A0A3Q0KLU0_SCHMA Loading...

Putative DNA double-strand break repair rad50 ATPase

AlphaFold DB , UniProt , Accession A0A3Q0KLU0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 170 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	61	Low	81.6	Confident	201 Å²	201	125.7 Å²	125.7	99%	0.99	66%	0.658	S	S	*	*				0	-32.6	0	-58.8	-50.3	-111.3	0	0	114.2	L3	M1-L3 PolarHBondContact O-N 3.2Å
2	G	77.3	Confident	82.3	Confident	54 Å²	54	124.2 Å²	124.2	56%	0.557	65%	0.65	S	S	*	*	H	α-helix	trans	-65.1	-34.6	-175.5	0	0	0	0	0	116.4	W4 L5 Q6	G2-W4 VanDerWaalsContact C-N 3.32Å; G2-W4 PolarHBondContact O-N 3.1Å; G2-L5 PolarHBondContact O-N 3.12Å; G2-Q6 PolarHBondContact O-N 3.43Å; G2-Q6 VanDerWaalsContact O-N 3.16Å
3	L	75.6	Confident	82.6	Confident	153 Å²	153	119.9 Å²	119.9	80%	0.801	64%	0.636	S	S	*	*	H	α-helix	trans	-60.1	-38.8	-178.6	-83.9	146.9	0	0	0	113.2	M1 Q6 T7	M1-L3 PolarHBondContact O-N 3.2Å; L3-Q6 PolarHBondContact O-N 3.33Å; L3-T7 PolarHBondContact O-N 3.37Å; L3-T7 VanDerWaalsContact O-N 3.1Å; L3-T7 PolarHBondContact O-OG1 2.9Å
4	W	80.2	Confident	82.7	Confident	201 Å²	201	116.4 Å²	116.4	76%	0.761	62%	0.621	S	S	*	*	H	α-helix	trans	-68.2	-35.6	178.6	-68.3	98.2	0	0	0	113	G2 Q6 T7 L8	G2-W4 VanDerWaalsContact C-N 3.32Å; G2-W4 PolarHBondContact O-N 3.1Å; W4-Q6 VanDerWaalsContact C-N 3.34Å; W4-T7 WeakPolarHBondContact CA-OG1 3.38Å; W4-T7 PolarHBondContact O-OG1 3.16Å; W4-T7 VanDerWaalsContact O-OG1 3.12Å; W4-L8 WeakPolarHBondContact O-CB 3.36Å; W4-L8 PolarHBondContact O-N 3.09Å; W4-L8 VanDerWaalsContact O-N 3.09Å
5	L	81.7	Confident	83	Confident	131 Å²	131	114.5 Å²	114.5	69%	0.686	62%	0.615	S	S	*	*	H	α-helix	trans	-68.2	-38.1	176.7	-119.9	117.2	0	0	0	111	G2 L8 L9	G2-L5 PolarHBondContact O-N 3.12Å; L5-L8 PolarHBondContact O-N 2.97Å; L5-L9 WeakPolarHBondContact O-CB 3.48Å; L5-L9 PolarHBondContact O-N 3Å
6	Q	85.1	Confident	82.9	Confident	138 Å²	138	112.4 Å²	112.4	65%	0.645	61%	0.607	S	S	*	*	H	α-helix	trans	-71.6	-38.6	179.8	-165.5	146.5	3.1	0	0	112.2	G2 L3 W4 L9 V10	G2-Q6 PolarHBondContact O-N 3.43Å; G2-Q6 VanDerWaalsContact O-N 3.16Å; L3-Q6 PolarHBondContact O-N 3.33Å; W4-Q6 VanDerWaalsContact C-N 3.34Å; Q6-L9 PolarHBondContact O-N 2.96Å; Q6-V10 VanDerWaalsContact O-CG2 3.3Å; Q6-V10 WeakPolarHBondContact O-CG2 3.44Å; Q6-V10 PolarHBondContact O-N 3.49Å
7	T	84.2	Confident	82.7	Confident	88 Å²	88	112.6 Å²	112.6	54%	0.54	61%	0.608	S	S	.	*	H	α-helix	trans	-64.2	-41.5	171.6	26.9	0	0	0	0	112.4	L3 W4 L9 V10 L11	L3-T7 PolarHBondContact O-N 3.37Å; L3-T7 VanDerWaalsContact O-N 3.1Å; L3-T7 PolarHBondContact O-OG1 2.9Å; W4-T7 WeakPolarHBondContact CA-OG1 3.38Å; W4-T7 PolarHBondContact O-OG1 3.16Å; W4-T7 VanDerWaalsContact O-OG1 3.12Å; T7-L9 PolarHBondContact O-N 3.42Å; T7-V10 PolarHBondContact O-N 3.39Å; T7-L11 WeakPolarHBondContact O-CB 3.3Å; T7-L11 PolarHBondContact O-N 3.42Å
8	L	86.4	Confident	82.5	Confident	107 Å²	107	112.8 Å²	112.8	56%	0.56	61%	0.613	S	S	*	*	H	α-helix	trans	-61.9	-41.5	174.7	-84.6	164.4	0	0	0	112.4	W4 L5 L11 L12	W4-L8 WeakPolarHBondContact O-CB 3.36Å; W4-L8 PolarHBondContact O-N 3.09Å; W4-L8 VanDerWaalsContact O-N 3.09Å; L5-L8 PolarHBondContact O-N 2.97Å; L8-L11 PolarHBondContact O-N 2.95Å; L8-L12 PolarHBondContact O-N 3.45Å
9	L	88.1	Confident	82.1	Confident	114 Å²	114	111.6 Å²	111.6	60%	0.597	61%	0.614	S	S	*	*	H	α-helix	trans	-65.4	-44.1	178.2	-166	78.5	0	0	0	111.7	L5 Q6 T7 L11 L12 C13	L5-L9 WeakPolarHBondContact O-CB 3.48Å; L5-L9 PolarHBondContact O-N 3Å; Q6-L9 PolarHBondContact O-N 2.96Å; T7-L9 PolarHBondContact O-N 3.42Å; L9-L11 VanDerWaalsContact C-N 3.34Å; L9-L11 PolarHBondContact O-N 2.94Å; L9-L12 PolarHBondContact O-N 3.3Å; L9-C13 PolarHBondContact O-N 3.42Å; L9-C13 PolarHBondContact O-SG 3.43Å
10	V	89.4	Confident	81.2	Confident	89 Å²	89	109.5 Å²	109.5	54%	0.539	61%	0.607	S	S	.	*	H	α-helix	trans	-63.7	-41.3	177	172	0	0	0	0	110.9	Q6 T7 C13 T14	Q6-V10 VanDerWaalsContact O-CG2 3.3Å; Q6-V10 WeakPolarHBondContact O-CG2 3.44Å; Q6-V10 PolarHBondContact O-N 3.49Å; T7-V10 PolarHBondContact O-N 3.39Å; V10-C13 PolarHBondContact O-N 2.91Å; V10-T14 WeakPolarHBondContact O-CG2 3.46Å; V10-T14 PolarHBondContact O-N 3.5Å; V10-T14 PolarHBondContact O-OG1 3.31Å
11	L	88.8	Confident	80.4	Confident	107 Å²	107	108.8 Å²	108.8	56%	0.56	61%	0.605	S	S	*	*	H	α-helix	trans	-62	-42.8	175.6	-166.6	86.2	0	0	0	111.8	T7 L8 L9 T14 V15	T7-L11 WeakPolarHBondContact O-CB 3.3Å; T7-L11 PolarHBondContact O-N 3.42Å; L8-L11 PolarHBondContact O-N 2.95Å; L9-L11 VanDerWaalsContact C-N 3.34Å; L9-L11 PolarHBondContact O-N 2.94Å; L11-T14 WeakPolarHBondContact CA-OG1 3.29Å; L11-T14 PolarHBondContact O-N 2.95Å; L11-T14 PolarHBondContact O-OG1 3.39Å; L11-V15 VanDerWaalsContact O-CG2 3.25Å; L11-V15 WeakPolarHBondContact O-CG2 3.36Å; L11-V15 PolarHBondContact O-N 3.26Å
12	L	89.2	Confident	80.1	Confident	107 Å²	107	104.6 Å²	104.6	56%	0.56	59%	0.593	S	S	*	*	H	α-helix	trans	-62.9	-43.9	174.9	-90.4	160.3	0	0	0	111.6	L8 L9 T14 V15 V16	L8-L12 PolarHBondContact O-N 3.45Å; L9-L12 PolarHBondContact O-N 3.3Å; L12-T14 PolarHBondContact O-N 2.89Å; L12-V15 PolarHBondContact O-N 3.02Å; L12-V16 VanDerWaalsContact O-CG2 3.29Å; L12-V16 WeakPolarHBondContact O-CG2 3.46Å; L12-V16 PolarHBondContact O-N 3.47Å
13	C	86.2	Confident	79	Confident	69 Å²	69	107.4 Å²	107.4	47%	0.466	60%	0.6	S	S	.	*	H	α-helix	trans	-63.1	-39.7	177.5	-74.3	0	0	0	0	112.5	L9 V10 V16 L17	L9-C13 PolarHBondContact O-N 3.42Å; L9-C13 PolarHBondContact O-SG 3.43Å; V10-C13 PolarHBondContact O-N 2.91Å; C13-V16 PolarHBondContact O-N 3.46Å; C13-L17 WeakPolarHBondContact O-CB 3.25Å; C13-L17 VanDerWaalsContact O-CG 3.28Å; C13-L17 WeakPolarHBondContact O-CG 3.5Å; C13-L17 PolarHBondContact O-N 2.92Å
14	T	84.8	Confident	77.5	Confident	70 Å²	70	105 Å²	105	43%	0.429	60%	0.596	S	S	.	*	H	α-helix	trans	-68.4	-40.8	176.9	53	0	0	0	0	111.7	V10 L11 L12 V16 L17 V18	V10-T14 WeakPolarHBondContact O-CG2 3.46Å; V10-T14 PolarHBondContact O-N 3.5Å; V10-T14 PolarHBondContact O-OG1 3.31Å; L11-T14 WeakPolarHBondContact CA-OG1 3.29Å; L11-T14 PolarHBondContact O-N 2.95Å; L11-T14 PolarHBondContact O-OG1 3.39Å; L12-T14 PolarHBondContact O-N 2.89Å; T14-V16 PolarHBondContact O-N 2.92Å; T14-L17 PolarHBondContact O-N 3.42Å; T14-V18 WeakPolarHBondContact O-CB 3.28Å; T14-V18 VanDerWaalsContact O-CG2 3.23Å; T14-V18 WeakPolarHBondContact O-CG2 3.38Å; T14-V18 PolarHBondContact O-N 3.49Å
15	V	86.2	Confident	75.8	Confident	88 Å²	88	103.2 Å²	103.2	53%	0.533	60%	0.6	S	S	.	*	H	α-helix	trans	-60.9	-45.4	174.2	172.1	0	0	0	0	110.9	L11 L12 V18 S19	L11-V15 VanDerWaalsContact O-CG2 3.25Å; L11-V15 WeakPolarHBondContact O-CG2 3.36Å; L11-V15 PolarHBondContact O-N 3.26Å; L12-V15 PolarHBondContact O-N 3.02Å; V15-V18 PolarHBondContact O-N 3.23Å; V15-S19 WeakPolarHBondContact O-CB 3.36Å; V15-S19 PolarHBondContact O-N 2.9Å; V15-S19 PolarHBondContact O-OG 3.36Å
16	V	82.8	Confident	74	Confident	81 Å²	81	105 Å²	105	49%	0.491	61%	0.605	S	S	.	*	H	α-helix	trans	-63.6	-45	177.6	172.8	0	0	0	0	111	L12 C13 T14 V18 S19 S20	L12-V16 VanDerWaalsContact O-CG2 3.29Å; L12-V16 WeakPolarHBondContact O-CG2 3.46Å; L12-V16 PolarHBondContact O-N 3.47Å; C13-V16 PolarHBondContact O-N 3.46Å; T14-V16 PolarHBondContact O-N 2.92Å; V16-V18 PolarHBondContact O-N 2.66Å; V16-S19 WeakPolarHBondContact CA-OG 3.23Å; V16-S19 PolarHBondContact O-N 3.37Å; V16-S19 PolarHBondContact O-OG 2.87Å; V16-S20 VanDerWaalsContact O-CB 3.29Å; V16-S20 WeakPolarHBondContact O-CB 3.29Å; V16-S20 PolarHBondContact O-N 3.36Å; V16-S20 PolarHBondContact O-OG 2.77Å
17	L	78.9	Confident	72	Confident	117 Å²	117	108 Å²	108	61%	0.613	62%	0.615	S	S	*	*	H	α-helix	trans	-62.9	-39.8	178	-75.8	170	0	0	0	112.6	C13 T14 S20 V21	C13-L17 WeakPolarHBondContact O-CB 3.25Å; C13-L17 VanDerWaalsContact O-CG 3.28Å; C13-L17 WeakPolarHBondContact O-CG 3.5Å; C13-L17 PolarHBondContact O-N 2.92Å; T14-L17 PolarHBondContact O-N 3.42Å; L17-S20 WeakPolarHBondContact CA-OG 3.41Å; L17-S20 PolarHBondContact O-N 3.45Å; L17-S20 PolarHBondContact O-OG 3.22Å; L17-V21 WeakPolarHBondContact O-CG2 3.41Å; L17-V21 PolarHBondContact O-N 3.44Å
18	V	79.7	Confident	70.4	Confident	115 Å²	115	109.9 Å²	109.9	70%	0.697	63%	0.629	S	S	*	*	H	α-helix	trans	-68	-37.6	175.3	174.1	0	0	0	0	111.2	T14 V15 V16 S20	T14-V18 WeakPolarHBondContact O-CB 3.28Å; T14-V18 VanDerWaalsContact O-CG2 3.23Å; T14-V18 WeakPolarHBondContact O-CG2 3.38Å; T14-V18 PolarHBondContact O-N 3.49Å; V15-V18 PolarHBondContact O-N 3.23Å; V16-V18 PolarHBondContact O-N 2.66Å; V18-S20 VanDerWaalsContact C-N 3.34Å
19	S	73.7	Confident	68	Low	91 Å²	91	112.2 Å²	112.2	64%	0.636	64%	0.642	S	S	*	*	H	α-helix	trans	-74.4	-22	177.1	72	0	0	0	0	114.3	V15 V16	V15-S19 WeakPolarHBondContact O-CB 3.36Å; V15-S19 PolarHBondContact O-N 2.9Å; V15-S19 PolarHBondContact O-OG 3.36Å; V16-S19 WeakPolarHBondContact CA-OG 3.23Å; V16-S19 PolarHBondContact O-N 3.37Å; V16-S19 PolarHBondContact O-OG 2.87Å
20	S	65.6	Low	66	Low	69 Å²	69	114.5 Å²	114.5	48%	0.483	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.1	10	-176.8	55	0	0	0	0	113.5	V16 L17 V18 P22	V16-S20 VanDerWaalsContact O-CB 3.29Å; V16-S20 WeakPolarHBondContact O-CB 3.29Å; V16-S20 PolarHBondContact O-N 3.36Å; V16-S20 PolarHBondContact O-OG 2.77Å; L17-S20 WeakPolarHBondContact CA-OG 3.41Å; L17-S20 PolarHBondContact O-N 3.45Å; L17-S20 PolarHBondContact O-OG 3.22Å; V18-S20 VanDerWaalsContact C-N 3.34Å; S20-P22 WeakPolarHBondContact O-CD 3.07Å
21	V	64.5	Low	63.9	Low	94 Å²	94	118.9 Å²	118.9	57%	0.57	67%	0.669	S	S	*	*			trans	-71	108.7	164.3	-177.5	0	0	0	0	107.9	L17 T23	L17-V21 WeakPolarHBondContact O-CG2 3.41Å; L17-V21 PolarHBondContact O-N 3.44Å; V21-T23 PolarHBondContact O-N 2.98Å
22	P	54.6	Low	61.6	Low	113 Å²	113	123.2 Å²	123.2	73%	0.734	69%	0.686	S	S	*	*			trans	-70.3	106	172.2	30.2	-30.5	0	0	0	107.5	S20 S24	S20-P22 WeakPolarHBondContact O-CD 3.07Å; P22-S24 PolarHBondContact O-N 3.22Å
23	T	53.9	Low	59.6	Low	114 Å²	114	122.6 Å²	122.6	70%	0.699	69%	0.687	S	S	*	*			trans	-66.2	59.9	163.3	41.8	0	0	0	0	110.1	V21 I25	V21-T23 PolarHBondContact O-N 2.98Å; T23-I25 VanDerWaalsContact C-N 3.27Å; T23-I25 PolarHBondContact O-N 2.79Å
24	S	43.6	Very low	57.5	Low	103 Å²	103	126 Å²	126	72%	0.72	70%	0.701	S	S	*	*			trans	-86.8	76.4	163.5	-176.4	0	0	0	0	107.3	P22	P22-S24 PolarHBondContact O-N 3.22Å
25	I	44.1	Very low	55.4	Low	163 Å²	163	127.1 Å²	127.1	84%	0.836	71%	0.711	S	S	*	*			trans	174.7	79.4	155.2	-77.6	138.4	0	0	0	104.5	T23	T23-I25 VanDerWaalsContact C-N 3.27Å; T23-I25 PolarHBondContact O-N 2.79Å
26	Q	43.8	Very low	53.5	Low	169 Å²	169	131.2 Å²	131.2	79%	0.79	73%	0.725	S	S	*	*			trans	-158.5	106	162.1	-106.8	169.7	46.6	0	0	106.7
27	K	44.2	Very low	51.4	Low	199 Å²	199	134.7 Å²	134.7	87%	0.865	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-76.5	127.5	162.3	-74.6	173.5	176.2	176.2	0	105.9	D29	K27-D29 PolarHBondContact O-N 3.38Å
28	P	49.5	Very low	50.1	Low	128 Å²	128	136.7 Å²	136.7	83%	0.831	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-72.7	118.5	173.7	27.8	-30.8	0	0	0	109.9
29	D	36.5	Very low	48.7	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-68.7	120.6	146.2	-80	-70.4	0	0	0	107.4	K27	K27-D29 PolarHBondContact O-N 3.38Å
30	L	45.9	Very low	47.2	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	76%	0.76	S	S	*	*			trans	166.7	99.6	150	-103.6	141.7	0	0	0	110.4
31	E	46	Very low	46.4	Very low	180 Å²	180	146 Å²	146	84%	0.841	78%	0.777	S	S	*	*			trans	-161	83.1	133.1	-112.5	-177.5	99.7	0	0	106.7	T33	E31-T33 PolarHBondContact O-N 3.43Å
32	E	39.8	Very low	45.2	Very low	198 Å²	198	144.3 Å²	144.3	93%	0.925	78%	0.779	S	S	*	*			trans	-70.5	105.3	148.8	-93.3	179.5	114.9	0	0	106.3
33	T	47.7	Very low	44.7	Very low	95 Å²	95	143.9 Å²	143.9	58%	0.583	78%	0.778	S	S	*	*			trans	-143.4	102.9	163.7	-8.5	0	0	0	0	108.2	E31	E31-T33 PolarHBondContact O-N 3.43Å
34	D	42.2	Very low	43.9	Very low	141 Å²	141	147.1 Å²	147.1	75%	0.754	79%	0.785	S	S	*	*			trans	42.1	106.3	139.6	-89.5	-42.1	0	0	0	117.3
35	S	41.3	Very low	43.8	Very low	92 Å²	92	150.6 Å²	150.6	64%	0.643	79%	0.79	S	S	*	*				83.9	137.1	86.7	-68.3	0	0	0	0	112.7
36	Q	45.3	Very low	43.4	Very low	175 Å²	175	155.2 Å²	155.2	82%	0.818	80%	0.797	S	S	*	*			trans	93.3	93.9	169.4	-50.6	-178.6	46.5	0	0	113.8
37	L	39.3	Very low	43	Very low	153 Å²	153	150.4 Å²	150.4	80%	0.801	79%	0.792	S	S	*	*				60.9	107.9	86.2	-77.3	162.6	0	0	0	111.5
38	I	50.9	Low	42.7	Very low	159 Å²	159	146.2 Å²	146.2	82%	0.815	79%	0.788	S	S	*	*			trans	178.7	92.2	150.9	-82.7	140.8	0	0	0	102.3
39	E	50.7	Low	42.6	Very low	169 Å²	169	149.1 Å²	149.1	79%	0.79	79%	0.79	S	S	*	*				44.4	134.2	86.2	-64.3	-173	142.9	0	0	111.8
40	D	42.9	Very low	42.6	Very low	143 Å²	143	151.6 Å²	151.6	77%	0.765	79%	0.794	S	S	*	*			cis	-165.9	-176.4	-7.9	-169.5	-93.7	0	0	0	102
41	D	47.1	Very low	42.2	Very low	158 Å²	158	146.9 Å²	146.9	85%	0.845	79%	0.785	S	S	*	*			trans	80.1	124.9	165.2	-112	-52.8	0	0	0	119.2
42	G	40.2	Very low	41.9	Very low	59 Å²	59	145.3 Å²	145.3	61%	0.608	78%	0.782	S	S	*	*			trans	144.4	22.4	160.3	0	0	0	0	0	120
43	S	44.6	Very low	42	Very low	104 Å²	104	146.7 Å²	146.7	73%	0.727	78%	0.779	S	S	*	*			trans	68.5	110.4	151.1	70.9	0	0	0	0	119.6	H45	S43-H45 PolarHBondContact O-N 3.38Å
44	H	37	Very low	42.2	Very low	182 Å²	182	150.6 Å²	150.6	84%	0.843	80%	0.796	S	S	*	*			trans	-60.7	119.5	158.4	-68.3	-95.5	0	0	0	111.9
45	H	41.1	Very low	42	Very low	176 Å²	176	147.7 Å²	147.7	82%	0.815	80%	0.799	S	S	*	*			trans	-139.3	75.5	151.9	-74.2	-53.8	0	0	0	112.1	S43 G47	S43-H45 PolarHBondContact O-N 3.38Å; H45-G47 PolarHBondContact O-N 2.8Å
46	R	35.3	Very low	42.1	Very low	261 Å²	261	149 Å²	149	99%	0.985	81%	0.808	S	S	*	*			trans	-66.4	107.2	143.2	-91.3	-176.1	172.9	179.6	-0.2	106.8
47	G	35.5	Very low	41.6	Very low	67 Å²	67	143.9 Å²	143.9	69%	0.691	80%	0.802	S	S	*	*			trans	-158.8	72.7	-177.4	0	0	0	0	0	112.4	H45 Q49	H45-G47 PolarHBondContact O-N 2.8Å; G47-Q49 PolarHBondContact O-N 3.36Å
48	S	37.5	Very low	42.2	Very low	111 Å²	111	145 Å²	145	78%	0.776	80%	0.801	S	S	*	*			trans	-64.9	106.3	160.5	161.3	0	0	0	0	108.4
49	Q	48	Very low	41.7	Very low	190 Å²	190	145 Å²	145	89%	0.888	80%	0.803	S	S	*	*			trans	-161.6	138.4	156.5	-110.2	167.6	60.4	0	0	112.3	G47	G47-Q49 PolarHBondContact O-N 3.36Å
50	F	36	Very low	41.3	Very low	207 Å²	207	143 Å²	143	91%	0.908	80%	0.798	S	S	*	*			trans	-67.1	149.6	-177.8	-70.6	-111.2	0	0	0	111.7
51	G	38.7	Very low	41.1	Very low	65 Å²	65	142.1 Å²	142.1	67%	0.67	80%	0.802	S	S	*	*			trans	143.1	100.9	152.6	0	0	0	0	0	117.6
52	N	38.6	Very low	41	Very low	146 Å²	146	136.7 Å²	136.7	78%	0.781	78%	0.777	S	S	*	*			trans	77	120.4	130.7	-64.8	-11.8	0	0	0	122.6
53	R	41.1	Very low	41.3	Very low	227 Å²	227	140.2 Å²	140.2	86%	0.857	79%	0.787	S	S	*	*			trans	88.4	144.8	131.7	-72.7	174.7	-172.7	-139.1	2.6	118.7
54	L	52.1	Low	41.4	Very low	177 Å²	177	138 Å²	138	93%	0.927	78%	0.78	S	S	*	*			trans	87.6	99.9	-178.1	-50.2	173.9	0	0	0	111.9
55	G	37.9	Very low	41.6	Very low	81 Å²	81	135.1 Å²	135.1	84%	0.835	77%	0.767	S	S	*	*			cis	104.3	86.8	38.5	0	0	0	0	0	108.2
56	S	43.8	Very low	41.8	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	77%	0.766	S	S	*	*			trans	-157.9	106.7	156.2	-157.4	0	0	0	0	108.6	K58	S56-K58 PolarHBondContact O-N 2.84Å
57	G	36.4	Very low	42.4	Very low	68 Å²	68	134 Å²	134	70%	0.701	76%	0.755	S	S	*	*			trans	-65.7	126.7	177.6	0	0	0	0	0	110.5
58	K	51.4	Low	43	Very low	177 Å²	177	133.8 Å²	133.8	77%	0.77	74%	0.744	S	S	*	*			trans	-146.7	109.3	156.3	-101	166	-176.5	179.8	0	107	S56 D60	S56-K58 PolarHBondContact O-N 2.84Å; K58-D60 PolarHBondContact O-N 3.36Å
59	N	39.9	Very low	43.4	Very low	160 Å²	160	135.6 Å²	135.6	86%	0.856	74%	0.739	S	S	*	*			trans	-77	74.2	-179.2	-53.8	-28.3	0	0	0	108
60	D	41.8	Very low	43.6	Very low	127 Å²	127	137.2 Å²	137.2	68%	0.679	74%	0.737	S	S	*	*			trans	-101.4	92.6	176.6	-75.6	-44.8	0	0	0	110.7	K58 S62	K58-D60 PolarHBondContact O-N 3.36Å; D60-S62 PolarHBondContact O-N 3.16Å; D60-S62 PolarHBondContact O-OG 3.39Å
61	S	38.9	Very low	44.3	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	74%	0.735	S	S	*	*			trans	-32.4	90.9	156.7	-60.5	0	0	0	0	112.8
62	S	44.3	Very low	44.9	Very low	45 Å²	45	145.7 Å²	145.7	32%	0.315	74%	0.743	S	S	.	*			trans	-151	42.1	176.2	63	0	0	0	0	112.6	D60 G64	D60-S62 PolarHBondContact O-N 3.16Å; D60-S62 PolarHBondContact O-OG 3.39Å; S62-G64 PolarHBondContact O-N 3.44Å; S62-G64 VanDerWaalsContact O-N 3.15Å
63	T	46.4	Very low	45.6	Very low	133 Å²	133	147.7 Å²	147.7	82%	0.816	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-10.9	174.7	45	0	0	0	0	113.4	R67	T63-R67 PolarHBondContact O-NH1 3.23Å
64	G	47.2	Very low	46.3	Very low	56 Å²	56	146.5 Å²	146.5	58%	0.577	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-30.8	175.9	0	0	0	0	0	116.3	S62	S62-G64 PolarHBondContact O-N 3.44Å; S62-G64 VanDerWaalsContact O-N 3.15Å
65	E	41.9	Very low	46.3	Very low	123 Å²	123	142.8 Å²	142.8	58%	0.575	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-28.9	-168.8	-89.5	171.4	121.2	0	0	114.8	R67 S68 H69	E65-R67 PolarHBondContact O-N 3.02Å; E65-R67 VanDerWaalsContact O-N 3.09Å; E65-S68 PolarHBondContact O-N 3.48Å; E65-S68 VanDerWaalsContact O-N 3.11Å; E65-S68 PolarHBondContact O-OG 3.25Å; E65-H69 PolarHBondContact O-N 2.87Å
66	R	45.8	Very low	47.1	Very low	212 Å²	212	142 Å²	142	80%	0.8	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-19.3	176.8	-91	-177.5	177.6	-164.1	-0.2	113.8
67	R	48.2	Very low	47.6	Very low	200 Å²	200	146.5 Å²	146.5	76%	0.755	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-20.1	177.3	-71.3	-173.4	-178.7	105.5	-4.8	113.5	T63 E65	T63-R67 PolarHBondContact O-NH1 3.23Å; E65-R67 PolarHBondContact O-N 3.02Å; E65-R67 VanDerWaalsContact O-N 3.09Å
68	S	46.9	Very low	48.5	Very low	64 Å²	64	151.3 Å²	151.3	45%	0.448	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	-31	-180	69.4	0	0	0	0	112.4	E65 R70 R71	E65-S68 PolarHBondContact O-N 3.48Å; E65-S68 VanDerWaalsContact O-N 3.11Å; E65-S68 PolarHBondContact O-OG 3.25Å; S68-R70 VanDerWaalsContact C-N 3.28Å; S68-R70 PolarHBondContact O-N 3.45Å; S68-R71 PolarHBondContact O-N 3.03Å
69	H	45.8	Very low	48.8	Very low	148 Å²	148	143.1 Å²	143.1	69%	0.685	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-64.1	-26.3	179.4	-94.7	-83.3	0	0	0	114.5	E65 R71	E65-H69 PolarHBondContact O-N 2.87Å; H69-R71 VanDerWaalsContact C-N 3.27Å; H69-R71 PolarHBondContact O-N 3.42Å
70	R	52	Low	49.6	Very low	224 Å²	224	141.4 Å²	141.4	85%	0.845	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-72.6	-15.9	177.8	-85.2	-174.6	176.9	177.3	-0.1	114.1	S68	S68-R70 VanDerWaalsContact C-N 3.28Å; S68-R70 PolarHBondContact O-N 3.45Å
71	R	51.3	Low	50.1	Low	227 Å²	227	141.8 Å²	141.8	86%	0.857	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-101.3	-7.5	-174.3	-68.2	-171.7	-179	-174.8	2.1	114.8	S68 H69	S68-R71 PolarHBondContact O-N 3.03Å; H69-R71 VanDerWaalsContact C-N 3.27Å; H69-R71 PolarHBondContact O-N 3.42Å
72	R	50.6	Low	50.5	Low	223 Å²	223	141.6 Å²	141.6	84%	0.842	64%	0.641	S	S	*	*			trans	-101.3	40	-178.9	-80.9	-173.4	173.1	-172.1	-0.6	113.4	K74	R72-K74 PolarHBondContact O-N 3.2Å
73	R	54.8	Low	51	Low	189 Å²	189	143 Å²	143	71%	0.713	66%	0.663	S	S	*	*			trans	-67.5	100.4	168.4	-72	-171.8	177.4	-172.9	-2.2	108	H75	R73-H75 PolarHBondContact O-N 3.24Å
74	K	54.4	Low	51.6	Low	201 Å²	201	143.4 Å²	143.4	87%	0.874	66%	0.655	S	S	*	*			trans	-42.3	121.3	177.6	-84.5	178.3	173.2	178.7	0	109.7	R72 N76	R72-K74 PolarHBondContact O-N 3.2Å; K74-N76 PolarHBondContact O-N 2.87Å
75	H	53.2	Low	52	Low	99 Å²	99	142.5 Å²	142.5	46%	0.458	64%	0.64	S	S	.	*			trans	-66.6	108.9	166.9	175.2	-78	0	0	0	107.9	R73 R77	R73-H75 PolarHBondContact O-N 3.24Å; H75-R77 WeakPolarHBondContact ND1-CG 3.31Å; H75-R77 PolarHBondContact O-N 3.08Å
76	N	53.9	Low	52.8	Low	65 Å²	65	141 Å²	141	35%	0.348	64%	0.641	S	S	.	*			trans	-73.4	107.6	168.7	-170.2	-5.8	0	0	0	108.4	K74 Q78 C79	K74-N76 PolarHBondContact O-N 2.87Å; N76-Q78 PolarHBondContact O-N 3.26Å; N76-Q78 VanDerWaalsContact OD1-CB 3.31Å; N76-Q78 WeakPolarHBondContact OD1-CB 2.99Å; N76-Q78 PolarHBondContact OD1-N 3.47Å; N76-Q78 PolarHBondContact OD1-OE1 2.04Å; N76-C79 PolarHBondContact O-N 2.76Å
77	R	55.5	Low	53.1	Low	213 Å²	213	140.8 Å²	140.8	80%	0.804	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-16.3	178.1	-72.2	-174	179.2	-179.1	0.7	112.9	H75 C79	H75-R77 WeakPolarHBondContact ND1-CG 3.31Å; H75-R77 PolarHBondContact O-N 3.08Å; R77-C79 PolarHBondContact O-N 3.23Å
78	Q	54.1	Low	53.3	Low	168 Å²	168	135.3 Å²	135.3	79%	0.785	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-9	177.3	-62.4	164.9	-22.1	0	0	113	N76 E80	N76-Q78 PolarHBondContact O-N 3.26Å; N76-Q78 VanDerWaalsContact OD1-CB 3.31Å; N76-Q78 WeakPolarHBondContact OD1-CB 2.99Å; N76-Q78 PolarHBondContact OD1-N 3.47Å; N76-Q78 PolarHBondContact OD1-OE1 2.04Å; Q78-E80 PolarHBondContact O-N 2.65Å
79	C	58.3	Low	53.3	Low	5 Å²	5	133.7 Å²	133.7	3%	0.034	65%	0.648	C	S	.	*			trans	-94.3	42.4	-179.3	-95.3	0	0	0	0	112.7	N76 R77 Q81 C85 N91	N76-C79 PolarHBondContact O-N 2.76Å; R77-C79 PolarHBondContact O-N 3.23Å; C79-Q81 VanDerWaalsContact C-N 3.34Å; C79-C85 WeakPolarHBondContact CB-SG 3.01Å; C79-C85 WeakPolarHBondContact SG-CA 3.43Å; C79-C85 WeakPolarHBondContact SG-CB 3.38Å; C79-C85 CovalentContact SG-SG 2.04Å; C79-C85 PolarHBondContact SG-SG 3.36Å; C79-N91 HydrophobicContact CB-CB 4.24Å; C79-N91 PolarHBondContact O-ND2 3.35Å; C79-N91 PolarHBondContact O-OD1 3.02Å
80	E	57.3	Low	53.5	Low	124 Å²	124	129.2 Å²	129.2	58%	0.579	64%	0.636	S	S	*	*			trans	-75.7	-25.4	-177.3	-158.2	156.4	-147.1	0	0	112.6	Q78 R93	Q78-E80 PolarHBondContact O-N 2.65Å; E80-R93 IonicContact OE1-CZ 3.38Å; E80-R93 VanDerWaalsContact OE1-CZ 3.29Å; E80-R93 IonicContact OE1-NH1 2.76Å; E80-R93 PolarHBondContact OE1-NH1 2.69Å; E80-R93 IonicContact OE1-NH2 2.8Å; E80-R93 PolarHBondContact OE1-NH2 3.14Å
81	Q	50.8	Low	53.4	Low	135 Å²	135	120.1 Å²	120.1	63%	0.631	61%	0.605	S	S	*	*	S	Bend	trans	-94.4	140.1	177.9	-64.3	-173.8	10.7	0	0	112.6	C79 G83	C79-Q81 VanDerWaalsContact C-N 3.34Å; Q81-G83 PolarHBondContact O-N 3.47Å; Q81-G83 VanDerWaalsContact O-N 3.16Å
82	T	47.9	Very low	53.2	Low	119 Å²	119	117.1 Å²	117.1	73%	0.73	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	105.9	176.5	-57.2	0	0	0	0	108.4
83	G	55.6	Low	53	Low	75 Å²	75	113.2 Å²	113.2	77%	0.773	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	125.5	-9.3	175.6	0	0	0	0	0	116.1	Q81	Q81-G83 PolarHBondContact O-N 3.47Å; Q81-G83 VanDerWaalsContact O-N 3.16Å
84	H	58.7	Low	52.4	Low	141 Å²	141	113.6 Å²	113.6	65%	0.653	58%	0.58	S	S	*	*			trans	-106	24.1	-174.5	-86.6	70.8	0	0	0	114.4
85	C	56.1	Low	51.8	Low	38 Å²	38	108.5 Å²	108.5	26%	0.257	57%	0.57	S	S	.	*			trans	-95.2	125.4	-179.5	-65.2	0	0	0	0	111.2	C79 G89	C79-C85 WeakPolarHBondContact CB-SG 3.01Å; C79-C85 WeakPolarHBondContact SG-CA 3.43Å; C79-C85 WeakPolarHBondContact SG-CB 3.38Å; C79-C85 CovalentContact SG-SG 2.04Å; C79-C85 PolarHBondContact SG-SG 3.36Å; C85-G89 WeakPolarHBondContact CB-O 3.38Å; C85-G89 PolarHBondContact SG-O 2.86Å
86	P	57	Low	51.4	Low	90 Å²	90	111 Å²	111	58%	0.584	58%	0.581	S	S	*	*			trans	-59.8	149.3	174.3	25	-32.7	0	0	0	110.1	G88 G89	P86-G88 PolarHBondContact O-N 2.78Å; P86-G89 WeakPolarHBondContact O-CA 3.47Å; P86-G89 PolarHBondContact O-N 2.98Å
87	E	52.7	Low	51	Low	209 Å²	209	119.8 Å²	119.8	98%	0.977	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.3	109.2	-172.7	-153.1	172.7	-170.9	0	0	111.4
88	G	52.5	Low	50.3	Low	85 Å²	85	119.4 Å²	119.4	88%	0.876	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.2	-10.2	-173.2	0	0	0	0	0	116	P86 A90	P86-G88 PolarHBondContact O-N 2.78Å; G88-A90 PolarHBondContact O-N 2.75Å
89	G	47.8	Very low	49.8	Very low	29 Å²	29	114.8 Å²	114.8	30%	0.299	61%	0.606	S	S	.	*			trans	-80.7	93.1	172.7	0	0	0	0	0	111.9	C85 P86 N91	C85-G89 WeakPolarHBondContact CB-O 3.38Å; C85-G89 PolarHBondContact SG-O 2.86Å; P86-G89 WeakPolarHBondContact O-CA 3.47Å; P86-G89 PolarHBondContact O-N 2.98Å; G89-N91 PolarHBondContact O-N 3.21Å
90	A	48.4	Very low	49.3	Very low	54 Å²	54	123.7 Å²	123.7	45%	0.446	64%	0.644	S	S	.	*			trans	-74.5	112.3	169.6	0	0	0	0	0	109.8	G88 W92	G88-A90 PolarHBondContact O-N 2.75Å; A90-W92 HydrophobicContact CB-CD2 4.17Å; A90-W92 HydrophobicContact CB-CG 4.38Å; A90-W92 HydrophobicContact CB-CZ2 3.87Å; A90-W92 PolarHBondContact O-N 3.33Å
91	N	49.8	Very low	49.2	Very low	33 Å²	33	124.7 Å²	124.7	18%	0.176	65%	0.647	C	S	.	*			trans	-67.1	87.4	161.1	-176.4	-2.8	0	0	0	108.8	C79 G89 R93 R94	C79-N91 HydrophobicContact CB-CB 4.24Å; C79-N91 PolarHBondContact O-ND2 3.35Å; C79-N91 PolarHBondContact O-OD1 3.02Å; G89-N91 PolarHBondContact O-N 3.21Å; N91-R93 PolarHBondContact O-N 2.95Å; N91-R93 VanDerWaalsContact O-N 3.08Å; N91-R93 VanDerWaalsContact OD1-CA 3.31Å; N91-R93 WeakPolarHBondContact OD1-CA 3.46Å; N91-R93 WeakPolarHBondContact OD1-CB 3.45Å; N91-R93 PolarHBondContact OD1-N 3.09Å; N91-R94 PolarHBondContact O-N 2.95Å; N91-R94 VanDerWaalsContact O-N 3.14Å
92	W	48.5	Very low	49.3	Very low	164 Å²	164	127.4 Å²	127.4	62%	0.621	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-0.8	174.6	-60.8	98.5	0	0	0	112.8	A90 R94	A90-W92 HydrophobicContact CB-CD2 4.17Å; A90-W92 HydrophobicContact CB-CG 4.38Å; A90-W92 HydrophobicContact CB-CZ2 3.87Å; A90-W92 PolarHBondContact O-N 3.33Å; W92-R94 PolarHBondContact O-N 2.04Å
93	R	46.5	Very low	50	Low	141 Å²	141	127 Å²	127	53%	0.532	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.8	13.1	163.9	-57.9	-176.5	151.9	-148.1	7.8	113.8	E80 N91 S95	E80-R93 IonicContact OE1-CZ 3.38Å; E80-R93 VanDerWaalsContact OE1-CZ 3.29Å; E80-R93 IonicContact OE1-NH1 2.76Å; E80-R93 PolarHBondContact OE1-NH1 2.69Å; E80-R93 IonicContact OE1-NH2 2.8Å; E80-R93 PolarHBondContact OE1-NH2 3.14Å; N91-R93 PolarHBondContact O-N 2.95Å; N91-R93 VanDerWaalsContact O-N 3.08Å; N91-R93 VanDerWaalsContact OD1-CA 3.31Å; N91-R93 WeakPolarHBondContact OD1-CA 3.46Å; N91-R93 WeakPolarHBondContact OD1-CB 3.45Å; N91-R93 PolarHBondContact OD1-N 3.09Å; R93-S95 PolarHBondContact O-N 2.7Å
94	R	42.6	Very low	50.6	Low	198 Å²	198	127.7 Å²	127.7	75%	0.747	63%	0.633	S	S	*	*	S	Bend	trans	-61.9	82.7	145	-86.8	-175.1	-169.9	164.2	5.3	107.3	N91 W92 H96	N91-R94 PolarHBondContact O-N 2.95Å; N91-R94 VanDerWaalsContact O-N 3.14Å; W92-R94 PolarHBondContact O-N 2.04Å; R94-H96 PolarHBondContact O-N 3.33Å
95	S	41.3	Very low	51.6	Low	93 Å²	93	129.3 Å²	129.3	65%	0.65	63%	0.634	S	S	*	*			trans	-39.2	115.6	159.2	56.2	0	0	0	0	104.7	R93 R97	R93-S95 PolarHBondContact O-N 2.7Å; S95-R97 VanDerWaalsContact C-N 3.27Å; S95-R97 PolarHBondContact O-N 2.81Å
96	H	45.2	Very low	52.7	Low	152 Å²	152	128.1 Å²	128.1	70%	0.704	63%	0.625	S	S	*	*			trans	-49	101	177.5	-78.8	-75.1	0	0	0	107.5	R94 R98	R94-H96 PolarHBondContact O-N 3.33Å; H96-R98 HydrophobicContact CB-CB 4.12Å; H96-R98 HydrophobicContact CB-CG 4.27Å; H96-R98 PolarHBondContact O-N 2.89Å
97	R	44.8	Very low	53.9	Low	249 Å²	249	128.4 Å²	128.4	94%	0.94	63%	0.629	S	S	*	*			trans	-67	30	159.6	-84.7	-166.6	177.5	-160.7	2.3	109.3	S95 G99	S95-R97 VanDerWaalsContact C-N 3.27Å; S95-R97 PolarHBondContact O-N 2.81Å; R97-G99 PolarHBondContact O-N 3.05Å
98	R	41.3	Very low	55.1	Low	205 Å²	205	121 Å²	121	77%	0.774	60%	0.604	S	S	*	*	S	Bend	trans	-73.9	80.2	160.9	-71.9	-170.4	173.7	-154.6	-0.2	107.2	H96 K100	H96-R98 HydrophobicContact CB-CB 4.12Å; H96-R98 HydrophobicContact CB-CG 4.27Å; H96-R98 PolarHBondContact O-N 2.89Å; R98-K100 PolarHBondContact O-N 2.76Å
99	G	42.7	Very low	56.4	Low	72 Å²	72	120.9 Å²	120.9	74%	0.742	58%	0.583	S	S	*	*	S	Bend	trans	58.5	15	140.9	0	0	0	0	0	119	R97 K101	R97-G99 PolarHBondContact O-N 3.05Å; G99-K101 PolarHBondContact O-N 3.13Å; G99-K101 VanDerWaalsContact O-N 3.09Å
100	K	48.3	Very low	58	Low	191 Å²	191	123 Å²	123	83%	0.83	61%	0.606	S	S	*	*			trans	-82.4	74.6	162.9	-79.9	-178.9	-179.3	174.7	0	107.7	R98 H102	R98-K100 PolarHBondContact O-N 2.76Å; K100-H102 PolarHBondContact O-N 2.89Å
101	K	54	Low	59.6	Low	146 Å²	146	124.6 Å²	124.6	64%	0.635	61%	0.607	S	S	*	*			trans	-51	114.2	156.9	-76.3	-174.8	174.4	-177.5	0	104.9	G99 R103 E158	G99-K101 PolarHBondContact O-N 3.13Å; G99-K101 VanDerWaalsContact O-N 3.09Å; K101-R103 PolarHBondContact O-N 2.69Å; K101-E158 IonicContact NZ-OE1 3.93Å; K101-E158 PolarHBondContact NZ-OE1 3.47Å; K101-E158 IonicContact NZ-OE2 3.29Å
102	H	52.8	Low	61.1	Low	191 Å²	191	123.9 Å²	123.9	88%	0.884	60%	0.604	S	S	*	*			trans	-60.6	94.1	170.3	-116.7	-91.1	0	0	0	105.1	K100 T104	K100-H102 PolarHBondContact O-N 2.89Å; H102-T104 PolarHBondContact O-N 2.87Å
103	R	63.6	Low	62.5	Low	111 Å²	111	119.4 Å²	119.4	42%	0.419	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-72.9	126.8	177	-62	-177.2	175.4	159.9	-0.4	106.2	K101 R105 F155 C156 R157	K101-R103 PolarHBondContact O-N 2.69Å; R103-R105 PolarHBondContact O-N 2.92Å; R103-F155 HydrophobicContact CB-CB 3.63Å; R103-F155 HydrophobicContact CB-CD1 3.8Å; R103-F155 HydrophobicContact CB-CG 4Å; R103-F155 HydrophobicContact CG-CB 4.47Å; R103-F155 WeakPolarHBondContact O-CD1 3.02Å; R103-C156 WeakPolarHBondContact CD-O 3.46Å; R103-R157 VanDerWaalsContact NH1-NE 3.1Å
104	T	68.4	Low	64	Low	89 Å²	89	122.2 Å²	122.2	55%	0.546	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-58.4	133.9	173.1	-45.6	0	0	0	0	108.2	H102 F155 C156	H102-T104 PolarHBondContact O-N 2.87Å; T104-F155 CarbonylContact O-C 3.59Å; T104-F155 VanDerWaalsContact O-CA 3.25Å; T104-F155 WeakPolarHBondContact O-CA 3.07Å; T104-C156 PolarHBondContact O-N 2.75Å
105	R	79.6	Confident	65.7	Low	176 Å²	176	114.8 Å²	114.8	66%	0.664	60%	0.6	S	S	*	*	B	Isolated β-bridge	trans	-68.3	145.8	169.7	-73.6	-173.8	-167.2	167.7	7.5	108.2	R103 K154 F155	R103-R105 PolarHBondContact O-N 2.92Å; R105-K154 WeakPolarHBondContact CA-O 3.31Å; R105-F155 HydrophobicContact CG-CD1 4.16Å; R105-F155 HydrophobicContact CG-CE1 3.75Å; R105-F155 HydrophobicContact CG-CZ 4.43Å
106	C	79.4	Confident	67.6	Low	12 Å²	12	112.9 Å²	112.9	8%	0.081	58%	0.58	C	S	.	*			trans	-142	154.7	179.1	55.3	0	0	0	0	108.3	D111 C118 K154 F155	C106-D111 HydrophobicContact CB-CB 3.83Å; C106-C118 HydrophobicContact CB-CB 3.71Å; C106-C118 WeakPolarHBondContact CB-SG 3.49Å; C106-C118 PolarHBondContact O-SG 2.95Å; C106-C118 VanDerWaalsContact O-SG 3.41Å; C106-C118 WeakPolarHBondContact SG-CA 3.19Å; C106-C118 WeakPolarHBondContact SG-CB 3.44Å; C106-C118 CovalentContact SG-SG 2.02Å; C106-C118 PolarHBondContact SG-SG 3.47Å; C106-K154 PolarHBondContact N-O 2.9Å; C106-K154 WeakPolarHBondContact O-CB 3.43Å; C106-F155 VanDerWaalsContact SG-CA 3.58Å; C106-F155 PolarHBondContact SG-N 2.96Å; C106-F155 VanDerWaalsContact SG-N 3.42Å
107	S	81.4	Confident	69.4	Low	96 Å²	96	109 Å²	109	67%	0.671	56%	0.564	S	S	*	*	S	Bend	trans	-104.2	-39.9	172.2	-64.9	0	0	0	0	109.9	D111 K154	S107-D111 WeakPolarHBondContact CA-OD2 3.43Å; S107-D111 WeakPolarHBondContact CB-OD2 3.48Å; S107-D111 PolarHBondContact N-OD2 2.93Å; S107-K154 PolarHBondContact O-NZ 3.18Å
108	A	77.5	Confident	71.2	Confident	53 Å²	53	98 Å²	98	44%	0.438	53%	0.525	S	S	.	.	S	Bend	trans	-131.1	167.1	179.3	0	0	0	0	0	111.8	G110 D111 C118	A108-G110 PolarHBondContact O-N 3.25Å; A108-D111 PolarHBondContact N-OD2 3.37Å; A108-D111 WeakPolarHBondContact O-CB 3.02Å; A108-D111 PolarHBondContact O-N 3.31Å; A108-C118 VanDerWaalsContact O-CB 3.29Å; A108-C118 WeakPolarHBondContact O-CB 3.29Å
109	D	80.1	Confident	73.1	Confident	83 Å²	83	92.5 Å²	92.5	44%	0.444	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-63.8	-27.7	179.3	-72.2	-37.6	0	0	0	113.2	D111 C112 C118	D109-D111 PolarHBondContact O-N 2.89Å; D109-C112 WeakPolarHBondContact O-CB 2.97Å; D109-C112 PolarHBondContact O-N 2.79Å; D109-C118 WeakPolarHBondContact OD1-CB 3.04Å; D109-C118 PolarHBondContact OD1-N 3.34Å
110	G	82	Confident	74.8	Confident	75 Å²	75	93.6 Å²	93.6	77%	0.773	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-69.4	-15.6	176.6	0	0	0	0	0	114.7	A108 C112	A108-G110 PolarHBondContact O-N 3.25Å; G110-C112 PolarHBondContact O-N 2.79Å
111	D	81.3	Confident	75.9	Confident	87 Å²	87	90.5 Å²	90.5	47%	0.465	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-78.8	-6.1	174.9	-56.4	-41.2	0	0	0	112.4	C106 S107 A108 D109	C106-D111 HydrophobicContact CB-CB 3.83Å; S107-D111 WeakPolarHBondContact CA-OD2 3.43Å; S107-D111 WeakPolarHBondContact CB-OD2 3.48Å; S107-D111 PolarHBondContact N-OD2 2.93Å; A108-D111 PolarHBondContact N-OD2 3.37Å; A108-D111 WeakPolarHBondContact O-CB 3.02Å; A108-D111 PolarHBondContact O-N 3.31Å; D109-D111 PolarHBondContact O-N 2.89Å
112	C	80.9	Confident	76.5	Confident	17 Å²	17	92.8 Å²	92.8	12%	0.115	48%	0.48	C	S	.	.	S	Bend	trans	-103.3	144.2	-175.8	-64.8	0	0	0	0	111.2	D109 G110 Q116 C156	D109-C112 WeakPolarHBondContact O-CB 2.97Å; D109-C112 PolarHBondContact O-N 2.79Å; G110-C112 PolarHBondContact O-N 2.79Å; C112-Q116 HydrophobicContact CB-CB 3.95Å; C112-C156 WeakPolarHBondContact CA-SG 3.25Å; C112-C156 HydrophobicContact CB-CB 3.81Å; C112-C156 WeakPolarHBondContact CB-SG 3.43Å; C112-C156 WeakPolarHBondContact SG-CA 3.13Å; C112-C156 WeakPolarHBondContact SG-CB 3.16Å; C112-C156 CovalentContact SG-SG 2.04Å; C112-C156 PolarHBondContact SG-SG 2.83Å
113	P	78.3	Confident	76.8	Confident	70 Å²	70	90.8 Å²	90.8	46%	0.455	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-61.9	158.3	174.3	28.9	-36	0	0	0	110.6	G115 Q116	P113-G115 PolarHBondContact O-N 3.05Å; P113-Q116 HydrophobicContact CG-CB 4.42Å; P113-Q116 HydrophobicContact CG-CG 4.08Å; P113-Q116 WeakPolarHBondContact O-CB 3.47Å; P113-Q116 PolarHBondContact O-N 3.41Å
114	E	78.3	Confident	76.2	Confident	201 Å²	201	88.8 Å²	88.8	94%	0.939	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	139.6	179.8	-164.3	176.1	-178.9	0	0	111.8	Q116	E114-Q116 VanDerWaalsContact C-N 3.28Å; E114-Q116 PolarHBondContact O-N 3.42Å
115	G	77.8	Confident	75.2	Confident	41 Å²	41	96.1 Å²	96.1	42%	0.423	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	2.6	-173.9	0	0	0	0	0	115	P113 R159	P113-G115 PolarHBondContact O-N 3.05Å; G115-R159 WeakPolarHBondContact O-CB 3.46Å; G115-R159 WeakPolarHBondContact O-CG 3.48Å; G115-R159 PolarHBondContact O-N 2.02Å
116	Q	81.8	Confident	73.4	Confident	53 Å²	53	91.2 Å²	91.2	25%	0.248	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	167.7	171.4	-58.4	-165	37.9	0	0	112.4	C112 P113 E114 C156 R157 R159	C112-Q116 HydrophobicContact CB-CB 3.95Å; P113-Q116 HydrophobicContact CG-CB 4.42Å; P113-Q116 HydrophobicContact CG-CG 4.08Å; P113-Q116 WeakPolarHBondContact O-CB 3.47Å; P113-Q116 PolarHBondContact O-N 3.41Å; E114-Q116 VanDerWaalsContact C-N 3.28Å; E114-Q116 PolarHBondContact O-N 3.42Å; Q116-C156 HydrophobicContact CB-CB 4.34Å; Q116-R157 CarbonylContact C-O 3.45Å; Q116-R157 WeakPolarHBondContact CA-O 3.36Å; Q116-R157 WeakPolarHBondContact CB-O 3.5Å; Q116-R159 PolarHBondContact O-NE 2.94Å
117	M	82.9	Confident	71.8	Confident	72 Å²	72	101.3 Å²	101.3	36%	0.355	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	149.4	172.4	71.8	-172	-21.3	0	0	110.5	K119 R157 R159	M117-K119 PolarHBondContact O-N 3.47Å; M117-R157 PolarHBondContact N-O 2.87Å; M117-R157 PolarHBondContact O-N 3.14Å; M117-R159 HydrophobicContact CB-CG 4.23Å; M117-R159 HydrophobicContact CG-CG 4.37Å; M117-R159 HydrophobicContact SD-CG 4.4Å
118	C	82.8	Confident	70.1	Confident	18 Å²	18	105.4 Å²	105.4	12%	0.122	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	104.2	-177.2	-172.8	0	0	0	0	110.7	C106 A108 D109 K154	C106-C118 HydrophobicContact CB-CB 3.71Å; C106-C118 WeakPolarHBondContact CB-SG 3.49Å; C106-C118 PolarHBondContact O-SG 2.95Å; C106-C118 VanDerWaalsContact O-SG 3.41Å; C106-C118 WeakPolarHBondContact SG-CA 3.19Å; C106-C118 WeakPolarHBondContact SG-CB 3.44Å; C106-C118 CovalentContact SG-SG 2.02Å; C106-C118 PolarHBondContact SG-SG 3.47Å; A108-C118 VanDerWaalsContact O-CB 3.29Å; A108-C118 WeakPolarHBondContact O-CB 3.29Å; D109-C118 WeakPolarHBondContact OD1-CB 3.04Å; D109-C118 PolarHBondContact OD1-N 3.34Å; C118-K154 WeakPolarHBondContact SG-CB 3.47Å
119	K	82.1	Confident	68.6	Low	88 Å²	88	110.9 Å²	110.9	38%	0.383	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.4	136	-174.3	-166	162.4	-171.2	160.1	0	112.2	M117 R121 F155 R157	M117-K119 PolarHBondContact O-N 3.47Å; K119-R121 PolarHBondContact O-N 3.27Å; K119-F155 PolarHBondContact N-O 3.2Å; K119-F155 PolarHBondContact O-N 3.32Å; K119-F155 VanDerWaalsContact O-O 3.12Å; K119-R157 HydrophobicContact CB-CG 4.21Å
120	E	78.1	Confident	67	Low	95 Å²	95	115.1 Å²	115.1	44%	0.444	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-56.1	139.7	175.5	-162.7	-177.7	174.6	0	0	111.4	R122 G152 R157	E120-R122 PolarHBondContact O-N 2.9Å; E120-G152 WeakPolarHBondContact OE1-CA 3.19Å; E120-R157 PolarHBondContact O-NH2 3.43Å
121	R	70.2	Confident	64.7	Low	126 Å²	126	119.5 Å²	119.5	48%	0.475	59%	0.588	S	S	.	*			trans	-67.4	99.2	169.7	-170.3	172.5	178.7	143.3	-3	109.3	K119 H123 K153 F155	K119-R121 PolarHBondContact O-N 3.27Å; R121-H123 PolarHBondContact O-CD2 3.38Å; R121-H123 PolarHBondContact O-N 3.08Å; R121-K153 WeakPolarHBondContact CB-O 3.48Å; R121-K153 PolarHBondContact N-O 3.11Å; R121-K153 VanDerWaalsContact N-O 3.12Å; R121-F155 HydrophobicContact CB-CD2 3.77Å; R121-F155 HydrophobicContact CB-CE2 3.77Å; R121-F155 HydrophobicContact CG-CD2 4.49Å; R121-F155 HydrophobicContact CG-CE2 4.34Å
122	R	67.5	Low	62.4	Low	194 Å²	194	119 Å²	119	73%	0.732	60%	0.602	S	S	*	*			trans	-55.5	104.6	160.8	-66.3	-171.2	-178.6	-176.7	-1.2	108.6	E120 G124	E120-R122 PolarHBondContact O-N 2.9Å; R122-G124 PolarHBondContact O-N 2.86Å
123	H	59.4	Low	60.2	Low	149 Å²	149	121.4 Å²	121.4	69%	0.69	63%	0.631	S	S	*	*			trans	-72.4	86.8	161.5	-72	-88.5	0	0	0	106	R121 R125	R121-H123 PolarHBondContact O-CD2 3.38Å; R121-H123 PolarHBondContact O-N 3.08Å; H123-R125 VanDerWaalsContact C-N 3.3Å; H123-R125 PolarHBondContact O-N 3.12Å
124	G	50.7	Low	58.6	Low	69 Å²	69	124 Å²	124	71%	0.711	65%	0.645	S	S	*	*			trans	-61.8	99.7	168.4	0	0	0	0	0	107.5	R122 G126	R122-G124 PolarHBondContact O-N 2.86Å; G124-G126 PolarHBondContact O-N 2.94Å
125	R	46.8	Very low	56.8	Low	243 Å²	243	122.9 Å²	122.9	92%	0.917	65%	0.645	S	S	*	*			trans	-61	99	149.3	-71.4	-168.1	-172.5	-131.5	5.2	103.9	H123 R127	H123-R125 VanDerWaalsContact C-N 3.3Å; H123-R125 PolarHBondContact O-N 3.12Å; R125-R127 VanDerWaalsContact C-N 3.31Å; R125-R127 PolarHBondContact O-N 3.26Å
126	G	42.9	Very low	55.3	Low	73 Å²	73	128.2 Å²	128.2	75%	0.753	66%	0.663	S	S	*	*			trans	-60.3	96.7	177.4	0	0	0	0	0	108.4	G124 K128	G124-G126 PolarHBondContact O-N 2.94Å; G126-K128 PolarHBondContact O-N 3.33Å
127	R	45.6	Very low	53.1	Low	225 Å²	225	130 Å²	130	85%	0.849	69%	0.687	S	S	*	*			trans	-65	92.1	152.7	-87.3	-174.5	174.8	178.4	-1.7	105.2	R125 H129	R125-R127 VanDerWaalsContact C-N 3.31Å; R125-R127 PolarHBondContact O-N 3.26Å; R127-H129 VanDerWaalsContact C-N 3.28Å; R127-H129 PolarHBondContact O-CD2 3.03Å; R127-H129 PolarHBondContact O-N 3.36Å
128	K	45	Very low	51	Low	182 Å²	182	132.8 Å²	132.8	79%	0.791	71%	0.713	S	S	*	*			trans	-60.6	101	161.2	-166.5	178.9	-176.1	-171.6	0	104.2	G126 Q130	G126-K128 PolarHBondContact O-N 3.33Å; K128-Q130 PolarHBondContact O-N 2.67Å
129	H	47.1	Very low	48.9	Very low	168 Å²	168	135 Å²	135	78%	0.778	74%	0.739	S	S	*	*			trans	-60.1	96.3	168.6	-77.9	-102.7	0	0	0	105.8	R127 N131	R127-H129 VanDerWaalsContact C-N 3.28Å; R127-H129 PolarHBondContact O-CD2 3.03Å; R127-H129 PolarHBondContact O-N 3.36Å; H129-N131 VanDerWaalsContact C-N 3.33Å; H129-N131 PolarHBondContact O-N 2.68Å; H129-N131 VanDerWaalsContact O-N 3.14Å
130	Q	45.8	Very low	46.8	Very low	171 Å²	171	138.7 Å²	138.7	80%	0.799	76%	0.763	S	S	*	*			trans	-70.2	102.6	162.4	-69.7	-168.6	83.4	0	0	104.6	K128 G132	K128-Q130 PolarHBondContact O-N 2.67Å; Q130-G132 PolarHBondContact O-N 3.33Å
131	N	33.7	Very low	45.1	Very low	168 Å²	168	139.5 Å²	139.5	90%	0.898	78%	0.779	S	S	*	*			trans	-52.9	124.4	156.5	-93.3	-4.6	0	0	0	107.5	H129	H129-N131 VanDerWaalsContact C-N 3.33Å; H129-N131 PolarHBondContact O-N 2.68Å; H129-N131 VanDerWaalsContact O-N 3.14Å
132	G	33.8	Very low	43.8	Very low	75 Å²	75	138.3 Å²	138.3	77%	0.773	79%	0.79	S	S	*	*			trans	123.3	110.3	168.9	0	0	0	0	0	113	Q130	Q130-G132 PolarHBondContact O-N 3.33Å
133	G	34.5	Very low	42.9	Very low	69 Å²	69	134.4 Å²	134.4	71%	0.711	79%	0.79	S	S	*	*			trans	113.3	99.8	157.3	0	0	0	0	0	115.1
134	T	43.3	Very low	41.9	Very low	124 Å²	124	131.5 Å²	131.5	76%	0.761	79%	0.786	S	S	*	*			trans	68	96.3	140.7	-32.7	0	0	0	0	117.1	L136	T134-L136 HydrophobicContact CG2-CD1 4.47Å; T134-L136 HydrophobicContact CG2-CG 4.09Å; T134-L136 PolarHBondContact O-N 2.87Å
135	L	41.5	Very low	41.3	Very low	178 Å²	178	132.8 Å²	132.8	93%	0.932	78%	0.784	S	S	*	*			trans	-57.8	100.1	156.3	-72.2	163.1	0	0	0	109
136	L	46.1	Very low	41.1	Very low	153 Å²	153	127.5 Å²	127.5	80%	0.801	77%	0.77	S	S	*	*			trans	-112.3	104.6	156.7	-74.1	174.3	0	0	0	107.5	T134	T134-L136 HydrophobicContact CG2-CD1 4.47Å; T134-L136 HydrophobicContact CG2-CG 4.09Å; T134-L136 PolarHBondContact O-N 2.87Å
137	A	36.3	Very low	40.9	Very low	91 Å²	91	129.4 Å²	129.4	75%	0.752	77%	0.772	S	S	*	*			trans	-57.2	148.7	162.5	0	0	0	0	0	109.6
138	S	38.3	Very low	40.7	Very low	130 Å²	130	120.8 Å²	120.8	91%	0.909	75%	0.752	S	S	*	*			trans	106.6	100.8	174.1	-51.7	0	0	0	0	113.4
139	G	38.7	Very low	40.5	Very low	63 Å²	63	118.4 Å²	118.4	65%	0.649	76%	0.755	S	S	*	*			trans	179	85.6	173.7	0	0	0	0	0	109	S141	G139-S141 PolarHBondContact O-N 2.99Å
140	N	38.4	Very low	40.7	Very low	167 Å²	167	117.4 Å²	117.4	89%	0.893	75%	0.749	S	S	*	*			trans	-36.9	97.4	174.3	-66.5	-8.3	0	0	0	110.9	S142	N140-S142 VanDerWaalsContact C-N 3.31Å; N140-S142 PolarHBondContact O-N 3.22Å
141	S	42	Very low	41.1	Very low	112 Å²	112	116.3 Å²	116.3	78%	0.783	75%	0.753	S	S	*	*			trans	-90.6	81.1	172.3	30.5	0	0	0	0	106.5	G139 P143	G139-S141 PolarHBondContact O-N 2.99Å; S141-P143 WeakPolarHBondContact O-CD 3.37Å; S141-P143 VanDerWaalsContact O-N 3.14Å
142	S	42.7	Very low	42.4	Very low	101 Å²	101	109.2 Å²	109.2	71%	0.706	72%	0.72	S	S	*	*			trans	-46.7	123.4	161.8	-60.8	0	0	0	0	107.3	N140 S144	N140-S142 VanDerWaalsContact C-N 3.31Å; N140-S142 PolarHBondContact O-N 3.22Å; S142-S144 VanDerWaalsContact C-N 3.31Å; S142-S144 PolarHBondContact O-N 2.95Å
143	P	48.4	Very low	44.3	Very low	112 Å²	112	111.7 Å²	111.7	73%	0.727	71%	0.709	S	S	*	*			trans	-62.1	107	167.6	26.5	-29	0	0	0	104.2	S141 S145	S141-P143 WeakPolarHBondContact O-CD 3.37Å; S141-P143 VanDerWaalsContact O-N 3.14Å; P143-S145 PolarHBondContact O-N 3.19Å; P143-S145 PolarHBondContact O-OG 3.26Å
144	S	37.6	Very low	46.5	Very low	87 Å²	87	113 Å²	113	61%	0.608	70%	0.695	S	S	*	*			trans	-64.9	95.2	170.8	-178	0	0	0	0	105.8	S142 H146	S142-S144 VanDerWaalsContact C-N 3.31Å; S142-S144 PolarHBondContact O-N 2.95Å; S144-H146 PolarHBondContact O-N 3.18Å; S144-H146 PolarHBondContact OG-CD2 2.87Å; S144-H146 PolarHBondContact OG-NE2 2.93Å
145	S	39.4	Very low	48.3	Very low	97 Å²	97	108.2 Å²	108.2	68%	0.678	66%	0.664	S	S	*	*			trans	-62.9	71.7	173.7	-53.1	0	0	0	0	108.8	P143 S147	P143-S145 PolarHBondContact O-N 3.19Å; P143-S145 PolarHBondContact O-OG 3.26Å; S145-S147 PolarHBondContact O-N 2.83Å
146	H	42.4	Very low	50.2	Low	131 Å²	131	99.8 Å²	99.8	61%	0.606	62%	0.621	S	S	*	*			trans	-89.6	54.8	160.9	-69.9	-52.1	0	0	0	108.9	S144 G148	S144-H146 PolarHBondContact O-N 3.18Å; S144-H146 PolarHBondContact OG-CD2 2.87Å; S144-H146 PolarHBondContact OG-NE2 2.93Å; H146-G148 PolarHBondContact O-N 2.93Å
147	S	38.7	Very low	51.6	Low	114 Å²	114	95.3 Å²	95.3	80%	0.797	59%	0.593	S	S	*	*			trans	-81.7	57.5	160.3	53.2	0	0	0	0	109	S145	S145-S147 PolarHBondContact O-N 2.83Å
148	G	41.2	Very low	53.6	Low	43 Å²	43	96.8 Å²	96.8	44%	0.443	58%	0.584	S	S	.	*	S	Bend	trans	-99.9	148.5	159.2	0	0	0	0	0	107.5	H146 K150	H146-G148 PolarHBondContact O-N 2.93Å; G148-K150 PolarHBondContact O-N 2.99Å
149	P	41.7	Very low	55.3	Low	132 Å²	132	97 Å²	97	86%	0.857	57%	0.565	S	S	*	*			trans	-66.5	82.5	173.4	29.2	-32	0	0	0	107.9	V151	P149-V151 PolarHBondContact O-N 3.44Å
150	K	50.6	Low	56.7	Low	148 Å²	148	103.6 Å²	103.6	64%	0.643	58%	0.576	S	S	*	*			trans	-64.9	112.1	167.4	-80.1	176.4	178.6	166.1	0	104.3	G148 G152	G148-K150 PolarHBondContact O-N 2.99Å; K150-G152 PolarHBondContact O-N 3.09Å
151	V	54.5	Low	57.7	Low	147 Å²	147	101.8 Å²	101.8	89%	0.891	57%	0.566	S	S	*	*			trans	-67.1	67.7	166.5	-170.1	0	0	0	0	106.9	P149 K153	P149-V151 PolarHBondContact O-N 3.44Å; V151-K153 PolarHBondContact O-N 3.42Å
152	G	61.3	Low	58.2	Low	19 Å²	19	100.3 Å²	100.3	20%	0.196	57%	0.569	C	S	.	*			trans	-65.4	129.6	177.8	0	0	0	0	0	107.2	E120 K150 K154	E120-G152 WeakPolarHBondContact OE1-CA 3.19Å; K150-G152 PolarHBondContact O-N 3.09Å; G152-K154 WeakPolarHBondContact O-CG 3.4Å; G152-K154 PolarHBondContact O-N 3.23Å
153	K	72	Confident	58.3	Low	127 Å²	127	100.7 Å²	100.7	55%	0.552	57%	0.566	S	S	*	*			trans	-54.6	108.8	175	-65.9	175.3	-179.1	175.1	0	107.5	R121 V151 F155	R121-K153 WeakPolarHBondContact CB-O 3.48Å; R121-K153 PolarHBondContact N-O 3.11Å; R121-K153 VanDerWaalsContact N-O 3.12Å; V151-K153 PolarHBondContact O-N 3.42Å; K153-F155 HydrophobicContact CB-CD2 4.42Å; K153-F155 HydrophobicContact CB-CE2 3.47Å; K153-F155 VanDerWaalsContact CB-CE2 3.47Å; K153-F155 HydrophobicContact CB-CZ 3.76Å; K153-F155 WeakPolarHBondContact O-CD2 2.93Å; K153-F155 WeakPolarHBondContact O-CE2 3.26Å
154	K	80.9	Confident	58.2	Low	96 Å²	96	103.7 Å²	103.7	42%	0.417	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.4	150.6	175.7	-52.2	-179.7	-172.2	174.6	0	109.5	R105 C106 S107 C118 G152	R105-K154 WeakPolarHBondContact CA-O 3.31Å; C106-K154 PolarHBondContact N-O 2.9Å; C106-K154 WeakPolarHBondContact O-CB 3.43Å; S107-K154 PolarHBondContact O-NZ 3.18Å; C118-K154 WeakPolarHBondContact SG-CB 3.47Å; G152-K154 WeakPolarHBondContact O-CG 3.4Å; G152-K154 PolarHBondContact O-N 3.23Å
155	F	82.3	Confident	58.5	Low	24 Å²	24	110.3 Å²	110.3	11%	0.105	58%	0.582	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-145.1	142.3	-173.3	-67.5	-79.6	0	0	0	110.5	R103 T104 R105 C106 K119 R121 K153 R157	R103-F155 HydrophobicContact CB-CB 3.63Å; R103-F155 HydrophobicContact CB-CD1 3.8Å; R103-F155 HydrophobicContact CB-CG 4Å; R103-F155 HydrophobicContact CG-CB 4.47Å; R103-F155 WeakPolarHBondContact O-CD1 3.02Å; T104-F155 CarbonylContact O-C 3.59Å; T104-F155 VanDerWaalsContact O-CA 3.25Å; T104-F155 WeakPolarHBondContact O-CA 3.07Å; R105-F155 HydrophobicContact CG-CD1 4.16Å; R105-F155 HydrophobicContact CG-CE1 3.75Å; R105-F155 HydrophobicContact CG-CZ 4.43Å; C106-F155 VanDerWaalsContact SG-CA 3.58Å; C106-F155 PolarHBondContact SG-N 2.96Å; C106-F155 VanDerWaalsContact SG-N 3.42Å; K119-F155 PolarHBondContact N-O 3.2Å; K119-F155 PolarHBondContact O-N 3.32Å; K119-F155 VanDerWaalsContact O-O 3.12Å; R121-F155 HydrophobicContact CB-CD2 3.77Å; R121-F155 HydrophobicContact CB-CE2 3.77Å; R121-F155 HydrophobicContact CG-CD2 4.49Å; R121-F155 HydrophobicContact CG-CE2 4.34Å; K153-F155 HydrophobicContact CB-CD2 4.42Å; K153-F155 HydrophobicContact CB-CE2 3.47Å; K153-F155 VanDerWaalsContact CB-CE2 3.47Å; K153-F155 HydrophobicContact CB-CZ 3.76Å; K153-F155 WeakPolarHBondContact O-CD2 2.93Å; K153-F155 WeakPolarHBondContact O-CE2 3.26Å; F155-R157 PolarHBondContact O-N 3.12Å
156	C	80.1	Confident	58.8	Low	2 Å²	2	116.9 Å²	116.9	1%	0.014	59%	0.592	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-61.7	129.9	172.4	-59.8	0	0	0	0	110.1	R103 T104 C112 Q116	R103-C156 WeakPolarHBondContact CD-O 3.46Å; T104-C156 PolarHBondContact O-N 2.75Å; C112-C156 WeakPolarHBondContact CA-SG 3.25Å; C112-C156 HydrophobicContact CB-CB 3.81Å; C112-C156 WeakPolarHBondContact CB-SG 3.43Å; C112-C156 WeakPolarHBondContact SG-CA 3.13Å; C112-C156 WeakPolarHBondContact SG-CB 3.16Å; C112-C156 CovalentContact SG-SG 2.04Å; C112-C156 PolarHBondContact SG-SG 2.83Å; Q116-C156 HydrophobicContact CB-CB 4.34Å
157	R	76.7	Confident	58.9	Low	59 Å²	59	116.8 Å²	116.8	22%	0.223	61%	0.606	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-130	141	174.3	-65.1	-168.5	-170.8	-155	-0.7	108.8	R103 Q116 M117 K119 E120 F155 R159	R103-R157 VanDerWaalsContact NH1-NE 3.1Å; Q116-R157 CarbonylContact C-O 3.45Å; Q116-R157 WeakPolarHBondContact CA-O 3.36Å; Q116-R157 WeakPolarHBondContact CB-O 3.5Å; M117-R157 PolarHBondContact N-O 2.87Å; M117-R157 PolarHBondContact O-N 3.14Å; K119-R157 HydrophobicContact CB-CG 4.21Å; E120-R157 PolarHBondContact O-NH2 3.43Å; F155-R157 PolarHBondContact O-N 3.12Å; R157-R159 PolarHBondContact O-N 2.98Å
158	E	78.2	Confident	58.9	Low	121 Å²	121	114.1 Å²	114.1	57%	0.565	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-48.9	130.9	167.4	-74.3	160.8	-163.3	0	0	110.2	K101 K160	K101-E158 IonicContact NZ-OE1 3.93Å; K101-E158 PolarHBondContact NZ-OE1 3.47Å; K101-E158 IonicContact NZ-OE2 3.29Å; E158-K160 PolarHBondContact O-N 3.15Å; E158-K160 VanDerWaalsContact O-N 3.13Å
159	R	73.3	Confident	58.8	Low	134 Å²	134	120 Å²	120	51%	0.506	62%	0.617	S	S	.	*			trans	-61.5	115.7	167.9	-69	179.9	-177	-170	-3	106.2	G115 Q116 M117 R157 N161	G115-R159 WeakPolarHBondContact O-CB 3.46Å; G115-R159 WeakPolarHBondContact O-CG 3.48Å; G115-R159 PolarHBondContact O-N 2.02Å; Q116-R159 PolarHBondContact O-NE 2.94Å; M117-R159 HydrophobicContact CB-CG 4.23Å; M117-R159 HydrophobicContact CG-CG 4.37Å; M117-R159 HydrophobicContact SD-CG 4.4Å; R157-R159 PolarHBondContact O-N 2.98Å; R159-N161 PolarHBondContact O-N 3.42Å
160	K	69.4	Low	59.2	Low	202 Å²	202	123.1 Å²	123.1	88%	0.878	64%	0.637	S	S	*	*			trans	-72.2	86.6	170.3	-81.4	-168.9	171.4	-164.9	0	107.3	E158 G162	E158-K160 PolarHBondContact O-N 3.15Å; E158-K160 VanDerWaalsContact O-N 3.13Å; K160-G162 PolarHBondContact O-N 3.28Å
161	N	59.1	Low	59.7	Low	129 Å²	129	121.9 Å²	121.9	69%	0.69	64%	0.637	S	S	*	*			trans	-64.1	128.4	157.9	-62.3	-1	0	0	0	105	R159 V163	R159-N161 PolarHBondContact O-N 3.42Å; N161-V163 PolarHBondContact O-N 2.76Å
162	G	51.6	Low	59.9	Low	81 Å²	81	120.6 Å²	120.6	84%	0.835	62%	0.624	S	S	*	*	S	Bend	trans	-63.2	26.2	-166.3	0	0	0	0	0	117.1	K160 H164	K160-G162 PolarHBondContact O-N 3.28Å; G162-H164 PolarHBondContact O-N 3.35Å; G162-H164 VanDerWaalsContact O-N 3.08Å
163	V	43.9	Very low	59.9	Low	109 Å²	109	126.2 Å²	126.2	66%	0.661	65%	0.647	S	S	*	*			trans	-81.6	86.6	173.9	-169.4	0	0	0	0	108.4	N161 R165	N161-V163 PolarHBondContact O-N 2.76Å; V163-R165 HydrophobicContact CG1-CG 3.93Å; V163-R165 PolarHBondContact O-N 2.85Å
164	H	46.9	Very low	59.1	Low	176 Å²	176	126.2 Å²	126.2	82%	0.815	65%	0.653	S	S	*	*			trans	-59.7	91.5	154.9	-96.8	-93.5	0	0	0	107.3	G162 R166	G162-H164 PolarHBondContact O-N 3.35Å; G162-H164 VanDerWaalsContact O-N 3.08Å; H164-R166 VanDerWaalsContact C-N 3.25Å; H164-R166 PolarHBondContact O-N 2.83Å
165	R	44.7	Very low	57.8	Low	225 Å²	225	128.1 Å²	128.1	85%	0.849	67%	0.668	S	S	*	*			trans	-66.2	97	160.1	-72.5	-160.3	177.7	-171.6	0.1	106.1	V163 S167	V163-R165 HydrophobicContact CG1-CG 3.93Å; V163-R165 PolarHBondContact O-N 2.85Å; R165-S167 PolarHBondContact O-N 3.2Å
166	R	44.4	Very low	56.1	Low	236 Å²	236	135 Å²	135	89%	0.891	71%	0.705	S	S	*	*			trans	-55.8	100.4	156.6	-87.9	-174.6	-174.1	-143.1	2	105.2	H164 G168	H164-R166 VanDerWaalsContact C-N 3.25Å; H164-R166 PolarHBondContact O-N 2.83Å; R166-G168 PolarHBondContact O-N 3.02Å
167	S	44.5	Very low	54.4	Low	128 Å²	128	144.5 Å²	144.5	90%	0.895	76%	0.755	S	S	*	*			trans	-73.8	69.7	154.1	51.9	0	0	0	0	106.8	R165	R165-S167 PolarHBondContact O-N 3.2Å
168	G	38.8	Very low	52.7	Low	58 Å²	58	151.1 Å²	151.1	60%	0.598	80%	0.796	S	S	*	*			trans	-110.4	117.3	156	0	0	0	0	0	104.3	R166	R166-G168 PolarHBondContact O-N 3.02Å
169	L	39.9	Very low	50.6	Low	167 Å²	167	153.6 Å²	153.6	87%	0.874	82%	0.815	S	S	*	*			trans	-53	156.1	166.7	-75.9	157.1	0	0	0	109.5
170	P	50.8	Low	48.5	Very low	198 Å²	198	155.4 Å²	155.4	100%	1.286	84%	0.843	S	S	*	*			trans	-51.1	0	-174	22.3	-35.1	0	0	0	114

Retrieved 170 of 170 residues in 61.2 ms (Link to these results)

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