A0A077ZHN9_TRITR Loading...

WAP domain containing protein, SLPI-like

AlphaFold DB , UniProt , Accession A0A077ZHN9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 167 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	P	40.9	Very low	51.8	Low	157 Å²	157	143.9 Å²	143.9	100%	1.019	78%	0.779	S	S	*	*				0	111	0	25.8	-34.2	0	0	0	108.5	F3	P1-F3 PolarHBondContact O-N 2.7Å
2	S	49	Very low	52.1	Low	122 Å²	122	140.9 Å²	140.9	85%	0.853	77%	0.772	S	S	*	*			trans	-71.8	112.9	-172.9	-61.5	0	0	0	0	110.9	K4	S2-K4 PolarHBondContact O-N 3.22Å
3	F	51.2	Low	52.3	Low	197 Å²	197	135.5 Å²	135.5	86%	0.864	75%	0.748	S	S	*	*			trans	-72.5	115	169.6	-58.4	-84.9	0	0	0	108.5	P1	P1-F3 PolarHBondContact O-N 2.7Å
4	K	54.8	Low	52	Low	178 Å²	178	137.1 Å²	137.1	77%	0.774	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-92.7	123.3	167.4	-79.1	-175.5	174.4	-176.4	0	108.8	S2	S2-K4 PolarHBondContact O-N 3.22Å
5	C	52.1	Low	52.4	Low	126 Å²	126	137.3 Å²	137.3	85%	0.851	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-68.1	128.9	165	-65	0	0	0	0	108.8
6	F	55.3	Low	52.8	Low	158 Å²	158	131.4 Å²	131.4	69%	0.693	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-90.8	131.1	168.9	-78.9	-89.8	0	0	0	108.9	D10	F6-D10 WeakPolarHBondContact CA-OD2 3.05Å; F6-D10 HydrophobicContact CD1-CB 3.94Å; F6-D10 WeakPolarHBondContact CD1-OD2 2.7Å
7	N	52.9	Low	53.1	Low	122 Å²	122	129 Å²	129	65%	0.652	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-79.7	149.4	171.9	-85.4	-61	0	0	0	108.3	L9 D10	N7-L9 PolarHBondContact O-N 3.49Å; N7-D10 PolarHBondContact N-OD2 2.98Å; N7-D10 WeakPolarHBondContact O-CB 3.44Å; N7-D10 PolarHBondContact O-N 2.84Å
8	L	54.3	Low	53.2	Low	191 Å²	191	124.2 Å²	124.2	100%	1	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	4.5	176.7	-71.8	159.9	0	0	0	114.3
9	L	53.8	Low	53.6	Low	165 Å²	165	120.2 Å²	120.2	86%	0.864	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-3.3	176.1	-72.2	161.1	0	0	0	112.8	N7	N7-L9 PolarHBondContact O-N 3.49Å
10	D	52.9	Low	54.1	Low	78 Å²	78	115.7 Å²	115.7	42%	0.417	65%	0.65	S	S	.	*	S	Bend	trans	-72.2	131.8	176.5	-69.9	-62.1	0	0	0	109.9	F6 N7	F6-D10 WeakPolarHBondContact CA-OD2 3.05Å; F6-D10 HydrophobicContact CD1-CB 3.94Å; F6-D10 WeakPolarHBondContact CD1-OD2 2.7Å; N7-D10 PolarHBondContact N-OD2 2.98Å; N7-D10 WeakPolarHBondContact O-CB 3.44Å; N7-D10 PolarHBondContact O-N 2.84Å
11	P	52.6	Low	54.5	Low	89 Å²	89	111.9 Å²	111.9	58%	0.578	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-55.4	143	177.3	23.6	-32.7	0	0	0	109.4
12	P	55	Low	55.2	Low	108 Å²	108	112.2 Å²	112.2	70%	0.701	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-52.4	135.4	-178.4	21.6	-32	0	0	0	108.9	F14	P12-F14 PolarHBondContact O-N 3.15Å; P12-F14 VanDerWaalsContact O-N 3.08Å
13	P	55.1	Low	55.4	Low	71 Å²	71	110.7 Å²	110.7	46%	0.461	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-53.1	123.5	-174.8	21	-32.3	0	0	0	108.7	I15	P13-I15 WeakPolarHBondContact O-CG1 3.38Å; P13-I15 PolarHBondContact O-N 2.91Å
14	F	48.7	Very low	55.1	Low	158 Å²	158	107 Å²	107	69%	0.693	59%	0.586	S	S	*	*			trans	-51	106	177.4	-73.9	-87.5	0	0	0	109.4	P12 K16 N39	P12-F14 PolarHBondContact O-N 3.15Å; P12-F14 VanDerWaalsContact O-N 3.08Å; F14-K16 PolarHBondContact O-N 3.25Å; F14-N39 PolarHBondContact O-OD1 2.92Å
15	I	57.9	Low	54.8	Low	140 Å²	140	100.9 Å²	100.9	72%	0.718	57%	0.574	S	S	*	*			trans	-76.2	110.6	177.9	-57.1	177.1	0	0	0	106.4	P13	P13-I15 WeakPolarHBondContact O-CG1 3.38Å; P13-I15 PolarHBondContact O-N 2.91Å
16	K	59	Low	54.6	Low	43 Å²	43	100.4 Å²	100.4	19%	0.187	57%	0.568	C	S	.	*			trans	-65	140.9	177.4	-70.4	175	-179	177.5	0	110	F14 D38 C41 D43 M45 K46	F14-K16 PolarHBondContact O-N 3.25Å; K16-D38 HydrophobicContact CB-CB 4.3Å; K16-D38 HydrophobicContact CD-CB 4.25Å; K16-D38 VanDerWaalsContact CE-O 3.29Å; K16-D38 WeakPolarHBondContact CE-O 3.16Å; K16-D38 HydrophobicContact CG-CB 4.24Å; K16-D38 PolarHBondContact N-OD2 3.45Å; K16-D38 PolarHBondContact NZ-O 3.27Å; K16-C41 PolarHBondContact NZ-O 3.19Å; K16-D43 WeakPolarHBondContact CD-O 3.46Å; K16-D43 WeakPolarHBondContact CE-O 3.28Å; K16-D43 PolarHBondContact NZ-O 2.91Å; K16-M45 WeakPolarHBondContact CD-O 3.44Å; K16-M45 PolarHBondContact NZ-O 2.92Å; K16-K46 HydrophobicContact CB-CG 4.22Å; K16-K46 PolarHBondContact O-NZ 2.85Å
17	A	56.8	Low	54.6	Low	90 Å²	90	97.4 Å²	97.4	74%	0.744	56%	0.564	S	S	*	*	S	Bend	trans	-61.5	141.4	-177.1	0	0	0	0	0	111.7	P59	A17-P59 WeakPolarHBondContact O-CG 3.39Å
18	G	55.1	Low	54.5	Low	43 Å²	43	95.3 Å²	95.3	44%	0.443	55%	0.552	S	S	.	*	S	Bend	trans	109	177.8	175.5	0	0	0	0	0	114.9	K46 P59	G18-K46 VanDerWaalsContact C-CD 3.44Å; G18-K46 WeakPolarHBondContact O-CD 3.26Å; G18-K46 WeakPolarHBondContact O-CE 3.21Å; G18-P59 VanDerWaalsContact CA-CB 3.42Å
19	V	60.4	Low	54.5	Low	47 Å²	47	92.7 Å²	92.7	29%	0.285	55%	0.549	S	S	.	.			trans	-122.2	137.8	-170.8	-176.5	0	0	0	0	110.3	P59 D60 Y73	V19-P59 CarbonylContact O-C 3.59Å; V19-P59 WeakPolarHBondContact O-CA 3.3Å; V19-D60 PolarHBondContact O-N 3.29Å; V19-Y73 HydrophobicContact CG2-CE2 4.13Å
20	C	64.4	Low	54.5	Low	31 Å²	31	90.5 Å²	90.5	21%	0.209	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-58.5	127.7	172.7	-71.3	0	0	0	0	110.7	W22 C48	C20-W22 PolarHBondContact O-N 2.55Å; C20-C48 WeakPolarHBondContact CA-SG 2.98Å; C20-C48 HydrophobicContact CB-CB 3.47Å; C20-C48 VanDerWaalsContact CB-CB 3.47Å; C20-C48 WeakPolarHBondContact CB-SG 3.46Å; C20-C48 WeakPolarHBondContact SG-CA 3.12Å; C20-C48 WeakPolarHBondContact SG-CB 3.33Å; C20-C48 CovalentContact SG-SG 2.01Å; C20-C48 PolarHBondContact SG-SG 3.05Å
21	P	62	Low	54.6	Low	36 Å²	36	89.2 Å²	89.2	23%	0.234	54%	0.536	C	S	.	.	P	Polyproline II helix	trans	-60	126.5	173.2	25.6	-32.4	0	0	0	108.1	L23 L57 D60	P21-L23 PolarHBondContact O-N 3.19Å; P21-L57 HydrophobicContact CG-CB 3.97Å; P21-L57 HydrophobicContact CG-CD1 3.68Å; P21-L57 HydrophobicContact CG-CG 4.41Å; P21-D60 HydrophobicContact CB-CB 4.17Å
22	W	55.9	Low	55	Low	164 Å²	164	90.5 Å²	90.5	62%	0.621	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-67.5	121.7	-178	-176.6	-83.8	0	0	0	109.6	C20 M67	C20-W22 PolarHBondContact O-N 2.55Å; W22-M67 VanDerWaalsContact CD1-CE 3.4Å; W22-M67 HydrophobicContact CG-CE 4.27Å; W22-M67 HydrophobicContact CZ2-SD 4.08Å
23	L	53.5	Low	55.6	Low	90 Å²	90	88.4 Å²	88.4	47%	0.471	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-100.3	118.1	167.1	-66.9	172.6	0	0	0	107.9	P21 G25 T50 L57	P21-L23 PolarHBondContact O-N 3.19Å; L23-G25 PolarHBondContact O-N 3.16Å; L23-T50 HydrophobicContact CD1-CG2 3.61Å; L23-L57 HydrophobicContact CD1-CD1 4.48Å
24	V	45.3	Very low	56.4	Low	118 Å²	118	90 Å²	90	72%	0.715	53%	0.528	S	S	*	.			trans	-73.2	111.7	175.8	-157.5	0	0	0	0	108.1	M67	V24-M67 HydrophobicContact CG1-CE 4.29Å; V24-M67 HydrophobicContact CG2-CE 3.83Å
25	G	48	Very low	57.7	Low	50 Å²	50	82.5 Å²	82.5	52%	0.515	50%	0.495	S	S	.	.	S	Bend	trans	156.1	167.7	163	0	0	0	0	0	114.4	L23	L23-G25 PolarHBondContact O-N 3.16Å
26	T	48.5	Very low	58.3	Low	117 Å²	117	80 Å²	80	72%	0.718	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-80.1	133.3	-177.5	44.5	0	0	0	0	111.3	I28 L51	T26-I28 PolarHBondContact O-N 2.9Å; T26-L51 WeakPolarHBondContact O-CD1 3.47Å
27	P	53.5	Low	58.8	Low	94 Å²	94	83.3 Å²	83.3	61%	0.61	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-60.4	129.2	176.9	25.5	-32.9	0	0	0	110.1
28	I	51.7	Low	59.3	Low	79 Å²	79	80.2 Å²	80.2	41%	0.405	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-75.6	135.6	177.6	-45.9	170.5	0	0	0	108.1	T26 N30 S31 L51 I52	T26-I28 PolarHBondContact O-N 2.9Å; I28-N30 WeakPolarHBondContact CG2-OD1 3.32Å; I28-N30 PolarHBondContact O-N 2.72Å; I28-S31 WeakPolarHBondContact O-CB 3.47Å; I28-S31 PolarHBondContact O-N 2.86Å; I28-S31 VanDerWaalsContact O-N 3.14Å; I28-S31 PolarHBondContact O-OG 2.03Å; I28-L51 HydrophobicContact CD1-CD2 4.4Å; I28-L51 HydrophobicContact CD1-CG 4.38Å; I28-L51 HydrophobicContact CG1-CG 4.25Å; I28-L51 WeakPolarHBondContact CG1-O 3.35Å; I28-L51 PolarHBondContact N-O 2.93Å; I28-I52 HydrophobicContact CD1-CG1 4.17Å
29	S	53.4	Low	60	Low	135 Å²	135	82.3 Å²	82.3	94%	0.944	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-7.9	-173.1	-98.9	0	0	0	0	116.2
30	N	54.4	Low	60.6	Low	120 Å²	120	84.3 Å²	84.3	64%	0.642	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	36	178.2	63.6	-40.2	0	0	0	111.9	I28	I28-N30 WeakPolarHBondContact CG2-OD1 3.32Å; I28-N30 PolarHBondContact O-N 2.72Å
31	S	55.7	Low	61	Low	51 Å²	51	83.1 Å²	83.1	36%	0.357	47%	0.471	S	S	.	.			trans	-74	130.3	-173.3	18.1	0	0	0	0	112.2	I28 I52	I28-S31 WeakPolarHBondContact O-CB 3.47Å; I28-S31 PolarHBondContact O-N 2.86Å; I28-S31 VanDerWaalsContact O-N 3.14Å; I28-S31 PolarHBondContact O-OG 2.03Å; S31-I52 CarbonylContact C-O 3.47Å; S31-I52 WeakPolarHBondContact CA-O 3.45Å; S31-I52 VanDerWaalsContact CB-C 3.4Å; S31-I52 VanDerWaalsContact CB-O 3.24Å; S31-I52 WeakPolarHBondContact CB-O 3.26Å
32	I	59.5	Low	61.6	Low	116 Å²	116	89.1 Å²	89.1	60%	0.595	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.3	174.1	-61.8	174.2	0	0	0	107.7	I34 I52	I32-I34 HydrophobicContact CG2-CG1 4.4Å; I32-I34 PolarHBondContact O-N 3.11Å; I32-I52 PolarHBondContact N-O 2.59Å
33	S	68.3	Low	62.4	Low	64 Å²	64	87.5 Å²	87.5	45%	0.448	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	107.9	172.3	-63	0	0	0	0	109.3
34	I	73.2	Confident	62.9	Low	105 Å²	105	86.4 Å²	86.4	54%	0.538	50%	0.501	S	S	.	.	S	Bend	trans	-77.6	-27.3	175.2	-58.3	-162.7	0	0	0	110.9	I32 R54 Y55	I32-I34 HydrophobicContact CG2-CG1 4.4Å; I32-I34 PolarHBondContact O-N 3.11Å; I34-R54 WeakPolarHBondContact CB-O 3.24Å; I34-R54 PolarHBondContact N-O 3.33Å; I34-Y55 HydrophobicContact CD1-CD1 3.54Å; I34-Y55 HydrophobicContact CD1-CE1 3.09Å; I34-Y55 HydrophobicContact CD1-CG 4.42Å; I34-Y55 HydrophobicContact CG1-CD1 4.09Å; I34-Y55 HydrophobicContact CG1-CE1 3.8Å; I34-Y55 HydrophobicContact CG1-CE2 4.38Å
35	C	74.8	Confident	64	Low	0 Å²	0	83.3 Å²	83.3	0%	0	48%	0.479	C	S	.	.			trans	-134.5	154.8	178.1	64.9	0	0	0	0	110.5	D40 C47 R54	C35-D40 HydrophobicContact CB-CB 3.8Å; C35-C47 HydrophobicContact CB-CB 3.67Å; C35-C47 WeakPolarHBondContact CB-SG 3.03Å; C35-C47 PolarHBondContact O-SG 3.13Å; C35-C47 WeakPolarHBondContact SG-CA 3.11Å; C35-C47 WeakPolarHBondContact SG-CB 3.28Å; C35-C47 CovalentContact SG-SG 2.03Å; C35-C47 PolarHBondContact SG-SG 3.44Å; C35-R54 PolarHBondContact N-O 2.76Å; C35-R54 WeakPolarHBondContact O-CB 2.98Å; C35-R54 VanDerWaalsContact SG-C 3.59Å
36	N	71.6	Confident	65.1	Low	88 Å²	88	81.8 Å²	81.8	47%	0.471	46%	0.458	S	S	.	.	S	Bend	trans	-112.1	-32.5	170.5	-68.4	-69	0	0	0	111.4	D40 R54	N36-D40 WeakPolarHBondContact CA-OD2 3.49Å; N36-D40 PolarHBondContact N-OD2 2.77Å; N36-R54 PolarHBondContact O-NH2 2.82Å
37	F	69.1	Low	66.4	Low	112 Å²	112	76.5 Å²	76.5	49%	0.491	43%	0.426	S	S	.	.	S	Bend	trans	-136.5	159.5	-176.2	-55.6	-81.3	0	0	0	111.3	N39 D40 C47	F37-N39 PolarHBondContact O-N 3.4Å; F37-N39 VanDerWaalsContact O-N 3.07Å; F37-D40 PolarHBondContact N-OD2 2.96Å; F37-D40 WeakPolarHBondContact O-CB 3.37Å; F37-D40 PolarHBondContact O-N 3.13Å; F37-C47 VanDerWaalsContact O-CB 3.26Å; F37-C47 WeakPolarHBondContact O-CB 3.3Å
38	D	67.9	Low	67.3	Low	24 Å²	24	72 Å²	72	13%	0.128	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-56.4	-25.8	176.8	-70.4	-10.2	0	0	0	113.1	K16 D40 C41 K46 C47	K16-D38 HydrophobicContact CB-CB 4.3Å; K16-D38 HydrophobicContact CD-CB 4.25Å; K16-D38 VanDerWaalsContact CE-O 3.29Å; K16-D38 WeakPolarHBondContact CE-O 3.16Å; K16-D38 HydrophobicContact CG-CB 4.24Å; K16-D38 PolarHBondContact N-OD2 3.45Å; K16-D38 PolarHBondContact NZ-O 3.27Å; D38-D40 VanDerWaalsContact C-N 3.31Å; D38-C41 WeakPolarHBondContact O-CB 3.12Å; D38-C41 PolarHBondContact O-N 2.04Å; D38-K46 WeakPolarHBondContact OD1-CA 3.01Å; D38-K46 WeakPolarHBondContact OD1-CB 3.34Å; D38-K46 IonicContact OD1-NZ 2.76Å; D38-K46 IonicContact OD2-NZ 3.89Å; D38-K46 PolarHBondContact OD2-NZ 3.14Å; D38-C47 PolarHBondContact OD1-N 2.94Å
39	N	68.5	Low	68.2	Low	87 Å²	87	72.4 Å²	72.4	47%	0.465	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-73.2	-20.2	176.5	-71.9	-13.5	0	0	0	113.7	F14 F37 C41	F14-N39 PolarHBondContact O-OD1 2.92Å; F37-N39 PolarHBondContact O-N 3.4Å; F37-N39 VanDerWaalsContact O-N 3.07Å; N39-C41 PolarHBondContact O-N 3Å
40	D	73.1	Confident	68.7	Low	89 Å²	89	67 Å²	67	48%	0.476	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-73.3	-14.9	171.8	-61.9	-49.3	0	0	0	111.4	C35 N36 F37 D38	C35-D40 HydrophobicContact CB-CB 3.8Å; N36-D40 WeakPolarHBondContact CA-OD2 3.49Å; N36-D40 PolarHBondContact N-OD2 2.77Å; F37-D40 PolarHBondContact N-OD2 2.96Å; F37-D40 WeakPolarHBondContact O-CB 3.37Å; F37-D40 PolarHBondContact O-N 3.13Å; D38-D40 VanDerWaalsContact C-N 3.31Å
41	C	73.3	Confident	69.2	Low	7 Å²	7	64.5 Å²	64.5	5%	0.047	35%	0.352	C	S	.	.	S	Bend	trans	-91.8	146.3	178.8	-57.5	0	0	0	0	111	K16 D38 N39 M45 C56	K16-C41 PolarHBondContact NZ-O 3.19Å; D38-C41 WeakPolarHBondContact O-CB 3.12Å; D38-C41 PolarHBondContact O-N 2.04Å; N39-C41 PolarHBondContact O-N 3Å; C41-M45 HydrophobicContact CB-CB 3.9Å; C41-M45 VanDerWaalsContact CB-O 3.26Å; C41-M45 WeakPolarHBondContact CB-O 3.2Å; C41-C56 WeakPolarHBondContact CA-SG 3.23Å; C41-C56 HydrophobicContact CB-CB 3.59Å; C41-C56 WeakPolarHBondContact CB-SG 3.02Å; C41-C56 WeakPolarHBondContact SG-CA 3.36Å; C41-C56 WeakPolarHBondContact SG-CB 3.36Å; C41-C56 CovalentContact SG-SG 2.03Å; C41-C56 PolarHBondContact SG-SG 2.9Å
42	K	75.2	Confident	69.5	Low	162 Å²	162	66.4 Å²	66.4	70%	0.704	36%	0.357	S	S	*	.	S	Bend	trans	-78.2	160.1	171.6	-64.3	-179.4	179.9	179.7	0	110.1	M45	K42-M45 HydrophobicContact CB-CE 3.92Å; K42-M45 WeakPolarHBondContact O-CB 3.01Å; K42-M45 WeakPolarHBondContact O-CE 3.39Å; K42-M45 PolarHBondContact O-N 3.24Å
43	D	70.8	Confident	69.9	Low	130 Å²	130	61.2 Å²	61.2	70%	0.695	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	-149.5	172.8	-50.6	-60.4	0	0	0	114.2	K16 M45	K16-D43 WeakPolarHBondContact CD-O 3.46Å; K16-D43 WeakPolarHBondContact CE-O 3.28Å; K16-D43 PolarHBondContact NZ-O 2.91Å; D43-M45 HydrophobicContact CB-CE 4.26Å; D43-M45 PolarHBondContact O-N 2.85Å
44	A	65.3	Low	70.1	Confident	66 Å²	66	62.9 Å²	62.9	55%	0.545	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	13.6	175.1	0	0	0	0	0	113.7	P59	A44-P59 WeakPolarHBondContact O-CD 3.37Å; A44-P59 WeakPolarHBondContact O-CG 3Å
45	M	67.2	Low	70.2	Confident	54 Å²	54	61.2 Å²	61.2	27%	0.266	32%	0.316	S	S	.	.			trans	-76.7	145.3	-179.1	-65.4	178.9	-87.2	0	0	112	K16 C41 K42 D43 C56 L57	K16-M45 WeakPolarHBondContact CD-O 3.44Å; K16-M45 PolarHBondContact NZ-O 2.92Å; C41-M45 HydrophobicContact CB-CB 3.9Å; C41-M45 VanDerWaalsContact CB-O 3.26Å; C41-M45 WeakPolarHBondContact CB-O 3.2Å; K42-M45 HydrophobicContact CB-CE 3.92Å; K42-M45 WeakPolarHBondContact O-CB 3.01Å; K42-M45 WeakPolarHBondContact O-CE 3.39Å; K42-M45 PolarHBondContact O-N 3.24Å; D43-M45 HydrophobicContact CB-CE 4.26Å; D43-M45 PolarHBondContact O-N 2.85Å; M45-C56 HydrophobicContact CB-CB 4.3Å; M45-C56 HydrophobicContact SD-CB 4.46Å; M45-L57 WeakPolarHBondContact CA-O 2.99Å
46	K	71	Confident	70.3	Confident	18 Å²	18	63.1 Å²	63.1	8%	0.078	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	150	-179.6	-66.4	-179.6	66.7	68.8	0	111.2	K16 G18 D38 C48 C56 L57 P59	K16-K46 HydrophobicContact CB-CG 4.22Å; K16-K46 PolarHBondContact O-NZ 2.85Å; G18-K46 VanDerWaalsContact C-CD 3.44Å; G18-K46 WeakPolarHBondContact O-CD 3.26Å; G18-K46 WeakPolarHBondContact O-CE 3.21Å; D38-K46 WeakPolarHBondContact OD1-CA 3.01Å; D38-K46 WeakPolarHBondContact OD1-CB 3.34Å; D38-K46 IonicContact OD1-NZ 2.76Å; D38-K46 IonicContact OD2-NZ 3.89Å; D38-K46 PolarHBondContact OD2-NZ 3.14Å; K46-C48 PolarHBondContact O-N 2.78Å; K46-C48 PolarHBondContact O-SG 2.75Å; K46-C56 CarbonylContact O-C 3.55Å; K46-C56 VanDerWaalsContact O-CA 3.31Å; K46-C56 WeakPolarHBondContact O-CA 3.39Å; K46-L57 PolarHBondContact N-O 2.88Å; K46-L57 PolarHBondContact O-N 3.33Å; K46-P59 HydrophobicContact CD-CB 4.12Å
47	C	75.8	Confident	70.3	Confident	5 Å²	5	61 Å²	61	3%	0.034	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	98.7	177.2	-179.1	0	0	0	0	110.9	C35 F37 D38	C35-C47 HydrophobicContact CB-CB 3.67Å; C35-C47 WeakPolarHBondContact CB-SG 3.03Å; C35-C47 PolarHBondContact O-SG 3.13Å; C35-C47 WeakPolarHBondContact SG-CA 3.11Å; C35-C47 WeakPolarHBondContact SG-CB 3.28Å; C35-C47 CovalentContact SG-SG 2.03Å; C35-C47 PolarHBondContact SG-SG 3.44Å; F37-C47 VanDerWaalsContact O-CB 3.26Å; F37-C47 WeakPolarHBondContact O-CB 3.3Å; D38-C47 PolarHBondContact OD1-N 2.94Å
48	C	74	Confident	70.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.3	-167.8	-61.7	0	0	0	0	112	C20 K46 R54 Y55 L57	C20-C48 WeakPolarHBondContact CA-SG 2.98Å; C20-C48 HydrophobicContact CB-CB 3.47Å; C20-C48 VanDerWaalsContact CB-CB 3.47Å; C20-C48 WeakPolarHBondContact CB-SG 3.46Å; C20-C48 WeakPolarHBondContact SG-CA 3.12Å; C20-C48 WeakPolarHBondContact SG-CB 3.33Å; C20-C48 CovalentContact SG-SG 2.01Å; C20-C48 PolarHBondContact SG-SG 3.05Å; K46-C48 PolarHBondContact O-N 2.78Å; K46-C48 PolarHBondContact O-SG 2.75Å; C48-R54 CarbonylContact O-C 3.6Å; C48-R54 WeakPolarHBondContact O-CA 3.44Å; C48-Y55 PolarHBondContact N-O 2.77Å; C48-Y55 PolarHBondContact O-N 2.77Å; C48-L57 HydrophobicContact CB-CB 4.05Å; C48-L57 HydrophobicContact CB-CD1 3.58Å; C48-L57 HydrophobicContact CB-CG 3.87Å
49	P	70.4	Confident	70	Confident	87 Å²	87	63.4 Å²	63.4	57%	0.565	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	136.6	170.2	30.3	-33	0	0	0	109.9	G53	P49-G53 CarbonylContact C-O 3.39Å
50	T	64.3	Low	69.5	Low	23 Å²	23	62.7 Å²	62.7	14%	0.141	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	171	176.6	76.8	0	0	0	0	109.4	L23 I52 G53 Y55 L57	L23-T50 HydrophobicContact CD1-CG2 3.61Å; T50-I52 PolarHBondContact O-N 2.9Å; T50-I52 VanDerWaalsContact O-N 3.14Å; T50-I52 PolarHBondContact OG1-N 2.98Å; T50-G53 WeakPolarHBondContact CA-O 3.29Å; T50-G53 PolarHBondContact N-O 2.03Å; T50-G53 PolarHBondContact O-N 2.76Å; T50-G53 PolarHBondContact OG1-N 3.3Å; T50-G53 PolarHBondContact OG1-O 2.97Å; T50-Y55 HydrophobicContact CG2-CD2 4.01Å; T50-Y55 HydrophobicContact CG2-CG 4.28Å; T50-Y55 VanDerWaalsContact OG1-CD2 3.32Å; T50-Y55 WeakPolarHBondContact OG1-CD2 3.29Å; T50-L57 HydrophobicContact CG2-CD1 4Å
51	L	63.7	Low	68.6	Low	67 Å²	67	63.2 Å²	63.2	35%	0.351	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.9	176.4	-154.8	75.5	0	0	0	112.9	T26 I28	T26-L51 WeakPolarHBondContact O-CD1 3.47Å; I28-L51 HydrophobicContact CD1-CD2 4.4Å; I28-L51 HydrophobicContact CD1-CG 4.38Å; I28-L51 HydrophobicContact CG1-CG 4.25Å; I28-L51 WeakPolarHBondContact CG1-O 3.35Å; I28-L51 PolarHBondContact N-O 2.93Å
52	I	62.6	Low	67.4	Low	91 Å²	91	68.9 Å²	68.9	47%	0.467	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	10.5	-172.1	-53.7	166.5	0	0	0	111.1	I28 S31 I32 T50	I28-I52 HydrophobicContact CD1-CG1 4.17Å; S31-I52 CarbonylContact C-O 3.47Å; S31-I52 WeakPolarHBondContact CA-O 3.45Å; S31-I52 VanDerWaalsContact CB-C 3.4Å; S31-I52 VanDerWaalsContact CB-O 3.24Å; S31-I52 WeakPolarHBondContact CB-O 3.26Å; I32-I52 PolarHBondContact N-O 2.59Å; T50-I52 PolarHBondContact O-N 2.9Å; T50-I52 VanDerWaalsContact O-N 3.14Å; T50-I52 PolarHBondContact OG1-N 2.98Å
53	G	68	Low	66.2	Low	7 Å²	7	62.8 Å²	62.8	7%	0.072	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	132.2	-139.3	176.1	0	0	0	0	0	112.8	P49 T50	P49-G53 CarbonylContact C-O 3.39Å; T50-G53 WeakPolarHBondContact CA-O 3.29Å; T50-G53 PolarHBondContact N-O 2.03Å; T50-G53 PolarHBondContact O-N 2.76Å; T50-G53 PolarHBondContact OG1-N 3.3Å; T50-G53 PolarHBondContact OG1-O 2.97Å
54	R	71.6	Confident	65.2	Low	99 Å²	99	59.8 Å²	59.8	37%	0.374	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.4	-179.8	-61.1	-174.1	77.2	156.1	-0.2	110	I34 C35 N36 C48	I34-R54 WeakPolarHBondContact CB-O 3.24Å; I34-R54 PolarHBondContact N-O 3.33Å; C35-R54 PolarHBondContact N-O 2.76Å; C35-R54 WeakPolarHBondContact O-CB 2.98Å; C35-R54 VanDerWaalsContact SG-C 3.59Å; N36-R54 PolarHBondContact O-NH2 2.82Å; C48-R54 CarbonylContact O-C 3.6Å; C48-R54 WeakPolarHBondContact O-CA 3.44Å
55	Y	76.4	Confident	64.4	Low	70 Å²	70	65.5 Å²	65.5	28%	0.275	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.8	-174.3	-75.8	-107	0	0	0	110.7	I34 C48 T50 L57	I34-Y55 HydrophobicContact CD1-CD1 3.54Å; I34-Y55 HydrophobicContact CD1-CE1 3.09Å; I34-Y55 HydrophobicContact CD1-CG 4.42Å; I34-Y55 HydrophobicContact CG1-CD1 4.09Å; I34-Y55 HydrophobicContact CG1-CE1 3.8Å; I34-Y55 HydrophobicContact CG1-CE2 4.38Å; C48-Y55 PolarHBondContact N-O 2.77Å; C48-Y55 PolarHBondContact O-N 2.77Å; T50-Y55 HydrophobicContact CG2-CD2 4.01Å; T50-Y55 HydrophobicContact CG2-CG 4.28Å; T50-Y55 VanDerWaalsContact OG1-CD2 3.32Å; T50-Y55 WeakPolarHBondContact OG1-CD2 3.29Å; Y55-L57 PolarHBondContact O-N 3Å
56	C	75.5	Confident	62.9	Low	40 Å²	40	68.3 Å²	68.3	27%	0.27	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	110	173.1	-65.3	0	0	0	0	110	C41 M45 K46	C41-C56 WeakPolarHBondContact CA-SG 3.23Å; C41-C56 HydrophobicContact CB-CB 3.59Å; C41-C56 WeakPolarHBondContact CB-SG 3.02Å; C41-C56 WeakPolarHBondContact SG-CA 3.36Å; C41-C56 WeakPolarHBondContact SG-CB 3.36Å; C41-C56 CovalentContact SG-SG 2.03Å; C41-C56 PolarHBondContact SG-SG 2.9Å; M45-C56 HydrophobicContact CB-CB 4.3Å; M45-C56 HydrophobicContact SD-CB 4.46Å; K46-C56 CarbonylContact O-C 3.55Å; K46-C56 VanDerWaalsContact O-CA 3.31Å; K46-C56 WeakPolarHBondContact O-CA 3.39Å
57	L	72.1	Confident	61.8	Low	44 Å²	44	72.8 Å²	72.8	23%	0.23	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	146.9	179.2	-58.4	179.1	0	0	0	110.3	P21 L23 M45 K46 C48 T50 Y55	P21-L57 HydrophobicContact CG-CB 3.97Å; P21-L57 HydrophobicContact CG-CD1 3.68Å; P21-L57 HydrophobicContact CG-CG 4.41Å; L23-L57 HydrophobicContact CD1-CD1 4.48Å; M45-L57 WeakPolarHBondContact CA-O 2.99Å; K46-L57 PolarHBondContact N-O 2.88Å; K46-L57 PolarHBondContact O-N 3.33Å; C48-L57 HydrophobicContact CB-CB 4.05Å; C48-L57 HydrophobicContact CB-CD1 3.58Å; C48-L57 HydrophobicContact CB-CG 3.87Å; T50-L57 HydrophobicContact CG2-CD1 4Å; Y55-L57 PolarHBondContact O-N 3Å
58	Q	68.9	Low	60	Low	156 Å²	156	75.7 Å²	75.7	73%	0.729	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-67.1	132.3	170.3	-168.2	172	-56.8	0	0	108.6	D60	Q58-D60 PolarHBondContact O-N 2.83Å
59	P	62.3	Low	58.5	Low	29 Å²	29	84 Å²	84	19%	0.188	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-64.2	127.4	177.9	23	-31.8	0	0	0	110.5	A17 G18 V19 A44 K46	A17-P59 WeakPolarHBondContact O-CG 3.39Å; G18-P59 VanDerWaalsContact CA-CB 3.42Å; V19-P59 CarbonylContact O-C 3.59Å; V19-P59 WeakPolarHBondContact O-CA 3.3Å; A44-P59 WeakPolarHBondContact O-CD 3.37Å; A44-P59 WeakPolarHBondContact O-CG 3Å; K46-P59 HydrophobicContact CD-CB 4.12Å
60	D	57.7	Low	57.5	Low	73 Å²	73	88.5 Å²	88.5	39%	0.39	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-84.2	119.5	175.4	-169.2	-80.5	0	0	0	108.8	V19 P21 Q58 N62 A63	V19-D60 PolarHBondContact O-N 3.29Å; P21-D60 HydrophobicContact CB-CB 4.17Å; Q58-D60 PolarHBondContact O-N 2.83Å; D60-N62 PolarHBondContact O-N 2.95Å; D60-N62 VanDerWaalsContact O-N 3.12Å; D60-N62 WeakPolarHBondContact OD1-CA 3.28Å; D60-N62 WeakPolarHBondContact OD1-CB 3Å; D60-N62 PolarHBondContact OD1-N 2.61Å; D60-A63 HydrophobicContact CB-CB 3.81Å; D60-A63 PolarHBondContact OD1-N 3.02Å
61	A	53.6	Low	56.7	Low	100 Å²	100	98.8 Å²	98.8	83%	0.826	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.8	179.3	0	0	0	0	0	113.1
62	N	49.1	Very low	55.6	Low	126 Å²	126	104.6 Å²	104.6	67%	0.674	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.5	-2.7	-172.1	-73.8	-23	0	0	0	114.7	D60 S64	D60-N62 PolarHBondContact O-N 2.95Å; D60-N62 VanDerWaalsContact O-N 3.12Å; D60-N62 WeakPolarHBondContact OD1-CA 3.28Å; D60-N62 WeakPolarHBondContact OD1-CB 3Å; D60-N62 PolarHBondContact OD1-N 2.61Å; N62-S64 PolarHBondContact O-N 3.44Å
63	A	50.3	Low	54.6	Low	33 Å²	33	106.7 Å²	106.7	27%	0.273	55%	0.55	S	S	.	.			trans	-67.6	-1.8	-177.5	0	0	0	0	0	115	D60 K65	D60-A63 HydrophobicContact CB-CB 3.81Å; D60-A63 PolarHBondContact OD1-N 3.02Å; A63-K65 PolarHBondContact O-N 2.79Å
64	S	50.5	Low	53.6	Low	67 Å²	67	107.5 Å²	107.5	47%	0.469	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	27.2	173.8	-174.7	0	0	0	0	113.8	N62	N62-S64 PolarHBondContact O-N 3.44Å
65	K	47.6	Very low	52.7	Low	186 Å²	186	106.9 Å²	106.9	81%	0.809	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-14.2	-179	-91.9	-171.1	177.5	-176.9	0	116.4	A63	A63-K65 PolarHBondContact O-N 2.79Å
66	T	36.5	Very low	51.6	Low	114 Å²	114	104.6 Å²	104.6	70%	0.699	56%	0.562	S	S	*	*	S	Bend	trans	-151	97.2	-170.8	-40.1	0	0	0	0	113.2
67	M	46.6	Very low	51	Low	112 Å²	112	112.1 Å²	112.1	55%	0.552	59%	0.585	S	S	*	*			trans	143.9	122.2	152.6	-89.8	-173	-104.2	0	0	109.3	W22 V24	W22-M67 VanDerWaalsContact CD1-CE 3.4Å; W22-M67 HydrophobicContact CG-CE 4.27Å; W22-M67 HydrophobicContact CZ2-SD 4.08Å; V24-M67 HydrophobicContact CG1-CE 4.29Å; V24-M67 HydrophobicContact CG2-CE 3.83Å
68	G	39.4	Very low	50.9	Low	66 Å²	66	110.3 Å²	110.3	68%	0.68	58%	0.575	S	S	*	*				96.9	113.8	61.5	0	0	0	0	0	106.8	E70	G68-E70 PolarHBondContact O-N 3.35Å
69	N	40.9	Very low	50.8	Low	173 Å²	173	105.6 Å²	105.6	93%	0.925	56%	0.558	S	S	*	*	S	Bend	trans	-47.8	104.6	-172.4	-76.1	-88.7	0	0	0	112.9
70	E	49.4	Very low	50.8	Low	183 Å²	183	108.3 Å²	108.3	86%	0.855	57%	0.572	S	S	*	*	S	Bend	trans	-176.8	8.6	134.4	-130	177.6	71.7	0	0	116.7	G68	G68-E70 PolarHBondContact O-N 3.35Å
71	R	47.2	Very low	51.1	Low	238 Å²	238	107.2 Å²	107.2	90%	0.898	58%	0.577	S	S	*	*	S	Bend	trans	-142.1	99.9	154.1	-71.1	-162.5	-179	175.9	2.8	108.7	Y73	R71-Y73 PolarHBondContact O-N 2.85Å
72	K	41.7	Very low	51.7	Low	190 Å²	190	104.5 Å²	104.5	83%	0.826	55%	0.552	S	S	*	*			trans	-64.5	78.8	-173.8	-165.1	175	-169.6	176.6	0	110.2	V74	K72-V74 PolarHBondContact O-N 2.87Å
73	Y	41.6	Very low	52.2	Low	134 Å²	134	104.7 Å²	104.7	53%	0.525	55%	0.553	S	S	.	*			trans	-52.9	115.3	151.3	-171.9	-100.2	0	0	0	105.3	V19 R71 S75	V19-Y73 HydrophobicContact CG2-CE2 4.13Å; R71-Y73 PolarHBondContact O-N 2.85Å; Y73-S75 PolarHBondContact O-N 3.23Å
74	V	47.2	Very low	53	Low	24 Å²	24	104 Å²	104	15%	0.145	55%	0.547	C	S	.	.			trans	-72.7	83.5	-176.9	176.4	0	0	0	0	107.1	K72 G76 A84 T87 V104	K72-V74 PolarHBondContact O-N 2.87Å; V74-G76 PolarHBondContact O-N 2.99Å; V74-A84 HydrophobicContact CG1-CB 3.82Å; V74-T87 HydrophobicContact CG2-CG2 3.25Å; V74-V104 HydrophobicContact CB-CG1 4.44Å; V74-V104 HydrophobicContact CG1-CB 3.64Å; V74-V104 HydrophobicContact CG1-CG1 3.11Å; V74-V104 HydrophobicContact CG1-CG2 4.4Å; V74-V104 HydrophobicContact CG2-CG1 4.47Å
75	S	52.5	Low	53.6	Low	86 Å²	86	105.2 Å²	105.2	60%	0.601	55%	0.551	S	S	*	*			trans	-70.4	33.2	153.7	-61.9	0	0	0	0	110.6	Y73 R77	Y73-S75 PolarHBondContact O-N 3.23Å; S75-R77 PolarHBondContact O-N 3.04Å
76	G	54.2	Low	54.6	Low	23 Å²	23	102.8 Å²	102.8	24%	0.237	54%	0.537	C	S	.	.			trans	-70.9	87.5	162.8	0	0	0	0	0	106.1	V74 C78 A84	V74-G76 PolarHBondContact O-N 2.99Å; G76-C78 PolarHBondContact O-N 3.11Å; G76-A84 WeakPolarHBondContact O-CB 3.44Å
77	R	62.7	Low	56.3	Low	198 Å²	198	101.3 Å²	101.3	75%	0.747	53%	0.528	S	S	*	.	B	Isolated β-bridge	trans	-57	129.2	164.8	-78.9	-177.8	177.8	-179.4	-1.9	106.9	S75	S75-R77 PolarHBondContact O-N 3.04Å
78	C	69.2	Low	57.7	Low	5 Å²	5	96.6 Å²	96.6	3%	0.034	51%	0.506	C	S	.	.			trans	-60.2	155.6	164.8	-65.5	0	0	0	0	108.5	G76 D80 G81 S82 C106	G76-C78 PolarHBondContact O-N 3.11Å; C78-D80 PolarHBondContact O-N 2.98Å; C78-G81 PolarHBondContact O-N 3.34Å; C78-S82 WeakPolarHBondContact CB-O 3.29Å; C78-S82 PolarHBondContact N-O 2.87Å; C78-C106 WeakPolarHBondContact CA-SG 3.5Å; C78-C106 HydrophobicContact CB-CB 3.74Å; C78-C106 WeakPolarHBondContact CB-SG 3.4Å; C78-C106 WeakPolarHBondContact SG-CA 3.11Å; C78-C106 WeakPolarHBondContact SG-CB 3.2Å; C78-C106 CovalentContact SG-SG 2.03Å; C78-C106 PolarHBondContact SG-SG 3Å
79	P	65.7	Low	59.6	Low	57 Å²	57	99.4 Å²	99.4	37%	0.37	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-15.8	-179.1	33.7	-39.3	0	0	0	110.7	F101 P116	P79-F101 HydrophobicContact CB-CE1 4.02Å; P79-F101 HydrophobicContact CB-CZ 4.04Å; P79-F101 HydrophobicContact CG-CD1 4.2Å; P79-F101 HydrophobicContact CG-CD2 4.49Å; P79-F101 HydrophobicContact CG-CE1 3.95Å; P79-F101 HydrophobicContact CG-CE2 4.27Å; P79-F101 HydrophobicContact CG-CG 4.44Å; P79-F101 HydrophobicContact CG-CZ 3.99Å; P79-P116 HydrophobicContact CB-CG 3.56Å; P79-P116 HydrophobicContact CG-CG 3.69Å; P79-P116 VanDerWaalsContact O-CG 3.3Å; P79-P116 WeakPolarHBondContact O-CG 3.49Å
80	D	63.5	Low	61.4	Low	87 Å²	87	94.7 Å²	94.7	47%	0.465	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-5.4	172.4	-174.6	-105.2	0	0	0	114.4	C78 S82 P116	C78-D80 PolarHBondContact O-N 2.98Å; D80-S82 PolarHBondContact O-N 2.98Å; D80-S82 PolarHBondContact OD1-OG 3.44Å; D80-P116 HydrophobicContact CB-CG 4.28Å
81	G	63.4	Low	62.7	Low	50 Å²	50	89.1 Å²	89.1	52%	0.515	46%	0.464	S	S	.	.	S	Bend	trans	82.5	-13.5	-173.7	0	0	0	0	0	114.4	C78	C78-G81 PolarHBondContact O-N 3.34Å
82	S	66.8	Low	64.2	Low	43 Å²	43	82.3 Å²	82.3	30%	0.301	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-56.1	146.7	170.1	-71.2	0	0	0	0	112.7	C78 D80	C78-S82 WeakPolarHBondContact CB-O 3.29Å; C78-S82 PolarHBondContact N-O 2.87Å; D80-S82 PolarHBondContact O-N 2.98Å; D80-S82 PolarHBondContact OD1-OG 3.44Å
83	L	59.9	Low	65.9	Low	129 Å²	129	76.8 Å²	76.8	68%	0.675	44%	0.438	S	S	*	.	B	Isolated β-bridge	trans	-72.4	130.2	175.8	-68.8	170.8	0	0	0	110
84	A	65.9	Low	67.5	Low	18 Å²	18	71.1 Å²	71.1	15%	0.149	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-66	135.7	170.9	0	0	0	0	0	110.5	V74 G76 V104	V74-A84 HydrophobicContact CG1-CB 3.82Å; G76-A84 WeakPolarHBondContact O-CB 3.44Å; A84-V104 HydrophobicContact CB-CB 3.75Å; A84-V104 HydrophobicContact CB-CG2 3.7Å
85	V	63.2	Low	68.9	Low	93 Å²	93	71.4 Å²	71.4	56%	0.564	43%	0.425	S	S	*	.			trans	-82.1	-32.3	-175.3	-179.6	0	0	0	0	111.3	C105	V85-C105 PolarHBondContact N-O 2.83Å
86	R	68.4	Low	69.6	Low	135 Å²	135	75.7 Å²	75.7	51%	0.509	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	169.2	-178.3	60.2	-175.9	69.2	177.9	0.3	111.3	V104 C105	R86-V104 CarbonylContact O-C 3.54Å; R86-V104 WeakPolarHBondContact O-CA 3.36Å; R86-C105 HydrophobicContact CG-CB 3.64Å; R86-C105 WeakPolarHBondContact CG-SG 3.3Å; R86-C105 PolarHBondContact O-N 2.79Å
87	T	72.3	Confident	70.5	Confident	84 Å²	84	77.8 Å²	77.8	52%	0.515	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	160	166.2	45.4	0	0	0	0	111.5	V74 G103	V74-T87 HydrophobicContact CG2-CG2 3.25Å; T87-G103 CarbonylContact C-O 3.54Å; T87-G103 VanDerWaalsContact CA-O 3.3Å; T87-G103 WeakPolarHBondContact CA-O 3.15Å
88	C	77.5	Confident	71.1	Confident	12 Å²	12	69.5 Å²	69.5	8%	0.081	43%	0.426	C	S	.	.			trans	-151.9	158.5	171.8	55.5	0	0	0	0	110.9	N93 C94 C100 G103 V104 C105	C88-N93 HydrophobicContact CB-CB 3.8Å; C88-C94 VanDerWaalsContact CB-SG 3.58Å; C88-C100 HydrophobicContact CB-CB 3.74Å; C88-C100 WeakPolarHBondContact CB-SG 3.07Å; C88-C100 PolarHBondContact O-SG 2.91Å; C88-C100 WeakPolarHBondContact SG-CA 3.49Å; C88-C100 WeakPolarHBondContact SG-CB 2.91Å; C88-C100 CovalentContact SG-SG 2.01Å; C88-C100 PolarHBondContact SG-SG 2.04Å; C88-G103 PolarHBondContact N-O 2.93Å; C88-G103 CarbonylContact O-C 3.43Å; C88-G103 VanDerWaalsContact O-C 3.29Å; C88-G103 WeakPolarHBondContact O-CA 3.32Å; C88-V104 VanDerWaalsContact SG-CA 3.57Å; C88-V104 PolarHBondContact SG-N 2.01Å; C88-V104 PolarHBondContact SG-O 3.23Å; C88-V104 VanDerWaalsContact SG-O 3.41Å; C88-C105 WeakPolarHBondContact CB-SG 3.49Å
89	T	79.3	Confident	71.5	Confident	125 Å²	125	71.6 Å²	71.6	77%	0.767	44%	0.439	S	S	*	.	S	Bend	trans	-105.1	-25.3	165.7	49.9	0	0	0	0	111.8	N93	T89-N93 PolarHBondContact OG1-ND2 3.26Å
90	T	77.6	Confident	72.2	Confident	75 Å²	75	70.4 Å²	70.4	46%	0.46	43%	0.432	S	S	.	.	S	Bend	trans	-148.1	162	-178.9	58.3	0	0	0	0	109.7	A92 N93 C100	T90-A92 PolarHBondContact O-N 3.2Å; T90-A92 VanDerWaalsContact O-N 3.11Å; T90-N93 PolarHBondContact N-ND2 2.03Å; T90-N93 WeakPolarHBondContact O-CB 3.48Å; T90-N93 PolarHBondContact O-N 2.77Å; T90-N93 PolarHBondContact O-ND2 2.81Å; T90-N93 PolarHBondContact OG1-ND2 3.31Å; T90-C100 WeakPolarHBondContact O-CB 3.27Å
91	D	77.3	Confident	72.9	Confident	66 Å²	66	70 Å²	70	35%	0.353	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-55.1	-28.9	178.2	-137	-108.8	0	0	0	112.9	N93 C94 T99 C100 K108	D91-N93 PolarHBondContact O-N 2.77Å; D91-C94 VanDerWaalsContact O-CB 3.28Å; D91-C94 WeakPolarHBondContact O-CB 3.2Å; D91-C94 PolarHBondContact O-N 3.49Å; D91-T99 WeakPolarHBondContact OD2-CA 2.9Å; D91-T99 VanDerWaalsContact OD2-CB 3.23Å; D91-T99 WeakPolarHBondContact OD2-CB 3.06Å; D91-T99 PolarHBondContact OD2-OG1 3.3Å; D91-C100 PolarHBondContact OD2-N 2.84Å; D91-K108 IonicContact OD1-NZ 2.68Å; D91-K108 PolarHBondContact OD1-NZ 3.41Å
92	A	78.9	Confident	73.3	Confident	94 Å²	94	78.4 Å²	78.4	78%	0.777	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-65.9	-19.3	179	0	0	0	0	0	114.1	T90	T90-A92 PolarHBondContact O-N 3.2Å; T90-A92 VanDerWaalsContact O-N 3.11Å
93	N	76.1	Confident	73.5	Confident	75 Å²	75	77.9 Å²	77.9	40%	0.401	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-82.1	-6.1	174.2	-66	-72.7	0	0	0	112.6	C88 T89 T90 D91	C88-N93 HydrophobicContact CB-CB 3.8Å; T89-N93 PolarHBondContact OG1-ND2 3.26Å; T90-N93 PolarHBondContact N-ND2 2.03Å; T90-N93 WeakPolarHBondContact O-CB 3.48Å; T90-N93 PolarHBondContact O-N 2.77Å; T90-N93 PolarHBondContact O-ND2 2.81Å; T90-N93 PolarHBondContact OG1-ND2 3.31Å; D91-N93 PolarHBondContact O-N 2.77Å
94	C	76.5	Confident	74.2	Confident	15 Å²	15	72.4 Å²	72.4	10%	0.101	42%	0.415	C	S	.	.	S	Bend	trans	-102.6	153.5	-178.2	-57.1	0	0	0	0	111	C88 D91 Q98 C105	C88-C94 VanDerWaalsContact CB-SG 3.58Å; D91-C94 VanDerWaalsContact O-CB 3.28Å; D91-C94 WeakPolarHBondContact O-CB 3.2Å; D91-C94 PolarHBondContact O-N 3.49Å; C94-Q98 HydrophobicContact CB-CB 3.64Å; C94-C105 WeakPolarHBondContact CA-SG 3.48Å; C94-C105 HydrophobicContact CB-CB 3.78Å; C94-C105 WeakPolarHBondContact CB-SG 2.99Å; C94-C105 WeakPolarHBondContact SG-CA 3.49Å; C94-C105 WeakPolarHBondContact SG-CB 3.48Å; C94-C105 CovalentContact SG-SG 2.04Å; C94-C105 PolarHBondContact SG-SG 2.89Å
95	G	77	Confident	74.9	Confident	30 Å²	30	71.5 Å²	71.5	31%	0.309	41%	0.408	S	S	.	.			trans	-65.8	164.8	174.9	0	0	0	0	0	112.2	A97 Q98	G95-A97 PolarHBondContact O-N 3.01Å; G95-Q98 WeakPolarHBondContact O-CB 2.96Å; G95-Q98 PolarHBondContact O-N 3.26Å
96	N	67.1	Low	75.5	Confident	175 Å²	175	67.3 Å²	67.3	94%	0.936	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-17.6	-175.2	-67.5	-46.5	0	0	0	115.1
97	A	72.1	Confident	75.8	Confident	68 Å²	68	63.4 Å²	63.4	56%	0.562	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	28	176.7	0	0	0	0	0	113.2	G95 P107 K108	G95-A97 PolarHBondContact O-N 3.01Å; A97-P107 WeakPolarHBondContact O-CA 3.47Å; A97-K108 PolarHBondContact O-N 3.02Å
98	Q	76.5	Confident	75.5	Confident	23 Å²	23	64.1 Å²	64.1	11%	0.107	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	153.4	-174.6	-59.7	-175.7	-70.8	0	0	111.8	C94 G95 C105 C106 K108	C94-Q98 HydrophobicContact CB-CB 3.64Å; G95-Q98 WeakPolarHBondContact O-CB 2.96Å; G95-Q98 PolarHBondContact O-N 3.26Å; Q98-C105 HydrophobicContact CB-CB 4.35Å; Q98-C106 CarbonylContact C-O 3.29Å; Q98-C106 WeakPolarHBondContact CA-O 3.36Å; Q98-C106 WeakPolarHBondContact CB-O 3.32Å; Q98-K108 VanDerWaalsContact O-CE 3.24Å; Q98-K108 WeakPolarHBondContact O-CE 3.42Å; Q98-K108 PolarHBondContact O-NZ 3.38Å
99	T	76.9	Confident	74.7	Confident	50 Å²	50	66.9 Å²	66.9	31%	0.307	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.8	176	-173.1	0	0	0	0	112	D91 F101 C105 C106 K108	D91-T99 WeakPolarHBondContact OD2-CA 2.9Å; D91-T99 VanDerWaalsContact OD2-CB 3.23Å; D91-T99 WeakPolarHBondContact OD2-CB 3.06Å; D91-T99 PolarHBondContact OD2-OG1 3.3Å; T99-F101 PolarHBondContact O-N 2.85Å; T99-C105 CarbonylContact O-C 3.58Å; T99-C105 WeakPolarHBondContact O-CA 3.43Å; T99-C106 HydrophobicContact CG2-CB 4.43Å; T99-C106 PolarHBondContact N-O 2.99Å; T99-C106 PolarHBondContact O-N 3.08Å; T99-K108 HydrophobicContact CG2-CG 4.41Å
100	C	80.6	Confident	73.2	Confident	31 Å²	31	64.4 Å²	64.4	21%	0.209	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	100.6	177.3	-169.6	0	0	0	0	111.7	C88 T90 D91	C88-C100 HydrophobicContact CB-CB 3.74Å; C88-C100 WeakPolarHBondContact CB-SG 3.07Å; C88-C100 PolarHBondContact O-SG 2.91Å; C88-C100 WeakPolarHBondContact SG-CA 3.49Å; C88-C100 WeakPolarHBondContact SG-CB 2.91Å; C88-C100 CovalentContact SG-SG 2.01Å; C88-C100 PolarHBondContact SG-SG 2.04Å; T90-C100 WeakPolarHBondContact O-CB 3.27Å; D91-C100 PolarHBondContact OD2-N 2.84Å
101	F	78	Confident	71.7	Confident	78 Å²	78	66.9 Å²	66.9	34%	0.342	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	119.6	179.7	-171.5	-100.8	0	0	0	110.5	P79 T99 G103 V104 C106	P79-F101 HydrophobicContact CB-CE1 4.02Å; P79-F101 HydrophobicContact CB-CZ 4.04Å; P79-F101 HydrophobicContact CG-CD1 4.2Å; P79-F101 HydrophobicContact CG-CD2 4.49Å; P79-F101 HydrophobicContact CG-CE1 3.95Å; P79-F101 HydrophobicContact CG-CE2 4.27Å; P79-F101 HydrophobicContact CG-CG 4.44Å; P79-F101 HydrophobicContact CG-CZ 3.99Å; T99-F101 PolarHBondContact O-N 2.85Å; F101-G103 PolarHBondContact O-N 2.93Å; F101-V104 PolarHBondContact N-O 2.75Å; F101-V104 WeakPolarHBondContact O-CG2 3.15Å; F101-V104 PolarHBondContact O-N 3.07Å; F101-C106 HydrophobicContact CB-CB 4.39Å
102	R	70.8	Confident	70	Confident	228 Å²	228	70.7 Å²	70.7	86%	0.86	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	36.3	178.3	-60.1	-175.9	72.5	164.5	3.2	114.2
103	G	71.4	Confident	68.3	Low	32 Å²	32	70.7 Å²	70.7	33%	0.33	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	12.9	179.3	0	0	0	0	0	115.3	T87 C88 F101	T87-G103 CarbonylContact C-O 3.54Å; T87-G103 VanDerWaalsContact CA-O 3.3Å; T87-G103 WeakPolarHBondContact CA-O 3.15Å; C88-G103 PolarHBondContact N-O 2.93Å; C88-G103 CarbonylContact O-C 3.43Å; C88-G103 VanDerWaalsContact O-C 3.29Å; C88-G103 WeakPolarHBondContact O-CA 3.32Å; F101-G103 PolarHBondContact O-N 2.93Å
104	V	74.8	Confident	66.6	Low	13 Å²	13	72 Å²	72	8%	0.079	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	138.2	-176.5	-43.1	0	0	0	0	111.7	V74 A84 R86 C88 F101 C106	V74-V104 HydrophobicContact CB-CG1 4.44Å; V74-V104 HydrophobicContact CG1-CB 3.64Å; V74-V104 HydrophobicContact CG1-CG1 3.11Å; V74-V104 HydrophobicContact CG1-CG2 4.4Å; V74-V104 HydrophobicContact CG2-CG1 4.47Å; A84-V104 HydrophobicContact CB-CB 3.75Å; A84-V104 HydrophobicContact CB-CG2 3.7Å; R86-V104 CarbonylContact O-C 3.54Å; R86-V104 WeakPolarHBondContact O-CA 3.36Å; C88-V104 VanDerWaalsContact SG-CA 3.57Å; C88-V104 PolarHBondContact SG-N 2.01Å; C88-V104 PolarHBondContact SG-O 3.23Å; C88-V104 VanDerWaalsContact SG-O 3.41Å; F101-V104 PolarHBondContact N-O 2.75Å; F101-V104 WeakPolarHBondContact O-CG2 3.15Å; F101-V104 PolarHBondContact O-N 3.07Å; V104-C106 PolarHBondContact O-N 3.23Å
105	C	79.9	Confident	65.3	Low	0 Å²	0	75.6 Å²	75.6	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	109.3	177.5	-67.2	0	0	0	0	110.4	V85 R86 C88 C94 Q98 T99	V85-C105 PolarHBondContact N-O 2.83Å; R86-C105 HydrophobicContact CG-CB 3.64Å; R86-C105 WeakPolarHBondContact CG-SG 3.3Å; R86-C105 PolarHBondContact O-N 2.79Å; C88-C105 WeakPolarHBondContact CB-SG 3.49Å; C94-C105 WeakPolarHBondContact CA-SG 3.48Å; C94-C105 HydrophobicContact CB-CB 3.78Å; C94-C105 WeakPolarHBondContact CB-SG 2.99Å; C94-C105 WeakPolarHBondContact SG-CA 3.49Å; C94-C105 WeakPolarHBondContact SG-CB 3.48Å; C94-C105 CovalentContact SG-SG 2.04Å; C94-C105 PolarHBondContact SG-SG 2.89Å; Q98-C105 HydrophobicContact CB-CB 4.35Å; T99-C105 CarbonylContact O-C 3.58Å; T99-C105 WeakPolarHBondContact O-CA 3.43Å
106	C	76.7	Confident	63.9	Low	4 Å²	4	76.9 Å²	76.9	3%	0.027	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	143.7	174.8	-73.7	0	0	0	0	110.9	C78 Q98 T99 F101 V104 K108	C78-C106 WeakPolarHBondContact CA-SG 3.5Å; C78-C106 HydrophobicContact CB-CB 3.74Å; C78-C106 WeakPolarHBondContact CB-SG 3.4Å; C78-C106 WeakPolarHBondContact SG-CA 3.11Å; C78-C106 WeakPolarHBondContact SG-CB 3.2Å; C78-C106 CovalentContact SG-SG 2.03Å; C78-C106 PolarHBondContact SG-SG 3Å; Q98-C106 CarbonylContact C-O 3.29Å; Q98-C106 WeakPolarHBondContact CA-O 3.36Å; Q98-C106 WeakPolarHBondContact CB-O 3.32Å; T99-C106 HydrophobicContact CG2-CB 4.43Å; T99-C106 PolarHBondContact N-O 2.99Å; T99-C106 PolarHBondContact O-N 3.08Å; F101-C106 HydrophobicContact CB-CB 4.39Å; V104-C106 PolarHBondContact O-N 3.23Å; C106-K108 PolarHBondContact O-N 3Å
107	P	74.3	Confident	63.1	Low	54 Å²	54	69.6 Å²	69.6	35%	0.351	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	130.7	170.9	25.7	-31.8	0	0	0	108.8	A97 S109	A97-P107 WeakPolarHBondContact O-CA 3.47Å; P107-S109 PolarHBondContact O-N 3.24Å
108	K	65.5	Low	62.1	Low	99 Å²	99	71 Å²	71	43%	0.43	43%	0.43	S	S	.	.			trans	-64.1	96.2	164.3	-78.8	169.3	171.6	135.7	0	104.4	D91 A97 Q98 T99 C106 G110	D91-K108 IonicContact OD1-NZ 2.68Å; D91-K108 PolarHBondContact OD1-NZ 3.41Å; A97-K108 PolarHBondContact O-N 3.02Å; Q98-K108 VanDerWaalsContact O-CE 3.24Å; Q98-K108 WeakPolarHBondContact O-CE 3.42Å; Q98-K108 PolarHBondContact O-NZ 3.38Å; T99-K108 HydrophobicContact CG2-CG 4.41Å; C106-K108 PolarHBondContact O-N 3Å; K108-G110 PolarHBondContact O-N 2.81Å
109	S	60.5	Low	61.3	Low	69 Å²	69	74.1 Å²	74.1	48%	0.483	45%	0.454	S	S	.	.			trans	-53.1	117.6	174.7	-170.2	0	0	0	0	106	P107 N111	P107-S109 PolarHBondContact O-N 3.24Å; S109-N111 PolarHBondContact O-N 2.87Å
110	G	49	Very low	60.7	Low	73 Å²	73	72.9 Å²	72.9	75%	0.753	45%	0.447	S	S	*	.	S	Bend	trans	-71.4	37.3	-170.7	0	0	0	0	0	113.5	K108	K108-G110 PolarHBondContact O-N 2.81Å
111	N	45.9	Very low	60.1	Low	127 Å²	127	76.9 Å²	76.9	68%	0.679	47%	0.472	S	S	*	.	S	Bend	trans	-143	109.4	174.7	-62.1	-65.4	0	0	0	107.9	S109	S109-N111 PolarHBondContact O-N 2.87Å
112	D	42.6	Very low	59.6	Low	147 Å²	147	75 Å²	75	79%	0.786	47%	0.474	S	S	*	.			trans	40.3	91	161.3	-63.6	-71.3	0	0	0	117.8	N114	D112-N114 PolarHBondContact O-N 2.68Å
113	G	43.2	Very low	60.1	Low	93 Å²	93	70 Å²	70	96%	0.959	47%	0.465	S	S	*	.	S	Bend	trans	42.9	5.5	130.6	0	0	0	0	0	122.5
114	N	40.4	Very low	60.5	Low	103 Å²	103	70.5 Å²	70.5	55%	0.551	46%	0.463	S	S	*	.			trans	-122.7	118.3	-172.5	-147.9	-11.8	0	0	0	106.7	D112	D112-N114 PolarHBondContact O-N 2.68Å
115	P	47.7	Very low	60.6	Low	90 Å²	90	71.9 Å²	71.9	58%	0.584	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-49.5	138.6	172.4	21.2	-32.7	0	0	0	108.7	A117	P115-A117 PolarHBondContact O-N 3.35Å
116	P	47.6	Very low	60.2	Low	57 Å²	57	78.4 Å²	78.4	37%	0.37	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-57.4	118.3	171.3	23	-28.1	0	0	0	105.5	P79 D80	P79-P116 HydrophobicContact CB-CG 3.56Å; P79-P116 HydrophobicContact CG-CG 3.69Å; P79-P116 VanDerWaalsContact O-CG 3.3Å; P79-P116 WeakPolarHBondContact O-CG 3.49Å; D80-P116 HydrophobicContact CB-CG 4.28Å
117	A	50.4	Low	59.5	Low	23 Å²	23	81.8 Å²	81.8	19%	0.19	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-56.7	150.6	-170.7	0	0	0	0	0	109.9	P115 S119 N144	P115-A117 PolarHBondContact O-N 3.35Å; A117-S119 PolarHBondContact O-N 2.8Å; A117-N144 HydrophobicContact CB-CB 3.22Å; A117-N144 WeakPolarHBondContact CB-OD1 3.26Å
118	P	51.7	Low	59	Low	98 Å²	98	85.5 Å²	85.5	64%	0.636	55%	0.55	S	S	*	*			trans	-53.8	102.8	178.3	22.2	-33	0	0	0	109.4	V120 D145	P118-V120 PolarHBondContact O-N 3.2Å; P118-D145 WeakPolarHBondContact O-CB 3.26Å
119	S	59.1	Low	58.6	Low	88 Å²	88	84.6 Å²	84.6	62%	0.615	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-75.2	117.3	-179	58.1	0	0	0	0	107.9	A117 D145	A117-S119 PolarHBondContact O-N 2.8Å; S119-D145 VanDerWaalsContact CA-OD2 3.28Å; S119-D145 WeakPolarHBondContact CA-OD2 2.97Å
120	V	65.7	Low	58.5	Low	24 Å²	24	85.7 Å²	85.7	15%	0.145	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-65.7	131.5	173.6	168.3	0	0	0	0	107.7	P118 D145 G151 R152 K153 P166	P118-V120 PolarHBondContact O-N 3.2Å; V120-D145 HydrophobicContact CG2-CB 4.32Å; V120-D145 PolarHBondContact N-OD2 2.83Å; V120-G151 VanDerWaalsContact CG1-C 3.47Å; V120-G151 VanDerWaalsContact CG1-O 3.26Å; V120-G151 WeakPolarHBondContact CG1-O 3.48Å; V120-R152 WeakPolarHBondContact CG2-O 3.31Å; V120-K153 HydrophobicContact CB-CG 3.82Å; V120-K153 HydrophobicContact CG1-CG 4.03Å; V120-K153 PolarHBondContact O-NZ 3.21Å; V120-P166 HydrophobicContact CG1-CG 4.14Å
121	P	66.4	Low	58.7	Low	114 Å²	114	87.5 Å²	87.5	74%	0.74	56%	0.556	S	S	*	*	S	Bend	trans	-61.1	146.5	178.2	22.9	-31.1	0	0	0	111.6	P166	P121-P166 WeakPolarHBondContact O-CB 3.38Å
122	G	68.9	Low	59	Low	38 Å²	38	87.3 Å²	87.3	39%	0.392	56%	0.562	S	S	.	*	S	Bend	trans	105.8	176.9	-175.2	0	0	0	0	0	113.2	K153	G122-K153 WeakPolarHBondContact O-CD 2.88Å; G122-K153 WeakPolarHBondContact O-CE 3.32Å; G122-K153 PolarHBondContact O-NZ 2.9Å
123	N	79.9	Confident	59.4	Low	123 Å²	123	85.5 Å²	85.5	66%	0.658	56%	0.561	S	S	*	*			trans	-108.2	155.5	-175.9	-73.2	-23.2	0	0	0	111.6	P166 S167	N123-P166 CarbonylContact O-C 3.54Å; N123-P166 VanDerWaalsContact O-CA 3.29Å; N123-P166 WeakPolarHBondContact O-CA 3.33Å; N123-S167 PolarHBondContact N-O 2.92Å; N123-S167 PolarHBondContact O-N 2.92Å
124	C	79.8	Confident	59.8	Low	44 Å²	44	84.8 Å²	84.8	30%	0.297	53%	0.531	S	S	.	.			trans	-65.4	136.8	167.8	-76.4	0	0	0	0	109.5	T126 C155	C124-T126 PolarHBondContact O-N 3.12Å; C124-C155 WeakPolarHBondContact CA-SG 2.97Å; C124-C155 HydrophobicContact CB-CB 3.75Å; C124-C155 WeakPolarHBondContact CB-SG 3.39Å; C124-C155 WeakPolarHBondContact SG-CA 3.42Å; C124-C155 WeakPolarHBondContact SG-CB 2.96Å; C124-C155 CovalentContact SG-SG 2.03Å; C124-C155 PolarHBondContact SG-SG 3.28Å
125	P	78.2	Confident	60.5	Low	42 Å²	42	85.7 Å²	85.7	27%	0.273	54%	0.54	S	S	.	.			trans	-58.4	133.4	173.7	24.6	-33	0	0	0	109.2	M127 L164 S167	P125-M127 PolarHBondContact O-N 2.99Å; P125-L164 HydrophobicContact CG-CB 4.2Å; P125-L164 HydrophobicContact CG-CD1 3.67Å; P125-S167 VanDerWaalsContact CA-OG 3.29Å; P125-S167 WeakPolarHBondContact CA-OG 3.01Å; P125-S167 WeakPolarHBondContact CB-OG 3.2Å
126	T	70	Confident	60.8	Low	136 Å²	136	84.5 Å²	84.5	83%	0.834	53%	0.531	S	S	*	.			trans	-63.7	105.3	177.1	-57.6	0	0	0	0	108.9	C124	C124-T126 PolarHBondContact O-N 3.12Å
127	M	63.7	Low	61.1	Low	76 Å²	76	87.7 Å²	87.7	37%	0.374	54%	0.541	S	S	.	.			trans	-92.8	123.1	163.1	-76.2	-164.7	-78.5	0	0	108.5	P125 L129 P156 T157 L164	P125-M127 PolarHBondContact O-N 2.99Å; M127-L129 PolarHBondContact O-N 2.8Å; M127-P156 WeakPolarHBondContact CE-O 3.2Å; M127-T157 VanDerWaalsContact CE-CB 3.47Å; M127-T157 HydrophobicContact CE-CG2 3.23Å; M127-L164 HydrophobicContact CE-CD1 3.82Å
128	V	63.8	Low	61.5	Low	132 Å²	132	93.5 Å²	93.5	80%	0.8	57%	0.569	S	S	*	*			trans	-68.9	99.8	173.1	-175.5	0	0	0	0	107.1
129	L	57.3	Low	62.4	Low	79 Å²	79	94.1 Å²	94.1	41%	0.414	57%	0.567	S	S	.	*			trans	-87.8	121.9	173.4	-150.7	78.7	0	0	0	108	M127 S131 L158	M127-L129 PolarHBondContact O-N 2.8Å; L129-S131 PolarHBondContact O-N 3.4Å; L129-L158 HydrophobicContact CD1-CB 4.47Å; L129-L158 HydrophobicContact CD1-CD2 3.3Å; L129-L158 HydrophobicContact CD1-CG 3.55Å; L129-L158 HydrophobicContact CG-CD2 4.19Å
130	P	56.4	Low	63.2	Low	92 Å²	92	93.1 Å²	93.1	60%	0.597	56%	0.555	S	S	*	*			trans	-68.7	106.5	172.7	25.1	-29	0	0	0	109.3
131	S	53.2	Low	64.1	Low	111 Å²	111	98.1 Å²	98.1	78%	0.776	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	146.6	168	-47.8	0	0	0	0	110.3	L129	L129-S131 PolarHBondContact O-N 3.4Å
132	P	52.9	Low	64.9	Low	123 Å²	123	93 Å²	93	80%	0.799	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	cis	-135.1	65.1	5.4	39.4	-18.3	0	0	0	112.9
133	S	51.4	Low	65.4	Low	110 Å²	110	97.1 Å²	97.1	77%	0.769	56%	0.556	S	S	*	*			trans	-165.2	38	173.4	49.2	0	0	0	0	114.4	V135	S133-V135 PolarHBondContact O-N 3.49Å
134	F	52.5	Low	65.3	Low	78 Å²	78	93 Å²	93	34%	0.342	53%	0.534	S	S	.	.			trans	-80.7	103.6	166.7	-171.3	-103.3	0	0	0	109	V136 L158	F134-V136 VanDerWaalsContact C-N 3.31Å; F134-V136 HydrophobicContact CD1-CG2 4.12Å; F134-V136 HydrophobicContact CE1-CG2 4.45Å; F134-V136 PolarHBondContact O-N 2.61Å; F134-L158 HydrophobicContact CD1-CD2 4.29Å; F134-L158 HydrophobicContact CD2-CD2 3.98Å; F134-L158 HydrophobicContact CE1-CB 4.47Å; F134-L158 WeakPolarHBondContact CE1-O 3.34Å; F134-L158 HydrophobicContact CE2-CD2 4.36Å; F134-L158 HydrophobicContact CG-CD2 3.99Å; F134-L158 VanDerWaalsContact CZ-C 3.43Å; F134-L158 HydrophobicContact CZ-CB 4.5Å; F134-L158 WeakPolarHBondContact CZ-O 3.29Å
135	V	53.3	Low	65.2	Low	122 Å²	122	91.9 Å²	91.9	74%	0.739	53%	0.525	S	S	*	.			trans	-61.5	101	164.2	-179.9	0	0	0	0	105.7	S133 Q137	S133-V135 PolarHBondContact O-N 3.49Å; V135-Q137 VanDerWaalsContact C-N 3.34Å; V135-Q137 PolarHBondContact O-N 3Å
136	V	54	Low	65	Low	64 Å²	64	91.7 Å²	91.7	39%	0.388	53%	0.531	S	S	.	.			trans	-54.8	105.8	169.7	178.8	0	0	0	0	105.7	F134 N138	F134-V136 VanDerWaalsContact C-N 3.31Å; F134-V136 HydrophobicContact CD1-CG2 4.12Å; F134-V136 HydrophobicContact CE1-CG2 4.45Å; F134-V136 PolarHBondContact O-N 2.61Å; V136-N138 PolarHBondContact O-N 2.72Å
137	Q	55	Low	65.6	Low	124 Å²	124	89.5 Å²	89.5	58%	0.579	51%	0.514	S	S	*	.			trans	-53.6	118.7	165.5	-74.1	-166.9	-21.6	0	0	104.6	V135 N139	V135-Q137 VanDerWaalsContact C-N 3.34Å; V135-Q137 PolarHBondContact O-N 3Å; Q137-N139 PolarHBondContact O-N 2.8Å
138	N	59.5	Low	66.4	Low	146 Å²	146	86.5 Å²	86.5	78%	0.781	50%	0.5	S	S	*	.	S	Bend	trans	-70.5	32.9	-168.8	-113	-28.5	0	0	0	112.2	V136 N140	V136-N138 PolarHBondContact O-N 2.72Å; N138-N140 VanDerWaalsContact C-N 3.28Å; N138-N140 PolarHBondContact O-N 3.27Å
139	N	68.8	Low	67.2	Low	110 Å²	110	85 Å²	85	59%	0.588	50%	0.495	S	S	*	.			trans	-93.9	61.5	-179.1	-156.6	12.3	0	0	0	109.7	Q137 L141	Q137-N139 PolarHBondContact O-N 2.8Å; N139-L141 PolarHBondContact O-N 2.92Å; N139-L141 VanDerWaalsContact O-N 3.15Å
140	N	77.5	Confident	67.9	Low	68 Å²	68	86.1 Å²	86.1	36%	0.364	51%	0.51	S	S	.	.			trans	-68.4	109.5	176.8	-64.3	-42.7	0	0	0	109	N138 C142 K161	N138-N140 VanDerWaalsContact C-N 3.28Å; N138-N140 PolarHBondContact O-N 3.27Å; N140-C142 PolarHBondContact O-N 3.07Å; N140-K161 HydrophobicContact CB-CB 4.08Å; N140-K161 HydrophobicContact CB-CD 4.49Å; N140-K161 WeakPolarHBondContact OD1-CG 3.13Å; N140-K161 PolarHBondContact OD1-N 3.21Å
141	L	83.2	Confident	68.7	Low	129 Å²	129	83.7 Å²	83.7	68%	0.675	50%	0.502	S	S	*	.	S	Bend	trans	-80.2	-8.1	175.2	-70.6	113.5	0	0	0	112.7	N139 K161	N139-L141 PolarHBondContact O-N 2.92Å; N139-L141 VanDerWaalsContact O-N 3.15Å; L141-K161 PolarHBondContact N-O 3.27Å
142	C	83.5	Confident	70.1	Confident	5 Å²	5	83.4 Å²	83.4	3%	0.034	48%	0.484	C	S	.	.			trans	-149.1	147.8	172.1	61.2	0	0	0	0	108.6	N140 N147 C154 K161	N140-C142 PolarHBondContact O-N 3.07Å; C142-N147 HydrophobicContact CB-CB 3.96Å; C142-C154 HydrophobicContact CB-CB 3.8Å; C142-C154 WeakPolarHBondContact CB-SG 2.95Å; C142-C154 PolarHBondContact O-SG 3.21Å; C142-C154 WeakPolarHBondContact SG-CA 3.31Å; C142-C154 WeakPolarHBondContact SG-CB 3.29Å; C142-C154 CovalentContact SG-SG 2.04Å; C142-C154 PolarHBondContact SG-SG 2.79Å; C142-K161 WeakPolarHBondContact O-CB 3.49Å; C142-K161 VanDerWaalsContact O-CD 3.28Å; C142-K161 WeakPolarHBondContact O-CD 3.32Å
143	E	80.5	Confident	71.5	Confident	126 Å²	126	78.8 Å²	78.8	59%	0.589	45%	0.451	S	S	*	.	S	Bend	trans	-96.6	-31.9	171.4	-164.7	154.2	88	0	0	110.9	N147 K161	E143-N147 WeakPolarHBondContact CB-OD1 3.42Å; E143-N147 PolarHBondContact N-OD1 3.31Å; E143-K161 PolarHBondContact O-NZ 3.48Å; E143-K161 VanDerWaalsContact O-NZ 3.11Å
144	N	76.5	Confident	73.1	Confident	36 Å²	36	74.4 Å²	74.4	19%	0.193	42%	0.42	C	S	.	.	S	Bend	trans	-153.7	166.2	-173	66.4	56.6	0	0	0	112.5	A117 G146 N147 C154	A117-N144 HydrophobicContact CB-CB 3.22Å; A117-N144 WeakPolarHBondContact CB-OD1 3.26Å; N144-G146 PolarHBondContact O-N 3.3Å; N144-G146 VanDerWaalsContact O-N 3.13Å; N144-G146 VanDerWaalsContact OD1-CA 3.3Å; N144-G146 WeakPolarHBondContact OD1-CA 3.19Å; N144-G146 PolarHBondContact OD1-N 2.81Å; N144-N147 PolarHBondContact N-OD1 3.27Å; N144-N147 WeakPolarHBondContact O-CB 3.33Å; N144-N147 PolarHBondContact O-N 2.85Å; N144-N147 PolarHBondContact OD1-N 3.23Å; N144-N147 VanDerWaalsContact OD1-N 3.13Å; N144-C154 WeakPolarHBondContact O-CB 3.34Å
145	D	77.9	Confident	74.6	Confident	20 Å²	20	70.7 Å²	70.7	11%	0.107	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-57.1	-28	-178	-73.1	5.4	0	0	0	112.9	P118 S119 V120 N147 C148 K153 C154	P118-D145 WeakPolarHBondContact O-CB 3.26Å; S119-D145 VanDerWaalsContact CA-OD2 3.28Å; S119-D145 WeakPolarHBondContact CA-OD2 2.97Å; V120-D145 HydrophobicContact CG2-CB 4.32Å; V120-D145 PolarHBondContact N-OD2 2.83Å; D145-N147 VanDerWaalsContact C-N 3.29Å; D145-N147 PolarHBondContact O-N 2.86Å; D145-C148 WeakPolarHBondContact O-CB 3.37Å; D145-C148 PolarHBondContact O-N 3.27Å; D145-C148 VanDerWaalsContact O-N 3.14Å; D145-K153 WeakPolarHBondContact OD1-CA 3.37Å; D145-K153 IonicContact OD2-NZ 2.76Å; D145-K153 PolarHBondContact OD2-NZ 2.83Å; D145-C154 PolarHBondContact OD1-N 3.38Å
146	G	75.1	Confident	75.8	Confident	39 Å²	39	69.5 Å²	69.5	40%	0.402	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-71.6	-17.6	176.9	0	0	0	0	0	114.9	N144 C148	N144-G146 PolarHBondContact O-N 3.3Å; N144-G146 VanDerWaalsContact O-N 3.13Å; N144-G146 VanDerWaalsContact OD1-CA 3.3Å; N144-G146 WeakPolarHBondContact OD1-CA 3.19Å; N144-G146 PolarHBondContact OD1-N 2.81Å; G146-C148 PolarHBondContact O-N 2.01Å
147	N	81.4	Confident	76.7	Confident	90 Å²	90	66.7 Å²	66.7	48%	0.481	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-78.8	-5.5	171.2	-57.3	144.9	0	0	0	112.7	C142 E143 N144 D145	C142-N147 HydrophobicContact CB-CB 3.96Å; E143-N147 WeakPolarHBondContact CB-OD1 3.42Å; E143-N147 PolarHBondContact N-OD1 3.31Å; N144-N147 PolarHBondContact N-OD1 3.27Å; N144-N147 WeakPolarHBondContact O-CB 3.33Å; N144-N147 PolarHBondContact O-N 2.85Å; N144-N147 PolarHBondContact OD1-N 3.23Å; N144-N147 VanDerWaalsContact OD1-N 3.13Å; D145-N147 VanDerWaalsContact C-N 3.29Å; D145-N147 PolarHBondContact O-N 2.86Å
148	C	80.5	Confident	77.6	Confident	13 Å²	13	64.2 Å²	64.2	9%	0.088	37%	0.372	C	S	.	.	S	Bend	trans	-103.8	114.3	-173.8	-64.2	0	0	0	0	112	D145 G146 R152 C163	D145-C148 WeakPolarHBondContact O-CB 3.37Å; D145-C148 PolarHBondContact O-N 3.27Å; D145-C148 VanDerWaalsContact O-N 3.14Å; G146-C148 PolarHBondContact O-N 2.01Å; C148-R152 HydrophobicContact CB-CB 3.82Å; C148-R152 WeakPolarHBondContact CB-O 3.43Å; C148-C163 WeakPolarHBondContact CA-SG 3.18Å; C148-C163 HydrophobicContact CB-CB 3.6Å; C148-C163 WeakPolarHBondContact CB-SG 3.24Å; C148-C163 WeakPolarHBondContact SG-CA 3.32Å; C148-C163 WeakPolarHBondContact SG-CB 3.16Å; C148-C163 CovalentContact SG-SG 2.03Å; C148-C163 PolarHBondContact SG-SG 2.7Å
149	S	80.1	Confident	78.1	Confident	99 Å²	99	61.8 Å²	61.8	69%	0.692	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	144.9	171.7	-59.4	0	0	0	0	111.4
150	S	71.8	Confident	78.4	Confident	104 Å²	104	56.7 Å²	56.7	73%	0.727	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	38.9	170.5	-45.1	0	0	0	0	116.6	R152	S150-R152 PolarHBondContact O-N 3.37Å
151	G	73.2	Confident	78.7	Confident	41 Å²	41	57 Å²	57	42%	0.423	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	42.4	173.9	0	0	0	0	0	112.1	V120 P166	V120-G151 VanDerWaalsContact CG1-C 3.47Å; V120-G151 VanDerWaalsContact CG1-O 3.26Å; V120-G151 WeakPolarHBondContact CG1-O 3.48Å; G151-P166 WeakPolarHBondContact O-CD 2.96Å
152	R	82.7	Confident	78.7	Confident	105 Å²	105	54.5 Å²	54.5	40%	0.396	31%	0.311	S	S	.	.			trans	-107.2	146.4	178.7	-71.4	-178.9	-171.6	-175.4	5.3	110.1	V120 C148 S150 C163 L164 L165	V120-R152 WeakPolarHBondContact CG2-O 3.31Å; C148-R152 HydrophobicContact CB-CB 3.82Å; C148-R152 WeakPolarHBondContact CB-O 3.43Å; S150-R152 PolarHBondContact O-N 3.37Å; R152-C163 HydrophobicContact CB-CB 4.09Å; R152-L164 CarbonylContact C-O 3.59Å; R152-L164 WeakPolarHBondContact CA-O 3.21Å; R152-L164 VanDerWaalsContact CB-O 3.26Å; R152-L164 WeakPolarHBondContact CB-O 2.97Å; R152-L165 HydrophobicContact CG-CD2 4.27Å
153	K	83.1	Confident	78.9	Confident	26 Å²	26	55.9 Å²	55.9	11%	0.113	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	143.4	175.2	-65.1	-174.7	70.7	65.1	0	110.6	V120 G122 D145 C155 C163 L164 P166	V120-K153 HydrophobicContact CB-CG 3.82Å; V120-K153 HydrophobicContact CG1-CG 4.03Å; V120-K153 PolarHBondContact O-NZ 3.21Å; G122-K153 WeakPolarHBondContact O-CD 2.88Å; G122-K153 WeakPolarHBondContact O-CE 3.32Å; G122-K153 PolarHBondContact O-NZ 2.9Å; D145-K153 WeakPolarHBondContact OD1-CA 3.37Å; D145-K153 IonicContact OD2-NZ 2.76Å; D145-K153 PolarHBondContact OD2-NZ 2.83Å; K153-C155 PolarHBondContact O-N 2.79Å; K153-C163 CarbonylContact O-C 3.58Å; K153-C163 WeakPolarHBondContact O-CA 3.03Å; K153-L164 PolarHBondContact N-O 3.14Å; K153-L164 PolarHBondContact O-N 2.03Å; K153-P166 HydrophobicContact CD-CB 3.87Å; K153-P166 HydrophobicContact CG-CB 4.2Å
154	C	84.5	Confident	79.2	Confident	17 Å²	17	51.8 Å²	51.8	12%	0.115	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	98.5	173.4	-175.4	0	0	0	0	109.5	C142 N144 D145	C142-C154 HydrophobicContact CB-CB 3.8Å; C142-C154 WeakPolarHBondContact CB-SG 2.95Å; C142-C154 PolarHBondContact O-SG 3.21Å; C142-C154 WeakPolarHBondContact SG-CA 3.31Å; C142-C154 WeakPolarHBondContact SG-CB 3.29Å; C142-C154 CovalentContact SG-SG 2.04Å; C142-C154 PolarHBondContact SG-SG 2.79Å; N144-C154 WeakPolarHBondContact O-CB 3.34Å; D145-C154 PolarHBondContact OD1-N 3.38Å
155	C	84.4	Confident	79.5	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.007	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	143.3	-169.6	-63.7	0	0	0	0	111.9	C124 K153 T157 K161 R162 L164	C124-C155 WeakPolarHBondContact CA-SG 2.97Å; C124-C155 HydrophobicContact CB-CB 3.75Å; C124-C155 WeakPolarHBondContact CB-SG 3.39Å; C124-C155 WeakPolarHBondContact SG-CA 3.42Å; C124-C155 WeakPolarHBondContact SG-CB 2.96Å; C124-C155 CovalentContact SG-SG 2.03Å; C124-C155 PolarHBondContact SG-SG 3.28Å; K153-C155 PolarHBondContact O-N 2.79Å; C155-T157 WeakPolarHBondContact O-CG2 3.27Å; C155-K161 WeakPolarHBondContact O-CA 3.34Å; C155-R162 PolarHBondContact N-O 2.96Å; C155-R162 PolarHBondContact O-N 2.03Å; C155-L164 HydrophobicContact CB-CB 4.25Å; C155-L164 HydrophobicContact CB-CD1 3.71Å; C155-L164 HydrophobicContact CB-CG 4.11Å
156	P	78.1	Confident	79.5	Confident	96 Å²	96	56.8 Å²	56.8	62%	0.623	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	138.4	176.2	30.5	-34.2	0	0	0	111.1	M127	M127-P156 WeakPolarHBondContact CE-O 3.2Å
157	T	73.6	Confident	79.5	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.037	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	168.9	-174.5	78.8	0	0	0	0	112.5	M127 C155 L159 G160 R162 L164	M127-T157 VanDerWaalsContact CE-CB 3.47Å; M127-T157 HydrophobicContact CE-CG2 3.23Å; C155-T157 WeakPolarHBondContact O-CG2 3.27Å; T157-L159 PolarHBondContact O-N 3.34Å; T157-L159 PolarHBondContact OG1-N 3.32Å; T157-L159 VanDerWaalsContact OG1-N 3.16Å; T157-G160 WeakPolarHBondContact CA-O 3.5Å; T157-G160 VanDerWaalsContact CB-O 3.32Å; T157-G160 WeakPolarHBondContact CB-O 2.98Å; T157-G160 PolarHBondContact N-O 3.3Å; T157-G160 PolarHBondContact O-N 3.14Å; T157-G160 PolarHBondContact OG1-O 3.27Å; T157-R162 VanDerWaalsContact CB-NH2 3.28Å; T157-R162 HydrophobicContact CG2-CB 4.22Å; T157-R162 VanDerWaalsContact CG2-CD 3.45Å; T157-R162 HydrophobicContact CG2-CG 3.36Å; T157-R162 PolarHBondContact OG1-NE 3.18Å; T157-R162 PolarHBondContact OG1-NH2 2.71Å; T157-L164 HydrophobicContact CG2-CD1 4.3Å
158	L	72.7	Confident	79.4	Confident	71 Å²	71	59.5 Å²	59.5	37%	0.372	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	7	170.3	-72.1	167.7	0	0	0	115	L129 F134	L129-L158 HydrophobicContact CD1-CB 4.47Å; L129-L158 HydrophobicContact CD1-CD2 3.3Å; L129-L158 HydrophobicContact CD1-CG 3.55Å; L129-L158 HydrophobicContact CG-CD2 4.19Å; F134-L158 HydrophobicContact CD1-CD2 4.29Å; F134-L158 HydrophobicContact CD2-CD2 3.98Å; F134-L158 HydrophobicContact CE1-CB 4.47Å; F134-L158 WeakPolarHBondContact CE1-O 3.34Å; F134-L158 HydrophobicContact CE2-CD2 4.36Å; F134-L158 HydrophobicContact CG-CD2 3.99Å; F134-L158 VanDerWaalsContact CZ-C 3.43Å; F134-L158 HydrophobicContact CZ-CB 4.5Å; F134-L158 WeakPolarHBondContact CZ-O 3.29Å
159	L	71.8	Confident	79.4	Confident	96 Å²	96	61.9 Å²	61.9	50%	0.503	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136	9.9	174.4	-65.8	168.8	0	0	0	112.6	T157	T157-L159 PolarHBondContact O-N 3.34Å; T157-L159 PolarHBondContact OG1-N 3.32Å; T157-L159 VanDerWaalsContact OG1-N 3.16Å
160	G	74.6	Confident	79.3	Confident	2 Å²	2	59.8 Å²	59.8	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.9	-170.1	-167.8	0	0	0	0	0	112.7	T157	T157-G160 WeakPolarHBondContact CA-O 3.5Å; T157-G160 VanDerWaalsContact CB-O 3.32Å; T157-G160 WeakPolarHBondContact CB-O 2.98Å; T157-G160 PolarHBondContact N-O 3.3Å; T157-G160 PolarHBondContact O-N 3.14Å; T157-G160 PolarHBondContact OG1-O 3.27Å
161	K	83	Confident	79.8	Confident	76 Å²	76	57.2 Å²	57.2	33%	0.33	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	133.6	170.2	-68.9	178.3	175.3	-176.5	0	111.1	N140 L141 C142 E143 C155	N140-K161 HydrophobicContact CB-CB 4.08Å; N140-K161 HydrophobicContact CB-CD 4.49Å; N140-K161 WeakPolarHBondContact OD1-CG 3.13Å; N140-K161 PolarHBondContact OD1-N 3.21Å; L141-K161 PolarHBondContact N-O 3.27Å; C142-K161 WeakPolarHBondContact O-CB 3.49Å; C142-K161 VanDerWaalsContact O-CD 3.28Å; C142-K161 WeakPolarHBondContact O-CD 3.32Å; E143-K161 PolarHBondContact O-NZ 3.48Å; E143-K161 VanDerWaalsContact O-NZ 3.11Å; C155-K161 WeakPolarHBondContact O-CA 3.34Å
162	R	84.6	Confident	80.2	Confident	76 Å²	76	58.3 Å²	58.3	29%	0.287	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	154.7	176.5	83	-170.9	62.5	165.3	0.4	112	C155 T157 L164	C155-R162 PolarHBondContact N-O 2.96Å; C155-R162 PolarHBondContact O-N 2.03Å; T157-R162 VanDerWaalsContact CB-NH2 3.28Å; T157-R162 HydrophobicContact CG2-CB 4.22Å; T157-R162 VanDerWaalsContact CG2-CD 3.45Å; T157-R162 HydrophobicContact CG2-CG 3.36Å; T157-R162 PolarHBondContact OG1-NE 3.18Å; T157-R162 PolarHBondContact OG1-NH2 2.71Å; R162-L164 HydrophobicContact CG-CD1 4.34Å; R162-L164 HydrophobicContact CG-CD2 3.76Å; R162-L164 HydrophobicContact CG-CG 3.81Å; R162-L164 PolarHBondContact O-N 3.28Å
163	C	87.7	Confident	80	Confident	33 Å²	33	55.1 Å²	55.1	22%	0.223	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	108.2	178.1	-62.8	0	0	0	0	111.7	C148 R152 K153	C148-C163 WeakPolarHBondContact CA-SG 3.18Å; C148-C163 HydrophobicContact CB-CB 3.6Å; C148-C163 WeakPolarHBondContact CB-SG 3.24Å; C148-C163 WeakPolarHBondContact SG-CA 3.32Å; C148-C163 WeakPolarHBondContact SG-CB 3.16Å; C148-C163 CovalentContact SG-SG 2.03Å; C148-C163 PolarHBondContact SG-SG 2.7Å; R152-C163 HydrophobicContact CB-CB 4.09Å; K153-C163 CarbonylContact O-C 3.58Å; K153-C163 WeakPolarHBondContact O-CA 3.03Å
164	L	85.2	Confident	79.8	Confident	40 Å²	40	57.2 Å²	57.2	21%	0.209	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	155.2	179.4	-63.4	-178.9	0	0	0	111.5	P125 M127 R152 K153 C155 T157 R162	P125-L164 HydrophobicContact CG-CB 4.2Å; P125-L164 HydrophobicContact CG-CD1 3.67Å; M127-L164 HydrophobicContact CE-CD1 3.82Å; R152-L164 CarbonylContact C-O 3.59Å; R152-L164 WeakPolarHBondContact CA-O 3.21Å; R152-L164 VanDerWaalsContact CB-O 3.26Å; R152-L164 WeakPolarHBondContact CB-O 2.97Å; K153-L164 PolarHBondContact N-O 3.14Å; K153-L164 PolarHBondContact O-N 2.03Å; C155-L164 HydrophobicContact CB-CB 4.25Å; C155-L164 HydrophobicContact CB-CD1 3.71Å; C155-L164 HydrophobicContact CB-CG 4.11Å; T157-L164 HydrophobicContact CG2-CD1 4.3Å; R162-L164 HydrophobicContact CG-CD1 4.34Å; R162-L164 HydrophobicContact CG-CD2 3.76Å; R162-L164 HydrophobicContact CG-CG 3.81Å; R162-L164 PolarHBondContact O-N 3.28Å
165	L	82.6	Confident	79.4	Confident	120 Å²	120	60.3 Å²	60.3	63%	0.628	34%	0.337	S	S	*	.			trans	-67.7	134.3	169.3	-72.6	162	0	0	0	108.9	R152	R152-L165 HydrophobicContact CG-CD2 4.27Å
166	P	79.3	Confident	79	Confident	42 Å²	42	65.3 Å²	65.3	27%	0.273	37%	0.365	S	S	.	.			trans	-59.6	144.9	172.3	24	-31.4	0	0	0	110.8	V120 P121 N123 G151 K153	V120-P166 HydrophobicContact CG1-CG 4.14Å; P121-P166 WeakPolarHBondContact O-CB 3.38Å; N123-P166 CarbonylContact O-C 3.54Å; N123-P166 VanDerWaalsContact O-CA 3.29Å; N123-P166 WeakPolarHBondContact O-CA 3.33Å; G151-P166 WeakPolarHBondContact O-CD 2.96Å; K153-P166 HydrophobicContact CD-CB 3.87Å; K153-P166 HydrophobicContact CG-CB 4.2Å
167	S	75	Confident	79.1	Confident	125 Å²	125	62.5 Å²	62.5	87%	0.874	34%	0.342	S	S	*	.			trans	-83.2	0	166.1	-58	0	0	0	0	111.6	N123 P125	N123-S167 PolarHBondContact N-O 2.92Å; N123-S167 PolarHBondContact O-N 2.92Å; P125-S167 VanDerWaalsContact CA-OG 3.29Å; P125-S167 WeakPolarHBondContact CA-OG 3.01Å; P125-S167 WeakPolarHBondContact CB-OG 3.2Å

Retrieved 167 of 167 residues in 238.9 ms (Link to these results)

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