å; W50-C86 HydrophobicContact CH2-CB 3.74Å; W50-C86 HydrophobicContact CZ3-CB 3.98Å; I63-C86 HydrophobicContact CD1-CB 3.93Å; I63-C86 HydrophobicContact CG1-CB 4.02Å; E78-C86 PolarHBondContact OE1-SG 2.8Å; E78-C86 VanDerWaalsContact OE1-SG 3.37Å
87	V	98	Very high	96.4	Very high	53 Å²	53	71.5 Å²	71.5	32%	0.321	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.4	172.6	176.9	0	0	0	0	107.6	A46 M47 W85 W89	A46-V87 CarbonylContact O-C 3.57Å; A46-V87 WeakPolarHBondContact O-CA 3.3Å; M47-V87 HydrophobicContact CG-CG2 4.46Å; W85-V87 HydrophobicContact CE3-CG2 4.32Å; W85-V87 HydrophobicContact CZ3-CG2 4.02Å; V87-W89 WeakPolarHBondContact O-CZ3 3.43Å
88	L	97.8	Very high	96.4	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	135	164.4	-54.9	-178.1	0	0	0	107.9	S45 A46 V48 I63 Q65 I76 L91 V99 F118	S45-L88 WeakPolarHBondContact CA-O 3.37Å; S45-L88 WeakPolarHBondContact CB-O 3.49Å; A46-L88 PolarHBondContact N-O 2.91Å; A46-L88 VanDerWaalsContact N-O 3.08Å; A46-L88 PolarHBondContact O-N 2.8Å; V48-L88 HydrophobicContact CG2-CD1 3.67Å; V48-L88 HydrophobicContact CG2-CD2 4.29Å; V48-L88 HydrophobicContact CG2-CG 3.72Å; I63-L88 HydrophobicContact CG2-CD2 4.03Å; Q65-L88 HydrophobicContact CB-CD1 4.37Å; I76-L88 HydrophobicContact CD1-CD2 3.81Å; L88-L91 HydrophobicContact CB-CD1 4.15Å; L88-L91 HydrophobicContact CB-CD2 4.36Å; L88-V99 HydrophobicContact CD1-CG2 4.31Å; L88-F118 HydrophobicContact CD1-CE1 4.12Å; L88-F118 HydrophobicContact CD1-CZ 3.82Å
89	W	96.1	Very high	96.5	Very high	125 Å²	125	62.6 Å²	62.6	47%	0.473	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	166.7	-179.9	56.6	85	0	0	0	110.3	R74 I76 V87 L91	R74-W89 PolarHBondContact NH1-O 3.37Å; I76-W89 HydrophobicContact CD1-CH2 3.83Å; I76-W89 HydrophobicContact CD1-CZ2 4.18Å; I76-W89 HydrophobicContact CD1-CZ3 4.09Å; I76-W89 HydrophobicContact CG1-CH2 4.37Å; I76-W89 HydrophobicContact CG2-CH2 4.27Å; V87-W89 WeakPolarHBondContact O-CZ3 3.43Å; W89-L91 VanDerWaalsContact C-N 3.31Å
90	D	95.5	Very high	96.6	Very high	113 Å²	113	61.8 Å²	61.8	60%	0.604	31%	0.311	S	S	*	.	S	Bend	trans	61.1	44.6	176.8	-171.8	43.1	0	0	0	110.8	H44 R74	H44-D90 PolarHBondContact O-N 3.19Å; H44-D90 VanDerWaalsContact O-N 3.16Å; R74-D90 IonicContact CZ-OD2 3.91Å; R74-D90 IonicContact NH1-OD2 3.96Å; R74-D90 IonicContact NH2-OD2 3.01Å; R74-D90 PolarHBondContact NH2-OD2 3.27Å
91	L	96.4	Very high	96.8	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-92.1	145.6	174.1	-53.4	-179.8	0	0	0	110.1	H44 A46 Q65 L88 W89 Y97 F118 T120	H44-L91 WeakPolarHBondContact CA-O 3.45Å; H44-L91 PolarHBondContact ND1-O 3.43Å; H44-L91 PolarHBondContact O-N 2.74Å; A46-L91 HydrophobicContact CB-CD1 4.25Å; Q65-L91 VanDerWaalsContact NE2-CD2 3.32Å; L88-L91 HydrophobicContact CB-CD1 4.15Å; L88-L91 HydrophobicContact CB-CD2 4.36Å; W89-L91 VanDerWaalsContact C-N 3.31Å; L91-Y97 HydrophobicContact CB-CE2 4.07Å; L91-Y97 HydrophobicContact CD2-CE1 4.18Å; L91-Y97 HydrophobicContact CD2-CE2 4.26Å; L91-F118 HydrophobicContact CD1-CE2 3.95Å; L91-F118 HydrophobicContact CD1-CZ 4.16Å; L91-T120 HydrophobicContact CB-CG2 3.75Å; L91-T120 HydrophobicContact CD1-CG2 3.67Å; L91-T120 HydrophobicContact CG-CG2 4.37Å
92	D	96	Very high	97	Very high	72 Å²	72	55.1 Å²	55.1	39%	0.385	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-70.5	142.6	169.8	-63.6	-58.2	0	0	0	109.2	R67 T95 Y97 T120	R67-D92 IonicContact CZ-OD2 3.78Å; R67-D92 IonicContact NH1-OD2 2.74Å; R67-D92 PolarHBondContact NH1-OD2 2.81Å; D92-T95 HydrophobicContact CB-CG2 4.15Å; D92-T95 WeakPolarHBondContact CB-OG1 3.14Å; D92-T95 WeakPolarHBondContact O-CB 3.43Å; D92-Y97 WeakPolarHBondContact CB-OH 3.05Å; D92-Y97 PolarHBondContact N-OH 3.41Å; D92-Y97 PolarHBondContact OD2-OH 3.35Å; D92-T120 WeakPolarHBondContact O-CB 3.36Å; D92-T120 PolarHBondContact O-OG1 3.36Å
93	E	96	Very high	97.2	Very high	89 Å²	89	50.5 Å²	50.5	42%	0.416	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	154.5	174.8	64.2	-169.9	-158	0	0	111.5	A43 H44 T95 R123	A43-E93 HydrophobicContact CB-CB 4.27Å; A43-E93 WeakPolarHBondContact O-CA 3.4Å; H44-E93 IonicContact CE1-OE2 3.81Å; E93-T95 WeakPolarHBondContact O-CB 2.94Å; E93-T95 PolarHBondContact O-N 2.78Å; E93-T95 PolarHBondContact O-OG1 2.75Å; E93-R123 WeakPolarHBondContact OE2-CB 3.25Å
94	D	96.3	Very high	97.3	Very high	68 Å²	68	48.5 Å²	48.5	36%	0.364	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	27.7	177.3	-163.1	39.8	0	0	0	115.6	R119 T120 L121 E122	D94-R119 PolarHBondContact O-NE 3.32Å; D94-R119 IonicContact OD1-CZ 3Å; D94-R119 IonicContact OD1-NE 2.69Å; D94-R119 PolarHBondContact OD1-NE 3.11Å; D94-R119 IonicContact OD1-NH2 2.76Å; D94-R119 PolarHBondContact OD1-NH2 3.46Å; D94-R119 IonicContact OD2-CZ 3.7Å; D94-R119 IonicContact OD2-NE 3.93Å; D94-R119 IonicContact OD2-NH2 2.72Å; D94-R119 PolarHBondContact OD2-NH2 3.07Å; D94-T120 PolarHBondContact N-OG1 2.83Å; D94-T120 VanDerWaalsContact N-OG1 3.17Å; D94-L121 PolarHBondContact N-O 2.93Å; D94-E122 HydrophobicContact CB-CB 4.48Å
95	T	97.3	Very high	97.1	Very high	32 Å²	32	42.9 Å²	42.9	20%	0.196	21%	0.207	C	C	.	.			trans	-115.9	140	-166.8	-65.9	0	0	0	0	111.8	R67 D92 E93 Y97 R119 T120	R67-T95 HydrophobicContact CG-CG2 3.65Å; D92-T95 HydrophobicContact CB-CG2 4.15Å; D92-T95 WeakPolarHBondContact CB-OG1 3.14Å; D92-T95 WeakPolarHBondContact O-CB 3.43Å; E93-T95 WeakPolarHBondContact O-CB 2.94Å; E93-T95 PolarHBondContact O-N 2.78Å; E93-T95 PolarHBondContact O-OG1 2.75Å; T95-Y97 HydrophobicContact CG2-CD2 4.24Å; T95-Y97 HydrophobicContact CG2-CE2 3.58Å; T95-Y97 WeakPolarHBondContact O-CD2 3.28Å; T95-R119 CarbonylContact O-C 3.49Å; T95-R119 VanDerWaalsContact O-CA 3.31Å; T95-R119 WeakPolarHBondContact O-CA 3.29Å; T95-T120 PolarHBondContact N-OG1 2.78Å; T95-T120 PolarHBondContact O-N 2.96Å; T95-T120 PolarHBondContact O-OG1 3.35Å
96	H	97.9	Very high	96.8	Very high	80 Å²	80	42.4 Å²	42.4	37%	0.37	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	131.1	-179.4	-69.1	79.3	0	0	0	112.1	Q68 F118 R119	Q68-H96 HydrophobicContact CB-CB 3.91Å; Q68-H96 PolarHBondContact N-O 2.72Å; H96-F118 WeakPolarHBondContact CA-O 3.14Å; H96-R119 WeakPolarHBondContact CE1-CD 3.37Å
97	Y	98.2	Very high	96.4	Very high	3 Å²	3	47.8 Å²	47.8	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	156.2	178.2	-68.3	-86.8	0	0	0	111.2	Q66 R67 M72 L91 D92 T95 H117 F118 T120	Q66-Y97 CarbonylContact O-C 3.52Å; Q66-Y97 VanDerWaalsContact O-CA 3.3Å; Q66-Y97 WeakPolarHBondContact O-CA 3.45Å; R67-Y97 HydrophobicContact CB-CD1 4Å; R67-Y97 HydrophobicContact CB-CE1 3.72Å; R67-Y97 HydrophobicContact CG-CD1 4.22Å; R67-Y97 HydrophobicContact CG-CE1 3.73Å; M72-Y97 HydrophobicContact SD-CE1 4.49Å; L91-Y97 HydrophobicContact CB-CE2 4.07Å; L91-Y97 HydrophobicContact CD2-CE1 4.18Å; L91-Y97 HydrophobicContact CD2-CE2 4.26Å; D92-Y97 WeakPolarHBondContact CB-OH 3.05Å; D92-Y97 PolarHBondContact N-OH 3.41Å; D92-Y97 PolarHBondContact OD2-OH 3.35Å; T95-Y97 HydrophobicContact CG2-CD2 4.24Å; T95-Y97 HydrophobicContact CG2-CE2 3.58Å; T95-Y97 WeakPolarHBondContact O-CD2 3.28Å; Y97-H117 WeakPolarHBondContact O-CA 3.22Å; Y97-F118 HydrophobicContact CD2-CE2 4.18Å; Y97-F118 HydrophobicContact CD2-CZ 4.31Å; Y97-F118 HydrophobicContact CG-CE2 4.46Å; Y97-F118 HydrophobicContact CG-CZ 4.15Å; Y97-F118 PolarHBondContact N-O 3.41Å; Y97-F118 PolarHBondContact O-N 2.92Å; Y97-T120 HydrophobicContact CD2-CG2 4.28Å; Y97-T120 HydrophobicContact CE2-CG2 4.13Å
98	S	97.8	Very high	96.2	Very high	16 Å²	16	46.6 Å²	46.6	11%	0.112	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.5	163.7	60.5	0	0	0	0	109.9	Q65 Q66 V116 H117	Q65-S98 WeakPolarHBondContact CA-O 3.33Å; Q66-S98 PolarHBondContact N-O 3.49Å; Q66-S98 PolarHBondContact O-N 2.97Å; Q66-S98 PolarHBondContact O-OG 2.82Å; S98-V116 CarbonylContact C-O 3.59Å; S98-V116 WeakPolarHBondContact CA-O 3.4Å; S98-H117 WeakPolarHBondContact CB-ND1 3.37Å
99	V	98.1	Very high	96.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.3	174.7	67.7	0	0	0	0	111.5	V38 V48 I63 S64 L88 P115 V116 F118	V38-V99 HydrophobicContact CG2-CG1 3.79Å; V48-V99 HydrophobicContact CG1-CG1 4.31Å; V48-V99 HydrophobicContact CG1-CG2 4.31Å; V48-V99 HydrophobicContact CG2-CG1 4.33Å; V48-V99 HydrophobicContact CG2-CG2 4.12Å; I63-V99 HydrophobicContact CG2-CG2 3.51Å; S64-V99 WeakPolarHBondContact O-CA 3.36Å; L88-V99 HydrophobicContact CD1-CG2 4.31Å; V99-P115 WeakPolarHBondContact O-CA 3.36Å; V99-V116 HydrophobicContact CG1-CB 3.99Å; V99-V116 PolarHBondContact N-O 3.46Å; V99-V116 PolarHBondContact O-N 2.91Å; V99-F118 HydrophobicContact CB-CE1 4.27Å; V99-F118 HydrophobicContact CG1-CD1 4.44Å; V99-F118 HydrophobicContact CG1-CE1 4.23Å
100	Q	98.3	Very high	96.1	Very high	56 Å²	56	43.8 Å²	43.8	26%	0.262	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	151.2	170.9	-64.3	178.1	-79.3	0	0	109.7	I63 S64 P112 S113 P115	I63-Q100 WeakPolarHBondContact CA-O 3.49Å; S64-Q100 PolarHBondContact N-O 2.82Å; S64-Q100 PolarHBondContact O-N 2.82Å; S64-Q100 PolarHBondContact OG-O 2.91Å; Q100-P112 HydrophobicContact CB-CB 4.28Å; Q100-S113 PolarHBondContact NE2-O 3.42Å; Q100-P115 HydrophobicContact CG-CB 3.88Å
101	V	98.4	Very high	96.1	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.1	179.4	-167.6	0	0	0	0	109.5	P33 V36 V48 W50 S62 I63 S113	P33-V101 HydrophobicContact CB-CB 4.27Å; P33-V101 HydrophobicContact CB-CG1 4.28Å; P33-V101 WeakPolarHBondContact CD-O 3.5Å; P33-V101 HydrophobicContact CG-CB 4.09Å; P33-V101 HydrophobicContact CG-CG1 3.83Å; V36-V101 HydrophobicContact CG1-CG2 3.88Å; V36-V101 HydrophobicContact CG2-CB 4.41Å; V36-V101 HydrophobicContact CG2-CG2 4.21Å; V48-V101 HydrophobicContact CG1-CG2 4.13Å; W50-V101 HydrophobicContact CD2-CG1 3.84Å; W50-V101 HydrophobicContact CD2-CG2 4.35Å; W50-V101 HydrophobicContact CE3-CG1 4.06Å; W50-V101 HydrophobicContact CE3-CG2 3.9Å; W50-V101 HydrophobicContact CG-CG1 4.26Å; W50-V101 HydrophobicContact CH2-CG1 4.47Å; W50-V101 HydrophobicContact CZ2-CG1 4.28Å; W50-V101 HydrophobicContact CZ3-CG1 4.36Å; W50-V101 HydrophobicContact CZ3-CG2 4.32Å; S62-V101 CarbonylContact O-C 3.59Å; S62-V101 WeakPolarHBondContact O-CA 3.5Å; I63-V101 HydrophobicContact CG1-CG1 4.28Å; I63-V101 HydrophobicContact CG1-CG2 4.46Å; V101-S113 PolarHBondContact N-OG 3.47Å; V101-S113 WeakPolarHBondContact O-CB 3.47Å; V101-S113 PolarHBondContact O-N 2.98Å
102	Q	98	Very high	96.2	Very high	44 Å²	44	48 Å²	48	21%	0.206	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.5	172.4	-69.5	171.7	105.2	0	0	109.5	Y61 S62 S110 P112	Y61-Q102 CarbonylContact C-O 3.56Å; Y61-Q102 VanDerWaalsContact CA-O 3.29Å; Y61-Q102 WeakPolarHBondContact CA-O 3.01Å; S62-Q102 PolarHBondContact N-O 2.89Å; S62-Q102 PolarHBondContact O-N 2.84Å; Q102-S110 PolarHBondContact OE1-O 2.97Å; Q102-P112 HydrophobicContact CG-CB 4.03Å; Q102-P112 HydrophobicContact CG-CG 3.99Å
103	S	97.3	Very high	96.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.9	167.5	-57.2	0	0	0	0	108.6	A31 P33 D109 S110	A31-S103 WeakPolarHBondContact O-CB 3.42Å; A31-S103 PolarHBondContact O-OG 3.33Å; P33-S103 WeakPolarHBondContact CD-OG 3.45Å; P33-S103 WeakPolarHBondContact CG-OG 3.46Å; S103-D109 CarbonylContact O-C 3.57Å; S103-D109 WeakPolarHBondContact O-CA 3.38Å; S103-S110 PolarHBondContact N-OG 3.45Å; S103-S110 PolarHBondContact O-N 3Å
104	V	96.7	Very high	96.3	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.7	173.9	177.8	0	0	0	0	107.7	I59 G60 R77 V79 D109	I59-V104 HydrophobicContact CD1-CG1 4.13Å; I59-V104 HydrophobicContact CG1-CB 4.44Å; I59-V104 HydrophobicContact CG1-CG1 3.92Å; I59-V104 WeakPolarHBondContact CG1-O 3.4Å; I59-V104 PolarHBondContact N-O 3.23Å; G60-V104 PolarHBondContact N-O 3.38Å; G60-V104 WeakPolarHBondContact O-CB 3.36Å; G60-V104 PolarHBondContact O-N 3.03Å; R77-V104 HydrophobicContact CG-CG2 4.43Å; V79-V104 HydrophobicContact CG1-CG1 4.29Å; V104-D109 WeakPolarHBondContact CG1-OD1 3.49Å
105	G	94.2	Very high	96.4	Very high	7 Å²	7	51.1 Å²	51.1	7%	0.072	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	168.9	177.8	0	0	0	0	0	112.5	H107 G108	G105-H107 PolarHBondContact O-N 2.74Å; G105-G108 CarbonylContact C-O 3.59Å; G105-G108 VanDerWaalsContact CA-O 3.28Å; G105-G108 WeakPolarHBondContact CA-O 3.29Å; G105-G108 PolarHBondContact N-O 3.11Å; G105-G108 PolarHBondContact O-N 2.73Å
106	L	91.8	Very high	96.4	Very high	124 Å²	124	51.3 Å²	51.3	65%	0.649	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-27.9	175.5	-70.4	168.6	0	0	0	113	I59	I59-L106 HydrophobicContact CD1-CD2 4.14Å; I59-L106 HydrophobicContact CG2-CD2 4.08Å; I59-L106 HydrophobicContact CG2-CG 3.92Å
107	H	89.6	Confident	96.4	Very high	115 Å²	115	53.9 Å²	53.9	53%	0.532	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	4.5	-174.3	-57.6	84.2	0	0	0	112.8	G27 G105	G27-H107 WeakPolarHBondContact CA-CE1 3.5Å; G27-H107 WeakPolarHBondContact CA-ND1 3.39Å; G27-H107 WeakPolarHBondContact O-CB 3.35Å; G105-H107 PolarHBondContact O-N 2.74Å
108	G	92	Very high	96.4	Very high	29 Å²	29	54.7 Å²	54.7	30%	0.299	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	138.8	171.3	-177	0	0	0	0	0	112.8	P30 G105	P30-G108 WeakPolarHBondContact CD-O 3.33Å; G105-G108 CarbonylContact C-O 3.59Å; G105-G108 VanDerWaalsContact CA-O 3.28Å; G105-G108 WeakPolarHBondContact CA-O 3.29Å; G105-G108 PolarHBondContact N-O 3.11Å; G105-G108 PolarHBondContact O-N 2.73Å
109	D	95.4	Very high	96.4	Very high	62 Å²	62	59.3 Å²	59.3	33%	0.332	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	146.6	176.5	-61.9	-11.3	0	0	0	109.8	V29 R77 S103 V104	V29-D109 WeakPolarHBondContact CG1-O 3.41Å; R77-D109 IonicContact NH2-OD1 3Å; R77-D109 PolarHBondContact NH2-OD1 2.94Å; R77-D109 IonicContact NH2-OD2 3.33Å; R77-D109 PolarHBondContact NH2-OD2 3.5Å; S103-D109 CarbonylContact O-C 3.57Å; S103-D109 WeakPolarHBondContact O-CA 3.38Å; V104-D109 WeakPolarHBondContact CG1-OD1 3.49Å
110	S	96.3	Very high	96.4	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.021	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-67.3	169.4	174.8	75.3	0	0	0	0	111.8	P30 A31 Q102 S103	P30-S110 WeakPolarHBondContact O-CA 3.33Å; P30-S110 WeakPolarHBondContact O-CB 3.15Å; A31-S110 WeakPolarHBondContact O-CB 3.44Å; Q102-S110 PolarHBondContact OE1-O 2.97Å; S103-S110 PolarHBondContact N-OG 3.45Å; S103-S110 PolarHBondContact O-N 3Å
111	Q	96.6	Very high	96.3	Very high	154 Å²	154	61 Å²	61	72%	0.72	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-58.5	151.1	160.6	-68	-63.2	-47.9	0	0	110.9	A32	A32-Q111 WeakPolarHBondContact CB-O 3.17Å
112	P	97.5	Very high	96.1	Very high	51 Å²	51	67.7 Å²	67.7	33%	0.331	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-62.2	147	172	-20.6	31.4	0	0	0	112.4	Q100 Q102	Q100-P112 HydrophobicContact CB-CB 4.28Å; Q102-P112 HydrophobicContact CG-CB 4.03Å; Q102-P112 HydrophobicContact CG-CG 3.99Å
113	S	98.3	Very high	95.6	Very high	6 Å²	6	71.9 Å²	71.9	4%	0.042	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-59.7	167	166.6	73.5	0	0	0	0	111.2	P33 Q100 V101	P33-S113 WeakPolarHBondContact O-CB 3.35Å; Q100-S113 PolarHBondContact NE2-O 3.42Å; V101-S113 PolarHBondContact N-OG 3.47Å; V101-S113 WeakPolarHBondContact O-CB 3.47Å; V101-S113 PolarHBondContact O-N 2.98Å
114	R	97.3	Very high	94.7	Very high	225 Å²	225	77.1 Å²	77.1	85%	0.849	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-56.6	139.6	163.6	-67.7	-176.4	178.3	175.1	-0.3	109.4
115	P	97.3	Very high	92.9	Very high	65 Å²	65	82.4 Å²	82.4	42%	0.422	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-66.3	135.2	176.8	27.4	-33.2	0	0	0	110.4	V99 Q100	V99-P115 WeakPolarHBondContact O-CA 3.36Å; Q100-P115 HydrophobicContact CG-CB 3.88Å
116	V	98.2	Very high	91.1	Very high	36 Å²	36	90 Å²	90	22%	0.218	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.1	172.4	-179.2	0	0	0	0	108	V36 V38 S98 V99	V36-V116 HydrophobicContact CB-CG2 3.91Å; V36-V116 HydrophobicContact CG1-CG2 3.82Å; V36-V116 WeakPolarHBondContact O-CG2 3.41Å; V38-V116 HydrophobicContact CG2-CG1 3.93Å; S98-V116 CarbonylContact C-O 3.59Å; S98-V116 WeakPolarHBondContact CA-O 3.4Å; V99-V116 HydrophobicContact CG1-CB 3.99Å; V99-V116 PolarHBondContact N-O 3.46Å; V99-V116 PolarHBondContact O-N 2.91Å
117	H	98	Very high	89	Confident	134 Å²	134	94 Å²	94	62%	0.62	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	139.9	178.6	-62	-77.6	0	0	0	110.4	Y97 S98	Y97-H117 WeakPolarHBondContact O-CA 3.22Å; S98-H117 WeakPolarHBondContact CB-ND1 3.37Å
118	F	97.9	Very high	87.1	Confident	20 Å²	20	94.7 Å²	94.7	9%	0.088	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	160.8	174.1	69	-83.7	0	0	0	109.9	V38 L41 A46 L88 L91 H96 Y97 V99 T120	V38-F118 HydrophobicContact CB-CB 4.39Å; V38-F118 HydrophobicContact CB-CD1 4.41Å; V38-F118 HydrophobicContact CB-CG 4.41Å; V38-F118 HydrophobicContact CG1-CB 4.25Å; V38-F118 HydrophobicContact CG1-CD1 4.16Å; V38-F118 HydrophobicContact CG1-CD2 4.18Å; V38-F118 HydrophobicContact CG1-CG 3.94Å; V38-F118 HydrophobicContact CG2-CD1 3.8Å; V38-F118 HydrophobicContact CG2-CE1 4.3Å; V38-F118 HydrophobicContact CG2-CG 4.29Å; L41-F118 HydrophobicContact CD1-CD2 3.58Å; L41-F118 HydrophobicContact CD1-CE2 4.16Å; L41-F118 HydrophobicContact CD1-CG 4.5Å; A46-F118 HydrophobicContact CB-CD2 4.49Å; A46-F118 HydrophobicContact CB-CE2 3.94Å; A46-F118 HydrophobicContact CB-CZ 4.34Å; L88-F118 HydrophobicContact CD1-CE1 4.12Å; L88-F118 HydrophobicContact CD1-CZ 3.82Å; L91-F118 HydrophobicContact CD1-CE2 3.95Å; L91-F118 HydrophobicContact CD1-CZ 4.16Å; H96-F118 WeakPolarHBondContact CA-O 3.14Å; Y97-F118 HydrophobicContact CD2-CE2 4.18Å; Y97-F118 HydrophobicContact CD2-CZ 4.31Å; Y97-F118 HydrophobicContact CG-CE2 4.46Å; Y97-F118 HydrophobicContact CG-CZ 4.15Å; Y97-F118 PolarHBondContact N-O 3.41Å; Y97-F118 PolarHBondContact O-N 2.92Å; V99-F118 HydrophobicContact CB-CE1 4.27Å; V99-F118 HydrophobicContact CG1-CD1 4.44Å; V99-F118 HydrophobicContact CG1-CE1 4.23Å; F118-T120 HydrophobicContact CE2-CG2 4.24Å
119	R	97.9	Very high	85.1	Confident	113 Å²	113	97.9 Å²	97.9	43%	0.426	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	132.5	173.2	-171.8	-171.8	-175	159.1	-5.5	107.6	L41 D94 T95 H96	L41-R119 WeakPolarHBondContact CD1-O 3.36Å; L41-R119 WeakPolarHBondContact CD2-O 3.24Å; D94-R119 PolarHBondContact O-NE 3.32Å; D94-R119 IonicContact OD1-CZ 3Å; D94-R119 IonicContact OD1-NE 2.69Å; D94-R119 PolarHBondContact OD1-NE 3.11Å; D94-R119 IonicContact OD1-NH2 2.76Å; D94-R119 PolarHBondContact OD1-NH2 3.46Å; D94-R119 IonicContact OD2-CZ 3.7Å; D94-R119 IonicContact OD2-NE 3.93Å; D94-R119 IonicContact OD2-NH2 2.72Å; D94-R119 PolarHBondContact OD2-NH2 3.07Å; T95-R119 CarbonylContact O-C 3.49Å; T95-R119 VanDerWaalsContact O-CA 3.31Å; T95-R119 WeakPolarHBondContact O-CA 3.29Å; H96-R119 WeakPolarHBondContact CE1-CD 3.37Å
120	T	97.2	Very high	83	Confident	3 Å²	3	98.2 Å²	98.2	2%	0.018	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-65.4	160.3	171.8	45.5	0	0	0	0	111	A43 L91 D92 D94 T95 Y97 F118	A43-T120 WeakPolarHBondContact O-CB 3.44Å; L91-T120 HydrophobicContact CB-CG2 3.75Å; L91-T120 HydrophobicContact CD1-CG2 3.67Å; L91-T120 HydrophobicContact CG-CG2 4.37Å; D92-T120 WeakPolarHBondContact O-CB 3.36Å; D92-T120 PolarHBondContact O-OG1 3.36Å; D94-T120 PolarHBondContact N-OG1 2.83Å; D94-T120 VanDerWaalsContact N-OG1 3.17Å; T95-T120 PolarHBondContact N-OG1 2.78Å; T95-T120 PolarHBondContact O-N 2.96Å; T95-T120 PolarHBondContact O-OG1 3.35Å; Y97-T120 HydrophobicContact CD2-CG2 4.28Å; Y97-T120 HydrophobicContact CE2-CG2 4.13Å; F118-T120 HydrophobicContact CE2-CG2 4.24Å
121	L	96	Very high	80.6	Confident	88 Å²	88	104.3 Å²	104.3	46%	0.461	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-75.9	158.6	176.2	-59.3	-179.1	0	0	0	110.6	L41 R42 A43 D94	L41-L121 HydrophobicContact CD2-CD2 3.64Å; L41-L121 HydrophobicContact CD2-CG 3.92Å; L41-L121 HydrophobicContact CG-CD2 4.36Å; L41-L121 HydrophobicContact CG-CG 4.08Å; L41-L121 VanDerWaalsContact O-CD1 3.3Å; L41-L121 WeakPolarHBondContact O-CD1 3.29Å; R42-L121 PolarHBondContact O-N 3.47Å; R42-L121 VanDerWaalsContact O-N 3.12Å; A43-L121 VanDerWaalsContact CA-O 3.29Å; A43-L121 WeakPolarHBondContact CA-O 3.29Å; D94-L121 PolarHBondContact N-O 2.93Å
122	E	94.9	Very high	78.4	Confident	140 Å²	140	104.6 Å²	104.6	65%	0.654	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-73.4	145.9	163.9	-171.7	176.6	-170.3	0	0	109.4	D94 T124	D94-E122 HydrophobicContact CB-CB 4.48Å; E122-T124 PolarHBondContact O-N 3.39Å
123	R	88	Confident	75.7	Confident	133 Å²	133	109.4 Å²	109.4	50%	0.502	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-73	116.1	172.5	-177.8	177.9	-177.9	152.1	1.5	109.7	A43 E93 D125	A43-R123 HydrophobicContact CB-CB 4.28Å; E93-R123 WeakPolarHBondContact OE2-CB 3.25Å; R123-D125 VanDerWaalsContact C-N 3.3Å; R123-D125 WeakPolarHBondContact CD-OD1 3.06Å; R123-D125 WeakPolarHBondContact CD-OD2 3.02Å; R123-D125 WeakPolarHBondContact CG-OD1 3.17Å; R123-D125 IonicContact CZ-OD1 3.72Å; R123-D125 IonicContact NE-OD1 2.81Å; R123-D125 PolarHBondContact NE-OD1 2.91Å; R123-D125 IonicContact NE-OD2 3.24Å; R123-D125 PolarHBondContact NE-OD2 3.44Å; R123-D125 IonicContact NH2-OD1 3.86Å; R123-D125 PolarHBondContact O-N 2.96Å
124	T	78.6	Confident	73.6	Confident	110 Å²	110	117.5 Å²	117.5	68%	0.675	61%	0.606	S	S	*	*			trans	-79.2	80	174.1	-45.8	0	0	0	0	110.3	E122 H126	E122-T124 PolarHBondContact O-N 3.39Å; T124-H126 HydrophobicContact CG2-CB 4.14Å; T124-H126 VanDerWaalsContact CG2-CD2 3.49Å; T124-H126 WeakPolarHBondContact CG2-CD2 3.28Å; T124-H126 PolarHBondContact O-N 2.97Å; T124-H126 VanDerWaalsContact O-N 3.09Å
125	D	57.3	Low	70.8	Confident	113 Å²	113	115 Å²	115	60%	0.604	60%	0.604	S	S	*	*			trans	-82.1	61.1	167.4	-70.3	-29.1	0	0	0	109.9	R123 Y127	R123-D125 VanDerWaalsContact C-N 3.3Å; R123-D125 WeakPolarHBondContact CD-OD1 3.06Å; R123-D125 WeakPolarHBondContact CD-OD2 3.02Å; R123-D125 WeakPolarHBondContact CG-OD1 3.17Å; R123-D125 IonicContact CZ-OD1 3.72Å; R123-D125 IonicContact NE-OD1 2.81Å; R123-D125 PolarHBondContact NE-OD1 2.91Å; R123-D125 IonicContact NE-OD2 3.24Å; R123-D125 PolarHBondContact NE-OD2 3.44Å; R123-D125 IonicContact NH2-OD1 3.86Å; R123-D125 PolarHBondContact O-N 2.96Å; D125-Y127 VanDerWaalsContact C-N 3.35Å; D125-Y127 PolarHBondContact O-N 3.49Å
126	H	57.5	Low	68.2	Low	165 Å²	165	119.9 Å²	119.9	76%	0.764	62%	0.621	S	S	*	*			trans	-88.9	78.1	170.7	-70	-15.5	0	0	0	110	T124	T124-H126 HydrophobicContact CG2-CB 4.14Å; T124-H126 VanDerWaalsContact CG2-CD2 3.49Å; T124-H126 WeakPolarHBondContact CG2-CD2 3.28Å; T124-H126 PolarHBondContact O-N 2.97Å; T124-H126 VanDerWaalsContact O-N 3.09Å
127	Y	47.7	Very low	65.7	Low	210 Å²	210	123.4 Å²	123.4	82%	0.824	64%	0.644	S	S	*	*			trans	-93.4	116.2	154.6	-131	-93.6	0	0	0	106.7	D125 A129	D125-Y127 VanDerWaalsContact C-N 3.35Å; D125-Y127 PolarHBondContact O-N 3.49Å; Y127-A129 PolarHBondContact O-N 3.46Å
128	P	48.9	Very low	62.9	Low	129 Å²	129	121 Å²	121	84%	0.838	65%	0.648	S	S	*	*			trans	-73.4	73	171.6	30.4	-31.6	0	0	0	108.8	G130	P128-G130 PolarHBondContact O-N 2.97Å
129	A	50	Low	60.9	Low	95 Å²	95	128.3 Å²	128.3	79%	0.785	68%	0.684	S	S	*	*			trans	-89	79.8	173.1	0	0	0	0	0	108.4	Y127	Y127-A129 PolarHBondContact O-N 3.46Å
130	G	51.7	Low	58.6	Low	69 Å²	69	132.2 Å²	132.2	71%	0.711	71%	0.707	S	S	*	*			trans	-173.9	35.6	-176.2	0	0	0	0	0	116.1	P128	P128-G130 PolarHBondContact O-N 2.97Å
131	V	44.9	Very low	56.1	Low	132 Å²	132	135.7 Å²	135.7	80%	0.8	74%	0.744	S	S	*	*			trans	-141.2	104	153.2	-175.2	0	0	0	0	107.4
132	L	51	Low	53.9	Low	159 Å²	159	140 Å²	140	83%	0.832	77%	0.767	S	S	*	*			trans	-92	104.8	175.3	-159	142.9	0	0	0	106.1
133	D	41.2	Very low	51.6	Low	152 Å²	152	136.1 Å²	136.1	81%	0.813	76%	0.764	S	S	*	*			trans	-134.8	122.5	159.8	-96.9	-46.4	0	0	0	109.6	H135	D133-H135 PolarHBondContact O-N 2.72Å
134	H	53.7	Low	49.6	Very low	176 Å²	176	137.7 Å²	137.7	82%	0.815	78%	0.779	S	S	*	*			trans	-55.1	115.2	179.3	-92.4	-14.3	0	0	0	112.4
135	H	39	Very low	48.3	Very low	174 Å²	174	138.3 Å²	138.3	81%	0.806	78%	0.782	S	S	*	*				-169.9	103.6	126.3	-128.6	-53.4	0	0	0	110.5	D133	D133-H135 PolarHBondContact O-N 2.72Å
136	E	42.2	Very low	48.2	Very low	167 Å²	167	137.6 Å²	137.6	78%	0.78	78%	0.784	S	S	*	*			trans	-76.5	137.3	144.7	-89.2	-126.1	96.3	0	0	106.4
137	P	46.8	Very low	47.9	Very low	109 Å²	109	138.1 Å²	138.1	71%	0.708	79%	0.786	S	S	*	*				-149.8	135.2	72.1	35.9	-16.1	0	0	0	114.9
138	A	37.9	Very low	48.4	Very low	85 Å²	85	133.7 Å²	133.7	70%	0.702	78%	0.776	S	S	*	*			trans	168.1	111.7	137	0	0	0	0	0	110	E140	A138-E140 PolarHBondContact O-N 3.03Å
139	M	56.4	Low	49.1	Very low	173 Å²	173	134.6 Å²	134.6	85%	0.852	77%	0.769	S	S	*	*			trans	-44.1	126.2	150.3	174.8	-169.2	-84.7	0	0	109.3
140	E	50.2	Low	49.8	Very low	194 Å²	194	135.6 Å²	135.6	91%	0.907	77%	0.766	S	S	*	*			trans	160.3	115.2	144	-89	170.3	123.2	0	0	110.5	A138	A138-E140 PolarHBondContact O-N 3.03Å
141	G	44.6	Very low	50.7	Low	76 Å²	76	134.2 Å²	134.2	78%	0.784	75%	0.752	S	S	*	*			trans	157.7	61.7	172.4	0	0	0	0	0	113.8	G143	G141-G143 PolarHBondContact O-N 3.35Å
142	L	50.1	Low	52.3	Low	180 Å²	180	132.3 Å²	132.3	94%	0.942	73%	0.734	S	S	*	*			trans	-57	88.5	162.6	-81.2	159.6	0	0	0	109.5
143	G	46.3	Very low	53.5	Low	58 Å²	58	129 Å²	129	60%	0.598	72%	0.717	S	S	*	*			trans	-117.7	43.6	172.4	0	0	0	0	0	110.7	G141 T145	G141-G143 PolarHBondContact O-N 3.35Å; G143-T145 PolarHBondContact O-N 2.97Å
144	M	45.3	Very low	55.5	Low	166 Å²	166	126.6 Å²	126.6	82%	0.818	70%	0.704	S	S	*	*			trans	-67.3	93.4	164.4	-67.6	-59	146.4	0	0	106.6	P146	M144-P146 WeakPolarHBondContact O-CD 3.39Å
145	T	52.3	Low	57.2	Low	122 Å²	122	123.3 Å²	123.3	75%	0.748	69%	0.691	S	S	*	*			trans	-67	108.1	165.5	52.6	0	0	0	0	107.1	G143 H147	G143-T145 PolarHBondContact O-N 2.97Å; T145-H147 PolarHBondContact O-N 3.4Å
146	P	55.2	Low	59.6	Low	99 Å²	99	120.4 Å²	120.4	64%	0.643	68%	0.68	S	S	*	*			trans	-79.8	85.1	167.1	10.7	11.4	0	0	0	104.8	M144 L148	M144-P146 WeakPolarHBondContact O-CD 3.39Å; P146-L148 PolarHBondContact O-N 3.33Å
147	H	50.8	Low	61.8	Low	175 Å²	175	115.1 Å²	115.1	81%	0.81	66%	0.659	S	S	*	*			trans	-76.3	47.3	169.4	-174.9	-85.9	0	0	0	110.4	T145	T145-H147 PolarHBondContact O-N 3.4Å
148	L	58.3	Low	64	Low	117 Å²	117	113.8 Å²	113.8	61%	0.613	65%	0.649	S	S	*	*	S	Bend	trans	-125.7	94.6	165.4	-73.1	167.2	0	0	0	105.5	P146 T150	P146-L148 PolarHBondContact O-N 3.33Å; L148-T150 PolarHBondContact O-N 2.9Å
149	Q	62.9	Low	66.7	Low	148 Å²	148	113.2 Å²	113.2	69%	0.692	64%	0.637	S	S	*	*			trans	14.1	102.6	157.2	-168.3	163	-31.7	0	0	112.6	G151 E152	Q149-G151 CarbonylContact O-C 3.58Å; Q149-G151 PolarHBondContact O-N 3.02Å; Q149-E152 HydrophobicContact CB-CG 4.37Å; Q149-E152 PolarHBondContact O-N 2.87Å
150	T	65.3	Low	68.5	Low	116 Å²	116	111 Å²	111	71%	0.712	63%	0.628	S	S	*	*	H	α-helix	trans	-40.1	-26.1	-176	-55	0	0	0	0	115	L148 L154	L148-T150 PolarHBondContact O-N 2.9Å; T150-L154 HydrophobicContact CG2-CD1 4.3Å; T150-L154 WeakPolarHBondContact O-CD1 3.5Å; T150-L154 WeakPolarHBondContact O-CG 3.49Å; T150-L154 PolarHBondContact O-N 3.45Å
151	G	70.9	Confident	70.6	Confident	40 Å²	40	107.4 Å²	107.4	41%	0.412	61%	0.614	S	S	.	*	H	α-helix	trans	-68.1	-41.4	171.2	0	0	0	0	0	115.7	Q149 L154 I155	Q149-G151 CarbonylContact O-C 3.58Å; Q149-G151 PolarHBondContact O-N 3.02Å; G151-L154 PolarHBondContact O-N 3.33Å; G151-I155 WeakPolarHBondContact O-CD1 3.46Å; G151-I155 WeakPolarHBondContact O-CG1 3.47Å; G151-I155 PolarHBondContact O-N 2.58Å
152	E	77.3	Confident	72.9	Confident	92 Å²	92	109.5 Å²	109.5	43%	0.43	61%	0.607	S	S	.	*	H	α-helix	trans	-70.6	-39.9	-176.6	-62.7	-171	161.2	0	0	112.2	Q149 L154 I155 I156	Q149-E152 HydrophobicContact CB-CG 4.37Å; Q149-E152 PolarHBondContact O-N 2.87Å; E152-L154 VanDerWaalsContact C-N 3.33Å; E152-L154 PolarHBondContact O-N 3.45Å; E152-I155 PolarHBondContact O-N 2.84Å; E152-I156 WeakPolarHBondContact O-CG1 3.24Å; E152-I156 PolarHBondContact O-N 3.46Å
153	L	77.4	Confident	75	Confident	90 Å²	90	109 Å²	109	47%	0.471	59%	0.593	S	S	.	*	H	α-helix	trans	-66.7	-36.4	175	-164.5	79.2	0	0	0	111.6	I155 I156 T157	L153-I155 VanDerWaalsContact C-N 3.33Å; L153-I156 PolarHBondContact O-N 3.17Å; L153-T157 HydrophobicContact CG-CG2 4.41Å; L153-T157 WeakPolarHBondContact O-CB 3.5Å; L153-T157 VanDerWaalsContact O-CG2 3.25Å; L153-T157 WeakPolarHBondContact O-CG2 3.35Å; L153-T157 PolarHBondContact O-N 3.41Å; L153-T157 PolarHBondContact O-OG1 2.94Å
154	L	82.3	Confident	77.4	Confident	102 Å²	102	108.8 Å²	108.8	53%	0.534	59%	0.585	S	S	.	*	H	α-helix	trans	-64.9	-38.2	173.6	-73.4	176	0	0	0	111.5	T150 G151 E152 T157 T158	T150-L154 HydrophobicContact CG2-CD1 4.3Å; T150-L154 WeakPolarHBondContact O-CD1 3.5Å; T150-L154 WeakPolarHBondContact O-CG 3.49Å; T150-L154 PolarHBondContact O-N 3.45Å; G151-L154 PolarHBondContact O-N 3.33Å; E152-L154 VanDerWaalsContact C-N 3.33Å; E152-L154 PolarHBondContact O-N 3.45Å; L154-T157 WeakPolarHBondContact CA-OG1 3.3Å; L154-T157 PolarHBondContact O-OG1 3.37Å; L154-T157 VanDerWaalsContact O-OG1 3.11Å; L154-T158 VanDerWaalsContact O-CB 3.29Å; L154-T158 WeakPolarHBondContact O-CB 3.26Å; L154-T158 WeakPolarHBondContact O-CG2 3.43Å; L154-T158 PolarHBondContact O-N 3.09Å; L154-T158 PolarHBondContact O-OG1 2.91Å
155	I	89.5	Confident	79.6	Confident	107 Å²	107	103.3 Å²	103.3	55%	0.549	57%	0.566	S	S	.	*	H	α-helix	trans	-64.7	-49	175.7	-65.9	160.2	0	0	0	110.3	G151 E152 L153 T157 T158 V159	G151-I155 WeakPolarHBondContact O-CD1 3.46Å; G151-I155 WeakPolarHBondContact O-CG1 3.47Å; G151-I155 PolarHBondContact O-N 2.58Å; E152-I155 PolarHBondContact O-N 2.84Å; L153-I155 VanDerWaalsContact C-N 3.33Å; I155-T157 PolarHBondContact O-N 3.25Å; I155-T158 WeakPolarHBondContact CA-OG1 3.45Å; I155-T158 PolarHBondContact O-N 2.69Å; I155-T158 PolarHBondContact O-OG1 2.89Å; I155-V159 HydrophobicContact CG2-CG2 4.42Å; I155-V159 WeakPolarHBondContact O-CB 3.42Å; I155-V159 VanDerWaalsContact O-CG2 3.24Å; I155-V159 WeakPolarHBondContact O-CG2 3.39Å; I155-V159 PolarHBondContact O-N 2.93Å
156	I	89.5	Confident	81.5	Confident	113 Å²	113	100.5 Å²	100.5	58%	0.579	55%	0.549	S	S	*	.	H	α-helix	trans	-62.9	-45.8	-179.4	-64	165.1	0	0	0	110.9	E152 L153 V159 L160	E152-I156 WeakPolarHBondContact O-CG1 3.24Å; E152-I156 PolarHBondContact O-N 3.46Å; L153-I156 PolarHBondContact O-N 3.17Å; I156-V159 PolarHBondContact O-N 3.34Å; I156-L160 VanDerWaalsContact O-CB 3.29Å; I156-L160 WeakPolarHBondContact O-CB 3.5Å; I156-L160 PolarHBondContact O-N 3.25Å
157	T	89.6	Confident	83.2	Confident	56 Å²	56	100.1 Å²	100.1	34%	0.344	54%	0.54	S	S	.	.	H	α-helix	trans	-65.9	-40.2	179.8	51.8	0	0	0	0	112.7	L153 L154 I155 L160 L161	L153-T157 HydrophobicContact CG-CG2 4.41Å; L153-T157 WeakPolarHBondContact O-CB 3.5Å; L153-T157 VanDerWaalsContact O-CG2 3.25Å; L153-T157 WeakPolarHBondContact O-CG2 3.35Å; L153-T157 PolarHBondContact O-N 3.41Å; L153-T157 PolarHBondContact O-OG1 2.94Å; L154-T157 WeakPolarHBondContact CA-OG1 3.3Å; L154-T157 PolarHBondContact O-OG1 3.37Å; L154-T157 VanDerWaalsContact O-OG1 3.11Å; I155-T157 PolarHBondContact O-N 3.25Å; T157-L160 PolarHBondContact O-N 2.78Å; T157-L161 WeakPolarHBondContact O-CB 3.34Å; T157-L161 VanDerWaalsContact O-CG 3.26Å; T157-L161 WeakPolarHBondContact O-CG 3.32Å; T157-L161 PolarHBondContact O-N 3.34Å
158	T	92.1	Very high	85	Confident	81 Å²	81	94.3 Å²	94.3	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-66.5	-42.7	176.6	52.4	0	0	0	0	112.1	L154 I155 L161 L162	L154-T158 VanDerWaalsContact O-CB 3.29Å; L154-T158 WeakPolarHBondContact O-CB 3.26Å; L154-T158 WeakPolarHBondContact O-CG2 3.43Å; L154-T158 PolarHBondContact O-N 3.09Å; L154-T158 PolarHBondContact O-OG1 2.91Å; I155-T158 WeakPolarHBondContact CA-OG1 3.45Å; I155-T158 PolarHBondContact O-N 2.69Å; I155-T158 PolarHBondContact O-OG1 2.89Å; T158-L161 PolarHBondContact O-N 3.48Å; T158-L162 WeakPolarHBondContact O-CB 3.46Å; T158-L162 PolarHBondContact O-N 3.26Å
159	V	94.8	Very high	86.3	Confident	73 Å²	73	94.4 Å²	94.4	44%	0.442	52%	0.523	S	S	.	.	H	α-helix	trans	-63.2	-43.7	175.6	172.8	0	0	0	0	110.8	I155 I156 L161 L162 W163	I155-V159 HydrophobicContact CG2-CG2 4.42Å; I155-V159 WeakPolarHBondContact O-CB 3.42Å; I155-V159 VanDerWaalsContact O-CG2 3.24Å; I155-V159 WeakPolarHBondContact O-CG2 3.39Å; I155-V159 PolarHBondContact O-N 2.93Å; I156-V159 PolarHBondContact O-N 3.34Å; V159-L161 PolarHBondContact O-N 2.91Å; V159-L162 PolarHBondContact O-N 3.43Å; V159-W163 WeakPolarHBondContact O-CB 3.16Å; V159-W163 PolarHBondContact O-N 3.43Å
160	L	94	Very high	87.4	Confident	125 Å²	125	93.6 Å²	93.6	65%	0.654	52%	0.518	S	S	*	.	H	α-helix	trans	-59.8	-46.6	177	-167.9	90	0	0	0	111.5	I156 T157 W163 A164	I156-L160 VanDerWaalsContact O-CB 3.29Å; I156-L160 WeakPolarHBondContact O-CB 3.5Å; I156-L160 PolarHBondContact O-N 3.25Å; T157-L160 PolarHBondContact O-N 2.78Å; L160-W163 PolarHBondContact O-N 3.04Å; L160-A164 WeakPolarHBondContact O-CB 3.36Å; L160-A164 PolarHBondContact O-N 2.93Å
161	L	93.4	Very high	88.2	Confident	120 Å²	120	91.8 Å²	91.8	63%	0.628	51%	0.509	S	S	*	.	H	α-helix	trans	-65.6	-40.3	178.4	-72.8	171.8	0	0	0	112.2	T157 T158 V159 A164 A165	T157-L161 WeakPolarHBondContact O-CB 3.34Å; T157-L161 VanDerWaalsContact O-CG 3.26Å; T157-L161 WeakPolarHBondContact O-CG 3.32Å; T157-L161 PolarHBondContact O-N 3.34Å; T158-L161 PolarHBondContact O-N 3.48Å; V159-L161 PolarHBondContact O-N 2.91Å; L161-A164 PolarHBondContact O-N 3.31Å; L161-A165 WeakPolarHBondContact O-CB 3.29Å; L161-A165 PolarHBondContact O-N 3.01Å
162	L	93.7	Very high	88.6	Confident	120 Å²	120	99.1 Å²	99.1	63%	0.628	52%	0.524	S	S	*	.	H	α-helix	trans	-62.3	-46.7	176.9	-166.4	94.5	0	0	0	111	T158 V159 A165 V166	T158-L162 WeakPolarHBondContact O-CB 3.46Å; T158-L162 PolarHBondContact O-N 3.26Å; V159-L162 PolarHBondContact O-N 3.43Å; L162-A165 PolarHBondContact O-N 3.47Å; L162-V166 WeakPolarHBondContact O-CG2 3.45Å; L162-V166 PolarHBondContact O-N 2.95Å
163	W	95.1	Very high	88.4	Confident	169 Å²	169	100 Å²	100	64%	0.64	53%	0.529	S	S	*	.	H	α-helix	trans	-62.9	-42.7	176.4	-91.7	85.6	0	0	0	112.4	V159 L160 A165 V166 I167	V159-W163 WeakPolarHBondContact O-CB 3.16Å; V159-W163 PolarHBondContact O-N 3.43Å; L160-W163 PolarHBondContact O-N 3.04Å; W163-A165 VanDerWaalsContact C-N 3.34Å; W163-A165 PolarHBondContact O-N 3.41Å; W163-V166 PolarHBondContact O-N 3.18Å; W163-I167 HydrophobicContact CE3-CD1 4.34Å; W163-I167 WeakPolarHBondContact O-CB 3.37Å; W163-I167 WeakPolarHBondContact O-CD1 3.48Å; W163-I167 VanDerWaalsContact O-CG1 3.24Å; W163-I167 WeakPolarHBondContact O-CG1 3.45Å; W163-I167 PolarHBondContact O-N 3.5Å
164	A	94.9	Very high	88	Confident	53 Å²	53	103.2 Å²	103.2	44%	0.438	54%	0.535	S	S	.	.	H	α-helix	trans	-61.6	-40.9	176.3	0	0	0	0	0	112.2	L160 L161 I167 A168	L160-A164 WeakPolarHBondContact O-CB 3.36Å; L160-A164 PolarHBondContact O-N 2.93Å; L161-A164 PolarHBondContact O-N 3.31Å; A164-I167 PolarHBondContact O-N 2.9Å; A164-A168 VanDerWaalsContact O-CB 3.32Å; A164-A168 WeakPolarHBondContact O-CB 3.49Å; A164-A168 PolarHBondContact O-N 3.46Å
165	A	91.9	Very high	87.2	Confident	52 Å²	52	102 Å²	102	43%	0.43	53%	0.53	S	S	.	.	H	α-helix	trans	-65.3	-42.7	176.7	0	0	0	0	0	112.2	L161 L162 W163 A168 L169	L161-A165 WeakPolarHBondContact O-CB 3.29Å; L161-A165 PolarHBondContact O-N 3.01Å; L162-A165 PolarHBondContact O-N 3.47Å; W163-A165 VanDerWaalsContact C-N 3.34Å; W163-A165 PolarHBondContact O-N 3.41Å; A165-A168 PolarHBondContact O-N 3.25Å; A165-L169 WeakPolarHBondContact O-CG 3.49Å; A165-L169 PolarHBondContact O-N 3.32Å
166	V	93.7	Very high	85.8	Confident	62 Å²	62	102.9 Å²	102.9	38%	0.376	53%	0.534	S	S	.	.	H	α-helix	trans	-61.2	-49.4	174.8	172.1	0	0	0	0	110.3	L162 W163 A168 L169 F170	L162-V166 WeakPolarHBondContact O-CG2 3.45Å; L162-V166 PolarHBondContact O-N 2.95Å; W163-V166 PolarHBondContact O-N 3.18Å; V166-A168 VanDerWaalsContact C-N 3.31Å; V166-A168 PolarHBondContact O-N 2.8Å; V166-L169 WeakPolarHBondContact O-CB 3.15Å; V166-L169 PolarHBondContact O-N 2.93Å; V166-F170 HydrophobicContact CG1-CD2 3.66Å; V166-F170 HydrophobicContact CG1-CE2 3.71Å; V166-F170 VanDerWaalsContact O-CD2 3.29Å; V166-F170 WeakPolarHBondContact O-CD2 3.17Å; V166-F170 PolarHBondContact O-N 2.94Å
167	I	90.4	Very high	84.5	Confident	91 Å²	91	102.1 Å²	102.1	47%	0.467	53%	0.53	S	S	.	.	H	α-helix	trans	-59.1	-42.9	177.3	-66.5	164.3	0	0	0	110.7	W163 A164 L169 F170 C171	W163-I167 HydrophobicContact CE3-CD1 4.34Å; W163-I167 WeakPolarHBondContact O-CB 3.37Å; W163-I167 WeakPolarHBondContact O-CD1 3.48Å; W163-I167 VanDerWaalsContact O-CG1 3.24Å; W163-I167 WeakPolarHBondContact O-CG1 3.45Å; W163-I167 PolarHBondContact O-N 3.5Å; A164-I167 PolarHBondContact O-N 2.9Å; I167-L169 PolarHBondContact O-N 3.37Å; I167-F170 PolarHBondContact O-N 3.36Å; I167-C171 WeakPolarHBondContact O-CB 3.27Å; I167-C171 PolarHBondContact O-N 2.82Å; I167-C171 PolarHBondContact O-SG 3.02Å
168	A	87.1	Confident	83.1	Confident	54 Å²	54	104.5 Å²	104.5	45%	0.446	54%	0.535	S	S	.	.	H	α-helix	trans	-63.8	-39.1	177.6	0	0	0	0	0	112.7	A164 A165 V166 C171 R172	A164-A168 VanDerWaalsContact O-CB 3.32Å; A164-A168 WeakPolarHBondContact O-CB 3.49Å; A164-A168 PolarHBondContact O-N 3.46Å; A165-A168 PolarHBondContact O-N 3.25Å; V166-A168 VanDerWaalsContact C-N 3.31Å; V166-A168 PolarHBondContact O-N 2.8Å; A168-C171 PolarHBondContact O-N 3.37Å; A168-R172 PolarHBondContact O-N 2.77Å
169	L	87.3	Confident	81.5	Confident	119 Å²	119	104.6 Å²	104.6	62%	0.623	53%	0.533	S	S	*	.	H	α-helix	trans	-64.5	-43.9	173.6	-75.6	167.9	0	0	0	111.3	A165 V166 I167 R172 Q173	A165-L169 WeakPolarHBondContact O-CG 3.49Å; A165-L169 PolarHBondContact O-N 3.32Å; V166-L169 WeakPolarHBondContact O-CB 3.15Å; V166-L169 PolarHBondContact O-N 2.93Å; I167-L169 PolarHBondContact O-N 3.37Å; L169-R172 PolarHBondContact O-N 2.84Å; L169-Q173 VanDerWaalsContact O-CB 3.27Å; L169-Q173 WeakPolarHBondContact O-CB 3.46Å; L169-Q173 PolarHBondContact O-N 3.05Å
170	F	84.8	Confident	79.7	Confident	131 Å²	131	106.5 Å²	106.5	58%	0.575	54%	0.541	S	S	*	.	H	α-helix	trans	-63.9	-40.4	174.6	-89.2	-81.3	0	0	0	112	V166 I167 Q173 Y174	V166-F170 HydrophobicContact CG1-CD2 3.66Å; V166-F170 HydrophobicContact CG1-CE2 3.71Å; V166-F170 VanDerWaalsContact O-CD2 3.29Å; V166-F170 WeakPolarHBondContact O-CD2 3.17Å; V166-F170 PolarHBondContact O-N 2.94Å; I167-F170 PolarHBondContact O-N 3.36Å; F170-Q173 PolarHBondContact O-N 3.01Å; F170-Y174 WeakPolarHBondContact O-CB 3.42Å; F170-Y174 PolarHBondContact O-N 3.42Å
171	C	82.4	Confident	78.1	Confident	78 Å²	78	106.3 Å²	106.3	53%	0.527	54%	0.54	S	S	.	.	H	α-helix	trans	-62.3	-43.9	174.4	-71.4	0	0	0	0	111.2	I167 A168 Y174 D175	I167-C171 WeakPolarHBondContact O-CB 3.27Å; I167-C171 PolarHBondContact O-N 2.82Å; I167-C171 PolarHBondContact O-SG 3.02Å; A168-C171 PolarHBondContact O-N 3.37Å; C171-Y174 PolarHBondContact O-N 2.85Å; C171-D175 VanDerWaalsContact O-CB 3.3Å; C171-D175 WeakPolarHBondContact O-CB 3.5Å; C171-D175 PolarHBondContact O-N 3.17Å
172	R	79.1	Confident	76.3	Confident	194 Å²	194	104.8 Å²	104.8	73%	0.732	54%	0.54	S	S	*	.	H	α-helix	trans	-66.5	-40.8	175	-74.4	-152	175.1	-169.6	-0.8	112.8	A168 L169 Y174 D175 I176	A168-R172 PolarHBondContact O-N 2.77Å; L169-R172 PolarHBondContact O-N 2.84Å; R172-Y174 VanDerWaalsContact C-N 3.32Å; R172-D175 PolarHBondContact O-N 3.06Å; R172-I176 WeakPolarHBondContact O-CB 3.3Å; R172-I176 WeakPolarHBondContact O-CD1 3.09Å; R172-I176 WeakPolarHBondContact O-CG1 3.12Å; R172-I176 PolarHBondContact O-N 3.26Å
173	Q	73.1	Confident	74.4	Confident	111 Å²	111	105.3 Å²	105.3	52%	0.519	54%	0.543	S	S	.	.	H	α-helix	trans	-65.7	-39	176.9	-173.1	168.4	0.1	0	0	111.2	L169 F170 I176 I177	L169-Q173 VanDerWaalsContact O-CB 3.27Å; L169-Q173 WeakPolarHBondContact O-CB 3.46Å; L169-Q173 PolarHBondContact O-N 3.05Å; F170-Q173 PolarHBondContact O-N 3.01Å; Q173-I176 PolarHBondContact O-N 3.45Å; Q173-I177 HydrophobicContact CG-CD1 4.04Å; Q173-I177 WeakPolarHBondContact O-CD1 3.3Å; Q173-I177 WeakPolarHBondContact O-CG1 3.45Å; Q173-I177 PolarHBondContact O-N 2.84Å
174	Y	68.9	Low	72.5	Confident	156 Å²	156	102.4 Å²	102.4	61%	0.612	55%	0.549	S	S	*	.	H	α-helix	trans	-69.9	-36.4	175.3	-168.9	-97.1	0	0	0	112.2	F170 C171 R172 I177 K178	F170-Y174 WeakPolarHBondContact O-CB 3.42Å; F170-Y174 PolarHBondContact O-N 3.42Å; C171-Y174 PolarHBondContact O-N 2.85Å; R172-Y174 VanDerWaalsContact C-N 3.32Å; Y174-I177 PolarHBondContact O-N 3.29Å; Y174-K178 HydrophobicContact CE1-CB 4.49Å; Y174-K178 HydrophobicContact CE1-CD 4.06Å; Y174-K178 WeakPolarHBondContact O-CB 3.24Å; Y174-K178 PolarHBondContact O-N 3.36Å
175	D	65.8	Low	70.4	Confident	78 Å²	78	105.2 Å²	105.2	42%	0.417	56%	0.561	S	S	.	*	H	α-helix	trans	-61.8	-46.8	172.1	-152.3	49.2	0	0	0	110.7	C171 R172 I177 K178 D179	C171-D175 VanDerWaalsContact O-CB 3.3Å; C171-D175 WeakPolarHBondContact O-CB 3.5Å; C171-D175 PolarHBondContact O-N 3.17Å; R172-D175 PolarHBondContact O-N 3.06Å; D175-I177 VanDerWaalsContact C-N 3.33Å; D175-I177 PolarHBondContact O-N 3.3Å; D175-K178 PolarHBondContact O-N 3.07Å; D175-D179 VanDerWaalsContact O-CB 3.3Å; D175-D179 WeakPolarHBondContact O-CB 3.39Å; D175-D179 VanDerWaalsContact O-CG 3.25Å; D175-D179 PolarHBondContact O-N 3.27Å
176	I	61	Low	68.4	Low	125 Å²	125	112.3 Å²	112.3	64%	0.641	58%	0.582	S	S	*	*	H	α-helix	trans	-60.1	-40.7	175.8	-67.6	163.9	0	0	0	111.8	R172 Q173 N180	R172-I176 WeakPolarHBondContact O-CB 3.3Å; R172-I176 WeakPolarHBondContact O-CD1 3.09Å; R172-I176 WeakPolarHBondContact O-CG1 3.12Å; R172-I176 PolarHBondContact O-N 3.26Å; Q173-I176 PolarHBondContact O-N 3.45Å; I176-N180 WeakPolarHBondContact O-CB 3.22Å; I176-N180 PolarHBondContact O-N 3.46Å
177	I	60.6	Low	66.1	Low	96 Å²	96	117.9 Å²	117.9	49%	0.492	60%	0.604	S	S	.	*	H	α-helix	trans	-74.2	-39.6	179.6	-65.7	162.2	0	0	0	111.1	Q173 Y174 D175 N180	Q173-I177 HydrophobicContact CG-CD1 4.04Å; Q173-I177 WeakPolarHBondContact O-CD1 3.3Å; Q173-I177 WeakPolarHBondContact O-CG1 3.45Å; Q173-I177 PolarHBondContact O-N 2.84Å; Y174-I177 PolarHBondContact O-N 3.29Å; D175-I177 VanDerWaalsContact C-N 3.33Å; D175-I177 PolarHBondContact O-N 3.3Å; I177-N180 WeakPolarHBondContact O-CB 3.49Å; I177-N180 PolarHBondContact O-N 3.37Å
178	K	61.6	Low	64	Low	106 Å²	106	123.7 Å²	123.7	46%	0.461	63%	0.626	S	S	.	*	H	α-helix	trans	-73.4	-39.7	-178.1	-174.4	-177.8	65.6	177.4	0	112.4	Y174 D175 N180 D181	Y174-K178 HydrophobicContact CE1-CB 4.49Å; Y174-K178 HydrophobicContact CE1-CD 4.06Å; Y174-K178 WeakPolarHBondContact O-CB 3.24Å; Y174-K178 PolarHBondContact O-N 3.36Å; D175-K178 PolarHBondContact O-N 3.07Å; K178-N180 PolarHBondContact O-N 3.48Å; K178-D181 PolarHBondContact O-N 3.34Å
179	D	57.8	Low	61.8	Low	84 Å²	84	124.5 Å²	124.5	45%	0.449	63%	0.632	S	S	.	*	H	α-helix	trans	-69.4	-24.2	177.7	-68.6	-19.5	0	0	0	111.6	D175 D181 S182	D175-D179 VanDerWaalsContact O-CB 3.3Å; D175-D179 WeakPolarHBondContact O-CB 3.39Å; D175-D179 VanDerWaalsContact O-CG 3.25Å; D175-D179 PolarHBondContact O-N 3.27Å; D179-D181 VanDerWaalsContact C-N 3.35Å; D179-D181 PolarHBondContact O-N 3.39Å; D179-S182 PolarHBondContact O-N 2.82Å; D179-S182 PolarHBondContact O-OG 3.34Å
180	N	58	Low	59.3	Low	112 Å²	112	128.4 Å²	128.4	60%	0.599	64%	0.644	S	S	*	*	H	α-helix	trans	-67.6	-30.1	174.9	-177.5	77	0	0	0	113.4	I176 I177 K178 S182	I176-N180 WeakPolarHBondContact O-CB 3.22Å; I176-N180 PolarHBondContact O-N 3.46Å; I177-N180 WeakPolarHBondContact O-CB 3.49Å; I177-N180 PolarHBondContact O-N 3.37Å; K178-N180 PolarHBondContact O-N 3.48Å; N180-S182 VanDerWaalsContact C-N 3.26Å; N180-S182 PolarHBondContact O-N 3.48Å
181	D	59	Low	57	Low	121 Å²	121	133.6 Å²	133.6	65%	0.647	66%	0.66	S	S	*	*	H	α-helix	trans	-73.6	-17.8	178.1	-68.7	-29	0	0	0	112.9	K178 D179	K178-D181 PolarHBondContact O-N 3.34Å; D179-D181 VanDerWaalsContact C-N 3.35Å; D179-D181 PolarHBondContact O-N 3.39Å
182	S	56.5	Low	54.7	Low	89 Å²	89	136 Å²	136	62%	0.622	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-12.9	-179.6	71.8	0	0	0	0	114.7	D179 N180	D179-S182 PolarHBondContact O-N 2.82Å; D179-S182 PolarHBondContact O-OG 3.34Å; N180-S182 VanDerWaalsContact C-N 3.26Å; N180-S182 PolarHBondContact O-N 3.48Å
183	N	54	Low	52.7	Low	130 Å²	130	133.7 Å²	133.7	70%	0.695	68%	0.676	S	S	*	*	S	Bend	trans	-94.2	-3.9	-175.3	-169.4	19.6	0	0	0	114.6	T185	N183-T185 PolarHBondContact O-N 3.49Å
184	S	54.4	Low	50.6	Low	108 Å²	108	135.1 Å²	135.1	76%	0.755	69%	0.692	S	S	*	*	S	Bend	trans	-83	-6.8	178.9	-174.2	0	0	0	0	114.4
185	T	50.3	Low	48.9	Very low	113 Å²	113	136 Å²	136	69%	0.693	70%	0.702	S	S	*	*	S	Bend	trans	-146.8	59.6	-169	18.6	0	0	0	0	112.9	N183	N183-T185 PolarHBondContact O-N 3.49Å
186	K	50.7	Low	47.2	Very low	201 Å²	201	136.7 Å²	136.7	87%	0.874	72%	0.719	S	S	*	*			trans	160.5	96	143.8	-92.3	167.4	-179.1	176.4	0	110.1
187	E	45.9	Very low	45.9	Very low	178 Å²	178	136.7 Å²	136.7	83%	0.832	73%	0.729	S	S	*	*			trans	-158.8	80.5	140	-122.6	-162.8	137.6	0	0	111.3
188	K	45.6	Very low	44.6	Very low	214 Å²	214	137.4 Å²	137.4	93%	0.93	74%	0.743	S	S	*	*			trans	-113.4	66.8	157.7	-156	-165.3	-161.5	-173.1	0	108.1
189	A	40.5	Very low	43	Very low	70 Å²	70	136.5 Å²	136.5	58%	0.579	75%	0.75	S	S	*	*	S	Bend	trans	-166.1	99.1	159.7	0	0	0	0	0	113.4
190	K	34.7	Very low	41.5	Very low	201 Å²	201	141.3 Å²	141.3	87%	0.874	76%	0.763	S	S	*	*			trans	69.1	105.9	136.8	-63.4	-179.8	180	-179.1	0	119
191	R	36.4	Very low	40	Very low	240 Å²	240	145.8 Å²	145.8	91%	0.906	77%	0.773	S	S	*	*			trans	-46.3	154.8	154.7	-57	-177.2	179.8	-168.8	-1.2	112.6
192	P	35.4	Very low	38.5	Very low	130 Å²	130	146.6 Å²	146.6	84%	0.844	78%	0.777	S	S	*	*				-123.7	127.5	120.8	2.3	18.7	0	0	0	113.1
193	L	36.4	Very low	37.4	Very low	145 Å²	145	147.8 Å²	147.8	76%	0.759	78%	0.781	S	S	*	*			trans	-53.3	131.6	157.4	178.3	88.9	0	0	0	110.7
194	V	28.8	Very low	36.4	Very low	141 Å²	141	146.7 Å²	146.7	86%	0.855	78%	0.784	S	S	*	*				-158.5	115.7	125.6	174.9	0	0	0	0	108.7
195	Q	32.3	Very low	35.5	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.813	79%	0.79	S	S	*	*			trans	-91.2	136.6	164.6	167.1	-179.3	-23.1	0	0	108.1
196	A	31.8	Very low	34.7	Very low	93 Å²	93	144.5 Å²	144.5	77%	0.769	79%	0.79	S	S	*	*			trans	175.9	130.9	133.8	0	0	0	0	0	112.3
197	S	33.7	Very low	33.9	Very low	124 Å²	124	140.8 Å²	140.8	87%	0.867	79%	0.789	S	S	*	*			trans	-69.1	155.4	167.3	-57.3	0	0	0	0	112.5
198	S	32.9	Very low	33.6	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	79%	0.788	S	S	*	*			trans	-43.6	145.2	174.4	-173.2	0	0	0	0	115.9
199	S	27.3	Very low	33.7	Very low	87 Å²	87	132.9 Å²	132.9	61%	0.608	78%	0.778	S	S	*	*				169.9	146.7	107.4	-61.4	0	0	0	0	116.1
200	Y	26.4	Very low	33.6	Very low	186 Å²	186	136.5 Å²	136.5	73%	0.729	79%	0.786	S	S	*	*			trans	94	134.8	146.3	-68.1	-69.9	0	0	0	124.2
201	Y	27.4	Very low	33.5	Very low	206 Å²	206	137.4 Å²	137.4	81%	0.808	79%	0.785	S	S	*	*			trans	76	141.9	160.2	-55.3	-62.6	0	0	0	117.8
202	N	27.7	Very low	33.8	Very low	138 Å²	138	134.7 Å²	134.7	74%	0.738	78%	0.783	S	S	*	*			cis	-169.1	139	-14.1	-164.4	10.1	0	0	0	106.6
203	T	32	Very low	33.8	Very low	114 Å²	114	135.5 Å²	135.5	70%	0.699	78%	0.78	S	S	*	*			trans	23.1	132.2	146.4	-45.6	0	0	0	0	122.9
204	S	34.3	Very low	33.9	Very low	107 Å²	107	132.2 Å²	132.2	75%	0.748	78%	0.781	S	S	*	*			trans	100.1	121	137.9	61.2	0	0	0	0	122.8
205	A	34.5	Very low	34.7	Very low	108 Å²	108	130.5 Å²	130.5	89%	0.893	78%	0.782	S	S	*	*			trans	73.5	125.7	133	0	0	0	0	0	120.2
206	G	33.4	Very low	35.3	Very low	67 Å²	67	128.8 Å²	128.8	69%	0.691	78%	0.783	S	S	*	*			trans	146.9	85.8	152.7	0	0	0	0	0	115.7
207	S	33.8	Very low	35.9	Very low	123 Å²	123	136 Å²	136	86%	0.86	79%	0.79	S	S	*	*			trans	57.1	113.5	130.9	-43.5	0	0	0	0	120.6
208	S	39.6	Very low	36.9	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	81%	0.812	S	S	*	*			trans	-60.2	161.8	144.3	-51.5	0	0	0	0	109.8
209	P	48.5	Very low	37.1	Very low	112 Å²	112	140.5 Å²	140.5	73%	0.727	81%	0.814	S	S	*	*				-159.9	-168.6	52.1	39.3	-12.8	0	0	0	117.9
210	I	37.5	Very low	37.6	Very low	146 Å²	146	143.3 Å²	143.3	75%	0.749	82%	0.824	S	S	*	*			trans	103.5	122.8	147.7	-66.2	160.7	0	0	0	121
211	Y	34.2	Very low	38.2	Very low	219 Å²	219	140.9 Å²	140.9	86%	0.859	83%	0.83	S	S	*	*			trans	-38.9	154.3	165.2	-59.8	-99.5	0	0	0	118.9
212	H	41.3	Very low	38.8	Very low	184 Å²	184	137.1 Å²	137.1	85%	0.852	83%	0.831	S	S	*	*				-164.1	142.7	116.3	-147.9	-82	0	0	0	114.4
213	N	35.8	Very low	39.5	Very low	147 Å²	147	137.1 Å²	137.1	79%	0.786	84%	0.837	S	S	*	*			trans	-59.8	151.7	171.5	-89.1	-28.3	0	0	0	115.6
214	G	39	Very low	40	Very low	76 Å²	76	138.6 Å²	138.6	78%	0.784	85%	0.846	S	S	*	*				97.3	122.4	120.3	0	0	0	0	0	118.5
215	A	45.1	Very low	40.4	Very low	104 Å²	104	140.9 Å²	140.9	86%	0.86	85%	0.853	S	S	*	*				-178	112.5	125.5	0	0	0	0	0	111.3
216	V	45	Very low	40.9	Very low	139 Å²	139	143.4 Å²	143.4	84%	0.842	85%	0.85	S	S	*	*			trans	-69.3	135.9	156.5	169.5	0	0	0	0	108.5
217	R	45	Very low	41.5	Very low	244 Å²	244	149.8 Å²	149.8	92%	0.921	86%	0.863	S	S	*	*			trans	-146.3	115.9	145.2	-78	-159.4	159.4	174.2	-7.1	111.2
218	S	53.6	Low	42.2	Very low	189 Å²	189	152.2 Å²	152.2	100%	1.322	86%	0.863	S	S	*	*			trans	23	0	150.7	-134.7	0	0	0	0	121.4

Retrieved 218 of 218 residues in 171.9 ms (Link to these results)

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