A0A077YZV0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YZV0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 200 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	36.7	Very low	44.7	Very low	243 Å²	243	160.3 Å²	160.3	100%	1.197	75%	0.75	S	S	*	*				0	102.6	0	-85.3	-175.2	-99.5	0	0	108.4	K3	M1-K3 PolarHBondContact O-N 3.48Å
2	A	44.1	Very low	45.7	Very low	75 Å²	75	164.2 Å²	164.2	62%	0.62	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-75.3	120.8	169.6	0	0	0	0	0	108.3
3	K	41.1	Very low	45.8	Very low	180 Å²	180	164.7 Å²	164.7	78%	0.783	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-86.2	117.3	173.5	-80.5	-179	176.1	178.3	0	108	M1	M1-K3 PolarHBondContact O-N 3.48Å
4	W	44.8	Very low	46.5	Very low	134 Å²	134	163.7 Å²	163.7	51%	0.508	77%	0.772	S	S	.	*	P	Polyproline II helix	trans	-85.6	135.3	172.7	-58.4	96.6	0	0	0	109.8	I16 L22 F23	W4-I16 HydrophobicContact CD2-CD1 4.29Å; W4-I16 HydrophobicContact CE3-CD1 3.65Å; W4-I16 HydrophobicContact CE3-CG1 4.05Å; W4-I16 HydrophobicContact CZ3-CD1 3.78Å; W4-I16 HydrophobicContact CZ3-CG1 4.15Å; W4-L22 HydrophobicContact CH2-CD2 3.98Å; W4-L22 HydrophobicContact CZ3-CD2 4.41Å; W4-F23 HydrophobicContact CZ3-CE1 4.46Å
5	Y	45.5	Very low	47.7	Very low	193 Å²	193	159.9 Å²	159.9	76%	0.757	75%	0.748	S	S	*	*			trans	-107.4	119.7	169	-84.2	-89.5	0	0	0	108.7
6	V	44.3	Very low	48.7	Very low	99 Å²	99	155.5 Å²	155.5	60%	0.6	73%	0.73	S	S	*	*			trans	-97.5	114.3	172.8	-179.1	0	0	0	0	107.1	L14	V6-L14 HydrophobicContact CG1-CD2 3.95Å
7	S	45	Very low	49.5	Very low	68 Å²	68	150.6 Å²	150.6	48%	0.476	72%	0.717	S	S	.	*			trans	-99.5	143.2	175.9	-170.2	0	0	0	0	110.7
8	R	39	Very low	50.7	Low	232 Å²	232	144.5 Å²	144.5	88%	0.875	70%	0.7	S	S	*	*			trans	-98.7	120.7	175.2	-89	-175.2	177.9	-178.2	-0.3	109.8
9	M	43.5	Very low	51.9	Low	146 Å²	146	143.5 Å²	143.5	72%	0.719	70%	0.699	S	S	*	*			trans	-104.7	162.7	153	-73.9	-129.1	-159.3	0	0	110	D11	M9-D11 PolarHBondContact O-N 2.74Å
10	R	55	Low	53	Low	247 Å²	247	142.6 Å²	142.6	93%	0.932	69%	0.691	S	S	*	*	S	Bend	trans	-65.2	-7.5	-158.9	-94.9	-179.7	-92.7	-173.1	-5.2	117
11	D	52.9	Low	54.2	Low	146 Å²	146	138.5 Å²	138.5	78%	0.781	68%	0.676	S	S	*	*	S	Bend	trans	-116.8	132.4	176.8	-65	-44.6	0	0	0	110	M9 Q13	M9-D11 PolarHBondContact O-N 2.74Å; D11-Q13 PolarHBondContact O-N 3.04Å
12	Q	56	Low	56.1	Low	207 Å²	207	131.3 Å²	131.3	97%	0.967	64%	0.642	S	S	*	*	S	Bend	trans	-68.2	45.5	-159.5	-63.9	178.5	-22.1	0	0	116.6
13	Q	47.7	Very low	57.7	Low	171 Å²	171	132 Å²	132	80%	0.799	63%	0.631	S	S	*	*			trans	-106.8	114.3	162.4	-89.8	179.5	-11.4	0	0	110.3	D11 Y15	D11-Q13 PolarHBondContact O-N 3.04Å; Q13-Y15 PolarHBondContact O-N 3.12Å; Q13-Y15 VanDerWaalsContact O-N 3.12Å
14	L	55.8	Low	59.6	Low	151 Å²	151	124.6 Å²	124.6	79%	0.791	60%	0.602	S	S	*	*			trans	-61.6	110.7	163.9	-69.7	164.6	0	0	0	107.2	V6	V6-L14 HydrophobicContact CG1-CD2 3.95Å
15	Y	63.6	Low	60.9	Low	107 Å²	107	123.4 Å²	123.4	42%	0.42	62%	0.621	S	S	.	*			trans	-110.6	149.6	168.4	69.9	-86.9	0	0	0	109.2	Q13	Q13-Y15 PolarHBondContact O-N 3.12Å; Q13-Y15 VanDerWaalsContact O-N 3.12Å
16	I	64	Low	62.1	Low	89 Å²	89	119 Å²	119	46%	0.456	62%	0.618	S	S	.	*			trans	-105.2	124.4	177	-172.9	157.7	0	0	0	107.6	W4 F23	W4-I16 HydrophobicContact CD2-CD1 4.29Å; W4-I16 HydrophobicContact CE3-CD1 3.65Å; W4-I16 HydrophobicContact CE3-CG1 4.05Å; W4-I16 HydrophobicContact CZ3-CD1 3.78Å; W4-I16 HydrophobicContact CZ3-CG1 4.15Å; I16-F23 HydrophobicContact CB-CE1 4.05Å; I16-F23 HydrophobicContact CB-CZ 4.22Å; I16-F23 HydrophobicContact CD1-CE1 3.83Å; I16-F23 HydrophobicContact CG1-CE1 3.69Å; I16-F23 HydrophobicContact CG1-CZ 4.02Å; I16-F23 HydrophobicContact CG2-CD1 4.28Å; I16-F23 HydrophobicContact CG2-CE1 3.26Å; I16-F23 HydrophobicContact CG2-CZ 3.46Å; I16-F23 VanDerWaalsContact CG2-CZ 3.46Å
17	S	62.2	Low	63.3	Low	73 Å²	73	115.2 Å²	115.2	51%	0.51	60%	0.599	S	S	.	*			trans	-94.9	126.5	176.7	56.1	0	0	0	0	109.8
18	G	71.9	Confident	64.9	Low	40 Å²	40	117.9 Å²	117.9	41%	0.412	60%	0.602	S	S	.	*	S	Bend	trans	179.8	163.9	176.1	0	0	0	0	0	110.1
19	D	72.8	Confident	66.9	Low	126 Å²	126	108.9 Å²	108.9	67%	0.674	58%	0.575	S	S	*	*			trans	-58	139.9	172.2	-62.9	-38.2	0	0	0	109.1	C21 L22	D19-C21 PolarHBondContact O-N 2.94Å; D19-L22 HydrophobicContact CB-CD1 4.24Å; D19-L22 VanDerWaalsContact O-CB 3.31Å; D19-L22 WeakPolarHBondContact O-CB 3.44Å; D19-L22 PolarHBondContact O-N 2.83Å
20	K	73.3	Confident	68.6	Low	125 Å²	125	107.6 Å²	107.6	54%	0.543	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-52.8	-31	-174.3	-62.2	173.8	-171.7	171.1	0	112.6	L22 F23 D32	K20-L22 PolarHBondContact O-N 2.99Å; K20-F23 WeakPolarHBondContact O-CD2 3.42Å; K20-F23 PolarHBondContact O-N 2.05Å; K20-D32 HydrophobicContact CB-CB 4.38Å; K20-D32 HydrophobicContact CD-CB 3.54Å; K20-D32 VanDerWaalsContact CD-CG 3.46Å; K20-D32 IonicContact NZ-OD2 2.68Å; K20-D32 PolarHBondContact NZ-OD2 3.27Å
21	C	78.4	Confident	69.5	Low	57 Å²	57	99.2 Å²	99.2	39%	0.385	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-72	-19.9	177.7	-55.9	0	0	0	0	115.3	D19 F23 C24 C29	D19-C21 PolarHBondContact O-N 2.94Å; C21-F23 PolarHBondContact O-N 3.35Å; C21-C24 PolarHBondContact O-N 3.45Å; C21-C29 WeakPolarHBondContact CA-SG 3.31Å; C21-C29 HydrophobicContact CB-CB 3.33Å; C21-C29 WeakPolarHBondContact CB-SG 3.04Å; C21-C29 WeakPolarHBondContact SG-CB 3.16Å; C21-C29 CovalentContact SG-SG 2.03Å; C21-C29 PolarHBondContact SG-SG 3.48Å
22	L	78	Confident	70.8	Confident	92 Å²	92	96.5 Å²	96.5	48%	0.482	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-65	-20.5	174.9	-101	142.6	0	0	0	112.5	W4 D19 K20	W4-L22 HydrophobicContact CH2-CD2 3.98Å; W4-L22 HydrophobicContact CZ3-CD2 4.41Å; D19-L22 HydrophobicContact CB-CD1 4.24Å; D19-L22 VanDerWaalsContact O-CB 3.31Å; D19-L22 WeakPolarHBondContact O-CB 3.44Å; D19-L22 PolarHBondContact O-N 2.83Å; K20-L22 PolarHBondContact O-N 2.99Å
23	F	77	Confident	71.8	Confident	88 Å²	88	92.5 Å²	92.5	39%	0.386	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-85.6	-6.1	-178.7	-59.2	-64.4	0	0	0	114.1	W4 I16 K20 C21 A25	W4-F23 HydrophobicContact CZ3-CE1 4.46Å; I16-F23 HydrophobicContact CB-CE1 4.05Å; I16-F23 HydrophobicContact CB-CZ 4.22Å; I16-F23 HydrophobicContact CD1-CE1 3.83Å; I16-F23 HydrophobicContact CG1-CE1 3.69Å; I16-F23 HydrophobicContact CG1-CZ 4.02Å; I16-F23 HydrophobicContact CG2-CD1 4.28Å; I16-F23 HydrophobicContact CG2-CE1 3.26Å; I16-F23 HydrophobicContact CG2-CZ 3.46Å; I16-F23 VanDerWaalsContact CG2-CZ 3.46Å; K20-F23 WeakPolarHBondContact O-CD2 3.42Å; K20-F23 PolarHBondContact O-N 2.05Å; C21-F23 PolarHBondContact O-N 3.35Å; F23-A25 PolarHBondContact O-N 3.48Å
24	C	80.3	Confident	73.5	Confident	25 Å²	25	87.7 Å²	87.7	17%	0.169	52%	0.516	C	S	.	.			trans	-70.2	104.6	176.6	-56.2	0	0	0	0	109.3	C21 S26 C34	C21-C24 PolarHBondContact O-N 3.45Å; C24-S26 PolarHBondContact O-N 2.83Å; C24-C34 WeakPolarHBondContact CA-SG 3.27Å; C24-C34 HydrophobicContact CB-CB 3.83Å; C24-C34 WeakPolarHBondContact CB-SG 3.07Å; C24-C34 WeakPolarHBondContact SG-CA 3.03Å; C24-C34 WeakPolarHBondContact SG-CB 3.41Å; C24-C34 CovalentContact SG-SG 2.05Å; C24-C34 PolarHBondContact SG-SG 3.27Å
25	A	73.3	Confident	74.6	Confident	109 Å²	109	83 Å²	83	90%	0.901	49%	0.493	S	S	*	.	S	Bend	trans	-61.3	-29.7	-179.4	0	0	0	0	0	112.5	F23	F23-A25 PolarHBondContact O-N 3.48Å
26	S	70.8	Confident	75	Confident	101 Å²	101	82.6 Å²	82.6	71%	0.706	50%	0.504	S	S	*	.	S	Bend	trans	-162.4	142.9	172.9	55.1	0	0	0	0	108.2	C24	C24-S26 PolarHBondContact O-N 2.83Å
27	G	70	Confident	75.3	Confident	19 Å²	19	83 Å²	83	20%	0.196	51%	0.506	C	S	.	.	S	Bend	trans	113.5	178.3	-178.3	0	0	0	0	0	115.3	V35 D37	G27-V35 CarbonylContact C-O 3.35Å; G27-V35 WeakPolarHBondContact CA-O 3.28Å; G27-D37 VanDerWaalsContact CA-CG 3.46Å; G27-D37 VanDerWaalsContact CA-OD2 3.29Å; G27-D37 WeakPolarHBondContact CA-OD2 3.1Å; G27-D37 PolarHBondContact N-OD2 3.25Å
28	K	78.2	Confident	75.1	Confident	124 Å²	124	84 Å²	84	54%	0.539	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	158.9	175	-55.9	-174.9	179.9	169.9	0	110.5	V35 D37	K28-V35 HydrophobicContact CB-CG2 3.82Å; K28-V35 PolarHBondContact N-O 2.68Å; K28-V35 VanDerWaalsContact O-CG2 3.28Å; K28-V35 WeakPolarHBondContact O-CG2 3.29Å; K28-V35 PolarHBondContact O-N 3.14Å; K28-D37 WeakPolarHBondContact CG-OD1 2.94Å
29	C	80.2	Confident	74.3	Confident	44 Å²	44	88.1 Å²	88.1	30%	0.297	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	120.3	168.7	-169.6	0	0	0	0	108.3	C21 L33	C21-C29 WeakPolarHBondContact CA-SG 3.31Å; C21-C29 HydrophobicContact CB-CB 3.33Å; C21-C29 WeakPolarHBondContact CB-SG 3.04Å; C21-C29 WeakPolarHBondContact SG-CB 3.16Å; C21-C29 CovalentContact SG-SG 2.03Å; C21-C29 PolarHBondContact SG-SG 3.48Å; C29-L33 WeakPolarHBondContact CA-O 3.33Å
30	D	79.6	Confident	73.4	Confident	119 Å²	119	86.9 Å²	86.9	64%	0.636	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.8	174	-175.1	24.5	0	0	0	109.3	D32 L33 V35	D30-D32 PolarHBondContact O-N 2.79Å; D30-D32 VanDerWaalsContact O-N 3.14Å; D30-L33 PolarHBondContact N-O 2.9Å; D30-L33 PolarHBondContact O-N 2.94Å; D30-V35 HydrophobicContact CB-CG1 4.47Å; D30-V35 HydrophobicContact CB-CG2 4.31Å
31	G	74.2	Confident	72.6	Confident	71 Å²	71	89.1 Å²	89.1	73%	0.732	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	41.2	-179.7	0	0	0	0	0	114.7	L33	G31-L33 VanDerWaalsContact C-N 3.32Å; G31-L33 PolarHBondContact O-N 3.45Å
32	D	79	Confident	71.5	Confident	89 Å²	89	91.6 Å²	91.6	48%	0.476	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	10.2	-176	-60.6	-32.5	0	0	0	116.7	K20 D30	K20-D32 HydrophobicContact CB-CB 4.38Å; K20-D32 HydrophobicContact CD-CB 3.54Å; K20-D32 VanDerWaalsContact CD-CG 3.46Å; K20-D32 IonicContact NZ-OD2 2.68Å; K20-D32 PolarHBondContact NZ-OD2 3.27Å; D30-D32 PolarHBondContact O-N 2.79Å; D30-D32 VanDerWaalsContact O-N 3.14Å
33	L	78.5	Confident	70.8	Confident	123 Å²	123	90.3 Å²	90.3	64%	0.644	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	140.4	176	-64.1	173.2	0	0	0	111.6	C29 D30 G31 V35	C29-L33 WeakPolarHBondContact CA-O 3.33Å; D30-L33 PolarHBondContact N-O 2.9Å; D30-L33 PolarHBondContact O-N 2.94Å; G31-L33 VanDerWaalsContact C-N 3.32Å; G31-L33 PolarHBondContact O-N 3.45Å; L33-V35 PolarHBondContact O-N 2.03Å
34	C	81.7	Confident	70.4	Confident	70 Å²	70	91.9 Å²	91.9	47%	0.473	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.6	122	171.2	-59.1	0	0	0	0	110.3	C24	C24-C34 WeakPolarHBondContact CA-SG 3.27Å; C24-C34 HydrophobicContact CB-CB 3.83Å; C24-C34 WeakPolarHBondContact CB-SG 3.07Å; C24-C34 WeakPolarHBondContact SG-CA 3.03Å; C24-C34 WeakPolarHBondContact SG-CB 3.41Å; C24-C34 CovalentContact SG-SG 2.05Å; C24-C34 PolarHBondContact SG-SG 3.27Å
35	V	79	Confident	70.5	Confident	53 Å²	53	92.8 Å²	92.8	32%	0.321	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.7	144.8	176.5	-62.9	0	0	0	0	110	G27 K28 D30 L33	G27-V35 CarbonylContact C-O 3.35Å; G27-V35 WeakPolarHBondContact CA-O 3.28Å; K28-V35 HydrophobicContact CB-CG2 3.82Å; K28-V35 PolarHBondContact N-O 2.68Å; K28-V35 VanDerWaalsContact O-CG2 3.28Å; K28-V35 WeakPolarHBondContact O-CG2 3.29Å; K28-V35 PolarHBondContact O-N 3.14Å; D30-V35 HydrophobicContact CB-CG1 4.47Å; D30-V35 HydrophobicContact CB-CG2 4.31Å; L33-V35 PolarHBondContact O-N 2.03Å
36	P	72.6	Confident	71.1	Confident	98 Å²	98	87.9 Å²	87.9	64%	0.636	53%	0.525	S	S	*	.			trans	-55.3	144.2	178.1	-21.9	31.4	0	0	0	112.5	T38	P36-T38 WeakPolarHBondContact CB-OG1 3.43Å; P36-T38 PolarHBondContact O-N 3.49Å
37	D	70.3	Confident	72.1	Confident	96 Å²	96	87.3 Å²	87.3	51%	0.513	51%	0.51	S	S	.	.	S	Bend	trans	-71.3	-11.4	173.7	-99.4	-38	0	0	0	112.8	G27 K28 T39	G27-D37 VanDerWaalsContact CA-CG 3.46Å; G27-D37 VanDerWaalsContact CA-OD2 3.29Å; G27-D37 WeakPolarHBondContact CA-OD2 3.1Å; G27-D37 PolarHBondContact N-OD2 3.25Å; K28-D37 WeakPolarHBondContact CG-OD1 2.94Å; D37-T39 PolarHBondContact O-N 3.03Å
38	T	58.6	Low	73.2	Confident	94 Å²	94	90.5 Å²	90.5	58%	0.577	52%	0.518	S	S	*	.			trans	-73.3	103.7	-177.4	44.4	0	0	0	0	110.1	P36 T40	P36-T38 WeakPolarHBondContact CB-OG1 3.43Å; P36-T38 PolarHBondContact O-N 3.49Å; T38-T40 WeakPolarHBondContact CB-OG1 3.42Å; T38-T40 PolarHBondContact O-N 3.37Å; T38-T40 PolarHBondContact O-OG1 2.84Å; T38-T40 PolarHBondContact OG1-OG1 3.29Å
39	T	54.9	Low	74.1	Confident	127 Å²	127	84.6 Å²	84.6	78%	0.779	49%	0.493	S	S	*	.			trans	-62.3	46.1	149.2	54.4	0	0	0	0	110.7	D37 E41	D37-T39 PolarHBondContact O-N 3.03Å; T39-E41 PolarHBondContact O-N 2.95Å
40	T	53.6	Low	74.7	Confident	101 Å²	101	86.2 Å²	86.2	62%	0.62	51%	0.509	S	S	*	.			trans	-61.1	110.2	165.3	11.6	0	0	0	0	105.7	T38 E42	T38-T40 WeakPolarHBondContact CB-OG1 3.42Å; T38-T40 PolarHBondContact O-N 3.37Å; T38-T40 PolarHBondContact O-OG1 2.84Å; T38-T40 PolarHBondContact OG1-OG1 3.29Å; T40-E42 PolarHBondContact O-N 2.88Å
41	E	57.1	Low	75.4	Confident	172 Å²	172	85.2 Å²	85.2	80%	0.804	50%	0.504	S	S	*	.	S	Bend	trans	-61.2	3.3	-177	-149.7	178.4	-162.4	0	0	113.5	T39 K47	T39-E41 PolarHBondContact O-N 2.95Å; E41-K47 WeakPolarHBondContact O-CE 3.19Å; E41-K47 PolarHBondContact O-NZ 2.87Å
42	E	55.5	Low	76.6	Confident	108 Å²	108	82.7 Å²	82.7	51%	0.505	47%	0.474	S	S	.	.	S	Bend	trans	-101.6	115.9	177.2	-159.9	172.6	178.4	0	0	108.5	T40 K47	T40-E42 PolarHBondContact O-N 2.88Å; E42-K47 HydrophobicContact CG-CG 4.38Å
43	P	63.3	Low	77.5	Confident	65 Å²	65	80.7 Å²	80.7	42%	0.422	46%	0.464	S	S	.	.			trans	-51.2	140.8	173.3	-20.6	29.9	0	0	0	108.9	C45 G46 K47	P43-C45 PolarHBondContact O-N 2.86Å; P43-G46 PolarHBondContact O-N 3.35Å; P43-K47 HydrophobicContact CG-CG 4.46Å
44	P	67.2	Low	78.4	Confident	121 Å²	121	76.2 Å²	76.2	79%	0.786	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-20.2	-178	21	-32.6	0	0	0	113.3
45	C	82.9	Confident	79.2	Confident	45 Å²	45	72.9 Å²	72.9	30%	0.304	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	7.6	-179.3	-55.7	0	0	0	0	114.4	P43 H101 D147 L148 C149	P43-C45 PolarHBondContact O-N 2.86Å; C45-H101 PolarHBondContact O-CD2 3.03Å; C45-H101 VanDerWaalsContact O-CD2 3.32Å; C45-D147 VanDerWaalsContact CB-O 3.32Å; C45-D147 WeakPolarHBondContact CB-O 3.32Å; C45-L148 HydrophobicContact CB-CD2 4.19Å; C45-C149 PolarHBondContact O-N 2.93Å; C45-C149 PolarHBondContact O-SG 2.88Å
46	G	86.1	Confident	80	Confident	6 Å²	6	72.3 Å²	72.3	6%	0.062	41%	0.413	C	S	.	.			trans	86.4	174.9	-176.8	0	0	0	0	0	114.3	P43	P43-G46 PolarHBondContact O-N 3.35Å
47	K	91.2	Very high	81.1	Confident	89 Å²	89	68.6 Å²	68.6	39%	0.387	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-103.4	155.4	178.4	-66.1	-177.3	-179.7	-178.3	0	111.5	E41 E42 P43 S98 C149	E41-K47 WeakPolarHBondContact O-CE 3.19Å; E41-K47 PolarHBondContact O-NZ 2.87Å; E42-K47 HydrophobicContact CG-CG 4.38Å; P43-K47 HydrophobicContact CG-CG 4.46Å; K47-S98 PolarHBondContact N-O 2.97Å; K47-C149 WeakPolarHBondContact O-CB 3.36Å
48	K	94.3	Very high	82.4	Confident	85 Å²	85	64 Å²	64	37%	0.37	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-58.7	127.8	172.3	179.2	-179.7	-178.2	-166.6	0	109.7	L52 C149 W197 A199 A200	K48-L52 HydrophobicContact CD-CD1 4.37Å; K48-L52 HydrophobicContact CG-CD1 4.26Å; K48-C149 WeakPolarHBondContact CA-O 3.29Å; K48-C149 PolarHBondContact N-O 2.83Å; K48-W197 HydrophobicContact CG-CG 4.43Å; K48-A199 VanDerWaalsContact CE-O 3.3Å; K48-A199 WeakPolarHBondContact CE-O 3.5Å; K48-A199 PolarHBondContact NZ-O 3.31Å; K48-A200 WeakPolarHBondContact CE-OXT 3.46Å; K48-A200 PolarHBondContact NZ-O 3.4Å; K48-A200 PolarHBondContact NZ-OXT 2.75Å
49	P	95.6	Very high	84.1	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-58.1	147.5	175.9	-24.8	34.5	0	0	0	112.3	L52 D96 C99 L102 W197	P49-L52 HydrophobicContact CB-CD2 4.08Å; P49-L52 HydrophobicContact CG-CD2 4.42Å; P49-D96 VanDerWaalsContact CA-OD2 3.24Å; P49-D96 WeakPolarHBondContact CA-OD2 3.21Å; P49-D96 HydrophobicContact CB-CB 3.88Å; P49-D96 HydrophobicContact CG-CB 4.37Å; P49-C99 HydrophobicContact CG-CB 4.3Å; P49-L102 HydrophobicContact CG-CD1 4.17Å; P49-L102 HydrophobicContact CG-CD2 4.13Å; P49-W197 HydrophobicContact CG-CH2 3.81Å; P49-W197 HydrophobicContact CG-CZ2 3.73Å
50	A	93.5	Very high	86.1	Confident	78 Å²	78	54.7 Å²	54.7	65%	0.645	30%	0.303	S	S	*	.	S	Bend	trans	-74.4	-40.3	-177.3	0	0	0	0	0	113	D96	A50-D96 PolarHBondContact N-OD2 2.93Å; A50-D96 VanDerWaalsContact N-OD2 3.09Å
51	D	95.4	Very high	88	Confident	97 Å²	97	55.5 Å²	55.5	52%	0.519	30%	0.298	S	S	.	.			trans	-101.4	90.7	-173.4	-65.5	-45.9	0	0	0	111.2	S92 T93	D51-S92 WeakPolarHBondContact O-CA 3.45Å; D51-S92 PolarHBondContact O-OG 3.43Å; D51-T93 PolarHBondContact O-N 2.9Å
52	L	98	Very high	89.7	Confident	19 Å²	19	51.2 Å²	51.2	10%	0.099	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	135.7	177.5	-67.4	-168.6	0	0	0	112	K48 P49 I91 W197 A199 A200	K48-L52 HydrophobicContact CD-CD1 4.37Å; K48-L52 HydrophobicContact CG-CD1 4.26Å; P49-L52 HydrophobicContact CB-CD2 4.08Å; P49-L52 HydrophobicContact CG-CD2 4.42Å; L52-I91 WeakPolarHBondContact CA-O 3.41Å; L52-W197 HydrophobicContact CD1-CB 3.69Å; L52-W197 HydrophobicContact CD1-CD2 3.87Å; L52-W197 HydrophobicContact CD1-CE3 4.07Å; L52-W197 HydrophobicContact CD1-CG 3.67Å; L52-W197 HydrophobicContact CD2-CD2 4.07Å; L52-W197 HydrophobicContact CD2-CE3 3.58Å; L52-W197 HydrophobicContact CD2-CZ3 3.94Å; L52-A199 WeakPolarHBondContact CD1-O 2.98Å; L52-A200 HydrophobicContact CB-CB 4.09Å
53	V	97.9	Very high	91.6	Very high	46 Å²	46	49.2 Å²	49.2	28%	0.279	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148.7	176.1	-67.6	0	0	0	0	111.3	L55 T70 Y90 I91 T93	V53-L55 PolarHBondContact O-N 3.45Å; V53-T70 HydrophobicContact CG2-CG2 4.32Å; V53-Y90 VanDerWaalsContact O-CA 3.3Å; V53-Y90 WeakPolarHBondContact O-CA 3.46Å; V53-I91 HydrophobicContact CG2-CG1 4.03Å; V53-I91 PolarHBondContact N-O 2.97Å; V53-I91 PolarHBondContact O-N 3.45Å; V53-T93 HydrophobicContact CB-CG2 4.04Å; V53-T93 HydrophobicContact CG1-CG2 3.37Å; V53-T93 HydrophobicContact CG2-CG2 3.5Å; V53-T93 VanDerWaalsContact CG2-CG2 3.5Å
54	P	98	Very high	93.1	Very high	30 Å²	30	49.8 Å²	49.8	20%	0.195	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	134	177.4	27.4	-34.4	0	0	0	110.8	Y56 I87 Y90	P54-Y56 HydrophobicContact CB-CE1 4.39Å; P54-Y56 HydrophobicContact CB-CE2 3.98Å; P54-Y56 HydrophobicContact CG-CE2 3.76Å; P54-Y56 WeakPolarHBondContact CG-OH 3.5Å; P54-I87 HydrophobicContact CB-CD1 4.14Å; P54-I87 HydrophobicContact CB-CG1 4.15Å; P54-I87 HydrophobicContact CB-CG2 4.34Å; P54-Y90 HydrophobicContact CB-CD1 4.31Å; P54-Y90 HydrophobicContact CB-CE1 3.98Å
55	L	98.1	Very high	94.5	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	118.7	165.4	-173	64.7	0	0	0	107.8	V53 L68 T70 F88 G89 I91 L105 L139	V53-L55 PolarHBondContact O-N 3.45Å; L55-L68 HydrophobicContact CD1-CB 4.02Å; L55-L68 HydrophobicContact CD2-CB 4.19Å; L55-L68 HydrophobicContact CD2-CD1 4Å; L55-L68 HydrophobicContact CG-CB 4.12Å; L55-T70 HydrophobicContact CD1-CG2 4.17Å; L55-F88 HydrophobicContact CB-CB 4.49Å; L55-F88 HydrophobicContact CD2-CD1 4.01Å; L55-F88 HydrophobicContact CG-CB 4.48Å; L55-F88 WeakPolarHBondContact O-CA 3.44Å; L55-F88 WeakPolarHBondContact O-CB 3.48Å; L55-F88 PolarHBondContact O-N 2.94Å; L55-G89 PolarHBondContact N-O 3.01Å; L55-I91 HydrophobicContact CB-CG2 4.21Å; L55-I91 HydrophobicContact CD1-CD1 4.16Å; L55-I91 HydrophobicContact CD2-CG2 3.98Å; L55-L105 HydrophobicContact CD2-CD2 3.9Å; L55-L139 HydrophobicContact CD1-CD1 4.1Å
56	Y	96.6	Very high	95.2	Very high	41 Å²	41	41.9 Å²	41.9	16%	0.161	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	144.5	-178.5	-62.3	-82	0	0	0	111.2	P54 L68 S69 K72 G86 I87	P54-Y56 HydrophobicContact CB-CE1 4.39Å; P54-Y56 HydrophobicContact CB-CE2 3.98Å; P54-Y56 HydrophobicContact CG-CE2 3.76Å; P54-Y56 WeakPolarHBondContact CG-OH 3.5Å; Y56-L68 VanDerWaalsContact O-CA 3.27Å; Y56-L68 WeakPolarHBondContact O-CA 3.17Å; Y56-S69 WeakPolarHBondContact CB-O 3.33Å; Y56-S69 WeakPolarHBondContact CD2-O 3.29Å; Y56-S69 PolarHBondContact N-O 3.31Å; Y56-S69 PolarHBondContact O-N 3.49Å; Y56-K72 HydrophobicContact CD2-CB 4.33Å; Y56-K72 HydrophobicContact CE1-CB 4.24Å; Y56-K72 HydrophobicContact CE2-CB 3.55Å; Y56-K72 VanDerWaalsContact CZ-CB 3.48Å; Y56-K72 WeakPolarHBondContact OH-CB 3.27Å; Y56-G86 WeakPolarHBondContact CA-O 3.27Å; Y56-I87 HydrophobicContact CD1-CG1 4.17Å; Y56-I87 HydrophobicContact CE1-CG1 3.86Å
57	R	96.4	Very high	95.7	Very high	19 Å²	19	42 Å²	42	7%	0.072	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.5	179	-172.5	-164	-177.3	-160.6	1.4	110.8	V59 T66 L68 K85 G86 F88 Y166 Y167 E173	R57-V59 HydrophobicContact CG-CG2 4.36Å; R57-T66 HydrophobicContact CG-CG2 3.86Å; R57-L68 HydrophobicContact CB-CD2 4.16Å; R57-L68 HydrophobicContact CG-CD2 4.15Å; R57-K85 HydrophobicContact CB-CB 4.17Å; R57-K85 HydrophobicContact CG-CB 4.17Å; R57-K85 PolarHBondContact O-N 3.25Å; R57-G86 PolarHBondContact N-O 3.21Å; R57-F88 HydrophobicContact CB-CB 4.05Å; R57-F88 HydrophobicContact CB-CD2 3.92Å; R57-F88 HydrophobicContact CB-CG 4.41Å; R57-F88 HydrophobicContact CG-CD2 3.9Å; R57-F88 HydrophobicContact CG-CE2 4.45Å; R57-Y166 VanDerWaalsContact NH2-CE1 3.28Å; R57-Y166 PolarHBondContact NH2-OH 2.74Å; R57-Y167 PolarHBondContact NE-O 2.85Å; R57-Y167 PolarHBondContact NH2-O 2.81Å; R57-E173 IonicContact CZ-OE2 2.76Å; R57-E173 IonicContact NH1-OE2 3.75Å; R57-E173 PolarHBondContact NH1-OE2 3.08Å; R57-E173 IonicContact NH2-OE1 2.97Å; R57-E173 IonicContact NH2-OE2 3.38Å; R57-E173 PolarHBondContact NH2-OE2 2.97Å
58	L	95.8	Very high	96	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	138.5	170.4	-63.8	88.5	0	0	0	109.5	T66 I67 I74 V78 Y82 E83	L58-T66 CarbonylContact O-C 3.55Å; L58-T66 VanDerWaalsContact O-CA 3.28Å; L58-T66 WeakPolarHBondContact O-CA 3.24Å; L58-I67 HydrophobicContact CB-CB 4.26Å; L58-I67 PolarHBondContact N-O 2.99Å; L58-I67 PolarHBondContact O-N 2.97Å; L58-I74 HydrophobicContact CD1-CB 4.44Å; L58-I74 HydrophobicContact CD1-CG1 4.32Å; L58-I74 HydrophobicContact CD1-CG2 3.27Å; L58-I74 HydrophobicContact CD2-CG2 4.04Å; L58-I74 HydrophobicContact CG-CG2 4.25Å; L58-V78 HydrophobicContact CD2-CG2 4.11Å; L58-Y82 HydrophobicContact CB-CD1 4.12Å; L58-E83 VanDerWaalsContact CA-O 3.3Å; L58-E83 WeakPolarHBondContact CA-O 2.91Å
59	V	95.7	Very high	96	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.024	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.9	-179	174.5	0	0	0	0	109.8	R57 K61 Y64 D65 Y82 E83 K85 Y166	R57-V59 HydrophobicContact CG-CG2 4.36Å; V59-K61 PolarHBondContact O-N 3.17Å; V59-Y64 HydrophobicContact CG1-CD1 4.01Å; V59-D65 WeakPolarHBondContact CA-O 3.48Å; V59-Y82 VanDerWaalsContact C-CD1 3.47Å; V59-Y82 WeakPolarHBondContact O-CA 3.35Å; V59-E83 PolarHBondContact N-O 2.83Å; V59-E83 PolarHBondContact O-N 3.07Å; V59-K85 HydrophobicContact CB-CG 4.12Å; V59-K85 HydrophobicContact CG2-CG 3.72Å; V59-Y166 HydrophobicContact CG1-CD2 4.49Å; V59-Y166 HydrophobicContact CG1-CE2 3.77Å; V59-Y166 HydrophobicContact CG2-CE2 3.88Å
60	H	95.4	Very high	96	Very high	21 Å²	21	37.4 Å²	37.4	10%	0.097	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	127.1	176.7	-171	-65.9	0	0	0	110.6	S62 R63 Y64 D65 Y82	H60-S62 VanDerWaalsContact C-N 3.32Å; H60-S62 PolarHBondContact ND1-N 1.99Å; H60-S62 VanDerWaalsContact ND1-N 3.19Å; H60-S62 PolarHBondContact O-N 2.86Å; H60-S62 VanDerWaalsContact O-N 3.15Å; H60-R63 HydrophobicContact CB-CB 4.2Å; H60-R63 PolarHBondContact CD2-NH2 3.32Å; H60-R63 PolarHBondContact ND1-N 3.21Å; H60-R63 VanDerWaalsContact ND1-N 3.15Å; H60-R63 VanDerWaalsContact NE2-CZ 3.34Å; H60-R63 PolarHBondContact NE2-NH1 3.43Å; H60-R63 VanDerWaalsContact NE2-NH1 3.19Å; H60-Y64 WeakPolarHBondContact O-CA 3.25Å; H60-Y64 PolarHBondContact O-N 2.85Å; H60-D65 WeakPolarHBondContact CB-OD1 3.39Å; H60-D65 IonicContact CD2-OD1 2.77Å; H60-D65 IonicContact CG-OD1 2.76Å; H60-D65 PolarHBondContact N-O 2.89Å; H60-Y82 HydrophobicContact CB-CD1 3.93Å; H60-Y82 HydrophobicContact CB-CE1 3.58Å; H60-Y82 HydrophobicContact CB-CE2 4.45Å; H60-Y82 HydrophobicContact CB-CG 4.49Å; H60-Y82 AromaticContact CD2-CE2 3.67Å; H60-Y82 AromaticContact CD2-CZ 3.73Å; H60-Y82 VanDerWaalsContact N-CD1 3.27Å
61	K	94.4	Very high	96	Very high	118 Å²	118	37.1 Å²	37.1	51%	0.513	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-34.3	-171.1	-69.4	172.8	179.9	176.3	0	115.4	V59 S80 A81 E83	V59-K61 PolarHBondContact O-N 3.17Å; K61-S80 WeakPolarHBondContact CD-O 3.4Å; K61-S80 VanDerWaalsContact CE-O 3.26Å; K61-S80 WeakPolarHBondContact CE-O 3.35Å; K61-S80 PolarHBondContact NZ-O 3.26Å; K61-A81 WeakPolarHBondContact CB-O 3.27Å; K61-A81 VanDerWaalsContact CG-O 3.31Å; K61-A81 WeakPolarHBondContact CG-O 3.32Å; K61-A81 PolarHBondContact N-O 3.04Å; K61-E83 HydrophobicContact CG-CB 4.36Å
62	S	93.4	Very high	95.6	Very high	82 Å²	82	38.8 Å²	38.8	57%	0.573	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-40	179.6	175.5	0	0	0	0	114.7	H60 Y64 R160	H60-S62 VanDerWaalsContact C-N 3.32Å; H60-S62 PolarHBondContact ND1-N 1.99Å; H60-S62 VanDerWaalsContact ND1-N 3.19Å; H60-S62 PolarHBondContact O-N 2.86Å; H60-S62 VanDerWaalsContact O-N 3.15Å; S62-Y64 WeakPolarHBondContact O-CD2 3.1Å; S62-R160 PolarHBondContact O-NH1 2.74Å
63	R	94.1	Very high	95	Very high	66 Å²	66	42 Å²	42	25%	0.249	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-24.6	-175.2	-66.9	-165.4	-48.3	-112	6.4	113.6	H60 D65 Y82 V114 R160 W164	H60-R63 HydrophobicContact CB-CB 4.2Å; H60-R63 PolarHBondContact CD2-NH2 3.32Å; H60-R63 PolarHBondContact ND1-N 3.21Å; H60-R63 VanDerWaalsContact ND1-N 3.15Å; H60-R63 VanDerWaalsContact NE2-CZ 3.34Å; H60-R63 PolarHBondContact NE2-NH1 3.43Å; H60-R63 VanDerWaalsContact NE2-NH1 3.19Å; R63-D65 VanDerWaalsContact C-N 3.25Å; R63-D65 WeakPolarHBondContact CB-OD1 3.48Å; R63-D65 IonicContact CZ-OD1 2.96Å; R63-D65 IonicContact CZ-OD2 3.57Å; R63-D65 IonicContact NE-OD1 3.4Å; R63-D65 PolarHBondContact NE-OD1 3.36Å; R63-D65 IonicContact NE-OD2 2.91Å; R63-D65 IonicContact NH2-OD1 3.97Å; R63-D65 PolarHBondContact NH2-OD1 3.02Å; R63-D65 IonicContact NH2-OD2 3.78Å; R63-D65 PolarHBondContact NH2-OD2 2.83Å; R63-D65 PolarHBondContact O-N 3.02Å; R63-Y82 PolarHBondContact NH2-OH 3.49Å; R63-V114 PolarHBondContact NH2-O 2.88Å; R63-R160 VanDerWaalsContact CA-NH1 3.35Å; R63-R160 VanDerWaalsContact O-CD 3.3Å; R63-R160 WeakPolarHBondContact O-CD 3.34Å; R63-R160 PolarHBondContact O-NH1 2.84Å; R63-W164 HydrophobicContact CB-CD2 4.37Å; R63-W164 HydrophobicContact CB-CG 4.43Å; R63-W164 VanDerWaalsContact CD-CZ2 3.48Å
64	Y	95.5	Very high	94.2	Very high	76 Å²	76	41.2 Å²	41.2	30%	0.298	21%	0.205	S	C	.	.			trans	57.2	33.4	-174.4	-59.7	-98.4	0	0	0	113.3	V59 H60 S62 Y166 F187	V59-Y64 HydrophobicContact CG1-CD1 4.01Å; H60-Y64 WeakPolarHBondContact O-CA 3.25Å; H60-Y64 PolarHBondContact O-N 2.85Å; S62-Y64 WeakPolarHBondContact O-CD2 3.1Å; Y64-Y166 HydrophobicContact CD1-CE2 4.45Å; Y64-Y166 WeakPolarHBondContact O-CD2 3.28Å; Y64-F187 HydrophobicContact CG-CZ 4.16Å
65	D	96.1	Very high	93.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.			trans	-79	148	161.1	45.7	-56.9	0	0	0	110.8	V59 H60 R63 Y82 V114 W164 N165	V59-D65 WeakPolarHBondContact CA-O 3.48Å; H60-D65 WeakPolarHBondContact CB-OD1 3.39Å; H60-D65 IonicContact CD2-OD1 2.77Å; H60-D65 IonicContact CG-OD1 2.76Å; H60-D65 PolarHBondContact N-O 2.89Å; R63-D65 VanDerWaalsContact C-N 3.25Å; R63-D65 WeakPolarHBondContact CB-OD1 3.48Å; R63-D65 IonicContact CZ-OD1 2.96Å; R63-D65 IonicContact CZ-OD2 3.57Å; R63-D65 IonicContact NE-OD1 3.4Å; R63-D65 PolarHBondContact NE-OD1 3.36Å; R63-D65 IonicContact NE-OD2 2.91Å; R63-D65 IonicContact NH2-OD1 3.97Å; R63-D65 PolarHBondContact NH2-OD1 3.02Å; R63-D65 IonicContact NH2-OD2 3.78Å; R63-D65 PolarHBondContact NH2-OD2 2.83Å; R63-D65 PolarHBondContact O-N 3.02Å; D65-Y82 PolarHBondContact OD2-OH 2.93Å; D65-V114 VanDerWaalsContact OD2-O 3.04Å; D65-W164 HydrophobicContact CB-CB 4.11Å; D65-W164 HydrophobicContact CB-CE3 4.01Å; D65-N165 CarbonylContact C-O 3.45Å; D65-N165 WeakPolarHBondContact CA-O 3.49Å
66	T	97.3	Very high	92	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.8	-175.7	-56.8	0	0	0	0	113	R57 L58 L68 Y118 N165 Y166 Y167	R57-T66 HydrophobicContact CG-CG2 3.86Å; L58-T66 CarbonylContact O-C 3.55Å; L58-T66 VanDerWaalsContact O-CA 3.28Å; L58-T66 WeakPolarHBondContact O-CA 3.24Å; T66-L68 HydrophobicContact CG2-CD2 3.85Å; T66-L68 HydrophobicContact CG2-CG 4.27Å; T66-Y118 PolarHBondContact O-OH 2.83Å; T66-N165 PolarHBondContact N-O 2.94Å; T66-Y166 WeakPolarHBondContact OG1-CA 3.34Å; T66-Y166 WeakPolarHBondContact OG1-CD2 3.31Å; T66-Y167 HydrophobicContact CG2-CD2 4.48Å; T66-Y167 PolarHBondContact OG1-N 3.08Å
67	I	96.4	Very high	90.8	Very high	8 Å²	8	49 Å²	49	4%	0.041	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128.4	166	-63.4	172.6	0	0	0	108.8	L58 V78 Y82 Y116 Y118	L58-I67 HydrophobicContact CB-CB 4.26Å; L58-I67 PolarHBondContact N-O 2.99Å; L58-I67 PolarHBondContact O-N 2.97Å; I67-V78 HydrophobicContact CD1-CG1 3.73Å; I67-V78 HydrophobicContact CD1-CG2 4.49Å; I67-Y82 HydrophobicContact CD1-CD1 4.19Å; I67-Y82 HydrophobicContact CD1-CE1 3.62Å; I67-Y82 HydrophobicContact CD1-CE2 4.18Å; I67-Y82 HydrophobicContact CG1-CE1 3.9Å; I67-Y116 HydrophobicContact CD1-CD2 4.44Å; I67-Y116 HydrophobicContact CD1-CE2 4.07Å; I67-Y116 HydrophobicContact CG1-CD2 3.83Å; I67-Y116 HydrophobicContact CG1-CE2 3.96Å; I67-Y118 VanDerWaalsContact CA-OH 3.29Å; I67-Y118 WeakPolarHBondContact CA-OH 3.45Å
68	L	97.5	Very high	89.7	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.5	169.3	-55.9	-179.8	0	0	0	108.8	L55 Y56 R57 T66 F88 Y118 L139 F194	L55-L68 HydrophobicContact CD1-CB 4.02Å; L55-L68 HydrophobicContact CD2-CB 4.19Å; L55-L68 HydrophobicContact CD2-CD1 4Å; L55-L68 HydrophobicContact CG-CB 4.12Å; Y56-L68 VanDerWaalsContact O-CA 3.27Å; Y56-L68 WeakPolarHBondContact O-CA 3.17Å; R57-L68 HydrophobicContact CB-CD2 4.16Å; R57-L68 HydrophobicContact CG-CD2 4.15Å; T66-L68 HydrophobicContact CG2-CD2 3.85Å; T66-L68 HydrophobicContact CG2-CG 4.27Å; L68-F88 HydrophobicContact CD1-CD1 4.18Å; L68-F88 HydrophobicContact CD1-CE1 3.94Å; L68-F88 HydrophobicContact CD1-CZ 4.3Å; L68-F88 HydrophobicContact CD2-CB 4.21Å; L68-F88 HydrophobicContact CD2-CD1 4.03Å; L68-F88 HydrophobicContact CD2-CD2 3.84Å; L68-F88 HydrophobicContact CD2-CE1 4.31Å; L68-F88 HydrophobicContact CD2-CE2 4.12Å; L68-F88 HydrophobicContact CD2-CG 3.77Å; L68-F88 HydrophobicContact CD2-CZ 4.34Å; L68-Y118 HydrophobicContact CB-CD1 4.12Å; L68-Y118 HydrophobicContact CB-CD2 4.49Å; L68-Y118 HydrophobicContact CB-CE1 3.64Å; L68-Y118 HydrophobicContact CB-CE2 4.09Å; L68-Y118 HydrophobicContact CD1-CD1 4.15Å; L68-Y118 HydrophobicContact CD1-CD2 3.63Å; L68-Y118 HydrophobicContact CD1-CE1 4.38Å; L68-Y118 HydrophobicContact CD1-CE2 3.92Å; L68-Y118 HydrophobicContact CD1-CG 3.79Å; L68-Y118 HydrophobicContact CG-CD1 4.44Å; L68-Y118 HydrophobicContact CG-CD2 3.97Å; L68-Y118 HydrophobicContact CG-CE1 4.16Å; L68-Y118 HydrophobicContact CG-CE2 3.7Å; L68-Y118 HydrophobicContact CG-CG 4.36Å; L68-Y118 VanDerWaalsContact N-CZ 3.35Å; L68-Y118 PolarHBondContact N-OH 2.94Å; L68-L139 HydrophobicContact CB-CD1 4.41Å; L68-F194 HydrophobicContact CD1-CZ 4.05Å
69	S	95.6	Very high	88.2	Confident	16 Å²	16	52.8 Å²	52.8	11%	0.112	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	144.3	-176.6	179.9	0	0	0	0	111.5	Y56 N71	Y56-S69 WeakPolarHBondContact CB-O 3.33Å; Y56-S69 WeakPolarHBondContact CD2-O 3.29Å; Y56-S69 PolarHBondContact N-O 3.31Å; Y56-S69 PolarHBondContact O-N 3.49Å; S69-N71 VanDerWaalsContact C-N 3.3Å; S69-N71 PolarHBondContact OG-N 3.27Å; S69-N71 VanDerWaalsContact OG-N 3.09Å
70	T	96	Very high	87.4	Confident	62 Å²	62	57.6 Å²	57.6	38%	0.38	33%	0.332	S	S	.	.	S	Bend	trans	-84.1	-7.3	171	52	0	0	0	0	112.7	V53 L55 I91	V53-T70 HydrophobicContact CG2-CG2 4.32Å; L55-T70 HydrophobicContact CD1-CG2 4.17Å; T70-I91 HydrophobicContact CG2-CD1 3.84Å
71	N	92.7	Very high	87.2	Confident	73 Å²	73	58.4 Å²	58.4	39%	0.39	34%	0.342	S	S	.	.			trans	-86.7	114.6	175.4	-177.8	-3.3	0	0	0	110.5	S69 D73 I74	S69-N71 VanDerWaalsContact C-N 3.3Å; S69-N71 PolarHBondContact OG-N 3.27Å; S69-N71 VanDerWaalsContact OG-N 3.09Å; N71-D73 PolarHBondContact O-N 2.79Å; N71-D73 PolarHBondContact OD1-N 3.45Å; N71-I74 HydrophobicContact CB-CB 4.4Å; N71-I74 VanDerWaalsContact O-CB 3.24Å; N71-I74 WeakPolarHBondContact O-CB 3.36Å; N71-I74 WeakPolarHBondContact O-CG2 3.31Å; N71-I74 PolarHBondContact O-N 3.48Å
72	K	86.9	Confident	87.2	Confident	131 Å²	131	53.8 Å²	53.8	57%	0.57	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.1	176.7	74.6	-179	-172.2	176.2	0	113.8	Y56 I74	Y56-K72 HydrophobicContact CD2-CB 4.33Å; Y56-K72 HydrophobicContact CE1-CB 4.24Å; Y56-K72 HydrophobicContact CE2-CB 3.55Å; Y56-K72 VanDerWaalsContact CZ-CB 3.48Å; Y56-K72 WeakPolarHBondContact OH-CB 3.27Å; K72-I74 VanDerWaalsContact C-N 3.31Å
73	D	85.3	Confident	87.1	Confident	86 Å²	86	54 Å²	54	46%	0.46	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	3.7	-174.4	-60.2	-48.9	0	0	0	112	N71 G75 S76	N71-D73 PolarHBondContact O-N 2.79Å; N71-D73 PolarHBondContact OD1-N 3.45Å; D73-G75 PolarHBondContact O-N 2.81Å; D73-S76 WeakPolarHBondContact O-CB 3.17Å; D73-S76 PolarHBondContact O-N 3.39Å; D73-S76 PolarHBondContact O-OG 2.66Å
74	I	82.2	Confident	87.1	Confident	30 Å²	30	54.8 Å²	54.8	15%	0.154	32%	0.323	C	S	.	.	H	α-helix	trans	-51.8	-35.2	-178.8	-171.1	61.4	0	0	0	112.5	L58 N71 K72 S76 T77 V78	L58-I74 HydrophobicContact CD1-CB 4.44Å; L58-I74 HydrophobicContact CD1-CG1 4.32Å; L58-I74 HydrophobicContact CD1-CG2 3.27Å; L58-I74 HydrophobicContact CD2-CG2 4.04Å; L58-I74 HydrophobicContact CG-CG2 4.25Å; N71-I74 HydrophobicContact CB-CB 4.4Å; N71-I74 VanDerWaalsContact O-CB 3.24Å; N71-I74 WeakPolarHBondContact O-CB 3.36Å; N71-I74 WeakPolarHBondContact O-CG2 3.31Å; N71-I74 PolarHBondContact O-N 3.48Å; K72-I74 VanDerWaalsContact C-N 3.31Å; I74-S76 PolarHBondContact O-N 3.09Å; I74-T77 WeakPolarHBondContact O-CA 3.32Å; I74-T77 WeakPolarHBondContact O-CB 3.49Å; I74-T77 PolarHBondContact O-N 2.79Å; I74-V78 HydrophobicContact CD1-CG2 3.79Å; I74-V78 HydrophobicContact CG1-CG2 3.58Å; I74-V78 WeakPolarHBondContact O-CG2 3.31Å; I74-V78 PolarHBondContact O-N 3.19Å
75	G	75	Confident	87	Confident	31 Å²	31	55.4 Å²	55.4	32%	0.32	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-28.7	177.7	0	0	0	0	0	114.2	D73 T77	D73-G75 PolarHBondContact O-N 2.81Å; G75-T77 VanDerWaalsContact C-N 3.27Å
76	S	74	Confident	86.9	Confident	100 Å²	100	56.7 Å²	56.7	70%	0.699	34%	0.341	S	S	*	.	H	α-helix	trans	-70.9	-26.1	172	71.6	0	0	0	0	112.3	D73 I74	D73-S76 WeakPolarHBondContact O-CB 3.17Å; D73-S76 PolarHBondContact O-N 3.39Å; D73-S76 PolarHBondContact O-OG 2.66Å; I74-S76 PolarHBondContact O-N 3.09Å
77	T	70.7	Confident	86.9	Confident	104 Å²	104	60.6 Å²	60.6	64%	0.638	36%	0.361	S	S	*	.	H	α-helix	trans	-90.3	-39.2	-175.8	-48.5	0	0	0	0	112.5	I74 G75 A79	I74-T77 WeakPolarHBondContact O-CA 3.32Å; I74-T77 WeakPolarHBondContact O-CB 3.49Å; I74-T77 PolarHBondContact O-N 2.79Å; G75-T77 VanDerWaalsContact C-N 3.27Å; T77-A79 VanDerWaalsContact C-N 3.27Å; T77-A79 PolarHBondContact O-N 3.4Å
78	V	73.6	Confident	86.9	Confident	38 Å²	38	60.4 Å²	60.4	23%	0.23	36%	0.359	C	S	.	.	S	Bend	trans	-86.7	10.8	-175.6	-134	0	0	0	0	114.9	L58 I67 I74 Y82	L58-V78 HydrophobicContact CD2-CG2 4.11Å; I67-V78 HydrophobicContact CD1-CG1 3.73Å; I67-V78 HydrophobicContact CD1-CG2 4.49Å; I74-V78 HydrophobicContact CD1-CG2 3.79Å; I74-V78 HydrophobicContact CG1-CG2 3.58Å; I74-V78 WeakPolarHBondContact O-CG2 3.31Å; I74-V78 PolarHBondContact O-N 3.19Å; V78-Y82 HydrophobicContact CB-CD2 4.29Å; V78-Y82 HydrophobicContact CG1-CD2 4.08Å; V78-Y82 HydrophobicContact CG1-CE2 4.08Å
79	A	63.8	Low	87	Confident	62 Å²	62	60.5 Å²	60.5	51%	0.512	36%	0.361	S	S	.	.			trans	65.7	175.2	169.2	0	0	0	0	0	116.2	T77 A81 Y82	T77-A79 VanDerWaalsContact C-N 3.27Å; T77-A79 PolarHBondContact O-N 3.4Å; A79-A81 PolarHBondContact O-N 2.83Å; A79-Y82 PolarHBondContact O-N 3.37Å
80	S	79.2	Confident	87.1	Confident	104 Å²	104	62.1 Å²	62.1	73%	0.727	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-11.5	-172.8	57.9	0	0	0	0	116.1	K61	K61-S80 WeakPolarHBondContact CD-O 3.4Å; K61-S80 VanDerWaalsContact CE-O 3.26Å; K61-S80 WeakPolarHBondContact CE-O 3.35Å; K61-S80 PolarHBondContact NZ-O 3.26Å
81	A	91.1	Very high	87.2	Confident	38 Å²	38	59.1 Å²	59.1	31%	0.314	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-21.8	-177.5	0	0	0	0	0	113.4	K61 A79	K61-A81 WeakPolarHBondContact CB-O 3.27Å; K61-A81 VanDerWaalsContact CG-O 3.31Å; K61-A81 WeakPolarHBondContact CG-O 3.32Å; K61-A81 PolarHBondContact N-O 3.04Å; A79-A81 PolarHBondContact O-N 2.83Å
82	Y	94	Very high	87.5	Confident	21 Å²	21	55.7 Å²	55.7	8%	0.082	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	149.6	177.2	-72	-100.8	0	0	0	111.3	L58 V59 H60 R63 D65 I67 V78 A79 V114	L58-Y82 HydrophobicContact CB-CD1 4.12Å; V59-Y82 VanDerWaalsContact C-CD1 3.47Å; V59-Y82 WeakPolarHBondContact O-CA 3.35Å; H60-Y82 HydrophobicContact CB-CD1 3.93Å; H60-Y82 HydrophobicContact CB-CE1 3.58Å; H60-Y82 HydrophobicContact CB-CE2 4.45Å; H60-Y82 HydrophobicContact CB-CG 4.49Å; H60-Y82 AromaticContact CD2-CE2 3.67Å; H60-Y82 AromaticContact CD2-CZ 3.73Å; H60-Y82 VanDerWaalsContact N-CD1 3.27Å; R63-Y82 PolarHBondContact NH2-OH 3.49Å; D65-Y82 PolarHBondContact OD2-OH 2.93Å; I67-Y82 HydrophobicContact CD1-CD1 4.19Å; I67-Y82 HydrophobicContact CD1-CE1 3.62Å; I67-Y82 HydrophobicContact CD1-CE2 4.18Å; I67-Y82 HydrophobicContact CG1-CE1 3.9Å; V78-Y82 HydrophobicContact CB-CD2 4.29Å; V78-Y82 HydrophobicContact CG1-CD2 4.08Å; V78-Y82 HydrophobicContact CG1-CE2 4.08Å; A79-Y82 PolarHBondContact O-N 3.37Å; Y82-V114 WeakPolarHBondContact OH-CG1 3.47Å
83	E	92.9	Very high	88	Confident	88 Å²	88	52.6 Å²	52.6	41%	0.411	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132.7	168.6	-167.5	-170.8	151.9	0	0	108.9	L58 V59 K61 K85	L58-E83 VanDerWaalsContact CA-O 3.3Å; L58-E83 WeakPolarHBondContact CA-O 2.91Å; V59-E83 PolarHBondContact N-O 2.83Å; V59-E83 PolarHBondContact O-N 3.07Å; K61-E83 HydrophobicContact CG-CB 4.36Å; E83-K85 PolarHBondContact O-N 3.26Å; E83-K85 IonicContact OE1-NZ 2.88Å; E83-K85 PolarHBondContact OE1-NZ 3.01Å; E83-K85 WeakPolarHBondContact OE2-CE 3.4Å; E83-K85 IonicContact OE2-NZ 3.82Å; E83-K85 PolarHBondContact OE2-NZ 3.44Å
84	N	92.8	Very high	88.5	Confident	81 Å²	81	51.5 Å²	51.5	43%	0.433	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	116.9	171.8	-173.8	-9	0	0	0	109	G86	N84-G86 WeakPolarHBondContact OD1-CA 3.49Å; N84-G86 PolarHBondContact OD1-N 3.45Å
85	K	93.8	Very high	89	Confident	89 Å²	89	54.8 Å²	54.8	39%	0.387	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	6.4	178.8	-64.7	-61.4	-176	-174.2	0	112.8	R57 V59 E83	R57-K85 HydrophobicContact CB-CB 4.17Å; R57-K85 HydrophobicContact CG-CB 4.17Å; R57-K85 PolarHBondContact O-N 3.25Å; V59-K85 HydrophobicContact CB-CG 4.12Å; V59-K85 HydrophobicContact CG2-CG 3.72Å; E83-K85 PolarHBondContact O-N 3.26Å; E83-K85 IonicContact OE1-NZ 2.88Å; E83-K85 PolarHBondContact OE1-NZ 3.01Å; E83-K85 WeakPolarHBondContact OE2-CE 3.4Å; E83-K85 IonicContact OE2-NZ 3.82Å; E83-K85 PolarHBondContact OE2-NZ 3.44Å
86	G	93.9	Very high	89.8	Confident	28 Å²	28	54.7 Å²	54.7	29%	0.289	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	85.4	-150.2	177.8	0	0	0	0	0	112.8	Y56 R57 N84 F88	Y56-G86 WeakPolarHBondContact CA-O 3.27Å; R57-G86 PolarHBondContact N-O 3.21Å; N84-G86 WeakPolarHBondContact OD1-CA 3.49Å; N84-G86 PolarHBondContact OD1-N 3.45Å; G86-F88 PolarHBondContact O-N 3.39Å
87	I	96.6	Very high	90.6	Very high	81 Å²	81	55.6 Å²	55.6	42%	0.415	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	120	-177.9	-63.9	174.6	0	0	0	108.6	P54 Y56 G89 Y90	P54-I87 HydrophobicContact CB-CD1 4.14Å; P54-I87 HydrophobicContact CB-CG1 4.15Å; P54-I87 HydrophobicContact CB-CG2 4.34Å; Y56-I87 HydrophobicContact CD1-CG1 4.17Å; Y56-I87 HydrophobicContact CE1-CG1 3.86Å; I87-G89 VanDerWaalsContact C-N 3.31Å; I87-G89 WeakPolarHBondContact CG2-O 3.3Å; I87-Y90 HydrophobicContact CG2-CD2 4.39Å; I87-Y90 HydrophobicContact CG2-CE2 3.95Å
88	F	97.7	Very high	91.4	Very high	4 Å²	4	52 Å²	52	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	-37	169.4	-164.3	-114.4	0	0	0	111.2	L55 R57 L68 G86 A155 T169 F194 L196	L55-F88 HydrophobicContact CB-CB 4.49Å; L55-F88 HydrophobicContact CD2-CD1 4.01Å; L55-F88 HydrophobicContact CG-CB 4.48Å; L55-F88 WeakPolarHBondContact O-CA 3.44Å; L55-F88 WeakPolarHBondContact O-CB 3.48Å; L55-F88 PolarHBondContact O-N 2.94Å; R57-F88 HydrophobicContact CB-CB 4.05Å; R57-F88 HydrophobicContact CB-CD2 3.92Å; R57-F88 HydrophobicContact CB-CG 4.41Å; R57-F88 HydrophobicContact CG-CD2 3.9Å; R57-F88 HydrophobicContact CG-CE2 4.45Å; L68-F88 HydrophobicContact CD1-CD1 4.18Å; L68-F88 HydrophobicContact CD1-CE1 3.94Å; L68-F88 HydrophobicContact CD1-CZ 4.3Å; L68-F88 HydrophobicContact CD2-CB 4.21Å; L68-F88 HydrophobicContact CD2-CD1 4.03Å; L68-F88 HydrophobicContact CD2-CD2 3.84Å; L68-F88 HydrophobicContact CD2-CE1 4.31Å; L68-F88 HydrophobicContact CD2-CE2 4.12Å; L68-F88 HydrophobicContact CD2-CG 3.77Å; L68-F88 HydrophobicContact CD2-CZ 4.34Å; G86-F88 PolarHBondContact O-N 3.39Å; F88-A155 HydrophobicContact CE1-CB 3.71Å; F88-A155 HydrophobicContact CZ-CB 3.86Å; F88-T169 HydrophobicContact CD1-CG2 3.76Å; F88-T169 HydrophobicContact CD2-CG2 3.93Å; F88-T169 HydrophobicContact CE1-CG2 3.52Å; F88-T169 HydrophobicContact CE2-CG2 3.71Å; F88-T169 HydrophobicContact CG-CG2 3.98Å; F88-T169 HydrophobicContact CZ-CG2 3.5Å; F88-T169 VanDerWaalsContact CZ-CG2 3.5Å; F88-T169 WeakPolarHBondContact O-CG2 3.21Å; F88-T169 PolarHBondContact O-OG1 3.42Å; F88-F194 HydrophobicContact CE1-CE2 4.15Å; F88-F194 HydrophobicContact CE1-CZ 4.04Å; F88-L196 HydrophobicContact CD1-CD2 3.93Å; F88-L196 HydrophobicContact CE1-CD2 3.83Å
89	G	98.4	Very high	92.3	Very high	4 Å²	4	50.3 Å²	50.3	4%	0.041	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.4	-153.4	171.1	0	0	0	0	0	108.6	L55 I87	L55-G89 PolarHBondContact N-O 3.01Å; I87-G89 VanDerWaalsContact C-N 3.31Å; I87-G89 WeakPolarHBondContact CG2-O 3.3Å
90	Y	98.7	Very high	93.6	Very high	49 Å²	49	55.1 Å²	55.1	19%	0.192	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.3	-171.3	-65.2	-99.8	0	0	0	111.5	V53 P54 I87 L196 W197 S198 A199 A200	V53-Y90 VanDerWaalsContact O-CA 3.3Å; V53-Y90 WeakPolarHBondContact O-CA 3.46Å; P54-Y90 HydrophobicContact CB-CD1 4.31Å; P54-Y90 HydrophobicContact CB-CE1 3.98Å; I87-Y90 HydrophobicContact CG2-CD2 4.39Å; I87-Y90 HydrophobicContact CG2-CE2 3.95Å; Y90-L196 WeakPolarHBondContact O-CB 3.15Å; Y90-W197 PolarHBondContact N-O 3.21Å; Y90-W197 VanDerWaalsContact O-CE3 3.31Å; Y90-W197 PolarHBondContact O-N 2.96Å; Y90-S198 WeakPolarHBondContact CD2-O 3.41Å; Y90-S198 WeakPolarHBondContact CE2-O 3.26Å; Y90-A199 VanDerWaalsContact CD2-CA 3.47Å; Y90-A200 HydrophobicContact CD1-CB 3.76Å; Y90-A200 HydrophobicContact CE1-CB 3.8Å; Y90-A200 HydrophobicContact CG-CB 4.48Å
91	I	98.4	Very high	94.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	154.9	179.1	66.1	174.2	0	0	0	109.8	L52 V53 L55 T70 L105 L139 V142	L52-I91 WeakPolarHBondContact CA-O 3.41Å; V53-I91 HydrophobicContact CG2-CG1 4.03Å; V53-I91 PolarHBondContact N-O 2.97Å; V53-I91 PolarHBondContact O-N 3.45Å; L55-I91 HydrophobicContact CB-CG2 4.21Å; L55-I91 HydrophobicContact CD1-CD1 4.16Å; L55-I91 HydrophobicContact CD2-CG2 3.98Å; T70-I91 HydrophobicContact CG2-CD1 3.84Å; I91-L105 HydrophobicContact CD1-CD2 4.3Å; I91-L105 HydrophobicContact CG2-CD2 4.33Å; I91-L139 HydrophobicContact CD1-CB 4.12Å; I91-L139 WeakPolarHBondContact CD1-O 3.42Å; I91-V142 HydrophobicContact CB-CG1 4.01Å; I91-V142 HydrophobicContact CG2-CG1 3.44Å; I91-V142 VanDerWaalsContact CG2-CG1 3.44Å
92	S	98	Very high	94.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	140.8	176.8	-172	0	0	0	0	111.2	D51 T94 G140 Y141	D51-S92 WeakPolarHBondContact O-CA 3.45Å; D51-S92 PolarHBondContact O-OG 3.43Å; S92-T94 VanDerWaalsContact C-N 3.32Å; S92-T94 PolarHBondContact OG-N 3.36Å; S92-T94 PolarHBondContact OG-O 2.94Å; S92-G140 CarbonylContact O-C 3.47Å; S92-G140 WeakPolarHBondContact O-CA 3.38Å; S92-Y141 PolarHBondContact N-O 3.4Å; S92-Y141 PolarHBondContact O-N 2.85Å
93	T	96.9	Very high	94.7	Very high	67 Å²	67	53.4 Å²	53.4	41%	0.411	28%	0.284	S	S	.	.	S	Bend	trans	-80.5	-16.8	176	54.5	0	0	0	0	112.8	D51 V53	D51-T93 PolarHBondContact O-N 2.9Å; V53-T93 HydrophobicContact CB-CG2 4.04Å; V53-T93 HydrophobicContact CG1-CG2 3.37Å; V53-T93 HydrophobicContact CG2-CG2 3.5Å; V53-T93 VanDerWaalsContact CG2-CG2 3.5Å
94	T	95.7	Very high	94.9	Very high	63 Å²	63	53.4 Å²	53.4	39%	0.387	28%	0.283	S	S	.	.	S	Bend	trans	-133.4	160.2	-174.6	64.1	0	0	0	0	111.6	S92 D96 Y141	S92-T94 VanDerWaalsContact C-N 3.32Å; S92-T94 PolarHBondContact OG-N 3.36Å; S92-T94 PolarHBondContact OG-O 2.94Å; T94-D96 PolarHBondContact O-N 3.35Å; T94-Y141 VanDerWaalsContact C-CE2 3.47Å; T94-Y141 VanDerWaalsContact O-CD2 3.31Å; T94-Y141 WeakPolarHBondContact O-CD2 3.45Å
95	Q	94.4	Very high	95.2	Very high	99 Å²	99	49.5 Å²	49.5	46%	0.463	26%	0.263	S	S	.	.			trans	-77.1	76.3	169.3	-172.9	78.2	23.8	0	0	108.6	S97 L102 Y141	Q95-S97 PolarHBondContact O-N 2.79Å; Q95-L102 PolarHBondContact NE2-O 2.85Å; Q95-Y141 HydrophobicContact CB-CD1 4.34Å; Q95-Y141 HydrophobicContact CB-CE1 3.93Å
96	D	90.2	Very high	95.4	Very high	28 Å²	28	45.9 Å²	45.9	15%	0.15	25%	0.247	C	C	.	.			trans	-60.7	124.2	-178.8	-168.5	-35.6	0	0	0	111.6	P49 A50 T94 S98 C99 L102	P49-D96 VanDerWaalsContact CA-OD2 3.24Å; P49-D96 WeakPolarHBondContact CA-OD2 3.21Å; P49-D96 HydrophobicContact CB-CB 3.88Å; P49-D96 HydrophobicContact CG-CB 4.37Å; A50-D96 PolarHBondContact N-OD2 2.93Å; A50-D96 VanDerWaalsContact N-OD2 3.09Å; T94-D96 PolarHBondContact O-N 3.35Å; D96-S98 PolarHBondContact O-N 3.34Å; D96-S98 VanDerWaalsContact O-N 3.17Å; D96-S98 VanDerWaalsContact OD1-CB 3.27Å; D96-S98 WeakPolarHBondContact OD1-CB 3.4Å; D96-S98 PolarHBondContact OD1-N 2.72Å; D96-S98 PolarHBondContact OD1-OG 3.41Å; D96-S98 PolarHBondContact OD2-OG 3.17Å; D96-C99 PolarHBondContact O-N 2.73Å; D96-C99 VanDerWaalsContact O-N 3.08Å; D96-L102 HydrophobicContact CB-CD1 3.83Å
97	S	91.1	Very high	95.6	Very high	120 Å²	120	45.4 Å²	45.4	84%	0.839	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.8	-179.7	52.9	0	0	0	0	114.2	Q95 C99	Q95-S97 PolarHBondContact O-N 2.79Å; S97-C99 PolarHBondContact O-N 3.19Å
98	S	88.1	Confident	95.7	Very high	29 Å²	29	41.6 Å²	41.6	20%	0.203	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-11.3	176.2	68.8	0	0	0	0	113.6	K47 D96	K47-S98 PolarHBondContact N-O 2.97Å; D96-S98 PolarHBondContact O-N 3.34Å; D96-S98 VanDerWaalsContact O-N 3.17Å; D96-S98 VanDerWaalsContact OD1-CB 3.27Å; D96-S98 WeakPolarHBondContact OD1-CB 3.4Å; D96-S98 PolarHBondContact OD1-N 2.72Å; D96-S98 PolarHBondContact OD1-OG 3.41Å; D96-S98 PolarHBondContact OD2-OG 3.17Å
99	C	92.2	Very high	95.6	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.007	23%	0.228	C	C	.	.			trans	-130.1	91	176.7	179.8	0	0	0	0	111.2	P49 D96 S97 H101 L102 C149	P49-C99 HydrophobicContact CG-CB 4.3Å; D96-C99 PolarHBondContact O-N 2.73Å; D96-C99 VanDerWaalsContact O-N 3.08Å; S97-C99 PolarHBondContact O-N 3.19Å; C99-H101 PolarHBondContact O-N 2.86Å; C99-L102 HydrophobicContact CB-CD1 4.11Å; C99-L102 HydrophobicContact CB-CD2 4.47Å; C99-L102 HydrophobicContact CB-CG 3.81Å; C99-L102 WeakPolarHBondContact O-CG 3.36Å; C99-L102 PolarHBondContact O-N 2.87Å; C99-C149 WeakPolarHBondContact CA-SG 3.13Å; C99-C149 HydrophobicContact CB-CB 3.68Å; C99-C149 WeakPolarHBondContact CB-SG 3.43Å; C99-C149 WeakPolarHBondContact SG-CB 3.44Å; C99-C149 CovalentContact SG-SG 1.99Å; C99-C149 PolarHBondContact SG-SG 3.42Å
100	K	91.9	Very high	95.6	Very high	163 Å²	163	43.1 Å²	43.1	71%	0.709	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-9.4	174.6	69.5	-178.4	177.4	-171.3	0	115
101	H	94.3	Very high	95.3	Very high	56 Å²	56	43.8 Å²	43.8	26%	0.259	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	1.9	-178.3	-62.3	-70.9	0	0	0	113.3	C45 C99 E103 V143 L148	C45-H101 PolarHBondContact O-CD2 3.03Å; C45-H101 VanDerWaalsContact O-CD2 3.32Å; C99-H101 PolarHBondContact O-N 2.86Å; H101-E103 PolarHBondContact O-N 2.9Å; H101-V143 HydrophobicContact CB-CG1 4.14Å; H101-L148 HydrophobicContact CB-CB 4.26Å; H101-L148 HydrophobicContact CB-CD1 4.13Å
102	L	96.1	Very high	95	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.042	29%	0.287	C	S	.	.			trans	-65.3	130.9	176.2	-74.2	178	0	0	0	111.2	P49 Q95 D96 C99 V142 V143 W197	P49-L102 HydrophobicContact CG-CD1 4.17Å; P49-L102 HydrophobicContact CG-CD2 4.13Å; Q95-L102 PolarHBondContact NE2-O 2.85Å; D96-L102 HydrophobicContact CB-CD1 3.83Å; C99-L102 HydrophobicContact CB-CD1 4.11Å; C99-L102 HydrophobicContact CB-CD2 4.47Å; C99-L102 HydrophobicContact CB-CG 3.81Å; C99-L102 WeakPolarHBondContact O-CG 3.36Å; C99-L102 PolarHBondContact O-N 2.87Å; L102-V142 CarbonylContact C-O 3.58Å; L102-V142 WeakPolarHBondContact CA-O 3.23Å; L102-V143 HydrophobicContact CD2-CG1 4.3Å; L102-W197 HydrophobicContact CD2-CH2 3.65Å; L102-W197 HydrophobicContact CD2-CZ2 4.48Å
103	E	96.9	Very high	94.6	Very high	64 Å²	64	51.6 Å²	51.6	30%	0.299	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	147.6	173.5	-66.3	178	-147.4	0	0	109.6	H101 L105 T120 Y141 V142	H101-E103 PolarHBondContact O-N 2.9Å; E103-L105 PolarHBondContact O-N 2.95Å; E103-T120 HydrophobicContact CB-CG2 4.47Å; E103-T120 WeakPolarHBondContact OE2-CB 3.34Å; E103-T120 PolarHBondContact OE2-OG1 2.79Å; E103-Y141 VanDerWaalsContact O-CA 3.27Å; E103-Y141 WeakPolarHBondContact O-CA 3.18Å; E103-V142 PolarHBondContact N-O 2.72Å; E103-V142 PolarHBondContact O-N 2.97Å
104	Q	97.7	Very high	94.2	Very high	87 Å²	87	51.8 Å²	51.8	41%	0.407	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	127.5	175.8	-71.9	-178	-18.4	0	0	110.7	M106 T120 T138 Y141	Q104-M106 HydrophobicContact CB-CG 4.17Å; Q104-M106 PolarHBondContact O-N 2.87Å; Q104-T120 WeakPolarHBondContact O-CA 3.37Å; Q104-T138 HydrophobicContact CB-CG2 3.92Å; Q104-T138 HydrophobicContact CG-CG2 4.05Å; Q104-Y141 HydrophobicContact CG-CD1 3.94Å; Q104-Y141 HydrophobicContact CG-CE1 3.44Å; Q104-Y141 VanDerWaalsContact CG-CE1 3.44Å
105	L	98.5	Very high	94.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	98.9	167.7	-177	61.4	0	0	0	109	L55 I91 E103 T120 L139 G140 V142 F194	L55-L105 HydrophobicContact CD2-CD2 3.9Å; I91-L105 HydrophobicContact CD1-CD2 4.3Å; I91-L105 HydrophobicContact CG2-CD2 4.33Å; E103-L105 PolarHBondContact O-N 2.95Å; L105-T120 HydrophobicContact CD1-CG2 4.5Å; L105-L139 HydrophobicContact CD2-CB 4.3Å; L105-L139 HydrophobicContact CD2-CD1 4.34Å; L105-L139 HydrophobicContact CG-CB 4.46Å; L105-L139 PolarHBondContact O-N 3Å; L105-G140 PolarHBondContact N-O 3.3Å; L105-V142 HydrophobicContact CB-CG1 4.18Å; L105-V142 HydrophobicContact CB-CG2 4.01Å; L105-V142 HydrophobicContact CD1-CG2 4.22Å; L105-V142 HydrophobicContact CD2-CG1 4.02Å; L105-F194 HydrophobicContact CD1-CD1 3.77Å; L105-F194 HydrophobicContact CD1-CD2 4.38Å; L105-F194 HydrophobicContact CD1-CE1 3.57Å; L105-F194 HydrophobicContact CD1-CE2 4.17Å; L105-F194 HydrophobicContact CD1-CG 4.2Å; L105-F194 HydrophobicContact CD1-CZ 3.79Å; L105-F194 HydrophobicContact CD2-CE2 4.23Å; L105-F194 HydrophobicContact CD2-CZ 4.2Å
106	M	97.9	Very high	94.3	Very high	12 Å²	12	46.7 Å²	46.7	6%	0.059	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.1	-178.3	-62.7	-178.8	-79.2	0	0	110.6	Q104 L108 Y118 V119 G121 L125 F135	Q104-M106 HydrophobicContact CB-CG 4.17Å; Q104-M106 PolarHBondContact O-N 2.87Å; M106-L108 HydrophobicContact CB-CD1 3.92Å; M106-Y118 WeakPolarHBondContact O-CA 3.48Å; M106-V119 HydrophobicContact CB-CG2 4.08Å; M106-V119 HydrophobicContact CE-CG2 4.22Å; M106-V119 PolarHBondContact N-O 3.42Å; M106-V119 PolarHBondContact O-N 2.82Å; M106-G121 WeakPolarHBondContact CE-O 3.35Å; M106-L125 HydrophobicContact CE-CB 4Å; M106-L125 HydrophobicContact CE-CD2 4.29Å; M106-L125 HydrophobicContact SD-CD2 4Å; M106-F135 HydrophobicContact CB-CD2 4.21Å; M106-F135 HydrophobicContact CB-CE2 4.01Å; M106-F135 HydrophobicContact CG-CD2 4.41Å; M106-F135 HydrophobicContact CG-CE2 3.91Å; M106-F135 HydrophobicContact SD-CD2 4.34Å; M106-F135 HydrophobicContact SD-CE2 4.16Å
107	Q	97.9	Very high	94.7	Very high	19 Å²	19	45.3 Å²	45.3	9%	0.089	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.1	170.3	178.4	-179.5	8.9	0	0	109.4	Y116 Y118 V136 T137 L139	Q107-Y116 HydrophobicContact CG-CD1 3.82Å; Q107-Y116 HydrophobicContact CG-CE1 4.45Å; Q107-Y118 HydrophobicContact CB-CD1 4.07Å; Q107-Y118 HydrophobicContact CB-CE1 4Å; Q107-Y118 HydrophobicContact CG-CD1 4.2Å; Q107-Y118 HydrophobicContact CG-CE1 3.68Å; Q107-V136 HydrophobicContact CG-CB 4.34Å; Q107-V136 WeakPolarHBondContact O-CB 3.45Å; Q107-V136 PolarHBondContact O-N 2.84Å; Q107-T137 HydrophobicContact CB-CG2 4.19Å; Q107-T137 PolarHBondContact N-O 2.94Å; Q107-T137 PolarHBondContact O-N 3.4Å; Q107-L139 HydrophobicContact CB-CD1 4.3Å; Q107-L139 HydrophobicContact CB-CG 4.26Å
108	L	98.1	Very high	95.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.4	172.4	-64.6	58.2	0	0	0	109.7	M106 Y116 V117 V119 L125 N134	M106-L108 HydrophobicContact CB-CD1 3.92Å; L108-Y116 VanDerWaalsContact O-CA 3.23Å; L108-Y116 WeakPolarHBondContact O-CA 3.43Å; L108-Y116 WeakPolarHBondContact O-CD1 3.3Å; L108-V117 HydrophobicContact CB-CG2 3.76Å; L108-V117 HydrophobicContact CD2-CG2 4.23Å; L108-V117 HydrophobicContact CG-CG2 4.5Å; L108-V117 PolarHBondContact N-O 3.18Å; L108-V117 PolarHBondContact O-N 3.28Å; L108-V119 HydrophobicContact CD1-CG2 3.61Å; L108-L125 HydrophobicContact CD1-CD1 4.15Å; L108-L125 HydrophobicContact CD2-CD1 3.84Å; L108-L125 HydrophobicContact CG-CD1 4.13Å; L108-N134 CarbonylContact C-O 3.5Å; L108-N134 WeakPolarHBondContact CA-O 3.4Å; L108-N134 WeakPolarHBondContact CB-O 3.49Å
109	S	96.9	Very high	95.5	Very high	32 Å²	32	38.6 Å²	38.6	22%	0.224	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.1	179.2	61.6	0	0	0	0	111.8	Y133 N134 V136	S109-Y133 CarbonylContact O-C 3.59Å; S109-Y133 WeakPolarHBondContact O-CA 3.28Å; S109-N134 PolarHBondContact N-O 3.32Å; S109-N134 PolarHBondContact O-N 2.99Å; S109-V136 WeakPolarHBondContact OG-CG2 3.35Å
110	A	96.8	Very high	95.6	Very high	8 Å²	8	38.9 Å²	38.9	7%	0.066	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	138	172.5	0	0	0	0	0	111	G112 K113 D115 Y133	A110-G112 PolarHBondContact O-N 3.44Å; A110-K113 HydrophobicContact CB-CD 4.3Å; A110-K113 HydrophobicContact CB-CG 3.7Å; A110-K113 VanDerWaalsContact O-O 3.05Å; A110-D115 HydrophobicContact CB-CB 3.99Å; A110-D115 PolarHBondContact N-O 2.86Å; A110-Y133 HydrophobicContact CB-CD1 3.94Å; A110-Y133 HydrophobicContact CB-CE1 3.58Å; A110-Y133 HydrophobicContact CB-CE2 4.41Å; A110-Y133 HydrophobicContact CB-CG 4.5Å; A110-Y133 VanDerWaalsContact N-CD1 3.33Å
111	S	94	Very high	95.6	Very high	64 Å²	64	32.5 Å²	32.5	45%	0.448	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	129.3	172.7	-57.6	0	0	0	0	110.7	K113 N132 N134	S111-K113 VanDerWaalsContact C-N 3.33Å; S111-K113 PolarHBondContact O-N 2.84Å; S111-N132 WeakPolarHBondContact CB-O 3.27Å; S111-N132 PolarHBondContact N-O 2.56Å; S111-N132 PolarHBondContact OG-O 3.43Å; S111-N134 PolarHBondContact OG-ND2 3.13Å
112	G	90.6	Very high	95.3	Very high	93 Å²	93	34.8 Å²	34.8	96%	0.959	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.2	2.6	172.4	0	0	0	0	0	116.4	A110	A110-G112 PolarHBondContact O-N 3.44Å
113	K	90.1	Very high	95.1	Very high	70 Å²	70	42 Å²	42	30%	0.304	25%	0.251	S	S	.	.	S	Bend	trans	-149.4	157.3	173.5	60.9	173.7	176.5	149.2	0	111.4	A110 S111 D115 T163 W164	A110-K113 HydrophobicContact CB-CD 4.3Å; A110-K113 HydrophobicContact CB-CG 3.7Å; A110-K113 VanDerWaalsContact O-O 3.05Å; S111-K113 VanDerWaalsContact C-N 3.33Å; S111-K113 PolarHBondContact O-N 2.84Å; K113-D115 HydrophobicContact CD-CB 4.11Å; K113-D115 HydrophobicContact CG-CB 4.15Å; K113-D115 IonicContact NZ-OD2 3.55Å; K113-D115 PolarHBondContact NZ-OD2 3.08Å; K113-D115 PolarHBondContact O-N 2.84Å; K113-T163 PolarHBondContact NZ-O 2.78Å; K113-W164 HydrophobicContact CB-CH2 4.27Å; K113-W164 HydrophobicContact CB-CZ3 4.41Å; K113-W164 HydrophobicContact CD-CH2 3.83Å; K113-W164 HydrophobicContact CD-CZ3 3.78Å; K113-W164 HydrophobicContact CG-CZ3 4.41Å
114	V	89.8	Confident	94.9	Very high	72 Å²	72	45.3 Å²	45.3	44%	0.436	26%	0.262	S	S	.	.	S	Bend	trans	-82.1	95.5	171.7	-174.7	0	0	0	0	108	R63 D65 Y82 Y116 W164	R63-V114 PolarHBondContact NH2-O 2.88Å; D65-V114 VanDerWaalsContact OD2-O 3.04Å; Y82-V114 WeakPolarHBondContact OH-CG1 3.47Å; V114-Y116 HydrophobicContact CG1-CE2 3.91Å; V114-W164 WeakPolarHBondContact O-CZ3 3.37Å
115	D	95.1	Very high	94.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.251	C	S	.	.			trans	-157.1	139.1	176.1	-176.3	24.6	0	0	0	107.6	A110 K113 Y133 W164 N165	A110-D115 HydrophobicContact CB-CB 3.99Å; A110-D115 PolarHBondContact N-O 2.86Å; K113-D115 HydrophobicContact CD-CB 4.11Å; K113-D115 HydrophobicContact CG-CB 4.15Å; K113-D115 IonicContact NZ-OD2 3.55Å; K113-D115 PolarHBondContact NZ-OD2 3.08Å; K113-D115 PolarHBondContact O-N 2.84Å; D115-Y133 PolarHBondContact OD2-OH 3.49Å; D115-W164 HydrophobicContact CB-CE3 3.89Å; D115-W164 HydrophobicContact CB-CZ3 3.88Å; D115-N165 PolarHBondContact OD1-N 3.36Å; D115-N165 VanDerWaalsContact OD1-N 3.08Å; D115-N165 PolarHBondContact OD1-ND2 2.84Å; D115-N165 VanDerWaalsContact OD1-ND2 3.11Å; D115-N165 PolarHBondContact OD2-ND2 3.05Å; D115-N165 VanDerWaalsContact OD2-ND2 3.14Å
116	Y	96.9	Very high	94.5	Very high	54 Å²	54	45.7 Å²	45.7	21%	0.212	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.4	-172.3	-63.7	-88.9	0	0	0	111.2	I67 Q107 L108 V114 Y118 V136 N165	I67-Y116 HydrophobicContact CD1-CD2 4.44Å; I67-Y116 HydrophobicContact CD1-CE2 4.07Å; I67-Y116 HydrophobicContact CG1-CD2 3.83Å; I67-Y116 HydrophobicContact CG1-CE2 3.96Å; Q107-Y116 HydrophobicContact CG-CD1 3.82Å; Q107-Y116 HydrophobicContact CG-CE1 4.45Å; L108-Y116 VanDerWaalsContact O-CA 3.23Å; L108-Y116 WeakPolarHBondContact O-CA 3.43Å; L108-Y116 WeakPolarHBondContact O-CD1 3.3Å; V114-Y116 HydrophobicContact CG1-CE2 3.91Å; Y116-Y118 WeakPolarHBondContact CB-OH 3.42Å; Y116-V136 HydrophobicContact CE1-CG2 4.4Å; Y116-N165 WeakPolarHBondContact O-CB 3.49Å
117	V	98.1	Very high	94.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147.7	168.6	-64.1	0	0	0	0	109.3	L108 V119 Y128 Y133 N165 Y167	L108-V117 HydrophobicContact CB-CG2 3.76Å; L108-V117 HydrophobicContact CD2-CG2 4.23Å; L108-V117 HydrophobicContact CG-CG2 4.5Å; L108-V117 PolarHBondContact N-O 3.18Å; L108-V117 PolarHBondContact O-N 3.28Å; V117-V119 HydrophobicContact CG2-CG1 4.44Å; V117-Y128 HydrophobicContact CB-CD1 4.23Å; V117-Y128 HydrophobicContact CB-CE1 4.06Å; V117-Y128 HydrophobicContact CB-CE2 4.46Å; V117-Y128 HydrophobicContact CG1-CD1 3.97Å; V117-Y128 HydrophobicContact CG1-CE1 3.55Å; V117-Y128 HydrophobicContact CG2-CD1 3.72Å; V117-Y128 HydrophobicContact CG2-CD2 4.14Å; V117-Y128 HydrophobicContact CG2-CE1 4.08Å; V117-Y128 HydrophobicContact CG2-CE2 4.44Å; V117-Y128 HydrophobicContact CG2-CG 3.75Å; V117-Y133 HydrophobicContact CB-CD1 4.36Å; V117-Y133 HydrophobicContact CB-CE1 4.39Å; V117-Y133 HydrophobicContact CG1-CD1 4.02Å; V117-Y133 HydrophobicContact CG1-CE1 3.61Å; V117-Y133 HydrophobicContact CG2-CD1 3.6Å; V117-Y133 HydrophobicContact CG2-CE1 4.11Å; V117-Y133 HydrophobicContact CG2-CG 4.02Å; V117-N165 HydrophobicContact CG1-CB 4.19Å; V117-N165 VanDerWaalsContact CG1-CG 3.42Å; V117-N165 WeakPolarHBondContact CG1-ND2 3.45Å; V117-N165 WeakPolarHBondContact CG1-OD1 3.29Å; V117-Y167 WeakPolarHBondContact CA-OH 3.47Å
118	Y	98.4	Very high	94.3	Very high	1 Å²	1	50 Å²	50	0%	0.004	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	121.6	-179.9	-51.9	-85.3	0	0	0	108	T66 I67 L68 M106 Q107 Y116 L139 Y167	T66-Y118 PolarHBondContact O-OH 2.83Å; I67-Y118 VanDerWaalsContact CA-OH 3.29Å; I67-Y118 WeakPolarHBondContact CA-OH 3.45Å; L68-Y118 HydrophobicContact CB-CD1 4.12Å; L68-Y118 HydrophobicContact CB-CD2 4.49Å; L68-Y118 HydrophobicContact CB-CE1 3.64Å; L68-Y118 HydrophobicContact CB-CE2 4.09Å; L68-Y118 HydrophobicContact CD1-CD1 4.15Å; L68-Y118 HydrophobicContact CD1-CD2 3.63Å; L68-Y118 HydrophobicContact CD1-CE1 4.38Å; L68-Y118 HydrophobicContact CD1-CE2 3.92Å; L68-Y118 HydrophobicContact CD1-CG 3.79Å; L68-Y118 HydrophobicContact CG-CD1 4.44Å; L68-Y118 HydrophobicContact CG-CD2 3.97Å; L68-Y118 HydrophobicContact CG-CE1 4.16Å; L68-Y118 HydrophobicContact CG-CE2 3.7Å; L68-Y118 HydrophobicContact CG-CG 4.36Å; L68-Y118 VanDerWaalsContact N-CZ 3.35Å; L68-Y118 PolarHBondContact N-OH 2.94Å; M106-Y118 WeakPolarHBondContact O-CA 3.48Å; Q107-Y118 HydrophobicContact CB-CD1 4.07Å; Q107-Y118 HydrophobicContact CB-CE1 4Å; Q107-Y118 HydrophobicContact CG-CD1 4.2Å; Q107-Y118 HydrophobicContact CG-CE1 3.68Å; Y116-Y118 WeakPolarHBondContact CB-OH 3.42Å; Y118-L139 HydrophobicContact CD1-CD1 3.84Å; Y118-L139 HydrophobicContact CE1-CD1 3.87Å; Y118-Y167 AromaticContact CD2-CD2 3.9Å; Y118-Y167 HydrophobicContact CD2-CD2 3.9Å; Y118-Y167 HydrophobicContact CD2-CE1 4.25Å; Y118-Y167 AromaticContact CD2-CE2 3.55Å; Y118-Y167 HydrophobicContact CD2-CE2 3.55Å; Y118-Y167 HydrophobicContact CD2-CG 4.4Å; Y118-Y167 AromaticContact CD2-CZ 3.74Å; Y118-Y167 HydrophobicContact CE2-CD2 4.12Å; Y118-Y167 AromaticContact CE2-CE2 3.96Å; Y118-Y167 HydrophobicContact CE2-CE2 3.96Å; Y118-Y167 PolarHBondContact N-OH 2.83Å
119	V	97	Very high	94.2	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.042	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	151.5	-169.9	-58.2	0	0	0	0	111	M106 L108 V117 Y128	M106-V119 HydrophobicContact CB-CG2 4.08Å; M106-V119 HydrophobicContact CE-CG2 4.22Å; M106-V119 PolarHBondContact N-O 3.42Å; M106-V119 PolarHBondContact O-N 2.82Å; L108-V119 HydrophobicContact CD1-CG2 3.61Å; V117-V119 HydrophobicContact CG2-CG1 4.44Å; V119-Y128 HydrophobicContact CG1-CD2 3.5Å; V119-Y128 HydrophobicContact CG1-CE2 3.57Å
120	T	95.8	Very high	94.1	Very high	6 Å²	6	59.4 Å²	59.4	4%	0.037	33%	0.329	C	S	.	.			trans	-113.2	147.4	169.3	75.2	0	0	0	0	108.9	E103 Q104 L105 Y124 V142 F194	E103-T120 HydrophobicContact CB-CG2 4.47Å; E103-T120 WeakPolarHBondContact OE2-CB 3.34Å; E103-T120 PolarHBondContact OE2-OG1 2.79Å; Q104-T120 WeakPolarHBondContact O-CA 3.37Å; L105-T120 HydrophobicContact CD1-CG2 4.5Å; T120-Y124 VanDerWaalsContact O-CD2 3.25Å; T120-Y124 WeakPolarHBondContact O-CD2 3.49Å; T120-V142 HydrophobicContact CG2-CG2 3.39Å; T120-F194 HydrophobicContact CG2-CB 3.83Å; T120-F194 HydrophobicContact CG2-CG 4.45Å
121	G	89.9	Confident	94	Very high	29 Å²	29	64 Å²	64	30%	0.299	35%	0.348	S	S	.	.	H	α-helix	trans	74.8	157.7	178.1	0	0	0	0	0	115.9	M106 E123 L125	M106-G121 WeakPolarHBondContact CE-O 3.35Å; G121-E123 PolarHBondContact O-N 2.84Å; G121-L125 PolarHBondContact O-N 2.86Å
122	T	89.1	Confident	94.1	Very high	105 Å²	105	66.4 Å²	66.4	64%	0.644	36%	0.356	S	S	*	.	H	α-helix	trans	-74.4	-23.8	-173.9	49	0	0	0	0	113.9	S126	T122-S126 WeakPolarHBondContact O-CB 3.38Å; T122-S126 PolarHBondContact O-N 2.85Å; T122-S126 PolarHBondContact O-OG 3.4Å
123	E	91.8	Very high	94.4	Very high	158 Å²	158	63 Å²	63	74%	0.738	31%	0.314	S	S	*	.	H	α-helix	trans	-66.7	-48.2	179.9	-64.3	173.5	175.1	0	0	111	G121 S126 Y127	G121-E123 PolarHBondContact O-N 2.84Å; E123-S126 PolarHBondContact O-N 3.43Å; E123-Y127 PolarHBondContact O-N 3.02Å
124	Y	93.3	Very high	94.7	Very high	135 Å²	135	63.6 Å²	63.6	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-69.1	-36.7	177.1	-68.9	-74.2	0	0	0	112.3	T120 S126 Y127 Y128	T120-Y124 VanDerWaalsContact O-CD2 3.25Å; T120-Y124 WeakPolarHBondContact O-CD2 3.49Å; Y124-S126 VanDerWaalsContact C-N 3.31Å; Y124-S126 PolarHBondContact O-N 3.39Å; Y124-Y127 PolarHBondContact O-N 2.91Å; Y124-Y128 WeakPolarHBondContact O-CD2 3.19Å; Y124-Y128 PolarHBondContact O-N 2.88Å
125	L	93.4	Very high	95.1	Very high	35 Å²	35	65 Å²	65	18%	0.183	32%	0.321	C	S	.	.	H	α-helix	trans	-55	-48.4	170.5	173.7	61	0	0	0	111	M106 L108 G121 Y127 Y128 N129 F135	M106-L125 HydrophobicContact CE-CB 4Å; M106-L125 HydrophobicContact CE-CD2 4.29Å; M106-L125 HydrophobicContact SD-CD2 4Å; L108-L125 HydrophobicContact CD1-CD1 4.15Å; L108-L125 HydrophobicContact CD2-CD1 3.84Å; L108-L125 HydrophobicContact CG-CD1 4.13Å; G121-L125 PolarHBondContact O-N 2.86Å; L125-Y127 PolarHBondContact O-N 3Å; L125-Y128 PolarHBondContact O-N 2.9Å; L125-N129 WeakPolarHBondContact O-CB 3.4Å; L125-N129 PolarHBondContact O-N 2.99Å; L125-N129 PolarHBondContact O-ND2 2.8Å; L125-F135 HydrophobicContact CD1-CB 4.39Å
126	S	94.6	Very high	95.1	Very high	60 Å²	60	68.3 Å²	68.3	42%	0.42	34%	0.341	S	S	.	.	H	α-helix	trans	-64	-42.1	179.7	-58.3	0	0	0	0	112.3	T122 E123 Y124 Q130	T122-S126 WeakPolarHBondContact O-CB 3.38Å; T122-S126 PolarHBondContact O-N 2.85Å; T122-S126 PolarHBondContact O-OG 3.4Å; E123-S126 PolarHBondContact O-N 3.43Å; Y124-S126 VanDerWaalsContact C-N 3.31Å; Y124-S126 PolarHBondContact O-N 3.39Å; S126-Q130 WeakPolarHBondContact O-CG 3.27Å; S126-Q130 PolarHBondContact O-N 2.79Å
127	Y	95.5	Very high	95.1	Very high	108 Å²	108	68.5 Å²	68.5	42%	0.424	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-46	177.2	169.2	-102.3	0	0	0	112.8	E123 Y124 L125 Q130 K131	E123-Y127 PolarHBondContact O-N 3.02Å; Y124-Y127 PolarHBondContact O-N 2.91Å; L125-Y127 PolarHBondContact O-N 3Å; Y127-Q130 PolarHBondContact O-N 2.84Å; Y127-K131 HydrophobicContact CE1-CD 4.1Å; Y127-K131 HydrophobicContact CE2-CD 4.39Å; Y127-K131 VanDerWaalsContact CZ-CE 3.41Å; Y127-K131 VanDerWaalsContact CZ-NZ 3.3Å; Y127-K131 PolarHBondContact O-N 2.81Å; Y127-K131 WeakPolarHBondContact OH-CE 3.4Å; Y127-K131 PolarHBondContact OH-NZ 3.12Å
128	Y	96	Very high	95	Very high	14 Å²	14	70.6 Å²	70.6	6%	0.055	36%	0.361	C	S	.	.	H	α-helix	trans	-75.5	-29.8	-179.8	-81.5	-73.9	0	0	0	112.9	V117 V119 Y124 L125 Q130 K131 N132 Y133 Q157	V117-Y128 HydrophobicContact CB-CD1 4.23Å; V117-Y128 HydrophobicContact CB-CE1 4.06Å; V117-Y128 HydrophobicContact CB-CE2 4.46Å; V117-Y128 HydrophobicContact CG1-CD1 3.97Å; V117-Y128 HydrophobicContact CG1-CE1 3.55Å; V117-Y128 HydrophobicContact CG2-CD1 3.72Å; V117-Y128 HydrophobicContact CG2-CD2 4.14Å; V117-Y128 HydrophobicContact CG2-CE1 4.08Å; V117-Y128 HydrophobicContact CG2-CE2 4.44Å; V117-Y128 HydrophobicContact CG2-CG 3.75Å; V119-Y128 HydrophobicContact CG1-CD2 3.5Å; V119-Y128 HydrophobicContact CG1-CE2 3.57Å; Y124-Y128 WeakPolarHBondContact O-CD2 3.19Å; Y124-Y128 PolarHBondContact O-N 2.88Å; L125-Y128 PolarHBondContact O-N 2.9Å; Y128-Q130 VanDerWaalsContact C-N 3.31Å; Y128-Q130 PolarHBondContact O-N 3.45Å; Y128-K131 CarbonylContact O-C 3.58Å; Y128-K131 WeakPolarHBondContact O-CA 3.27Å; Y128-K131 WeakPolarHBondContact O-CB 3.15Å; Y128-K131 PolarHBondContact O-N 2.89Å; Y128-N132 PolarHBondContact O-N 3.46Å; Y128-Y133 AromaticContact CD1-CD2 3.95Å; Y128-Y133 HydrophobicContact CD1-CD2 3.95Å; Y128-Y133 HydrophobicContact CD1-CE2 4.25Å; Y128-Y133 HydrophobicContact CD1-CG 4.26Å; Y128-Y133 WeakPolarHBondContact O-CB 3.47Å; Y128-Y133 PolarHBondContact O-N 3.12Å; Y128-Q157 PolarHBondContact OH-NE2 3.06Å; Y128-Q157 PolarHBondContact OH-OE1 3.25Å
129	N	95.1	Very high	95	Very high	69 Å²	69	71.7 Å²	71.7	37%	0.369	37%	0.367	S	S	.	.	H	α-helix	trans	-57.4	-43.2	169	-75.3	-20.1	0	0	0	111.7	L125 K131 N132 Y133	L125-N129 WeakPolarHBondContact O-CB 3.4Å; L125-N129 PolarHBondContact O-N 2.99Å; L125-N129 PolarHBondContact O-ND2 2.8Å; N129-K131 PolarHBondContact O-N 3.47Å; N129-N132 PolarHBondContact O-N 3.06Å; N129-N132 VanDerWaalsContact O-N 3.08Å; N129-Y133 VanDerWaalsContact CA-O 3.31Å; N129-Y133 WeakPolarHBondContact CA-O 3.44Å; N129-Y133 PolarHBondContact OD1-O 2.81Å
130	Q	95.7	Very high	95.1	Very high	159 Å²	159	71.6 Å²	71.6	74%	0.743	37%	0.367	S	S	*	.	H	α-helix	trans	-64.6	-19.1	174.8	-66.8	171.9	26.5	0	0	113.1	S126 Y127 Y128	S126-Q130 WeakPolarHBondContact O-CG 3.27Å; S126-Q130 PolarHBondContact O-N 2.79Å; Y127-Q130 PolarHBondContact O-N 2.84Å; Y128-Q130 VanDerWaalsContact C-N 3.31Å; Y128-Q130 PolarHBondContact O-N 3.45Å
131	K	94	Very high	95.2	Very high	105 Å²	105	73.3 Å²	73.3	46%	0.457	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	18.7	175.7	-66.2	-171.1	168.1	-165.8	0	113.4	Y127 Y128 N129 Y133	Y127-K131 HydrophobicContact CE1-CD 4.1Å; Y127-K131 HydrophobicContact CE2-CD 4.39Å; Y127-K131 VanDerWaalsContact CZ-CE 3.41Å; Y127-K131 VanDerWaalsContact CZ-NZ 3.3Å; Y127-K131 PolarHBondContact O-N 2.81Å; Y127-K131 WeakPolarHBondContact OH-CE 3.4Å; Y127-K131 PolarHBondContact OH-NZ 3.12Å; Y128-K131 CarbonylContact O-C 3.58Å; Y128-K131 WeakPolarHBondContact O-CA 3.27Å; Y128-K131 WeakPolarHBondContact O-CB 3.15Å; Y128-K131 PolarHBondContact O-N 2.89Å; N129-K131 PolarHBondContact O-N 3.47Å; K131-Y133 VanDerWaalsContact C-N 3.28Å; K131-Y133 HydrophobicContact CB-CD2 4.1Å; K131-Y133 HydrophobicContact CB-CE2 4.43Å; K131-Y133 WeakPolarHBondContact O-CD2 3.32Å; K131-Y133 PolarHBondContact O-N 3.06Å
132	N	96	Very high	95.6	Very high	115 Å²	115	72 Å²	72	62%	0.615	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	27.9	-179.7	-55	-56.9	0	0	0	114.6	S111 Y128 N129	S111-N132 WeakPolarHBondContact CB-O 3.27Å; S111-N132 PolarHBondContact N-O 2.56Å; S111-N132 PolarHBondContact OG-O 3.43Å; Y128-N132 PolarHBondContact O-N 3.46Å; N129-N132 PolarHBondContact O-N 3.06Å; N129-N132 VanDerWaalsContact O-N 3.08Å
133	Y	97.7	Very high	95.9	Very high	20 Å²	20	67 Å²	67	8%	0.078	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.6	164.7	-72	-103.8	0	0	0	109.4	S109 A110 D115 V117 Y128 N129 K131 N165	S109-Y133 CarbonylContact O-C 3.59Å; S109-Y133 WeakPolarHBondContact O-CA 3.28Å; A110-Y133 HydrophobicContact CB-CD1 3.94Å; A110-Y133 HydrophobicContact CB-CE1 3.58Å; A110-Y133 HydrophobicContact CB-CE2 4.41Å; A110-Y133 HydrophobicContact CB-CG 4.5Å; A110-Y133 VanDerWaalsContact N-CD1 3.33Å; D115-Y133 PolarHBondContact OD2-OH 3.49Å; V117-Y133 HydrophobicContact CB-CD1 4.36Å; V117-Y133 HydrophobicContact CB-CE1 4.39Å; V117-Y133 HydrophobicContact CG1-CD1 4.02Å; V117-Y133 HydrophobicContact CG1-CE1 3.61Å; V117-Y133 HydrophobicContact CG2-CD1 3.6Å; V117-Y133 HydrophobicContact CG2-CE1 4.11Å; V117-Y133 HydrophobicContact CG2-CG 4.02Å; Y128-Y133 AromaticContact CD1-CD2 3.95Å; Y128-Y133 HydrophobicContact CD1-CD2 3.95Å; Y128-Y133 HydrophobicContact CD1-CE2 4.25Å; Y128-Y133 HydrophobicContact CD1-CG 4.26Å; Y128-Y133 WeakPolarHBondContact O-CB 3.47Å; Y128-Y133 PolarHBondContact O-N 3.12Å; N129-Y133 VanDerWaalsContact CA-O 3.31Å; N129-Y133 WeakPolarHBondContact CA-O 3.44Å; N129-Y133 PolarHBondContact OD1-O 2.81Å; K131-Y133 VanDerWaalsContact C-N 3.28Å; K131-Y133 HydrophobicContact CB-CD2 4.1Å; K131-Y133 HydrophobicContact CB-CE2 4.43Å; K131-Y133 WeakPolarHBondContact O-CD2 3.32Å; K131-Y133 PolarHBondContact O-N 3.06Å; Y133-N165 PolarHBondContact OH-ND2 2.85Å
134	N	96.8	Very high	96.1	Very high	83 Å²	83	61.9 Å²	61.9	44%	0.444	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142.7	-179.3	-57	-69.7	0	0	0	110.4	L108 S109 S111 V136	L108-N134 CarbonylContact C-O 3.5Å; L108-N134 WeakPolarHBondContact CA-O 3.4Å; L108-N134 WeakPolarHBondContact CB-O 3.49Å; S109-N134 PolarHBondContact N-O 3.32Å; S109-N134 PolarHBondContact O-N 2.99Å; S111-N134 PolarHBondContact OG-ND2 3.13Å; N134-V136 PolarHBondContact O-N 3.22Å
135	F	96.3	Very high	96.1	Very high	101 Å²	101	61.7 Å²	61.7	44%	0.443	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	133.9	172.2	178.2	-96	0	0	0	111.5	M106 L125	M106-F135 HydrophobicContact CB-CD2 4.21Å; M106-F135 HydrophobicContact CB-CE2 4.01Å; M106-F135 HydrophobicContact CG-CD2 4.41Å; M106-F135 HydrophobicContact CG-CE2 3.91Å; M106-F135 HydrophobicContact SD-CD2 4.34Å; M106-F135 HydrophobicContact SD-CE2 4.16Å; L125-F135 HydrophobicContact CD1-CB 4.39Å
136	V	95.6	Very high	96.2	Very high	70 Å²	70	61.8 Å²	61.8	42%	0.424	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-57.9	176.6	179.2	0	0	0	0	110	Q107 S109 Y116 N134	Q107-V136 HydrophobicContact CG-CB 4.34Å; Q107-V136 WeakPolarHBondContact O-CB 3.45Å; Q107-V136 PolarHBondContact O-N 2.84Å; S109-V136 WeakPolarHBondContact OG-CG2 3.35Å; Y116-V136 HydrophobicContact CE1-CG2 4.4Å; N134-V136 PolarHBondContact O-N 3.22Å
137	T	96.5	Very high	96.1	Very high	58 Å²	58	65.2 Å²	65.2	36%	0.356	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	165.6	-174.8	-168.1	0	0	0	0	111.3	Q107 L139	Q107-T137 HydrophobicContact CB-CG2 4.19Å; Q107-T137 PolarHBondContact N-O 2.94Å; Q107-T137 PolarHBondContact O-N 3.4Å; T137-L139 HydrophobicContact CG2-CD2 3.86Å; T137-L139 HydrophobicContact CG2-CG 4.48Å
138	T	97.6	Very high	96	Very high	45 Å²	45	60.8 Å²	60.8	28%	0.276	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.4	165.3	-61	0	0	0	0	108.4	Q104 G140	Q104-T138 HydrophobicContact CB-CG2 3.92Å; Q104-T138 HydrophobicContact CG-CG2 4.05Å; T138-G140 WeakPolarHBondContact CG2-O 3.44Å
139	L	97.7	Very high	95.9	Very high	23 Å²	23	60.1 Å²	60.1	12%	0.12	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-26.4	-178.6	-64.7	178.8	0	0	0	112.6	L55 L68 I91 L105 Q107 Y118 T137	L55-L139 HydrophobicContact CD1-CD1 4.1Å; L68-L139 HydrophobicContact CB-CD1 4.41Å; I91-L139 HydrophobicContact CD1-CB 4.12Å; I91-L139 WeakPolarHBondContact CD1-O 3.42Å; L105-L139 HydrophobicContact CD2-CB 4.3Å; L105-L139 HydrophobicContact CD2-CD1 4.34Å; L105-L139 HydrophobicContact CG-CB 4.46Å; L105-L139 PolarHBondContact O-N 3Å; Q107-L139 HydrophobicContact CB-CD1 4.3Å; Q107-L139 HydrophobicContact CB-CG 4.26Å; Y118-L139 HydrophobicContact CD1-CD1 3.84Å; Y118-L139 HydrophobicContact CE1-CD1 3.87Å; T137-L139 HydrophobicContact CG2-CD2 3.86Å; T137-L139 HydrophobicContact CG2-CG 4.48Å
140	G	98	Very high	95.9	Very high	5 Å²	5	59.1 Å²	59.1	5%	0.052	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.1	-148.3	-177.2	0	0	0	0	0	110.1	S92 L105 T138	S92-G140 CarbonylContact O-C 3.47Å; S92-G140 WeakPolarHBondContact O-CA 3.38Å; L105-G140 PolarHBondContact N-O 3.3Å; T138-G140 WeakPolarHBondContact CG2-O 3.44Å
141	Y	98.3	Very high	95.9	Very high	43 Å²	43	51.6 Å²	51.6	17%	0.169	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	138.1	-175.9	-56.8	-94.7	0	0	0	111.6	S92 T94 Q95 E103 Q104	S92-Y141 PolarHBondContact N-O 3.4Å; S92-Y141 PolarHBondContact O-N 2.85Å; T94-Y141 VanDerWaalsContact C-CE2 3.47Å; T94-Y141 VanDerWaalsContact O-CD2 3.31Å; T94-Y141 WeakPolarHBondContact O-CD2 3.45Å; Q95-Y141 HydrophobicContact CB-CD1 4.34Å; Q95-Y141 HydrophobicContact CB-CE1 3.93Å; E103-Y141 VanDerWaalsContact O-CA 3.27Å; E103-Y141 WeakPolarHBondContact O-CA 3.18Å; Q104-Y141 HydrophobicContact CG-CD1 3.94Å; Q104-Y141 HydrophobicContact CG-CE1 3.44Å; Q104-Y141 VanDerWaalsContact CG-CE1 3.44Å
142	V	98.3	Very high	96	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	179.2	-178.5	-65.7	0	0	0	0	109.4	I91 L102 E103 L105 T120 F194 A195	I91-V142 HydrophobicContact CB-CG1 4.01Å; I91-V142 HydrophobicContact CG2-CG1 3.44Å; I91-V142 VanDerWaalsContact CG2-CG1 3.44Å; L102-V142 CarbonylContact C-O 3.58Å; L102-V142 WeakPolarHBondContact CA-O 3.23Å; E103-V142 PolarHBondContact N-O 2.72Å; E103-V142 PolarHBondContact O-N 2.97Å; L105-V142 HydrophobicContact CB-CG1 4.18Å; L105-V142 HydrophobicContact CB-CG2 4.01Å; L105-V142 HydrophobicContact CD1-CG2 4.22Å; L105-V142 HydrophobicContact CD2-CG1 4.02Å; T120-V142 HydrophobicContact CG2-CG2 3.39Å; V142-F194 HydrophobicContact CB-CB 4.44Å; V142-F194 HydrophobicContact CB-CD2 4.14Å; V142-F194 HydrophobicContact CG1-CD2 4Å; V142-F194 HydrophobicContact CG1-CE2 4.36Å; V142-F194 HydrophobicContact CG2-CB 3.82Å; V142-F194 HydrophobicContact CG2-CD2 4.06Å; V142-F194 HydrophobicContact CG2-CG 4.05Å; V142-A195 WeakPolarHBondContact CB-O 3.31Å
143	V	96.8	Very high	96.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-114	158.6	172.3	-63.3	0	0	0	0	110	H101 L102 K145 L148 C149 A151 A195 W197	H101-V143 HydrophobicContact CB-CG1 4.14Å; L102-V143 HydrophobicContact CD2-CG1 4.3Å; V143-K145 VanDerWaalsContact C-N 3.32Å; V143-K145 VanDerWaalsContact CG2-O 3.31Å; V143-K145 WeakPolarHBondContact CG2-O 3.39Å; V143-K145 PolarHBondContact O-N 2.96Å; V143-L148 HydrophobicContact CB-CB 3.83Å; V143-L148 HydrophobicContact CB-CD1 4.28Å; V143-L148 HydrophobicContact CG1-CB 4Å; V143-L148 HydrophobicContact CG2-CB 3.94Å; V143-C149 HydrophobicContact CG1-CB 4.31Å; V143-A151 HydrophobicContact CG2-CB 3.33Å; V143-A195 HydrophobicContact CG2-CB 4.06Å; V143-A195 PolarHBondContact N-O 3.25Å; V143-A195 PolarHBondContact O-N 3.33Å; V143-W197 HydrophobicContact CG1-CH2 4.33Å; V143-W197 HydrophobicContact CG1-CZ2 4.38Å
144	S	94.9	Very high	96.1	Very high	52 Å²	52	46.6 Å²	46.6	36%	0.364	26%	0.261	S	S	.	.	S	Bend	trans	-71.2	-23.3	-176	48.7	0	0	0	0	114.4
145	K	94.3	Very high	96.2	Very high	131 Å²	131	42.6 Å²	42.6	57%	0.57	24%	0.24	S	C	*	.	S	Bend	trans	-156.1	162.5	-178.9	63.3	177.2	-177.6	177.2	0	112.1	V143 L148	V143-K145 VanDerWaalsContact C-N 3.32Å; V143-K145 VanDerWaalsContact CG2-O 3.31Å; V143-K145 WeakPolarHBondContact CG2-O 3.39Å; V143-K145 PolarHBondContact O-N 2.96Å; K145-L148 HydrophobicContact CG-CD1 3.69Å; K145-L148 HydrophobicContact CG-CG 3.98Å
146	P	94.2	Very high	96.3	Very high	37 Å²	37	38.7 Å²	38.7	24%	0.24	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	165.9	175.7	-24.3	35.4	0	0	0	113.2	L148 T154 A195	P146-L148 PolarHBondContact O-N 3.33Å; P146-T154 WeakPolarHBondContact CG-OG1 3.27Å; P146-A195 HydrophobicContact CG-CB 4.01Å; P146-A195 VanDerWaalsContact N-CB 3.32Å
147	D	92.1	Very high	96.4	Very high	131 Å²	131	35.8 Å²	35.8	70%	0.701	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.5	-13.6	-178.3	-50.8	-48.1	0	0	0	115.3	C45 C149 A151	C45-D147 VanDerWaalsContact CB-O 3.32Å; C45-D147 WeakPolarHBondContact CB-O 3.32Å; D147-C149 PolarHBondContact O-N 3.28Å; D147-A151 PolarHBondContact N-O 3.22Å
148	L	94.6	Very high	96.5	Very high	16 Å²	16	33.1 Å²	33.1	8%	0.084	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-72.1	123.7	167.5	-60.8	-177.9	0	0	0	109.4	C45 H101 V143 K145 P146 G150 A151	C45-L148 HydrophobicContact CB-CD2 4.19Å; H101-L148 HydrophobicContact CB-CB 4.26Å; H101-L148 HydrophobicContact CB-CD1 4.13Å; V143-L148 HydrophobicContact CB-CB 3.83Å; V143-L148 HydrophobicContact CB-CD1 4.28Å; V143-L148 HydrophobicContact CG1-CB 4Å; V143-L148 HydrophobicContact CG2-CB 3.94Å; K145-L148 HydrophobicContact CG-CD1 3.69Å; K145-L148 HydrophobicContact CG-CG 3.98Å; P146-L148 PolarHBondContact O-N 3.33Å; L148-G150 PolarHBondContact O-N 3.42Å; L148-A151 VanDerWaalsContact O-CB 3.27Å; L148-A151 WeakPolarHBondContact O-CB 3.43Å; L148-A151 PolarHBondContact O-N 3.35Å
149	C	94.3	Very high	96.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	52.8	33.4	176.6	-52.8	0	0	0	0	113.7	C45 K47 K48 C99 V143 D147 A151 W197	C45-C149 PolarHBondContact O-N 2.93Å; C45-C149 PolarHBondContact O-SG 2.88Å; K47-C149 WeakPolarHBondContact O-CB 3.36Å; K48-C149 WeakPolarHBondContact CA-O 3.29Å; K48-C149 PolarHBondContact N-O 2.83Å; C99-C149 WeakPolarHBondContact CA-SG 3.13Å; C99-C149 HydrophobicContact CB-CB 3.68Å; C99-C149 WeakPolarHBondContact CB-SG 3.43Å; C99-C149 WeakPolarHBondContact SG-CB 3.44Å; C99-C149 CovalentContact SG-SG 1.99Å; C99-C149 PolarHBondContact SG-SG 3.42Å; V143-C149 HydrophobicContact CG1-CB 4.31Å; D147-C149 PolarHBondContact O-N 3.28Å; C149-A151 PolarHBondContact O-N 2.92Å; C149-W197 HydrophobicContact CB-CZ2 4.14Å; C149-W197 PolarHBondContact O-NE1 3.4Å
150	G	93.3	Very high	96.4	Very high	47 Å²	47	34 Å²	34	49%	0.485	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	68.6	13	-178.2	0	0	0	0	0	115.2	L148 N152	L148-G150 PolarHBondContact O-N 3.42Å; G150-N152 PolarHBondContact O-N 2.87Å
151	A	96.8	Very high	96.3	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.008	20%	0.203	C	C	.	.			trans	-63.5	133.5	170.3	0	0	0	0	0	109.5	V143 D147 L148 C149 A195 W197	V143-A151 HydrophobicContact CG2-CB 3.33Å; D147-A151 PolarHBondContact N-O 3.22Å; L148-A151 VanDerWaalsContact O-CB 3.27Å; L148-A151 WeakPolarHBondContact O-CB 3.43Å; L148-A151 PolarHBondContact O-N 3.35Å; C149-A151 PolarHBondContact O-N 2.92Å; A151-A195 HydrophobicContact CB-CB 4.29Å; A151-W197 HydrophobicContact CB-CZ2 4.4Å
152	N	95.8	Very high	95.9	Very high	97 Å²	97	38.6 Å²	38.6	52%	0.519	23%	0.225	S	C	.	.			trans	-136	10.1	-170.5	70.8	-26.7	0	0	0	113.6	G150 L196 S198	G150-N152 PolarHBondContact O-N 2.87Å; N152-L196 PolarHBondContact N-O 2.98Å; N152-S198 VanDerWaalsContact CG-OG 3.24Å; N152-S198 PolarHBondContact ND2-OG 3.34Å; N152-S198 WeakPolarHBondContact OD1-CB 3.44Å; N152-S198 PolarHBondContact OD1-N 3.15Å; N152-S198 PolarHBondContact OD1-OG 2.87Å
153	V	97.3	Very high	95.7	Very high	22 Å²	22	41.3 Å²	41.3	13%	0.133	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	129.5	179.1	174.8	0	0	0	0	109.1	T169 A195 L196	V153-T169 HydrophobicContact CG1-CG2 3.33Å; V153-A195 CarbonylContact O-C 3.55Å; V153-A195 WeakPolarHBondContact O-CA 3.11Å; V153-A195 VanDerWaalsContact O-CB 3.29Å; V153-A195 WeakPolarHBondContact O-CB 3.4Å; V153-L196 HydrophobicContact CB-CD1 4.04Å; V153-L196 HydrophobicContact CB-CG 3.97Å; V153-L196 HydrophobicContact CG1-CD1 3.87Å; V153-L196 HydrophobicContact CG1-CD2 4.36Å; V153-L196 HydrophobicContact CG1-CG 3.93Å; V153-L196 PolarHBondContact N-O 2.86Å; V153-L196 PolarHBondContact O-N 2.93Å
154	T	98.1	Very high	95.6	Very high	16 Å²	16	43.6 Å²	43.6	10%	0.098	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	130.4	177.7	-56.6	0	0	0	0	110.3	P146 H156 T169 N192	P146-T154 WeakPolarHBondContact CG-OG1 3.27Å; T154-H156 PolarHBondContact O-N 3.14Å; T154-T169 WeakPolarHBondContact O-CA 3.47Å; T154-N192 HydrophobicContact CG2-CB 3.72Å
155	A	98.6	Very high	95.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	100.3	169.6	0	0	0	0	0	110	F88 A193 F194 L196	F88-A155 HydrophobicContact CE1-CB 3.71Å; F88-A155 HydrophobicContact CZ-CB 3.86Å; A155-A193 PolarHBondContact O-N 3.19Å; A155-F194 HydrophobicContact CB-CD1 4.15Å; A155-F194 HydrophobicContact CB-CD2 3.8Å; A155-F194 HydrophobicContact CB-CE1 3.93Å; A155-F194 HydrophobicContact CB-CE2 3.61Å; A155-F194 HydrophobicContact CB-CG 4.07Å; A155-F194 HydrophobicContact CB-CZ 3.66Å; A155-F194 WeakPolarHBondContact CB-O 3.37Å; A155-F194 PolarHBondContact N-O 2.84Å; A155-L196 HydrophobicContact CB-CD2 4.05Å
156	H	98.5	Very high	96	Very high	18 Å²	18	35.2 Å²	35.2	8%	0.083	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	123	175.8	-59.3	-78.3	0	0	0	109.9	T154 F158 Y167 T168 E171 A174 N192	T154-H156 PolarHBondContact O-N 3.14Å; H156-F158 HydrophobicContact CB-CD2 4.35Å; H156-F158 HydrophobicContact CB-CE2 3.65Å; H156-F158 HydrophobicContact CB-CZ 4.38Å; H156-Y167 VanDerWaalsContact O-CA 3.29Å; H156-Y167 WeakPolarHBondContact O-CA 3.2Å; H156-T168 HydrophobicContact CB-CG2 4.17Å; H156-T168 PolarHBondContact N-O 3.11Å; H156-T168 PolarHBondContact O-N 2.5Å; H156-E171 IonicContact CD2-OE1 3.83Å; H156-E171 IonicContact CE1-OE1 3.75Å; H156-E171 IonicContact CE1-OE2 3.68Å; H156-E171 VanDerWaalsContact NE2-CD 3.27Å; H156-E171 IonicContact NE2-OE1 2.84Å; H156-E171 PolarHBondContact NE2-OE1 2.92Å; H156-E171 IonicContact NE2-OE2 3.13Å; H156-E171 PolarHBondContact NE2-OE2 2.76Å; H156-E171 VanDerWaalsContact NE2-OE2 3.13Å; H156-A174 HydrophobicContact CB-CB 4.36Å; H156-N192 PolarHBondContact ND1-OD1 3.15Å
157	Q	98.4	Very high	96.2	Very high	10 Å²	10	33.4 Å²	33.4	5%	0.047	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.7	172.9	-174.6	-176	2.8	0	0	110.3	Y128 N165 Y166 Y167 I190 G191 A193	Y128-Q157 PolarHBondContact OH-NE2 3.06Å; Y128-Q157 PolarHBondContact OH-OE1 3.25Å; Q157-N165 PolarHBondContact NE2-OD1 2.93Å; Q157-Y166 WeakPolarHBondContact CA-O 3.35Å; Q157-Y167 HydrophobicContact CB-CD1 3.96Å; Q157-Y167 HydrophobicContact CB-CE1 3.64Å; Q157-Y167 VanDerWaalsContact CD-OH 3.28Å; Q157-Y167 HydrophobicContact CG-CD1 4.2Å; Q157-Y167 HydrophobicContact CG-CE1 3.62Å; Q157-Y167 HydrophobicContact CG-CE2 4.23Å; Q157-Y167 PolarHBondContact NE2-OH 2.87Å; Q157-I190 HydrophobicContact CB-CB 4.16Å; Q157-I190 HydrophobicContact CG-CB 3.91Å; Q157-I190 HydrophobicContact CG-CG1 4.14Å; Q157-I190 HydrophobicContact CG-CG2 4.3Å; Q157-I190 WeakPolarHBondContact O-CB 3.38Å; Q157-I190 PolarHBondContact O-N 3.4Å; Q157-G191 PolarHBondContact N-O 3.19Å; Q157-G191 PolarHBondContact O-N 3.25Å; Q157-A193 HydrophobicContact CB-CB 4.23Å
158	F	98.4	Very high	96.5	Very high	1 Å²	1	27.2 Å²	27.2	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	161.9	168.4	-60.5	-94	0	0	0	110.3	H156 Y166 T168 A174 I177 L178 F187 W188 L189	H156-F158 HydrophobicContact CB-CD2 4.35Å; H156-F158 HydrophobicContact CB-CE2 3.65Å; H156-F158 HydrophobicContact CB-CZ 4.38Å; F158-Y166 HydrophobicContact CD2-CD1 4.27Å; F158-Y166 PolarHBondContact N-O 2.88Å; F158-Y166 PolarHBondContact O-N 3.05Å; F158-T168 HydrophobicContact CE2-CG2 4.06Å; F158-A174 HydrophobicContact CE2-CB 4.29Å; F158-A174 HydrophobicContact CZ-CB 4.23Å; F158-I177 HydrophobicContact CD1-CB 4.38Å; F158-I177 HydrophobicContact CD1-CG2 3.41Å; F158-I177 VanDerWaalsContact CD1-CG2 3.41Å; F158-I177 HydrophobicContact CD2-CD1 4.32Å; F158-I177 HydrophobicContact CD2-CG2 4.31Å; F158-I177 HydrophobicContact CE1-CB 4.02Å; F158-I177 HydrophobicContact CE1-CG2 3.47Å; F158-I177 VanDerWaalsContact CE1-CG2 3.47Å; F158-I177 HydrophobicContact CE2-CB 4.48Å; F158-I177 HydrophobicContact CE2-CD1 4.27Å; F158-I177 HydrophobicContact CE2-CG2 4.36Å; F158-I177 HydrophobicContact CG-CG2 3.86Å; F158-I177 HydrophobicContact CZ-CB 4.06Å; F158-I177 HydrophobicContact CZ-CG2 3.97Å; F158-L178 HydrophobicContact CE1-CD2 3.86Å; F158-L178 HydrophobicContact CE1-CG 4.03Å; F158-L178 HydrophobicContact CZ-CD2 4.34Å; F158-L178 HydrophobicContact CZ-CG 4.16Å; F158-F187 HydrophobicContact CB-CD1 4.05Å; F158-W188 CarbonylContact C-O 3.54Å; F158-W188 WeakPolarHBondContact CA-O 3.42Å; F158-L189 HydrophobicContact CD1-CB 4.13Å; F158-L189 HydrophobicContact CD1-CD1 4.1Å; F158-L189 HydrophobicContact CE1-CB 4.02Å; F158-L189 HydrophobicContact CE1-CD1 3.7Å; F158-L189 HydrophobicContact CE1-CG 4.47Å; F158-L189 HydrophobicContact CE2-CD1 4.45Å; F158-L189 HydrophobicContact CZ-CD1 3.9Å
159	I	97.4	Very high	96.7	Very high	31 Å²	31	27.9 Å²	27.9	16%	0.159	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.6	168	-165.4	168.7	0	0	0	109.7	W164 F187 W188 I190	I159-W164 CarbonylContact C-O 3.38Å; I159-W164 WeakPolarHBondContact CA-O 3.39Å; I159-F187 CarbonylContact O-C 3.45Å; I159-F187 WeakPolarHBondContact O-CA 3.39Å; I159-W188 HydrophobicContact CG2-CB 3.93Å; I159-W188 PolarHBondContact N-O 2.96Å; I159-W188 PolarHBondContact O-N 3.08Å; I159-I190 HydrophobicContact CB-CD1 3.95Å; I159-I190 HydrophobicContact CB-CG1 3.98Å; I159-I190 HydrophobicContact CG2-CD1 3.57Å; I159-I190 HydrophobicContact CG2-CG1 4.04Å
160	R	96.7	Very high	96.8	Very high	55 Å²	55	31.9 Å²	31.9	21%	0.208	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	130.5	176.3	-174.5	-173.4	172.9	-124.7	1.5	110.8	S62 R63 S162 T163 W164 F187	S62-R160 PolarHBondContact O-NH1 2.74Å; R63-R160 VanDerWaalsContact CA-NH1 3.35Å; R63-R160 VanDerWaalsContact O-CD 3.3Å; R63-R160 WeakPolarHBondContact O-CD 3.34Å; R63-R160 PolarHBondContact O-NH1 2.84Å; R160-S162 PolarHBondContact O-N 2.84Å; R160-S162 VanDerWaalsContact O-N 3.08Å; R160-T163 PolarHBondContact O-N 2.77Å; R160-W164 HydrophobicContact CB-CB 4.42Å; R160-W164 PolarHBondContact N-O 2.97Å; R160-W164 PolarHBondContact O-N 2.84Å; R160-F187 HydrophobicContact CB-CD1 4.18Å; R160-F187 HydrophobicContact CB-CD2 4.18Å; R160-F187 HydrophobicContact CB-CE1 4.04Å; R160-F187 HydrophobicContact CB-CE2 4.05Å; R160-F187 HydrophobicContact CB-CG 4.26Å; R160-F187 HydrophobicContact CB-CZ 3.99Å; R160-F187 VanDerWaalsContact CD-CE2 3.45Å; R160-F187 HydrophobicContact CG-CD2 3.81Å; R160-F187 HydrophobicContact CG-CE1 4.45Å; R160-F187 HydrophobicContact CG-CE2 3.56Å; R160-F187 HydrophobicContact CG-CG 4.38Å; R160-F187 HydrophobicContact CG-CZ 3.92Å
161	S	94.1	Very high	97	Very high	56 Å²	56	34.2 Å²	34.2	39%	0.392	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	34.2	-178.9	-56.7	0	0	0	0	112.4	T163 T186	S161-T163 PolarHBondContact O-N 3.05Å; S161-T163 PolarHBondContact O-OG1 2.78Å; S161-T186 PolarHBondContact N-O 3.38Å
162	S	91.3	Very high	97	Very high	90 Å²	90	37.1 Å²	37.1	63%	0.629	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	55	19.1	-176.8	-47.6	0	0	0	0	114.5	R160	R160-S162 PolarHBondContact O-N 2.84Å; R160-S162 VanDerWaalsContact O-N 3.08Å
163	T	92.9	Very high	97	Very high	56 Å²	56	34 Å²	34	34%	0.344	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-42.7	-169.4	-55.5	0	0	0	0	113.2	K113 R160 S161	K113-T163 PolarHBondContact NZ-O 2.78Å; R160-T163 PolarHBondContact O-N 2.77Å; S161-T163 PolarHBondContact O-N 3.05Å; S161-T163 PolarHBondContact O-OG1 2.78Å
164	W	96.4	Very high	97	Very high	48 Å²	48	33 Å²	33	18%	0.182	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.3	-167.8	-58.5	108.7	0	0	0	111	R63 D65 K113 V114 D115 I159 R160	R63-W164 HydrophobicContact CB-CD2 4.37Å; R63-W164 HydrophobicContact CB-CG 4.43Å; R63-W164 VanDerWaalsContact CD-CZ2 3.48Å; D65-W164 HydrophobicContact CB-CB 4.11Å; D65-W164 HydrophobicContact CB-CE3 4.01Å; K113-W164 HydrophobicContact CB-CH2 4.27Å; K113-W164 HydrophobicContact CB-CZ3 4.41Å; K113-W164 HydrophobicContact CD-CH2 3.83Å; K113-W164 HydrophobicContact CD-CZ3 3.78Å; K113-W164 HydrophobicContact CG-CZ3 4.41Å; V114-W164 WeakPolarHBondContact O-CZ3 3.37Å; D115-W164 HydrophobicContact CB-CE3 3.89Å; D115-W164 HydrophobicContact CB-CZ3 3.88Å; I159-W164 CarbonylContact C-O 3.38Å; I159-W164 WeakPolarHBondContact CA-O 3.39Å; R160-W164 HydrophobicContact CB-CB 4.42Å; R160-W164 PolarHBondContact N-O 2.97Å; R160-W164 PolarHBondContact O-N 2.84Å
165	N	98	Very high	97	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	128	-177.8	-61.8	-86.1	0	0	0	111	D65 T66 D115 Y116 V117 Y133 Q157 Y167	D65-N165 CarbonylContact C-O 3.45Å; D65-N165 WeakPolarHBondContact CA-O 3.49Å; T66-N165 PolarHBondContact N-O 2.94Å; D115-N165 PolarHBondContact OD1-N 3.36Å; D115-N165 VanDerWaalsContact OD1-N 3.08Å; D115-N165 PolarHBondContact OD1-ND2 2.84Å; D115-N165 VanDerWaalsContact OD1-ND2 3.11Å; D115-N165 PolarHBondContact OD2-ND2 3.05Å; D115-N165 VanDerWaalsContact OD2-ND2 3.14Å; Y116-N165 WeakPolarHBondContact O-CB 3.49Å; V117-N165 HydrophobicContact CG1-CB 4.19Å; V117-N165 VanDerWaalsContact CG1-CG 3.42Å; V117-N165 WeakPolarHBondContact CG1-ND2 3.45Å; V117-N165 WeakPolarHBondContact CG1-OD1 3.29Å; Y133-N165 PolarHBondContact OH-ND2 2.85Å; Q157-N165 PolarHBondContact NE2-OD1 2.93Å; N165-Y167 HydrophobicContact CB-CE2 3.91Å
166	Y	98.3	Very high	97	Very high	3 Å²	3	40.5 Å²	40.5	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.9	-179.4	-172.9	-107.3	0	0	0	110.2	R57 V59 Y64 T66 Q157 F158 E173 I177 F187	R57-Y166 VanDerWaalsContact NH2-CE1 3.28Å; R57-Y166 PolarHBondContact NH2-OH 2.74Å; V59-Y166 HydrophobicContact CG1-CD2 4.49Å; V59-Y166 HydrophobicContact CG1-CE2 3.77Å; V59-Y166 HydrophobicContact CG2-CE2 3.88Å; Y64-Y166 HydrophobicContact CD1-CE2 4.45Å; Y64-Y166 WeakPolarHBondContact O-CD2 3.28Å; T66-Y166 WeakPolarHBondContact OG1-CA 3.34Å; T66-Y166 WeakPolarHBondContact OG1-CD2 3.31Å; Q157-Y166 WeakPolarHBondContact CA-O 3.35Å; F158-Y166 HydrophobicContact CD2-CD1 4.27Å; F158-Y166 PolarHBondContact N-O 2.88Å; F158-Y166 PolarHBondContact O-N 3.05Å; Y166-E173 PolarHBondContact OH-OE1 3.48Å; Y166-I177 HydrophobicContact CD1-CD1 3.87Å; Y166-I177 HydrophobicContact CE1-CD1 3.4Å; Y166-I177 VanDerWaalsContact CE1-CD1 3.4Å; Y166-F187 HydrophobicContact CD1-CD1 4.47Å; Y166-F187 AromaticContact CD1-CE1 3.94Å; Y166-F187 HydrophobicContact CD1-CE1 3.94Å; Y166-F187 HydrophobicContact CD2-CE1 4.38Å; Y166-F187 HydrophobicContact CE1-CE1 4.45Å; Y166-F187 AromaticContact CG-CE1 3.84Å; Y166-F187 HydrophobicContact CG-CE1 3.84Å
167	Y	98.6	Very high	96.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.9	178.1	-66.2	-99	0	0	0	109.9	R57 T66 V117 Y118 H156 Q157 N165 A193	R57-Y167 PolarHBondContact NE-O 2.85Å; R57-Y167 PolarHBondContact NH2-O 2.81Å; T66-Y167 HydrophobicContact CG2-CD2 4.48Å; T66-Y167 PolarHBondContact OG1-N 3.08Å; V117-Y167 WeakPolarHBondContact CA-OH 3.47Å; Y118-Y167 AromaticContact CD2-CD2 3.9Å; Y118-Y167 HydrophobicContact CD2-CD2 3.9Å; Y118-Y167 HydrophobicContact CD2-CE1 4.25Å; Y118-Y167 AromaticContact CD2-CE2 3.55Å; Y118-Y167 HydrophobicContact CD2-CE2 3.55Å; Y118-Y167 HydrophobicContact CD2-CG 4.4Å; Y118-Y167 AromaticContact CD2-CZ 3.74Å; Y118-Y167 HydrophobicContact CE2-CD2 4.12Å; Y118-Y167 AromaticContact CE2-CE2 3.96Å; Y118-Y167 HydrophobicContact CE2-CE2 3.96Å; Y118-Y167 PolarHBondContact N-OH 2.83Å; H156-Y167 VanDerWaalsContact O-CA 3.29Å; H156-Y167 WeakPolarHBondContact O-CA 3.2Å; Q157-Y167 HydrophobicContact CB-CD1 3.96Å; Q157-Y167 HydrophobicContact CB-CE1 3.64Å; Q157-Y167 VanDerWaalsContact CD-OH 3.28Å; Q157-Y167 HydrophobicContact CG-CD1 4.2Å; Q157-Y167 HydrophobicContact CG-CE1 3.62Å; Q157-Y167 HydrophobicContact CG-CE2 4.23Å; Q157-Y167 PolarHBondContact NE2-OH 2.87Å; N165-Y167 HydrophobicContact CB-CE2 3.91Å; Y167-A193 HydrophobicContact CD1-CB 4.44Å; Y167-A193 HydrophobicContact CE1-CB 3.86Å
168	T	98.4	Very high	96.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	149.9	170.6	-169.3	0	0	0	0	111.4	H156 F158 D170 E173 A174	H156-T168 HydrophobicContact CB-CG2 4.17Å; H156-T168 PolarHBondContact N-O 3.11Å; H156-T168 PolarHBondContact O-N 2.5Å; F158-T168 HydrophobicContact CE2-CG2 4.06Å; T168-D170 PolarHBondContact OG1-N 2.93Å; T168-D170 VanDerWaalsContact OG1-N 3.12Å; T168-E173 WeakPolarHBondContact CB-OE2 3.07Å; T168-E173 HydrophobicContact CG2-CG 4.36Å; T168-E173 PolarHBondContact OG1-OE2 2.97Å; T168-A174 HydrophobicContact CG2-CB 3.98Å
169	T	98.3	Very high	96.8	Very high	31 Å²	31	49.4 Å²	49.4	19%	0.19	28%	0.276	C	S	.	.			trans	-110.4	-2.9	169.4	46.3	0	0	0	0	112.4	F88 V153 T154 E171 L196	F88-T169 HydrophobicContact CD1-CG2 3.76Å; F88-T169 HydrophobicContact CD2-CG2 3.93Å; F88-T169 HydrophobicContact CE1-CG2 3.52Å; F88-T169 HydrophobicContact CE2-CG2 3.71Å; F88-T169 HydrophobicContact CG-CG2 3.98Å; F88-T169 HydrophobicContact CZ-CG2 3.5Å; F88-T169 VanDerWaalsContact CZ-CG2 3.5Å; F88-T169 WeakPolarHBondContact O-CG2 3.21Å; F88-T169 PolarHBondContact O-OG1 3.42Å; V153-T169 HydrophobicContact CG1-CG2 3.33Å; T154-T169 WeakPolarHBondContact O-CA 3.47Å; T169-E171 PolarHBondContact O-N 2.88Å; T169-L196 HydrophobicContact CG2-CD2 3.99Å
170	D	97.3	Very high	96.7	Very high	83 Å²	83	52.3 Å²	52.3	44%	0.444	29%	0.285	S	S	.	.			trans	-83.1	112.8	177.3	-176.8	-34.2	0	0	0	108.8	T168 A172 E173 A174	T168-D170 PolarHBondContact OG1-N 2.93Å; T168-D170 VanDerWaalsContact OG1-N 3.12Å; D170-A172 VanDerWaalsContact C-N 3.28Å; D170-A172 PolarHBondContact O-N 3.28Å; D170-A172 WeakPolarHBondContact OD1-CA 3.42Å; D170-A172 VanDerWaalsContact OD1-CB 3.32Å; D170-A172 WeakPolarHBondContact OD1-CB 3.43Å; D170-A172 PolarHBondContact OD1-N 2.97Å; D170-E173 HydrophobicContact CB-CB 3.82Å; D170-E173 PolarHBondContact O-N 3.26Å; D170-E173 PolarHBondContact OD1-N 3.28Å; D170-A174 WeakPolarHBondContact O-CB 3.24Å; D170-A174 PolarHBondContact O-N 2.88Å
171	E	96.7	Very high	96.6	Very high	97 Å²	97	54 Å²	54	45%	0.453	30%	0.301	S	S	.	.	H	α-helix	trans	-65	-30.1	-178.8	-65.8	-61.1	152.6	0	0	112.8	H156 T169 S175	H156-E171 IonicContact CD2-OE1 3.83Å; H156-E171 IonicContact CE1-OE1 3.75Å; H156-E171 IonicContact CE1-OE2 3.68Å; H156-E171 VanDerWaalsContact NE2-CD 3.27Å; H156-E171 IonicContact NE2-OE1 2.84Å; H156-E171 PolarHBondContact NE2-OE1 2.92Å; H156-E171 IonicContact NE2-OE2 3.13Å; H156-E171 PolarHBondContact NE2-OE2 2.76Å; H156-E171 VanDerWaalsContact NE2-OE2 3.13Å; T169-E171 PolarHBondContact O-N 2.88Å; E171-S175 VanDerWaalsContact O-CB 3.27Å; E171-S175 WeakPolarHBondContact O-CB 3.41Å; E171-S175 PolarHBondContact O-N 2.99Å; E171-S175 PolarHBondContact O-OG 2.85Å
172	A	96.9	Very high	96.6	Very high	62 Å²	62	54.4 Å²	54.4	51%	0.512	31%	0.314	S	S	.	.	H	α-helix	trans	-71.6	-45	175.1	0	0	0	0	0	110.2	D170 S175 E176	D170-A172 VanDerWaalsContact C-N 3.28Å; D170-A172 PolarHBondContact O-N 3.28Å; D170-A172 WeakPolarHBondContact OD1-CA 3.42Å; D170-A172 VanDerWaalsContact OD1-CB 3.32Å; D170-A172 WeakPolarHBondContact OD1-CB 3.43Å; D170-A172 PolarHBondContact OD1-N 2.97Å; A172-S175 WeakPolarHBondContact O-CB 3.42Å; A172-S175 PolarHBondContact O-N 2.85Å; A172-E176 WeakPolarHBondContact O-CG 3.37Å; A172-E176 PolarHBondContact O-N 3.18Å
173	E	96.9	Very high	96.5	Very high	30 Å²	30	54.8 Å²	54.8	14%	0.14	31%	0.313	C	S	.	.	H	α-helix	trans	-60.7	-46.2	173.8	-178.8	174.4	-141.4	0	0	111.4	R57 Y166 T168 D170 S175 E176 I177	R57-E173 IonicContact CZ-OE2 2.76Å; R57-E173 IonicContact NH1-OE2 3.75Å; R57-E173 PolarHBondContact NH1-OE2 3.08Å; R57-E173 IonicContact NH2-OE1 2.97Å; R57-E173 IonicContact NH2-OE2 3.38Å; R57-E173 PolarHBondContact NH2-OE2 2.97Å; Y166-E173 PolarHBondContact OH-OE1 3.48Å; T168-E173 WeakPolarHBondContact CB-OE2 3.07Å; T168-E173 HydrophobicContact CG2-CG 4.36Å; T168-E173 PolarHBondContact OG1-OE2 2.97Å; D170-E173 HydrophobicContact CB-CB 3.82Å; D170-E173 PolarHBondContact O-N 3.26Å; D170-E173 PolarHBondContact OD1-N 3.28Å; E173-S175 VanDerWaalsContact C-N 3.3Å; E173-S175 PolarHBondContact O-N 3.38Å; E173-E176 PolarHBondContact O-N 3.2Å; E173-I177 HydrophobicContact CG-CD1 3.8Å; E173-I177 HydrophobicContact CG-CG1 4.41Å; E173-I177 VanDerWaalsContact O-CG1 3.27Å; E173-I177 WeakPolarHBondContact O-CG1 3.09Å; E173-I177 PolarHBondContact O-N 3.09Å
174	A	97.9	Very high	96.6	Very high	2 Å²	2	54 Å²	54	2%	0.017	30%	0.304	C	S	.	.	H	α-helix	trans	-58.2	-44.7	176.9	0	0	0	0	0	111	H156 F158 T168 D170 E176 I177 L178	H156-A174 HydrophobicContact CB-CB 4.36Å; F158-A174 HydrophobicContact CE2-CB 4.29Å; F158-A174 HydrophobicContact CZ-CB 4.23Å; T168-A174 HydrophobicContact CG2-CB 3.98Å; D170-A174 WeakPolarHBondContact O-CB 3.24Å; D170-A174 PolarHBondContact O-N 2.88Å; A174-E176 PolarHBondContact O-N 3.46Å; A174-I177 PolarHBondContact O-N 3.38Å; A174-L178 WeakPolarHBondContact O-CG 3.13Å; A174-L178 PolarHBondContact O-N 2.8Å
175	S	97.3	Very high	96.6	Very high	66 Å²	66	54.6 Å²	54.6	46%	0.462	32%	0.315	S	S	.	.	H	α-helix	trans	-61	-43.4	176.4	-62.9	0	0	0	0	112.2	E171 A172 E173 L178 L179	E171-S175 VanDerWaalsContact O-CB 3.27Å; E171-S175 WeakPolarHBondContact O-CB 3.41Å; E171-S175 PolarHBondContact O-N 2.99Å; E171-S175 PolarHBondContact O-OG 2.85Å; A172-S175 WeakPolarHBondContact O-CB 3.42Å; A172-S175 PolarHBondContact O-N 2.85Å; E173-S175 VanDerWaalsContact C-N 3.3Å; E173-S175 PolarHBondContact O-N 3.38Å; S175-L178 PolarHBondContact O-N 2.91Å; S175-L179 PolarHBondContact O-N 2.96Å
176	E	97.5	Very high	96.6	Very high	108 Å²	108	56.6 Å²	56.6	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-63.4	-42.6	176.1	-73.7	-174.7	174.6	0	0	112.5	A172 E173 A174 L178 L179 Y184	A172-E176 WeakPolarHBondContact O-CG 3.37Å; A172-E176 PolarHBondContact O-N 3.18Å; E173-E176 PolarHBondContact O-N 3.2Å; A174-E176 PolarHBondContact O-N 3.46Å; E176-L178 VanDerWaalsContact C-N 3.29Å; E176-L178 PolarHBondContact O-N 2.93Å; E176-L179 WeakPolarHBondContact O-CB 2.98Å; E176-L179 PolarHBondContact O-N 2.84Å; E176-Y184 HydrophobicContact CB-CD2 4.31Å; E176-Y184 HydrophobicContact CB-CE2 3.93Å
177	I	97.7	Very high	96.6	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-64.3	-37.8	178.4	-65.3	167	0	0	0	110.7	F158 Y166 E173 A174 L179 R180 Y184 F187	F158-I177 HydrophobicContact CD1-CB 4.38Å; F158-I177 HydrophobicContact CD1-CG2 3.41Å; F158-I177 VanDerWaalsContact CD1-CG2 3.41Å; F158-I177 HydrophobicContact CD2-CD1 4.32Å; F158-I177 HydrophobicContact CD2-CG2 4.31Å; F158-I177 HydrophobicContact CE1-CB 4.02Å; F158-I177 HydrophobicContact CE1-CG2 3.47Å; F158-I177 VanDerWaalsContact CE1-CG2 3.47Å; F158-I177 HydrophobicContact CE2-CB 4.48Å; F158-I177 HydrophobicContact CE2-CD1 4.27Å; F158-I177 HydrophobicContact CE2-CG2 4.36Å; F158-I177 HydrophobicContact CG-CG2 3.86Å; F158-I177 HydrophobicContact CZ-CB 4.06Å; F158-I177 HydrophobicContact CZ-CG2 3.97Å; Y166-I177 HydrophobicContact CD1-CD1 3.87Å; Y166-I177 HydrophobicContact CE1-CD1 3.4Å; Y166-I177 VanDerWaalsContact CE1-CD1 3.4Å; E173-I177 HydrophobicContact CG-CD1 3.8Å; E173-I177 HydrophobicContact CG-CG1 4.41Å; E173-I177 VanDerWaalsContact O-CG1 3.27Å; E173-I177 WeakPolarHBondContact O-CG1 3.09Å; E173-I177 PolarHBondContact O-N 3.09Å; A174-I177 PolarHBondContact O-N 3.38Å; I177-L179 PolarHBondContact O-N 3.42Å; I177-R180 WeakPolarHBondContact O-CA 3.48Å; I177-R180 VanDerWaalsContact O-CG 3.27Å; I177-R180 WeakPolarHBondContact O-CG 3.49Å; I177-R180 PolarHBondContact O-N 2.93Å; I177-Y184 HydrophobicContact CB-CG 4.39Å; I177-Y184 HydrophobicContact CD1-CE1 4.33Å; I177-Y184 HydrophobicContact CG1-CD1 3.68Å; I177-Y184 HydrophobicContact CG1-CD2 4.08Å; I177-Y184 HydrophobicContact CG1-CE1 3.72Å; I177-Y184 HydrophobicContact CG1-CE2 4.1Å; I177-Y184 HydrophobicContact CG1-CG 3.87Å; I177-F187 HydrophobicContact CG2-CB 3.55Å; I177-F187 HydrophobicContact CG2-CD1 3.83Å; I177-F187 HydrophobicContact CG2-CG 3.89Å
178	L	97.2	Very high	96.5	Very high	91 Å²	91	62.7 Å²	62.7	48%	0.476	35%	0.351	S	S	.	.	H	α-helix	trans	-64.3	-26.2	177.7	-73.1	168.2	0	0	0	113.4	F158 A174 S175 E176 R180 L189	F158-L178 HydrophobicContact CE1-CD2 3.86Å; F158-L178 HydrophobicContact CE1-CG 4.03Å; F158-L178 HydrophobicContact CZ-CD2 4.34Å; F158-L178 HydrophobicContact CZ-CG 4.16Å; A174-L178 WeakPolarHBondContact O-CG 3.13Å; A174-L178 PolarHBondContact O-N 2.8Å; S175-L178 PolarHBondContact O-N 2.91Å; E176-L178 VanDerWaalsContact C-N 3.29Å; E176-L178 PolarHBondContact O-N 2.93Å; L178-R180 PolarHBondContact O-N 3.45Å; L178-L189 HydrophobicContact CD2-CB 3.97Å; L178-L189 HydrophobicContact CD2-CD1 4.42Å; L178-L189 HydrophobicContact CD2-CD2 3.99Å; L178-L189 HydrophobicContact CD2-CG 4.34Å
179	L	96.5	Very high	96.4	Very high	123 Å²	123	66.8 Å²	66.8	64%	0.644	37%	0.372	S	S	*	.	H	α-helix	trans	-66.3	-24.4	171.8	-60.9	177.2	0	0	0	112.1	S175 E176 I177 T181	S175-L179 PolarHBondContact O-N 2.96Å; E176-L179 WeakPolarHBondContact O-CB 2.98Å; E176-L179 PolarHBondContact O-N 2.84Å; I177-L179 PolarHBondContact O-N 3.42Å; L179-T181 HydrophobicContact CB-CG2 4.43Å; L179-T181 PolarHBondContact O-N 2.86Å
180	R	95.1	Very high	96.3	Very high	93 Å²	93	69.4 Å²	69.4	35%	0.351	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	41.8	178.8	-60	179.1	64.3	-126.6	-15.2	112.8	I177 L178 S185 F187 W188	I177-R180 WeakPolarHBondContact O-CA 3.48Å; I177-R180 VanDerWaalsContact O-CG 3.27Å; I177-R180 WeakPolarHBondContact O-CG 3.49Å; I177-R180 PolarHBondContact O-N 2.93Å; L178-R180 PolarHBondContact O-N 3.45Å; R180-S185 PolarHBondContact NH2-O 2.99Å; R180-S185 VanDerWaalsContact NH2-O 3.12Å; R180-S185 VanDerWaalsContact O-CA 3.28Å; R180-S185 WeakPolarHBondContact O-CA 3.3Å; R180-F187 WeakPolarHBondContact CD-O 3.34Å; R180-F187 PolarHBondContact NE-O 3.14Å; R180-W188 VanDerWaalsContact NH2-CE2 3.32Å
181	T	95.3	Very high	96.2	Very high	90 Å²	90	66.6 Å²	66.6	55%	0.552	38%	0.375	S	S	*	.			trans	-106.5	160.4	175.9	54.4	0	0	0	0	111.1	L179 T183 Y184	L179-T181 HydrophobicContact CB-CG2 4.43Å; L179-T181 PolarHBondContact O-N 2.86Å; T181-T183 PolarHBondContact O-N 2.91Å; T181-Y184 PolarHBondContact O-N 2.77Å
182	G	93.4	Very high	96.2	Very high	64 Å²	64	66.7 Å²	66.7	66%	0.66	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	54.5	-127	176.6	0	0	0	0	0	113.5	Y184 S185	G182-Y184 PolarHBondContact O-N 2.76Å; G182-S185 WeakPolarHBondContact O-CB 3.3Å; G182-S185 PolarHBondContact O-N 2.62Å; G182-S185 PolarHBondContact O-OG 2.9Å
183	T	90.9	Very high	96.2	Very high	98 Å²	98	64.8 Å²	64.8	60%	0.601	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-63.3	-22.2	178.7	48.2	0	0	0	0	113.3	T181	T181-T183 PolarHBondContact O-N 2.91Å
184	Y	95	Very high	96.2	Very high	40 Å²	40	63.4 Å²	63.4	16%	0.157	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-91	-0.8	-179.4	-57.7	-48.2	0	0	0	114.5	E176 I177 T181 G182 T186 F187	E176-Y184 HydrophobicContact CB-CD2 4.31Å; E176-Y184 HydrophobicContact CB-CE2 3.93Å; I177-Y184 HydrophobicContact CB-CG 4.39Å; I177-Y184 HydrophobicContact CD1-CE1 4.33Å; I177-Y184 HydrophobicContact CG1-CD1 3.68Å; I177-Y184 HydrophobicContact CG1-CD2 4.08Å; I177-Y184 HydrophobicContact CG1-CE1 3.72Å; I177-Y184 HydrophobicContact CG1-CE2 4.1Å; I177-Y184 HydrophobicContact CG1-CG 3.87Å; T181-Y184 PolarHBondContact O-N 2.77Å; G182-Y184 PolarHBondContact O-N 2.76Å; Y184-T186 PolarHBondContact O-N 3.06Å; Y184-F187 HydrophobicContact CD1-CD2 4.08Å; Y184-F187 AromaticContact CD1-CE2 3.89Å; Y184-F187 HydrophobicContact CD1-CE2 3.89Å; Y184-F187 HydrophobicContact CD1-CZ 4.19Å; Y184-F187 WeakPolarHBondContact O-CB 3.42Å; Y184-F187 PolarHBondContact O-N 3.22Å
185	S	96.4	Very high	96.2	Very high	60 Å²	60	63.3 Å²	63.3	42%	0.42	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-25.2	179.5	53.7	0	0	0	0	115.2	R180 G182	R180-S185 PolarHBondContact NH2-O 2.99Å; R180-S185 VanDerWaalsContact NH2-O 3.12Å; R180-S185 VanDerWaalsContact O-CA 3.28Å; R180-S185 WeakPolarHBondContact O-CA 3.3Å; G182-S185 WeakPolarHBondContact O-CB 3.3Å; G182-S185 PolarHBondContact O-N 2.62Å; G182-S185 PolarHBondContact O-OG 2.9Å
186	T	96.6	Very high	96.3	Very high	47 Å²	47	60.2 Å²	60.2	29%	0.288	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-1.4	179.8	55.4	0	0	0	0	114.3	S161 Y184	S161-T186 PolarHBondContact N-O 3.38Å; Y184-T186 PolarHBondContact O-N 3.06Å
187	F	97.9	Very high	96.3	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.009	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	148.3	-179.8	-73	-116.2	0	0	0	111.1	Y64 F158 I159 R160 Y166 I177 R180 Y184	Y64-F187 HydrophobicContact CG-CZ 4.16Å; F158-F187 HydrophobicContact CB-CD1 4.05Å; I159-F187 CarbonylContact O-C 3.45Å; I159-F187 WeakPolarHBondContact O-CA 3.39Å; R160-F187 HydrophobicContact CB-CD1 4.18Å; R160-F187 HydrophobicContact CB-CD2 4.18Å; R160-F187 HydrophobicContact CB-CE1 4.04Å; R160-F187 HydrophobicContact CB-CE2 4.05Å; R160-F187 HydrophobicContact CB-CG 4.26Å; R160-F187 HydrophobicContact CB-CZ 3.99Å; R160-F187 VanDerWaalsContact CD-CE2 3.45Å; R160-F187 HydrophobicContact CG-CD2 3.81Å; R160-F187 HydrophobicContact CG-CE1 4.45Å; R160-F187 HydrophobicContact CG-CE2 3.56Å; R160-F187 HydrophobicContact CG-CG 4.38Å; R160-F187 HydrophobicContact CG-CZ 3.92Å; Y166-F187 HydrophobicContact CD1-CD1 4.47Å; Y166-F187 AromaticContact CD1-CE1 3.94Å; Y166-F187 HydrophobicContact CD1-CE1 3.94Å; Y166-F187 HydrophobicContact CD2-CE1 4.38Å; Y166-F187 HydrophobicContact CE1-CE1 4.45Å; Y166-F187 AromaticContact CG-CE1 3.84Å; Y166-F187 HydrophobicContact CG-CE1 3.84Å; I177-F187 HydrophobicContact CG2-CB 3.55Å; I177-F187 HydrophobicContact CG2-CD1 3.83Å; I177-F187 HydrophobicContact CG2-CG 3.89Å; R180-F187 WeakPolarHBondContact CD-O 3.34Å; R180-F187 PolarHBondContact NE-O 3.14Å; Y184-F187 HydrophobicContact CD1-CD2 4.08Å; Y184-F187 AromaticContact CD1-CE2 3.89Å; Y184-F187 HydrophobicContact CD1-CE2 3.89Å; Y184-F187 HydrophobicContact CD1-CZ 4.19Å; Y184-F187 WeakPolarHBondContact O-CB 3.42Å; Y184-F187 PolarHBondContact O-N 3.22Å
188	W	97.2	Very high	96.3	Very high	129 Å²	129	58.2 Å²	58.2	49%	0.489	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	136	173.3	-66	92.5	0	0	0	109.5	F158 I159 R180 I190	F158-W188 CarbonylContact C-O 3.54Å; F158-W188 WeakPolarHBondContact CA-O 3.42Å; I159-W188 HydrophobicContact CG2-CB 3.93Å; I159-W188 PolarHBondContact N-O 2.96Å; I159-W188 PolarHBondContact O-N 3.08Å; R180-W188 VanDerWaalsContact NH2-CE2 3.32Å; W188-I190 PolarHBondContact O-N 2.96Å
189	L	97.5	Very high	96.2	Very high	85 Å²	85	56.2 Å²	56.2	45%	0.445	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	129.4	172.4	-178.6	69	0	0	0	109.3	F158 L178	F158-L189 HydrophobicContact CD1-CB 4.13Å; F158-L189 HydrophobicContact CD1-CD1 4.1Å; F158-L189 HydrophobicContact CE1-CB 4.02Å; F158-L189 HydrophobicContact CE1-CD1 3.7Å; F158-L189 HydrophobicContact CE1-CG 4.47Å; F158-L189 HydrophobicContact CE2-CD1 4.45Å; F158-L189 HydrophobicContact CZ-CD1 3.9Å; L178-L189 HydrophobicContact CD2-CB 3.97Å; L178-L189 HydrophobicContact CD2-CD1 4.42Å; L178-L189 HydrophobicContact CD2-CD2 3.99Å; L178-L189 HydrophobicContact CD2-CG 4.34Å
190	I	95.4	Very high	95.9	Very high	87 Å²	87	54 Å²	54	45%	0.446	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-45.5	166.5	-62.5	-60.4	0	0	0	109.3	Q157 I159 W188	Q157-I190 HydrophobicContact CB-CB 4.16Å; Q157-I190 HydrophobicContact CG-CB 3.91Å; Q157-I190 HydrophobicContact CG-CG1 4.14Å; Q157-I190 HydrophobicContact CG-CG2 4.3Å; Q157-I190 WeakPolarHBondContact O-CB 3.38Å; Q157-I190 PolarHBondContact O-N 3.4Å; I159-I190 HydrophobicContact CB-CD1 3.95Å; I159-I190 HydrophobicContact CB-CG1 3.98Å; I159-I190 HydrophobicContact CG2-CD1 3.57Å; I159-I190 HydrophobicContact CG2-CG1 4.04Å; W188-I190 PolarHBondContact O-N 2.96Å
191	G	94.9	Very high	96	Very high	23 Å²	23	52.1 Å²	52.1	24%	0.237	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152	-165.9	177.4	0	0	0	0	0	112.1	Q157	Q157-G191 PolarHBondContact N-O 3.19Å; Q157-G191 PolarHBondContact O-N 3.25Å
192	N	96.3	Very high	96	Very high	100 Å²	100	50.1 Å²	50.1	54%	0.535	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	109.9	176.1	-60.3	-7.9	0	0	0	107.7	T154 H156	T154-N192 HydrophobicContact CG2-CB 3.72Å; H156-N192 PolarHBondContact ND1-OD1 3.15Å
193	A	96.8	Very high	96.1	Very high	22 Å²	22	49.3 Å²	49.3	18%	0.182	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-39.9	-170	0	0	0	0	0	112.6	A155 Q157 Y167	A155-A193 PolarHBondContact O-N 3.19Å; Q157-A193 HydrophobicContact CB-CB 4.23Å; Y167-A193 HydrophobicContact CD1-CB 4.44Å; Y167-A193 HydrophobicContact CE1-CB 3.86Å
194	F	98.1	Very high	96.4	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	176.7	178.7	51.7	-87.6	0	0	0	109.3	L68 F88 L105 T120 V142 A155 L196	L68-F194 HydrophobicContact CD1-CZ 4.05Å; F88-F194 HydrophobicContact CE1-CE2 4.15Å; F88-F194 HydrophobicContact CE1-CZ 4.04Å; L105-F194 HydrophobicContact CD1-CD1 3.77Å; L105-F194 HydrophobicContact CD1-CD2 4.38Å; L105-F194 HydrophobicContact CD1-CE1 3.57Å; L105-F194 HydrophobicContact CD1-CE2 4.17Å; L105-F194 HydrophobicContact CD1-CG 4.2Å; L105-F194 HydrophobicContact CD1-CZ 3.79Å; L105-F194 HydrophobicContact CD2-CE2 4.23Å; L105-F194 HydrophobicContact CD2-CZ 4.2Å; T120-F194 HydrophobicContact CG2-CB 3.83Å; T120-F194 HydrophobicContact CG2-CG 4.45Å; V142-F194 HydrophobicContact CB-CB 4.44Å; V142-F194 HydrophobicContact CB-CD2 4.14Å; V142-F194 HydrophobicContact CG1-CD2 4Å; V142-F194 HydrophobicContact CG1-CE2 4.36Å; V142-F194 HydrophobicContact CG2-CB 3.82Å; V142-F194 HydrophobicContact CG2-CD2 4.06Å; V142-F194 HydrophobicContact CG2-CG 4.05Å; A155-F194 HydrophobicContact CB-CD1 4.15Å; A155-F194 HydrophobicContact CB-CD2 3.8Å; A155-F194 HydrophobicContact CB-CE1 3.93Å; A155-F194 HydrophobicContact CB-CE2 3.61Å; A155-F194 HydrophobicContact CB-CG 4.07Å; A155-F194 HydrophobicContact CB-CZ 3.66Å; A155-F194 WeakPolarHBondContact CB-O 3.37Å; A155-F194 PolarHBondContact N-O 2.84Å; F194-L196 HydrophobicContact CD2-CD2 3.87Å; F194-L196 HydrophobicContact CE2-CD2 3.55Å
195	A	98.3	Very high	96.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	155.2	171.3	0	0	0	0	0	111.8	V142 V143 P146 A151 V153	V142-A195 WeakPolarHBondContact CB-O 3.31Å; V143-A195 HydrophobicContact CG2-CB 4.06Å; V143-A195 PolarHBondContact N-O 3.25Å; V143-A195 PolarHBondContact O-N 3.33Å; P146-A195 HydrophobicContact CG-CB 4.01Å; P146-A195 VanDerWaalsContact N-CB 3.32Å; A151-A195 HydrophobicContact CB-CB 4.29Å; V153-A195 CarbonylContact O-C 3.55Å; V153-A195 WeakPolarHBondContact O-CA 3.11Å; V153-A195 VanDerWaalsContact O-CB 3.29Å; V153-A195 WeakPolarHBondContact O-CB 3.4Å
196	L	98.2	Very high	96.5	Very high	0 Å²	0	46 Å²	46	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	179.7	-168.4	59.9	114.7	0	0	0	110.5	F88 Y90 N152 V153 A155 T169 F194	F88-L196 HydrophobicContact CD1-CD2 3.93Å; F88-L196 HydrophobicContact CE1-CD2 3.83Å; Y90-L196 WeakPolarHBondContact O-CB 3.15Å; N152-L196 PolarHBondContact N-O 2.98Å; V153-L196 HydrophobicContact CB-CD1 4.04Å; V153-L196 HydrophobicContact CB-CG 3.97Å; V153-L196 HydrophobicContact CG1-CD1 3.87Å; V153-L196 HydrophobicContact CG1-CD2 4.36Å; V153-L196 HydrophobicContact CG1-CG 3.93Å; V153-L196 PolarHBondContact N-O 2.86Å; V153-L196 PolarHBondContact O-N 2.93Å; A155-L196 HydrophobicContact CB-CD2 4.05Å; T169-L196 HydrophobicContact CG2-CD2 3.99Å; F194-L196 HydrophobicContact CD2-CD2 3.87Å; F194-L196 HydrophobicContact CE2-CD2 3.55Å
197	W	98.2	Very high	96.5	Very high	3 Å²	3	45.9 Å²	45.9	1%	0.011	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-99.3	137.8	-177	-59.7	-89.3	0	0	0	111.2	K48 P49 L52 Y90 L102 V143 C149 A151 A199	K48-W197 HydrophobicContact CG-CG 4.43Å; P49-W197 HydrophobicContact CG-CH2 3.81Å; P49-W197 HydrophobicContact CG-CZ2 3.73Å; L52-W197 HydrophobicContact CD1-CB 3.69Å; L52-W197 HydrophobicContact CD1-CD2 3.87Å; L52-W197 HydrophobicContact CD1-CE3 4.07Å; L52-W197 HydrophobicContact CD1-CG 3.67Å; L52-W197 HydrophobicContact CD2-CD2 4.07Å; L52-W197 HydrophobicContact CD2-CE3 3.58Å; L52-W197 HydrophobicContact CD2-CZ3 3.94Å; Y90-W197 PolarHBondContact N-O 3.21Å; Y90-W197 VanDerWaalsContact O-CE3 3.31Å; Y90-W197 PolarHBondContact O-N 2.96Å; L102-W197 HydrophobicContact CD2-CH2 3.65Å; L102-W197 HydrophobicContact CD2-CZ2 4.48Å; V143-W197 HydrophobicContact CG1-CH2 4.33Å; V143-W197 HydrophobicContact CG1-CZ2 4.38Å; C149-W197 HydrophobicContact CB-CZ2 4.14Å; C149-W197 PolarHBondContact O-NE1 3.4Å; A151-W197 HydrophobicContact CB-CZ2 4.4Å; W197-A199 VanDerWaalsContact C-N 3.27Å; W197-A199 PolarHBondContact O-N 2.95Å
198	S	97.1	Very high	96.4	Very high	64 Å²	64	49.3 Å²	49.3	45%	0.448	30%	0.296	S	S	.	.	S	Bend	trans	-69.8	-21.5	174.9	47.9	0	0	0	0	114	Y90 N152	Y90-S198 WeakPolarHBondContact CD2-O 3.41Å; Y90-S198 WeakPolarHBondContact CE2-O 3.26Å; N152-S198 VanDerWaalsContact CG-OG 3.24Å; N152-S198 PolarHBondContact ND2-OG 3.34Å; N152-S198 WeakPolarHBondContact OD1-CB 3.44Å; N152-S198 PolarHBondContact OD1-N 3.15Å; N152-S198 PolarHBondContact OD1-OG 2.87Å
199	A	95.1	Very high	96.4	Very high	49 Å²	49	42.7 Å²	42.7	41%	0.405	28%	0.28	S	S	.	.			trans	-143.3	152	179.9	0	0	0	0	0	110.5	K48 L52 Y90 W197	K48-A199 VanDerWaalsContact CE-O 3.3Å; K48-A199 WeakPolarHBondContact CE-O 3.5Å; K48-A199 PolarHBondContact NZ-O 3.31Å; L52-A199 WeakPolarHBondContact CD1-O 2.98Å; Y90-A199 VanDerWaalsContact CD2-CA 3.47Å; W197-A199 VanDerWaalsContact C-N 3.27Å; W197-A199 PolarHBondContact O-N 2.95Å
200	A	90.6	Very high	96.3	Very high	78 Å²	78	38.8 Å²	38.8	65%	0.645	27%	0.265	S	S	*	.			trans	-61.1	0	166.1	0	0	0	0	0	111.4	K48 L52 Y90	K48-A200 WeakPolarHBondContact CE-OXT 3.46Å; K48-A200 PolarHBondContact NZ-O 3.4Å; K48-A200 PolarHBondContact NZ-OXT 2.75Å; L52-A200 HydrophobicContact CB-CB 4.09Å; Y90-A200 HydrophobicContact CD1-CB 3.76Å; Y90-A200 HydrophobicContact CE1-CB 3.8Å; Y90-A200 HydrophobicContact CG-CB 4.48Å

Retrieved 200 of 200 residues in 192.3 ms (Link to these results)

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