A0A077ZA14_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZA14, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 227 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	42.6	Very low	39.6	Very low	245 Å²	245	162.2 Å²	162.2	100%	1.207	86%	0.855	S	S	*	*				0	109.9	0	-73.7	166.9	155.9	0	0	107.2
2	K	41.1	Very low	38.9	Very low	222 Å²	222	165.6 Å²	165.6	97%	0.965	87%	0.867	S	S	*	*			trans	-137	81.5	178.4	-145.4	171.5	-173	178.1	0	107
3	S	37.4	Very low	38.4	Very low	92 Å²	92	157.7 Å²	157.7	64%	0.643	85%	0.85	S	S	*	*			trans	-99.2	166.9	166.4	48.8	0	0	0	0	108.5
4	E	40.7	Very low	38.1	Very low	164 Å²	164	155.1 Å²	155.1	77%	0.766	85%	0.85	S	S	*	*			trans	88.6	99.6	168.4	-52.5	171.4	-164	0	0	115
5	H	41.3	Very low	38.3	Very low	170 Å²	170	156.8 Å²	156.8	79%	0.787	85%	0.846	S	S	*	*				179	117.2	87.4	-112.5	-80.4	0	0	0	109.2	P7	H5-P7 WeakPolarHBondContact O-CD 3.34Å
6	L	35.1	Very low	38.3	Very low	170 Å²	170	158.9 Å²	158.9	89%	0.89	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-72.7	126.2	160.9	-86.9	149.9	0	0	0	108.1
7	P	51.2	Low	38.3	Very low	118 Å²	118	158.6 Å²	158.6	77%	0.766	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-89.8	141.7	161.6	5.5	14	0	0	0	110.3	H5	H5-P7 WeakPolarHBondContact O-CD 3.34Å
8	E	37	Very low	38.3	Very low	181 Å²	181	152.7 Å²	152.7	85%	0.846	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-62	146.5	-170.6	-71.6	161.8	120.2	0	0	115.2	S10	E8-S10 PolarHBondContact O-N 3.25Å
9	M	31.8	Very low	38.4	Very low	201 Å²	201	150.6 Å²	150.6	99%	0.99	82%	0.816	S	S	*	*			trans	-55.6	113.7	156.7	-69.2	-175	152.8	0	0	109.9
10	S	39.4	Very low	38.6	Very low	110 Å²	110	152.8 Å²	152.8	77%	0.769	82%	0.817	S	S	*	*			trans	-133	140.3	166.9	61.6	0	0	0	0	111.6	E8	E8-S10 PolarHBondContact O-N 3.25Å
11	S	38.2	Very low	38.8	Very low	111 Å²	111	147.8 Å²	147.8	78%	0.776	80%	0.802	S	S	*	*			trans	82.5	83.4	159.2	-168.3	0	0	0	0	117.8	G13	S11-G13 PolarHBondContact O-N 3.46Å
12	M	31	Very low	38.8	Very low	203 Å²	203	143.1 Å²	143.1	100%	1	78%	0.775	S	S	*	*			trans	-42.2	101.8	144	-71.1	161.2	92.6	0	0	110.8
13	G	32.7	Very low	38.8	Very low	63 Å²	63	142.3 Å²	142.3	65%	0.649	77%	0.766	S	S	*	*			trans	-124.9	66.6	171.8	0	0	0	0	0	109.6	S11 K15	S11-G13 PolarHBondContact O-N 3.46Å; G13-K15 PolarHBondContact O-N 3.09Å
14	S	34	Very low	39.2	Very low	121 Å²	121	141 Å²	141	85%	0.846	76%	0.761	S	S	*	*			trans	-66.9	83.2	170.8	-169.6	0	0	0	0	109.2
15	K	40.8	Very low	39.5	Very low	181 Å²	181	136.7 Å²	136.7	79%	0.787	75%	0.748	S	S	*	*			trans	-104.7	100.3	154.8	-93.5	177.7	174.2	172.7	0	105.4	G13 I17	G13-K15 PolarHBondContact O-N 3.09Å; K15-I17 PolarHBondContact O-N 3.25Å
16	E	38.5	Very low	39.6	Very low	191 Å²	191	134.2 Å²	134.2	89%	0.893	74%	0.74	S	S	*	*			trans	-54.4	86.7	156.2	-83.4	-175.8	133.9	0	0	107.4	G18	E16-G18 PolarHBondContact O-N 3.31Å
17	I	38.3	Very low	40.1	Very low	154 Å²	154	132.3 Å²	132.3	79%	0.79	73%	0.731	S	S	*	*			trans	-65.6	99.8	164.3	-71.3	167	0	0	0	103.4	K15 N19	K15-I17 PolarHBondContact O-N 3.25Å; I17-N19 PolarHBondContact O-N 2.99Å
18	G	37.4	Very low	40	Very low	51 Å²	51	129.9 Å²	129.9	53%	0.526	72%	0.721	S	S	.	*			trans	-39.5	132.1	174	0	0	0	0	0	109.2	E16 K20	E16-G18 PolarHBondContact O-N 3.31Å; G18-K20 PolarHBondContact O-N 3.39Å
19	N	40.8	Very low	40.4	Very low	114 Å²	114	126.3 Å²	126.3	61%	0.61	71%	0.711	S	S	*	*	S	Bend	trans	-60.3	39.9	-169.8	-162.4	18.1	0	0	0	114.7	I17 G21 K22	I17-N19 PolarHBondContact O-N 2.99Å; N19-G21 VanDerWaalsContact C-N 3.27Å; N19-K22 WeakPolarHBondContact OD1-CD 3.38Å; N19-K22 WeakPolarHBondContact OD1-CG 3.45Å
20	K	42.8	Very low	40.9	Very low	193 Å²	193	120.6 Å²	120.6	84%	0.839	69%	0.688	S	S	*	*			trans	-78.4	-10.5	174.1	-70	-174.7	176.3	-179.1	0	112.2	G18	G18-K20 PolarHBondContact O-N 3.39Å
21	G	42.7	Very low	41.2	Very low	48 Å²	48	120.7 Å²	120.7	50%	0.495	68%	0.684	S	S	.	*	H	α-helix	trans	-83.4	-22.6	-177.2	0	0	0	0	0	115.9	N19 W23 A24 S25	N19-G21 VanDerWaalsContact C-N 3.27Å; G21-W23 VanDerWaalsContact C-N 3.32Å; G21-W23 PolarHBondContact O-N 3.32Å; G21-A24 PolarHBondContact O-N 3.01Å; G21-S25 PolarHBondContact O-N 3.22Å; G21-S25 VanDerWaalsContact O-N 3.16Å
22	K	42.3	Very low	41.5	Very low	148 Å²	148	122.9 Å²	122.9	64%	0.643	69%	0.687	S	S	*	*	H	α-helix	trans	-69.4	-28.8	-174.6	-75	-171.1	-179.5	-174.7	0	113.6	N19	N19-K22 WeakPolarHBondContact OD1-CD 3.38Å; N19-K22 WeakPolarHBondContact OD1-CG 3.45Å
23	W	42	Very low	42.1	Very low	205 Å²	205	116.2 Å²	116.2	78%	0.777	66%	0.66	S	S	*	*	H	α-helix	trans	-78.9	-32.7	175.1	-66.2	99.4	0	0	0	112.8	G21 L26 L27	G21-W23 VanDerWaalsContact C-N 3.32Å; G21-W23 PolarHBondContact O-N 3.32Å; W23-L26 PolarHBondContact O-N 3.09Å; W23-L27 PolarHBondContact O-N 3.27Å
24	A	45.8	Very low	42.8	Very low	64 Å²	64	119 Å²	119	53%	0.529	67%	0.667	S	S	.	*	H	α-helix	trans	-68.4	-37.8	177	0	0	0	0	0	111.7	G21 L26 L27 A28	G21-A24 PolarHBondContact O-N 3.01Å; A24-L26 VanDerWaalsContact C-N 3.32Å; A24-L26 PolarHBondContact O-N 3.03Å; A24-L27 PolarHBondContact O-N 2.83Å; A24-A28 PolarHBondContact O-N 3.02Å
25	S	46.6	Very low	43.7	Very low	73 Å²	73	117.8 Å²	117.8	51%	0.51	65%	0.651	S	S	.	*	H	α-helix	trans	-66.9	-30	176.4	153.1	0	0	0	0	113.2	G21 L27 A28 T29	G21-S25 PolarHBondContact O-N 3.22Å; G21-S25 VanDerWaalsContact O-N 3.16Å; S25-L27 VanDerWaalsContact C-N 3.32Å; S25-A28 PolarHBondContact O-N 2.91Å; S25-T29 PolarHBondContact O-N 3.21Å; S25-T29 PolarHBondContact O-OG1 3.41Å
26	L	42.5	Very low	44	Very low	118 Å²	118	110.3 Å²	110.3	62%	0.618	63%	0.625	S	S	*	*	H	α-helix	trans	-75.2	-23.9	179.5	-140.7	105.3	0	0	0	112.8	W23 A24 T29	W23-L26 PolarHBondContact O-N 3.09Å; A24-L26 VanDerWaalsContact C-N 3.32Å; A24-L26 PolarHBondContact O-N 3.03Å; L26-T29 PolarHBondContact O-OG1 2.77Å
27	L	46.6	Very low	44.7	Very low	131 Å²	131	104.7 Å²	104.7	69%	0.686	61%	0.607	S	S	*	*	H	α-helix	trans	-79.4	-36.5	172.7	-75.7	165.1	0	0	0	111.4	W23 A24 S25 T29 T30	W23-L27 PolarHBondContact O-N 3.27Å; A24-L27 PolarHBondContact O-N 2.83Å; S25-L27 VanDerWaalsContact C-N 3.32Å; L27-T29 VanDerWaalsContact C-N 3.32Å; L27-T29 PolarHBondContact O-N 2.98Å; L27-T30 PolarHBondContact O-N 3.11Å; L27-T30 PolarHBondContact O-OG1 3.15Å
28	A	49.2	Very low	45.4	Very low	67 Å²	67	103.5 Å²	103.5	55%	0.554	60%	0.598	S	S	*	*	H	α-helix	trans	-69.7	-23.6	-179.5	0	0	0	0	0	114	A24 S25 T30	A24-A28 PolarHBondContact O-N 3.02Å; S25-A28 PolarHBondContact O-N 2.91Å; A28-T30 PolarHBondContact O-N 3.48Å
29	T	45	Very low	46.2	Very low	106 Å²	106	107.3 Å²	107.3	65%	0.65	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	0.7	178.1	44.9	0	0	0	0	114.4	S25 L26 L27	S25-T29 PolarHBondContact O-N 3.21Å; S25-T29 PolarHBondContact O-OG1 3.41Å; L26-T29 PolarHBondContact O-OG1 2.77Å; L27-T29 VanDerWaalsContact C-N 3.32Å; L27-T29 PolarHBondContact O-N 2.98Å
30	T	42.4	Very low	46.9	Very low	80 Å²	80	104.1 Å²	104.1	49%	0.491	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.8	-6.3	-179.2	64	0	0	0	0	114.7	L27 A28 N32	L27-T30 PolarHBondContact O-N 3.11Å; L27-T30 PolarHBondContact O-OG1 3.15Å; A28-T30 PolarHBondContact O-N 3.48Å; T30-N32 PolarHBondContact O-N 3.34Å
31	T	45.4	Very low	47.6	Very low	112 Å²	112	102.6 Å²	102.6	69%	0.687	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-3	-175	61.3	0	0	0	0	115.3
32	N	45.3	Very low	48.6	Very low	158 Å²	158	105.1 Å²	105.1	85%	0.845	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	14.4	179.6	-74.3	-9	0	0	0	114.6	T30	T30-N32 PolarHBondContact O-N 3.34Å
33	S	42.5	Very low	49.7	Very low	62 Å²	62	102.5 Å²	102.5	43%	0.434	59%	0.585	S	S	.	*			trans	-104.3	122	168.9	168.5	0	0	0	0	108.8	N35 G36	S33-N35 PolarHBondContact O-N 3.2Å; S33-N35 PolarHBondContact OG-N 3.44Å; S33-G36 PolarHBondContact O-N 3.42Å
34	P	48	Very low	51	Low	122 Å²	122	96.8 Å²	96.8	79%	0.792	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-3.5	175.5	24.6	-30.8	0	0	0	113.4
35	N	52	Low	52.5	Low	95 Å²	95	96.9 Å²	96.9	51%	0.508	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98	4.7	172.9	-60.7	6.4	0	0	0	112.8	S33 S37 E38 M39	S33-N35 PolarHBondContact O-N 3.2Å; S33-N35 PolarHBondContact OG-N 3.44Å; N35-S37 VanDerWaalsContact C-N 3.29Å; N35-S37 PolarHBondContact O-N 2.79Å; N35-E38 PolarHBondContact O-N 3.46Å; N35-M39 PolarHBondContact O-N 3.35Å
36	G	47.8	Very low	53.9	Low	25 Å²	25	96.2 Å²	96.2	26%	0.258	56%	0.563	S	S	.	*	H	α-helix	trans	-65.2	-30.2	-177.3	0	0	0	0	0	113.8	S33 A40	S33-G36 PolarHBondContact O-N 3.42Å; G36-A40 PolarHBondContact O-N 3.05Å
37	S	54	Low	55.6	Low	72 Å²	72	97.3 Å²	97.3	50%	0.503	56%	0.563	S	S	.	*	H	α-helix	trans	-65.9	-39.3	175.5	54.6	0	0	0	0	111.7	N35 M39 A40 F41	N35-S37 VanDerWaalsContact C-N 3.29Å; N35-S37 PolarHBondContact O-N 2.79Å; S37-M39 PolarHBondContact O-N 2.87Å; S37-A40 WeakPolarHBondContact O-CB 3.32Å; S37-A40 PolarHBondContact O-N 3.32Å; S37-F41 WeakPolarHBondContact O-CD2 3.22Å; S37-F41 PolarHBondContact O-N 3.2Å
38	E	53	Low	57.3	Low	130 Å²	130	96.1 Å²	96.1	61%	0.607	56%	0.557	S	S	*	*	H	α-helix	trans	-64.5	-40.7	-179.8	-63.6	-173.2	164.1	0	0	111.7	N35 A40 F41 V42	N35-E38 PolarHBondContact O-N 3.46Å; E38-A40 VanDerWaalsContact C-N 3.34Å; E38-A40 PolarHBondContact O-N 3.3Å; E38-F41 PolarHBondContact O-N 2.94Å; E38-V42 PolarHBondContact O-N 3.37Å
39	M	54	Low	58.9	Low	131 Å²	131	98.5 Å²	98.5	65%	0.645	56%	0.559	S	S	*	*	H	α-helix	trans	-68.6	-32	175.6	-69.2	-64.4	-137.9	0	0	112.7	N35 S37 F41 V42 L43	N35-M39 PolarHBondContact O-N 3.35Å; S37-M39 PolarHBondContact O-N 2.87Å; M39-F41 VanDerWaalsContact C-N 3.33Å; M39-V42 PolarHBondContact O-N 2.9Å; M39-L43 WeakPolarHBondContact O-CG 3.5Å; M39-L43 PolarHBondContact O-N 3.39Å
40	A	55.4	Low	60.7	Low	47 Å²	47	100.2 Å²	100.2	39%	0.388	56%	0.558	S	S	.	*	H	α-helix	trans	-64.4	-39.3	174.9	0	0	0	0	0	111.5	G36 S37 E38 V42 L43 V44	G36-A40 PolarHBondContact O-N 3.05Å; S37-A40 WeakPolarHBondContact O-CB 3.32Å; S37-A40 PolarHBondContact O-N 3.32Å; E38-A40 VanDerWaalsContact C-N 3.34Å; E38-A40 PolarHBondContact O-N 3.3Å; A40-V42 VanDerWaalsContact C-N 3.27Å; A40-V42 PolarHBondContact O-N 3.47Å; A40-L43 PolarHBondContact O-N 3.34Å; A40-V44 WeakPolarHBondContact O-CB 3.26Å; A40-V44 WeakPolarHBondContact O-CG2 3.41Å; A40-V44 PolarHBondContact O-N 2.86Å
41	F	57.5	Low	62.7	Low	160 Å²	160	103.2 Å²	103.2	70%	0.702	56%	0.564	S	S	*	*	H	α-helix	trans	-66.3	-26.7	176.2	-76.3	-71.2	0	0	0	113.5	S37 E38 M39 P45	S37-F41 WeakPolarHBondContact O-CD2 3.22Å; S37-F41 PolarHBondContact O-N 3.2Å; E38-F41 PolarHBondContact O-N 2.94Å; M39-F41 VanDerWaalsContact C-N 3.33Å; F41-P45 WeakPolarHBondContact O-CD 3.28Å; F41-P45 WeakPolarHBondContact O-CG 3.36Å
42	V	62.4	Low	64.7	Low	101 Å²	101	105.9 Å²	105.9	61%	0.612	56%	0.562	S	S	*	*	H	α-helix	trans	-81.7	-41	176.2	179.6	0	0	0	0	111.4	E38 M39 A40	E38-V42 PolarHBondContact O-N 3.37Å; M39-V42 PolarHBondContact O-N 2.9Å; A40-V42 VanDerWaalsContact C-N 3.27Å; A40-V42 PolarHBondContact O-N 3.47Å
43	L	65.7	Low	66.7	Low	94 Å²	94	103.5 Å²	103.5	49%	0.492	55%	0.548	S	S	.	.	H	α-helix	trans	-76.1	-41.6	-175.6	-66.9	174.5	0	0	0	112.3	M39 A40 S46 F47	M39-L43 WeakPolarHBondContact O-CG 3.5Å; M39-L43 PolarHBondContact O-N 3.39Å; A40-L43 PolarHBondContact O-N 3.34Å; L43-S46 PolarHBondContact O-N 3.41Å; L43-S46 VanDerWaalsContact O-N 3.14Å; L43-S46 PolarHBondContact O-OG 3.04Å; L43-F47 HydrophobicContact CB-CD2 4.39Å; L43-F47 HydrophobicContact CB-CE2 4.49Å; L43-F47 WeakPolarHBondContact O-CD2 3.45Å; L43-F47 PolarHBondContact O-N 3.44Å
44	V	70.3	Confident	68.5	Low	85 Å²	85	103.5 Å²	103.5	52%	0.515	55%	0.546	S	S	.	.	H	α-helix	trans	-58.2	-47.5	-174.4	171.6	0	0	0	0	113.2	A40 S46 F47 L48	A40-V44 WeakPolarHBondContact O-CB 3.26Å; A40-V44 WeakPolarHBondContact O-CG2 3.41Å; A40-V44 PolarHBondContact O-N 2.86Å; V44-S46 VanDerWaalsContact C-N 3.34Å; V44-S46 PolarHBondContact O-N 2.89Å; V44-F47 PolarHBondContact O-N 2.8Å; V44-L48 HydrophobicContact CG1-CD1 4.3Å; V44-L48 WeakPolarHBondContact O-CG 3.41Å; V44-L48 PolarHBondContact O-N 3.47Å; V44-L48 VanDerWaalsContact O-N 3.12Å
45	P	76.8	Confident	70.2	Confident	65 Å²	65	100.2 Å²	100.2	42%	0.422	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-38	176.6	-20.5	32.6	0	0	0	112.6	F41 F47 L48 I49	F41-P45 WeakPolarHBondContact O-CD 3.28Å; F41-P45 WeakPolarHBondContact O-CG 3.36Å; P45-F47 VanDerWaalsContact C-N 3.35Å; P45-F47 PolarHBondContact O-N 3.45Å; P45-L48 PolarHBondContact O-N 2.93Å; P45-I49 WeakPolarHBondContact O-CG1 3.38Å; P45-I49 PolarHBondContact O-N 3.37Å
46	S	76.4	Confident	71.3	Confident	59 Å²	59	99.8 Å²	99.8	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-63.6	-40.6	178.8	76.5	0	0	0	0	112	L43 V44 I49 F50	L43-S46 PolarHBondContact O-N 3.41Å; L43-S46 VanDerWaalsContact O-N 3.14Å; L43-S46 PolarHBondContact O-OG 3.04Å; V44-S46 VanDerWaalsContact C-N 3.34Å; V44-S46 PolarHBondContact O-N 2.89Å; S46-I49 PolarHBondContact O-N 3.05Å; S46-F50 WeakPolarHBondContact O-CB 3.46Å; S46-F50 PolarHBondContact O-N 3.24Å
47	F	78.5	Confident	72.6	Confident	142 Å²	142	102.3 Å²	102.3	62%	0.623	53%	0.533	S	S	*	.	H	α-helix	trans	-66	-39.5	175.3	-88.8	-79	0	0	0	112.3	L43 V44 P45 F50 F51	L43-F47 HydrophobicContact CB-CD2 4.39Å; L43-F47 HydrophobicContact CB-CE2 4.49Å; L43-F47 WeakPolarHBondContact O-CD2 3.45Å; L43-F47 PolarHBondContact O-N 3.44Å; V44-F47 PolarHBondContact O-N 2.8Å; P45-F47 VanDerWaalsContact C-N 3.35Å; P45-F47 PolarHBondContact O-N 3.45Å; F47-F50 PolarHBondContact O-N 3.29Å; F47-F51 WeakPolarHBondContact O-CB 3.35Å; F47-F51 PolarHBondContact O-N 3.49Å
48	L	81	Confident	73.4	Confident	105 Å²	105	102 Å²	102	55%	0.55	54%	0.536	S	S	.	.	H	α-helix	trans	-64.2	-41.4	176.9	-73.4	171.8	0	0	0	112.2	V44 P45 F51 W52	V44-L48 HydrophobicContact CG1-CD1 4.3Å; V44-L48 WeakPolarHBondContact O-CG 3.41Å; V44-L48 PolarHBondContact O-N 3.47Å; V44-L48 VanDerWaalsContact O-N 3.12Å; P45-L48 PolarHBondContact O-N 2.93Å; L48-F51 PolarHBondContact O-N 3.2Å; L48-W52 WeakPolarHBondContact O-CB 3.36Å; L48-W52 PolarHBondContact O-N 3.33Å
49	I	83.1	Confident	73.9	Confident	117 Å²	117	104.8 Å²	104.8	60%	0.6	54%	0.541	S	S	*	.	H	α-helix	trans	-63.6	-45	175.6	-66.1	164	0	0	0	110.1	P45 S46 F51 W52 L53	P45-I49 WeakPolarHBondContact O-CG1 3.38Å; P45-I49 PolarHBondContact O-N 3.37Å; S46-I49 PolarHBondContact O-N 3.05Å; I49-F51 PolarHBondContact O-N 3.46Å; I49-W52 PolarHBondContact O-N 2.93Å; I49-L53 WeakPolarHBondContact O-CB 3.38Å; I49-L53 PolarHBondContact O-N 3.39Å
50	F	83.7	Confident	74.1	Confident	142 Å²	142	104.4 Å²	104.4	62%	0.623	54%	0.541	S	S	*	.	H	α-helix	trans	-63.7	-41.8	178.5	-163.3	-92.8	0	0	0	112.2	S46 F47 L53 T54	S46-F50 WeakPolarHBondContact O-CB 3.46Å; S46-F50 PolarHBondContact O-N 3.24Å; F47-F50 PolarHBondContact O-N 3.29Å; F50-L53 PolarHBondContact O-N 3.5Å; F50-T54 HydrophobicContact CD1-CG2 4.08Å; F50-T54 HydrophobicContact CE1-CG2 3.85Å; F50-T54 HydrophobicContact CZ-CG2 4.46Å; F50-T54 WeakPolarHBondContact O-CG2 3.48Å; F50-T54 PolarHBondContact O-N 3.04Å; F50-T54 PolarHBondContact O-OG1 3.43Å
51	F	83.8	Confident	74.1	Confident	144 Å²	144	110.8 Å²	110.8	63%	0.632	56%	0.56	S	S	*	*	H	α-helix	trans	-64.2	-41.8	175.6	-161	-95.2	0	0	0	111.9	F47 L48 I49 T54 V55	F47-F51 WeakPolarHBondContact O-CB 3.35Å; F47-F51 PolarHBondContact O-N 3.49Å; L48-F51 PolarHBondContact O-N 3.2Å; I49-F51 PolarHBondContact O-N 3.46Å; F51-T54 WeakPolarHBondContact CA-OG1 3.33Å; F51-T54 PolarHBondContact O-OG1 3.29Å; F51-V55 HydrophobicContact CD1-CG2 4.15Å; F51-V55 HydrophobicContact CE1-CG2 4Å; F51-V55 VanDerWaalsContact O-CG2 3.26Å; F51-V55 WeakPolarHBondContact O-CG2 3.34Å; F51-V55 PolarHBondContact O-N 3.44Å
52	W	87.1	Confident	73.6	Confident	168 Å²	168	112.3 Å²	112.3	64%	0.636	57%	0.566	S	S	*	*	H	α-helix	trans	-64.3	-42.6	174.5	-98.7	91.3	0	0	0	112.7	L48 I49 V55 L56	L48-W52 WeakPolarHBondContact O-CB 3.36Å; L48-W52 PolarHBondContact O-N 3.33Å; I49-W52 PolarHBondContact O-N 2.93Å; W52-V55 PolarHBondContact O-N 2.95Å; W52-L56 HydrophobicContact CE3-CD1 3.95Å; W52-L56 HydrophobicContact CZ3-CD1 4.5Å; W52-L56 PolarHBondContact O-N 3.37Å
53	L	87.1	Confident	72.9	Confident	107 Å²	107	113.5 Å²	113.5	56%	0.56	57%	0.574	S	S	*	*	H	α-helix	trans	-64.3	-42.8	179.6	-154.6	77.9	0	0	0	111.3	I49 F50 L56 C57	I49-L53 WeakPolarHBondContact O-CB 3.38Å; I49-L53 PolarHBondContact O-N 3.39Å; F50-L53 PolarHBondContact O-N 3.5Å; L53-L56 PolarHBondContact O-N 3.12Å; L53-C57 WeakPolarHBondContact O-CB 2.93Å; L53-C57 PolarHBondContact O-N 2.66Å; L53-C57 PolarHBondContact O-SG 2.91Å
54	T	80.4	Confident	71.8	Confident	63 Å²	63	115 Å²	115	39%	0.387	59%	0.587	S	S	.	*	H	α-helix	trans	-64.2	-40.3	175.8	49.3	0	0	0	0	112.4	F50 F51 C57 A58	F50-T54 HydrophobicContact CD1-CG2 4.08Å; F50-T54 HydrophobicContact CE1-CG2 3.85Å; F50-T54 HydrophobicContact CZ-CG2 4.46Å; F50-T54 WeakPolarHBondContact O-CG2 3.48Å; F50-T54 PolarHBondContact O-N 3.04Å; F50-T54 PolarHBondContact O-OG1 3.43Å; F51-T54 WeakPolarHBondContact CA-OG1 3.33Å; F51-T54 PolarHBondContact O-OG1 3.29Å; T54-C57 PolarHBondContact O-N 2.91Å; T54-A58 WeakPolarHBondContact O-CB 3.19Å; T54-A58 PolarHBondContact O-N 2.71Å
55	V	84.5	Confident	70.3	Confident	52 Å²	52	118.5 Å²	118.5	32%	0.315	60%	0.603	S	S	.	*	H	α-helix	trans	-63.6	-41.1	173.7	171.1	0	0	0	0	111.7	F51 W52 A58 R59	F51-V55 HydrophobicContact CD1-CG2 4.15Å; F51-V55 HydrophobicContact CE1-CG2 4Å; F51-V55 VanDerWaalsContact O-CG2 3.26Å; F51-V55 WeakPolarHBondContact O-CG2 3.34Å; F51-V55 PolarHBondContact O-N 3.44Å; W52-V55 PolarHBondContact O-N 2.95Å; V55-A58 PolarHBondContact O-N 2.96Å; V55-R59 WeakPolarHBondContact O-CG 3.48Å; V55-R59 PolarHBondContact O-N 2.86Å
56	L	75.4	Confident	68.7	Low	87 Å²	87	122.2 Å²	122.2	46%	0.455	62%	0.624	S	S	.	*	H	α-helix	trans	-63	-45.1	174.8	-100.6	131.9	0	0	0	112	W52 L53 A58 R59 N60	W52-L56 HydrophobicContact CE3-CD1 3.95Å; W52-L56 HydrophobicContact CZ3-CD1 4.5Å; W52-L56 PolarHBondContact O-N 3.37Å; L53-L56 PolarHBondContact O-N 3.12Å; L56-A58 VanDerWaalsContact C-N 3.33Å; L56-A58 PolarHBondContact O-N 2.85Å; L56-R59 PolarHBondContact O-N 2.81Å; L56-N60 PolarHBondContact O-N 2.94Å; L56-N60 VanDerWaalsContact O-N 3.09Å
57	C	75.3	Confident	66.7	Low	77 Å²	77	127.7 Å²	127.7	52%	0.52	64%	0.64	S	S	.	*	H	α-helix	trans	-64	-37.7	176.5	-71.9	0	0	0	0	112.2	L53 T54	L53-C57 WeakPolarHBondContact O-CB 2.93Å; L53-C57 PolarHBondContact O-N 2.66Å; L53-C57 PolarHBondContact O-SG 2.91Å; T54-C57 PolarHBondContact O-N 2.91Å
58	A	70	Confident	64.5	Low	67 Å²	67	131.2 Å²	131.2	55%	0.554	66%	0.656	S	S	*	*	H	α-helix	trans	-67.2	-36.8	175.7	0	0	0	0	0	112.2	T54 V55 L56	T54-A58 WeakPolarHBondContact O-CB 3.19Å; T54-A58 PolarHBondContact O-N 2.71Å; V55-A58 PolarHBondContact O-N 2.96Å; L56-A58 VanDerWaalsContact C-N 3.33Å; L56-A58 PolarHBondContact O-N 2.85Å
59	R	63.7	Low	62.6	Low	188 Å²	188	132 Å²	132	71%	0.709	66%	0.664	S	S	*	*	H	α-helix	trans	-69.1	-38	177.3	-79.4	-177.9	157.5	170.8	-4	112.9	V55 L56 K61	V55-R59 WeakPolarHBondContact O-CG 3.48Å; V55-R59 PolarHBondContact O-N 2.86Å; L56-R59 PolarHBondContact O-N 2.81Å; R59-K61 VanDerWaalsContact C-N 3.28Å; R59-K61 PolarHBondContact O-N 2.92Å
60	N	57.7	Low	60.3	Low	123 Å²	123	130.9 Å²	130.9	66%	0.658	67%	0.673	S	S	*	*	H	α-helix	trans	-73.4	-14.8	-177	-76	-9.5	0	0	0	114.3	L56 K62	L56-N60 PolarHBondContact O-N 2.94Å; L56-N60 VanDerWaalsContact O-N 3.09Å; N60-K62 PolarHBondContact O-N 2.74Å
61	K	54.9	Low	58	Low	181 Å²	181	130.3 Å²	130.3	79%	0.787	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-1.7	178.9	-88.1	-174.5	175.2	-178.8	0	115.5	R59	R59-K61 VanDerWaalsContact C-N 3.28Å; R59-K61 PolarHBondContact O-N 2.92Å
62	K	48.3	Very low	55.8	Low	191 Å²	191	128.3 Å²	128.3	83%	0.83	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	5.8	-176.1	-72.1	-167.9	177.5	-173.6	0	116.5	N60	N60-K62 PolarHBondContact O-N 2.74Å
63	V	48.1	Very low	53.6	Low	127 Å²	127	125 Å²	125	77%	0.77	70%	0.696	S	S	*	*			trans	-122.5	45.9	-172.3	-161	0	0	0	0	113.4
64	T	42.5	Very low	51	Low	125 Å²	125	126 Å²	126	77%	0.767	71%	0.707	S	S	*	*			trans	-134.8	65.3	170.1	58.6	0	0	0	0	110.8
65	N	37.9	Very low	49.2	Very low	159 Å²	159	129.3 Å²	129.3	85%	0.85	73%	0.727	S	S	*	*			trans	-158.7	73.2	166	-127.7	-42.9	0	0	0	112
66	V	43.6	Very low	46.8	Very low	143 Å²	143	136.2 Å²	136.2	87%	0.867	75%	0.753	S	S	*	*			trans	-139.8	90.7	160.1	-173.9	0	0	0	0	110
67	K	33.5	Very low	45.1	Very low	173 Å²	173	138 Å²	138	75%	0.752	77%	0.767	S	S	*	*				46.5	93.8	128.4	-142.7	167	-175.3	175.8	0	117.3	T69	K67-T69 HydrophobicContact CG-CG2 4.41Å; K67-T69 PolarHBondContact O-N 3.18Å; K67-T69 VanDerWaalsContact O-N 3.09Å
68	K	33.8	Very low	43.1	Very low	217 Å²	217	145.6 Å²	145.6	94%	0.943	79%	0.785	S	S	*	*			trans	-39.4	110.1	145.2	-98.3	173.6	169.4	175.3	0	109.3
69	T	40.4	Very low	41.4	Very low	120 Å²	120	150.5 Å²	150.5	74%	0.736	80%	0.796	S	S	*	*			trans	-122.1	125.3	159.3	36.6	0	0	0	0	107.3	K67	K67-T69 HydrophobicContact CG-CG2 4.41Å; K67-T69 PolarHBondContact O-N 3.18Å; K67-T69 VanDerWaalsContact O-N 3.09Å
70	A	34	Very low	40.1	Very low	94 Å²	94	148.8 Å²	148.8	78%	0.777	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-67.6	153.6	-169.4	0	0	0	0	0	112.1	A72	A70-A72 PolarHBondContact O-N 3.23Å
71	P	36.2	Very low	39.2	Very low	131 Å²	131	147.4 Å²	147.4	85%	0.851	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-71.7	124.5	-179.8	28.2	-33.6	0	0	0	111.5
72	A	38.1	Very low	38.3	Very low	102 Å²	102	150.4 Å²	150.4	84%	0.843	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76.1	139.5	169.9	0	0	0	0	0	110.9	A70	A70-A72 PolarHBondContact O-N 3.23Å
73	S	40.1	Very low	37.7	Very low	98 Å²	98	150.6 Å²	150.6	69%	0.685	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-65.7	132.7	-171.3	47.4	0	0	0	0	115.1
74	T	33.2	Very low	37.4	Very low	129 Å²	129	149.6 Å²	149.6	79%	0.791	82%	0.815	S	S	*	*			trans	7.7	112.8	136.4	52.2	0	0	0	0	117.5
75	T	41.3	Very low	37.4	Very low	131 Å²	131	153.6 Å²	153.6	80%	0.804	82%	0.822	S	S	*	*			trans	-125.4	108.1	151.1	-25.3	0	0	0	0	107.9
76	K	35	Very low	37.7	Very low	198 Å²	198	154.4 Å²	154.4	86%	0.861	82%	0.821	S	S	*	*			trans	-76.3	113.7	173.1	-62.1	178.5	176.2	-175.5	0	107.7
77	V	39.1	Very low	37.6	Very low	124 Å²	124	156.7 Å²	156.7	75%	0.752	82%	0.822	S	S	*	*			trans	-148	124.2	165.3	-177.4	0	0	0	0	109.7
78	R	34.3	Very low	38.1	Very low	237 Å²	237	159.8 Å²	159.8	89%	0.894	83%	0.829	S	S	*	*			trans	88.9	80.1	159.4	-131.5	164.2	-176.6	127	1.1	118.2
79	E	34.2	Very low	38.4	Very low	169 Å²	169	155 Å²	155	79%	0.79	81%	0.814	S	S	*	*			trans	-58.9	160.3	144.7	-84.4	163.5	141.8	0	0	111.8
80	D	35.3	Very low	38.8	Very low	153 Å²	153	155.9 Å²	155.9	82%	0.818	82%	0.82	S	S	*	*			trans	81.4	106.4	160.4	-52.4	-29.1	0	0	0	119.1
81	A	40.2	Very low	39.5	Very low	94 Å²	94	159.4 Å²	159.4	78%	0.777	82%	0.824	S	S	*	*	S	Bend	trans	135.8	83.2	134.1	0	0	0	0	0	112.2
82	R	35	Very low	39.7	Very low	243 Å²	243	163.2 Å²	163.2	92%	0.917	82%	0.822	S	S	*	*			trans	172.3	55.7	142	-92.7	163.9	-173.6	-157.9	3	110.4	S84	R82-S84 VanDerWaalsContact C-N 3.34Å; R82-S84 PolarHBondContact O-N 3.5Å
83	Q	36.3	Very low	39.8	Very low	196 Å²	196	163.4 Å²	163.4	92%	0.916	82%	0.815	S	S	*	*			trans	-82	82.7	160.9	-76.4	-177	-20.8	0	0	108.3
84	S	41.5	Very low	40.3	Very low	105 Å²	105	164.3 Å²	164.3	73%	0.734	82%	0.818	S	S	*	*			trans	-161.2	54.4	168.3	73.3	0	0	0	0	111.9	R82	R82-S84 VanDerWaalsContact C-N 3.34Å; R82-S84 PolarHBondContact O-N 3.5Å
85	K	41.6	Very low	40.8	Very low	210 Å²	210	163.5 Å²	163.5	91%	0.913	82%	0.817	S	S	*	*			trans	-162.2	44.8	159.7	-140.9	167.7	-176.9	172.4	0	112.3
86	E	45.6	Very low	41	Very low	176 Å²	176	165.3 Å²	165.3	82%	0.822	82%	0.822	S	S	*	*			trans	-107.4	68.4	176.1	-163.2	167.2	-173	0	0	108.7
87	E	41.7	Very low	41.4	Very low	191 Å²	191	165.1 Å²	165.1	89%	0.893	82%	0.821	S	S	*	*	S	Bend	trans	-144.6	37	167.3	-156.1	-172.9	164.5	0	0	111
88	R	42.2	Very low	41.4	Very low	237 Å²	237	170 Å²	170	89%	0.894	83%	0.825	S	S	*	*			trans	-149.4	45.1	176.3	-129.5	-173.1	-158.3	-171.9	6.3	112.5
89	D	40.8	Very low	42	Very low	116 Å²	116	166.8 Å²	166.8	62%	0.62	83%	0.825	S	S	*	*			trans	-129.2	31.2	-176	-110.6	-9.6	0	0	0	114.4
90	T	49.2	Very low	42.3	Very low	140 Å²	140	162.6 Å²	162.6	86%	0.859	82%	0.815	S	S	*	*	S	Bend	trans	-92.8	4	171	34.8	0	0	0	0	115.2
91	L	48.8	Very low	42.6	Very low	168 Å²	168	163.2 Å²	163.2	88%	0.88	82%	0.818	S	S	*	*	S	Bend	trans	-129.5	23.1	-177.9	-70.3	174.8	0	0	0	114.9	P93	L91-P93 VanDerWaalsContact O-CD 3.32Å; L91-P93 WeakPolarHBondContact O-CD 3.34Å
92	R	39.4	Very low	42.9	Very low	210 Å²	210	163.8 Å²	163.8	79%	0.792	81%	0.812	S	S	*	*			trans	-96.3	106.2	169.4	-139	174	-165.1	159.6	3.1	108.9
93	P	41.4	Very low	43.3	Very low	107 Å²	107	158.2 Å²	158.2	70%	0.695	80%	0.8	S	S	*	*			trans	-56.8	142.3	177.5	22.1	-31.2	0	0	0	109	L91 S95	L91-P93 VanDerWaalsContact O-CD 3.32Å; L91-P93 WeakPolarHBondContact O-CD 3.34Å; P93-S95 PolarHBondContact O-N 3.47Å
94	P	49.4	Very low	43.8	Very low	116 Å²	116	153.8 Å²	153.8	75%	0.753	79%	0.789	S	S	*	*			trans	-50.6	120.9	-176.3	18.9	-30.9	0	0	0	108.3	L96	P94-L96 VanDerWaalsContact C-N 3.32Å; P94-L96 PolarHBondContact O-N 3.38Å
95	S	44.8	Very low	44.2	Very low	112 Å²	112	153.6 Å²	153.6	78%	0.783	79%	0.787	S	S	*	*			trans	-49.9	104.3	170.8	54.3	0	0	0	0	106.5	P93 K97	P93-S95 PolarHBondContact O-N 3.47Å; S95-K97 PolarHBondContact O-N 3.18Å
96	L	46.2	Very low	44.6	Very low	170 Å²	170	149 Å²	149	89%	0.89	77%	0.773	S	S	*	*			trans	-50.5	109.9	-179.8	-79.4	162.9	0	0	0	106.2	P94 R98	P94-L96 VanDerWaalsContact C-N 3.32Å; P94-L96 PolarHBondContact O-N 3.38Å; L96-R98 PolarHBondContact O-N 3.42Å
97	K	41.3	Very low	44.6	Very low	194 Å²	194	144.9 Å²	144.9	84%	0.843	76%	0.756	S	S	*	*			trans	-44	119.1	177.9	-83.1	174.2	175.3	174.2	0	106.6	S95 L99	S95-K97 PolarHBondContact O-N 3.18Å; K97-L99 PolarHBondContact O-N 3.03Å
98	R	40.5	Very low	44.9	Very low	225 Å²	225	145.7 Å²	145.7	85%	0.849	75%	0.751	S	S	*	*			trans	-24.4	96.3	169.2	-75.4	172.6	167.5	159	-4.8	110.6	L96 S100	L96-R98 PolarHBondContact O-N 3.42Å; R98-S100 PolarHBondContact O-N 3.34Å
99	L	45.9	Very low	45.2	Very low	170 Å²	170	137 Å²	137	89%	0.89	73%	0.73	S	S	*	*			trans	-74.5	63.5	150.4	-70	173.1	0	0	0	105.9	K97 N101	K97-L99 PolarHBondContact O-N 3.03Å; L99-N101 PolarHBondContact O-N 3.03Å
100	S	40.3	Very low	45.4	Very low	81 Å²	81	137.1 Å²	137.1	57%	0.566	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	95.5	172.2	50.7	0	0	0	0	107	R98	R98-S100 PolarHBondContact O-N 3.34Å
101	N	41.9	Very low	45.2	Very low	166 Å²	166	138 Å²	138	89%	0.888	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169	14.9	148.4	-94.1	-15.7	0	0	0	112.6	L99 N103	L99-N101 PolarHBondContact O-N 3.03Å; N101-N103 PolarHBondContact O-N 3.47Å
102	T	47.4	Very low	44.9	Very low	106 Å²	106	139.6 Å²	139.6	65%	0.65	71%	0.713	S	S	*	*	S	Bend	trans	-85.2	104.6	167.7	51	0	0	0	0	108.6	P104	T102-P104 WeakPolarHBondContact O-CD 3.16Å; T102-P104 VanDerWaalsContact O-N 3.11Å
103	N	42.6	Very low	45.2	Very low	126 Å²	126	139.2 Å²	139.2	67%	0.674	71%	0.711	S	S	*	*			trans	-53.2	112	176.9	-135.4	-28.7	0	0	0	109.2	N101 S105 N106	N101-N103 PolarHBondContact O-N 3.47Å; N103-S105 PolarHBondContact O-N 3.37Å; N103-N106 PolarHBondContact O-N 3.44Å
104	P	47.7	Very low	45.6	Very low	103 Å²	103	136.9 Å²	136.9	67%	0.669	70%	0.698	S	S	*	*	H	α-helix	trans	-64.9	-14	-172.1	24.9	-34.2	0	0	0	113.1	T102 N106	T102-P104 WeakPolarHBondContact O-CD 3.16Å; T102-P104 VanDerWaalsContact O-N 3.11Å; P104-N106 VanDerWaalsContact C-N 3.26Å; P104-N106 PolarHBondContact O-N 3.28Å
105	S	49.8	Very low	45.5	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	68%	0.683	S	S	*	*	H	α-helix	trans	-59.6	-35	172.6	-178.1	0	0	0	0	112.5	N103	N103-S105 PolarHBondContact O-N 3.37Å
106	N	48.9	Very low	45.6	Very low	115 Å²	115	134.6 Å²	134.6	62%	0.615	67%	0.673	S	S	*	*	H	α-helix	trans	-83.8	-25.6	-175	-141	6.2	0	0	0	113.2	N103 P104 R108 A109 Q110	N103-N106 PolarHBondContact O-N 3.44Å; P104-N106 VanDerWaalsContact C-N 3.26Å; P104-N106 PolarHBondContact O-N 3.28Å; N106-R108 VanDerWaalsContact C-N 3.27Å; N106-R108 PolarHBondContact O-N 2.99Å; N106-A109 PolarHBondContact O-N 3.14Å; N106-Q110 PolarHBondContact O-N 3.29Å
107	D	46.4	Very low	45.5	Very low	88 Å²	88	129.3 Å²	129.3	47%	0.471	65%	0.654	S	S	.	*	H	α-helix	trans	-64.7	-30.6	179.8	-89.9	-16.7	0	0	0	112.5	A109 Q110 K111	D107-A109 VanDerWaalsContact C-N 3.35Å; D107-A109 PolarHBondContact O-N 2.69Å; D107-Q110 PolarHBondContact O-N 3.49Å; D107-K111 VanDerWaalsContact O-CB 3.22Å; D107-K111 WeakPolarHBondContact O-CB 3.36Å; D107-K111 PolarHBondContact O-N 3.36Å
108	R	47.3	Very low	45.8	Very low	209 Å²	209	127 Å²	127	79%	0.789	65%	0.646	S	S	*	*	H	α-helix	trans	-68.9	-35.8	-178.2	-143.4	177.8	-168.5	165.7	2.9	112.2	N106 R112	N106-R108 VanDerWaalsContact C-N 3.27Å; N106-R108 PolarHBondContact O-N 2.99Å; R108-R112 PolarHBondContact O-N 3.02Å
109	A	49.6	Very low	46.1	Very low	54 Å²	54	123.8 Å²	123.8	45%	0.446	64%	0.638	S	S	.	*	H	α-helix	trans	-72.1	-39	174.6	0	0	0	0	0	111.2	N106 D107 R112 R113	N106-A109 PolarHBondContact O-N 3.14Å; D107-A109 VanDerWaalsContact C-N 3.35Å; D107-A109 PolarHBondContact O-N 2.69Å; A109-R112 PolarHBondContact O-N 3.16Å; A109-R113 PolarHBondContact O-N 3.01Å
110	Q	45	Very low	46.2	Very low	118 Å²	118	118.9 Å²	118.9	55%	0.551	62%	0.616	S	S	*	*	H	α-helix	trans	-68.6	-38.9	178.1	-159.9	167.1	-14	0	0	111.9	N106 D107 R112 R113 S114	N106-Q110 PolarHBondContact O-N 3.29Å; D107-Q110 PolarHBondContact O-N 3.49Å; Q110-R112 VanDerWaalsContact C-N 3.33Å; Q110-R112 PolarHBondContact O-N 3.3Å; Q110-R113 PolarHBondContact O-N 3.11Å; Q110-R113 VanDerWaalsContact O-N 3.15Å; Q110-S114 PolarHBondContact O-N 3.38Å; Q110-S114 PolarHBondContact O-OG 3.05Å
111	K	44.2	Very low	46.4	Very low	159 Å²	159	116.5 Å²	116.5	69%	0.691	60%	0.604	S	S	*	*	H	α-helix	trans	-67.6	-30.9	176.8	-155.9	175.6	-168.9	-178.9	0	113	D107 S114	D107-K111 VanDerWaalsContact O-CB 3.22Å; D107-K111 WeakPolarHBondContact O-CB 3.36Å; D107-K111 PolarHBondContact O-N 3.36Å; K111-S114 WeakPolarHBondContact CA-OG 3.21Å; K111-S114 PolarHBondContact O-OG 3.15Å; K111-S114 VanDerWaalsContact O-OG 3.11Å
112	R	43.5	Very low	46.6	Very low	201 Å²	201	113.9 Å²	113.9	76%	0.758	59%	0.589	S	S	*	*	H	α-helix	trans	-71.3	-31.3	171.6	-81.9	-174.7	155.9	-170.1	-6.7	112.8	R108 A109 Q110 T115	R108-R112 PolarHBondContact O-N 3.02Å; A109-R112 PolarHBondContact O-N 3.16Å; Q110-R112 VanDerWaalsContact C-N 3.33Å; Q110-R112 PolarHBondContact O-N 3.3Å; R112-T115 PolarHBondContact O-OG1 3.11Å
113	R	45.4	Very low	46.7	Very low	202 Å²	202	114.8 Å²	114.8	76%	0.762	59%	0.586	S	S	*	*	H	α-helix	trans	-83.6	-30.4	177.8	-73.5	-176.7	175	176.5	-1.7	113.1	A109 Q110 T115 D116 A117	A109-R113 PolarHBondContact O-N 3.01Å; Q110-R113 PolarHBondContact O-N 3.11Å; Q110-R113 VanDerWaalsContact O-N 3.15Å; R113-T115 VanDerWaalsContact C-N 3.28Å; R113-T115 PolarHBondContact O-N 2.78Å; R113-D116 PolarHBondContact O-N 2.82Å; R113-A117 PolarHBondContact O-N 3.04Å
114	S	49.9	Very low	47	Very low	59 Å²	59	111.3 Å²	111.3	41%	0.413	57%	0.566	S	S	.	*	H	α-helix	trans	-66.1	-32.1	178.5	62.6	0	0	0	0	112.3	Q110 K111 D116 A117 E118	Q110-S114 PolarHBondContact O-N 3.38Å; Q110-S114 PolarHBondContact O-OG 3.05Å; K111-S114 WeakPolarHBondContact CA-OG 3.21Å; K111-S114 PolarHBondContact O-OG 3.15Å; K111-S114 VanDerWaalsContact O-OG 3.11Å; S114-D116 VanDerWaalsContact C-N 3.28Å; S114-D116 PolarHBondContact O-N 3.27Å; S114-A117 PolarHBondContact O-N 2.96Å; S114-E118 WeakPolarHBondContact O-CB 3.11Å; S114-E118 PolarHBondContact O-N 3.31Å
115	T	47	Very low	47.1	Very low	72 Å²	72	111.7 Å²	111.7	44%	0.442	56%	0.561	S	S	.	*	H	α-helix	trans	-66.6	-29.4	177.3	48.3	0	0	0	0	113.3	R112 R113 K119	R112-T115 PolarHBondContact O-OG1 3.11Å; R113-T115 VanDerWaalsContact C-N 3.28Å; R113-T115 PolarHBondContact O-N 2.78Å; T115-K119 WeakPolarHBondContact O-CG 3.17Å; T115-K119 PolarHBondContact O-N 3.48Å
116	D	46.5	Very low	47.1	Very low	108 Å²	108	116.1 Å²	116.1	58%	0.578	56%	0.562	S	S	*	*	H	α-helix	trans	-78.9	-45	176.4	-78.5	-14.6	0	0	0	110.9	R113 S114 E118 K119 V120	R113-D116 PolarHBondContact O-N 2.82Å; S114-D116 VanDerWaalsContact C-N 3.28Å; S114-D116 PolarHBondContact O-N 3.27Å; D116-E118 VanDerWaalsContact C-N 3.33Å; D116-E118 PolarHBondContact O-N 2.8Å; D116-K119 PolarHBondContact O-N 3.26Å; D116-V120 VanDerWaalsContact O-CG2 3.28Å; D116-V120 WeakPolarHBondContact O-CG2 3.43Å; D116-V120 PolarHBondContact O-N 2.99Å
117	A	44.9	Very low	47.3	Very low	59 Å²	59	115.7 Å²	115.7	49%	0.488	56%	0.564	S	S	.	*	H	α-helix	trans	-62.5	-39.3	179.7	0	0	0	0	0	112.7	R113 S114 K119 V120 G121	R113-A117 PolarHBondContact O-N 3.04Å; S114-A117 PolarHBondContact O-N 2.96Å; A117-K119 VanDerWaalsContact C-N 3.31Å; A117-K119 PolarHBondContact O-N 3.37Å; A117-V120 PolarHBondContact O-N 2.95Å; A117-G121 PolarHBondContact O-N 3.3Å
118	E	48	Very low	47.3	Very low	145 Å²	145	114.9 Å²	114.9	68%	0.678	58%	0.576	S	S	*	*	H	α-helix	trans	-68.5	-32	179.1	-154.8	174.9	-147.4	0	0	111.9	S114 D116	S114-E118 WeakPolarHBondContact O-CB 3.11Å; S114-E118 PolarHBondContact O-N 3.31Å; D116-E118 VanDerWaalsContact C-N 3.33Å; D116-E118 PolarHBondContact O-N 2.8Å
119	K	46	Very low	47.3	Very low	157 Å²	157	111.8 Å²	111.8	68%	0.683	58%	0.575	S	S	*	*	H	α-helix	trans	-74.8	-41	174.2	-79.1	-173.4	175.6	-164.8	0	113	T115 D116 A117 G121 L122 E123	T115-K119 WeakPolarHBondContact O-CG 3.17Å; T115-K119 PolarHBondContact O-N 3.48Å; D116-K119 PolarHBondContact O-N 3.26Å; A117-K119 VanDerWaalsContact C-N 3.31Å; A117-K119 PolarHBondContact O-N 3.37Å; K119-G121 VanDerWaalsContact C-N 3.32Å; K119-L122 PolarHBondContact O-N 3.41Å; K119-E123 PolarHBondContact O-N 3.2Å
120	V	48.1	Very low	47.3	Very low	68 Å²	68	111.5 Å²	111.5	41%	0.412	57%	0.568	S	S	.	*	H	α-helix	trans	-66	-39.3	178.9	178.2	0	0	0	0	110.4	D116 A117 L122 E123 E124	D116-V120 VanDerWaalsContact O-CG2 3.28Å; D116-V120 WeakPolarHBondContact O-CG2 3.43Å; D116-V120 PolarHBondContact O-N 2.99Å; A117-V120 PolarHBondContact O-N 2.95Å; V120-L122 PolarHBondContact O-N 2.87Å; V120-E123 PolarHBondContact O-N 3.42Å; V120-E124 PolarHBondContact O-N 3.36Å
121	G	43.9	Very low	47.3	Very low	31 Å²	31	112.9 Å²	112.9	32%	0.32	57%	0.574	S	S	.	*	H	α-helix	trans	-61.5	-38.8	178	0	0	0	0	0	113.8	A117 K119 I125	A117-G121 PolarHBondContact O-N 3.3Å; K119-G121 VanDerWaalsContact C-N 3.32Å; G121-I125 WeakPolarHBondContact O-CD1 3.47Å; G121-I125 WeakPolarHBondContact O-CG1 3.36Å; G121-I125 PolarHBondContact O-N 3.32Å
122	L	46.4	Very low	47.5	Very low	110 Å²	110	110.1 Å²	110.1	58%	0.576	57%	0.573	S	S	*	*	H	α-helix	trans	-74.2	-34.7	-178.2	-88.3	162	0	0	0	113.8	K119 V120	K119-L122 PolarHBondContact O-N 3.41Å; V120-L122 PolarHBondContact O-N 2.87Å
123	E	50.7	Low	48	Very low	125 Å²	125	104 Å²	104	58%	0.584	56%	0.559	S	S	*	*	H	α-helix	trans	-70.2	-41.8	176	-78.8	-69.8	137.7	0	0	111.3	K119 V120 I125 R126	K119-E123 PolarHBondContact O-N 3.2Å; V120-E123 PolarHBondContact O-N 3.42Å; E123-I125 PolarHBondContact O-N 3.02Å; E123-R126 PolarHBondContact O-N 3.38Å; E123-R126 IonicContact OE1-NH1 3.87Å
124	E	48	Very low	48.3	Very low	54 Å²	54	100.1 Å²	100.1	25%	0.252	55%	0.553	S	S	.	*	H	α-helix	trans	-67.6	-36.3	178	-76.2	-174.7	158.5	0	0	112.5	V120 R126 T127 T130 V153	V120-E124 PolarHBondContact O-N 3.36Å; E124-R126 PolarHBondContact O-N 3.27Å; E124-R126 VanDerWaalsContact O-N 3.15Å; E124-T127 PolarHBondContact O-N 3.17Å; E124-T127 PolarHBondContact O-OG1 3.32Å; E124-T130 HydrophobicContact CB-CG2 3.84Å; E124-T130 WeakPolarHBondContact O-CG2 3.48Å; E124-V153 WeakPolarHBondContact OE2-CB 3.41Å
125	I	49.3	Very low	48.7	Very low	111 Å²	111	101.1 Å²	101.1	57%	0.569	56%	0.557	S	S	*	*	H	α-helix	trans	-59.6	-29.1	176.3	-68.6	162.2	0	0	0	111.6	G121 E123 T130	G121-I125 WeakPolarHBondContact O-CD1 3.47Å; G121-I125 WeakPolarHBondContact O-CG1 3.36Å; G121-I125 PolarHBondContact O-N 3.32Å; E123-I125 PolarHBondContact O-N 3.02Å; I125-T130 HydrophobicContact CG1-CG2 4.35Å
126	R	49.9	Very low	49.3	Very low	193 Å²	193	101.8 Å²	101.8	73%	0.728	56%	0.557	S	S	*	*	H	α-helix	trans	-73.6	-27	176.8	-78.5	-170.2	174.2	118.4	0.8	114	E123 E124 G128	E123-R126 PolarHBondContact O-N 3.38Å; E123-R126 IonicContact OE1-NH1 3.87Å; E124-R126 PolarHBondContact O-N 3.27Å; E124-R126 VanDerWaalsContact O-N 3.15Å; R126-G128 PolarHBondContact O-N 3.46Å
127	T	53.5	Low	50	Low	107 Å²	107	101.5 Å²	101.5	66%	0.656	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	6.1	-177.9	52.3	0	0	0	0	113.3	E124 N129	E124-T127 PolarHBondContact O-N 3.17Å; E124-T127 PolarHBondContact O-OG1 3.32Å; T127-N129 PolarHBondContact O-N 3.19Å
128	G	47.1	Very low	50.8	Low	70 Å²	70	101.4 Å²	101.4	72%	0.722	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	2.3	166.8	0	0	0	0	0	115	R126	R126-G128 PolarHBondContact O-N 3.46Å
129	N	46.7	Very low	51.3	Low	144 Å²	144	100.4 Å²	100.4	77%	0.77	55%	0.547	S	S	*	.			trans	-108.7	19.4	-177	-153.6	14.5	0	0	0	112.6	T127 Q131	T127-N129 PolarHBondContact O-N 3.19Å; N129-Q131 PolarHBondContact O-N 3.47Å
130	T	50.3	Low	52	Low	49 Å²	49	94.9 Å²	94.9	30%	0.301	53%	0.527	S	S	.	.			trans	-81.9	93.7	-178.5	48.9	0	0	0	0	109.8	E124 I125	E124-T130 HydrophobicContact CB-CG2 3.84Å; E124-T130 WeakPolarHBondContact O-CG2 3.48Å; I125-T130 HydrophobicContact CG1-CG2 4.35Å
131	Q	44.9	Very low	52.8	Low	146 Å²	146	97.7 Å²	97.7	68%	0.682	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-47	130.5	153	-161.5	169.9	23.3	0	0	107.4	N129	N129-Q131 PolarHBondContact O-N 3.47Å
132	P	47.5	Very low	53.9	Low	101 Å²	101	103.9 Å²	103.9	66%	0.656	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-55.4	135.6	-178.6	21.6	-32	0	0	0	108.6	L134	P132-L134 PolarHBondContact O-N 3.18Å; P132-L134 VanDerWaalsContact O-N 3.12Å
133	P	54	Low	54.5	Low	73 Å²	73	100.2 Å²	100.2	47%	0.474	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-54.7	125.7	-179.2	20.7	-31.1	0	0	0	108.9	V135	P133-V135 PolarHBondContact O-N 3.37Å
134	L	52.4	Low	55.1	Low	121 Å²	121	102.3 Å²	102.3	63%	0.634	57%	0.571	S	S	*	*			trans	-65.5	111	176.1	-73.6	168	0	0	0	107.8	P132 Y151	P132-L134 PolarHBondContact O-N 3.18Å; P132-L134 VanDerWaalsContact O-N 3.12Å; L134-Y151 PolarHBondContact O-N 3.12Å
135	V	57.2	Low	55.5	Low	80 Å²	80	104.8 Å²	104.8	49%	0.485	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	110.9	173.7	-172.4	0	0	0	0	108.3	P133 F148 F149 A150	P133-V135 PolarHBondContact O-N 3.37Å; V135-F148 HydrophobicContact CG1-CB 3.84Å; V135-F148 HydrophobicContact CG1-CD1 3.71Å; V135-F148 HydrophobicContact CG1-CG 4.25Å; V135-F149 CarbonylContact C-O 3.45Å; V135-F149 VanDerWaalsContact CA-O 3.3Å; V135-F149 WeakPolarHBondContact CA-O 3.31Å; V135-A150 HydrophobicContact CG2-CB 4.28Å
136	L	60.1	Low	55.9	Low	85 Å²	85	102 Å²	102	45%	0.445	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.1	120.1	167.7	-68	-174.5	0	0	0	109.6	V138 F148 F149 Y151	L136-V138 PolarHBondContact O-N 2.95Å; L136-F148 CarbonylContact O-C 3.58Å; L136-F148 WeakPolarHBondContact O-CA 3.08Å; L136-F149 HydrophobicContact CB-CB 4.32Å; L136-F149 PolarHBondContact N-O 2.94Å; L136-F149 PolarHBondContact O-N 3.09Å; L136-Y151 HydrophobicContact CD1-CE2 3.6Å; L136-Y151 HydrophobicContact CG-CE2 3.98Å
137	L	60.2	Low	56.5	Low	102 Å²	102	94.5 Å²	94.5	53%	0.534	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.6	106.5	165.8	177.7	62.8	0	0	0	108.5	P146 F148	L137-P146 HydrophobicContact CD1-CB 3.34Å; L137-F148 HydrophobicContact CD1-CD1 3.99Å; L137-F148 HydrophobicContact CD1-CE1 3.61Å; L137-F148 HydrophobicContact CD1-CE2 4.25Å; L137-F148 HydrophobicContact CD1-CG 4.49Å; L137-F148 HydrophobicContact CD1-CZ 3.74Å
138	V	62.4	Low	56.9	Low	57 Å²	57	92.2 Å²	92.2	35%	0.345	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	107.6	173.8	-176.2	0	0	0	0	107.9	L136 T140 Q147 F149	L136-V138 PolarHBondContact O-N 2.95Å; V138-T140 HydrophobicContact CG1-CG2 3.93Å; V138-T140 PolarHBondContact O-N 3.37Å; V138-Q147 PolarHBondContact N-O 3.24Å; V138-Q147 PolarHBondContact O-N 3.43Å; V138-Q147 VanDerWaalsContact O-N 3.09Å; V138-F149 HydrophobicContact CB-CD2 4.02Å; V138-F149 HydrophobicContact CB-CE2 3.99Å; V138-F149 HydrophobicContact CG2-CD2 3.57Å; V138-F149 HydrophobicContact CG2-CE2 3.91Å
139	N	59.2	Low	57.6	Low	124 Å²	124	90.7 Å²	90.7	66%	0.663	51%	0.507	S	S	*	.			trans	-88	97.9	173.3	-145.5	8.5	0	0	0	108.2
140	T	60.1	Low	58.2	Low	41 Å²	41	84.6 Å²	84.6	25%	0.252	48%	0.477	S	S	.	.			trans	-83.3	128.8	176.8	49.3	0	0	0	0	109.6	V138 N142 S143 Q147	V138-T140 HydrophobicContact CG1-CG2 3.93Å; V138-T140 PolarHBondContact O-N 3.37Å; T140-N142 PolarHBondContact O-N 3.32Å; T140-S143 PolarHBondContact O-N 3.38Å; T140-S143 PolarHBondContact OG1-OG 3.35Å; T140-Q147 PolarHBondContact OG1-NE2 3.42Å
141	P	64.4	Low	58.3	Low	128 Å²	128	86.7 Å²	86.7	83%	0.831	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.5	-175.1	24.4	-34.3	0	0	0	113.7
142	N	67.8	Low	58.7	Low	161 Å²	161	81.8 Å²	81.8	86%	0.861	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	3.1	-179.8	-62.5	-15.9	0	0	0	113.7	T140	T140-N142 PolarHBondContact O-N 3.32Å
143	S	59.6	Low	58.8	Low	32 Å²	32	79.3 Å²	79.3	22%	0.224	44%	0.443	C	S	.	.			trans	-134.9	127.9	175.4	81.5	0	0	0	0	112.4	T140 V145 Q147	T140-S143 PolarHBondContact O-N 3.38Å; T140-S143 PolarHBondContact OG1-OG 3.35Å; S143-V145 PolarHBondContact O-N 3.23Å; S143-V145 VanDerWaalsContact O-N 3.09Å; S143-V145 PolarHBondContact OG-O 3.36Å; S143-Q147 PolarHBondContact OG-NE2 3.45Å
144	D	63.5	Low	58.7	Low	170 Å²	170	79.1 Å²	79.1	91%	0.909	45%	0.454	S	S	*	.	S	Bend	trans	-67.3	-8.4	174.4	-56.1	-38	0	0	0	113.3
145	V	56.3	Low	58.5	Low	105 Å²	105	75.9 Å²	75.9	64%	0.636	44%	0.441	S	S	*	.	S	Bend	trans	-102.9	114.4	-179	-173.7	0	0	0	0	109.6	S143 Q147	S143-V145 PolarHBondContact O-N 3.23Å; S143-V145 VanDerWaalsContact O-N 3.09Å; S143-V145 PolarHBondContact OG-O 3.36Å; V145-Q147 PolarHBondContact O-N 3.36Å
146	P	57.5	Low	58.3	Low	54 Å²	54	81 Å²	81	35%	0.351	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-56.5	130.5	172.9	16.8	-26.7	0	0	0	110.7	L137 F148	L137-P146 HydrophobicContact CD1-CB 3.34Å; P146-F148 HydrophobicContact CB-CE2 4.13Å; P146-F148 HydrophobicContact CB-CZ 4.41Å; P146-F148 HydrophobicContact CG-CE2 4.19Å
147	Q	62.7	Low	58.1	Low	35 Å²	35	79.8 Å²	79.8	16%	0.164	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	118.2	178.8	-61.9	178.8	26.8	0	0	108.9	V138 T140 S143 V145 F149 R161	V138-Q147 PolarHBondContact N-O 3.24Å; V138-Q147 PolarHBondContact O-N 3.43Å; V138-Q147 VanDerWaalsContact O-N 3.09Å; T140-Q147 PolarHBondContact OG1-NE2 3.42Å; S143-Q147 PolarHBondContact OG-NE2 3.45Å; V145-Q147 PolarHBondContact O-N 3.36Å; Q147-F149 HydrophobicContact CB-CD2 4.37Å; Q147-F149 HydrophobicContact CB-CE2 3.73Å; Q147-R161 VanDerWaalsContact CD-NH1 3.27Å; Q147-R161 VanDerWaalsContact OE1-NH1 3.15Å
148	F	61	Low	57.9	Low	59 Å²	59	80.6 Å²	80.6	26%	0.259	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.2	175.6	-63.7	-89.2	0	0	0	109.5	V135 L136 L137 P146 R161 V162 M164	V135-F148 HydrophobicContact CG1-CB 3.84Å; V135-F148 HydrophobicContact CG1-CD1 3.71Å; V135-F148 HydrophobicContact CG1-CG 4.25Å; L136-F148 CarbonylContact O-C 3.58Å; L136-F148 WeakPolarHBondContact O-CA 3.08Å; L137-F148 HydrophobicContact CD1-CD1 3.99Å; L137-F148 HydrophobicContact CD1-CE1 3.61Å; L137-F148 HydrophobicContact CD1-CE2 4.25Å; L137-F148 HydrophobicContact CD1-CG 4.49Å; L137-F148 HydrophobicContact CD1-CZ 3.74Å; P146-F148 HydrophobicContact CB-CE2 4.13Å; P146-F148 HydrophobicContact CB-CZ 4.41Å; P146-F148 HydrophobicContact CG-CE2 4.19Å; F148-R161 CarbonylContact O-C 3.6Å; F148-R161 WeakPolarHBondContact O-CA 3.45Å; F148-V162 HydrophobicContact CB-CB 4.18Å; F148-V162 PolarHBondContact O-N 2.72Å; F148-M164 HydrophobicContact CD2-CG 3.5Å; F148-M164 HydrophobicContact CE2-CG 3.89Å; F148-M164 HydrophobicContact CG-CG 4.14Å
149	F	61.2	Low	57.6	Low	37 Å²	37	80 Å²	80	16%	0.162	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	122.3	175.2	-73.6	-88.7	0	0	0	108.5	V135 L136 V138 Q147 P159 V160 R161	V135-F149 CarbonylContact C-O 3.45Å; V135-F149 VanDerWaalsContact CA-O 3.3Å; V135-F149 WeakPolarHBondContact CA-O 3.31Å; L136-F149 HydrophobicContact CB-CB 4.32Å; L136-F149 PolarHBondContact N-O 2.94Å; L136-F149 PolarHBondContact O-N 3.09Å; V138-F149 HydrophobicContact CB-CD2 4.02Å; V138-F149 HydrophobicContact CB-CE2 3.99Å; V138-F149 HydrophobicContact CG2-CD2 3.57Å; V138-F149 HydrophobicContact CG2-CE2 3.91Å; Q147-F149 HydrophobicContact CB-CD2 4.37Å; Q147-F149 HydrophobicContact CB-CE2 3.73Å; F149-P159 HydrophobicContact CB-CB 3.93Å; F149-P159 HydrophobicContact CD1-CB 4.04Å; F149-P159 HydrophobicContact CG-CB 4.35Å; F149-V160 CarbonylContact C-O 3.55Å; F149-V160 VanDerWaalsContact CA-O 3.31Å; F149-V160 WeakPolarHBondContact CA-O 3.3Å; F149-R161 HydrophobicContact CD1-CB 4.06Å; F149-R161 HydrophobicContact CE1-CB 3.71Å; F149-R161 HydrophobicContact CE1-CG 4.28Å; F149-R161 HydrophobicContact CZ-CB 4.27Å; F149-R161 HydrophobicContact CZ-CG 4.36Å
150	A	59.2	Low	57.6	Low	17 Å²	17	77.9 Å²	77.9	14%	0.14	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	140.1	174.7	0	0	0	0	0	109.7	V135 P152 V160 V162	V135-A150 HydrophobicContact CG2-CB 4.28Å; A150-P152 WeakPolarHBondContact O-CD 3.39Å; A150-V160 PolarHBondContact N-O 3.02Å; A150-V160 PolarHBondContact O-N 3.07Å; A150-V162 HydrophobicContact CB-CG2 3.47Å; A150-V162 VanDerWaalsContact CB-CG2 3.47Å
151	Y	52.7	Low	57.4	Low	92 Å²	92	82.7 Å²	82.7	36%	0.361	48%	0.476	S	S	.	.			trans	-88.2	114.5	161.1	-68	-89.4	0	0	0	107.5	L134 L136 V153 P159	L134-Y151 PolarHBondContact O-N 3.12Å; L136-Y151 HydrophobicContact CD1-CE2 3.6Å; L136-Y151 HydrophobicContact CG-CE2 3.98Å; Y151-V153 PolarHBondContact O-N 2.81Å; Y151-P159 HydrophobicContact CD1-CB 4.45Å; Y151-P159 HydrophobicContact CE1-CB 3.92Å; Y151-P159 HydrophobicContact CE1-CG 4.15Å; Y151-P159 HydrophobicContact CE2-CB 4.09Å
152	P	53.7	Low	57.1	Low	43 Å²	43	79.2 Å²	79.2	28%	0.279	45%	0.452	S	S	.	.			trans	-60.1	134	169.2	22.5	-26.4	0	0	0	108.4	A150 C155	A150-P152 WeakPolarHBondContact O-CD 3.39Å; P152-C155 HydrophobicContact CG-CB 4Å; P152-C155 PolarHBondContact O-N 3.06Å
153	V	50.3	Low	56.5	Low	50 Å²	50	79.3 Å²	79.3	30%	0.303	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	145.4	173	-177.7	0	0	0	0	108.3	E124 Y151 C155	E124-V153 WeakPolarHBondContact OE2-CB 3.41Å; Y151-V153 PolarHBondContact O-N 2.81Å; V153-C155 VanDerWaalsContact C-N 3.3Å; V153-C155 PolarHBondContact O-N 3.09Å
154	G	51.7	Low	56.2	Low	68 Å²	68	83.7 Å²	83.7	70%	0.701	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	-3.7	179.3	0	0	0	0	0	116.4
155	C	46.9	Very low	55.4	Low	54 Å²	54	81.5 Å²	81.5	37%	0.365	45%	0.449	S	S	.	.			trans	-116.8	119.5	-178	-62.3	0	0	0	0	112.5	P152 V153 S157	P152-C155 HydrophobicContact CG-CB 4Å; P152-C155 PolarHBondContact O-N 3.06Å; V153-C155 VanDerWaalsContact C-N 3.3Å; V153-C155 PolarHBondContact O-N 3.09Å; C155-S157 WeakPolarHBondContact CB-OG 3.36Å; C155-S157 PolarHBondContact O-N 3.38Å
156	N	54.1	Low	55	Low	188 Å²	188	80.3 Å²	80.3	100%	1.005	44%	0.444	S	S	*	.			trans	-69.4	21.6	167.8	-67.2	-26	0	0	0	113.1
157	S	55.1	Low	54.5	Low	58 Å²	58	84.2 Å²	84.2	41%	0.406	46%	0.461	S	S	.	.	S	Bend	trans	-112.7	141.5	-164.4	68.2	0	0	0	0	112.2	C155	C155-S157 WeakPolarHBondContact CB-OG 3.36Å; C155-S157 PolarHBondContact O-N 3.38Å
158	V	57.1	Low	53.6	Low	119 Å²	119	90 Å²	90	72%	0.721	49%	0.486	S	S	*	.			trans	-7.2	125.6	168.7	-173.7	0	0	0	0	115.5	V160	V158-V160 PolarHBondContact O-N 3.01Å
159	P	56.5	Low	52.9	Low	45 Å²	45	96.2 Å²	96.2	29%	0.292	51%	0.513	S	S	.	.			trans	-54.7	129.5	176.5	19.1	-28.8	0	0	0	111.3	F149 Y151	F149-P159 HydrophobicContact CB-CB 3.93Å; F149-P159 HydrophobicContact CD1-CB 4.04Å; F149-P159 HydrophobicContact CG-CB 4.35Å; Y151-P159 HydrophobicContact CD1-CB 4.45Å; Y151-P159 HydrophobicContact CE1-CB 3.92Å; Y151-P159 HydrophobicContact CE1-CG 4.15Å; Y151-P159 HydrophobicContact CE2-CB 4.09Å
160	V	57.4	Low	52.1	Low	80 Å²	80	102.6 Å²	102.6	49%	0.485	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.4	179.6	-178.8	0	0	0	0	108.6	F149 A150 V158 V162	F149-V160 CarbonylContact C-O 3.55Å; F149-V160 VanDerWaalsContact CA-O 3.31Å; F149-V160 WeakPolarHBondContact CA-O 3.3Å; A150-V160 PolarHBondContact N-O 3.02Å; A150-V160 PolarHBondContact O-N 3.07Å; V158-V160 PolarHBondContact O-N 3.01Å; V160-V162 PolarHBondContact O-N 3.49Å; V160-V162 VanDerWaalsContact O-N 3.11Å
161	R	57.5	Low	51.3	Low	142 Å²	142	108.9 Å²	108.9	54%	0.536	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-62.7	115	173.1	-173.4	-170.6	-67.6	-126.6	-6.7	108.9	Q147 F148 F149 K163	Q147-R161 VanDerWaalsContact CD-NH1 3.27Å; Q147-R161 VanDerWaalsContact OE1-NH1 3.15Å; F148-R161 CarbonylContact O-C 3.6Å; F148-R161 WeakPolarHBondContact O-CA 3.45Å; F149-R161 HydrophobicContact CD1-CB 4.06Å; F149-R161 HydrophobicContact CE1-CB 3.71Å; F149-R161 HydrophobicContact CE1-CG 4.28Å; F149-R161 HydrophobicContact CZ-CB 4.27Å; F149-R161 HydrophobicContact CZ-CG 4.36Å; R161-K163 PolarHBondContact O-N 3.26Å
162	V	56.7	Low	50.9	Low	55 Å²	55	113.4 Å²	113.4	33%	0.333	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.9	111	172.1	-174.1	0	0	0	0	107.3	F148 A150 V160 M164	F148-V162 HydrophobicContact CB-CB 4.18Å; F148-V162 PolarHBondContact O-N 2.72Å; A150-V162 HydrophobicContact CB-CG2 3.47Å; A150-V162 VanDerWaalsContact CB-CG2 3.47Å; V160-V162 PolarHBondContact O-N 3.49Å; V160-V162 VanDerWaalsContact O-N 3.11Å; V162-M164 HydrophobicContact CG1-SD 4.29Å; V162-M164 PolarHBondContact O-N 3.49Å; V162-M164 VanDerWaalsContact O-N 3.11Å
163	K	56	Low	50.5	Low	163 Å²	163	118.6 Å²	118.6	71%	0.709	62%	0.621	S	S	*	*			trans	-75.3	99.2	168.3	-173.4	177.6	-177.5	179	0	106.8	R161 M165	R161-K163 PolarHBondContact O-N 3.26Å; K163-M165 VanDerWaalsContact C-N 3.33Å; K163-M165 HydrophobicContact CD-CE 4.25Å; K163-M165 PolarHBondContact O-N 2.91Å
164	M	53.4	Low	50.2	Low	124 Å²	124	121.5 Å²	121.5	61%	0.611	64%	0.639	S	S	*	*			trans	-62.7	101.4	165.2	-64.9	-65.3	-78.3	0	0	106.6	F148 V162 P166	F148-M164 HydrophobicContact CD2-CG 3.5Å; F148-M164 HydrophobicContact CE2-CG 3.89Å; F148-M164 HydrophobicContact CG-CG 4.14Å; V162-M164 HydrophobicContact CG1-SD 4.29Å; V162-M164 PolarHBondContact O-N 3.49Å; V162-M164 VanDerWaalsContact O-N 3.11Å; M164-P166 WeakPolarHBondContact O-CD 3.46Å
165	M	47.2	Very low	49.6	Very low	123 Å²	123	123.5 Å²	123.5	61%	0.606	64%	0.638	S	S	*	*			trans	-72.4	121.2	159.4	-73.2	-132.4	150.6	0	0	105.4	K163 D167	K163-M165 VanDerWaalsContact C-N 3.33Å; K163-M165 HydrophobicContact CD-CE 4.25Å; K163-M165 PolarHBondContact O-N 2.91Å; M165-D167 VanDerWaalsContact C-N 3.31Å; M165-D167 PolarHBondContact O-N 2.96Å
166	P	47.6	Very low	49.5	Very low	81 Å²	81	126.7 Å²	126.7	53%	0.526	66%	0.658	S	S	.	*			trans	-65.1	105.1	164.6	27.7	-30.9	0	0	0	105.6	M164 F168	M164-P166 WeakPolarHBondContact O-CD 3.46Å; P166-F168 HydrophobicContact CB-CD1 4.15Å; P166-F168 HydrophobicContact CB-CD2 3.5Å; P166-F168 VanDerWaalsContact CB-CD2 3.5Å; P166-F168 HydrophobicContact CB-CE1 3.91Å; P166-F168 HydrophobicContact CB-CE2 3.25Å; P166-F168 HydrophobicContact CB-CG 3.95Å; P166-F168 HydrophobicContact CB-CZ 3.45Å; P166-F168 VanDerWaalsContact CB-CZ 3.45Å; P166-F168 HydrophobicContact CG-CD2 3.46Å; P166-F168 VanDerWaalsContact CG-CD2 3.46Å; P166-F168 HydrophobicContact CG-CE2 3.06Å; P166-F168 HydrophobicContact CG-CG 4.4Å; P166-F168 HydrophobicContact CG-CZ 3.71Å; P166-F168 PolarHBondContact O-N 3.31Å
167	D	46.3	Very low	49	Very low	135 Å²	135	126.5 Å²	126.5	72%	0.722	65%	0.648	S	S	*	*			trans	-66.7	76.5	165.3	-78.8	-19.8	0	0	0	106.9	M165 K169	M165-D167 VanDerWaalsContact C-N 3.31Å; M165-D167 PolarHBondContact O-N 2.96Å; D167-K169 PolarHBondContact O-N 3.42Å
168	F	44.5	Very low	48.5	Very low	157 Å²	157	132.3 Å²	132.3	69%	0.689	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	33.5	176.7	-72.4	-61.7	0	0	0	111.9	P166	P166-F168 HydrophobicContact CB-CD1 4.15Å; P166-F168 HydrophobicContact CB-CD2 3.5Å; P166-F168 VanDerWaalsContact CB-CD2 3.5Å; P166-F168 HydrophobicContact CB-CE1 3.91Å; P166-F168 HydrophobicContact CB-CE2 3.25Å; P166-F168 HydrophobicContact CB-CG 3.95Å; P166-F168 HydrophobicContact CB-CZ 3.45Å; P166-F168 VanDerWaalsContact CB-CZ 3.45Å; P166-F168 HydrophobicContact CG-CD2 3.46Å; P166-F168 VanDerWaalsContact CG-CD2 3.46Å; P166-F168 HydrophobicContact CG-CE2 3.06Å; P166-F168 HydrophobicContact CG-CG 4.4Å; P166-F168 HydrophobicContact CG-CZ 3.71Å; P166-F168 PolarHBondContact O-N 3.31Å
169	K	46.6	Very low	47.8	Very low	189 Å²	189	134 Å²	134	82%	0.822	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-3.8	172.4	-71.7	-166.2	176.9	-173.3	0	113.7	D167	D167-K169 PolarHBondContact O-N 3.42Å
170	F	44.5	Very low	47.1	Very low	171 Å²	171	139.1 Å²	139.1	75%	0.75	69%	0.69	S	S	*	*	S	Bend	trans	-126.4	2.6	-175.9	-69.2	-73.4	0	0	0	116
171	L	41	Very low	46.5	Very low	149 Å²	149	142.4 Å²	142.4	78%	0.78	70%	0.704	S	S	*	*	S	Bend	trans	-90.4	-10.4	-175.8	-125.2	83.6	0	0	0	115.5
172	E	45.7	Very low	45.9	Very low	187 Å²	187	144.1 Å²	144.1	87%	0.874	72%	0.718	S	S	*	*	S	Bend	trans	-90.5	-17.2	-172.1	-99.6	175.9	170	0	0	116.4
173	D	44	Very low	45.5	Very low	152 Å²	152	146.3 Å²	146.3	81%	0.813	73%	0.732	S	S	*	*	S	Bend	trans	-126.5	9.3	-174.2	-84.8	-27.3	0	0	0	116.4	T175	D173-T175 VanDerWaalsContact C-N 3.31Å; D173-T175 PolarHBondContact O-N 3.34Å
174	V	43.5	Very low	45.2	Very low	111 Å²	111	143.3 Å²	143.3	67%	0.673	73%	0.729	S	S	*	*			trans	-100.9	61.4	166.7	-156.6	0	0	0	0	108.8
175	T	40	Very low	45	Very low	111 Å²	111	147.1 Å²	147.1	68%	0.681	74%	0.742	S	S	*	*			trans	-43.8	131.6	148.2	-11.4	0	0	0	0	105.6	D173 K177	D173-T175 VanDerWaalsContact C-N 3.31Å; D173-T175 PolarHBondContact O-N 3.34Å; T175-K177 PolarHBondContact O-N 2.58Å
176	P	43.6	Very low	45.2	Very low	120 Å²	120	148.4 Å²	148.4	78%	0.779	75%	0.751	S	S	*	*			trans	-66.4	81.8	-174.6	26.9	-34.4	0	0	0	108.3	K178	P176-K178 PolarHBondContact O-N 2.67Å
177	K	45.5	Very low	45.5	Very low	185 Å²	185	153.6 Å²	153.6	80%	0.804	77%	0.765	S	S	*	*			trans	-65	86.3	168.1	-113.5	-172.5	-179.7	175.2	0	103.2	T175 L179	T175-K177 PolarHBondContact O-N 2.58Å; K177-L179 PolarHBondContact O-N 2.73Å
178	K	43.1	Very low	45.9	Very low	180 Å²	180	156.8 Å²	156.8	78%	0.783	77%	0.772	S	S	*	*			trans	11.6	70.8	165.3	-70.6	176	176.8	177.2	0	110.3	P176 Q180	P176-K178 PolarHBondContact O-N 2.67Å; K178-Q180 PolarHBondContact O-N 2.77Å
179	L	43.6	Very low	46.5	Very low	153 Å²	153	155 Å²	155	80%	0.801	77%	0.774	S	S	*	*			trans	-76.1	72.1	162.8	-72.4	173.3	0	0	0	101.7	K177 L181	K177-L179 PolarHBondContact O-N 2.73Å; L179-L181 PolarHBondContact O-N 2.71Å
180	Q	41.7	Very low	47	Very low	153 Å²	153	151.2 Å²	151.2	72%	0.715	77%	0.768	S	S	*	*			trans	-53.4	93.6	146.3	-68.3	-177	4.1	0	0	101.8	K178 Q182	K178-Q180 PolarHBondContact O-N 2.77Å; Q180-Q182 PolarHBondContact O-N 2.76Å
181	L	44.6	Very low	47.7	Very low	150 Å²	150	148 Å²	148	79%	0.785	77%	0.768	S	S	*	*			trans	-45.6	100	159.7	-103.5	134.1	0	0	0	102.9	L179 V183	L179-L181 PolarHBondContact O-N 2.71Å; L181-V183 HydrophobicContact CB-CG2 4.13Å; L181-V183 PolarHBondContact O-N 3.03Å
182	Q	44.7	Very low	48.7	Very low	177 Å²	177	147.7 Å²	147.7	83%	0.827	77%	0.766	S	S	*	*			trans	-66.6	79.9	161.9	-73.4	-174.2	12.9	0	0	102.2	Q180 P184	Q180-Q182 PolarHBondContact O-N 2.76Å; Q182-P184 VanDerWaalsContact C-N 3.29Å; Q182-P184 WeakPolarHBondContact O-CD 2.99Å
183	V	48.8	Very low	49.3	Very low	102 Å²	102	143.9 Å²	143.9	62%	0.618	76%	0.758	S	S	*	*			trans	-56.1	106.9	167.1	178.2	0	0	0	0	101.7	L181 K185	L181-V183 HydrophobicContact CB-CG2 4.13Å; L181-V183 PolarHBondContact O-N 3.03Å; V183-K185 PolarHBondContact O-N 2.72Å
184	P	48.7	Very low	50	Low	99 Å²	99	145.6 Å²	145.6	64%	0.643	76%	0.758	S	S	*	*			trans	-53.1	127	176.2	-18.8	32.2	0	0	0	103.5	Q182 L186	Q182-P184 VanDerWaalsContact C-N 3.29Å; Q182-P184 WeakPolarHBondContact O-CD 2.99Å; P184-L186 PolarHBondContact O-N 2.6Å
185	K	49.6	Very low	50.9	Low	205 Å²	205	147.4 Å²	147.4	89%	0.891	76%	0.763	S	S	*	*			trans	-58.5	90.2	174.7	-70.2	179.6	-178.8	177.7	0	105.4	V183 K187	V183-K185 PolarHBondContact O-N 2.72Å; K185-K187 VanDerWaalsContact C-N 3.27Å; K185-K187 PolarHBondContact O-N 2.82Å
186	L	51.2	Low	51.6	Low	150 Å²	150	148.2 Å²	148.2	79%	0.785	76%	0.763	S	S	*	*			trans	-59.3	104.9	174.3	-78.2	167.1	0	0	0	102	P184 K188	P184-L186 PolarHBondContact O-N 2.6Å; L186-K188 PolarHBondContact O-N 2.68Å
187	K	53.8	Low	52.5	Low	190 Å²	190	147.4 Å²	147.4	83%	0.826	76%	0.758	S	S	*	*			trans	-47.7	117.8	167.7	-73.5	-176.8	177.1	-179.4	0	103.4	K185 V189	K185-K187 VanDerWaalsContact C-N 3.27Å; K185-K187 PolarHBondContact O-N 2.82Å; K187-V189 PolarHBondContact O-N 2.93Å
188	K	55.5	Low	53.2	Low	201 Å²	201	143.7 Å²	143.7	87%	0.874	75%	0.752	S	S	*	*			trans	-56.5	95.2	174.3	-76.3	179.7	175.8	-178.5	0	104.8	L186 P190	L186-K188 PolarHBondContact O-N 2.68Å; K188-P190 WeakPolarHBondContact O-CD 3.4Å
189	V	56	Low	53.9	Low	120 Å²	120	143 Å²	143	73%	0.727	76%	0.756	S	S	*	*			trans	-56.5	122.2	163.1	178.5	0	0	0	0	102.6	K187 S191	K187-V189 PolarHBondContact O-N 2.93Å; V189-S191 PolarHBondContact O-N 2.81Å
190	P	58	Low	54.8	Low	109 Å²	109	140.7 Å²	140.7	71%	0.708	75%	0.748	S	S	*	*			trans	-49.6	109.7	174.1	-23.9	33.3	0	0	0	105.9	K188 D192	K188-P190 WeakPolarHBondContact O-CD 3.4Å; P190-D192 PolarHBondContact O-N 2.98Å
191	S	58.5	Low	55.8	Low	105 Å²	105	136.5 Å²	136.5	73%	0.734	74%	0.735	S	S	*	*			trans	-59.8	114.8	175.3	46.6	0	0	0	0	104.5	V189	V189-S191 PolarHBondContact O-N 2.81Å
192	D	61.7	Low	56.8	Low	141 Å²	141	138.1 Å²	138.1	75%	0.754	73%	0.731	S	S	*	*			trans	-45.3	136.6	168.7	-70.5	-45.2	0	0	0	107.3	P190 K194	P190-D192 PolarHBondContact O-N 2.98Å; D192-K194 PolarHBondContact O-N 2.86Å
193	P	60	Low	58	Low	108 Å²	108	137.1 Å²	137.1	70%	0.701	72%	0.719	S	S	*	*			trans	-51.3	116.7	-179.5	20.8	-30.7	0	0	0	106.1	I195	P193-I195 PolarHBondContact O-N 3Å
194	K	58.3	Low	59	Low	188 Å²	188	137.1 Å²	137.1	82%	0.817	72%	0.724	S	S	*	*			trans	-56.2	94.7	170.4	-79.1	179.4	177.8	-179.9	0	104.7	D192 N196	D192-K194 PolarHBondContact O-N 2.86Å; K194-N196 PolarHBondContact O-N 3.29Å
195	I	61.3	Low	60.2	Low	148 Å²	148	135.3 Å²	135.3	76%	0.759	71%	0.709	S	S	*	*			trans	-63.5	95.4	162.9	-65.5	167.7	0	0	0	101.1	P193	P193-I195 PolarHBondContact O-N 3Å
196	N	55.9	Low	61.5	Low	128 Å²	128	131.2 Å²	131.2	68%	0.684	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-49.1	129.7	170.2	-71.2	-41.6	0	0	0	104.8	K194	K194-N196 PolarHBondContact O-N 3.29Å
197	P	62	Low	62.5	Low	104 Å²	104	130.6 Å²	130.6	68%	0.675	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-49.8	136.7	175	22.6	-32.2	0	0	0	106.8	I199	P197-I199 PolarHBondContact O-N 2.89Å; P197-I199 VanDerWaalsContact O-N 3.07Å
198	P	59.8	Low	63.2	Low	106 Å²	106	124.8 Å²	124.8	69%	0.688	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-48	127.6	179	18.2	-29.8	0	0	0	107.3	V200	P198-V200 WeakPolarHBondContact O-CG2 3.39Å; P198-V200 PolarHBondContact O-N 3.44Å
199	I	58.8	Low	64	Low	166 Å²	166	118.4 Å²	118.4	85%	0.851	66%	0.66	S	S	*	*			trans	-64.9	90.4	173	-62.9	167.7	0	0	0	104.4	P197 S201	P197-I199 PolarHBondContact O-N 2.89Å; P197-I199 VanDerWaalsContact O-N 3.07Å; I199-S201 VanDerWaalsContact C-N 3.34Å; I199-S201 PolarHBondContact O-N 2.7Å
200	V	61	Low	64.6	Low	105 Å²	105	116.7 Å²	116.7	64%	0.636	65%	0.651	S	S	*	*			trans	-69.5	103	174.2	-178.2	0	0	0	0	104.5	P198 R202	P198-V200 WeakPolarHBondContact O-CG2 3.39Å; P198-V200 PolarHBondContact O-N 3.44Å; V200-R202 PolarHBondContact O-N 2.94Å
201	S	63.1	Low	65.1	Low	64 Å²	64	113.7 Å²	113.7	45%	0.448	64%	0.635	S	S	.	*			trans	-60.4	103.7	171.3	173.5	0	0	0	0	107.6	I199 R203 S204	I199-S201 VanDerWaalsContact C-N 3.34Å; I199-S201 PolarHBondContact O-N 2.7Å; S201-R203 PolarHBondContact O-N 2.98Å; S201-R203 WeakPolarHBondContact OG-CB 3.23Å; S201-R203 PolarHBondContact OG-N 3.48Å; S201-S204 PolarHBondContact O-OG 3.17Å
202	R	66.6	Low	65.3	Low	184 Å²	184	109.9 Å²	109.9	69%	0.694	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-62.9	-6.5	171.8	-70.9	-167.9	168	-178.4	-4.4	112.8	V200 S204 D205 Y208	V200-R202 PolarHBondContact O-N 2.94Å; R202-S204 PolarHBondContact O-N 3.5Å; R202-S204 VanDerWaalsContact O-N 3.09Å; R202-D205 WeakPolarHBondContact CA-OD2 3.42Å; R202-D205 WeakPolarHBondContact CB-OD2 3.45Å; R202-D205 WeakPolarHBondContact CG-OD2 3.07Å; R202-D205 VanDerWaalsContact O-CB 3.27Å; R202-D205 WeakPolarHBondContact O-CB 3.49Å; R202-D205 PolarHBondContact O-N 3.23Å; R202-Y208 HydrophobicContact CB-CD2 4.1Å; R202-Y208 VanDerWaalsContact O-CB 3.31Å; R202-Y208 WeakPolarHBondContact O-CB 3.33Å; R202-Y208 WeakPolarHBondContact O-CD2 3.4Å
203	R	69.4	Low	65.5	Low	156 Å²	156	108.3 Å²	108.3	59%	0.589	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-62.3	-15.8	179.8	-58.5	-175	168.4	-167.4	-4.2	114	S201 Y208 E213	S201-R203 PolarHBondContact O-N 2.98Å; S201-R203 WeakPolarHBondContact OG-CB 3.23Å; S201-R203 PolarHBondContact OG-N 3.48Å; R203-Y208 HydrophobicContact CB-CE1 4.45Å; R203-Y208 HydrophobicContact CB-CE2 4.47Å; R203-Y208 HydrophobicContact CG-CD2 4.4Å; R203-Y208 HydrophobicContact CG-CE1 4.13Å; R203-Y208 HydrophobicContact CG-CE2 3.8Å; R203-E213 IonicContact CZ-OE1 3.31Å; R203-E213 VanDerWaalsContact CZ-OE1 3.31Å; R203-E213 IonicContact CZ-OE2 3.98Å; R203-E213 IonicContact NE-OE1 2.88Å; R203-E213 PolarHBondContact NE-OE1 3.28Å; R203-E213 VanDerWaalsContact NH2-CD 3.34Å; R203-E213 IonicContact NH2-OE1 2.86Å; R203-E213 PolarHBondContact NH2-OE1 3.09Å; R203-E213 IonicContact NH2-OE2 2.95Å; R203-E213 PolarHBondContact NH2-OE2 3.21Å
204	S	70.9	Confident	65.7	Low	102 Å²	102	112.2 Å²	112.2	71%	0.713	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-86.9	-10.5	171.7	52.8	0	0	0	0	113.9	S201 R202	S201-S204 PolarHBondContact O-OG 3.17Å; R202-S204 PolarHBondContact O-N 3.5Å; R202-S204 VanDerWaalsContact O-N 3.09Å
205	D	73.8	Confident	65.8	Low	62 Å²	62	105.1 Å²	105.1	33%	0.332	58%	0.578	S	S	.	*	S	Bend	trans	-77.6	140.9	-175	-57.5	-18.6	0	0	0	109.9	R202 D207 Y208	R202-D205 WeakPolarHBondContact CA-OD2 3.42Å; R202-D205 WeakPolarHBondContact CB-OD2 3.45Å; R202-D205 WeakPolarHBondContact CG-OD2 3.07Å; R202-D205 VanDerWaalsContact O-CB 3.27Å; R202-D205 WeakPolarHBondContact O-CB 3.49Å; R202-D205 PolarHBondContact O-N 3.23Å; D205-D207 WeakPolarHBondContact CB-OD1 3.14Å; D205-D207 PolarHBondContact O-N 2.66Å; D205-Y208 WeakPolarHBondContact O-CB 3.41Å; D205-Y208 PolarHBondContact O-N 2.8Å; D205-Y208 VanDerWaalsContact O-N 3.11Å
206	A	75.7	Confident	65.8	Low	118 Å²	118	106.7 Å²	106.7	98%	0.975	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-22.7	-175.7	0	0	0	0	0	113.2
207	D	72.3	Confident	66.1	Low	138 Å²	138	108.6 Å²	108.6	74%	0.738	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	8.7	177.5	62.5	-29.3	0	0	0	112.8	D205 N209	D205-D207 WeakPolarHBondContact CB-OD1 3.14Å; D205-D207 PolarHBondContact O-N 2.66Å; D207-N209 PolarHBondContact O-N 2.72Å
208	Y	69.8	Low	66.1	Low	67 Å²	67	105.5 Å²	105.5	26%	0.263	57%	0.573	S	S	.	*			trans	-62.4	120.3	178.5	176.6	-101.3	0	0	0	111.7	R202 R203 D205 P210 E213	R202-Y208 HydrophobicContact CB-CD2 4.1Å; R202-Y208 VanDerWaalsContact O-CB 3.31Å; R202-Y208 WeakPolarHBondContact O-CB 3.33Å; R202-Y208 WeakPolarHBondContact O-CD2 3.4Å; R203-Y208 HydrophobicContact CB-CE1 4.45Å; R203-Y208 HydrophobicContact CB-CE2 4.47Å; R203-Y208 HydrophobicContact CG-CD2 4.4Å; R203-Y208 HydrophobicContact CG-CE1 4.13Å; R203-Y208 HydrophobicContact CG-CE2 3.8Å; D205-Y208 WeakPolarHBondContact O-CB 3.41Å; D205-Y208 PolarHBondContact O-N 2.8Å; D205-Y208 VanDerWaalsContact O-N 3.11Å; Y208-P210 HydrophobicContact CE1-CB 4.05Å; Y208-E213 HydrophobicContact CE2-CG 4.17Å; Y208-E213 VanDerWaalsContact OH-CG 3.3Å; Y208-E213 WeakPolarHBondContact OH-CG 3.27Å; Y208-E213 PolarHBondContact OH-OE1 3.07Å
209	N	70.7	Confident	66.4	Low	68 Å²	68	105.6 Å²	105.6	36%	0.364	57%	0.567	S	S	.	*			trans	-114.1	116.2	173.3	-175.6	-6.2	0	0	0	109.9	D207 A211 C212	D207-N209 PolarHBondContact O-N 2.72Å; N209-A211 PolarHBondContact O-N 2.94Å; N209-A211 WeakPolarHBondContact OD1-CB 3.32Å; N209-A211 PolarHBondContact OD1-N 3.18Å; N209-C212 HydrophobicContact CB-CB 4.34Å; N209-C212 VanDerWaalsContact O-CB 3.22Å; N209-C212 WeakPolarHBondContact O-CB 3.31Å; N209-C212 PolarHBondContact O-N 3.41Å
210	P	70.2	Confident	66.7	Low	83 Å²	83	100.7 Å²	100.7	54%	0.539	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-64.1	-25.6	179.7	25.1	-33.4	0	0	0	113.2	Y208 C212 E213	Y208-P210 HydrophobicContact CE1-CB 4.05Å; P210-C212 PolarHBondContact O-N 3.45Å; P210-E213 PolarHBondContact O-N 2.87Å
211	A	67.5	Low	67	Low	47 Å²	47	100.4 Å²	100.4	39%	0.388	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-65.8	-10.4	175.4	0	0	0	0	0	113.2	N209 P220	N209-A211 PolarHBondContact O-N 2.94Å; N209-A211 WeakPolarHBondContact OD1-CB 3.32Å; N209-A211 PolarHBondContact OD1-N 3.18Å; A211-P220 HydrophobicContact CB-CB 4.15Å
212	C	62.4	Low	67.4	Low	24 Å²	24	103.5 Å²	103.5	16%	0.162	56%	0.562	C	S	.	*	G	3₁₀ helix	trans	-97.8	-9.1	-179.3	-63.3	0	0	0	0	113	N209 P210 E214 T215 G218	N209-C212 HydrophobicContact CB-CB 4.34Å; N209-C212 VanDerWaalsContact O-CB 3.22Å; N209-C212 WeakPolarHBondContact O-CB 3.31Å; N209-C212 PolarHBondContact O-N 3.41Å; P210-C212 PolarHBondContact O-N 3.45Å; C212-E214 VanDerWaalsContact C-N 3.28Å; C212-E214 PolarHBondContact O-N 3.26Å; C212-T215 PolarHBondContact O-N 3.11Å; C212-T215 PolarHBondContact O-OG1 3.06Å; C212-G218 VanDerWaalsContact CB-C 3.47Å; C212-G218 WeakPolarHBondContact CB-O 3.3Å; C212-G218 PolarHBondContact SG-O 3.28Å
213	E	66.5	Low	67.6	Low	108 Å²	108	100 Å²	100	51%	0.505	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65	-34.2	175.8	-74.6	-166.3	148.9	0	0	111.7	R203 Y208 P210 T215	R203-E213 IonicContact CZ-OE1 3.31Å; R203-E213 VanDerWaalsContact CZ-OE1 3.31Å; R203-E213 IonicContact CZ-OE2 3.98Å; R203-E213 IonicContact NE-OE1 2.88Å; R203-E213 PolarHBondContact NE-OE1 3.28Å; R203-E213 VanDerWaalsContact NH2-CD 3.34Å; R203-E213 IonicContact NH2-OE1 2.86Å; R203-E213 PolarHBondContact NH2-OE1 3.09Å; R203-E213 IonicContact NH2-OE2 2.95Å; R203-E213 PolarHBondContact NH2-OE2 3.21Å; Y208-E213 HydrophobicContact CE2-CG 4.17Å; Y208-E213 VanDerWaalsContact OH-CG 3.3Å; Y208-E213 WeakPolarHBondContact OH-CG 3.27Å; Y208-E213 PolarHBondContact OH-OE1 3.07Å; P210-E213 PolarHBondContact O-N 2.87Å; E213-T215 VanDerWaalsContact C-N 3.32Å
214	E	65	Low	67.9	Low	190 Å²	190	101.6 Å²	101.6	89%	0.888	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-10.1	-177.7	-65.1	-175.3	177.1	0	0	113.4	C212	C212-E214 VanDerWaalsContact C-N 3.28Å; C212-E214 PolarHBondContact O-N 3.26Å
215	T	59.9	Low	68	Low	39 Å²	39	104 Å²	104	24%	0.239	58%	0.58	C	S	.	*	S	Bend	trans	-107.9	132.4	-176	68.3	0	0	0	0	111.5	C212 E213 F217 G218 I219	C212-T215 PolarHBondContact O-N 3.11Å; C212-T215 PolarHBondContact O-OG1 3.06Å; E213-T215 VanDerWaalsContact C-N 3.32Å; T215-F217 PolarHBondContact O-N 3.04Å; T215-G218 PolarHBondContact O-N 3.17Å; T215-G218 WeakPolarHBondContact OG1-CA 3.36Å; T215-G218 PolarHBondContact OG1-N 2.98Å; T215-I219 VanDerWaalsContact CB-O 3.23Å; T215-I219 WeakPolarHBondContact CB-O 3.22Å; T215-I219 WeakPolarHBondContact CG2-O 3.35Å; T215-I219 PolarHBondContact OG1-N 3.45Å; T215-I219 PolarHBondContact OG1-O 3.07Å
216	M	60.5	Low	67.7	Low	182 Å²	182	110.1 Å²	110.1	90%	0.897	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	-26.4	-179.2	-106.6	-169.6	-62.3	0	0	113.9
217	F	62.3	Low	66.8	Low	168 Å²	168	119.4 Å²	119.4	74%	0.737	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	1	-175.6	-60.6	-72.5	0	0	0	113.5	T215 I219	T215-F217 PolarHBondContact O-N 3.04Å; F217-I219 VanDerWaalsContact C-N 3.28Å; F217-I219 HydrophobicContact CB-CD1 3.96Å; F217-I219 HydrophobicContact CB-CG1 4.07Å; F217-I219 PolarHBondContact O-N 3.26Å
218	G	62.5	Low	66.5	Low	38 Å²	38	118.5 Å²	118.5	39%	0.392	61%	0.611	S	S	.	*	S	Bend	trans	62.4	35	-174.2	0	0	0	0	0	113.7	C212 T215	C212-G218 VanDerWaalsContact CB-C 3.47Å; C212-G218 WeakPolarHBondContact CB-O 3.3Å; C212-G218 PolarHBondContact SG-O 3.28Å; T215-G218 PolarHBondContact O-N 3.17Å; T215-G218 WeakPolarHBondContact OG1-CA 3.36Å; T215-G218 PolarHBondContact OG1-N 2.98Å
219	I	65.9	Low	66.3	Low	109 Å²	109	121.2 Å²	121.2	56%	0.559	63%	0.629	S	S	*	*			trans	-110.6	128	175.9	-58.7	173.1	0	0	0	107.5	T215 F217	T215-I219 VanDerWaalsContact CB-O 3.23Å; T215-I219 WeakPolarHBondContact CB-O 3.22Å; T215-I219 WeakPolarHBondContact CG2-O 3.35Å; T215-I219 PolarHBondContact OG1-N 3.45Å; T215-I219 PolarHBondContact OG1-O 3.07Å; F217-I219 VanDerWaalsContact C-N 3.28Å; F217-I219 HydrophobicContact CB-CD1 3.96Å; F217-I219 HydrophobicContact CB-CG1 4.07Å; F217-I219 PolarHBondContact O-N 3.26Å
220	P	64.1	Low	66.1	Low	63 Å²	63	124.1 Å²	124.1	41%	0.409	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-63.4	144.8	178.6	26.6	-32.9	0	0	0	110.7	A211 V222	A211-P220 HydrophobicContact CB-CB 4.15Å; P220-V222 PolarHBondContact O-N 3.04Å
221	P	67.4	Low	65.8	Low	98 Å²	98	126.5 Å²	126.5	64%	0.636	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-60.3	138.4	176.7	24.6	-32.4	0	0	0	110.7
222	V	71.8	Confident	65.7	Low	130 Å²	130	131.5 Å²	131.5	79%	0.788	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-69.2	128.6	177.2	-179.7	0	0	0	0	108.4	P220 E224	P220-V222 PolarHBondContact O-N 3.04Å; V222-E224 PolarHBondContact O-N 2.77Å
223	P	70.9	Confident	65.9	Low	111 Å²	111	138.7 Å²	138.7	72%	0.721	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-59.8	127.8	177.4	21.6	-30.7	0	0	0	110.4	I225	P223-I225 PolarHBondContact O-N 2.88Å
224	E	75.3	Confident	65.9	Low	188 Å²	188	140.9 Å²	140.9	88%	0.879	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-61	117.9	172.8	-83	-177.8	157.2	0	0	109.3	V222 Q226	V222-E224 PolarHBondContact O-N 2.77Å; E224-Q226 PolarHBondContact O-N 2.86Å
225	I	73.9	Confident	66	Low	152 Å²	152	137.1 Å²	137.1	78%	0.779	70%	0.701	S	S	*	*			trans	-73.5	106.9	171.8	-58.5	167.8	0	0	0	106.5	P223 R227	P223-I225 PolarHBondContact O-N 2.88Å; I225-R227 PolarHBondContact O-N 2.95Å
226	Q	68	Low	66.5	Low	192 Å²	192	145.3 Å²	145.3	90%	0.897	74%	0.739	S	S	*	*			trans	-57.8	122.2	167.9	-66.4	-177.6	12.7	0	0	108.3	E224	E224-Q226 PolarHBondContact O-N 2.86Å
227	R	55.3	Low	67	Low	312 Å²	312	141.9 Å²	141.9	100%	1.177	73%	0.725	S	S	*	*			trans	-101.3	0	171	-74.8	-170.9	179.1	-171.5	0.7	110	I225	I225-R227 PolarHBondContact O-N 2.95Å

Retrieved 227 of 227 residues in 742.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).