A0A077ZEX6_TRITR Loading...

Gremlin

AlphaFold DB , UniProt , Accession A0A077ZEX6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 265 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	43.1	Very low	58.4	Low	246 Å²	246	131.2 Å²	131.2	100%	1.212	71%	0.708	S	S	*	*				0	94.4	0	-65.3	-174.8	-178.2	0	0	108.3	C3	M1-C3 PolarHBondContact O-N 3.22Å
2	A	49.4	Very low	59.6	Low	103 Å²	103	132.8 Å²	132.8	85%	0.851	70%	0.704	S	S	*	*			trans	-75	115.5	175.5	0	0	0	0	0	108	Q4	A2-Q4 PolarHBondContact O-N 2.95Å
3	C	57.4	Low	61	Low	78 Å²	78	127.7 Å²	127.7	53%	0.527	68%	0.683	S	S	.	*			trans	-57.1	108.1	-173.8	-158.2	0	0	0	0	110.2	M1 Y5 C6	M1-C3 PolarHBondContact O-N 3.22Å; C3-Y5 PolarHBondContact O-N 3.15Å; C3-Y5 VanDerWaalsContact O-N 3.08Å; C3-C6 PolarHBondContact O-N 3.2Å
4	Q	60	Low	62.4	Low	167 Å²	167	127 Å²	127	78%	0.78	68%	0.676	S	S	*	*	H	α-helix	trans	-55.5	-25.9	176.9	-86.4	175.4	-29.4	0	0	111.9	A2 C6 R7 L8	A2-Q4 PolarHBondContact O-N 2.95Å; Q4-C6 VanDerWaalsContact C-N 3.32Å; Q4-C6 PolarHBondContact O-N 2.81Å; Q4-R7 PolarHBondContact O-N 3.24Å; Q4-L8 VanDerWaalsContact O-CD1 3.31Å; Q4-L8 WeakPolarHBondContact O-CD1 3.31Å
5	Y	59	Low	63.8	Low	194 Å²	194	126.3 Å²	126.3	76%	0.761	67%	0.671	S	S	*	*	H	α-helix	trans	-66.6	-24.5	176.2	-73.2	-82.1	0	0	0	114.6	C3 R7 S9	C3-Y5 PolarHBondContact O-N 3.15Å; C3-Y5 VanDerWaalsContact O-N 3.08Å; Y5-R7 PolarHBondContact O-N 3.29Å; Y5-S9 PolarHBondContact O-N 2.85Å
6	C	59.6	Low	65	Low	91 Å²	91	125.1 Å²	125.1	62%	0.615	66%	0.664	S	S	*	*	H	α-helix	trans	-72	-27.5	178.2	-83.5	0	0	0	0	113.1	C3 Q4	C3-C6 PolarHBondContact O-N 3.2Å; Q4-C6 VanDerWaalsContact C-N 3.32Å; Q4-C6 PolarHBondContact O-N 2.81Å
7	R	57	Low	66.1	Low	222 Å²	222	123.6 Å²	123.6	84%	0.838	66%	0.656	S	S	*	*	H	α-helix	trans	-78.9	-30.6	177.2	-69.8	-165.7	178.8	-162.6	0.7	112.8	Q4 Y5	Q4-R7 PolarHBondContact O-N 3.24Å; Y5-R7 PolarHBondContact O-N 3.29Å
8	L	57.6	Low	67	Low	101 Å²	101	122.1 Å²	122.1	53%	0.529	65%	0.647	S	S	.	*	H	α-helix	trans	-72.3	-30.7	177	-82.3	92	0	0	0	112.7	Q4 V10 A11 F12	Q4-L8 VanDerWaalsContact O-CD1 3.31Å; Q4-L8 WeakPolarHBondContact O-CD1 3.31Å; L8-V10 PolarHBondContact O-N 2.77Å; L8-A11 PolarHBondContact O-N 2.85Å; L8-F12 PolarHBondContact O-N 2.75Å
9	S	62.7	Low	67.7	Low	88 Å²	88	120.3 Å²	120.3	62%	0.615	64%	0.638	S	S	*	*	H	α-helix	trans	-64.6	-24.1	-178.4	-169.7	0	0	0	0	114.1	Y5 P13	Y5-S9 PolarHBondContact O-N 2.85Å; S9-P13 WeakPolarHBondContact O-CD 3.47Å; S9-P13 WeakPolarHBondContact O-CG 3.34Å
10	V	68	Low	68.3	Low	94 Å²	94	119.1 Å²	119.1	57%	0.57	63%	0.631	S	S	*	*	H	α-helix	trans	-93.9	-26.9	179.9	-151.4	0	0	0	0	111.8	L8 P13 M14	L8-V10 PolarHBondContact O-N 2.77Å; V10-P13 WeakPolarHBondContact O-CD 3.13Å; V10-P13 WeakPolarHBondContact O-CG 3.42Å; V10-M14 WeakPolarHBondContact O-CG 3.42Å
11	A	68.4	Low	68.7	Low	59 Å²	59	117.6 Å²	117.6	49%	0.488	62%	0.622	S	S	.	*	H	α-helix	trans	-73.4	-37.6	-179.2	0	0	0	0	0	112.7	L8 M14 L15	L8-A11 PolarHBondContact O-N 2.85Å; A11-M14 PolarHBondContact O-N 3.05Å; A11-L15 WeakPolarHBondContact O-CB 3.37Å; A11-L15 PolarHBondContact O-N 2.69Å
12	F	72.7	Confident	70.3	Confident	150 Å²	150	109 Å²	109	66%	0.658	58%	0.58	S	S	*	*	H	α-helix	trans	-59.4	-51.4	178.5	-99.9	-89.2	0	0	0	114.6	L8 M14 L15 L16	L8-F12 PolarHBondContact O-N 2.75Å; F12-M14 VanDerWaalsContact C-N 3.33Å; F12-M14 PolarHBondContact O-N 3.18Å; F12-L15 PolarHBondContact O-N 2.03Å; F12-L16 WeakPolarHBondContact O-CB 3.46Å; F12-L16 PolarHBondContact O-N 2.88Å
13	P	78.3	Confident	71.4	Confident	67 Å²	67	109.2 Å²	109.2	44%	0.435	57%	0.571	S	S	.	*	H	α-helix	trans	-68	-33.5	179.8	24.5	-33.2	0	0	0	112.4	S9 V10 L16 L17	S9-P13 WeakPolarHBondContact O-CD 3.47Å; S9-P13 WeakPolarHBondContact O-CG 3.34Å; V10-P13 WeakPolarHBondContact O-CD 3.13Å; V10-P13 WeakPolarHBondContact O-CG 3.42Å; P13-L16 PolarHBondContact O-N 3.44Å; P13-L17 WeakPolarHBondContact O-CB 3.4Å; P13-L17 PolarHBondContact O-N 3.44Å
14	M	80.5	Confident	72	Confident	118 Å²	118	113.3 Å²	113.3	58%	0.581	58%	0.582	S	S	*	*	H	α-helix	trans	-66.6	-42.7	176.4	-75	-71	134.4	0	0	112	V10 A11 F12 L16 L17 L18	V10-M14 WeakPolarHBondContact O-CG 3.42Å; A11-M14 PolarHBondContact O-N 3.05Å; F12-M14 VanDerWaalsContact C-N 3.33Å; F12-M14 PolarHBondContact O-N 3.18Å; M14-L16 VanDerWaalsContact C-N 3.35Å; M14-L17 PolarHBondContact O-N 2.73Å; M14-L18 WeakPolarHBondContact O-CB 3.35Å; M14-L18 PolarHBondContact O-N 3Å
15	L	83	Confident	72.5	Confident	116 Å²	116	111.2 Å²	111.2	61%	0.607	58%	0.576	S	S	*	*	H	α-helix	trans	-65.2	-39.6	176.4	-164.5	85.1	0	0	0	111.6	A11 F12 L18 L19	A11-L15 WeakPolarHBondContact O-CB 3.37Å; A11-L15 PolarHBondContact O-N 2.69Å; F12-L15 PolarHBondContact O-N 2.03Å; L15-L18 PolarHBondContact O-N 3.33Å; L15-L19 WeakPolarHBondContact O-CG 3.42Å; L15-L19 PolarHBondContact O-N 2.86Å
16	L	83.5	Confident	72.6	Confident	107 Å²	107	104.9 Å²	104.9	56%	0.56	57%	0.57	S	S	*	*	H	α-helix	trans	-64.9	-43.2	176.7	-172.4	68.9	0	0	0	111.6	F12 P13 M14 L18 L19 I20	F12-L16 WeakPolarHBondContact O-CB 3.46Å; F12-L16 PolarHBondContact O-N 2.88Å; P13-L16 PolarHBondContact O-N 3.44Å; M14-L16 VanDerWaalsContact C-N 3.35Å; L16-L18 VanDerWaalsContact C-N 3.33Å; L16-L18 PolarHBondContact O-N 2.87Å; L16-L19 PolarHBondContact O-N 3.06Å; L16-I20 HydrophobicContact CG-CD1 4.14Å; L16-I20 VanDerWaalsContact O-CG1 3.28Å; L16-I20 WeakPolarHBondContact O-CG1 3.18Å; L16-I20 PolarHBondContact O-N 2.95Å
17	L	82.9	Confident	72.6	Confident	100 Å²	100	108.8 Å²	108.8	52%	0.524	58%	0.577	S	S	.	*	H	α-helix	trans	-62.3	-41.3	176	-161	91.3	0	0	0	111.5	P13 M14 I20 L21	P13-L17 WeakPolarHBondContact O-CB 3.4Å; P13-L17 PolarHBondContact O-N 3.44Å; M14-L17 PolarHBondContact O-N 2.73Å; L17-I20 PolarHBondContact O-N 2.88Å; L17-L21 HydrophobicContact CD2-CD1 4.46Å; L17-L21 WeakPolarHBondContact O-CB 3.5Å; L17-L21 WeakPolarHBondContact O-CG 3.31Å; L17-L21 PolarHBondContact O-N 3.36Å
18	L	82.8	Confident	72.1	Confident	96 Å²	96	103.5 Å²	103.5	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-64.4	-40.5	177.1	-121.9	152.1	0	0	0	111.9	M14 L15 L16 L21 M22	M14-L18 WeakPolarHBondContact O-CB 3.35Å; M14-L18 PolarHBondContact O-N 3Å; L15-L18 PolarHBondContact O-N 3.33Å; L16-L18 VanDerWaalsContact C-N 3.33Å; L16-L18 PolarHBondContact O-N 2.87Å; L18-L21 PolarHBondContact O-N 2.8Å; L18-M22 HydrophobicContact CD2-CE 3.88Å; L18-M22 WeakPolarHBondContact O-CB 3.07Å; L18-M22 WeakPolarHBondContact O-CG 3.41Å; L18-M22 PolarHBondContact O-N 2.94Å
19	L	80.8	Confident	71.3	Confident	89 Å²	89	101.7 Å²	101.7	47%	0.466	57%	0.57	S	S	.	*	H	α-helix	trans	-65	-43.1	173.9	-78.3	167.2	0	0	0	112	L15 L16 L21 M22 V23	L15-L19 WeakPolarHBondContact O-CG 3.42Å; L15-L19 PolarHBondContact O-N 2.86Å; L16-L19 PolarHBondContact O-N 3.06Å; L19-L21 VanDerWaalsContact C-N 3.33Å; L19-L21 PolarHBondContact O-N 3.1Å; L19-M22 PolarHBondContact O-N 2.84Å; L19-V23 WeakPolarHBondContact O-CG2 3.32Å; L19-V23 PolarHBondContact O-N 2.82Å
20	I	80	Confident	70.3	Confident	96 Å²	96	103 Å²	103	49%	0.492	57%	0.574	S	S	.	*	H	α-helix	trans	-61.5	-43.9	175.8	-66.8	164.2	0	0	0	110.3	L16 L17 M22 V23 H24	L16-I20 HydrophobicContact CG-CD1 4.14Å; L16-I20 VanDerWaalsContact O-CG1 3.28Å; L16-I20 WeakPolarHBondContact O-CG1 3.18Å; L16-I20 PolarHBondContact O-N 2.95Å; L17-I20 PolarHBondContact O-N 2.88Å; I20-M22 VanDerWaalsContact C-N 3.34Å; I20-M22 PolarHBondContact O-N 3.05Å; I20-V23 PolarHBondContact O-N 3.28Å; I20-H24 WeakPolarHBondContact O-CB 3.36Å; I20-H24 PolarHBondContact O-N 3.23Å
21	L	76.9	Confident	69.2	Low	87 Å²	87	104.1 Å²	104.1	46%	0.455	59%	0.586	S	S	.	*	H	α-helix	trans	-63.4	-38	175.5	-73.8	170.4	0	0	0	112.4	L17 L18 L19 V23 H24 N25	L17-L21 HydrophobicContact CD2-CD1 4.46Å; L17-L21 WeakPolarHBondContact O-CB 3.5Å; L17-L21 WeakPolarHBondContact O-CG 3.31Å; L17-L21 PolarHBondContact O-N 3.36Å; L18-L21 PolarHBondContact O-N 2.8Å; L19-L21 VanDerWaalsContact C-N 3.33Å; L19-L21 PolarHBondContact O-N 3.1Å; L21-V23 VanDerWaalsContact C-N 3.34Å; L21-H24 PolarHBondContact O-N 2.87Å; L21-N25 WeakPolarHBondContact O-CB 3.29Å; L21-N25 VanDerWaalsContact O-CG 3.27Å; L21-N25 PolarHBondContact O-N 2.91Å; L21-N25 PolarHBondContact O-ND2 3.15Å
22	M	76	Confident	67.8	Low	65 Å²	65	108.1 Å²	108.1	32%	0.32	60%	0.595	S	S	.	*	H	α-helix	trans	-66.6	-34.7	176	-70.6	-92.8	-177.1	0	0	112.4	L18 L19 I20 G26 F27 I28	L18-M22 HydrophobicContact CD2-CE 3.88Å; L18-M22 WeakPolarHBondContact O-CB 3.07Å; L18-M22 WeakPolarHBondContact O-CG 3.41Å; L18-M22 PolarHBondContact O-N 2.94Å; L19-M22 PolarHBondContact O-N 2.84Å; I20-M22 VanDerWaalsContact C-N 3.34Å; I20-M22 PolarHBondContact O-N 3.05Å; M22-G26 PolarHBondContact O-N 2.92Å; M22-F27 PolarHBondContact O-N 2.83Å; M22-F27 HydrophobicContact SD-CB 4.14Å; M22-F27 HydrophobicContact SD-CD1 4.22Å; M22-I28 HydrophobicContact CB-CD1 3.83Å; M22-I28 HydrophobicContact CB-CG1 4.15Å; M22-I28 HydrophobicContact CG-CD1 4.16Å; M22-I28 HydrophobicContact SD-CD1 4.19Å; M22-I28 HydrophobicContact SD-CG1 4.32Å
23	V	72.2	Confident	66.4	Low	109 Å²	109	105.8 Å²	105.8	66%	0.661	60%	0.596	S	S	*	*	H	α-helix	trans	-73	-43.2	174.1	174.2	0	0	0	0	110.8	L19 I20 L21 G26	L19-V23 WeakPolarHBondContact O-CG2 3.32Å; L19-V23 PolarHBondContact O-N 2.82Å; I20-V23 PolarHBondContact O-N 3.28Å; L21-V23 VanDerWaalsContact C-N 3.34Å; V23-G26 PolarHBondContact O-N 3.36Å
24	H	69.8	Low	64.6	Low	164 Å²	164	111.5 Å²	111.5	76%	0.759	62%	0.619	S	S	*	*	H	α-helix	trans	-69.8	-35.4	-179.7	-143.2	-97.1	0	0	0	112.4	I20 L21 G26	I20-H24 WeakPolarHBondContact O-CB 3.36Å; I20-H24 PolarHBondContact O-N 3.23Å; L21-H24 PolarHBondContact O-N 2.87Å; H24-G26 VanDerWaalsContact C-N 3.26Å; H24-G26 PolarHBondContact O-N 3.23Å
25	N	70.8	Confident	62.7	Low	122 Å²	122	111.6 Å²	111.6	65%	0.652	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	4.8	174.3	-66.1	-21.1	0	0	0	112.9	L21 F27	L21-N25 WeakPolarHBondContact O-CB 3.29Å; L21-N25 VanDerWaalsContact O-CG 3.27Å; L21-N25 PolarHBondContact O-N 2.91Å; L21-N25 PolarHBondContact O-ND2 3.15Å; N25-F27 VanDerWaalsContact C-N 3.3Å; N25-F27 PolarHBondContact O-N 3.5Å
26	G	61.2	Low	60.9	Low	62 Å²	62	112.2 Å²	112.2	64%	0.639	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.6	26.3	171.9	0	0	0	0	0	115.2	M22 V23 H24	M22-G26 PolarHBondContact O-N 2.92Å; V23-G26 PolarHBondContact O-N 3.36Å; H24-G26 VanDerWaalsContact C-N 3.26Å; H24-G26 PolarHBondContact O-N 3.23Å
27	F	58.9	Low	58.9	Low	173 Å²	173	115.7 Å²	115.7	76%	0.759	65%	0.648	S	S	*	*			trans	-89.9	-23	-171	-147.2	-101.7	0	0	0	113.8	M22 N25	M22-F27 PolarHBondContact O-N 2.83Å; M22-F27 HydrophobicContact SD-CB 4.14Å; M22-F27 HydrophobicContact SD-CD1 4.22Å; N25-F27 VanDerWaalsContact C-N 3.3Å; N25-F27 PolarHBondContact O-N 3.5Å
28	I	47.9	Very low	57	Low	110 Å²	110	120.5 Å²	120.5	56%	0.564	66%	0.659	S	S	*	*	S	Bend	trans	-109.8	88.5	177.4	-56.8	175.3	0	0	0	109.3	M22	M22-I28 HydrophobicContact CB-CD1 3.83Å; M22-I28 HydrophobicContact CB-CG1 4.15Å; M22-I28 HydrophobicContact CG-CD1 4.16Å; M22-I28 HydrophobicContact SD-CD1 4.19Å; M22-I28 HydrophobicContact SD-CG1 4.32Å
29	G	39.7	Very low	55	Low	64 Å²	64	123.4 Å²	123.4	66%	0.66	67%	0.67	S	S	*	*	S	Bend	trans	66.3	90.9	149.5	0	0	0	0	0	116.9
30	T	41.9	Very low	53.3	Low	115 Å²	115	126.4 Å²	126.4	71%	0.706	68%	0.682	S	S	*	*				-152.5	134	107.9	47.8	0	0	0	0	109.6	H32	T30-H32 PolarHBondContact O-N 2.74Å
31	S	45.6	Very low	51.5	Low	117 Å²	117	128.9 Å²	128.9	82%	0.818	69%	0.693	S	S	*	*			trans	-64.6	78.1	168	52.6	0	0	0	0	110.2
32	H	39.4	Very low	50.3	Low	144 Å²	144	127.7 Å²	127.7	67%	0.667	69%	0.689	S	S	*	*			trans	-128.7	104.6	169.9	-72.9	-65	0	0	0	109.9	T30	T30-H32 PolarHBondContact O-N 2.74Å
33	C	43.4	Very low	48.8	Very low	101 Å²	101	128.4 Å²	128.4	68%	0.682	70%	0.695	S	S	*	*			trans	25.8	113.1	151.2	53.8	0	0	0	0	116.3	T35	C33-T35 PolarHBondContact O-N 2.77Å
34	M	38.7	Very low	47.9	Very low	186 Å²	186	126.4 Å²	126.4	92%	0.916	69%	0.689	S	S	*	*			trans	-49.8	105.7	156	-65.2	-151	142.2	0	0	108.7	V36	M34-V36 PolarHBondContact O-N 2.99Å
35	T	42.4	Very low	47.2	Very low	121 Å²	121	124.3 Å²	124.3	74%	0.742	68%	0.684	S	S	*	*			trans	-68.3	90.4	163.2	43.5	0	0	0	0	105.6	C33 Q37	C33-T35 PolarHBondContact O-N 2.77Å; T35-Q37 VanDerWaalsContact C-N 3.3Å; T35-Q37 PolarHBondContact O-N 2.64Å
36	V	43.6	Very low	46.4	Very low	128 Å²	128	125 Å²	125	78%	0.776	68%	0.683	S	S	*	*			trans	-58.4	104.6	162.4	176.1	0	0	0	0	105.1	M34 R38	M34-V36 PolarHBondContact O-N 2.99Å; V36-R38 VanDerWaalsContact C-N 3.27Å; V36-R38 PolarHBondContact O-N 3.23Å
37	Q	41.2	Very low	46.1	Very low	180 Å²	180	124.6 Å²	124.6	84%	0.841	67%	0.67	S	S	*	*			trans	-57	98.8	169.4	-75	178.7	-50	0	0	106.8	T35 Q39	T35-Q37 VanDerWaalsContact C-N 3.3Å; T35-Q37 PolarHBondContact O-N 2.64Å; Q37-Q39 VanDerWaalsContact C-N 3.29Å; Q37-Q39 PolarHBondContact O-N 3.19Å
38	R	43	Very low	46.2	Very low	201 Å²	201	118.3 Å²	118.3	76%	0.758	65%	0.651	S	S	*	*			trans	-67.9	94.9	171.8	-176.1	176.7	-174.7	149.4	-5.4	105.2	V36 E40	V36-R38 VanDerWaalsContact C-N 3.27Å; V36-R38 PolarHBondContact O-N 3.23Å; R38-E40 PolarHBondContact O-N 3.32Å
39	Q	42.7	Very low	46.7	Very low	158 Å²	158	115.3 Å²	115.3	74%	0.738	64%	0.642	S	S	*	*			trans	-48.8	118.1	169.9	-89.4	172.8	-41.6	0	0	108.5	Q37 M41	Q37-Q39 VanDerWaalsContact C-N 3.29Å; Q37-Q39 PolarHBondContact O-N 3.19Å; Q39-M41 PolarHBondContact O-N 2.89Å
40	E	43.3	Very low	47.8	Very low	152 Å²	152	115 Å²	115	71%	0.71	63%	0.633	S	S	*	*			trans	-61.7	73	175.3	-70.6	164.4	159.7	0	0	109.8	R38 T42	R38-E40 PolarHBondContact O-N 3.32Å; E40-T42 VanDerWaalsContact C-N 3.31Å
41	M	43.2	Very low	49	Very low	147 Å²	147	116.1 Å²	116.1	72%	0.724	63%	0.631	S	S	*	*			trans	-94	7.9	165.5	-69	-173	-179.1	0	0	111.6	Q39	Q39-M41 PolarHBondContact O-N 2.89Å
42	T	52	Low	49.6	Very low	62 Å²	62	116 Å²	116	38%	0.38	62%	0.619	S	S	.	*	S	Bend	trans	-88	-27.5	175	41.4	0	0	0	0	112.6	E40 A44 N45 E46	E40-T42 VanDerWaalsContact C-N 3.31Å; T42-A44 PolarHBondContact O-N 3.31Å; T42-N45 PolarHBondContact O-N 3.22Å; T42-E46 WeakPolarHBondContact O-CB 3.22Å; T42-E46 PolarHBondContact O-N 3.28Å; T42-E46 VanDerWaalsContact O-N 3.08Å
43	D	45	Very low	50.6	Low	81 Å²	81	113.4 Å²	113.4	43%	0.433	61%	0.608	S	S	.	*	H	α-helix	trans	-78.6	-29.2	-167.6	-57.6	-2.2	0	0	0	111.8	S47	D43-S47 WeakPolarHBondContact O-CB 3.4Å; D43-S47 PolarHBondContact O-N 3.33Å; D43-S47 PolarHBondContact O-OG 2.75Å
44	A	53.1	Low	51.8	Low	66 Å²	66	112.6 Å²	112.6	55%	0.545	61%	0.608	S	S	.	*	H	α-helix	trans	-68.7	-38.7	175.5	0	0	0	0	0	112.9	T42 S47 A48	T42-A44 PolarHBondContact O-N 3.31Å; A44-S47 WeakPolarHBondContact CA-OG 3.31Å; A44-S47 PolarHBondContact O-OG 2.85Å; A44-S47 VanDerWaalsContact O-OG 3.06Å; A44-A48 VanDerWaalsContact O-CB 3.31Å; A44-A48 WeakPolarHBondContact O-CB 3.46Å; A44-A48 PolarHBondContact O-N 3.33Å
45	N	54.9	Low	53.2	Low	121 Å²	121	105.5 Å²	105.5	65%	0.647	58%	0.579	S	S	*	*	H	α-helix	trans	-78	-35.6	178.7	-83.7	13.3	0	0	0	112	T42 A49	T42-N45 PolarHBondContact O-N 3.22Å; N45-A49 WeakPolarHBondContact O-CB 3.49Å; N45-A49 PolarHBondContact O-N 3.22Å
46	E	53.7	Low	54.5	Low	135 Å²	135	106 Å²	106	63%	0.631	59%	0.585	S	S	*	*	H	α-helix	trans	-72.6	-38.6	177.2	-165.7	155.3	-176.2	0	0	111.4	T42 A49 A50	T42-E46 WeakPolarHBondContact O-CB 3.22Å; T42-E46 PolarHBondContact O-N 3.28Å; T42-E46 VanDerWaalsContact O-N 3.08Å; E46-A49 PolarHBondContact O-N 2.91Å; E46-A50 VanDerWaalsContact O-CB 3.22Å; E46-A50 WeakPolarHBondContact O-CB 3.46Å; E46-A50 PolarHBondContact O-N 2.92Å
47	S	54.3	Low	55.6	Low	54 Å²	54	107.1 Å²	107.1	38%	0.378	59%	0.586	S	S	.	*	H	α-helix	trans	-65.5	-40.9	171.6	56.7	0	0	0	0	112.5	D43 A44 A50 Q51	D43-S47 WeakPolarHBondContact O-CB 3.4Å; D43-S47 PolarHBondContact O-N 3.33Å; D43-S47 PolarHBondContact O-OG 2.75Å; A44-S47 WeakPolarHBondContact CA-OG 3.31Å; A44-S47 PolarHBondContact O-OG 2.85Å; A44-S47 VanDerWaalsContact O-OG 3.06Å; S47-A50 PolarHBondContact O-N 3.36Å; S47-Q51 VanDerWaalsContact O-CB 3.25Å; S47-Q51 WeakPolarHBondContact O-CB 3.28Å; S47-Q51 WeakPolarHBondContact O-CG 3.42Å; S47-Q51 PolarHBondContact O-N 3.42Å
48	A	61.6	Low	56.7	Low	42 Å²	42	102.7 Å²	102.7	35%	0.347	56%	0.562	S	S	.	*	H	α-helix	trans	-62.1	-45.1	173.6	0	0	0	0	0	111.7	A44 Q51 M52	A44-A48 VanDerWaalsContact O-CB 3.31Å; A44-A48 WeakPolarHBondContact O-CB 3.46Å; A44-A48 PolarHBondContact O-N 3.33Å; A48-Q51 PolarHBondContact O-N 2.81Å; A48-M52 WeakPolarHBondContact O-CB 3.5Å; A48-M52 VanDerWaalsContact O-CG 3.23Å; A48-M52 WeakPolarHBondContact O-CG 3.36Å; A48-M52 PolarHBondContact O-N 2.81Å
49	A	57.9	Low	57.8	Low	47 Å²	47	94.9 Å²	94.9	39%	0.388	54%	0.537	S	S	.	.	H	α-helix	trans	-63.7	-43	176.6	0	0	0	0	0	111.9	N45 E46 M52 M53	N45-A49 WeakPolarHBondContact O-CB 3.49Å; N45-A49 PolarHBondContact O-N 3.22Å; E46-A49 PolarHBondContact O-N 2.91Å; A49-M52 PolarHBondContact O-N 3.38Å; A49-M53 WeakPolarHBondContact O-CB 3.44Å; A49-M53 WeakPolarHBondContact O-CG 3.28Å; A49-M53 PolarHBondContact O-N 3.07Å
50	A	62.7	Low	59.3	Low	57 Å²	57	90.5 Å²	90.5	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-42.4	176.9	0	0	0	0	0	112	E46 S47 M53 A54	E46-A50 VanDerWaalsContact O-CB 3.22Å; E46-A50 WeakPolarHBondContact O-CB 3.46Å; E46-A50 PolarHBondContact O-N 2.92Å; S47-A50 PolarHBondContact O-N 3.36Å; A50-M53 PolarHBondContact O-N 3.06Å; A50-A54 WeakPolarHBondContact O-CB 3.37Å; A50-A54 PolarHBondContact O-N 2.63Å
51	Q	67.3	Low	60.5	Low	139 Å²	139	88.8 Å²	88.8	65%	0.65	51%	0.512	S	S	*	.	H	α-helix	trans	-62.8	-40.8	174.6	-75.6	171.3	1.8	0	0	111.7	S47 A48 A54 A55	S47-Q51 VanDerWaalsContact O-CB 3.25Å; S47-Q51 WeakPolarHBondContact O-CB 3.28Å; S47-Q51 WeakPolarHBondContact O-CG 3.42Å; S47-Q51 PolarHBondContact O-N 3.42Å; A48-Q51 PolarHBondContact O-N 2.81Å; Q51-A54 PolarHBondContact O-N 3.25Å; Q51-A55 PolarHBondContact O-N 2.88Å; Q51-A55 VanDerWaalsContact O-N 3.15Å
52	M	57.8	Low	61.5	Low	115 Å²	115	88.6 Å²	88.6	57%	0.567	51%	0.507	S	S	*	.	H	α-helix	trans	-66.1	-36.2	173.8	-71.1	179.2	78.1	0	0	112.6	A48 A49 A54 A55	A48-M52 WeakPolarHBondContact O-CB 3.5Å; A48-M52 VanDerWaalsContact O-CG 3.23Å; A48-M52 WeakPolarHBondContact O-CG 3.36Å; A48-M52 PolarHBondContact O-N 2.81Å; A49-M52 PolarHBondContact O-N 3.38Å; M52-A54 VanDerWaalsContact C-N 3.33Å; M52-A55 PolarHBondContact O-N 2.89Å
53	M	61	Low	62.1	Low	88 Å²	88	88.6 Å²	88.6	43%	0.433	51%	0.505	S	S	.	.	H	α-helix	trans	-73.5	-24.9	177.2	-66.8	-95.9	-167.3	0	0	112.9	A49 A50 R58	A49-M53 WeakPolarHBondContact O-CB 3.44Å; A49-M53 WeakPolarHBondContact O-CG 3.28Å; A49-M53 PolarHBondContact O-N 3.07Å; A50-M53 PolarHBondContact O-N 3.06Å; M53-R58 VanDerWaalsContact SD-CZ 3.52Å; M53-R58 PolarHBondContact SD-NH2 3.17Å
54	A	67.9	Low	63.2	Low	84 Å²	84	88 Å²	88	69%	0.694	50%	0.501	S	S	*	.	S	Bend	trans	-90.6	-6.1	176.7	0	0	0	0	0	113.6	A50 Q51 M52	A50-A54 WeakPolarHBondContact O-CB 3.37Å; A50-A54 PolarHBondContact O-N 2.63Å; Q51-A54 PolarHBondContact O-N 3.25Å; M52-A54 VanDerWaalsContact C-N 3.33Å
55	A	68.4	Low	63.7	Low	38 Å²	38	86.3 Å²	86.3	31%	0.314	49%	0.486	S	S	.	.	S	Bend	trans	-68.9	142.3	-179.6	0	0	0	0	0	111.7	Q51 M52 N57 R58	Q51-A55 PolarHBondContact O-N 2.88Å; Q51-A55 VanDerWaalsContact O-N 3.15Å; M52-A55 PolarHBondContact O-N 2.89Å; A55-N57 PolarHBondContact O-N 2.83Å; A55-R58 PolarHBondContact O-N 3.38Å
56	P	69.3	Low	64.2	Low	131 Å²	131	85.8 Å²	85.8	85%	0.851	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-27.1	179.3	23	-32.3	0	0	0	113.1
57	N	67.4	Low	64.7	Low	151 Å²	151	83.8 Å²	83.8	81%	0.807	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	55.8	173.7	-66.7	-34.4	0	0	0	110.5	A55 P59	A55-N57 PolarHBondContact O-N 2.83Å; N57-P59 WeakPolarHBondContact O-CD 3.26Å
58	R	64.7	Low	65.2	Low	87 Å²	87	82.5 Å²	82.5	33%	0.328	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-60.9	124.8	176.8	179	177.4	170.9	165.9	-3.2	109.4	M53 A55	M53-R58 VanDerWaalsContact SD-CZ 3.52Å; M53-R58 PolarHBondContact SD-NH2 3.17Å; A55-R58 PolarHBondContact O-N 3.38Å
59	P	66.1	Low	65.2	Low	38 Å²	38	83.1 Å²	83.1	25%	0.247	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-59.7	141.3	176	20.2	-28.9	0	0	0	110.7	N57 D63 L64	N57-P59 WeakPolarHBondContact O-CD 3.26Å; P59-D63 HydrophobicContact CB-CB 3.82Å; P59-L64 HydrophobicContact CB-CD1 4.45Å; P59-L64 HydrophobicContact CB-CG 4.21Å; P59-L64 HydrophobicContact CG-CD1 4.16Å; P59-L64 HydrophobicContact CG-CD2 4.33Å; P59-L64 HydrophobicContact CG-CG 3.95Å; P59-L64 WeakPolarHBondContact O-CD1 3.5Å
60	S	73.2	Confident	65.3	Low	66 Å²	66	84.9 Å²	84.9	46%	0.462	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-58.1	153.2	173.1	173.3	0	0	0	0	109.6	F62 D63 L64	S60-F62 PolarHBondContact O-N 2.87Å; S60-F62 PolarHBondContact OG-N 3.49Å; S60-D63 WeakPolarHBondContact CB-OD2 3.18Å; S60-D63 PolarHBondContact N-OD2 2.94Å; S60-D63 WeakPolarHBondContact O-CA 3.2Å; S60-D63 PolarHBondContact O-N 3.07Å; S60-L64 PolarHBondContact O-N 3.14Å
61	Y	68.7	Low	65.2	Low	116 Å²	116	86 Å²	86	46%	0.455	46%	0.463	S	S	.	.	H	α-helix	trans	-49.1	-36.1	169.8	177.1	-98.5	0	0	0	111.5	L64 S65 F212 S214	Y61-L64 PolarHBondContact O-N 2.02Å; Y61-S65 WeakPolarHBondContact O-CB 3.42Å; Y61-S65 PolarHBondContact O-N 2.04Å; Y61-S65 PolarHBondContact O-OG 3.05Å; Y61-F212 WeakPolarHBondContact OH-CZ 3.43Å; Y61-S214 WeakPolarHBondContact OH-CB 3.41Å
62	F	64.3	Low	64.4	Low	142 Å²	142	82.9 Å²	82.9	62%	0.623	45%	0.45	S	S	*	.	H	α-helix	trans	-60.6	-47	173.7	-168.2	-94.3	0	0	0	112.6	S60 S65 R66	S60-F62 PolarHBondContact O-N 2.87Å; S60-F62 PolarHBondContact OG-N 3.49Å; F62-S65 PolarHBondContact O-N 2.68Å; F62-S65 PolarHBondContact O-OG 3.29Å; F62-R66 WeakPolarHBondContact O-CB 3.3Å; F62-R66 PolarHBondContact O-N 2.94Å
63	D	65.3	Low	64.3	Low	62 Å²	62	80 Å²	80	33%	0.332	44%	0.439	S	S	.	.	H	α-helix	trans	-67.9	-38.1	179.4	-61.5	-45.9	0	0	0	112.4	P59 S60 R66 N67	P59-D63 HydrophobicContact CB-CB 3.82Å; S60-D63 WeakPolarHBondContact CB-OD2 3.18Å; S60-D63 PolarHBondContact N-OD2 2.94Å; S60-D63 WeakPolarHBondContact O-CA 3.2Å; S60-D63 PolarHBondContact O-N 3.07Å; D63-R66 PolarHBondContact O-N 2.95Å; D63-N67 WeakPolarHBondContact O-CB 3.04Å; D63-N67 VanDerWaalsContact O-CG 3.26Å; D63-N67 PolarHBondContact O-N 3.43Å
64	L	68.2	Low	63.6	Low	68 Å²	68	77.9 Å²	77.9	36%	0.356	43%	0.432	S	S	.	.	H	α-helix	trans	-60.2	-46.4	172.5	-80.1	143.8	0	0	0	111	P59 S60 Y61 N67 A68	P59-L64 HydrophobicContact CB-CD1 4.45Å; P59-L64 HydrophobicContact CB-CG 4.21Å; P59-L64 HydrophobicContact CG-CD1 4.16Å; P59-L64 HydrophobicContact CG-CD2 4.33Å; P59-L64 HydrophobicContact CG-CG 3.95Å; P59-L64 WeakPolarHBondContact O-CD1 3.5Å; S60-L64 PolarHBondContact O-N 3.14Å; Y61-L64 PolarHBondContact O-N 2.02Å; L64-N67 PolarHBondContact O-N 3.17Å; L64-A68 WeakPolarHBondContact O-CB 3.5Å; L64-A68 PolarHBondContact O-N 3.18Å
65	S	63.1	Low	62.8	Low	32 Å²	32	77.5 Å²	77.5	22%	0.224	42%	0.422	C	S	.	.	H	α-helix	trans	-63.7	-41.3	178.1	74.3	0	0	0	0	112.1	Y61 F62 F69	Y61-S65 WeakPolarHBondContact O-CB 3.42Å; Y61-S65 PolarHBondContact O-N 2.04Å; Y61-S65 PolarHBondContact O-OG 3.05Å; F62-S65 PolarHBondContact O-N 2.68Å; F62-S65 PolarHBondContact O-OG 3.29Å; S65-F69 VanDerWaalsContact O-CB 3.26Å; S65-F69 WeakPolarHBondContact O-CB 3.36Å; S65-F69 PolarHBondContact O-N 3.48Å
66	R	66.2	Low	62.1	Low	109 Å²	109	82.1 Å²	82.1	41%	0.411	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-46.1	176.3	-179	-178.2	172.7	-153	-3	111.6	F62 D63 F69 L70 Q151	F62-R66 WeakPolarHBondContact O-CB 3.3Å; F62-R66 PolarHBondContact O-N 2.94Å; D63-R66 PolarHBondContact O-N 2.95Å; R66-F69 WeakPolarHBondContact O-CB 3.21Å; R66-F69 PolarHBondContact O-N 2.86Å; R66-L70 HydrophobicContact CG-CD1 4.24Å; R66-L70 WeakPolarHBondContact O-CG 3.42Å; R66-L70 PolarHBondContact O-N 3.41Å; R66-Q151 VanDerWaalsContact NH2-NE2 3.18Å
67	N	62.4	Low	61.6	Low	94 Å²	94	83 Å²	83	50%	0.503	43%	0.434	S	S	.	.	H	α-helix	trans	-69.7	-39.8	-178.7	-71	-10.8	0	0	0	112.3	D63 L64 F69 L70 S71	D63-N67 WeakPolarHBondContact O-CB 3.04Å; D63-N67 VanDerWaalsContact O-CG 3.26Å; D63-N67 PolarHBondContact O-N 3.43Å; L64-N67 PolarHBondContact O-N 3.17Å; N67-F69 PolarHBondContact O-N 3.2Å; N67-L70 PolarHBondContact O-N 2.9Å; N67-S71 PolarHBondContact O-N 3.43Å
68	A	66.5	Low	61.1	Low	26 Å²	26	81 Å²	81	22%	0.215	42%	0.419	C	S	.	.	H	α-helix	trans	-59.6	-40.5	172.8	0	0	0	0	0	110.9	L64 S71 L72 F212	L64-A68 WeakPolarHBondContact O-CB 3.5Å; L64-A68 PolarHBondContact O-N 3.18Å; A68-S71 PolarHBondContact O-N 2.97Å; A68-S71 PolarHBondContact O-OG 3.25Å; A68-L72 PolarHBondContact O-N 3.44Å; A68-F212 HydrophobicContact CB-CD2 4.48Å
69	F	60.9	Low	60.5	Low	55 Å²	55	79 Å²	79	24%	0.241	42%	0.416	C	S	.	.	H	α-helix	trans	-69.1	-39.9	175.4	-175	-86.8	0	0	0	113.1	S65 R66 N67 S71 L72 V73 Q152 Y154	S65-F69 VanDerWaalsContact O-CB 3.26Å; S65-F69 WeakPolarHBondContact O-CB 3.36Å; S65-F69 PolarHBondContact O-N 3.48Å; R66-F69 WeakPolarHBondContact O-CB 3.21Å; R66-F69 PolarHBondContact O-N 2.86Å; N67-F69 PolarHBondContact O-N 3.2Å; F69-S71 PolarHBondContact O-N 3.39Å; F69-L72 WeakPolarHBondContact O-CB 3.45Å; F69-L72 PolarHBondContact O-N 2.87Å; F69-V73 HydrophobicContact CD1-CG2 4.24Å; F69-V73 HydrophobicContact CE1-CG2 3.9Å; F69-V73 HydrophobicContact CZ-CG2 4.39Å; F69-V73 WeakPolarHBondContact O-CG2 3.04Å; F69-V73 PolarHBondContact O-N 3.08Å; F69-Q152 WeakPolarHBondContact CE1-O 3.42Å; F69-Q152 WeakPolarHBondContact CZ-O 3.1Å; F69-Y154 AromaticContact CE1-CD2 3.98Å; F69-Y154 HydrophobicContact CE1-CD2 3.98Å; F69-Y154 AromaticContact CE2-CD2 3.8Å; F69-Y154 HydrophobicContact CE2-CD2 3.8Å; F69-Y154 HydrophobicContact CE2-CG 4.29Å; F69-Y154 AromaticContact CZ-CD2 3.16Å; F69-Y154 HydrophobicContact CZ-CD2 3.16Å; F69-Y154 HydrophobicContact CZ-CE2 4.07Å; F69-Y154 AromaticContact CZ-CG 3.79Å; F69-Y154 HydrophobicContact CZ-CG 3.79Å
70	L	60.5	Low	60.1	Low	85 Å²	85	82.7 Å²	82.7	45%	0.445	43%	0.429	S	S	.	.	H	α-helix	trans	-63.1	-33.7	173.5	-70.5	171.8	0	0	0	111.8	R66 N67 L72 V73	R66-L70 HydrophobicContact CG-CD1 4.24Å; R66-L70 WeakPolarHBondContact O-CG 3.42Å; R66-L70 PolarHBondContact O-N 3.41Å; N67-L70 PolarHBondContact O-N 2.9Å; L70-L72 PolarHBondContact O-N 2.93Å; L70-V73 CarbonylContact O-C 3.51Å; L70-V73 PolarHBondContact O-N 3.48Å
71	S	59	Low	59.9	Low	80 Å²	80	87.5 Å²	87.5	56%	0.559	44%	0.438	S	S	*	.	H	α-helix	trans	-68.5	-17.9	174.1	80.9	0	0	0	0	113.9	N67 A68 F69	N67-S71 PolarHBondContact O-N 3.43Å; A68-S71 PolarHBondContact O-N 2.97Å; A68-S71 PolarHBondContact O-OG 3.25Å; F69-S71 PolarHBondContact O-N 3.39Å
72	L	52.2	Low	59.6	Low	73 Å²	73	88.5 Å²	88.5	38%	0.382	45%	0.448	S	S	.	.	H	α-helix	trans	-79.3	-33.1	171.5	-88.3	166.6	0	0	0	113.5	A68 F69 L70 S74 L211	A68-L72 PolarHBondContact O-N 3.44Å; F69-L72 WeakPolarHBondContact O-CB 3.45Å; F69-L72 PolarHBondContact O-N 2.87Å; L70-L72 PolarHBondContact O-N 2.93Å; L72-S74 PolarHBondContact O-N 2.85Å; L72-L211 HydrophobicContact CD1-CD1 4.33Å; L72-L211 HydrophobicContact CD1-CD2 3.53Å; L72-L211 HydrophobicContact CD1-CG 3.8Å; L72-L211 HydrophobicContact CD2-CD1 3.63Å; L72-L211 HydrophobicContact CD2-CD2 2.98Å; L72-L211 HydrophobicContact CD2-CG 3.66Å; L72-L211 HydrophobicContact CG-CD1 3.74Å; L72-L211 HydrophobicContact CG-CD2 3.53Å; L72-L211 HydrophobicContact CG-CG 3.74Å
73	V	54.2	Low	59.2	Low	56 Å²	56	88.5 Å²	88.5	34%	0.339	44%	0.444	S	S	.	.			trans	-97.5	42.5	-178	-164.3	0	0	0	0	108.6	F69 L70 T75 Y154	F69-V73 HydrophobicContact CD1-CG2 4.24Å; F69-V73 HydrophobicContact CE1-CG2 3.9Å; F69-V73 HydrophobicContact CZ-CG2 4.39Å; F69-V73 WeakPolarHBondContact O-CG2 3.04Å; F69-V73 PolarHBondContact O-N 3.08Å; L70-V73 CarbonylContact O-C 3.51Å; L70-V73 PolarHBondContact O-N 3.48Å; V73-T75 PolarHBondContact O-N 3.17Å; V73-T75 VanDerWaalsContact O-N 3.09Å; V73-Y154 HydrophobicContact CG1-CE2 4.37Å; V73-Y154 HydrophobicContact CG2-CD2 4.17Å; V73-Y154 HydrophobicContact CG2-CE2 3.65Å
74	S	47.6	Very low	59.1	Low	42 Å²	42	92.7 Å²	92.7	29%	0.294	46%	0.461	S	S	.	.			trans	-54.9	119.8	161.4	54.3	0	0	0	0	106.3	L72 E78	L72-S74 PolarHBondContact O-N 2.85Å; S74-E78 WeakPolarHBondContact CB-OE2 3.25Å
75	T	50.9	Low	59.3	Low	76 Å²	76	96.7 Å²	96.7	47%	0.466	48%	0.478	S	S	.	.			trans	-46.7	149.8	-173.7	58.3	0	0	0	0	111.6	V73 E77 E78 D79	V73-T75 PolarHBondContact O-N 3.17Å; V73-T75 VanDerWaalsContact O-N 3.09Å; T75-E77 PolarHBondContact O-N 2.97Å; T75-E78 PolarHBondContact O-N 2.03Å; T75-D79 PolarHBondContact O-N 2.78Å
76	D	52.9	Low	58.4	Low	135 Å²	135	101 Å²	101	72%	0.722	49%	0.49	S	S	*	.	H	α-helix	trans	-47.9	-27.6	176.3	-69.9	-48.7	0	0	0	112.4	Q80	D76-Q80 VanDerWaalsContact O-CB 3.27Å; D76-Q80 WeakPolarHBondContact O-CB 3.22Å; D76-Q80 WeakPolarHBondContact O-CG 3.4Å; D76-Q80 PolarHBondContact O-N 3.39Å
77	E	58.6	Low	57.9	Low	150 Å²	150	98.6 Å²	98.6	70%	0.701	49%	0.488	S	S	*	.	H	α-helix	trans	-66.4	-45	174.7	-63	-174.3	141.5	0	0	113.8	T75 D79 Q80 R81	T75-E77 PolarHBondContact O-N 2.97Å; E77-D79 VanDerWaalsContact C-N 3.33Å; E77-Q80 PolarHBondContact O-N 3.17Å; E77-R81 VanDerWaalsContact O-CB 3.28Å; E77-R81 WeakPolarHBondContact O-CB 3.23Å; E77-R81 PolarHBondContact O-N 3.19Å
78	E	58.4	Low	57.8	Low	108 Å²	108	99.1 Å²	99.1	51%	0.505	49%	0.487	S	S	.	.	H	α-helix	trans	-66.3	-39.4	175.7	-80.1	-171.4	128.6	0	0	111.2	S74 T75 R81 M82	S74-E78 WeakPolarHBondContact CB-OE2 3.25Å; T75-E78 PolarHBondContact O-N 2.03Å; E78-R81 PolarHBondContact O-N 3.31Å; E78-M82 WeakPolarHBondContact O-CB 3.14Å; E78-M82 PolarHBondContact O-N 3.4Å
79	D	52.1	Low	57.1	Low	47 Å²	47	102.3 Å²	102.3	25%	0.251	51%	0.509	S	S	.	.	H	α-helix	trans	-67.1	-40.9	178.6	-141.1	51.1	0	0	0	110.6	T75 E77 R83	T75-D79 PolarHBondContact O-N 2.78Å; E77-D79 VanDerWaalsContact C-N 3.33Å; D79-R83 VanDerWaalsContact O-CB 3.24Å; D79-R83 WeakPolarHBondContact O-CB 3.36Å; D79-R83 PolarHBondContact O-N 2.95Å; D79-R83 IonicContact OD2-CZ 3.84Å; D79-R83 IonicContact OD2-NH2 3.97Å; D79-R83 PolarHBondContact OD2-NH2 2.83Å
80	Q	57.7	Low	56.9	Low	114 Å²	114	106.1 Å²	106.1	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-44.7	170.4	-79.9	-179.9	17.3	0	0	112.1	D76 E77 R83 Q84	D76-Q80 VanDerWaalsContact O-CB 3.27Å; D76-Q80 WeakPolarHBondContact O-CB 3.22Å; D76-Q80 WeakPolarHBondContact O-CG 3.4Å; D76-Q80 PolarHBondContact O-N 3.39Å; E77-Q80 PolarHBondContact O-N 3.17Å; Q80-R83 CarbonylContact O-C 3.51Å; Q80-R83 WeakPolarHBondContact O-CB 3.17Å; Q80-R83 PolarHBondContact O-N 3.48Å; Q80-R83 VanDerWaalsContact O-N 3.15Å; Q80-Q84 VanDerWaalsContact O-CG 3.31Å; Q80-Q84 WeakPolarHBondContact O-CG 3.24Å; Q80-Q84 PolarHBondContact O-N 2.62Å
81	R	68	Low	56.5	Low	168 Å²	168	108.2 Å²	108.2	63%	0.634	52%	0.523	S	S	*	.	H	α-helix	trans	-64	-42.1	179.4	-170	173	160.3	-93.1	-5	111.6	E77 E78 R83 Q84 Q85	E77-R81 VanDerWaalsContact O-CB 3.28Å; E77-R81 WeakPolarHBondContact O-CB 3.23Å; E77-R81 PolarHBondContact O-N 3.19Å; E78-R81 PolarHBondContact O-N 3.31Å; R81-R83 VanDerWaalsContact C-N 3.34Å; R81-R83 PolarHBondContact O-N 3.41Å; R81-Q84 PolarHBondContact O-N 2.97Å; R81-Q85 PolarHBondContact O-N 3.25Å
82	M	62.3	Low	56.5	Low	137 Å²	137	113.4 Å²	113.4	68%	0.675	53%	0.53	S	S	*	.	H	α-helix	trans	-61.5	-40.3	171.2	-86.1	-112.1	-78.3	0	0	112.5	E78 Q85 W86	E78-M82 WeakPolarHBondContact O-CB 3.14Å; E78-M82 PolarHBondContact O-N 3.4Å; M82-Q85 PolarHBondContact O-N 3.02Å; M82-W86 PolarHBondContact O-N 2.78Å
83	R	56.2	Low	56.8	Low	142 Å²	142	117.4 Å²	117.4	54%	0.536	55%	0.545	S	S	.	.	H	α-helix	trans	-70.2	-31.4	179.2	-150.5	175.2	-63.8	-121.8	3.2	112.4	D79 Q80 R81 W86	D79-R83 VanDerWaalsContact O-CB 3.24Å; D79-R83 WeakPolarHBondContact O-CB 3.36Å; D79-R83 PolarHBondContact O-N 2.95Å; D79-R83 IonicContact OD2-CZ 3.84Å; D79-R83 IonicContact OD2-NH2 3.97Å; D79-R83 PolarHBondContact OD2-NH2 2.83Å; Q80-R83 CarbonylContact O-C 3.51Å; Q80-R83 WeakPolarHBondContact O-CB 3.17Å; Q80-R83 PolarHBondContact O-N 3.48Å; Q80-R83 VanDerWaalsContact O-N 3.15Å; R81-R83 VanDerWaalsContact C-N 3.34Å; R81-R83 PolarHBondContact O-N 3.41Å; R83-W86 WeakPolarHBondContact O-CB 3.35Å; R83-W86 PolarHBondContact O-N 3.04Å
84	Q	64.2	Low	56.8	Low	149 Å²	149	118.8 Å²	118.8	70%	0.696	55%	0.55	S	S	*	*	H	α-helix	trans	-73.7	-35.8	172.3	-71.9	177.2	18.1	0	0	112.2	Q80 R81 W86	Q80-Q84 VanDerWaalsContact O-CG 3.31Å; Q80-Q84 WeakPolarHBondContact O-CG 3.24Å; Q80-Q84 PolarHBondContact O-N 2.62Å; R81-Q84 PolarHBondContact O-N 2.97Å; Q84-W86 PolarHBondContact O-N 3.29Å
85	Q	71.5	Confident	57.3	Low	153 Å²	153	118.5 Å²	118.5	72%	0.715	55%	0.554	S	S	*	*	H	α-helix	trans	-69.9	-14.9	173.9	-158.6	92.7	36.5	0	0	112.5	R81 M82	R81-Q85 PolarHBondContact O-N 3.25Å; M82-Q85 PolarHBondContact O-N 3.02Å
86	W	44.7	Very low	57.7	Low	123 Å²	123	121.3 Å²	121.3	47%	0.466	56%	0.562	S	S	.	*	S	Bend	trans	-71.9	129.3	-175.7	-142.4	68.3	0	0	0	111.4	M82 R83 Q84 E88 R90	M82-W86 PolarHBondContact O-N 2.78Å; R83-W86 WeakPolarHBondContact O-CB 3.35Å; R83-W86 PolarHBondContact O-N 3.04Å; Q84-W86 PolarHBondContact O-N 3.29Å; W86-E88 PolarHBondContact O-N 3.47Å; W86-R90 HydrophobicContact CE3-CB 3.94Å; W86-R90 HydrophobicContact CH2-CB 3.81Å; W86-R90 HydrophobicContact CH2-CG 4.35Å; W86-R90 HydrophobicContact CZ3-CB 3.35Å; W86-R90 HydrophobicContact CZ3-CG 4.33Å
87	P	54.9	Low	57.7	Low	57 Å²	57	123.8 Å²	123.8	37%	0.37	56%	0.561	S	S	.	*			trans	-59.4	123.5	-170.5	-25.4	33.5	0	0	0	113.6	S89 R90	P87-S89 PolarHBondContact O-N 3.42Å; P87-R90 PolarHBondContact O-N 2.96Å
88	E	60.5	Low	57.7	Low	105 Å²	105	121 Å²	121	49%	0.491	55%	0.551	S	S	.	*	H	α-helix	trans	-51.5	-32	-177.3	-164.9	62.1	-145	0	0	113.4	W86 R90 R91 R92	W86-E88 PolarHBondContact O-N 3.47Å; E88-R90 PolarHBondContact O-N 3.47Å; E88-R91 WeakPolarHBondContact O-CB 3.5Å; E88-R91 PolarHBondContact O-N 3.46Å; E88-R91 IonicContact OE2-NH1 2.81Å; E88-R92 PolarHBondContact O-N 3.4Å
89	S	52	Low	57.5	Low	94 Å²	94	124.8 Å²	124.8	66%	0.657	56%	0.561	S	S	*	*	H	α-helix	trans	-61.2	-27.4	178	36.1	0	0	0	0	113.6	P87	P87-S89 PolarHBondContact O-N 3.42Å
90	R	56.4	Low	57.7	Low	135 Å²	135	129.5 Å²	129.5	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-82.7	-28.6	172	-77.2	-170.7	-89.4	-152.6	-7.5	113.1	W86 P87 E88 K93 N94	W86-R90 HydrophobicContact CE3-CB 3.94Å; W86-R90 HydrophobicContact CH2-CB 3.81Å; W86-R90 HydrophobicContact CH2-CG 4.35Å; W86-R90 HydrophobicContact CZ3-CB 3.35Å; W86-R90 HydrophobicContact CZ3-CG 4.33Å; P87-R90 PolarHBondContact O-N 2.96Å; E88-R90 PolarHBondContact O-N 3.47Å; R90-K93 PolarHBondContact O-N 3.48Å; R90-N94 PolarHBondContact O-N 3Å
91	R	52.9	Low	57.5	Low	129 Å²	129	134.1 Å²	134.1	49%	0.487	59%	0.593	S	S	.	*	H	α-helix	trans	-64.4	-43.6	179.1	-146.1	178	-158.3	161.9	4.1	111.5	E88 K93 N94 G95	E88-R91 WeakPolarHBondContact O-CB 3.5Å; E88-R91 PolarHBondContact O-N 3.46Å; E88-R91 IonicContact OE2-NH1 2.81Å; R91-K93 VanDerWaalsContact C-N 3.33Å; R91-K93 PolarHBondContact O-N 3.46Å; R91-N94 PolarHBondContact O-N 3.42Å; R91-G95 PolarHBondContact O-N 3.23Å; R91-G95 VanDerWaalsContact O-N 3.12Å
92	R	57.7	Low	57	Low	188 Å²	188	133.5 Å²	133.5	71%	0.709	60%	0.598	S	S	*	*	H	α-helix	trans	-59.6	-40.7	175.8	-69.5	-175.6	177.5	-179	-1.2	112.7	E88 G95 Q96	E88-R92 PolarHBondContact O-N 3.4Å; R92-G95 PolarHBondContact O-N 3.49Å; R92-Q96 PolarHBondContact O-N 3.15Å
93	K	58.7	Low	56.7	Low	157 Å²	157	133.5 Å²	133.5	68%	0.683	60%	0.601	S	S	*	*	H	α-helix	trans	-68.4	-38.2	-177.8	-151.4	172.7	-173.1	174.6	0	112.6	R90 R91 R97	R90-K93 PolarHBondContact O-N 3.48Å; R91-K93 VanDerWaalsContact C-N 3.33Å; R91-K93 PolarHBondContact O-N 3.46Å; K93-R97 PolarHBondContact O-N 2.79Å
94	N	54	Low	56.6	Low	86 Å²	86	128.3 Å²	128.3	46%	0.46	59%	0.591	S	S	.	*	H	α-helix	trans	-71.1	-40.6	175.2	-78.5	-3.9	0	0	0	112.3	R90 R91 Q96 R97 D98	R90-N94 PolarHBondContact O-N 3Å; R91-N94 PolarHBondContact O-N 3.42Å; N94-Q96 VanDerWaalsContact C-N 3.29Å; N94-Q96 PolarHBondContact O-N 3.03Å; N94-R97 WeakPolarHBondContact O-CB 3.06Å; N94-R97 PolarHBondContact O-N 2.99Å; N94-D98 PolarHBondContact O-N 3.49Å
95	G	57.7	Low	55.8	Low	35 Å²	35	127.4 Å²	127.4	36%	0.361	60%	0.598	S	S	.	*	H	α-helix	trans	-59.6	-37	176.5	0	0	0	0	0	113.4	R91 R92 R99	R91-G95 PolarHBondContact O-N 3.23Å; R91-G95 VanDerWaalsContact O-N 3.12Å; R92-G95 PolarHBondContact O-N 3.49Å; G95-R99 WeakPolarHBondContact O-CG 3.34Å; G95-R99 PolarHBondContact O-N 3.07Å
96	Q	61.3	Low	55	Low	136 Å²	136	129.8 Å²	129.8	64%	0.636	61%	0.606	S	S	*	*	H	α-helix	trans	-65.9	-39.8	172.2	-78.4	-178.5	-48.3	0	0	112.6	R92 N94 R99 Q100	R92-Q96 PolarHBondContact O-N 3.15Å; N94-Q96 VanDerWaalsContact C-N 3.29Å; N94-Q96 PolarHBondContact O-N 3.03Å; Q96-R99 PolarHBondContact O-N 2.91Å; Q96-Q100 PolarHBondContact O-N 3.18Å
97	R	52.7	Low	55.2	Low	186 Å²	186	135.5 Å²	135.5	70%	0.702	63%	0.628	S	S	*	*	H	α-helix	trans	-68.1	-38.7	-178.5	-145.1	178.7	-168.9	-168.8	2.4	112.2	K93 N94 Q100 R101	K93-R97 PolarHBondContact O-N 2.79Å; N94-R97 WeakPolarHBondContact O-CB 3.06Å; N94-R97 PolarHBondContact O-N 2.99Å; R97-Q100 PolarHBondContact O-N 3.28Å; R97-R101 PolarHBondContact O-N 3.34Å
98	D	58.3	Low	54.6	Low	93 Å²	93	143.1 Å²	143.1	50%	0.497	66%	0.655	S	S	.	*	H	α-helix	trans	-69.7	-39.5	176.6	-77	-26.1	0	0	0	112.3	N94 Q100 R101 Q102	N94-D98 PolarHBondContact O-N 3.49Å; D98-Q100 VanDerWaalsContact C-N 3.33Å; D98-Q100 PolarHBondContact O-N 2.95Å; D98-R101 PolarHBondContact O-N 2.78Å; D98-R101 VanDerWaalsContact O-N 3.14Å; D98-Q102 WeakPolarHBondContact O-CG 3.38Å; D98-Q102 PolarHBondContact O-N 3.49Å
99	R	54	Low	53.7	Low	187 Å²	187	140.9 Å²	140.9	71%	0.706	66%	0.66	S	S	*	*	H	α-helix	trans	-61	-40.7	172.4	-73.8	-179.1	-176.1	-177.7	1.6	111.9	G95 Q96 R101 Q102 N103	G95-R99 WeakPolarHBondContact O-CG 3.34Å; G95-R99 PolarHBondContact O-N 3.07Å; Q96-R99 PolarHBondContact O-N 2.91Å; R99-R101 VanDerWaalsContact C-N 3.33Å; R99-R101 PolarHBondContact O-N 3.39Å; R99-Q102 PolarHBondContact O-N 3.35Å; R99-N103 WeakPolarHBondContact O-CB 2.99Å; R99-N103 PolarHBondContact O-N 3.3Å; R99-N103 VanDerWaalsContact O-N 3.16Å; R99-N103 PolarHBondContact O-ND2 3.09Å
100	Q	56.4	Low	53.2	Low	145 Å²	145	144.5 Å²	144.5	68%	0.678	67%	0.672	S	S	*	*	H	α-helix	trans	-65.1	-35.2	174.1	-81.9	-177.8	-29.1	0	0	112.8	Q96 R97 D98 N103 G104	Q96-Q100 PolarHBondContact O-N 3.18Å; R97-Q100 PolarHBondContact O-N 3.28Å; D98-Q100 VanDerWaalsContact C-N 3.33Å; D98-Q100 PolarHBondContact O-N 2.95Å; Q100-N103 PolarHBondContact O-N 3.02Å; Q100-G104 PolarHBondContact O-N 3.29Å
101	R	52.9	Low	52.7	Low	211 Å²	211	148.4 Å²	148.4	80%	0.796	69%	0.687	S	S	*	*	H	α-helix	trans	-71.3	-33.3	180	-151.8	178.7	-170	-165.6	2.2	112.4	R97 D98 R99	R97-R101 PolarHBondContact O-N 3.34Å; D98-R101 PolarHBondContact O-N 2.78Å; D98-R101 VanDerWaalsContact O-N 3.14Å; R99-R101 VanDerWaalsContact C-N 3.33Å; R99-R101 PolarHBondContact O-N 3.39Å
102	Q	57.1	Low	52.1	Low	156 Å²	156	151.6 Å²	151.6	73%	0.729	70%	0.704	S	S	*	*	H	α-helix	trans	-72.8	-33.1	174.3	-68.3	179.9	13.8	0	0	112.4	D98 R99	D98-Q102 WeakPolarHBondContact O-CG 3.38Å; D98-Q102 PolarHBondContact O-N 3.49Å; R99-Q102 PolarHBondContact O-N 3.35Å
103	N	57.3	Low	51.2	Low	137 Å²	137	152.3 Å²	152.3	73%	0.733	71%	0.712	S	S	*	*	H	α-helix	trans	-92	-1	-179.9	-65.4	-22.2	0	0	0	114	R99 Q100	R99-N103 WeakPolarHBondContact O-CB 2.99Å; R99-N103 PolarHBondContact O-N 3.3Å; R99-N103 VanDerWaalsContact O-N 3.16Å; R99-N103 PolarHBondContact O-ND2 3.09Å; Q100-N103 PolarHBondContact O-N 3.02Å
104	G	53.2	Low	50.1	Low	32 Å²	32	152.3 Å²	152.3	33%	0.33	72%	0.715	S	S	.	*	S	Bend	trans	-71.9	148.8	180	0	0	0	0	0	112.8	Q100 K106	Q100-G104 PolarHBondContact O-N 3.29Å; G104-K106 PolarHBondContact O-N 2.65Å; G104-K106 VanDerWaalsContact O-N 3.16Å
105	P	48.5	Very low	49.3	Very low	130 Å²	130	157.1 Å²	157.1	84%	0.844	73%	0.731	S	S	*	*			trans	-56.9	121.2	-179.2	-21.9	30.8	0	0	0	111.8	R107	P105-R107 PolarHBondContact O-N 3.17Å
106	K	54.2	Low	48.2	Very low	203 Å²	203	163.9 Å²	163.9	88%	0.883	75%	0.754	S	S	*	*			trans	-63	103.6	175.3	-72.7	-179	179	175.2	0	109.1	G104 K108	G104-K106 PolarHBondContact O-N 2.65Å; G104-K106 VanDerWaalsContact O-N 3.16Å; K106-K108 PolarHBondContact O-N 2.85Å; K106-K108 VanDerWaalsContact O-N 3.11Å
107	R	47.9	Very low	46.7	Very low	244 Å²	244	167.1 Å²	167.1	92%	0.921	77%	0.766	S	S	*	*			trans	-57.8	115.1	170.6	-77.5	-177.3	170.3	-179.9	-3.6	108.9	P105 G109	P105-R107 PolarHBondContact O-N 3.17Å; R107-G109 PolarHBondContact O-N 2.93Å
108	K	43.9	Very low	45.9	Very low	217 Å²	217	169.1 Å²	169.1	94%	0.943	77%	0.773	S	S	*	*			trans	-68.9	74.8	167.2	-78.6	-176.7	175.7	178.5	0	109	K106	K106-K108 PolarHBondContact O-N 2.85Å; K106-K108 VanDerWaalsContact O-N 3.11Å
109	G	41.2	Very low	44.8	Very low	58 Å²	58	170.7 Å²	170.7	60%	0.598	79%	0.789	S	S	*	*			trans	-91.5	125.6	170.7	0	0	0	0	0	109.8	R107 R111	R107-G109 PolarHBondContact O-N 2.93Å; G109-R111 PolarHBondContact O-N 3.36Å
110	N	41.9	Very low	43.6	Very low	170 Å²	170	165.2 Å²	165.2	91%	0.909	79%	0.79	S	S	*	*			trans	-54.9	95.8	174.6	-82.6	-9.8	0	0	0	110.8	K112	N110-K112 PolarHBondContact O-N 3.43Å
111	R	45.3	Very low	42.4	Very low	216 Å²	216	162.8 Å²	162.8	82%	0.815	80%	0.795	S	S	*	*			trans	-78.1	89.4	175.9	-155.4	174	-175.8	180	-0.1	108	G109 K113	G109-R111 PolarHBondContact O-N 3.36Å; R111-K113 PolarHBondContact O-N 2.79Å; R111-K113 VanDerWaalsContact O-N 3.14Å
112	K	39.1	Very low	41.5	Very low	196 Å²	196	160.5 Å²	160.5	85%	0.852	80%	0.799	S	S	*	*			trans	-47.9	120.7	160.6	-102	179	174.8	176.9	0	107.5	N110 Q114	N110-K112 PolarHBondContact O-N 3.43Å; K112-Q114 PolarHBondContact O-N 2.93Å
113	K	38.5	Very low	40	Very low	203 Å²	203	161.4 Å²	161.4	88%	0.883	80%	0.803	S	S	*	*			trans	-43.8	97.2	179.6	-123	172	178.9	175.4	0	110.6	R111 K115	R111-K113 PolarHBondContact O-N 2.79Å; R111-K113 VanDerWaalsContact O-N 3.14Å; K113-K115 PolarHBondContact O-N 2.8Å
114	Q	37.6	Very low	38.8	Very low	157 Å²	157	163.3 Å²	163.3	73%	0.734	81%	0.812	S	S	*	*			trans	-74.2	109.1	158.1	-78.5	-179.1	-22.4	0	0	105.7	K112 H116	K112-Q114 PolarHBondContact O-N 2.93Å; Q114-H116 PolarHBondContact O-N 2.89Å; Q114-H116 VanDerWaalsContact O-N 3.16Å
115	K	35.7	Very low	37.5	Very low	187 Å²	187	165.4 Å²	165.4	81%	0.813	83%	0.833	S	S	*	*			trans	-60.4	116	176.2	-73.4	178.8	178	179.3	0	107.9	K113 F117	K113-K115 PolarHBondContact O-N 2.8Å; K115-F117 PolarHBondContact O-N 2.89Å; K115-F117 VanDerWaalsContact O-N 3.12Å
116	H	34.9	Very low	36.4	Very low	178 Å²	178	167.2 Å²	167.2	82%	0.824	84%	0.836	S	S	*	*			trans	-62.9	109.1	167.6	-70.3	-88.3	0	0	0	108.1	Q114 R118	Q114-H116 PolarHBondContact O-N 2.89Å; Q114-H116 VanDerWaalsContact O-N 3.16Å; H116-R118 PolarHBondContact O-N 2.83Å
117	F	31.1	Very low	35	Very low	204 Å²	204	165.8 Å²	165.8	90%	0.895	83%	0.832	S	S	*	*			trans	-67.2	110.5	161.2	-107.6	-99.2	0	0	0	106.7	K115 P119	K115-F117 PolarHBondContact O-N 2.89Å; K115-F117 VanDerWaalsContact O-N 3.12Å; F117-P119 WeakPolarHBondContact O-CD 3.49Å
118	R	34	Very low	34.1	Very low	228 Å²	228	159.1 Å²	159.1	86%	0.86	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-71.4	121.5	170.7	-81.7	179.4	162.7	171.1	-6.6	107.7	H116 G120	H116-R118 PolarHBondContact O-N 2.83Å; R118-G120 PolarHBondContact O-N 3.48Å
119	P	36.3	Very low	33.2	Very low	126 Å²	126	156.4 Å²	156.4	82%	0.818	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-67.3	123.5	169.1	25.9	-28.8	0	0	0	108.4	F117 A121	F117-P119 WeakPolarHBondContact O-CD 3.49Å; P119-A121 PolarHBondContact O-N 3.17Å
120	G	29.1	Very low	32.3	Very low	72 Å²	72	158.7 Å²	158.7	74%	0.742	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-62.4	124.9	176.6	0	0	0	0	0	110.2	R118 N122	R118-G120 PolarHBondContact O-N 3.48Å; G120-N122 PolarHBondContact O-N 3.23Å
121	A	30.6	Very low	31.4	Very low	94 Å²	94	156.6 Å²	156.6	78%	0.777	82%	0.821	S	S	*	*			trans	-66.3	107.6	164.9	0	0	0	0	0	107.8	P119 E123	P119-A121 PolarHBondContact O-N 3.17Å; A121-E123 PolarHBondContact O-N 3.41Å
122	N	33.4	Very low	30.4	Very low	162 Å²	162	151.3 Å²	151.3	87%	0.866	82%	0.818	S	S	*	*			trans	-86.2	98.8	157.5	-76.5	-6.4	0	0	0	106.2	G120	G120-N122 PolarHBondContact O-N 3.23Å
123	E	25.7	Very low	29.5	Very low	175 Å²	175	147.5 Å²	147.5	82%	0.818	82%	0.815	S	S	*	*			trans	-51.6	136.7	162.4	-57.4	-163.8	127.4	0	0	110.2	A121	A121-E123 PolarHBondContact O-N 3.41Å
124	L	32.3	Very low	28.8	Very low	178 Å²	178	143 Å²	143	93%	0.932	81%	0.809	S	S	*	*			trans	-161.8	92.7	154.4	-104.7	149.2	0	0	0	109
125	G	26.5	Very low	28.1	Very low	75 Å²	75	140.1 Å²	140.1	77%	0.773	81%	0.807	S	S	*	*			trans	81.1	77.7	134.7	0	0	0	0	0	117.6
126	D	25.6	Very low	27.6	Very low	169 Å²	169	136.1 Å²	136.1	90%	0.904	80%	0.802	S	S	*	*			trans	-74.9	120.3	146.5	-70.6	-60.2	0	0	0	108.5
127	E	24.9	Very low	27.5	Very low	172 Å²	172	136.8 Å²	136.8	80%	0.804	81%	0.806	S	S	*	*			trans	-135	120.3	152.2	-122.1	-64.6	108.1	0	0	107.6
128	P	29.7	Very low	27.3	Very low	104 Å²	104	130.9 Å²	130.9	68%	0.675	80%	0.803	S	S	*	*			trans	-97.6	120.2	-166.3	33	-21.7	0	0	0	110.3
129	L	24.7	Very low	27.5	Very low	161 Å²	161	129 Å²	129	84%	0.843	80%	0.8	S	S	*	*			trans	-118.2	121.4	169.7	-152.1	71.2	0	0	0	112.4
130	S	22	Very low	27.3	Very low	106 Å²	106	128.9 Å²	128.9	74%	0.741	80%	0.803	S	S	*	*			trans	77.4	102.7	153.2	69	0	0	0	0	118.4
131	S	22.1	Very low	28	Very low	126 Å²	126	132.9 Å²	132.9	88%	0.881	81%	0.806	S	S	*	*			trans	-113.8	104	141.3	54.2	0	0	0	0	107.6
132	S	24.9	Very low	28.7	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	81%	0.808	S	S	*	*			trans	-148.6	103.2	154.4	48.1	0	0	0	0	109
133	S	20.1	Very low	29	Very low	115 Å²	115	134 Å²	134	80%	0.804	81%	0.806	S	S	*	*			trans	-16.3	126.8	147.5	50.4	0	0	0	0	115.7
134	S	23.3	Very low	29.6	Very low	108 Å²	108	136.9 Å²	136.9	76%	0.755	81%	0.809	S	S	*	*				-169.2	126.9	124.3	41.3	0	0	0	0	112.3
135	S	22.8	Very low	29.9	Very low	98 Å²	98	133.9 Å²	133.9	69%	0.685	80%	0.8	S	S	*	*			trans	56	116.4	138.5	73.5	0	0	0	0	120.4
136	S	25.7	Very low	30.3	Very low	102 Å²	102	139.8 Å²	139.8	71%	0.713	80%	0.804	S	S	*	*				65.5	105.4	118	-45	0	0	0	0	118.1
137	Q	33.4	Very low	31	Very low	193 Å²	193	136.9 Å²	136.9	90%	0.902	80%	0.795	S	S	*	*				171.2	125.9	112.5	-90.2	167.3	12.7	0	0	109.8	K139	Q137-K139 PolarHBondContact O-N 2.82Å
138	G	26.3	Very low	32	Very low	80 Å²	80	134.1 Å²	134.1	83%	0.825	79%	0.792	S	S	*	*			trans	-63.3	132	-179	0	0	0	0	0	112.4
139	K	37.5	Very low	33	Very low	187 Å²	187	134.8 Å²	134.8	81%	0.813	80%	0.796	S	S	*	*			trans	-133.5	111.8	153.3	-74.6	-176.6	179.2	171.8	0	108	Q137 L141	Q137-K139 PolarHBondContact O-N 2.82Å; K139-L141 PolarHBondContact O-N 3.43Å
140	S	33.5	Very low	34.4	Very low	124 Å²	124	135.4 Å²	135.4	87%	0.867	80%	0.795	S	S	*	*			trans	-51	112.1	166.7	178.8	0	0	0	0	109.1
141	L	43.9	Very low	35.8	Very low	156 Å²	156	136.8 Å²	136.8	82%	0.817	79%	0.789	S	S	*	*			trans	-121.2	119.3	172.7	-71.7	172.4	0	0	0	107.5	K139	K139-L141 PolarHBondContact O-N 3.43Å
142	L	44.9	Very low	37.4	Very low	155 Å²	155	136 Å²	136	81%	0.812	77%	0.772	S	S	*	*			trans	-45.4	148.4	179.7	-62.5	165.1	0	0	0	112.1	R144	L142-R144 PolarHBondContact O-N 2.84Å
143	P	39.6	Very low	39	Very low	126 Å²	126	136.8 Å²	136.8	82%	0.818	77%	0.773	S	S	*	*			trans	-56	112.3	-178.4	-22.3	32.2	0	0	0	110.9
144	R	37.3	Very low	41.1	Very low	234 Å²	234	137.1 Å²	137.1	88%	0.883	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-61.9	130.6	172.7	-150.4	173.5	-167.8	-130.3	3.6	107.5	L142 K146	L142-R144 PolarHBondContact O-N 2.84Å; R144-K146 PolarHBondContact O-N 2.97Å
145	P	39.5	Very low	43.3	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-54.2	125.7	178	-22	30.7	0	0	0	109.3	P147	P145-P147 VanDerWaalsContact O-N 3.16Å
146	K	35.4	Very low	45.4	Very low	199 Å²	199	137.7 Å²	137.7	87%	0.865	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-53.6	123.8	176.6	-83.9	179.9	-172.1	172.8	0	107.8	R144	R144-K146 PolarHBondContact O-N 2.97Å
147	P	40.2	Very low	47.6	Very low	108 Å²	108	134.2 Å²	134.2	70%	0.701	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-57.3	142.3	171.9	23.5	-30.6	0	0	0	108.1	P145	P145-P147 VanDerWaalsContact O-N 3.16Å
148	P	45.3	Very low	49.6	Very low	114 Å²	114	127.5 Å²	127.5	74%	0.74	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-54.2	142	179.3	22.5	-31.7	0	0	0	109	Q150	P148-Q150 PolarHBondContact O-N 3.27Å
149	P	51.4	Low	51.9	Low	119 Å²	119	134.4 Å²	134.4	77%	0.773	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-50.8	127.6	-171.1	18.5	-30.3	0	0	0	110	Q151	P149-Q151 PolarHBondContact O-N 3.21Å
150	Q	53.2	Low	53.7	Low	173 Å²	173	132.9 Å²	132.9	81%	0.808	71%	0.705	S	S	*	*			trans	-47.2	114.7	-177.6	-67.6	174.7	-8.3	0	0	108.6	P148 Q152	P148-Q150 PolarHBondContact O-N 3.27Å; Q150-Q152 VanDerWaalsContact C-N 3.28Å; Q150-Q152 PolarHBondContact O-N 2.91Å
151	Q	52.3	Low	55.4	Low	135 Å²	135	134.2 Å²	134.2	63%	0.631	70%	0.7	S	S	*	*			trans	-65.2	89.7	-179.4	-72.1	172.8	-6.1	0	0	108.6	R66 P149 T153	R66-Q151 VanDerWaalsContact NH2-NE2 3.18Å; P149-Q151 PolarHBondContact O-N 3.21Å; Q151-T153 PolarHBondContact O-N 2.91Å
152	Q	54	Low	57.1	Low	109 Å²	109	129.5 Å²	129.5	51%	0.509	68%	0.675	S	S	.	*			trans	-67.7	104.2	175	-71.2	-175.2	13	0	0	107.6	F69 Q150 Y154	F69-Q152 WeakPolarHBondContact CE1-O 3.42Å; F69-Q152 WeakPolarHBondContact CZ-O 3.1Å; Q150-Q152 VanDerWaalsContact C-N 3.28Å; Q150-Q152 PolarHBondContact O-N 2.91Å; Q152-Y154 HydrophobicContact CB-CE1 4.27Å; Q152-Y154 HydrophobicContact CB-CE2 4.24Å; Q152-Y154 PolarHBondContact OE1-OH 3.47Å
153	T	60.3	Low	58.7	Low	123 Å²	123	124.3 Å²	124.3	76%	0.755	66%	0.658	S	S	*	*			trans	-82.3	116	174.5	-55.8	0	0	0	0	107.2	Q151	Q151-T153 PolarHBondContact O-N 2.91Å
154	Y	62.6	Low	61	Low	121 Å²	121	124.8 Å²	124.8	48%	0.475	66%	0.658	S	S	.	*			trans	-98.6	132.2	177.9	-60	-66.1	0	0	0	110	F69 V73 Q152 V156	F69-Y154 AromaticContact CE1-CD2 3.98Å; F69-Y154 HydrophobicContact CE1-CD2 3.98Å; F69-Y154 AromaticContact CE2-CD2 3.8Å; F69-Y154 HydrophobicContact CE2-CD2 3.8Å; F69-Y154 HydrophobicContact CE2-CG 4.29Å; F69-Y154 AromaticContact CZ-CD2 3.16Å; F69-Y154 HydrophobicContact CZ-CD2 3.16Å; F69-Y154 HydrophobicContact CZ-CE2 4.07Å; F69-Y154 AromaticContact CZ-CG 3.79Å; F69-Y154 HydrophobicContact CZ-CG 3.79Å; V73-Y154 HydrophobicContact CG1-CE2 4.37Å; V73-Y154 HydrophobicContact CG2-CD2 4.17Å; V73-Y154 HydrophobicContact CG2-CE2 3.65Å; Q152-Y154 HydrophobicContact CB-CE1 4.27Å; Q152-Y154 HydrophobicContact CB-CE2 4.24Å; Q152-Y154 PolarHBondContact OE1-OH 3.47Å; Y154-V156 PolarHBondContact O-N 2.91Å
155	V	69.8	Low	63.5	Low	121 Å²	121	117.8 Å²	117.8	73%	0.733	64%	0.636	S	S	*	*			trans	-82.6	107.9	176.7	179.4	0	0	0	0	108.3	A157	V155-A157 VanDerWaalsContact C-N 3.33Å; V155-A157 WeakPolarHBondContact CG1-O 3.48Å
156	V	67.5	Low	66.1	Low	98 Å²	98	115 Å²	115	59%	0.594	61%	0.613	S	S	*	*	S	Bend	trans	-65.8	-37	-179.1	177.1	0	0	0	0	111.8	Y154 I200	Y154-V156 PolarHBondContact O-N 2.91Å; V156-I200 HydrophobicContact CG1-CD1 3.81Å; V156-I200 HydrophobicContact CG1-CG1 4.37Å; V156-I200 HydrophobicContact CG2-CD1 3.96Å
157	A	72.6	Confident	69	Low	29 Å²	29	106.9 Å²	106.9	24%	0.24	58%	0.581	C	S	.	*	S	Bend	trans	-150.7	151.4	176.6	0	0	0	0	0	110.3	V155 I162	V155-A157 VanDerWaalsContact C-N 3.33Å; V155-A157 WeakPolarHBondContact CG1-O 3.48Å; A157-I162 HydrophobicContact CB-CD1 4.13Å; A157-I162 HydrophobicContact CB-CG1 4.08Å
158	S	74.3	Confident	71.7	Confident	52 Å²	52	109.5 Å²	109.5	36%	0.364	58%	0.577	S	S	.	*			trans	-64.5	150.4	172	60.1	0	0	0	0	110.5	D160 M161 I162	S158-D160 PolarHBondContact O-N 2.95Å; S158-D160 VanDerWaalsContact O-N 3.13Å; S158-M161 PolarHBondContact O-N 3.42Å; S158-M161 VanDerWaalsContact O-N 3.08Å; S158-I162 PolarHBondContact O-N 2.98Å
159	R	73.7	Confident	74.2	Confident	225 Å²	225	106.5 Å²	106.5	85%	0.849	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-28.3	179.5	-169.3	174.3	176.6	151.6	-0.8	112.6	M161 I162	R159-M161 VanDerWaalsContact C-N 3.34Å; R159-I162 PolarHBondContact O-N 3.34Å; R159-I162 VanDerWaalsContact O-O 3.05Å
160	D	75.4	Confident	76.3	Confident	154 Å²	154	104 Å²	104	82%	0.824	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-23.6	-178.8	-48.6	-36.3	0	0	0	113.2	S158	S158-D160 PolarHBondContact O-N 2.95Å; S158-D160 VanDerWaalsContact O-N 3.13Å
161	M	70.3	Confident	78.4	Confident	153 Å²	153	99.9 Å²	99.9	75%	0.754	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-16	176.3	-68.2	-146.6	-75.5	0	0	112.8	S158 R159	S158-M161 PolarHBondContact O-N 3.42Å; S158-M161 VanDerWaalsContact O-N 3.08Å; R159-M161 VanDerWaalsContact C-N 3.34Å
162	I	80.1	Confident	80.6	Confident	57 Å²	57	96.8 Å²	96.8	29%	0.292	51%	0.509	S	S	.	.	S	Bend	trans	-92.1	114.1	175.8	-60.6	174.1	0	0	0	107.5	A157 S158 R159 N196 F198	A157-I162 HydrophobicContact CB-CD1 4.13Å; A157-I162 HydrophobicContact CB-CG1 4.08Å; S158-I162 PolarHBondContact O-N 2.98Å; R159-I162 PolarHBondContact O-N 3.34Å; R159-I162 VanDerWaalsContact O-O 3.05Å; I162-N196 WeakPolarHBondContact CG2-ND2 3.05Å; I162-F198 HydrophobicContact CD1-CE1 4.06Å; I162-F198 HydrophobicContact CD1-CZ 3.94Å; I162-F198 HydrophobicContact CG1-CE1 4.08Å; I162-F198 HydrophobicContact CG1-CZ 4.18Å; I162-F198 HydrophobicContact CG2-CZ 4.1Å
163	G	78.6	Confident	82.6	Confident	45 Å²	45	100 Å²	100	46%	0.464	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-56.2	144.3	176.1	0	0	0	0	0	111.4	E165 N196	G163-E165 PolarHBondContact O-N 3.32Å; G163-E165 VanDerWaalsContact O-N 3.15Å; G163-N196 PolarHBondContact O-ND2 2.84Å; G163-N196 PolarHBondContact O-OD1 2.98Å
164	V	86.5	Confident	84.1	Confident	136 Å²	136	97 Å²	97	82%	0.824	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-64.4	116.8	169.9	179.4	0	0	0	0	107.9
165	E	90.3	Very high	85.6	Confident	87 Å²	87	97.8 Å²	97.8	41%	0.407	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-65.4	140.7	173.6	-59.6	-170.1	142.3	0	0	110	G163 N196	G163-E165 PolarHBondContact O-N 3.32Å; G163-E165 VanDerWaalsContact O-N 3.15Å; E165-N196 HydrophobicContact CG-CB 4.22Å; E165-N196 WeakPolarHBondContact CG-ND2 3.33Å; E165-N196 WeakPolarHBondContact OE1-CB 3.42Å; E165-N196 PolarHBondContact OE1-N 3.38Å; E165-N196 PolarHBondContact OE1-ND2 2.88Å
166	H	93.7	Very high	86.8	Confident	57 Å²	57	92.7 Å²	92.7	26%	0.264	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	130.9	167.6	64.8	94.7	0	0	0	108.8	G193 Q194	H166-G193 CarbonylContact O-C 3.57Å; H166-G193 VanDerWaalsContact O-C 3.31Å; H166-G193 WeakPolarHBondContact O-CA 3.01Å; H166-Q194 PolarHBondContact N-O 3.04Å; H166-Q194 PolarHBondContact NE2-OE1 3.06Å; H166-Q194 PolarHBondContact O-N 3.45Å
167	C	97.6	Very high	88	Confident	29 Å²	29	94.7 Å²	94.7	20%	0.196	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	120.6	170.3	179.6	0	0	0	0	107.8	C218 S251	C167-C218 VanDerWaalsContact CA-SG 3.55Å; C167-C218 HydrophobicContact CB-CB 3.83Å; C167-C218 WeakPolarHBondContact CB-SG 3.13Å; C167-C218 WeakPolarHBondContact SG-CA 3.5Å; C167-C218 WeakPolarHBondContact SG-CB 3.45Å; C167-C218 CovalentContact SG-SG 2.04Å; C167-C218 PolarHBondContact SG-SG 2.98Å; C167-S251 WeakPolarHBondContact SG-CA 3.28Å; C167-S251 PolarHBondContact SG-N 3.14Å
168	R	96.1	Very high	89	Confident	163 Å²	163	95.2 Å²	95.2	62%	0.615	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.9	-170	-62.6	-176.7	-177.6	175.3	1.3	111	I170 C191 H192	R168-I170 HydrophobicContact CB-CG1 4.23Å; R168-C191 WeakPolarHBondContact O-CA 3.1Å; R168-H192 PolarHBondContact N-O 3.35Å; R168-H192 PolarHBondContact O-N 3.31Å
169	T	97.4	Very high	89.8	Confident	50 Å²	50	99.6 Å²	99.6	31%	0.307	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	108.7	169.7	-55.5	0	0	0	0	108.6	N189 V247 Q249 C250	T169-N189 HydrophobicContact CG2-CB 3.43Å; T169-N189 VanDerWaalsContact CG2-CB 3.43Å; T169-V247 HydrophobicContact CG2-CG1 4.46Å; T169-Q249 WeakPolarHBondContact OG1-CA 3.49Å; T169-C250 WeakPolarHBondContact OG1-CB 3.41Å; T169-C250 PolarHBondContact OG1-N 3.4Å; T169-C250 PolarHBondContact OG1-SG 3.38Å
170	I	97	Very high	90.8	Very high	66 Å²	66	91 Å²	91	34%	0.338	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.2	-174.8	-56.3	177.9	0	0	0	109	R168 N189 I190 H192	R168-I170 HydrophobicContact CB-CG1 4.23Å; I170-N189 CarbonylContact O-C 3.59Å; I170-N189 VanDerWaalsContact O-CA 3.24Å; I170-N189 WeakPolarHBondContact O-CA 3.21Å; I170-I190 HydrophobicContact CB-CG1 3.92Å; I170-I190 PolarHBondContact N-O 3.08Å; I170-I190 PolarHBondContact O-N 3.02Å; I170-H192 HydrophobicContact CD1-CB 3.73Å
171	P	97.3	Very high	91.7	Very high	88 Å²	88	84.3 Å²	84.3	57%	0.571	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	142.3	176.6	30.2	-34.3	0	0	0	111.7	V187 N188 N189	P171-V187 HydrophobicContact CB-CG1 4.02Å; P171-N188 CarbonylContact C-O 3.54Å; P171-N188 WeakPolarHBondContact CA-O 3Å; P171-N189 VanDerWaalsContact CA-OD1 3.28Å; P171-N189 WeakPolarHBondContact CA-OD1 3.47Å
172	F	96.6	Very high	93	Very high	70 Å²	70	82.1 Å²	82.1	31%	0.307	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	157	174.1	81.7	-76.5	0	0	0	111.6	Q174 V187 N188 I190	F172-Q174 HydrophobicContact CD2-CB 4.39Å; F172-Q174 HydrophobicContact CE2-CB 3.69Å; F172-Q174 HydrophobicContact CE2-CG 4.22Å; F172-Q174 HydrophobicContact CZ-CB 4.04Å; F172-Q174 HydrophobicContact CZ-CG 4.45Å; F172-V187 WeakPolarHBondContact O-CA 3.39Å; F172-N188 VanDerWaalsContact CD1-C 3.48Å; F172-N188 HydrophobicContact CD1-CB 4.18Å; F172-N188 VanDerWaalsContact CD1-O 3.26Å; F172-N188 WeakPolarHBondContact CD1-O 3Å; F172-N188 HydrophobicContact CE1-CB 3.55Å; F172-N188 HydrophobicContact CZ-CB 3.92Å; F172-N188 PolarHBondContact N-O 3.23Å; F172-N188 PolarHBondContact O-N 3.33Å; F172-N188 VanDerWaalsContact O-O 3.14Å; F172-I190 HydrophobicContact CD1-CB 4.46Å; F172-I190 HydrophobicContact CD1-CG2 3.5Å; F172-I190 VanDerWaalsContact CD1-CG2 3.5Å; F172-I190 HydrophobicContact CE1-CG2 3.51Å; F172-I190 HydrophobicContact CG-CG2 4.14Å; F172-I190 HydrophobicContact CZ-CG2 4.2Å
173	K	95.8	Very high	93.7	Very high	176 Å²	176	82.2 Å²	82.2	77%	0.765	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	117.1	176.6	-67.6	-179.6	-177.6	175.5	0	109.6	T185	K173-T185 HydrophobicContact CB-CG2 3.92Å; K173-T185 HydrophobicContact CG-CG2 4.37Å
174	Q	93.4	Very high	94.5	Very high	61 Å²	61	85 Å²	85	29%	0.285	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.5	175.5	-175	176.5	-24.3	0	0	109.7	F172 T185 V186 N188	F172-Q174 HydrophobicContact CD2-CB 4.39Å; F172-Q174 HydrophobicContact CE2-CB 3.69Å; F172-Q174 HydrophobicContact CE2-CG 4.22Å; F172-Q174 HydrophobicContact CZ-CB 4.04Å; F172-Q174 HydrophobicContact CZ-CG 4.45Å; Q174-T185 CarbonylContact O-C 3.45Å; Q174-T185 WeakPolarHBondContact O-CA 3.4Å; Q174-V186 HydrophobicContact CB-CG2 4.13Å; Q174-V186 PolarHBondContact N-O 2.87Å; Q174-V186 PolarHBondContact O-N 3.45Å; Q174-N188 HydrophobicContact CB-CB 4.44Å; Q174-N188 PolarHBondContact OE1-ND2 2.87Å
175	R	94.3	Very high	95	Very high	137 Å²	137	82.4 Å²	82.4	52%	0.517	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	113.4	178.6	-178.3	169.3	142.9	-154.2	-6.4	110.5	R177	R175-R177 HydrophobicContact CG-CG 4.23Å; R175-R177 VanDerWaalsContact NE-NH2 3.13Å; R175-R177 VanDerWaalsContact NH2-NH2 3.17Å; R175-R177 PolarHBondContact O-NH1 3.42Å
176	I	94.3	Very high	95.2	Very high	14 Å²	14	79.1 Å²	79.1	7%	0.072	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.4	178.2	-57.5	177.3	0	0	0	108.8	S183 K184 V186 V228 L230 R242 Y244	I176-S183 VanDerWaalsContact O-CA 3.29Å; I176-S183 WeakPolarHBondContact O-CA 3.35Å; I176-K184 PolarHBondContact N-O 2.87Å; I176-K184 PolarHBondContact O-N 2.83Å; I176-V186 HydrophobicContact CD1-CB 4.5Å; I176-V186 HydrophobicContact CD1-CG1 3.97Å; I176-V186 HydrophobicContact CD1-CG2 3.67Å; I176-V186 HydrophobicContact CG1-CG2 4.08Å; I176-V228 HydrophobicContact CD1-CB 4.18Å; I176-V228 HydrophobicContact CD1-CG1 3.61Å; I176-V228 HydrophobicContact CG2-CG1 4.08Å; I176-L230 HydrophobicContact CG2-CD1 4.17Å; I176-R242 HydrophobicContact CG2-CG 4.29Å; I176-Y244 HydrophobicContact CD1-CD1 3.68Å; I176-Y244 HydrophobicContact CD1-CE1 4.07Å; I176-Y244 HydrophobicContact CD1-CG 4.09Å
177	R	93.3	Very high	95.3	Very high	140 Å²	140	80.1 Å²	80.1	53%	0.528	41%	0.406	S	S	.	.			trans	-127.6	140.9	-178.6	-49.4	-174.7	177.7	68	-18.7	109.9	R175 S183	R175-R177 HydrophobicContact CG-CG 4.23Å; R175-R177 VanDerWaalsContact NE-NH2 3.13Å; R175-R177 VanDerWaalsContact NH2-NH2 3.17Å; R175-R177 PolarHBondContact O-NH1 3.42Å; R177-S183 WeakPolarHBondContact CG-OG 3.31Å
178	I	93	Very high	95.2	Very high	40 Å²	40	79.2 Å²	79.2	21%	0.205	40%	0.399	C	S	.	.			trans	-141.9	138.4	169.9	-63.7	-172.6	0	0	0	106.4	C181 L230 V240 R242	I178-C181 HydrophobicContact CB-CB 4.22Å; I178-C181 WeakPolarHBondContact O-CB 3.49Å; I178-C181 PolarHBondContact O-N 3.39Å; I178-L230 HydrophobicContact CB-CD1 3.87Å; I178-L230 HydrophobicContact CD1-CD1 3.61Å; I178-L230 HydrophobicContact CG1-CD1 3.54Å; I178-V240 HydrophobicContact CD1-CG1 4.1Å; I178-R242 HydrophobicContact CD1-CB 3.87Å; I178-R242 HydrophobicContact CD1-CG 4.03Å
179	D	92.1	Very high	95.2	Very high	143 Å²	143	73 Å²	73	77%	0.765	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	139.8	-178.2	-59.2	-32.2	0	0	0	112	C181 R235	D179-C181 PolarHBondContact O-N 3.48Å; D179-R235 PolarHBondContact O-NE 3.34Å; D179-R235 PolarHBondContact O-NH2 3.33Å
180	G	93.3	Very high	95.1	Very high	44 Å²	44	74.4 Å²	74.4	45%	0.454	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	8	-176.2	0	0	0	0	0	114.8	C232	G180-C232 WeakPolarHBondContact O-CA 3.47Å; G180-C232 WeakPolarHBondContact O-CB 3.36Å
181	C	95.8	Very high	95	Very high	14 Å²	14	73 Å²	73	10%	0.095	38%	0.379	C	S	.	.	S	Bend	trans	-121.8	146	176.1	-55.7	0	0	0	0	111.9	I178 D179 S183 L230 R231 C232	I178-C181 HydrophobicContact CB-CB 4.22Å; I178-C181 WeakPolarHBondContact O-CB 3.49Å; I178-C181 PolarHBondContact O-N 3.39Å; D179-C181 PolarHBondContact O-N 3.48Å; C181-S183 PolarHBondContact O-N 2.58Å; C181-L230 HydrophobicContact CB-CB 4.07Å; C181-L230 HydrophobicContact CB-CD1 4.45Å; C181-R231 CarbonylContact C-O 3.58Å; C181-R231 WeakPolarHBondContact CA-O 3.21Å; C181-C232 HydrophobicContact CB-CB 3.99Å; C181-C232 WeakPolarHBondContact CB-SG 3.33Å; C181-C232 WeakPolarHBondContact SG-CB 3.2Å; C181-C232 CovalentContact SG-SG 2.03Å; C181-C232 PolarHBondContact SG-SG 3.03Å
182	L	95.7	Very high	95	Very high	107 Å²	107	74.2 Å²	74.2	56%	0.56	38%	0.377	S	S	*	.			trans	-64.5	125.1	171.3	-61.8	179.6	0	0	0	109.4	R231	L182-R231 HydrophobicContact CD1-CB 4.31Å; L182-R231 PolarHBondContact N-O 3.22Å
183	S	96.1	Very high	94.9	Very high	59 Å²	59	72.1 Å²	72.1	41%	0.413	38%	0.375	S	S	.	.			trans	-65.4	142	178.2	-60.2	0	0	0	0	110.6	I176 R177 C181	I176-S183 VanDerWaalsContact O-CA 3.29Å; I176-S183 WeakPolarHBondContact O-CA 3.35Å; R177-S183 WeakPolarHBondContact CG-OG 3.31Å; C181-S183 PolarHBondContact O-N 2.58Å
184	K	95.7	Very high	94.8	Very high	104 Å²	104	70.3 Å²	70.3	45%	0.452	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.3	176.4	-171.4	168.6	175.6	179.7	0	110.7	I176 V228 L230	I176-K184 PolarHBondContact N-O 2.87Å; I176-K184 PolarHBondContact O-N 2.83Å; K184-V228 HydrophobicContact CB-CG2 4.47Å; K184-V228 HydrophobicContact CD-CG2 3.68Å; K184-V228 HydrophobicContact CG-CG2 4.36Å; K184-L230 HydrophobicContact CB-CD2 3.58Å
185	T	95.8	Very high	94.8	Very high	82 Å²	82	68.9 Å²	68.9	50%	0.503	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.8	173.4	-57.2	0	0	0	0	109.5	K173 Q174	K173-T185 HydrophobicContact CB-CG2 3.92Å; K173-T185 HydrophobicContact CG-CG2 4.37Å; Q174-T185 CarbonylContact O-C 3.45Å; Q174-T185 WeakPolarHBondContact O-CA 3.4Å
186	V	95.3	Very high	94.6	Very high	17 Å²	17	64.1 Å²	64.1	10%	0.103	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	158.9	175.7	-59.3	0	0	0	0	109.8	Q174 I176 V228 Y244	Q174-V186 HydrophobicContact CB-CG2 4.13Å; Q174-V186 PolarHBondContact N-O 2.87Å; Q174-V186 PolarHBondContact O-N 3.45Å; I176-V186 HydrophobicContact CD1-CB 4.5Å; I176-V186 HydrophobicContact CD1-CG1 3.97Å; I176-V186 HydrophobicContact CD1-CG2 3.67Å; I176-V186 HydrophobicContact CG1-CG2 4.08Å; V186-V228 HydrophobicContact CG1-CG2 4.13Å; V186-Y244 HydrophobicContact CG1-CE1 4.44Å; V186-Y244 HydrophobicContact CG2-CE1 4.27Å; V186-Y244 HydrophobicContact CG2-CE2 4.07Å
187	V	95.3	Very high	94.4	Very high	79 Å²	79	67 Å²	67	48%	0.479	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.9	172.9	-178.6	0	0	0	0	108.8	P171 F172	P171-V187 HydrophobicContact CB-CG1 4.02Å; F172-V187 WeakPolarHBondContact O-CA 3.39Å
188	N	95.3	Very high	94.2	Very high	10 Å²	10	63.7 Å²	63.7	5%	0.053	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	177.5	173.7	-163.6	0.4	0	0	0	108.9	P171 F172 Q174 F245 K246 V247	P171-N188 CarbonylContact C-O 3.54Å; P171-N188 WeakPolarHBondContact CA-O 3Å; F172-N188 VanDerWaalsContact CD1-C 3.48Å; F172-N188 HydrophobicContact CD1-CB 4.18Å; F172-N188 VanDerWaalsContact CD1-O 3.26Å; F172-N188 WeakPolarHBondContact CD1-O 3Å; F172-N188 HydrophobicContact CE1-CB 3.55Å; F172-N188 HydrophobicContact CZ-CB 3.92Å; F172-N188 PolarHBondContact N-O 3.23Å; F172-N188 PolarHBondContact O-N 3.33Å; F172-N188 VanDerWaalsContact O-O 3.14Å; Q174-N188 HydrophobicContact CB-CB 4.44Å; Q174-N188 PolarHBondContact OE1-ND2 2.87Å; N188-F245 PolarHBondContact ND2-O 2.96Å; N188-K246 VanDerWaalsContact OD1-CA 3.28Å; N188-K246 WeakPolarHBondContact OD1-CA 3.49Å; N188-V247 PolarHBondContact OD1-N 3.16Å; N188-V247 VanDerWaalsContact OD1-N 3.1Å
189	N	95.7	Very high	94	Very high	31 Å²	31	66.4 Å²	66.4	17%	0.166	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	146.4	-179.2	-58.2	-38.6	0	0	0	111.6	T169 I170 P171 V247	T169-N189 HydrophobicContact CG2-CB 3.43Å; T169-N189 VanDerWaalsContact CG2-CB 3.43Å; I170-N189 CarbonylContact O-C 3.59Å; I170-N189 VanDerWaalsContact O-CA 3.24Å; I170-N189 WeakPolarHBondContact O-CA 3.21Å; P171-N189 VanDerWaalsContact CA-OD1 3.28Å; P171-N189 WeakPolarHBondContact CA-OD1 3.47Å; N189-V247 HydrophobicContact CB-CB 4.01Å; N189-V247 HydrophobicContact CB-CG1 4.17Å; N189-V247 WeakPolarHBondContact CB-O 3.45Å; N189-V247 PolarHBondContact ND2-O 3.44Å; N189-V247 WeakPolarHBondContact O-CB 3.09Å
190	I	95.6	Very high	93.8	Very high	81 Å²	81	61.6 Å²	61.6	42%	0.415	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	156.6	169	60.7	175.6	0	0	0	110.1	I170 F172	I170-I190 HydrophobicContact CB-CG1 3.92Å; I170-I190 PolarHBondContact N-O 3.08Å; I170-I190 PolarHBondContact O-N 3.02Å; F172-I190 HydrophobicContact CD1-CB 4.46Å; F172-I190 HydrophobicContact CD1-CG2 3.5Å; F172-I190 VanDerWaalsContact CD1-CG2 3.5Å; F172-I190 HydrophobicContact CE1-CG2 3.51Å; F172-I190 HydrophobicContact CG-CG2 4.14Å; F172-I190 HydrophobicContact CZ-CG2 4.2Å
191	C	95.8	Very high	93.6	Very high	36 Å²	36	62.7 Å²	62.7	24%	0.243	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.4	170.6	-57.7	0	0	0	0	110.3	R168 R219 P220 C250	R168-C191 WeakPolarHBondContact O-CA 3.1Å; C191-R219 VanDerWaalsContact SG-C 3.53Å; C191-P220 WeakPolarHBondContact SG-CD 3.38Å; C191-P220 WeakPolarHBondContact SG-CG 2.91Å; C191-P220 VanDerWaalsContact SG-N 3.38Å; C191-C250 WeakPolarHBondContact CA-SG 3.12Å; C191-C250 HydrophobicContact CB-CB 3.67Å; C191-C250 WeakPolarHBondContact CB-SG 3.28Å; C191-C250 WeakPolarHBondContact SG-CB 3.31Å; C191-C250 CovalentContact SG-SG 2.02Å; C191-C250 PolarHBondContact SG-SG 3.44Å
192	H	96.1	Very high	93.1	Very high	114 Å²	114	68.7 Å²	68.7	53%	0.528	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	129	176	176.4	-93.9	0	0	0	109.8	R168 I170 C218	R168-H192 PolarHBondContact N-O 3.35Å; R168-H192 PolarHBondContact O-N 3.31Å; I170-H192 HydrophobicContact CD1-CB 3.73Å; H192-C218 VanDerWaalsContact C-SG 3.57Å
193	G	95.7	Very high	92.6	Very high	26 Å²	26	70.9 Å²	70.9	27%	0.268	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.5	172.5	-174	0	0	0	0	0	115.2	H166	H166-G193 CarbonylContact O-C 3.57Å; H166-G193 VanDerWaalsContact O-C 3.31Å; H166-G193 WeakPolarHBondContact O-CA 3.01Å
194	Q	92.5	Very high	92	Very high	138 Å²	138	75.7 Å²	75.7	65%	0.645	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.2	169.8	-66.1	172.4	-36.8	0	0	108.5	H166	H166-Q194 PolarHBondContact N-O 3.04Å; H166-Q194 PolarHBondContact NE2-OE1 3.06Å; H166-Q194 PolarHBondContact O-N 3.45Å
195	C	94.2	Very high	91.1	Very high	30 Å²	30	72.7 Å²	72.7	20%	0.203	39%	0.385	C	S	.	.			trans	-121.6	151.5	-178.6	-52.2	0	0	0	0	109.9	S216 C218 C252	C195-S216 WeakPolarHBondContact CB-OG 3.41Å; C195-C218 PolarHBondContact SG-N 3.28Å; C195-C252 VanDerWaalsContact CA-SG 3.6Å; C195-C252 HydrophobicContact CB-CB 3.63Å; C195-C252 WeakPolarHBondContact CB-SG 3.27Å; C195-C252 WeakPolarHBondContact SG-CA 3.28Å; C195-C252 WeakPolarHBondContact SG-CB 3.18Å; C195-C252 CovalentContact SG-SG 2.03Å; C195-C252 PolarHBondContact SG-SG 3.41Å
196	N	90.3	Very high	90.5	Very high	38 Å²	38	74.8 Å²	74.8	20%	0.203	40%	0.403	C	S	.	.			trans	-82.5	146	-175.6	-66.8	-38.3	0	0	0	111.5	I162 G163 E165 F198 S216	I162-N196 WeakPolarHBondContact CG2-ND2 3.05Å; G163-N196 PolarHBondContact O-ND2 2.84Å; G163-N196 PolarHBondContact O-OD1 2.98Å; E165-N196 HydrophobicContact CG-CB 4.22Å; E165-N196 WeakPolarHBondContact CG-ND2 3.33Å; E165-N196 WeakPolarHBondContact OE1-CB 3.42Å; E165-N196 PolarHBondContact OE1-N 3.38Å; E165-N196 PolarHBondContact OE1-ND2 2.88Å; N196-F198 HydrophobicContact CB-CE2 4.11Å; N196-F198 HydrophobicContact CB-CZ 4.16Å; N196-S216 PolarHBondContact N-OG 3.35Å; N196-S216 PolarHBondContact O-OG 3.32Å
197	S	90.4	Very high	90.1	Very high	75 Å²	75	80.1 Å²	80.1	52%	0.524	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.5	169.2	59.9	0	0	0	0	109.7	S214	S197-S214 CarbonylContact C-O 3.51Å; S197-S214 WeakPolarHBondContact CA-O 3.47Å; S197-S214 WeakPolarHBondContact CB-O 3.46Å
198	F	88.4	Confident	89.5	Confident	70 Å²	70	83.3 Å²	83.3	31%	0.307	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133.4	-179.5	-60.3	-75.1	0	0	0	108.4	I162 N196 F212 E213 S214	I162-F198 HydrophobicContact CD1-CE1 4.06Å; I162-F198 HydrophobicContact CD1-CZ 3.94Å; I162-F198 HydrophobicContact CG1-CE1 4.08Å; I162-F198 HydrophobicContact CG1-CZ 4.18Å; I162-F198 HydrophobicContact CG2-CZ 4.1Å; N196-F198 HydrophobicContact CB-CE2 4.11Å; N196-F198 HydrophobicContact CB-CZ 4.16Å; F198-F212 HydrophobicContact CB-CD1 4.34Å; F198-F212 HydrophobicContact CB-CE1 4Å; F198-E213 CarbonylContact O-C 3.58Å; F198-E213 WeakPolarHBondContact O-CA 3.26Å; F198-S214 WeakPolarHBondContact CB-OG 3.36Å; F198-S214 VanDerWaalsContact CD2-OG 3.28Å; F198-S214 WeakPolarHBondContact CD2-OG 3.36Å; F198-S214 PolarHBondContact N-O 3.48Å; F198-S214 PolarHBondContact N-OG 3.25Å; F198-S214 VanDerWaalsContact N-OG 3.17Å; F198-S214 PolarHBondContact O-N 2.95Å
199	F	88.8	Confident	89	Confident	97 Å²	97	88.4 Å²	88.4	43%	0.425	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	109.2	172.5	-179.1	-85.2	0	0	0	108	P201 L208 A210 E213	F199-P201 HydrophobicContact CE1-CB 4.07Å; F199-L208 HydrophobicContact CE1-CD1 3.79Å; F199-L208 HydrophobicContact CE1-CG 4.28Å; F199-L208 HydrophobicContact CZ-CD1 3.93Å; F199-L208 HydrophobicContact CZ-CD2 4.43Å; F199-L208 HydrophobicContact CZ-CG 3.94Å; F199-A210 HydrophobicContact CD2-CB 4.07Å; F199-A210 HydrophobicContact CE2-CB 3.62Å; F199-A210 HydrophobicContact CZ-CB 4.16Å; F199-E213 HydrophobicContact CD2-CG 4.27Å
200	I	87.8	Confident	88.4	Confident	41 Å²	41	88.6 Å²	88.6	21%	0.21	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	115.8	176.3	-52.9	-179.4	0	0	0	107	V156 L211 F212	V156-I200 HydrophobicContact CG1-CD1 3.81Å; V156-I200 HydrophobicContact CG1-CG1 4.37Å; V156-I200 HydrophobicContact CG2-CD1 3.96Å; I200-L211 HydrophobicContact CG2-CD2 3.92Å; I200-L211 VanDerWaalsContact O-CB 3.28Å; I200-L211 WeakPolarHBondContact O-CB 3.44Å; I200-L211 PolarHBondContact O-N 2.81Å; I200-F212 HydrophobicContact CB-CB 4.1Å; I200-F212 HydrophobicContact CD1-CB 4.04Å; I200-F212 HydrophobicContact CD1-CD1 3.88Å; I200-F212 HydrophobicContact CD1-CG 4.31Å; I200-F212 HydrophobicContact CG1-CB 4.22Å; I200-F212 HydrophobicContact CG1-CD1 4.12Å; I200-F212 PolarHBondContact N-O 3.36Å; I200-F212 PolarHBondContact O-N 3.15Å
201	P	88.7	Confident	87.8	Confident	68 Å²	68	86.6 Å²	86.6	44%	0.442	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	151.5	178.7	28.9	-33.5	0	0	0	111.9	F199 L203 L208	F199-P201 HydrophobicContact CE1-CB 4.07Å; P201-L203 PolarHBondContact O-N 3.24Å; P201-L208 HydrophobicContact CB-CD1 4.38Å
202	R	86.6	Confident	87.2	Confident	140 Å²	140	87 Å²	87	53%	0.528	45%	0.45	S	S	.	.			trans	-71.8	121.4	166.6	-64.8	-176	75.1	167.4	2.1	110.1	H204 R209 L211	R202-H204 VanDerWaalsContact C-N 3.28Å; R202-H204 PolarHBondContact O-N 2.85Å; R202-R209 PolarHBondContact N-O 2.63Å; R202-L211 HydrophobicContact CB-CB 4.48Å; R202-L211 HydrophobicContact CG-CB 3.6Å; R202-L211 HydrophobicContact CG-CD1 4.09Å; R202-L211 HydrophobicContact CG-CG 4.41Å
203	L	84.6	Confident	86.6	Confident	153 Å²	153	87.6 Å²	87.6	80%	0.801	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.4	-176.2	-170.7	61.3	0	0	0	113.9	P201	P201-L203 PolarHBondContact O-N 3.24Å
204	H	83.5	Confident	86.3	Confident	159 Å²	159	86.9 Å²	86.9	74%	0.736	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	23.2	-172.2	-59.5	121.2	0	0	0	114.6	R202	R202-H204 VanDerWaalsContact C-N 3.28Å; R202-H204 PolarHBondContact O-N 2.85Å
205	S	77.7	Confident	86.2	Confident	42 Å²	42	87.2 Å²	87.2	29%	0.294	44%	0.44	S	S	.	.			trans	-99.7	135.6	179.8	-179.9	0	0	0	0	112	K207	S205-K207 VanDerWaalsContact CB-O 3.28Å; S205-K207 WeakPolarHBondContact CB-O 3.28Å; S205-K207 PolarHBondContact O-N 3.08Å; S205-K207 PolarHBondContact OG-N 3.27Å; S205-K207 PolarHBondContact OG-O 3.13Å
206	S	82.6	Confident	86.1	Confident	126 Å²	126	86.8 Å²	86.8	88%	0.881	44%	0.438	S	S	*	.	S	Bend	trans	-70.7	-15.4	171.8	57.9	0	0	0	0	113.4
207	K	85.8	Confident	86.3	Confident	128 Å²	128	87.4 Å²	87.4	56%	0.557	44%	0.443	S	S	*	.	S	Bend	trans	-115.9	141.6	177	-64.2	-179.7	179.8	177.2	0	109.3	S205 R209	S205-K207 VanDerWaalsContact CB-O 3.28Å; S205-K207 WeakPolarHBondContact CB-O 3.28Å; S205-K207 PolarHBondContact O-N 3.08Å; S205-K207 PolarHBondContact OG-N 3.27Å; S205-K207 PolarHBondContact OG-O 3.13Å; K207-R209 HydrophobicContact CB-CG 4.28Å; K207-R209 PolarHBondContact O-N 2.86Å
208	L	84.1	Confident	86.5	Confident	147 Å²	147	84.9 Å²	84.9	77%	0.77	43%	0.425	S	S	*	.			trans	-60.2	103.9	170.8	-175.4	65.6	0	0	0	108.2	F199 P201	F199-L208 HydrophobicContact CE1-CD1 3.79Å; F199-L208 HydrophobicContact CE1-CG 4.28Å; F199-L208 HydrophobicContact CZ-CD1 3.93Å; F199-L208 HydrophobicContact CZ-CD2 4.43Å; F199-L208 HydrophobicContact CZ-CG 3.94Å; P201-L208 HydrophobicContact CB-CD1 4.38Å
209	R	84.5	Confident	86.8	Confident	117 Å²	117	83.1 Å²	83.1	44%	0.442	42%	0.416	S	S	.	.			trans	-130.5	130.1	178.9	-74.1	-173.4	169.6	-171.5	-5.5	107.3	R202 K207 L211	R202-R209 PolarHBondContact N-O 2.63Å; K207-R209 HydrophobicContact CB-CG 4.28Å; K207-R209 PolarHBondContact O-N 2.86Å; R209-L211 PolarHBondContact O-N 2.84Å
210	A	82	Confident	87	Confident	34 Å²	34	79.4 Å²	79.4	28%	0.281	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	133.7	168.9	0	0	0	0	0	109	F199 E213	F199-A210 HydrophobicContact CD2-CB 4.07Å; F199-A210 HydrophobicContact CE2-CB 3.62Å; F199-A210 HydrophobicContact CZ-CB 4.16Å; A210-E213 HydrophobicContact CB-CB 3.71Å
211	L	83.8	Confident	87.2	Confident	40 Å²	40	79.4 Å²	79.4	21%	0.209	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-40.9	160.8	176	59	0	0	0	109.7	L72 I200 R202 R209	L72-L211 HydrophobicContact CD1-CD1 4.33Å; L72-L211 HydrophobicContact CD1-CD2 3.53Å; L72-L211 HydrophobicContact CD1-CG 3.8Å; L72-L211 HydrophobicContact CD2-CD1 3.63Å; L72-L211 HydrophobicContact CD2-CD2 2.98Å; L72-L211 HydrophobicContact CD2-CG 3.66Å; L72-L211 HydrophobicContact CG-CD1 3.74Å; L72-L211 HydrophobicContact CG-CD2 3.53Å; L72-L211 HydrophobicContact CG-CG 3.74Å; I200-L211 HydrophobicContact CG2-CD2 3.92Å; I200-L211 VanDerWaalsContact O-CB 3.28Å; I200-L211 WeakPolarHBondContact O-CB 3.44Å; I200-L211 PolarHBondContact O-N 2.81Å; R202-L211 HydrophobicContact CB-CB 4.48Å; R202-L211 HydrophobicContact CG-CB 3.6Å; R202-L211 HydrophobicContact CG-CD1 4.09Å; R202-L211 HydrophobicContact CG-CG 4.41Å; R209-L211 PolarHBondContact O-N 2.84Å
212	F	82.6	Confident	87.4	Confident	43 Å²	43	80.3 Å²	80.3	19%	0.189	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	131.7	172.4	175.8	-98.8	0	0	0	107.5	Y61 A68 F198 I200	Y61-F212 WeakPolarHBondContact OH-CZ 3.43Å; A68-F212 HydrophobicContact CB-CD2 4.48Å; F198-F212 HydrophobicContact CB-CD1 4.34Å; F198-F212 HydrophobicContact CB-CE1 4Å; I200-F212 HydrophobicContact CB-CB 4.1Å; I200-F212 HydrophobicContact CD1-CB 4.04Å; I200-F212 HydrophobicContact CD1-CD1 3.88Å; I200-F212 HydrophobicContact CD1-CG 4.31Å; I200-F212 HydrophobicContact CG1-CB 4.22Å; I200-F212 HydrophobicContact CG1-CD1 4.12Å; I200-F212 PolarHBondContact N-O 3.36Å; I200-F212 PolarHBondContact O-N 3.15Å
213	E	84.4	Confident	87.6	Confident	127 Å²	127	74 Å²	74	59%	0.593	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	130.8	173.4	-176.8	172.3	-178.7	0	0	108.4	F198 F199 A210	F198-E213 CarbonylContact O-C 3.58Å; F198-E213 WeakPolarHBondContact O-CA 3.26Å; F199-E213 HydrophobicContact CD2-CG 4.27Å; A210-E213 HydrophobicContact CB-CB 3.71Å
214	S	88.1	Confident	87.9	Confident	12 Å²	12	68.7 Å²	68.7	8%	0.084	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.6	171.2	68.2	0	0	0	0	108.9	Y61 S197 F198	Y61-S214 WeakPolarHBondContact OH-CB 3.41Å; S197-S214 CarbonylContact C-O 3.51Å; S197-S214 WeakPolarHBondContact CA-O 3.47Å; S197-S214 WeakPolarHBondContact CB-O 3.46Å; F198-S214 WeakPolarHBondContact CB-OG 3.36Å; F198-S214 VanDerWaalsContact CD2-OG 3.28Å; F198-S214 WeakPolarHBondContact CD2-OG 3.36Å; F198-S214 PolarHBondContact N-O 3.48Å; F198-S214 PolarHBondContact N-OG 3.25Å; F198-S214 VanDerWaalsContact N-OG 3.17Å; F198-S214 PolarHBondContact O-N 2.95Å
215	Y	90.9	Very high	88.3	Confident	144 Å²	144	64.2 Å²	64.2	57%	0.565	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	112.4	173.6	-179.8	-114.6	0	0	0	108.2	V217 S254 A255	Y215-V217 HydrophobicContact CD1-CG2 4.1Å; Y215-V217 HydrophobicContact CE1-CG2 3.39Å; Y215-V217 HydrophobicContact CE2-CG2 4.48Å; Y215-S254 WeakPolarHBondContact O-CA 3.48Å; Y215-A255 HydrophobicContact CD1-CB 3.34Å; Y215-A255 HydrophobicContact CE1-CB 3.71Å; Y215-A255 HydrophobicContact CG-CB 4.44Å; Y215-A255 PolarHBondContact O-N 3.03Å
216	S	92.6	Very high	89.1	Confident	22 Å²	22	64.5 Å²	64.5	15%	0.154	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	145.7	179.3	71.6	0	0	0	0	110.9	C195 N196 M253	C195-S216 WeakPolarHBondContact CB-OG 3.41Å; N196-S216 PolarHBondContact N-OG 3.35Å; N196-S216 PolarHBondContact O-OG 3.32Å; S216-M253 CarbonylContact C-O 3.53Å; S216-M253 WeakPolarHBondContact CA-O 3.31Å
217	V	94	Very high	89.7	Confident	50 Å²	50	61.3 Å²	61.3	30%	0.303	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.9	-177	179.8	0	0	0	0	109.1	Y215 R219 M253 A255	Y215-V217 HydrophobicContact CD1-CG2 4.1Å; Y215-V217 HydrophobicContact CE1-CG2 3.39Å; Y215-V217 HydrophobicContact CE2-CG2 4.48Å; V217-R219 PolarHBondContact O-N 3.5Å; V217-M253 PolarHBondContact N-O 3.48Å; V217-M253 PolarHBondContact O-N 3.32Å; V217-A255 HydrophobicContact CG2-CB 3.98Å
218	C	95.6	Very high	90.1	Very high	23 Å²	23	55.6 Å²	55.6	16%	0.155	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	106.7	174.7	178.8	0	0	0	0	109.4	C167 H192 C195	C167-C218 VanDerWaalsContact CA-SG 3.55Å; C167-C218 HydrophobicContact CB-CB 3.83Å; C167-C218 WeakPolarHBondContact CB-SG 3.13Å; C167-C218 WeakPolarHBondContact SG-CA 3.5Å; C167-C218 WeakPolarHBondContact SG-CB 3.45Å; C167-C218 CovalentContact SG-SG 2.04Å; C167-C218 PolarHBondContact SG-SG 2.98Å; H192-C218 VanDerWaalsContact C-SG 3.57Å; C195-C218 PolarHBondContact SG-N 3.28Å
219	R	93.9	Very high	90.7	Very high	32 Å²	32	52.9 Å²	52.9	12%	0.121	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	166.1	-175.4	69.3	-176.4	-171.7	166.2	7.9	112	C191 V217 T221 C250 S251 M253 S254 E257	C191-R219 VanDerWaalsContact SG-C 3.53Å; V217-R219 PolarHBondContact O-N 3.5Å; R219-T221 PolarHBondContact O-N 3.37Å; R219-C250 WeakPolarHBondContact O-CA 3.4Å; R219-S251 PolarHBondContact N-O 3.47Å; R219-S251 VanDerWaalsContact N-O 3.17Å; R219-S251 PolarHBondContact O-N 3.04Å; R219-S251 VanDerWaalsContact O-N 3.14Å; R219-M253 HydrophobicContact CG-CB 4.45Å; R219-M253 HydrophobicContact CG-SD 4.47Å; R219-S254 PolarHBondContact NH2-O 3.19Å; R219-E257 VanDerWaalsContact CZ-O 3.25Å; R219-E257 PolarHBondContact NH1-O 2.85Å; R219-E257 VanDerWaalsContact NH2-CB 3.29Å; R219-E257 PolarHBondContact NH2-O 3.16Å; R219-E257 IonicContact NH2-OE2 3.95Å
220	P	93.6	Very high	91.3	Very high	19 Å²	19	47.4 Å²	47.4	12%	0.123	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	124	178.9	-28.6	40.4	0	0	0	112.5	C191 V223 V247 Q249 Y263	C191-P220 WeakPolarHBondContact SG-CD 3.38Å; C191-P220 WeakPolarHBondContact SG-CG 2.91Å; C191-P220 VanDerWaalsContact SG-N 3.38Å; P220-V223 HydrophobicContact CB-CG2 3.52Å; P220-V247 HydrophobicContact CB-CG1 3.96Å; P220-V247 HydrophobicContact CB-CG2 4.09Å; P220-V247 HydrophobicContact CG-CG1 4.04Å; P220-V247 HydrophobicContact CG-CG2 3.77Å; P220-Q249 WeakPolarHBondContact CA-O 3.41Å; P220-Y263 HydrophobicContact CB-CE2 4.1Å; P220-Y263 WeakPolarHBondContact CB-OH 3.46Å; P220-Y263 WeakPolarHBondContact CG-OH 3.48Å
221	T	91.6	Very high	92.1	Very high	42 Å²	42	54.9 Å²	54.9	26%	0.258	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-30.3	175.5	-49.9	0	0	0	0	111.3	R219 Q249 S251 M253	R219-T221 PolarHBondContact O-N 3.37Å; T221-Q249 PolarHBondContact N-O 3.29Å; T221-S251 WeakPolarHBondContact OG1-CB 3.45Å; T221-S251 PolarHBondContact OG1-N 3.22Å; T221-S251 PolarHBondContact OG1-OG 2.96Å; T221-M253 HydrophobicContact CG2-CE 4.13Å; T221-M253 HydrophobicContact CG2-SD 3.76Å; T221-M253 PolarHBondContact OG1-SD 3.25Å
222	Q	92	Very high	92.7	Very high	86 Å²	86	53 Å²	53	40%	0.402	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	125.2	175.4	-63.1	-173.9	17.6	0	0	109.7	K248 Q249	Q222-K248 HydrophobicContact CB-CB 3.86Å; Q222-K248 PolarHBondContact O-N 3.04Å; Q222-Q249 HydrophobicContact CB-CB 4.18Å; Q222-Q249 HydrophobicContact CG-CB 4.35Å; Q222-Q249 PolarHBondContact N-O 2.91Å; Q222-Q249 PolarHBondContact O-N 3.4Å
223	V	92.1	Very high	93.2	Very high	9 Å²	9	55.3 Å²	55.3	6%	0.055	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.7	176.3	178.5	0	0	0	0	109.1	P220 F245 K246 V247 S262 Y263	P220-V223 HydrophobicContact CB-CG2 3.52Å; V223-F245 HydrophobicContact CG1-CB 3.97Å; V223-F245 HydrophobicContact CG1-CD1 3.88Å; V223-F245 HydrophobicContact CG1-CG 4.31Å; V223-K246 WeakPolarHBondContact CA-O 3.47Å; V223-V247 HydrophobicContact CG2-CG2 4.31Å; V223-S262 WeakPolarHBondContact O-CB 3.18Å; V223-S262 PolarHBondContact O-OG 3.23Å; V223-Y263 HydrophobicContact CB-CD2 4.33Å; V223-Y263 HydrophobicContact CB-CE2 4Å; V223-Y263 HydrophobicContact CG2-CD2 4.07Å; V223-Y263 HydrophobicContact CG2-CE2 3.28Å
224	T	91.1	Very high	93.6	Very high	41 Å²	41	56.4 Å²	56.4	25%	0.252	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.1	174.8	47.4	0	0	0	0	111.1	K246 K248	T224-K246 PolarHBondContact N-O 3.37Å; T224-K246 WeakPolarHBondContact O-CA 3.1Å; T224-K246 PolarHBondContact O-N 3.34Å; T224-K246 PolarHBondContact OG1-O 3.12Å; T224-K248 HydrophobicContact CG2-CD 3.76Å; T224-K248 HydrophobicContact CG2-CG 4.39Å; T224-K248 WeakPolarHBondContact OG1-CE 3.47Å
225	T	91.8	Very high	93.7	Very high	64 Å²	64	61 Å²	61	39%	0.393	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.4	176.1	-55.7	0	0	0	0	109.8	K243	T225-K243 HydrophobicContact CG2-CB 3.77Å; T225-K243 HydrophobicContact CG2-CD 3.96Å; T225-K243 HydrophobicContact CG2-CG 4.04Å
226	V	93.2	Very high	93.8	Very high	48 Å²	48	61.5 Å²	61.5	29%	0.291	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	137.5	179.7	179.6	0	0	0	0	109.4	K243 Y244 K246	V226-K243 CarbonylContact O-C 3.52Å; V226-K243 WeakPolarHBondContact O-CA 3.21Å; V226-Y244 HydrophobicContact CB-CD1 4.2Å; V226-Y244 HydrophobicContact CB-CE1 3.62Å; V226-Y244 HydrophobicContact CB-CE2 4.39Å; V226-Y244 HydrophobicContact CG1-CE1 3.64Å; V226-Y244 PolarHBondContact N-O 3.41Å; V226-Y244 VanDerWaalsContact O-CD1 3.31Å; V226-Y244 WeakPolarHBondContact O-CD1 3.35Å; V226-Y244 PolarHBondContact O-N 3.4Å; V226-K246 HydrophobicContact CG2-CB 3.73Å; V226-K246 HydrophobicContact CG2-CD 3.93Å; V226-K246 HydrophobicContact CG2-CG 4.48Å
227	T	95.1	Very high	93.7	Very high	60 Å²	60	64.5 Å²	64.5	37%	0.368	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.6	175.5	-56.4	0	0	0	0	110.1	R241 R242	T227-R241 HydrophobicContact CG2-CB 3.83Å; T227-R241 HydrophobicContact CG2-CG 4.39Å; T227-R242 CarbonylContact C-O 3.31Å; T227-R242 WeakPolarHBondContact CA-O 3.42Å
228	V	95.9	Very high	93.6	Very high	7 Å²	7	66.2 Å²	66.2	4%	0.042	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	139.5	171.1	72.4	0	0	0	0	110.2	I176 K184 V186 L230 R241 R242 Y244	I176-V228 HydrophobicContact CD1-CB 4.18Å; I176-V228 HydrophobicContact CD1-CG1 3.61Å; I176-V228 HydrophobicContact CG2-CG1 4.08Å; K184-V228 HydrophobicContact CB-CG2 4.47Å; K184-V228 HydrophobicContact CD-CG2 3.68Å; K184-V228 HydrophobicContact CG-CG2 4.36Å; V186-V228 HydrophobicContact CG1-CG2 4.13Å; V228-L230 HydrophobicContact CG1-CD2 4.26Å; V228-L230 HydrophobicContact CG1-CG 4.41Å; V228-L230 HydrophobicContact CG2-CD2 4.23Å; V228-R241 CarbonylContact O-C 3.57Å; V228-R241 WeakPolarHBondContact O-CA 3.18Å; V228-R242 HydrophobicContact CG1-CB 3.83Å; V228-R242 WeakPolarHBondContact CG1-O 3.28Å; V228-R242 PolarHBondContact N-O 3.25Å; V228-R242 PolarHBondContact O-N 3.03Å; V228-Y244 HydrophobicContact CB-CE1 4.43Å
229	H	96.6	Very high	93.6	Very high	90 Å²	90	69.8 Å²	69.8	42%	0.417	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121	171.7	-61.7	-96.2	0	0	0	109.1	I239	H229-I239 HydrophobicContact CB-CG2 4.02Å
230	L	97.3	Very high	93.7	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.01	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	140.3	174.4	-56.3	-178.4	0	0	0	109.2	I176 I178 C181 K184 V228 I239 V240	I176-L230 HydrophobicContact CG2-CD1 4.17Å; I178-L230 HydrophobicContact CB-CD1 3.87Å; I178-L230 HydrophobicContact CD1-CD1 3.61Å; I178-L230 HydrophobicContact CG1-CD1 3.54Å; C181-L230 HydrophobicContact CB-CB 4.07Å; C181-L230 HydrophobicContact CB-CD1 4.45Å; K184-L230 HydrophobicContact CB-CD2 3.58Å; V228-L230 HydrophobicContact CG1-CD2 4.26Å; V228-L230 HydrophobicContact CG1-CG 4.41Å; V228-L230 HydrophobicContact CG2-CD2 4.23Å; L230-I239 WeakPolarHBondContact O-CA 3.13Å; L230-V240 PolarHBondContact N-O 3.28Å; L230-V240 PolarHBondContact O-N 3.34Å
231	R	97.4	Very high	93.7	Very high	192 Å²	192	77.6 Å²	77.6	73%	0.725	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.7	174.9	-69.2	-177.3	-177.6	141.8	-2	109.5	C181 L182 P238	C181-R231 CarbonylContact C-O 3.58Å; C181-R231 WeakPolarHBondContact CA-O 3.21Å; L182-R231 HydrophobicContact CD1-CB 4.31Å; L182-R231 PolarHBondContact N-O 3.22Å; R231-P238 CarbonylContact C-O 3.57Å; R231-P238 WeakPolarHBondContact CA-O 3.17Å
232	C	96.7	Very high	93.8	Very high	1 Å²	1	82.3 Å²	82.3	1%	0.007	41%	0.414	C	S	.	.			trans	-128.8	84.8	-173.4	-45.9	0	0	0	0	109.4	G180 C181 N234 R235 P238 V240	G180-C232 WeakPolarHBondContact O-CA 3.47Å; G180-C232 WeakPolarHBondContact O-CB 3.36Å; C181-C232 HydrophobicContact CB-CB 3.99Å; C181-C232 WeakPolarHBondContact CB-SG 3.33Å; C181-C232 WeakPolarHBondContact SG-CB 3.2Å; C181-C232 CovalentContact SG-SG 2.03Å; C181-C232 PolarHBondContact SG-SG 3.03Å; C232-N234 PolarHBondContact O-N 3.12Å; C232-R235 HydrophobicContact CB-CB 3.99Å; C232-R235 HydrophobicContact CB-CG 3.94Å; C232-R235 PolarHBondContact O-N 2.98Å; C232-P238 PolarHBondContact N-O 3.24Å; C232-V240 WeakPolarHBondContact SG-CG2 3.34Å
233	P	94.4	Very high	93.7	Very high	91 Å²	91	84.9 Å²	84.9	59%	0.591	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.5	-169.8	24.5	-33.9	0	0	0	113.9
234	N	91.4	Very high	93.6	Very high	150 Å²	150	85.7 Å²	85.7	80%	0.802	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	12.8	-175.1	-57	-17	0	0	0	113.1	C232	C232-N234 PolarHBondContact O-N 3.12Å
235	R	91.1	Very high	93.6	Very high	108 Å²	108	87.3 Å²	87.3	41%	0.408	43%	0.429	S	S	.	.	S	Bend	trans	-110.4	148	178.6	-68	-171.4	177.5	-137.2	-2.2	109.9	D179 C232 T237	D179-R235 PolarHBondContact O-NE 3.34Å; D179-R235 PolarHBondContact O-NH2 3.33Å; C232-R235 HydrophobicContact CB-CB 3.99Å; C232-R235 HydrophobicContact CB-CG 3.94Å; C232-R235 PolarHBondContact O-N 2.98Å; R235-T237 PolarHBondContact O-N 3.21Å
236	V	92.1	Very high	93.7	Very high	155 Å²	155	87.8 Å²	87.8	94%	0.939	43%	0.426	S	S	*	.	S	Bend	trans	-55	-36	171.4	-178.3	0	0	0	0	111.2	P238	V236-P238 VanDerWaalsContact O-CD 3.31Å; V236-P238 WeakPolarHBondContact O-CD 3.17Å
237	T	90.4	Very high	93.7	Very high	85 Å²	85	86.2 Å²	86.2	52%	0.521	42%	0.416	S	S	.	.	S	Bend	trans	-94.7	104.8	170.7	46.3	0	0	0	0	110.1	R235 I239	R235-T237 PolarHBondContact O-N 3.21Å; T237-I239 PolarHBondContact O-N 3.45Å; T237-I239 VanDerWaalsContact O-N 3.15Å
238	P	92.6	Very high	93.7	Very high	85 Å²	85	88.6 Å²	88.6	55%	0.552	42%	0.422	S	S	*	.	S	Bend	trans	-70.6	-13.4	-173.2	27.2	-35.8	0	0	0	113.6	R231 C232 V236	R231-P238 CarbonylContact C-O 3.57Å; R231-P238 WeakPolarHBondContact CA-O 3.17Å; C232-P238 PolarHBondContact N-O 3.24Å; V236-P238 VanDerWaalsContact O-CD 3.31Å; V236-P238 WeakPolarHBondContact O-CD 3.17Å
239	I	96	Very high	93.7	Very high	98 Å²	98	93 Å²	93	50%	0.503	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	122.8	179.7	-58.5	174.6	0	0	0	109.8	H229 L230 T237	H229-I239 HydrophobicContact CB-CG2 4.02Å; L230-I239 WeakPolarHBondContact O-CA 3.13Å; T237-I239 PolarHBondContact O-N 3.45Å; T237-I239 VanDerWaalsContact O-N 3.15Å
240	V	95.2	Very high	93.7	Very high	28 Å²	28	89.4 Å²	89.4	17%	0.17	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.7	173.2	173.3	0	0	0	0	109.6	I178 L230 C232	I178-V240 HydrophobicContact CD1-CG1 4.1Å; L230-V240 PolarHBondContact N-O 3.28Å; L230-V240 PolarHBondContact O-N 3.34Å; C232-V240 WeakPolarHBondContact SG-CG2 3.34Å
241	R	94.6	Very high	93.6	Very high	187 Å²	187	91.4 Å²	91.4	71%	0.706	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	129.4	177.2	-60.6	-177.5	-172.8	-163	0.8	109.6	T227 V228	T227-R241 HydrophobicContact CG2-CB 3.83Å; T227-R241 HydrophobicContact CG2-CG 4.39Å; V228-R241 CarbonylContact O-C 3.57Å; V228-R241 WeakPolarHBondContact O-CA 3.18Å
242	R	91.8	Very high	93.5	Very high	141 Å²	141	83.9 Å²	83.9	53%	0.532	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127	176.3	-178.4	64.6	172.3	130.5	-0.4	110.1	I176 I178 T227 V228	I176-R242 HydrophobicContact CG2-CG 4.29Å; I178-R242 HydrophobicContact CD1-CB 3.87Å; I178-R242 HydrophobicContact CD1-CG 4.03Å; T227-R242 CarbonylContact C-O 3.31Å; T227-R242 WeakPolarHBondContact CA-O 3.42Å; V228-R242 HydrophobicContact CG1-CB 3.83Å; V228-R242 WeakPolarHBondContact CG1-O 3.28Å; V228-R242 PolarHBondContact N-O 3.25Å; V228-R242 PolarHBondContact O-N 3.03Å
243	K	91.3	Very high	93.3	Very high	140 Å²	140	85 Å²	85	61%	0.609	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	144	172.3	-69.6	178.4	-178.9	179.6	0	110.6	T225 V226	T225-K243 HydrophobicContact CG2-CB 3.77Å; T225-K243 HydrophobicContact CG2-CD 3.96Å; T225-K243 HydrophobicContact CG2-CG 4.04Å; V226-K243 CarbonylContact O-C 3.52Å; V226-K243 WeakPolarHBondContact O-CA 3.21Å
244	Y	89.4	Confident	93.2	Very high	27 Å²	27	81.8 Å²	81.8	11%	0.106	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	153.2	169.2	73.8	-82.8	0	0	0	110.6	I176 V186 V226 V228 K246	I176-Y244 HydrophobicContact CD1-CD1 3.68Å; I176-Y244 HydrophobicContact CD1-CE1 4.07Å; I176-Y244 HydrophobicContact CD1-CG 4.09Å; V186-Y244 HydrophobicContact CG1-CE1 4.44Å; V186-Y244 HydrophobicContact CG2-CE1 4.27Å; V186-Y244 HydrophobicContact CG2-CE2 4.07Å; V226-Y244 HydrophobicContact CB-CD1 4.2Å; V226-Y244 HydrophobicContact CB-CE1 3.62Å; V226-Y244 HydrophobicContact CB-CE2 4.39Å; V226-Y244 HydrophobicContact CG1-CE1 3.64Å; V226-Y244 PolarHBondContact N-O 3.41Å; V226-Y244 VanDerWaalsContact O-CD1 3.31Å; V226-Y244 WeakPolarHBondContact O-CD1 3.35Å; V226-Y244 PolarHBondContact O-N 3.4Å; V228-Y244 HydrophobicContact CB-CE1 4.43Å; Y244-K246 HydrophobicContact CE2-CB 4Å
245	F	91	Very high	93	Very high	75 Å²	75	76.7 Å²	76.7	33%	0.329	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	124.5	174.1	-67.5	-66.5	0	0	0	111	N188 V223 S262 A265	N188-F245 PolarHBondContact ND2-O 2.96Å; V223-F245 HydrophobicContact CG1-CB 3.97Å; V223-F245 HydrophobicContact CG1-CD1 3.88Å; V223-F245 HydrophobicContact CG1-CG 4.31Å; F245-S262 VanDerWaalsContact CE1-O 3.22Å; F245-S262 WeakPolarHBondContact CE1-O 3.41Å; F245-A265 HydrophobicContact CE1-CB 4.12Å; F245-A265 HydrophobicContact CZ-CB 4.11Å; F245-A265 VanDerWaalsContact CZ-O 3.31Å; F245-A265 WeakPolarHBondContact CZ-O 3.47Å
246	K	93.2	Very high	92.6	Very high	73 Å²	73	75.7 Å²	75.7	32%	0.317	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	116.1	173.3	-173.8	173.5	-178.2	177.6	0	110.1	N188 V223 T224 V226 Y244	N188-K246 VanDerWaalsContact OD1-CA 3.28Å; N188-K246 WeakPolarHBondContact OD1-CA 3.49Å; V223-K246 WeakPolarHBondContact CA-O 3.47Å; T224-K246 PolarHBondContact N-O 3.37Å; T224-K246 WeakPolarHBondContact O-CA 3.1Å; T224-K246 PolarHBondContact O-N 3.34Å; T224-K246 PolarHBondContact OG1-O 3.12Å; V226-K246 HydrophobicContact CG2-CB 3.73Å; V226-K246 HydrophobicContact CG2-CD 3.93Å; V226-K246 HydrophobicContact CG2-CG 4.48Å; Y244-K246 HydrophobicContact CE2-CB 4Å
247	V	94.3	Very high	92.1	Very high	15 Å²	15	71.9 Å²	71.9	9%	0.091	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	127.3	173.2	173.6	0	0	0	0	108.6	T169 N188 N189 P220 V223	T169-V247 HydrophobicContact CG2-CG1 4.46Å; N188-V247 PolarHBondContact OD1-N 3.16Å; N188-V247 VanDerWaalsContact OD1-N 3.1Å; N189-V247 HydrophobicContact CB-CB 4.01Å; N189-V247 HydrophobicContact CB-CG1 4.17Å; N189-V247 WeakPolarHBondContact CB-O 3.45Å; N189-V247 PolarHBondContact ND2-O 3.44Å; N189-V247 WeakPolarHBondContact O-CB 3.09Å; P220-V247 HydrophobicContact CB-CG1 3.96Å; P220-V247 HydrophobicContact CB-CG2 4.09Å; P220-V247 HydrophobicContact CG-CG1 4.04Å; P220-V247 HydrophobicContact CG-CG2 3.77Å; V223-V247 HydrophobicContact CG2-CG2 4.31Å
248	K	95.4	Very high	91.4	Very high	110 Å²	110	71.9 Å²	71.9	48%	0.478	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-44.9	175.9	-75.5	-173.9	168.9	177.9	0	111.9	Q222 T224	Q222-K248 HydrophobicContact CB-CB 3.86Å; Q222-K248 PolarHBondContact O-N 3.04Å; T224-K248 HydrophobicContact CG2-CD 3.76Å; T224-K248 HydrophobicContact CG2-CG 4.39Å; T224-K248 WeakPolarHBondContact OG1-CE 3.47Å
249	Q	96.1	Very high	90.4	Very high	100 Å²	100	72 Å²	72	47%	0.467	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	150.5	-174.9	-66.2	-175.5	-13.5	0	0	111	T169 P220 T221 Q222	T169-Q249 WeakPolarHBondContact OG1-CA 3.49Å; P220-Q249 WeakPolarHBondContact CA-O 3.41Å; T221-Q249 PolarHBondContact N-O 3.29Å; Q222-Q249 HydrophobicContact CB-CB 4.18Å; Q222-Q249 HydrophobicContact CG-CB 4.35Å; Q222-Q249 PolarHBondContact N-O 2.91Å; Q222-Q249 PolarHBondContact O-N 3.4Å
250	C	96	Very high	89.1	Confident	15 Å²	15	68.9 Å²	68.9	10%	0.101	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.4	178.5	-56.5	0	0	0	0	109.3	T169 C191 R219	T169-C250 WeakPolarHBondContact OG1-CB 3.41Å; T169-C250 PolarHBondContact OG1-N 3.4Å; T169-C250 PolarHBondContact OG1-SG 3.38Å; C191-C250 WeakPolarHBondContact CA-SG 3.12Å; C191-C250 HydrophobicContact CB-CB 3.67Å; C191-C250 WeakPolarHBondContact CB-SG 3.28Å; C191-C250 WeakPolarHBondContact SG-CB 3.31Å; C191-C250 CovalentContact SG-SG 2.02Å; C191-C250 PolarHBondContact SG-SG 3.44Å; R219-C250 WeakPolarHBondContact O-CA 3.4Å
251	S	95.4	Very high	87.6	Confident	43 Å²	43	73.2 Å²	73.2	30%	0.301	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	165.9	169.7	68.6	0	0	0	0	111.4	C167 R219 T221 M253	C167-S251 WeakPolarHBondContact SG-CA 3.28Å; C167-S251 PolarHBondContact SG-N 3.14Å; R219-S251 PolarHBondContact N-O 3.47Å; R219-S251 VanDerWaalsContact N-O 3.17Å; R219-S251 PolarHBondContact O-N 3.04Å; R219-S251 VanDerWaalsContact O-N 3.14Å; T221-S251 WeakPolarHBondContact OG1-CB 3.45Å; T221-S251 PolarHBondContact OG1-N 3.22Å; T221-S251 PolarHBondContact OG1-OG 2.96Å; S251-M253 PolarHBondContact O-N 3.07Å; S251-M253 WeakPolarHBondContact OG-CG 3.42Å
252	C	95.5	Very high	86.2	Confident	34 Å²	34	66.1 Å²	66.1	23%	0.23	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	115.6	169.4	-68.3	0	0	0	0	108.7	C195	C195-C252 VanDerWaalsContact CA-SG 3.6Å; C195-C252 HydrophobicContact CB-CB 3.63Å; C195-C252 WeakPolarHBondContact CB-SG 3.27Å; C195-C252 WeakPolarHBondContact SG-CA 3.28Å; C195-C252 WeakPolarHBondContact SG-CB 3.18Å; C195-C252 CovalentContact SG-SG 2.03Å; C195-C252 PolarHBondContact SG-SG 3.41Å
253	M	91.9	Very high	84.4	Confident	26 Å²	26	62.7 Å²	62.7	13%	0.128	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	156.2	-179.4	-59	178.3	75.9	0	0	109.6	S216 V217 R219 T221 S251 A255 E257	S216-M253 CarbonylContact C-O 3.53Å; S216-M253 WeakPolarHBondContact CA-O 3.31Å; V217-M253 PolarHBondContact N-O 3.48Å; V217-M253 PolarHBondContact O-N 3.32Å; R219-M253 HydrophobicContact CG-CB 4.45Å; R219-M253 HydrophobicContact CG-SD 4.47Å; T221-M253 HydrophobicContact CG2-CE 4.13Å; T221-M253 HydrophobicContact CG2-SD 3.76Å; T221-M253 PolarHBondContact OG1-SD 3.25Å; S251-M253 PolarHBondContact O-N 3.07Å; S251-M253 WeakPolarHBondContact OG-CG 3.42Å; M253-A255 PolarHBondContact O-N 3.47Å; M253-E257 VanDerWaalsContact CE-CD 3.4Å; M253-E257 HydrophobicContact CE-CG 4.48Å; M253-E257 WeakPolarHBondContact CE-OE1 3.33Å; M253-E257 VanDerWaalsContact CE-OE2 3.3Å; M253-E257 WeakPolarHBondContact CE-OE2 3.45Å
254	S	91.4	Very high	82.6	Confident	23 Å²	23	60.5 Å²	60.5	16%	0.161	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	135.4	175.9	70.6	0	0	0	0	110.4	Y215 R219 S256 E257	Y215-S254 WeakPolarHBondContact O-CA 3.48Å; R219-S254 PolarHBondContact NH2-O 3.19Å; S254-S256 PolarHBondContact O-N 3.14Å; S254-E257 WeakPolarHBondContact O-CB 3.24Å; S254-E257 PolarHBondContact O-N 2.99Å; S254-E257 WeakPolarHBondContact OG-CB 3.48Å; S254-E257 PolarHBondContact OG-N 2.85Å
255	A	87.4	Confident	80.3	Confident	43 Å²	43	65 Å²	65	36%	0.355	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.8	-178.5	0	0	0	0	0	112.8	Y215 V217 M253 E257	Y215-A255 HydrophobicContact CD1-CB 3.34Å; Y215-A255 HydrophobicContact CE1-CB 3.71Å; Y215-A255 HydrophobicContact CG-CB 4.44Å; Y215-A255 PolarHBondContact O-N 3.03Å; V217-A255 HydrophobicContact CG2-CB 3.98Å; M253-A255 PolarHBondContact O-N 3.47Å; A255-E257 VanDerWaalsContact C-N 3.33Å
256	S	83.5	Confident	79.8	Confident	86 Å²	86	64.5 Å²	64.5	60%	0.601	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.2	179	57	0	0	0	0	114	S254	S254-S256 PolarHBondContact O-N 3.14Å
257	E	82.1	Confident	79.1	Confident	76 Å²	76	64.1 Å²	64.1	36%	0.355	40%	0.399	S	S	.	.	S	Bend	trans	-73.4	134.2	175.8	173.5	178.7	-175.1	0	0	110	R219 M253 S254 A255	R219-E257 VanDerWaalsContact CZ-O 3.25Å; R219-E257 PolarHBondContact NH1-O 2.85Å; R219-E257 VanDerWaalsContact NH2-CB 3.29Å; R219-E257 PolarHBondContact NH2-O 3.16Å; R219-E257 IonicContact NH2-OE2 3.95Å; M253-E257 VanDerWaalsContact CE-CD 3.4Å; M253-E257 HydrophobicContact CE-CG 4.48Å; M253-E257 WeakPolarHBondContact CE-OE1 3.33Å; M253-E257 VanDerWaalsContact CE-OE2 3.3Å; M253-E257 WeakPolarHBondContact CE-OE2 3.45Å; S254-E257 WeakPolarHBondContact O-CB 3.24Å; S254-E257 PolarHBondContact O-N 2.99Å; S254-E257 WeakPolarHBondContact OG-CB 3.48Å; S254-E257 PolarHBondContact OG-N 2.85Å; A255-E257 VanDerWaalsContact C-N 3.33Å
258	P	75.4	Confident	78.2	Confident	85 Å²	85	66.8 Å²	66.8	55%	0.552	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-57.8	147.4	176.3	-23.2	33.1	0	0	0	111.9
259	L	71.4	Confident	77.2	Confident	88 Å²	88	64.2 Å²	64.2	46%	0.461	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-64.8	143.9	170.9	-68.3	175	0	0	0	109.7	Y263	L259-Y263 HydrophobicContact CB-CD2 3.97Å; L259-Y263 HydrophobicContact CB-CG 4.17Å; L259-Y263 HydrophobicContact CD1-CD1 4.23Å; L259-Y263 HydrophobicContact CD1-CD2 4.36Å; L259-Y263 HydrophobicContact CD1-CG 4.09Å; L259-Y263 HydrophobicContact CD2-CD2 4.34Å; L259-Y263 HydrophobicContact CD2-CE2 4.26Å; L259-Y263 HydrophobicContact CG-CD2 4.46Å
260	P	67.7	Low	76.1	Confident	32 Å²	32	62 Å²	62	21%	0.208	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-58.2	147.1	178	20.4	-29.5	0	0	0	110.4	S262 Y263	P260-S262 PolarHBondContact O-N 3.16Å; P260-Y263 HydrophobicContact CG-CD2 4.09Å; P260-Y263 HydrophobicContact CG-CE2 4.46Å; P260-Y263 PolarHBondContact O-N 2.97Å
261	P	65	Low	74.7	Confident	118 Å²	118	65.1 Å²	65.1	77%	0.766	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-53.5	-22	-175.9	-24.7	31.2	0	0	0	114.1	Y263 A264	P261-Y263 PolarHBondContact O-N 3.41Å; P261-A264 PolarHBondContact O-N 2.98Å
262	S	64.1	Low	73.3	Confident	39 Å²	39	66.7 Å²	66.7	27%	0.273	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-55.8	-17.5	172.4	57	0	0	0	0	114.8	V223 F245 P260	V223-S262 WeakPolarHBondContact O-CB 3.18Å; V223-S262 PolarHBondContact O-OG 3.23Å; F245-S262 VanDerWaalsContact CE1-O 3.22Å; F245-S262 WeakPolarHBondContact CE1-O 3.41Å; P260-S262 PolarHBondContact O-N 3.16Å
263	Y	55.7	Low	71.5	Confident	68 Å²	68	69.2 Å²	69.2	27%	0.267	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-84.8	-22.6	173.4	-92.3	-82.9	0	0	0	114.3	P220 V223 L259 P260 P261 A265	P220-Y263 HydrophobicContact CB-CE2 4.1Å; P220-Y263 WeakPolarHBondContact CB-OH 3.46Å; P220-Y263 WeakPolarHBondContact CG-OH 3.48Å; V223-Y263 HydrophobicContact CB-CD2 4.33Å; V223-Y263 HydrophobicContact CB-CE2 4Å; V223-Y263 HydrophobicContact CG2-CD2 4.07Å; V223-Y263 HydrophobicContact CG2-CE2 3.28Å; L259-Y263 HydrophobicContact CB-CD2 3.97Å; L259-Y263 HydrophobicContact CB-CG 4.17Å; L259-Y263 HydrophobicContact CD1-CD1 4.23Å; L259-Y263 HydrophobicContact CD1-CD2 4.36Å; L259-Y263 HydrophobicContact CD1-CG 4.09Å; L259-Y263 HydrophobicContact CD2-CD2 4.34Å; L259-Y263 HydrophobicContact CD2-CE2 4.26Å; L259-Y263 HydrophobicContact CG-CD2 4.46Å; P260-Y263 HydrophobicContact CG-CD2 4.09Å; P260-Y263 HydrophobicContact CG-CE2 4.46Å; P260-Y263 PolarHBondContact O-N 2.97Å; P261-Y263 PolarHBondContact O-N 3.41Å; Y263-A265 PolarHBondContact O-N 3.11Å
264	A	51.9	Low	69.8	Low	94 Å²	94	72.8 Å²	72.8	78%	0.777	48%	0.482	S	S	*	.			trans	-83	26.7	-169.4	0	0	0	0	0	113.8	P261	P261-A264 PolarHBondContact O-N 2.98Å
265	A	42.5	Very low	67.9	Low	122 Å²	122	77.4 Å²	77.4	100%	1.008	51%	0.511	S	S	*	.			trans	-103.7	0	-175.2	0	0	0	0	0	113.9	F245 Y263	F245-A265 HydrophobicContact CE1-CB 4.12Å; F245-A265 HydrophobicContact CZ-CB 4.11Å; F245-A265 VanDerWaalsContact CZ-O 3.31Å; F245-A265 WeakPolarHBondContact CZ-O 3.47Å; Y263-A265 PolarHBondContact O-N 3.11Å

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