A0A077ZHS5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZHS5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 185 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	47.9	Very low	40.8	Very low	234 Å²	234	161.5 Å²	161.5	100%	1.153	84%	0.844	S	S	*	*				0	107.8	0	-70.9	-179.3	172.7	0	0	106.3
2	S	35.8	Very low	40.5	Very low	122 Å²	122	158.6 Å²	158.6	85%	0.853	83%	0.83	S	S	*	*			trans	-102.3	127.2	-173.2	-50.1	0	0	0	0	108.6
3	W	39.4	Very low	40.7	Very low	249 Å²	249	154.5 Å²	154.5	94%	0.943	82%	0.823	S	S	*	*			trans	-104.9	107.8	174.2	-76.1	40.7	0	0	0	107.8
4	S	38.7	Very low	40.6	Very low	110 Å²	110	154.6 Å²	154.6	77%	0.769	82%	0.823	S	S	*	*			trans	-81.9	125.5	165.2	44.4	0	0	0	0	108.5
5	V	46	Very low	40.3	Very low	139 Å²	139	153.3 Å²	153.3	84%	0.842	82%	0.815	S	S	*	*			trans	-87.4	112.4	168.7	177.6	0	0	0	0	106.8	E7	V5-E7 PolarHBondContact O-N 3.3Å
6	D	41.8	Very low	39.9	Very low	153 Å²	153	150.4 Å²	150.4	82%	0.818	81%	0.81	S	S	*	*			trans	-65.8	114.4	171.4	-102	-51	0	0	0	109.3	K8	D6-K8 PolarHBondContact O-N 2.91Å
7	E	37.8	Very low	39.8	Very low	184 Å²	184	148.7 Å²	148.7	86%	0.86	81%	0.809	S	S	*	*			trans	-65.6	101.3	160.7	-76.7	179.1	133.3	0	0	108.7	V5	V5-E7 PolarHBondContact O-N 3.3Å
8	K	41	Very low	39.8	Very low	194 Å²	194	146.2 Å²	146.2	84%	0.843	81%	0.805	S	S	*	*			trans	177.1	81.9	153.5	-103.8	164.8	-178.3	174.4	0	109.9	D6	D6-K8 PolarHBondContact O-N 2.91Å
9	D	39.4	Very low	39.5	Very low	166 Å²	166	147.6 Å²	147.6	89%	0.888	81%	0.811	S	S	*	*			trans	-131.6	118.6	151	-88	-40.8	0	0	0	109.1
10	S	38.5	Very low	39.7	Very low	84 Å²	84	149.2 Å²	149.2	59%	0.587	81%	0.812	S	S	*	*			trans	-67.9	126.8	-163.1	-163.8	0	0	0	0	111.9	D12	S10-D12 PolarHBondContact O-N 2.9Å; S10-D12 VanDerWaalsContact O-N 3.12Å
11	I	42.5	Very low	39.8	Very low	142 Å²	142	147.8 Å²	147.8	73%	0.728	81%	0.813	S	S	*	*	G	3₁₀ helix	trans	-62.2	-17.2	179.8	-66.4	164.3	0	0	0	112.2	S13	I11-S13 VanDerWaalsContact C-N 3.33Å; I11-S13 PolarHBondContact O-N 3.38Å
12	D	37.4	Very low	39.3	Very low	126 Å²	126	145.2 Å²	145.2	67%	0.674	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-73.8	-15.5	-175.4	-71.6	-31.4	0	0	0	115	S10	S10-D12 PolarHBondContact O-N 2.9Å; S10-D12 VanDerWaalsContact O-N 3.12Å
13	S	43.1	Very low	39.6	Very low	105 Å²	105	144.8 Å²	144.8	73%	0.734	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-85.9	-5.7	-179.9	-67.5	0	0	0	0	114.6	I11	I11-S13 VanDerWaalsContact C-N 3.33Å; I11-S13 PolarHBondContact O-N 3.38Å
14	L	39.8	Very low	39.7	Very low	157 Å²	157	138.1 Å²	138.1	82%	0.822	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-92.6	0.5	-178.8	-80.4	162.9	0	0	0	114
15	L	36.1	Very low	40.1	Very low	135 Å²	135	140.4 Å²	140.4	71%	0.707	77%	0.774	S	S	*	*			trans	-100.8	17	-173	-67.7	174.8	0	0	0	114.8	P17	L15-P17 WeakPolarHBondContact O-CD 3.27Å
16	S	33	Very low	39.9	Very low	106 Å²	106	138.3 Å²	138.3	74%	0.741	76%	0.758	S	S	*	*			trans	-91.4	111.1	172.1	-66.4	0	0	0	0	110.2	S18	S16-S18 PolarHBondContact O-N 3.33Å
17	P	38	Very low	39.8	Very low	122 Å²	122	133 Å²	133	79%	0.792	74%	0.74	S	S	*	*			trans	-71.9	117.6	172.2	15.5	-4	0	0	0	108.3	L15 D19	L15-P17 WeakPolarHBondContact O-CD 3.27Å; P17-D19 PolarHBondContact O-N 3.08Å
18	S	39.4	Very low	40	Very low	104 Å²	104	132 Å²	132	73%	0.727	73%	0.732	S	S	*	*			trans	-73.2	120.6	168.5	44.8	0	0	0	0	109.4	S16 E20	S16-S18 PolarHBondContact O-N 3.33Å; S18-E20 VanDerWaalsContact C-N 3.34Å; S18-E20 PolarHBondContact O-N 3.28Å
19	D	34.5	Very low	39.9	Very low	172 Å²	172	131.8 Å²	131.8	92%	0.92	73%	0.726	S	S	*	*			trans	-60.6	86.5	170.6	-81.1	-40.8	0	0	0	110.8	P17	P17-D19 PolarHBondContact O-N 3.08Å
20	E	43.6	Very low	40	Very low	179 Å²	179	125.9 Å²	125.9	84%	0.836	71%	0.705	S	S	*	*			trans	-95.6	109.8	159.9	-72.3	-153.5	147.7	0	0	109.2	S18 F22	S18-E20 VanDerWaalsContact C-N 3.34Å; S18-E20 PolarHBondContact O-N 3.28Å; E20-F22 PolarHBondContact O-N 2.88Å
21	S	41.2	Very low	40.4	Very low	120 Å²	120	125.7 Å²	125.7	84%	0.839	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-61.7	116.5	179.2	53.4	0	0	0	0	111.2	N23	S21-N23 PolarHBondContact O-N 2.89Å
22	F	38	Very low	40.9	Very low	181 Å²	181	124.2 Å²	124.2	79%	0.794	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-63.2	118.9	173.5	-137	-95.3	0	0	0	110.2	E20 D26	E20-F22 PolarHBondContact O-N 2.88Å; F22-D26 HydrophobicContact CE1-CB 4.13Å
23	N	42.3	Very low	41.4	Very low	113 Å²	113	122.2 Å²	122.2	60%	0.604	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-77.8	130.7	-179.6	-139.9	-1.2	0	0	0	109.3	S21 E25 D26	S21-N23 PolarHBondContact O-N 2.89Å; N23-E25 PolarHBondContact O-N 3.26Å; N23-D26 PolarHBondContact O-N 3.41Å
24	S	42.3	Very low	41.6	Very low	108 Å²	108	122 Å²	122	76%	0.755	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-11.3	-170.3	64.6	0	0	0	0	115.6
25	E	46.3	Very low	42.2	Very low	158 Å²	158	120.3 Å²	120.3	74%	0.738	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-29.4	172.6	-73.9	-163.6	142.2	0	0	113.2	N23 G27 K28	N23-E25 PolarHBondContact O-N 3.26Å; E25-G27 PolarHBondContact O-N 2.84Å; E25-K28 PolarHBondContact O-N 2.84Å
26	D	43	Very low	42.9	Very low	95 Å²	95	116.8 Å²	116.8	51%	0.508	64%	0.64	S	S	.	*	H	α-helix	trans	-65.6	-27.3	174.2	-68.4	-41.7	0	0	0	111.7	F22 N23 K28 R29 G30	F22-D26 HydrophobicContact CE1-CB 4.13Å; N23-D26 PolarHBondContact O-N 3.41Å; D26-K28 PolarHBondContact O-N 3.26Å; D26-R29 PolarHBondContact O-N 3.22Å; D26-G30 PolarHBondContact O-N 3.11Å
27	G	38.5	Very low	43.6	Very low	42 Å²	42	114 Å²	114	43%	0.433	62%	0.615	S	S	.	*	H	α-helix	trans	-64.8	-21.2	176.6	0	0	0	0	0	114.7	E25	E25-G27 PolarHBondContact O-N 2.84Å
28	K	42.4	Very low	44.2	Very low	162 Å²	162	112 Å²	112	70%	0.704	60%	0.597	S	S	*	*	H	α-helix	trans	-84.2	-43.9	177	-81.2	-179	178.9	173.2	0	112.5	E25 D26 G30 N31 D32	E25-K28 PolarHBondContact O-N 2.84Å; D26-K28 PolarHBondContact O-N 3.26Å; K28-G30 VanDerWaalsContact C-N 3.33Å; K28-G30 PolarHBondContact O-N 3.01Å; K28-N31 PolarHBondContact O-N 3.46Å; K28-D32 PolarHBondContact O-N 3.42Å
29	R	39.5	Very low	44.9	Very low	190 Å²	190	109.9 Å²	109.9	72%	0.717	59%	0.586	S	S	*	*	H	α-helix	trans	-63.1	-39.1	176.5	-82.9	-175.5	168.7	-159.2	-4	111.8	D26 N31 D32 F33	D26-R29 PolarHBondContact O-N 3.22Å; R29-N31 VanDerWaalsContact C-N 3.27Å; R29-N31 PolarHBondContact O-N 3.12Å; R29-D32 PolarHBondContact O-N 3.11Å; R29-F33 PolarHBondContact O-N 3.2Å
30	G	41.3	Very low	45.7	Very low	43 Å²	43	104.7 Å²	104.7	44%	0.443	56%	0.558	S	S	.	*	H	α-helix	trans	-62.4	-31	175	0	0	0	0	0	113.9	D26 K28 H34	D26-G30 PolarHBondContact O-N 3.11Å; K28-G30 VanDerWaalsContact C-N 3.33Å; K28-G30 PolarHBondContact O-N 3.01Å; G30-H34 WeakPolarHBondContact O-CB 3.47Å; G30-H34 PolarHBondContact O-N 2.88Å
31	N	46.2	Very low	46	Very low	80 Å²	80	97.3 Å²	97.3	43%	0.428	52%	0.524	S	S	.	.	H	α-helix	trans	-76.5	-35.9	-177.1	-159.2	-0.4	0	0	0	112.6	K28 R29 K35	K28-N31 PolarHBondContact O-N 3.46Å; R29-N31 VanDerWaalsContact C-N 3.27Å; R29-N31 PolarHBondContact O-N 3.12Å; N31-K35 VanDerWaalsContact O-CG 3.3Å; N31-K35 WeakPolarHBondContact O-CG 3.34Å; N31-K35 PolarHBondContact O-N 3.36Å
32	D	52.7	Low	46.5	Very low	111 Å²	111	96.5 Å²	96.5	59%	0.594	51%	0.51	S	S	*	.	H	α-helix	trans	-71.4	-41	177.3	-70.8	-20.7	0	0	0	111.4	K28 R29 K35 A36	K28-D32 PolarHBondContact O-N 3.42Å; R29-D32 PolarHBondContact O-N 3.11Å; D32-K35 PolarHBondContact O-N 2.99Å; D32-A36 WeakPolarHBondContact O-CB 3.42Å; D32-A36 PolarHBondContact O-N 3.23Å
33	F	47.2	Very low	47	Very low	84 Å²	84	89.2 Å²	89.2	37%	0.368	49%	0.486	S	S	.	.	H	α-helix	trans	-62.2	-45.7	171.7	179.8	-94.2	0	0	0	111.5	R29 K35 A36 F37 Y96	R29-F33 PolarHBondContact O-N 3.2Å; F33-K35 VanDerWaalsContact C-N 3.32Å; F33-K35 PolarHBondContact O-N 3.5Å; F33-A36 PolarHBondContact O-N 3Å; F33-F37 VanDerWaalsContact O-CB 3.3Å; F33-F37 WeakPolarHBondContact O-CB 3.47Å; F33-F37 PolarHBondContact O-N 3.01Å; F33-Y96 HydrophobicContact CE1-CD2 4.17Å; F33-Y96 HydrophobicContact CE1-CE1 4.16Å; F33-Y96 AromaticContact CE1-CE2 3.44Å; F33-Y96 HydrophobicContact CE1-CE2 3.44Å; F33-Y96 VanDerWaalsContact CE1-CE2 3.44Å; F33-Y96 AromaticContact CE1-CZ 3.45Å; F33-Y96 VanDerWaalsContact CE1-CZ 3.45Å; F33-Y96 WeakPolarHBondContact CE1-OH 3.23Å; F33-Y96 HydrophobicContact CE2-CE2 4.45Å; F33-Y96 AromaticContact CZ-CD2 3.78Å; F33-Y96 HydrophobicContact CZ-CD2 3.78Å; F33-Y96 AromaticContact CZ-CE2 3.35Å; F33-Y96 HydrophobicContact CZ-CE2 3.35Å; F33-Y96 AromaticContact CZ-CZ 3.9Å
34	H	49.2	Very low	47.3	Very low	100 Å²	100	86 Å²	86	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-60.7	-39.4	178.2	-173.9	70.4	0	0	0	112.4	G30 F37 L38	G30-H34 WeakPolarHBondContact O-CB 3.47Å; G30-H34 PolarHBondContact O-N 2.88Å; H34-F37 WeakPolarHBondContact O-CB 3.39Å; H34-F37 PolarHBondContact O-N 3.21Å; H34-L38 WeakPolarHBondContact O-CG 3.14Å; H34-L38 PolarHBondContact O-N 3.47Å
35	K	52.3	Low	47.6	Very low	121 Å²	121	85.9 Å²	85.9	53%	0.526	46%	0.456	S	S	.	.	H	α-helix	trans	-66.4	-44.1	173.6	-75.1	173.7	-174.8	172.2	0	112.6	N31 D32 F33 F37 L38 A39	N31-K35 VanDerWaalsContact O-CG 3.3Å; N31-K35 WeakPolarHBondContact O-CG 3.34Å; N31-K35 PolarHBondContact O-N 3.36Å; D32-K35 PolarHBondContact O-N 2.99Å; F33-K35 VanDerWaalsContact C-N 3.32Å; F33-K35 PolarHBondContact O-N 3.5Å; K35-F37 PolarHBondContact O-N 3.39Å; K35-L38 PolarHBondContact O-N 3.39Å; K35-A39 WeakPolarHBondContact O-CB 3.47Å; K35-A39 PolarHBondContact O-N 3.14Å
36	A	49	Very low	47.7	Very low	62 Å²	62	82.8 Å²	82.8	51%	0.512	44%	0.444	S	S	.	.	H	α-helix	trans	-61.6	-37.3	175.6	0	0	0	0	0	111.2	D32 F33 A39 L40	D32-A36 WeakPolarHBondContact O-CB 3.42Å; D32-A36 PolarHBondContact O-N 3.23Å; F33-A36 PolarHBondContact O-N 3Å; A36-A39 PolarHBondContact O-N 3.02Å; A36-L40 WeakPolarHBondContact O-CB 3.5Å; A36-L40 PolarHBondContact O-N 3.35Å
37	F	47.9	Very low	47.9	Very low	47 Å²	47	81.1 Å²	81.1	21%	0.206	44%	0.438	C	S	.	.	H	α-helix	trans	-64.8	-49.3	174.2	175.3	-96.6	0	0	0	112.1	F33 H34 K35 A39 L40 I41 L100	F33-F37 VanDerWaalsContact O-CB 3.3Å; F33-F37 WeakPolarHBondContact O-CB 3.47Å; F33-F37 PolarHBondContact O-N 3.01Å; H34-F37 WeakPolarHBondContact O-CB 3.39Å; H34-F37 PolarHBondContact O-N 3.21Å; K35-F37 PolarHBondContact O-N 3.39Å; F37-A39 VanDerWaalsContact C-N 3.28Å; F37-A39 PolarHBondContact O-N 2.87Å; F37-L40 CarbonylContact O-C 3.55Å; F37-L40 WeakPolarHBondContact O-CA 3.15Å; F37-L40 WeakPolarHBondContact O-CB 3.3Å; F37-L40 PolarHBondContact O-N 2.83Å; F37-I41 HydrophobicContact CD1-CG1 4.17Å; F37-I41 HydrophobicContact CE1-CD1 4.29Å; F37-I41 HydrophobicContact CE1-CG1 3.72Å; F37-I41 HydrophobicContact CE2-CD1 4.02Å; F37-I41 HydrophobicContact CE2-CG1 4.13Å; F37-I41 HydrophobicContact CZ-CD1 3.76Å; F37-I41 HydrophobicContact CZ-CG1 3.71Å; F37-I41 WeakPolarHBondContact O-CG1 3.24Å; F37-I41 PolarHBondContact O-N 3.36Å; F37-L100 HydrophobicContact CE2-CD2 4.49Å; F37-L100 HydrophobicContact CZ-CD2 4.49Å
38	L	51	Low	48.2	Very low	79 Å²	79	81.5 Å²	81.5	41%	0.414	44%	0.437	S	S	.	.	H	α-helix	trans	-58.9	-41.9	175.2	-71.2	176.4	0	0	0	111.3	H34 K35 L40 I41 D42	H34-L38 WeakPolarHBondContact O-CG 3.14Å; H34-L38 PolarHBondContact O-N 3.47Å; K35-L38 PolarHBondContact O-N 3.39Å; L38-L40 VanDerWaalsContact C-N 3.32Å; L38-L40 PolarHBondContact O-N 3.26Å; L38-I41 PolarHBondContact O-N 2.91Å; L38-D42 WeakPolarHBondContact O-CB 3.39Å; L38-D42 PolarHBondContact O-N 3.44Å
39	A	54.9	Low	48.2	Very low	61 Å²	61	81.7 Å²	81.7	50%	0.504	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-36.1	174.6	0	0	0	0	0	112.7	K35 A36 F37 G43	K35-A39 WeakPolarHBondContact O-CB 3.47Å; K35-A39 PolarHBondContact O-N 3.14Å; A36-A39 PolarHBondContact O-N 3.02Å; F37-A39 VanDerWaalsContact C-N 3.28Å; F37-A39 PolarHBondContact O-N 2.87Å; A39-G43 PolarHBondContact O-N 2.68Å
40	L	49.9	Very low	48.5	Very low	63 Å²	63	76.2 Å²	76.2	33%	0.33	42%	0.418	S	S	.	.	H	α-helix	trans	-66.8	-45.9	173.6	177.8	68	0	0	0	111.2	A36 F37 L38 G43 L44 V80	A36-L40 WeakPolarHBondContact O-CB 3.5Å; A36-L40 PolarHBondContact O-N 3.35Å; F37-L40 CarbonylContact O-C 3.55Å; F37-L40 WeakPolarHBondContact O-CA 3.15Å; F37-L40 WeakPolarHBondContact O-CB 3.3Å; F37-L40 PolarHBondContact O-N 2.83Å; L38-L40 VanDerWaalsContact C-N 3.32Å; L38-L40 PolarHBondContact O-N 3.26Å; L40-G43 CarbonylContact O-C 3.44Å; L40-G43 PolarHBondContact O-N 3.24Å; L40-L44 HydrophobicContact CD1-CD1 4.29Å; L40-L44 HydrophobicContact CD1-CG 4.21Å; L40-L44 HydrophobicContact CG-CD1 4.04Å; L40-L44 HydrophobicContact CG-CG 4.35Å; L40-L44 WeakPolarHBondContact O-CB 3.36Å; L40-L44 VanDerWaalsContact O-CG 3.25Å; L40-L44 WeakPolarHBondContact O-CG 3.48Å; L40-L44 PolarHBondContact O-N 3.28Å; L40-V80 HydrophobicContact CD1-CG1 3.6Å; L40-V80 HydrophobicContact CD1-CG2 4.31Å; L40-V80 HydrophobicContact CD2-CG1 3.9Å; L40-V80 HydrophobicContact CG-CG1 4.4Å
41	I	51.8	Low	48.6	Very low	24 Å²	24	77.2 Å²	77.2	12%	0.123	42%	0.415	C	S	.	.	H	α-helix	trans	-60.6	-48.3	176.4	-64.1	-60.1	0	0	0	110.4	F37 L38 G43 L44 Q45 L100	F37-I41 HydrophobicContact CD1-CG1 4.17Å; F37-I41 HydrophobicContact CE1-CD1 4.29Å; F37-I41 HydrophobicContact CE1-CG1 3.72Å; F37-I41 HydrophobicContact CE2-CD1 4.02Å; F37-I41 HydrophobicContact CE2-CG1 4.13Å; F37-I41 HydrophobicContact CZ-CD1 3.76Å; F37-I41 HydrophobicContact CZ-CG1 3.71Å; F37-I41 WeakPolarHBondContact O-CG1 3.24Å; F37-I41 PolarHBondContact O-N 3.36Å; L38-I41 PolarHBondContact O-N 2.91Å; I41-G43 VanDerWaalsContact C-N 3.28Å; I41-G43 PolarHBondContact O-N 3.39Å; I41-L44 PolarHBondContact O-N 3.43Å; I41-Q45 HydrophobicContact CG2-CG 4.24Å; I41-Q45 WeakPolarHBondContact O-CB 3.49Å; I41-Q45 VanDerWaalsContact O-CG 3.26Å; I41-Q45 WeakPolarHBondContact O-CG 3.48Å; I41-Q45 PolarHBondContact O-N 2.83Å; I41-L100 HydrophobicContact CD1-CD2 3.6Å
42	D	51	Low	48.3	Very low	102 Å²	102	75.6 Å²	75.6	55%	0.545	41%	0.406	S	S	.	.	H	α-helix	trans	-60	-41.2	176.6	-74.2	-13.4	0	0	0	110.8	L38 L46	L38-D42 WeakPolarHBondContact O-CB 3.39Å; L38-D42 PolarHBondContact O-N 3.44Å; D42-L46 WeakPolarHBondContact O-CB 3.28Å; D42-L46 PolarHBondContact O-N 3.24Å
43	G	48.2	Very low	47.9	Very low	29 Å²	29	73.9 Å²	73.9	30%	0.299	40%	0.396	S	S	.	.	H	α-helix	trans	-64.3	-43.7	175.8	0	0	0	0	0	113	A39 L40 I41 L46 T47	A39-G43 PolarHBondContact O-N 2.68Å; L40-G43 CarbonylContact O-C 3.44Å; L40-G43 PolarHBondContact O-N 3.24Å; I41-G43 VanDerWaalsContact C-N 3.28Å; I41-G43 PolarHBondContact O-N 3.39Å; G43-L46 PolarHBondContact O-N 2.85Å; G43-T47 VanDerWaalsContact O-CB 3.28Å; G43-T47 WeakPolarHBondContact O-CB 3.47Å; G43-T47 PolarHBondContact O-N 2.81Å; G43-T47 PolarHBondContact O-OG1 2.87Å
44	L	49.5	Very low	47.9	Very low	45 Å²	45	76.8 Å²	76.8	24%	0.236	41%	0.411	C	S	.	.	H	α-helix	trans	-66.6	-43.9	177	-73.8	175.5	0	0	0	111.5	L40 I41 T47 A48 L78 V80	L40-L44 HydrophobicContact CD1-CD1 4.29Å; L40-L44 HydrophobicContact CD1-CG 4.21Å; L40-L44 HydrophobicContact CG-CD1 4.04Å; L40-L44 HydrophobicContact CG-CG 4.35Å; L40-L44 WeakPolarHBondContact O-CB 3.36Å; L40-L44 VanDerWaalsContact O-CG 3.25Å; L40-L44 WeakPolarHBondContact O-CG 3.48Å; L40-L44 PolarHBondContact O-N 3.28Å; I41-L44 PolarHBondContact O-N 3.43Å; L44-T47 PolarHBondContact O-N 2.77Å; L44-A48 WeakPolarHBondContact O-CB 3.35Å; L44-A48 PolarHBondContact O-N 3.44Å; L44-L78 HydrophobicContact CD2-CD1 4.24Å; L44-L78 HydrophobicContact CD2-CD2 3.52Å; L44-L78 HydrophobicContact CD2-CG 4.33Å; L44-V80 HydrophobicContact CD2-CG2 4.16Å
45	Q	47.8	Very low	47.5	Very low	105 Å²	105	77.5 Å²	77.5	49%	0.491	42%	0.418	S	S	.	.	H	α-helix	trans	-61.9	-45.1	174.2	-73.6	179.5	-1.8	0	0	111.1	I41 T47 R49	I41-Q45 HydrophobicContact CG2-CG 4.24Å; I41-Q45 WeakPolarHBondContact O-CB 3.49Å; I41-Q45 VanDerWaalsContact O-CG 3.26Å; I41-Q45 WeakPolarHBondContact O-CG 3.48Å; I41-Q45 PolarHBondContact O-N 2.83Å; Q45-T47 VanDerWaalsContact C-N 3.35Å; Q45-R49 WeakPolarHBondContact O-CB 3.45Å; Q45-R49 PolarHBondContact O-N 2.81Å
46	L	47.6	Very low	47	Very low	93 Å²	93	77.3 Å²	77.3	49%	0.487	42%	0.422	S	S	.	.	H	α-helix	trans	-62.8	-42.5	177	-173.5	69.9	0	0	0	111.3	D42 G43 R49 N50	D42-L46 WeakPolarHBondContact O-CB 3.28Å; D42-L46 PolarHBondContact O-N 3.24Å; G43-L46 PolarHBondContact O-N 2.85Å; L46-R49 PolarHBondContact O-N 2.78Å; L46-N50 WeakPolarHBondContact O-CB 3.26Å; L46-N50 PolarHBondContact O-N 3.34Å; L46-N50 PolarHBondContact O-ND2 3.37Å
47	T	48.3	Very low	47.1	Very low	61 Å²	61	80.7 Å²	80.7	37%	0.374	43%	0.431	S	S	.	.	H	α-helix	trans	-66	-51.2	178.4	-57.2	0	0	0	0	110.3	G43 L44 Q45 R49 N50 T51	G43-T47 VanDerWaalsContact O-CB 3.28Å; G43-T47 WeakPolarHBondContact O-CB 3.47Å; G43-T47 PolarHBondContact O-N 2.81Å; G43-T47 PolarHBondContact O-OG1 2.87Å; L44-T47 PolarHBondContact O-N 2.77Å; Q45-T47 VanDerWaalsContact C-N 3.35Å; T47-R49 PolarHBondContact O-N 3.08Å; T47-N50 PolarHBondContact O-N 2.9Å; T47-N50 VanDerWaalsContact O-N 3.11Å; T47-T51 WeakPolarHBondContact O-CB 3.4Å; T47-T51 PolarHBondContact O-N 2.99Å; T47-T51 PolarHBondContact O-OG1 3.14Å
48	A	44.8	Very low	46.9	Very low	49 Å²	49	80.9 Å²	80.9	41%	0.405	45%	0.446	S	S	.	.	H	α-helix	trans	-58.1	-38.2	177.4	0	0	0	0	0	112.3	L44 M52 R174	L44-A48 WeakPolarHBondContact O-CB 3.35Å; L44-A48 PolarHBondContact O-N 3.44Å; A48-M52 WeakPolarHBondContact O-CB 3.26Å; A48-M52 PolarHBondContact O-N 3.1Å; A48-R174 PolarHBondContact O-NH2 2.93Å; A48-R174 VanDerWaalsContact O-NH2 3.11Å
49	R	41.6	Very low	46.4	Very low	167 Å²	167	84.2 Å²	84.2	63%	0.63	47%	0.465	S	S	*	.	H	α-helix	trans	-66.3	-48.7	173.6	-178.8	-177.1	176.7	-166.6	-1.6	111.7	Q45 L46 T47 M52 L53	Q45-R49 WeakPolarHBondContact O-CB 3.45Å; Q45-R49 PolarHBondContact O-N 2.81Å; L46-R49 PolarHBondContact O-N 2.78Å; T47-R49 PolarHBondContact O-N 3.08Å; R49-M52 WeakPolarHBondContact O-CA 3.21Å; R49-M52 VanDerWaalsContact O-CB 3.3Å; R49-M52 WeakPolarHBondContact O-CB 3.29Å; R49-M52 PolarHBondContact O-N 3.37Å; R49-M52 VanDerWaalsContact O-N 3.12Å; R49-L53 HydrophobicContact CG-CD1 4.22Å; R49-L53 WeakPolarHBondContact O-CG 3.46Å; R49-L53 PolarHBondContact O-N 2.84Å
50	N	46.2	Very low	45.7	Very low	75 Å²	75	88.9 Å²	88.9	40%	0.401	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-43.4	-180	-73	-13.7	0	0	0	111.5	L46 T47 M52 L53 Q54	L46-N50 WeakPolarHBondContact O-CB 3.26Å; L46-N50 PolarHBondContact O-N 3.34Å; L46-N50 PolarHBondContact O-ND2 3.37Å; T47-N50 PolarHBondContact O-N 2.9Å; T47-N50 VanDerWaalsContact O-N 3.11Å; N50-M52 VanDerWaalsContact C-N 3.29Å; N50-M52 PolarHBondContact O-N 3.21Å; N50-L53 PolarHBondContact O-N 3.42Å; N50-Q54 WeakPolarHBondContact O-CG 3.39Å; N50-Q54 PolarHBondContact O-N 3.45Å
51	T	43.7	Very low	45.5	Very low	63 Å²	63	95.3 Å²	95.3	39%	0.387	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-37.7	172.9	-52.5	0	0	0	0	111.2	T47 L55	T47-T51 WeakPolarHBondContact O-CB 3.4Å; T47-T51 PolarHBondContact O-N 2.99Å; T47-T51 PolarHBondContact O-OG1 3.14Å; T51-L55 HydrophobicContact CG2-CD1 4.12Å; T51-L55 WeakPolarHBondContact O-CB 3.42Å; T51-L55 WeakPolarHBondContact O-CD1 3.3Å; T51-L55 VanDerWaalsContact O-CG 3.24Å; T51-L55 WeakPolarHBondContact O-CG 3.41Å; T51-L55 PolarHBondContact O-N 3.3Å; T51-L55 VanDerWaalsContact O-N 3.08Å
52	M	40.1	Very low	44.7	Very low	47 Å²	47	100.2 Å²	100.2	23%	0.232	55%	0.546	C	S	.	.	H	α-helix	trans	-62.4	-46.2	173.4	-152.3	159.9	164.9	0	0	112	A48 R49 N50 L55 L56 R174 E177	A48-M52 WeakPolarHBondContact O-CB 3.26Å; A48-M52 PolarHBondContact O-N 3.1Å; R49-M52 WeakPolarHBondContact O-CA 3.21Å; R49-M52 VanDerWaalsContact O-CB 3.3Å; R49-M52 WeakPolarHBondContact O-CB 3.29Å; R49-M52 PolarHBondContact O-N 3.37Å; R49-M52 VanDerWaalsContact O-N 3.12Å; N50-M52 VanDerWaalsContact C-N 3.29Å; N50-M52 PolarHBondContact O-N 3.21Å; M52-L55 PolarHBondContact O-N 2.93Å; M52-L56 HydrophobicContact CE-CD1 4.45Å; M52-L56 HydrophobicContact CG-CD1 3.9Å; M52-L56 WeakPolarHBondContact O-CB 3.39Å; M52-L56 VanDerWaalsContact O-CG 3.23Å; M52-L56 WeakPolarHBondContact O-CG 3.49Å; M52-L56 PolarHBondContact O-N 3.4Å; M52-R174 VanDerWaalsContact CA-NH1 3.26Å; M52-R174 VanDerWaalsContact CG-NH2 3.31Å; M52-R174 PolarHBondContact SD-NH2 3.22Å; M52-E177 HydrophobicContact CE-CB 4.04Å; M52-E177 HydrophobicContact CE-CG 4Å
53	L	44.7	Very low	44	Very low	74 Å²	74	98.8 Å²	98.8	39%	0.387	56%	0.556	S	S	.	*	H	α-helix	trans	-64.6	-39.5	179.4	-71.1	171	0	0	0	112.1	R49 N50 L56 N57	R49-L53 HydrophobicContact CG-CD1 4.22Å; R49-L53 WeakPolarHBondContact O-CG 3.46Å; R49-L53 PolarHBondContact O-N 2.84Å; N50-L53 PolarHBondContact O-N 3.42Å; L53-L56 PolarHBondContact O-N 3.07Å; L53-N57 VanDerWaalsContact O-CB 3.27Å; L53-N57 WeakPolarHBondContact O-CB 3.38Å; L53-N57 PolarHBondContact O-N 3.01Å; L53-N57 PolarHBondContact O-ND2 3.43Å
54	Q	47.4	Very low	43.4	Very low	145 Å²	145	104.9 Å²	104.9	68%	0.678	59%	0.586	S	S	*	*	H	α-helix	trans	-63.8	-41.5	174.4	-75	179.5	-4.8	0	0	112.1	N50 G58	N50-Q54 WeakPolarHBondContact O-CG 3.39Å; N50-Q54 PolarHBondContact O-N 3.45Å; Q54-G58 PolarHBondContact O-N 2.91Å
55	L	40.7	Very low	42.6	Very low	116 Å²	116	106 Å²	106	61%	0.607	61%	0.609	S	S	*	*	H	α-helix	trans	-68.5	-34.5	176.6	-70.6	167.9	0	0	0	112.4	T51 M52	T51-L55 HydrophobicContact CG2-CD1 4.12Å; T51-L55 WeakPolarHBondContact O-CB 3.42Å; T51-L55 WeakPolarHBondContact O-CD1 3.3Å; T51-L55 VanDerWaalsContact O-CG 3.24Å; T51-L55 WeakPolarHBondContact O-CG 3.41Å; T51-L55 PolarHBondContact O-N 3.3Å; T51-L55 VanDerWaalsContact O-N 3.08Å; M52-L55 PolarHBondContact O-N 2.93Å
56	L	40.6	Very low	42.2	Very low	116 Å²	116	110 Å²	110	61%	0.607	63%	0.627	S	S	*	*	H	α-helix	trans	-79.2	-27.2	179	-70.7	167.8	0	0	0	113.2	M52 L53 G58	M52-L56 HydrophobicContact CE-CD1 4.45Å; M52-L56 HydrophobicContact CG-CD1 3.9Å; M52-L56 WeakPolarHBondContact O-CB 3.39Å; M52-L56 VanDerWaalsContact O-CG 3.23Å; M52-L56 WeakPolarHBondContact O-CG 3.49Å; M52-L56 PolarHBondContact O-N 3.4Å; L53-L56 PolarHBondContact O-N 3.07Å; L56-G58 VanDerWaalsContact C-N 3.31Å
57	N	50.7	Low	41.6	Very low	133 Å²	133	114.7 Å²	114.7	71%	0.711	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	8.3	176.1	-65.1	-19.7	0	0	0	112.8	L53	L53-N57 VanDerWaalsContact O-CB 3.27Å; L53-N57 WeakPolarHBondContact O-CB 3.38Å; L53-N57 PolarHBondContact O-N 3.01Å; L53-N57 PolarHBondContact O-ND2 3.43Å
58	G	44	Very low	41	Very low	51 Å²	51	116.4 Å²	116.4	53%	0.526	67%	0.667	S	S	.	*	S	Bend	trans	-89.7	1.9	-166.1	0	0	0	0	0	117.3	Q54 L56	Q54-G58 PolarHBondContact O-N 2.91Å; L56-G58 VanDerWaalsContact C-N 3.31Å
59	D	41.4	Very low	40.3	Very low	150 Å²	150	121.1 Å²	121.1	80%	0.802	69%	0.686	S	S	*	*	S	Bend	trans	-143.3	96.6	175.3	-90.6	-33.9	0	0	0	109.2
60	D	40.4	Very low	40	Very low	158 Å²	158	118.9 Å²	118.9	85%	0.845	69%	0.694	S	S	*	*			trans	157	80.5	146.5	-81.7	-23	0	0	0	109.4
61	E	44.8	Very low	39.2	Very low	198 Å²	198	124.9 Å²	124.9	93%	0.925	72%	0.717	S	S	*	*			trans	-152.8	110.4	132.3	-79.5	-135.3	167.8	0	0	109.6
62	S	35.8	Very low	38.6	Very low	128 Å²	128	125.2 Å²	125.2	90%	0.895	73%	0.733	S	S	*	*			trans	-70.5	123.7	168.1	38.5	0	0	0	0	109.3
63	G	35.9	Very low	38.1	Very low	72 Å²	72	131.3 Å²	131.3	74%	0.742	77%	0.766	S	S	*	*			trans	-173.3	74.4	-178.4	0	0	0	0	0	114.6
64	V	35.1	Very low	37.3	Very low	156 Å²	156	131.4 Å²	131.4	95%	0.945	79%	0.785	S	S	*	*			trans	19.3	116.1	141.1	-172.4	0	0	0	0	117
65	G	33.7	Very low	36.8	Very low	68 Å²	68	128.7 Å²	128.7	70%	0.701	79%	0.787	S	S	*	*			trans	154.4	93.3	156.8	0	0	0	0	0	115.7
66	E	38.1	Very low	36.7	Very low	189 Å²	189	131.9 Å²	131.9	88%	0.883	80%	0.799	S	S	*	*			trans	40.2	121.3	143.6	-70.1	174.7	152.1	0	0	121.4
67	E	35.5	Very low	36.6	Very low	193 Å²	193	134 Å²	134	90%	0.902	81%	0.811	S	S	*	*			trans	54.9	92.4	141.7	-62.1	-167.1	157.9	0	0	119.2
68	A	37	Very low	36.3	Very low	96 Å²	96	133.1 Å²	133.1	79%	0.793	81%	0.806	S	S	*	*			trans	-159.7	109.3	134.3	0	0	0	0	0	110.8	C70	A68-C70 PolarHBondContact O-N 3.03Å
69	D	29.7	Very low	36.1	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	82%	0.815	S	S	*	*			trans	-59.5	109.1	163.6	-175.7	19	0	0	0	109.8
70	C	34.5	Very low	36.4	Very low	120 Å²	120	132.9 Å²	132.9	81%	0.811	79%	0.793	S	S	*	*			trans	-144.6	95	163.1	-83.7	0	0	0	0	109.6	A68	A68-C70 PolarHBondContact O-N 3.03Å
71	K	30.4	Very low	36.6	Very low	201 Å²	201	132.5 Å²	132.5	87%	0.874	79%	0.79	S	S	*	*			trans	-48.6	129.6	156.3	-78.7	168.4	169.5	167.9	0	111.1
72	G	30	Very low	36.7	Very low	70 Å²	70	126.3 Å²	126.3	72%	0.722	77%	0.766	S	S	*	*			trans	170.2	94.7	164.7	0	0	0	0	0	112.4	G74	G72-G74 VanDerWaalsContact C-N 3.34Å; G72-G74 PolarHBondContact O-N 2.95Å
73	N	30.3	Very low	37.1	Very low	175 Å²	175	124.4 Å²	124.4	94%	0.936	75%	0.753	S	S	*	*			trans	-63.6	92.8	167.7	-86.8	-6.1	0	0	0	109.3	A75	N73-A75 VanDerWaalsContact C-N 3.34Å; N73-A75 PolarHBondContact O-N 3.47Å; N73-A75 VanDerWaalsContact O-N 3.14Å
74	G	26.9	Very low	37.5	Very low	75 Å²	75	125.6 Å²	125.6	77%	0.773	75%	0.75	S	S	*	*			trans	-84	60.5	-177.2	0	0	0	0	0	114.2	G72	G72-G74 VanDerWaalsContact C-N 3.34Å; G72-G74 PolarHBondContact O-N 2.95Å
75	A	37.3	Very low	38.1	Very low	88 Å²	88	125.6 Å²	125.6	73%	0.727	75%	0.745	S	S	*	*			trans	-90.9	95.3	157.8	0	0	0	0	0	106.9	N73 N77	N73-A75 VanDerWaalsContact C-N 3.34Å; N73-A75 PolarHBondContact O-N 3.47Å; N73-A75 VanDerWaalsContact O-N 3.14Å; A75-N77 PolarHBondContact O-N 3.15Å; A75-N77 VanDerWaalsContact O-N 3.14Å
76	E	39.1	Very low	38.9	Very low	183 Å²	183	128.2 Å²	128.2	86%	0.855	74%	0.739	S	S	*	*			trans	-59.9	116	-178.8	-59.9	-176.5	166.4	0	0	109.7	L78	E76-L78 PolarHBondContact O-N 2.95Å; E76-L78 VanDerWaalsContact O-N 3.1Å
77	N	38.3	Very low	39.5	Very low	160 Å²	160	124.5 Å²	124.5	86%	0.856	73%	0.733	S	S	*	*			trans	-62.1	112.8	172.1	-73.1	-30.2	0	0	0	108.5	A75 L79	A75-N77 PolarHBondContact O-N 3.15Å; A75-N77 VanDerWaalsContact O-N 3.14Å; N77-L79 PolarHBondContact O-N 3.04Å; N77-L79 VanDerWaalsContact O-N 3.08Å
78	L	44.4	Very low	40.6	Very low	116 Å²	116	119.7 Å²	119.7	61%	0.607	71%	0.714	S	S	*	*			trans	-76.7	95.3	174.2	-176.8	74.6	0	0	0	109.1	L44 E76 V80	L44-L78 HydrophobicContact CD2-CD1 4.24Å; L44-L78 HydrophobicContact CD2-CD2 3.52Å; L44-L78 HydrophobicContact CD2-CG 4.33Å; E76-L78 PolarHBondContact O-N 2.95Å; E76-L78 VanDerWaalsContact O-N 3.1Å; L78-V80 HydrophobicContact CG-CG2 4.31Å
79	L	39.5	Very low	41.5	Very low	139 Å²	139	116.9 Å²	116.9	73%	0.728	69%	0.687	S	S	*	*			trans	-94.4	115	167.9	-177.3	67.6	0	0	0	109.1	N77 L81	N77-L79 PolarHBondContact O-N 3.04Å; N77-L79 VanDerWaalsContact O-N 3.08Å; L79-L81 HydrophobicContact CD2-CD2 3.91Å; L79-L81 HydrophobicContact CG-CD2 4.2Å
80	V	48.2	Very low	42.6	Very low	56 Å²	56	112.4 Å²	112.4	34%	0.339	67%	0.67	S	S	.	*			trans	-93.6	113.9	171.2	179.6	0	0	0	0	108.5	L40 L44 L78	L40-V80 HydrophobicContact CD1-CG1 3.6Å; L40-V80 HydrophobicContact CD1-CG2 4.31Å; L40-V80 HydrophobicContact CD2-CG1 3.9Å; L40-V80 HydrophobicContact CG-CG1 4.4Å; L44-V80 HydrophobicContact CD2-CG2 4.16Å; L78-V80 HydrophobicContact CG-CG2 4.31Å
81	L	43.7	Very low	43.8	Very low	150 Å²	150	108 Å²	108	79%	0.785	64%	0.64	S	S	*	*			trans	-80.5	132.4	173.6	-62.9	176.8	0	0	0	109.7	L79	L79-L81 HydrophobicContact CD2-CD2 3.91Å; L79-L81 HydrophobicContact CG-CD2 4.2Å
82	T	47.1	Very low	45.3	Very low	68 Å²	68	101.8 Å²	101.8	42%	0.417	61%	0.614	S	S	.	*			trans	-111.8	139	175.5	55.8	0	0	0	0	108.5	S84 L93	T82-S84 PolarHBondContact O-N 3.4Å; T82-L93 HydrophobicContact CG2-CD1 3.53Å; T82-L93 HydrophobicContact CG2-CD2 3.84Å; T82-L93 HydrophobicContact CG2-CG 4.33Å; T82-L93 WeakPolarHBondContact OG1-CD2 3.25Å
83	S	44.4	Very low	47.1	Very low	89 Å²	89	100.7 Å²	100.7	62%	0.622	59%	0.591	S	S	*	*			trans	-77	116.6	-176.5	57.3	0	0	0	0	110.6	V89	S83-V89 WeakPolarHBondContact O-CG1 3.38Å
84	S	44.2	Very low	49	Very low	97 Å²	97	93.4 Å²	93.4	68%	0.678	55%	0.553	S	S	*	*			trans	-106.8	88.1	179	70.4	0	0	0	0	112	T82	T82-S84 PolarHBondContact O-N 3.4Å
85	D	48.8	Very low	50.8	Low	155 Å²	155	90.8 Å²	90.8	83%	0.829	52%	0.521	S	S	*	.	S	Bend	trans	-94.5	-17.8	169.3	-73.9	-18.2	0	0	0	112.4
86	E	49.6	Very low	52.2	Low	123 Å²	123	90.3 Å²	90.3	58%	0.575	50%	0.501	S	S	*	.	S	Bend	trans	-147.1	155	-177.1	-63.1	-165.9	-171.2	0	0	112.7	D88 V89	E86-D88 PolarHBondContact O-N 3.47Å; E86-V89 VanDerWaalsContact O-CB 3.23Å; E86-V89 WeakPolarHBondContact O-CB 3.41Å; E86-V89 VanDerWaalsContact O-CG2 3.23Å; E86-V89 WeakPolarHBondContact O-CG2 3.47Å; E86-V89 PolarHBondContact O-N 3.42Å
87	S	51.5	Low	53.8	Low	111 Å²	111	84.8 Å²	84.8	78%	0.776	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.6	-178.1	55.5	0	0	0	0	114.1	V89 A90	S87-V89 PolarHBondContact O-N 3.35Å; S87-A90 PolarHBondContact O-N 3.49Å
88	D	58	Low	55.3	Low	92 Å²	92	77.1 Å²	77.1	49%	0.492	44%	0.436	S	S	.	.	H	α-helix	trans	-66.2	-22.3	174.3	-102.4	-6.6	0	0	0	112.9	E86 A90 T91 Q92	E86-D88 PolarHBondContact O-N 3.47Å; D88-A90 VanDerWaalsContact C-N 3.27Å; D88-A90 PolarHBondContact O-N 3.34Å; D88-T91 PolarHBondContact O-N 2.8Å; D88-Q92 WeakPolarHBondContact O-CB 3.23Å; D88-Q92 WeakPolarHBondContact O-CG 3.32Å; D88-Q92 PolarHBondContact O-N 3.18Å
89	V	55.3	Low	56.3	Low	38 Å²	38	74.7 Å²	74.7	23%	0.23	42%	0.423	C	S	.	.	H	α-helix	trans	-61.4	-37.3	179.5	176.2	0	0	0	0	111.3	S83 E86 S87 L93	S83-V89 WeakPolarHBondContact O-CG1 3.38Å; E86-V89 VanDerWaalsContact O-CB 3.23Å; E86-V89 WeakPolarHBondContact O-CB 3.41Å; E86-V89 VanDerWaalsContact O-CG2 3.23Å; E86-V89 WeakPolarHBondContact O-CG2 3.47Å; E86-V89 PolarHBondContact O-N 3.42Å; S87-V89 PolarHBondContact O-N 3.35Å; V89-L93 WeakPolarHBondContact O-CB 2.81Å; V89-L93 PolarHBondContact O-N 3.22Å
90	A	54	Low	57.6	Low	54 Å²	54	69.6 Å²	69.6	45%	0.446	40%	0.397	S	S	.	.	H	α-helix	trans	-65.7	-44.5	-178.1	0	0	0	0	0	111.7	S87 D88 L93 D94	S87-A90 PolarHBondContact O-N 3.49Å; D88-A90 VanDerWaalsContact C-N 3.27Å; D88-A90 PolarHBondContact O-N 3.34Å; A90-L93 WeakPolarHBondContact O-CB 3.4Å; A90-L93 PolarHBondContact O-N 3.29Å; A90-D94 PolarHBondContact O-N 2.98Å
91	T	59.9	Low	58.5	Low	29 Å²	29	67.1 Å²	67.1	18%	0.178	38%	0.382	C	S	.	.	H	α-helix	trans	-70.2	-39.1	179.4	-32.7	0	0	0	0	111.8	D88 L93 D94 N95 H114 E116	D88-T91 PolarHBondContact O-N 2.8Å; T91-L93 VanDerWaalsContact C-N 3.33Å; T91-D94 PolarHBondContact O-N 3.4Å; T91-N95 PolarHBondContact O-N 3.39Å; T91-N95 PolarHBondContact O-ND2 3.18Å; T91-H114 HydrophobicContact CG2-CB 4.12Å; T91-H114 VanDerWaalsContact CG2-O 3.3Å; T91-H114 WeakPolarHBondContact CG2-O 3.45Å; T91-E116 HydrophobicContact CG2-CB 4.02Å; T91-E116 HydrophobicContact CG2-CG 3.29Å
92	Q	61.8	Low	59.5	Low	69 Å²	69	66.8 Å²	66.8	32%	0.322	37%	0.371	S	S	.	.	H	α-helix	trans	-61.2	-45	172.4	-74	-178.9	12.5	0	0	110.8	D88 D94 N95 Y96 E116	D88-Q92 WeakPolarHBondContact O-CB 3.23Å; D88-Q92 WeakPolarHBondContact O-CG 3.32Å; D88-Q92 PolarHBondContact O-N 3.18Å; Q92-D94 VanDerWaalsContact C-N 3.34Å; Q92-D94 PolarHBondContact O-N 2.89Å; Q92-N95 WeakPolarHBondContact O-CB 2.94Å; Q92-N95 PolarHBondContact O-N 2.91Å; Q92-Y96 VanDerWaalsContact C-CD2 3.42Å; Q92-Y96 HydrophobicContact CB-CD2 4.3Å; Q92-Y96 HydrophobicContact CB-CE2 3.82Å; Q92-Y96 WeakPolarHBondContact O-CD2 3.33Å; Q92-Y96 WeakPolarHBondContact O-CE2 3.44Å; Q92-Y96 VanDerWaalsContact O-CG 3.31Å; Q92-Y96 PolarHBondContact O-N 2.95Å; Q92-E116 VanDerWaalsContact CG-OE1 3.26Å; Q92-E116 WeakPolarHBondContact CG-OE1 3.35Å
93	L	67	Low	59.9	Low	47 Å²	47	68.8 Å²	68.8	25%	0.246	38%	0.379	C	S	.	.	H	α-helix	trans	-59.1	-43.7	177.4	179.9	59.9	0	0	0	112.2	T82 V89 A90 T91 Y96 L97	T82-L93 HydrophobicContact CG2-CD1 3.53Å; T82-L93 HydrophobicContact CG2-CD2 3.84Å; T82-L93 HydrophobicContact CG2-CG 4.33Å; T82-L93 WeakPolarHBondContact OG1-CD2 3.25Å; V89-L93 WeakPolarHBondContact O-CB 2.81Å; V89-L93 PolarHBondContact O-N 3.22Å; A90-L93 WeakPolarHBondContact O-CB 3.4Å; A90-L93 PolarHBondContact O-N 3.29Å; T91-L93 VanDerWaalsContact C-N 3.33Å; L93-Y96 CarbonylContact O-C 3.49Å; L93-Y96 PolarHBondContact O-N 3.41Å; L93-L97 HydrophobicContact CD1-CG 4.26Å; L93-L97 HydrophobicContact CG-CD1 4.16Å; L93-L97 HydrophobicContact CG-CG 4.37Å; L93-L97 WeakPolarHBondContact O-CB 3.42Å; L93-L97 WeakPolarHBondContact O-CG 3.36Å; L93-L97 PolarHBondContact O-N 2.84Å
94	D	69.5	Low	60.8	Low	23 Å²	23	69.3 Å²	69.3	12%	0.123	37%	0.37	C	S	.	.	H	α-helix	trans	-62.6	-46.4	176.2	-77.5	-13.2	0	0	0	111	A90 T91 Q92 Y96 L97 L98 F113 H114	A90-D94 PolarHBondContact O-N 2.98Å; T91-D94 PolarHBondContact O-N 3.4Å; Q92-D94 VanDerWaalsContact C-N 3.34Å; Q92-D94 PolarHBondContact O-N 2.89Å; D94-Y96 PolarHBondContact O-N 2.79Å; D94-L97 PolarHBondContact O-N 3.48Å; D94-L98 PolarHBondContact O-N 3.19Å; D94-F113 HydrophobicContact CB-CD1 4.36Å; D94-F113 HydrophobicContact CB-CD2 4.13Å; D94-F113 HydrophobicContact CB-CE1 4.08Å; D94-F113 HydrophobicContact CB-CE2 3.82Å; D94-F113 HydrophobicContact CB-CG 4.42Å; D94-F113 HydrophobicContact CB-CZ 3.83Å; D94-F113 WeakPolarHBondContact O-CZ 3.16Å; D94-H114 WeakPolarHBondContact CB-O 3.41Å; D94-H114 WeakPolarHBondContact OD2-CA 3.44Å; D94-H114 WeakPolarHBondContact OD2-CB 3.2Å; D94-H114 PolarHBondContact OD2-N 3.22Å
95	N	66	Low	61.5	Low	20 Å²	20	66.1 Å²	66.1	11%	0.107	35%	0.353	C	S	.	.	H	α-helix	trans	-56.2	-41	173.2	-73.9	-31.9	0	0	0	112	T91 Q92 L98 L99 E116 W124	T91-N95 PolarHBondContact O-N 3.39Å; T91-N95 PolarHBondContact O-ND2 3.18Å; Q92-N95 WeakPolarHBondContact O-CB 2.94Å; Q92-N95 PolarHBondContact O-N 2.91Å; N95-L98 PolarHBondContact O-N 3.31Å; N95-L99 PolarHBondContact O-N 3.24Å; N95-E116 WeakPolarHBondContact ND2-CB 3.3Å; N95-E116 VanDerWaalsContact ND2-CG 3.31Å; N95-E116 WeakPolarHBondContact ND2-CG 3.25Å; N95-W124 HydrophobicContact CB-CZ3 4.22Å; N95-W124 VanDerWaalsContact O-CH2 3.25Å; N95-W124 WeakPolarHBondContact O-CH2 3.22Å; N95-W124 WeakPolarHBondContact O-CZ3 3.23Å
96	Y	66.1	Low	62.3	Low	77 Å²	77	61 Å²	61	30%	0.302	33%	0.331	S	S	.	.	H	α-helix	trans	-69	-41.3	177.5	-66	-54.2	0	0	0	113.1	F33 Q92 L93 D94 L98 L99 L100	F33-Y96 HydrophobicContact CE1-CD2 4.17Å; F33-Y96 HydrophobicContact CE1-CE1 4.16Å; F33-Y96 AromaticContact CE1-CE2 3.44Å; F33-Y96 HydrophobicContact CE1-CE2 3.44Å; F33-Y96 VanDerWaalsContact CE1-CE2 3.44Å; F33-Y96 AromaticContact CE1-CZ 3.45Å; F33-Y96 VanDerWaalsContact CE1-CZ 3.45Å; F33-Y96 WeakPolarHBondContact CE1-OH 3.23Å; F33-Y96 HydrophobicContact CE2-CE2 4.45Å; F33-Y96 AromaticContact CZ-CD2 3.78Å; F33-Y96 HydrophobicContact CZ-CD2 3.78Å; F33-Y96 AromaticContact CZ-CE2 3.35Å; F33-Y96 HydrophobicContact CZ-CE2 3.35Å; F33-Y96 AromaticContact CZ-CZ 3.9Å; Q92-Y96 VanDerWaalsContact C-CD2 3.42Å; Q92-Y96 HydrophobicContact CB-CD2 4.3Å; Q92-Y96 HydrophobicContact CB-CE2 3.82Å; Q92-Y96 WeakPolarHBondContact O-CD2 3.33Å; Q92-Y96 WeakPolarHBondContact O-CE2 3.44Å; Q92-Y96 VanDerWaalsContact O-CG 3.31Å; Q92-Y96 PolarHBondContact O-N 2.95Å; L93-Y96 CarbonylContact O-C 3.49Å; L93-Y96 PolarHBondContact O-N 3.41Å; D94-Y96 PolarHBondContact O-N 2.79Å; Y96-L98 PolarHBondContact O-N 3.31Å; Y96-L99 PolarHBondContact O-N 3.01Å; Y96-L100 WeakPolarHBondContact O-CG 3.48Å; Y96-L100 PolarHBondContact O-N 3.41Å
97	L	72.3	Confident	63.1	Low	67 Å²	67	57.4 Å²	57.4	35%	0.351	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-39.9	175	-74.9	173.2	0	0	0	110.7	L93 D94 L100 A101 I108 F113	L93-L97 HydrophobicContact CD1-CG 4.26Å; L93-L97 HydrophobicContact CG-CD1 4.16Å; L93-L97 HydrophobicContact CG-CG 4.37Å; L93-L97 WeakPolarHBondContact O-CB 3.42Å; L93-L97 WeakPolarHBondContact O-CG 3.36Å; L93-L97 PolarHBondContact O-N 2.84Å; D94-L97 PolarHBondContact O-N 3.48Å; L97-L100 PolarHBondContact O-N 3.25Å; L97-A101 VanDerWaalsContact O-CB 3.31Å; L97-A101 WeakPolarHBondContact O-CB 3.19Å; L97-A101 PolarHBondContact O-N 3.22Å; L97-I108 HydrophobicContact CB-CD1 4.22Å; L97-F113 HydrophobicContact CB-CE2 4.22Å; L97-F113 HydrophobicContact CB-CZ 4.37Å
98	L	69.4	Low	64.1	Low	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.2	-40.1	175.5	-171.3	59	0	0	0	112.6	D94 N95 Y96 A101 Y102 I108 F113 L115 W124 L127 A128 Q131	D94-L98 PolarHBondContact O-N 3.19Å; N95-L98 PolarHBondContact O-N 3.31Å; Y96-L98 PolarHBondContact O-N 3.31Å; L98-A101 PolarHBondContact O-N 2.92Å; L98-Y102 WeakPolarHBondContact O-CB 3.26Å; L98-Y102 PolarHBondContact O-N 3.25Å; L98-I108 HydrophobicContact CB-CD1 4.27Å; L98-I108 HydrophobicContact CD1-CD1 4.07Å; L98-F113 HydrophobicContact CB-CE1 3.98Å; L98-F113 HydrophobicContact CB-CZ 3.83Å; L98-F113 HydrophobicContact CD2-CE1 4.2Å; L98-L115 HydrophobicContact CD2-CD2 3.71Å; L98-W124 HydrophobicContact CB-CH2 4.47Å; L98-W124 HydrophobicContact CB-CZ3 3.78Å; L98-W124 HydrophobicContact CD2-CD2 4.49Å; L98-W124 HydrophobicContact CD2-CE3 3.44Å; L98-W124 VanDerWaalsContact CD2-CE3 3.44Å; L98-W124 HydrophobicContact CD2-CZ3 3.59Å; L98-W124 HydrophobicContact CG-CE3 4.17Å; L98-W124 HydrophobicContact CG-CZ3 3.87Å; L98-L127 HydrophobicContact CD1-CD2 4.32Å; L98-L127 HydrophobicContact CD1-CG 4.01Å; L98-L127 HydrophobicContact CD2-CD2 4.34Å; L98-L127 HydrophobicContact CD2-CG 4.48Å; L98-L127 HydrophobicContact CG-CD2 3.94Å; L98-L127 HydrophobicContact CG-CG 4.16Å; L98-A128 HydrophobicContact CD1-CB 4.29Å; L98-A128 HydrophobicContact CD2-CB 3.64Å; L98-Q131 HydrophobicContact CD1-CB 3.88Å; L98-Q131 PolarHBondContact O-OE1 3.18Å
99	L	66.2	Low	64.6	Low	64 Å²	64	53.5 Å²	53.5	34%	0.335	29%	0.288	S	S	.	.	H	α-helix	trans	-63.5	-43.1	174.3	-173.9	63.8	0	0	0	111.6	N95 Y96 Y102 L103 W124	N95-L99 PolarHBondContact O-N 3.24Å; Y96-L99 PolarHBondContact O-N 3.01Å; L99-Y102 PolarHBondContact O-N 3.42Å; L99-L103 HydrophobicContact CD1-CD1 4.47Å; L99-L103 HydrophobicContact CD1-CG 4.5Å; L99-L103 HydrophobicContact CG-CD1 4.09Å; L99-L103 WeakPolarHBondContact O-CG 3.47Å; L99-L103 PolarHBondContact O-N 3.42Å; L99-W124 HydrophobicContact CB-CH2 4.08Å; L99-W124 HydrophobicContact CD1-CZ2 4.42Å
100	L	67.3	Low	65.4	Low	33 Å²	33	53.1 Å²	53.1	17%	0.173	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-47.1	175.9	-70	171	0	0	0	111	F37 I41 Y96 L97 Y102 L103 F104	F37-L100 HydrophobicContact CE2-CD2 4.49Å; F37-L100 HydrophobicContact CZ-CD2 4.49Å; I41-L100 HydrophobicContact CD1-CD2 3.6Å; Y96-L100 WeakPolarHBondContact O-CG 3.48Å; Y96-L100 PolarHBondContact O-N 3.41Å; L97-L100 PolarHBondContact O-N 3.25Å; L100-Y102 PolarHBondContact O-N 2.96Å; L100-L103 PolarHBondContact O-N 3.38Å; L100-F104 HydrophobicContact CB-CD2 4.43Å; L100-F104 HydrophobicContact CD2-CD2 4.3Å; L100-F104 HydrophobicContact CD2-CE2 3.82Å; L100-F104 WeakPolarHBondContact O-CB 3.16Å; L100-F104 VanDerWaalsContact O-CD2 3.23Å; L100-F104 WeakPolarHBondContact O-CD2 3.18Å; L100-F104 PolarHBondContact O-N 2.86Å
101	A	67.5	Low	65.9	Low	4 Å²	4	56 Å²	56	3%	0.033	29%	0.289	C	S	.	.	H	α-helix	trans	-58.5	-38.8	177.2	0	0	0	0	0	111.7	L97 L98 G105 A106 I108 Q131	L97-A101 VanDerWaalsContact O-CB 3.31Å; L97-A101 WeakPolarHBondContact O-CB 3.19Å; L97-A101 PolarHBondContact O-N 3.22Å; L98-A101 PolarHBondContact O-N 2.92Å; A101-G105 CarbonylContact O-C 3.59Å; A101-G105 WeakPolarHBondContact O-CA 3.46Å; A101-G105 PolarHBondContact O-N 3.42Å; A101-A106 HydrophobicContact CB-CB 4.49Å; A101-A106 PolarHBondContact O-N 2.79Å; A101-I108 HydrophobicContact CB-CD1 3.78Å; A101-I108 HydrophobicContact CB-CG1 3.72Å; A101-Q131 VanDerWaalsContact C-OE1 3.28Å; A101-Q131 HydrophobicContact CB-CB 4.46Å
102	Y	63.1	Low	66.3	Low	142 Å²	142	62.2 Å²	62.2	56%	0.557	31%	0.314	S	S	*	.	H	α-helix	trans	-65.8	-48.1	172.8	178.7	-110.8	0	0	0	114.7	L98 L99 L100 F104 G105 L127	L98-Y102 WeakPolarHBondContact O-CB 3.26Å; L98-Y102 PolarHBondContact O-N 3.25Å; L99-Y102 PolarHBondContact O-N 3.42Å; L100-Y102 PolarHBondContact O-N 2.96Å; Y102-F104 VanDerWaalsContact C-N 3.32Å; Y102-F104 PolarHBondContact O-N 3.19Å; Y102-G105 PolarHBondContact O-N 2.75Å; Y102-L127 HydrophobicContact CD2-CD1 3.49Å; Y102-L127 VanDerWaalsContact CD2-CD1 3.49Å; Y102-L127 HydrophobicContact CD2-CD2 4.29Å; Y102-L127 HydrophobicContact CE2-CD1 4.21Å; Y102-L127 HydrophobicContact CG-CD1 4.09Å; Y102-L127 HydrophobicContact CG-CD2 4.11Å
103	L	57	Low	66.6	Low	110 Å²	110	60.9 Å²	60.9	58%	0.576	31%	0.307	S	S	*	.	H	α-helix	trans	-66.5	-35.2	-178.3	-69.9	173	0	0	0	112.8	L99 L100	L99-L103 HydrophobicContact CD1-CD1 4.47Å; L99-L103 HydrophobicContact CD1-CG 4.5Å; L99-L103 HydrophobicContact CG-CD1 4.09Å; L99-L103 WeakPolarHBondContact O-CG 3.47Å; L99-L103 PolarHBondContact O-N 3.42Å; L100-L103 PolarHBondContact O-N 3.38Å
104	F	62.2	Low	66.6	Low	100 Å²	100	64.1 Å²	64.1	44%	0.439	32%	0.321	S	S	.	.	H	α-helix	trans	-97.1	0.7	-177.5	-68.2	-71.2	0	0	0	113.9	L100 Y102 A106	L100-F104 HydrophobicContact CB-CD2 4.43Å; L100-F104 HydrophobicContact CD2-CD2 4.3Å; L100-F104 HydrophobicContact CD2-CE2 3.82Å; L100-F104 WeakPolarHBondContact O-CB 3.16Å; L100-F104 VanDerWaalsContact O-CD2 3.23Å; L100-F104 WeakPolarHBondContact O-CD2 3.18Å; L100-F104 PolarHBondContact O-N 2.86Å; Y102-F104 VanDerWaalsContact C-N 3.32Å; Y102-F104 PolarHBondContact O-N 3.19Å; F104-A106 HydrophobicContact CB-CB 4.46Å; F104-A106 PolarHBondContact O-N 2.79Å
105	G	59.4	Low	66.3	Low	31 Å²	31	65.2 Å²	65.2	32%	0.32	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	21.7	-175.4	0	0	0	0	0	114.4	A101 Y102 W158	A101-G105 CarbonylContact O-C 3.59Å; A101-G105 WeakPolarHBondContact O-CA 3.46Å; A101-G105 PolarHBondContact O-N 3.42Å; Y102-G105 PolarHBondContact O-N 2.75Å; G105-W158 VanDerWaalsContact CA-CZ3 3.47Å
106	A	64.3	Low	66	Low	46 Å²	46	66.4 Å²	66.4	38%	0.38	33%	0.331	S	S	.	.			trans	-89.4	171.3	-175.1	0	0	0	0	0	111.7	A101 F104	A101-A106 HydrophobicContact CB-CB 4.49Å; A101-A106 PolarHBondContact O-N 2.79Å; F104-A106 HydrophobicContact CB-CB 4.46Å; F104-A106 PolarHBondContact O-N 2.79Å
107	V	66.8	Low	65.3	Low	49 Å²	49	68.2 Å²	68.2	30%	0.297	35%	0.353	S	S	.	.			trans	-121.4	139	178.9	176.5	0	0	0	0	107.5	Q131 V133	V107-Q131 CarbonylContact C-O 3.56Å; V107-Q131 WeakPolarHBondContact CA-O 2.84Å; V107-Q131 WeakPolarHBondContact CG1-O 3.46Å; V107-V133 HydrophobicContact CG1-CB 3.64Å; V107-V133 HydrophobicContact CG1-CG2 3.21Å
108	I	72.2	Confident	63.9	Low	22 Å²	22	72.6 Å²	72.6	11%	0.113	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.4	177.2	-62.6	160.2	0	0	0	108.2	L97 L98 A101 S110 F113 Q131 V132 V133	L97-I108 HydrophobicContact CB-CD1 4.22Å; L98-I108 HydrophobicContact CB-CD1 4.27Å; L98-I108 HydrophobicContact CD1-CD1 4.07Å; A101-I108 HydrophobicContact CB-CD1 3.78Å; A101-I108 HydrophobicContact CB-CG1 3.72Å; I108-S110 PolarHBondContact O-N 3.05Å; I108-F113 HydrophobicContact CD1-CE2 3.81Å; I108-F113 HydrophobicContact CD1-CZ 3.68Å; I108-F113 HydrophobicContact CG2-CD2 4.18Å; I108-F113 HydrophobicContact CG2-CE2 3.97Å; I108-Q131 PolarHBondContact N-O 3.24Å; I108-V132 HydrophobicContact CB-CG2 4.32Å; I108-V132 HydrophobicContact CD1-CG2 4.26Å; I108-V132 CarbonylContact O-C 3.6Å; I108-V132 WeakPolarHBondContact O-CA 3.5Å; I108-V133 PolarHBondContact O-N 2.79Å
109	L	70.3	Confident	63	Low	99 Å²	99	73.4 Å²	73.4	52%	0.518	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	104.8	169.9	-64.1	176.9	0	0	0	109	V133 F135 V145	L109-V133 WeakPolarHBondContact CA-O 3.33Å; L109-V133 HydrophobicContact CD2-CB 3.99Å; L109-V133 HydrophobicContact CD2-CG1 3.79Å; L109-F135 HydrophobicContact CB-CD1 4.12Å; L109-F135 HydrophobicContact CB-CE1 4.47Å; L109-V145 HydrophobicContact CD2-CG2 3.97Å
110	S	70.3	Confident	62	Low	30 Å²	30	74 Å²	74	21%	0.21	39%	0.39	C	S	.	.			trans	-151	142.7	175.7	-168.9	0	0	0	0	112.7	I108 F112 V133 P134	I108-S110 PolarHBondContact O-N 3.05Å; S110-F112 PolarHBondContact OG-N 3.4Å; S110-F112 VanDerWaalsContact OG-N 3.16Å; S110-F112 PolarHBondContact OG-O 2.89Å; S110-V133 PolarHBondContact N-O 3.48Å; S110-V133 VanDerWaalsContact N-O 3.15Å; S110-P134 WeakPolarHBondContact O-CA 3.31Å
111	K	65.7	Low	61.4	Low	115 Å²	115	74.3 Å²	74.3	50%	0.5	40%	0.397	S	S	.	.	S	Bend	trans	-80.3	-27	168.8	-70.1	-178.6	177.6	175.8	0	112.5	F135	K111-F135 WeakPolarHBondContact CE-O 2.94Å; K111-F135 HydrophobicContact CG-CD1 4.46Å; K111-F135 HydrophobicContact CG-CE1 4.29Å; K111-F135 HydrophobicContact CG-CZ 4.45Å; K111-F135 WeakPolarHBondContact CG-O 3.49Å
112	F	67.8	Low	61	Low	159 Å²	159	82 Å²	82	70%	0.697	43%	0.43	S	S	*	.			trans	-135.9	125.7	-176.7	-62.1	-76.6	0	0	0	109.2	S110	S110-F112 PolarHBondContact OG-N 3.4Å; S110-F112 VanDerWaalsContact OG-N 3.16Å; S110-F112 PolarHBondContact OG-O 2.89Å
113	F	68	Low	60.7	Low	41 Å²	41	81.7 Å²	81.7	18%	0.18	43%	0.433	C	S	.	.			trans	-139.6	115.7	179.9	-160	-101.4	0	0	0	108.9	D94 L97 L98 I108 L115 V132	D94-F113 HydrophobicContact CB-CD1 4.36Å; D94-F113 HydrophobicContact CB-CD2 4.13Å; D94-F113 HydrophobicContact CB-CE1 4.08Å; D94-F113 HydrophobicContact CB-CE2 3.82Å; D94-F113 HydrophobicContact CB-CG 4.42Å; D94-F113 HydrophobicContact CB-CZ 3.83Å; D94-F113 WeakPolarHBondContact O-CZ 3.16Å; L97-F113 HydrophobicContact CB-CE2 4.22Å; L97-F113 HydrophobicContact CB-CZ 4.37Å; L98-F113 HydrophobicContact CB-CE1 3.98Å; L98-F113 HydrophobicContact CB-CZ 3.83Å; L98-F113 HydrophobicContact CD2-CE1 4.2Å; I108-F113 HydrophobicContact CD1-CE2 3.81Å; I108-F113 HydrophobicContact CD1-CZ 3.68Å; I108-F113 HydrophobicContact CG2-CD2 4.18Å; I108-F113 HydrophobicContact CG2-CE2 3.97Å; F113-L115 HydrophobicContact CD1-CD2 4.01Å; F113-L115 HydrophobicContact CD1-CG 4.16Å; F113-L115 HydrophobicContact CE1-CD2 3.66Å; F113-L115 HydrophobicContact CE1-CG 4.32Å; F113-V132 HydrophobicContact CB-CG1 4.14Å; F113-V132 HydrophobicContact CB-CG2 4.25Å; F113-V132 HydrophobicContact CD1-CG2 3.78Å; F113-V132 HydrophobicContact CD2-CG2 4.16Å; F113-V132 HydrophobicContact CE1-CG2 4.04Å; F113-V132 HydrophobicContact CE2-CG2 4.42Å; F113-V132 HydrophobicContact CG-CG1 4.46Å; F113-V132 HydrophobicContact CG-CG2 3.79Å; F113-V132 HydrophobicContact CZ-CG2 4.31Å
114	H	67.2	Low	60.9	Low	115 Å²	115	79.9 Å²	79.9	53%	0.532	42%	0.419	S	S	.	.			trans	-98.2	103.8	-175.9	-65.5	-74.7	0	0	0	109.7	T91 D94	T91-H114 HydrophobicContact CG2-CB 4.12Å; T91-H114 VanDerWaalsContact CG2-O 3.3Å; T91-H114 WeakPolarHBondContact CG2-O 3.45Å; D94-H114 WeakPolarHBondContact CB-O 3.41Å; D94-H114 WeakPolarHBondContact OD2-CA 3.44Å; D94-H114 WeakPolarHBondContact OD2-CB 3.2Å; D94-H114 PolarHBondContact OD2-N 3.22Å
115	L	63.9	Low	61	Low	46 Å²	46	81.5 Å²	81.5	24%	0.241	42%	0.422	C	S	.	.			trans	-82.9	134.2	167.7	-67.6	175.3	0	0	0	109.6	L98 F113 W124 R125 A128	L98-L115 HydrophobicContact CD2-CD2 3.71Å; F113-L115 HydrophobicContact CD1-CD2 4.01Å; F113-L115 HydrophobicContact CD1-CG 4.16Å; F113-L115 HydrophobicContact CE1-CD2 3.66Å; F113-L115 HydrophobicContact CE1-CG 4.32Å; L115-W124 HydrophobicContact CD2-CE3 4.38Å; L115-R125 HydrophobicContact CD1-CG 4.3Å; L115-A128 HydrophobicContact CD1-CB 3.63Å; L115-A128 HydrophobicContact CD2-CB 4.4Å; L115-A128 HydrophobicContact CG-CB 4.4Å
116	E	58.2	Low	61.2	Low	44 Å²	44	88.5 Å²	88.5	21%	0.206	44%	0.439	C	S	.	.			trans	-58.6	140.1	173.9	-80.1	-178.8	-176.9	0	0	109.9	T91 Q92 N95 L118 S119	T91-E116 HydrophobicContact CG2-CB 4.02Å; T91-E116 HydrophobicContact CG2-CG 3.29Å; Q92-E116 VanDerWaalsContact CG-OE1 3.26Å; Q92-E116 WeakPolarHBondContact CG-OE1 3.35Å; N95-E116 WeakPolarHBondContact ND2-CB 3.3Å; N95-E116 VanDerWaalsContact ND2-CG 3.31Å; N95-E116 WeakPolarHBondContact ND2-CG 3.25Å; E116-L118 PolarHBondContact O-N 3.29Å; E116-S119 VanDerWaalsContact O-CB 3.31Å; E116-S119 WeakPolarHBondContact O-CB 3.45Å; E116-S119 PolarHBondContact O-N 3Å; E116-S119 PolarHBondContact O-OG 2.89Å
117	P	51.1	Low	61.3	Low	115 Å²	115	87.7 Å²	87.7	75%	0.747	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.1	173.2	13.3	-19.7	0	0	0	112.6	C120	P117-C120 PolarHBondContact O-SG 3.04Å
118	L	44.8	Very low	61.3	Low	159 Å²	159	85.8 Å²	85.8	83%	0.832	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-15.3	173.2	-69.7	167.9	0	0	0	113.9	E116 C120	E116-L118 PolarHBondContact O-N 3.29Å; L118-C120 PolarHBondContact O-N 2.76Å
119	S	50	Low	61.1	Low	18 Å²	18	88.6 Å²	88.6	13%	0.126	44%	0.439	C	S	.	.			trans	-72.2	23.1	170.2	72.7	0	0	0	0	113.3	E116 A121 W124	E116-S119 VanDerWaalsContact O-CB 3.31Å; E116-S119 WeakPolarHBondContact O-CB 3.45Å; E116-S119 PolarHBondContact O-N 3Å; E116-S119 PolarHBondContact O-OG 2.89Å; S119-A121 PolarHBondContact O-N 2.69Å; S119-W124 WeakPolarHBondContact O-CB 3.19Å
120	C	43.9	Very low	60.8	Low	76 Å²	76	87.7 Å²	87.7	51%	0.514	43%	0.434	S	S	.	.			trans	-56.5	-2.1	-174	-96.7	0	0	0	0	116.5	P117 L118 K122 R125	P117-C120 PolarHBondContact O-SG 3.04Å; L118-C120 PolarHBondContact O-N 2.76Å; C120-K122 PolarHBondContact O-N 3.29Å; C120-K122 VanDerWaalsContact O-N 3.12Å; C120-R125 PolarHBondContact SG-NH2 3.33Å
121	A	55.7	Low	60.7	Low	39 Å²	39	87.2 Å²	87.2	32%	0.322	43%	0.429	S	S	.	.			trans	-53.1	118.1	165.9	0	0	0	0	0	108.9	S119 E123 W124 R125	S119-A121 PolarHBondContact O-N 2.69Å; A121-E123 WeakPolarHBondContact CB-OE2 3.46Å; A121-E123 PolarHBondContact O-N 2.86Å; A121-W124 HydrophobicContact CB-CB 4.21Å; A121-W124 HydrophobicContact CB-CG 4.4Å; A121-W124 WeakPolarHBondContact O-CB 3.44Å; A121-W124 PolarHBondContact O-N 3.3Å; A121-R125 PolarHBondContact O-N 2.83Å
122	K	58.6	Low	60.9	Low	167 Å²	167	83 Å²	83	73%	0.726	41%	0.413	S	S	*	.	H	α-helix	trans	-52.5	-31.2	176.6	-177.2	179.6	178.7	180	0	110.8	C120 R126	C120-K122 PolarHBondContact O-N 3.29Å; C120-K122 VanDerWaalsContact O-N 3.12Å; K122-R126 VanDerWaalsContact O-CB 3.28Å; K122-R126 WeakPolarHBondContact O-CB 3.47Å; K122-R126 PolarHBondContact O-N 3.36Å
123	E	58.1	Low	61.1	Low	134 Å²	134	75.7 Å²	75.7	63%	0.626	38%	0.381	S	S	*	.	H	α-helix	trans	-61.1	-43.4	174	-59.6	75.3	-160.3	0	0	112.3	A121 R126 L127	A121-E123 WeakPolarHBondContact CB-OE2 3.46Å; A121-E123 PolarHBondContact O-N 2.86Å; E123-R126 PolarHBondContact O-N 3.31Å; E123-L127 VanDerWaalsContact O-CB 3.22Å; E123-L127 WeakPolarHBondContact O-CB 3.46Å; E123-L127 PolarHBondContact O-N 3.35Å
124	W	61.1	Low	60.9	Low	72 Å²	72	77.6 Å²	77.6	27%	0.273	40%	0.398	S	S	.	.	H	α-helix	trans	-69.6	-42.8	-178.8	-95.9	81.7	0	0	0	112.5	N95 L98 L99 L115 S119 A121 R126 L127 A128	N95-W124 HydrophobicContact CB-CZ3 4.22Å; N95-W124 VanDerWaalsContact O-CH2 3.25Å; N95-W124 WeakPolarHBondContact O-CH2 3.22Å; N95-W124 WeakPolarHBondContact O-CZ3 3.23Å; L98-W124 HydrophobicContact CB-CH2 4.47Å; L98-W124 HydrophobicContact CB-CZ3 3.78Å; L98-W124 HydrophobicContact CD2-CD2 4.49Å; L98-W124 HydrophobicContact CD2-CE3 3.44Å; L98-W124 VanDerWaalsContact CD2-CE3 3.44Å; L98-W124 HydrophobicContact CD2-CZ3 3.59Å; L98-W124 HydrophobicContact CG-CE3 4.17Å; L98-W124 HydrophobicContact CG-CZ3 3.87Å; L99-W124 HydrophobicContact CB-CH2 4.08Å; L99-W124 HydrophobicContact CD1-CZ2 4.42Å; L115-W124 HydrophobicContact CD2-CE3 4.38Å; S119-W124 WeakPolarHBondContact O-CB 3.19Å; A121-W124 HydrophobicContact CB-CB 4.21Å; A121-W124 HydrophobicContact CB-CG 4.4Å; A121-W124 WeakPolarHBondContact O-CB 3.44Å; A121-W124 PolarHBondContact O-N 3.3Å; W124-R126 VanDerWaalsContact C-N 3.3Å; W124-R126 PolarHBondContact O-N 3.03Å; W124-L127 WeakPolarHBondContact O-CB 3.34Å; W124-L127 PolarHBondContact O-N 3.03Å; W124-A128 WeakPolarHBondContact O-CB 3.3Å; W124-A128 PolarHBondContact O-N 3.07Å
125	R	64	Low	60.9	Low	135 Å²	135	74.7 Å²	74.7	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-65	-38	173.4	-59.9	-168.9	-149	122.7	4	111.5	L115 C120 A121 A128 S129	L115-R125 HydrophobicContact CD1-CG 4.3Å; C120-R125 PolarHBondContact SG-NH2 3.33Å; A121-R125 PolarHBondContact O-N 2.83Å; R125-A128 PolarHBondContact O-N 2.83Å; R125-S129 PolarHBondContact O-N 3.05Å
126	R	63.9	Low	60.7	Low	178 Å²	178	76.5 Å²	76.5	67%	0.672	40%	0.396	S	S	*	.	H	α-helix	trans	-64.6	-44.1	174.5	-172.6	177.5	-176.7	-176.1	0.2	110.9	K122 E123 W124 S129 L130	K122-R126 VanDerWaalsContact O-CB 3.28Å; K122-R126 WeakPolarHBondContact O-CB 3.47Å; K122-R126 PolarHBondContact O-N 3.36Å; E123-R126 PolarHBondContact O-N 3.31Å; W124-R126 VanDerWaalsContact C-N 3.3Å; W124-R126 PolarHBondContact O-N 3.03Å; R126-S129 PolarHBondContact O-N 3.39Å; R126-S129 PolarHBondContact O-OG 3.47Å; R126-L130 HydrophobicContact CG-CD1 4.19Å; R126-L130 VanDerWaalsContact O-CG 3.3Å; R126-L130 WeakPolarHBondContact O-CG 3.23Å; R126-L130 PolarHBondContact O-N 2.73Å
127	L	66.2	Low	60.7	Low	28 Å²	28	80.9 Å²	80.9	15%	0.147	42%	0.415	C	S	.	.	H	α-helix	trans	-59.2	-47.9	176.2	-176.2	67.6	0	0	0	111.1	L98 Y102 E123 W124 S129 L130 Q131	L98-L127 HydrophobicContact CD1-CD2 4.32Å; L98-L127 HydrophobicContact CD1-CG 4.01Å; L98-L127 HydrophobicContact CD2-CD2 4.34Å; L98-L127 HydrophobicContact CD2-CG 4.48Å; L98-L127 HydrophobicContact CG-CD2 3.94Å; L98-L127 HydrophobicContact CG-CG 4.16Å; Y102-L127 HydrophobicContact CD2-CD1 3.49Å; Y102-L127 VanDerWaalsContact CD2-CD1 3.49Å; Y102-L127 HydrophobicContact CD2-CD2 4.29Å; Y102-L127 HydrophobicContact CE2-CD1 4.21Å; Y102-L127 HydrophobicContact CG-CD1 4.09Å; Y102-L127 HydrophobicContact CG-CD2 4.11Å; E123-L127 VanDerWaalsContact O-CB 3.22Å; E123-L127 WeakPolarHBondContact O-CB 3.46Å; E123-L127 PolarHBondContact O-N 3.35Å; W124-L127 WeakPolarHBondContact O-CB 3.34Å; W124-L127 PolarHBondContact O-N 3.03Å; L127-S129 VanDerWaalsContact C-N 3.33Å; L127-S129 PolarHBondContact O-N 2.99Å; L127-L130 CarbonylContact O-C 3.59Å; L127-L130 WeakPolarHBondContact O-CA 3.26Å; L127-L130 WeakPolarHBondContact O-CB 3.17Å; L127-L130 PolarHBondContact O-N 3.29Å; L127-Q131 HydrophobicContact CD1-CG 4.24Å; L127-Q131 VanDerWaalsContact CD1-NE2 3.28Å; L127-Q131 WeakPolarHBondContact O-CB 3.48Å; L127-Q131 PolarHBondContact O-N 2.85Å
128	A	66.5	Low	60.9	Low	9 Å²	9	78.7 Å²	78.7	7%	0.074	40%	0.397	C	S	.	.	H	α-helix	trans	-57.5	-45	174.8	0	0	0	0	0	112	L98 L115 W124 R125 L130 Q131 V132	L98-A128 HydrophobicContact CD1-CB 4.29Å; L98-A128 HydrophobicContact CD2-CB 3.64Å; L115-A128 HydrophobicContact CD1-CB 3.63Å; L115-A128 HydrophobicContact CD2-CB 4.4Å; L115-A128 HydrophobicContact CG-CB 4.4Å; W124-A128 WeakPolarHBondContact O-CB 3.3Å; W124-A128 PolarHBondContact O-N 3.07Å; R125-A128 PolarHBondContact O-N 2.83Å; A128-L130 PolarHBondContact O-N 3.3Å; A128-Q131 PolarHBondContact O-N 3.49Å; A128-V132 HydrophobicContact CB-CG2 4.4Å; A128-V132 VanDerWaalsContact O-CB 3.28Å; A128-V132 WeakPolarHBondContact O-CB 3.47Å; A128-V132 WeakPolarHBondContact O-CG2 3.45Å; A128-V132 PolarHBondContact O-N 3.16Å
129	S	66.9	Low	61.3	Low	81 Å²	81	79.6 Å²	79.6	57%	0.566	40%	0.397	S	S	*	.	H	α-helix	trans	-63.2	-25.2	176.3	72.9	0	0	0	0	113.7	R125 R126 L127	R125-S129 PolarHBondContact O-N 3.05Å; R126-S129 PolarHBondContact O-N 3.39Å; R126-S129 PolarHBondContact O-OG 3.47Å; L127-S129 VanDerWaalsContact C-N 3.33Å; L127-S129 PolarHBondContact O-N 2.99Å
130	L	65.5	Low	61.4	Low	81 Å²	81	86.3 Å²	86.3	42%	0.424	43%	0.432	S	S	.	.	H	α-helix	trans	-90.9	-18.3	178.6	-70.3	172.3	0	0	0	113.3	R126 L127 A128 R150	R126-L130 HydrophobicContact CG-CD1 4.19Å; R126-L130 VanDerWaalsContact O-CG 3.3Å; R126-L130 WeakPolarHBondContact O-CG 3.23Å; R126-L130 PolarHBondContact O-N 2.73Å; L127-L130 CarbonylContact O-C 3.59Å; L127-L130 WeakPolarHBondContact O-CA 3.26Å; L127-L130 WeakPolarHBondContact O-CB 3.17Å; L127-L130 PolarHBondContact O-N 3.29Å; A128-L130 PolarHBondContact O-N 3.3Å; L130-R150 PolarHBondContact O-NH1 2.63Å; L130-R150 PolarHBondContact O-NH2 3.46Å
131	Q	66.5	Low	61.7	Low	20 Å²	20	84.6 Å²	84.6	9%	0.093	42%	0.423	C	S	.	.	H	α-helix	trans	-117.4	-28.5	-174.3	-69.7	-172.2	-3.2	0	0	113.7	L98 A101 V107 I108 L127 A128	L98-Q131 HydrophobicContact CD1-CB 3.88Å; L98-Q131 PolarHBondContact O-OE1 3.18Å; A101-Q131 VanDerWaalsContact C-OE1 3.28Å; A101-Q131 HydrophobicContact CB-CB 4.46Å; V107-Q131 CarbonylContact C-O 3.56Å; V107-Q131 WeakPolarHBondContact CA-O 2.84Å; V107-Q131 WeakPolarHBondContact CG1-O 3.46Å; I108-Q131 PolarHBondContact N-O 3.24Å; L127-Q131 HydrophobicContact CD1-CG 4.24Å; L127-Q131 VanDerWaalsContact CD1-NE2 3.28Å; L127-Q131 WeakPolarHBondContact O-CB 3.48Å; L127-Q131 PolarHBondContact O-N 2.85Å; A128-Q131 PolarHBondContact O-N 3.49Å
132	V	71	Confident	61.6	Low	27 Å²	27	83.9 Å²	83.9	16%	0.164	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	125.7	174.2	-175	0	0	0	0	108.5	I108 F113 A128	I108-V132 HydrophobicContact CB-CG2 4.32Å; I108-V132 HydrophobicContact CD1-CG2 4.26Å; I108-V132 CarbonylContact O-C 3.6Å; I108-V132 WeakPolarHBondContact O-CA 3.5Å; F113-V132 HydrophobicContact CB-CG1 4.14Å; F113-V132 HydrophobicContact CB-CG2 4.25Å; F113-V132 HydrophobicContact CD1-CG2 3.78Å; F113-V132 HydrophobicContact CD2-CG2 4.16Å; F113-V132 HydrophobicContact CE1-CG2 4.04Å; F113-V132 HydrophobicContact CE2-CG2 4.42Å; F113-V132 HydrophobicContact CG-CG1 4.46Å; F113-V132 HydrophobicContact CG-CG2 3.79Å; F113-V132 HydrophobicContact CZ-CG2 4.31Å; A128-V132 HydrophobicContact CB-CG2 4.4Å; A128-V132 VanDerWaalsContact O-CB 3.28Å; A128-V132 WeakPolarHBondContact O-CB 3.47Å; A128-V132 WeakPolarHBondContact O-CG2 3.45Å; A128-V132 PolarHBondContact O-N 3.16Å
133	V	71.4	Confident	61.3	Low	5 Å²	5	79.6 Å²	79.6	3%	0.03	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	113.2	-179.6	168.7	0	0	0	0	108.1	V107 I108 L109 S110 V145	V107-V133 HydrophobicContact CG1-CB 3.64Å; V107-V133 HydrophobicContact CG1-CG2 3.21Å; I108-V133 PolarHBondContact O-N 2.79Å; L109-V133 WeakPolarHBondContact CA-O 3.33Å; L109-V133 HydrophobicContact CD2-CB 3.99Å; L109-V133 HydrophobicContact CD2-CG1 3.79Å; S110-V133 PolarHBondContact N-O 3.48Å; S110-V133 VanDerWaalsContact N-O 3.15Å; V133-V145 HydrophobicContact CG1-CB 4.38Å; V133-V145 HydrophobicContact CG1-CG1 3.15Å; V133-V145 HydrophobicContact CG1-CG2 4.42Å
134	P	65.1	Low	61.1	Low	81 Å²	81	76 Å²	76	53%	0.526	39%	0.394	S	S	.	.			trans	-68	145.8	173.7	29.9	-33.1	0	0	0	109.4	S110	S110-P134 WeakPolarHBondContact O-CA 3.31Å
135	F	67	Low	61	Low	54 Å²	54	74.9 Å²	74.9	24%	0.237	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.1	175.2	70.1	-88.1	0	0	0	110	L109 K111 V143 V144 V145	L109-F135 HydrophobicContact CB-CD1 4.12Å; L109-F135 HydrophobicContact CB-CE1 4.47Å; K111-F135 WeakPolarHBondContact CE-O 2.94Å; K111-F135 HydrophobicContact CG-CD1 4.46Å; K111-F135 HydrophobicContact CG-CE1 4.29Å; K111-F135 HydrophobicContact CG-CZ 4.45Å; K111-F135 WeakPolarHBondContact CG-O 3.49Å; F135-V143 HydrophobicContact CB-CG1 3.75Å; F135-V143 HydrophobicContact CD2-CG1 3.72Å; F135-V143 HydrophobicContact CG-CG1 3.9Å; F135-V144 CarbonylContact C-O 3.49Å; F135-V144 VanDerWaalsContact CA-O 3.24Å; F135-V144 WeakPolarHBondContact CA-O 3.24Å; F135-V144 WeakPolarHBondContact CB-O 3.49Å; F135-V145 HydrophobicContact CB-CG2 4.13Å
136	T	58.9	Low	60.6	Low	83 Å²	83	73.3 Å²	73.3	51%	0.509	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	160.4	164.8	53.1	0	0	0	0	109.1	V144	T136-V144 PolarHBondContact N-O 3.22Å; T136-V144 PolarHBondContact O-N 2.58Å; T136-V144 WeakPolarHBondContact OG1-CB 3.37Å; T136-V144 PolarHBondContact OG1-O 3.09Å
137	F	59.6	Low	60.1	Low	136 Å²	136	68.1 Å²	68.1	60%	0.596	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.7	172.1	-177.2	-95.1	0	0	0	106.6	E139 V143	F137-E139 HydrophobicContact CE1-CG 4.34Å; F137-V143 HydrophobicContact CD2-CG2 4.47Å
138	D	54.6	Low	58.9	Low	69 Å²	69	73.9 Å²	73.9	37%	0.369	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	133.3	172.3	-177.5	52.6	0	0	0	108.3	D140 A141 G142 V144	D138-D140 PolarHBondContact O-N 3.15Å; D138-A141 HydrophobicContact CB-CB 4.11Å; D138-A141 WeakPolarHBondContact OD2-CB 3.31Å; D138-A141 PolarHBondContact OD2-N 3.49Å; D138-G142 PolarHBondContact N-O 3.25Å; D138-G142 VanDerWaalsContact O-CA 3.26Å; D138-G142 WeakPolarHBondContact O-CA 3.44Å; D138-G142 PolarHBondContact O-N 2.79Å; D138-V144 HydrophobicContact CB-CG2 3.91Å
139	E	53.4	Low	57.6	Low	178 Å²	178	79.3 Å²	79.3	83%	0.832	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.5	-174.9	-66.8	-174	170.1	0	0	112	F137	F137-E139 HydrophobicContact CE1-CG 4.34Å
140	D	52.5	Low	56.4	Low	160 Å²	160	79.4 Å²	79.4	86%	0.856	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-39.3	-179.1	-65.8	-41.2	0	0	0	112.7	D138	D138-D140 PolarHBondContact O-N 3.15Å
141	A	48.8	Very low	54.9	Low	40 Å²	40	84.2 Å²	84.2	33%	0.331	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-9.5	-175.8	0	0	0	0	0	115.1	D138 V144	D138-A141 HydrophobicContact CB-CB 4.11Å; D138-A141 WeakPolarHBondContact OD2-CB 3.31Å; D138-A141 PolarHBondContact OD2-N 3.49Å; A141-V144 HydrophobicContact CB-CG2 4.19Å
142	G	54.3	Low	53.3	Low	23 Å²	23	91.6 Å²	91.6	24%	0.237	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.1	-139.3	-177.7	0	0	0	0	0	113.3	D138 V144	D138-G142 PolarHBondContact N-O 3.25Å; D138-G142 VanDerWaalsContact O-CA 3.26Å; D138-G142 WeakPolarHBondContact O-CA 3.44Å; D138-G142 PolarHBondContact O-N 2.79Å; G142-V144 PolarHBondContact O-N 3.21Å
143	V	52.7	Low	51.3	Low	78 Å²	78	94.3 Å²	94.3	47%	0.473	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	114.6	-179.4	178	0	0	0	0	109.6	F135 F137 V145	F135-V143 HydrophobicContact CB-CG1 3.75Å; F135-V143 HydrophobicContact CD2-CG1 3.72Å; F135-V143 HydrophobicContact CG-CG1 3.9Å; F137-V143 HydrophobicContact CD2-CG2 4.47Å; V143-V145 HydrophobicContact CG1-CG2 4.32Å
144	V	53.5	Low	49.3	Very low	58 Å²	58	101.1 Å²	101.1	35%	0.352	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.1	128.9	177.7	178.4	0	0	0	0	109	F135 T136 D138 A141 G142	F135-V144 CarbonylContact C-O 3.49Å; F135-V144 VanDerWaalsContact CA-O 3.24Å; F135-V144 WeakPolarHBondContact CA-O 3.24Å; F135-V144 WeakPolarHBondContact CB-O 3.49Å; T136-V144 PolarHBondContact N-O 3.22Å; T136-V144 PolarHBondContact O-N 2.58Å; T136-V144 WeakPolarHBondContact OG1-CB 3.37Å; T136-V144 PolarHBondContact OG1-O 3.09Å; D138-V144 HydrophobicContact CB-CG2 3.91Å; A141-V144 HydrophobicContact CB-CG2 4.19Å; G142-V144 PolarHBondContact O-N 3.21Å
145	V	59.5	Low	47.8	Very low	49 Å²	49	99.1 Å²	99.1	30%	0.297	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.7	-178.7	174.9	0	0	0	0	108.9	L109 V133 F135 V143 L147	L109-V145 HydrophobicContact CD2-CG2 3.97Å; V133-V145 HydrophobicContact CG1-CB 4.38Å; V133-V145 HydrophobicContact CG1-CG1 3.15Å; V133-V145 HydrophobicContact CG1-CG2 4.42Å; F135-V145 HydrophobicContact CB-CG2 4.13Å; V143-V145 HydrophobicContact CG1-CG2 4.32Å; V145-L147 HydrophobicContact CG1-CD2 3.9Å; V145-L147 HydrophobicContact CG1-CG 4.04Å; V145-L147 PolarHBondContact O-N 2.9Å
146	D	54.9	Low	46.1	Very low	102 Å²	102	103.6 Å²	103.6	55%	0.545	57%	0.565	S	S	.	*			trans	-91.4	101.2	175.6	-166.6	-8.8	0	0	0	110.3	I148	D146-I148 VanDerWaalsContact C-N 3.31Å; D146-I148 WeakPolarHBondContact OD1-CB 3.28Å; D146-I148 WeakPolarHBondContact OD1-CD1 3.19Å; D146-I148 WeakPolarHBondContact OD1-CG1 3.45Å; D146-I148 PolarHBondContact OD1-N 2.79Å; D146-I148 VanDerWaalsContact OD1-N 3.09Å
147	L	52.8	Low	44.6	Very low	69 Å²	69	106.9 Å²	106.9	36%	0.361	57%	0.574	S	S	.	*			trans	-83.5	-4.8	-179.7	-66.6	170.4	0	0	0	113	V145 C149 R150	V145-L147 HydrophobicContact CG1-CD2 3.9Å; V145-L147 HydrophobicContact CG1-CG 4.04Å; V145-L147 PolarHBondContact O-N 2.9Å; L147-C149 PolarHBondContact O-N 3.36Å; L147-R150 PolarHBondContact O-N 2.87Å
148	I	41.8	Very low	43.2	Very low	148 Å²	148	107.7 Å²	107.7	76%	0.759	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-13.6	-162.1	-62.8	171	0	0	0	113.3	D146	D146-I148 VanDerWaalsContact C-N 3.31Å; D146-I148 WeakPolarHBondContact OD1-CB 3.28Å; D146-I148 WeakPolarHBondContact OD1-CD1 3.19Å; D146-I148 WeakPolarHBondContact OD1-CG1 3.45Å; D146-I148 PolarHBondContact OD1-N 2.79Å; D146-I148 VanDerWaalsContact OD1-N 3.09Å
149	C	38.1	Very low	42	Very low	124 Å²	124	108.2 Å²	108.2	84%	0.838	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	0.2	176	-72.7	0	0	0	0	115.8	L147 Q151	L147-C149 PolarHBondContact O-N 3.36Å; C149-Q151 PolarHBondContact O-N 2.87Å
150	R	42.7	Very low	40.9	Very low	83 Å²	83	104.3 Å²	104.3	31%	0.313	56%	0.557	S	S	.	*			trans	-90.1	79.8	178.8	-67.6	-170.1	-180	-157.3	-4.5	112.1	L130 L147 H152	L130-R150 PolarHBondContact O-NH1 2.63Å; L130-R150 PolarHBondContact O-NH2 3.46Å; L147-R150 PolarHBondContact O-N 2.87Å; R150-H152 PolarHBondContact O-N 3.23Å
151	Q	34.7	Very low	39.6	Very low	181 Å²	181	102.1 Å²	102.1	85%	0.846	55%	0.553	S	S	*	*			trans	-60.5	119.7	167	-87.8	-179.4	-21.9	0	0	110.9	C149	C149-Q151 PolarHBondContact O-N 2.87Å
152	H	31.8	Very low	38.7	Very low	175 Å²	175	105.4 Å²	105.4	81%	0.81	56%	0.561	S	S	*	*			trans	54.8	68.1	160.2	-68.5	-52	0	0	0	117.4	R150	R150-H152 PolarHBondContact O-N 3.23Å
153	C	30.1	Very low	37.4	Very low	84 Å²	84	109.1 Å²	109.1	57%	0.568	58%	0.579	S	S	*	*			trans	-77.9	115.1	149.6	-80.4	0	0	0	0	108.4	S155	C153-S155 PolarHBondContact O-N 2.99Å
154	T	29.7	Very low	36.1	Very low	149 Å²	149	113.2 Å²	113.2	91%	0.914	60%	0.598	S	S	*	*	S	Bend	trans	-77	32.1	179.5	43	0	0	0	0	113.9
155	S	31.5	Very low	35	Very low	38 Å²	38	115.4 Å²	115.4	27%	0.266	61%	0.611	S	S	.	*			trans	-160.9	116.5	167.9	158.7	0	0	0	0	106.4	C153 E157	C153-S155 PolarHBondContact O-N 2.99Å; S155-E157 PolarHBondContact O-N 3.49Å; S155-E157 WeakPolarHBondContact OG-CB 3.37Å; S155-E157 VanDerWaalsContact OG-CG 3.26Å; S155-E157 WeakPolarHBondContact OG-CG 3.15Å; S155-E157 PolarHBondContact OG-N 2.64Å; S155-E157 VanDerWaalsContact OG-N 3.15Å; S155-E157 PolarHBondContact OG-OE2 3.04Å
156	D	32	Very low	33.7	Very low	148 Å²	148	121.7 Å²	121.7	79%	0.791	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-65	5.2	171.4	-69.4	-40.8	0	0	0	112.2	W158	D156-W158 PolarHBondContact O-N 3.35Å
157	E	28.2	Very low	32.6	Very low	152 Å²	152	124.9 Å²	124.9	71%	0.71	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-85.7	-7.7	-168.2	-59.1	167.4	138.5	0	0	114.1	S155	S155-E157 PolarHBondContact O-N 3.49Å; S155-E157 WeakPolarHBondContact OG-CB 3.37Å; S155-E157 VanDerWaalsContact OG-CG 3.26Å; S155-E157 WeakPolarHBondContact OG-CG 3.15Å; S155-E157 PolarHBondContact OG-N 2.64Å; S155-E157 VanDerWaalsContact OG-N 3.15Å; S155-E157 PolarHBondContact OG-OE2 3.04Å
158	W	28.7	Very low	31.6	Very low	154 Å²	154	124.3 Å²	124.3	58%	0.583	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-103.9	-3.7	174.1	-61.9	78.9	0	0	0	113.1	G105 D156 L183	G105-W158 VanDerWaalsContact CA-CZ3 3.47Å; D156-W158 PolarHBondContact O-N 3.35Å; W158-L183 HydrophobicContact CD2-CD2 3.7Å; W158-L183 HydrophobicContact CE3-CD2 3.94Å; W158-L183 HydrophobicContact CH2-CD2 3.25Å; W158-L183 HydrophobicContact CZ2-CD2 2.96Å; W158-L183 HydrophobicContact CZ2-CG 4.45Å; W158-L183 HydrophobicContact CZ3-CD2 3.7Å
159	L	31.3	Very low	31	Very low	79 Å²	79	121.5 Å²	121.5	41%	0.414	65%	0.651	S	S	.	*	S	Bend	trans	-96.8	108.9	175.2	-127.2	78.2	0	0	0	107.9	F162	L159-F162 HydrophobicContact CB-CE2 4.15Å; L159-F162 HydrophobicContact CD2-CE2 3.83Å; L159-F162 HydrophobicContact CD2-CZ 4.23Å; L159-F162 HydrophobicContact CG-CE2 4Å; L159-F162 HydrophobicContact CG-CZ 4.28Å
160	F	28.8	Very low	30.8	Very low	97 Å²	97	120.4 Å²	120.4	43%	0.425	64%	0.64	S	S	.	*			trans	-7.1	127.1	164.4	-60.3	-88.9	0	0	0	115.7	F162 V172	F160-F162 HydrophobicContact CB-CE1 4.21Å; F160-F162 HydrophobicContact CB-CE2 4.22Å; F160-F162 HydrophobicContact CB-CZ 3.89Å; F160-F162 WeakPolarHBondContact O-CD2 3.46Å; F160-F162 WeakPolarHBondContact O-CE2 3.3Å; F160-F162 WeakPolarHBondContact O-CG 3.47Å; F160-F162 PolarHBondContact O-N 3.18Å; F160-V172 HydrophobicContact CE1-CG1 4.42Å
161	S	25	Very low	30.1	Very low	113 Å²	113	122.1 Å²	122.1	79%	0.79	66%	0.661	S	S	*	*			trans	-61.7	103.6	173.5	-177	0	0	0	0	110.7
162	F	31.1	Very low	30	Very low	109 Å²	109	118.7 Å²	118.7	48%	0.478	65%	0.652	S	S	.	*			trans	-86.4	115.4	-179.7	-59.8	-79.6	0	0	0	110.7	L159 F160 N164 V170	L159-F162 HydrophobicContact CB-CE2 4.15Å; L159-F162 HydrophobicContact CD2-CE2 3.83Å; L159-F162 HydrophobicContact CD2-CZ 4.23Å; L159-F162 HydrophobicContact CG-CE2 4Å; L159-F162 HydrophobicContact CG-CZ 4.28Å; F160-F162 HydrophobicContact CB-CE1 4.21Å; F160-F162 HydrophobicContact CB-CE2 4.22Å; F160-F162 HydrophobicContact CB-CZ 3.89Å; F160-F162 WeakPolarHBondContact O-CD2 3.46Å; F160-F162 WeakPolarHBondContact O-CE2 3.3Å; F160-F162 WeakPolarHBondContact O-CG 3.47Å; F160-F162 PolarHBondContact O-N 3.18Å; F162-N164 VanDerWaalsContact C-N 3.31Å; F162-N164 PolarHBondContact O-N 3.05Å; F162-V170 HydrophobicContact CE1-CG1 4.5Å
163	T	26.6	Very low	29.9	Very low	101 Å²	101	119.7 Å²	119.7	62%	0.62	65%	0.648	S	S	*	*			trans	-76.4	88.3	163.1	49.4	0	0	0	0	109.1	V165	T163-V165 PolarHBondContact O-N 3.05Å
164	N	26	Very low	30	Very low	165 Å²	165	121.7 Å²	121.7	88%	0.882	64%	0.644	S	S	*	*	S	Bend	trans	29.9	56.4	138.8	-135.9	18.6	0	0	0	118.9	F162	F162-N164 VanDerWaalsContact C-N 3.31Å; F162-N164 PolarHBondContact O-N 3.05Å
165	V	30	Very low	30.3	Very low	103 Å²	103	118.6 Å²	118.6	62%	0.624	63%	0.628	S	S	*	*			trans	-136.5	108.8	166.8	-169	0	0	0	0	109.4	T163 N167 A168	T163-V165 PolarHBondContact O-N 3.05Å; V165-N167 PolarHBondContact O-N 3.12Å; V165-A168 HydrophobicContact CB-CB 4.2Å; V165-A168 HydrophobicContact CG1-CB 3.99Å
166	E	31.4	Very low	30.7	Very low	181 Å²	181	119.9 Å²	119.9	85%	0.846	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	120.7	164.5	-72.8	178.4	156.1	0	0	108.3
167	N	33.2	Very low	30.8	Very low	169 Å²	169	119.6 Å²	119.6	90%	0.904	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.6	29.3	172.1	-47.9	-48.2	0	0	0	119.4	V165	V165-N167 PolarHBondContact O-N 3.12Å
168	A	30.4	Very low	31.2	Very low	58 Å²	58	115 Å²	115	48%	0.479	62%	0.624	S	S	.	*			trans	-114.1	142	172.8	0	0	0	0	0	113.5	V165	V165-A168 HydrophobicContact CB-CB 4.2Å; V165-A168 HydrophobicContact CG1-CB 3.99Å
169	P	30.1	Very low	31.7	Very low	88 Å²	88	112 Å²	112	57%	0.571	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-58.2	137.3	173.3	22	-30.4	0	0	0	111.4	T171	P169-T171 PolarHBondContact O-N 3.21Å
170	V	32.9	Very low	31.7	Very low	101 Å²	101	113.2 Å²	113.2	61%	0.612	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-65.4	124.2	-169.3	179.6	0	0	0	0	111.3	F162	F162-V170 HydrophobicContact CE1-CG1 4.5Å
171	T	28.4	Very low	31.8	Very low	120 Å²	120	111.6 Å²	111.6	74%	0.736	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-99.4	119.8	171.1	-23.9	0	0	0	0	109.8	P169	P169-T171 PolarHBondContact O-N 3.21Å
172	V	32.2	Very low	32.1	Very low	109 Å²	109	110 Å²	110	66%	0.661	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-80.6	127.1	-179.7	-178.1	0	0	0	0	110.3	F160	F160-V172 HydrophobicContact CE1-CG1 4.42Å
173	R	30.5	Very low	32.2	Very low	196 Å²	196	107.8 Å²	107.8	74%	0.74	61%	0.605	S	S	*	*			trans	-119.9	148.3	172.5	-78	-175.4	156.4	128.6	-3.1	110.9
174	R	32.4	Very low	32.4	Very low	126 Å²	126	109 Å²	109	48%	0.475	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-65.4	131.3	179.6	-167.3	178.6	-175.4	146.1	9	110.7	A48 M52	A48-R174 PolarHBondContact O-NH2 2.93Å; A48-R174 VanDerWaalsContact O-NH2 3.11Å; M52-R174 VanDerWaalsContact CA-NH1 3.26Å; M52-R174 VanDerWaalsContact CG-NH2 3.31Å; M52-R174 PolarHBondContact SD-NH2 3.22Å
175	S	35.1	Very low	32.6	Very low	84 Å²	84	108.5 Å²	108.5	59%	0.587	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-65.8	144.7	170.3	-57.8	0	0	0	0	110.7
176	S	39.5	Very low	32.8	Very low	65 Å²	65	108.8 Å²	108.8	46%	0.455	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-69.7	153.1	175.8	63.8	0	0	0	0	111.4	G178 Q179 F180	S176-G178 PolarHBondContact O-N 3.48Å; S176-Q179 WeakPolarHBondContact O-CB 3.41Å; S176-Q179 PolarHBondContact O-N 3.05Å; S176-Q179 WeakPolarHBondContact OG-CG 3.28Å; S176-Q179 PolarHBondContact OG-OE1 2.88Å; S176-F180 PolarHBondContact O-N 3.05Å
177	E	34	Very low	32.8	Very low	142 Å²	142	105 Å²	105	66%	0.664	60%	0.604	S	S	*	*	H	α-helix	trans	-57.7	-33	-179.6	-157.2	169.2	-161.9	0	0	112.4	M52 Q179 F180 A181	M52-E177 HydrophobicContact CE-CB 4.04Å; M52-E177 HydrophobicContact CE-CG 4Å; E177-Q179 PolarHBondContact O-N 2.91Å; E177-F180 PolarHBondContact O-N 3.18Å; E177-A181 PolarHBondContact O-N 2.92Å
178	G	37.4	Very low	32.8	Very low	54 Å²	54	101.4 Å²	101.4	56%	0.557	59%	0.587	S	S	*	*	H	α-helix	trans	-68.4	-29.6	175.1	0	0	0	0	0	114.5	S176 S182	S176-G178 PolarHBondContact O-N 3.48Å; G178-S182 PolarHBondContact O-N 3.35Å
179	Q	38.5	Very low	32.9	Very low	92 Å²	92	104 Å²	104	43%	0.43	59%	0.593	S	S	.	*	H	α-helix	trans	-73.8	-32.4	175.5	-73.9	167.2	-40.6	0	0	111.5	S176 E177 S182 L183	S176-Q179 WeakPolarHBondContact O-CB 3.41Å; S176-Q179 PolarHBondContact O-N 3.05Å; S176-Q179 WeakPolarHBondContact OG-CG 3.28Å; S176-Q179 PolarHBondContact OG-OE1 2.88Å; E177-Q179 PolarHBondContact O-N 2.91Å; Q179-S182 PolarHBondContact O-OG 3.3Å; Q179-L183 VanDerWaalsContact O-CD1 3.29Å; Q179-L183 WeakPolarHBondContact O-CD1 3.31Å
180	F	31.5	Very low	33.1	Very low	104 Å²	104	105 Å²	105	46%	0.456	60%	0.595	S	S	.	*	H	α-helix	trans	-71.7	-37.3	176	-157.6	-105.3	0	0	0	111.6	S176 E177 S182 L183 I184	S176-F180 PolarHBondContact O-N 3.05Å; E177-F180 PolarHBondContact O-N 3.18Å; F180-S182 PolarHBondContact O-N 3.19Å; F180-L183 WeakPolarHBondContact O-CB 3.38Å; F180-L183 PolarHBondContact O-N 3.31Å; F180-I184 HydrophobicContact CD1-CD1 3.45Å; F180-I184 VanDerWaalsContact CD1-CD1 3.45Å; F180-I184 HydrophobicContact CE1-CD1 3.28Å; F180-I184 HydrophobicContact CG-CD1 4.28Å; F180-I184 HydrophobicContact CZ-CD1 3.97Å; F180-I184 WeakPolarHBondContact O-CD1 3.42Å; F180-I184 WeakPolarHBondContact O-CG1 2.88Å
181	A	31.6	Very low	33.1	Very low	64 Å²	64	105.3 Å²	105.3	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-66.5	-33.3	178.6	0	0	0	0	0	113.7	E177 L183	E177-A181 PolarHBondContact O-N 2.92Å; A181-L183 PolarHBondContact O-N 3.12Å
182	S	31.7	Very low	33.5	Very low	78 Å²	78	104.2 Å²	104.2	55%	0.545	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.2	-12.5	176.8	62.2	0	0	0	0	114	G178 Q179 F180	G178-S182 PolarHBondContact O-N 3.35Å; Q179-S182 PolarHBondContact O-OG 3.3Å; F180-S182 PolarHBondContact O-N 3.19Å
183	L	32.8	Very low	33.6	Very low	64 Å²	64	103.8 Å²	103.8	34%	0.335	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.6	-14.7	-176.6	-98.8	145.7	0	0	0	113.2	W158 Q179 F180 A181	W158-L183 HydrophobicContact CD2-CD2 3.7Å; W158-L183 HydrophobicContact CE3-CD2 3.94Å; W158-L183 HydrophobicContact CH2-CD2 3.25Å; W158-L183 HydrophobicContact CZ2-CD2 2.96Å; W158-L183 HydrophobicContact CZ2-CG 4.45Å; W158-L183 HydrophobicContact CZ3-CD2 3.7Å; Q179-L183 VanDerWaalsContact O-CD1 3.29Å; Q179-L183 WeakPolarHBondContact O-CD1 3.31Å; F180-L183 WeakPolarHBondContact O-CB 3.38Å; F180-L183 PolarHBondContact O-N 3.31Å; A181-L183 PolarHBondContact O-N 3.12Å
184	I	31.6	Very low	33.8	Very low	125 Å²	125	96.2 Å²	96.2	64%	0.641	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	-2.7	-172.4	-46.3	164.9	0	0	0	111.6	F180	F180-I184 HydrophobicContact CD1-CD1 3.45Å; F180-I184 VanDerWaalsContact CD1-CD1 3.45Å; F180-I184 HydrophobicContact CE1-CD1 3.28Å; F180-I184 HydrophobicContact CG-CD1 4.28Å; F180-I184 HydrophobicContact CZ-CD1 3.97Å; F180-I184 WeakPolarHBondContact O-CD1 3.42Å; F180-I184 WeakPolarHBondContact O-CG1 2.88Å
185	S	29.7	Very low	33.9	Very low	156 Å²	156	93.5 Å²	93.5	100%	1.091	57%	0.572	S	S	*	*			trans	-98.6	0	174.6	74.4	0	0	0	0	112.2

Retrieved 185 of 185 residues in 412.9 ms (Link to these results)

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