A0A077ZFY3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZFY3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 125 aa.

						>A0A077ZFY3_TRITR|A0A077ZFY3
MNLEFVNRTLPIYSVSDDNYDWSTVPIGTLPWGNNSVTHLRLAQEMACENTDALTGDTAKTMPIMEFNETSDADNASESVQQSVMEADDFNLDEYGCYKRRKAVDVAAISQRVFDRIRCGFGECL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	48.6	Very low	60.5	Low	235 Å²	235	111.1 Å²	111.1	100%	1.158	57%	0.569	S	S	*	*				0	119.7	0	-77.1	175.7	177.6	0	0	106.7	L3	M1-L3 PolarHBondContact O-N 2.87Å
2	N	55	Low	61.1	Low	166 Å²	166	108.4 Å²	108.4	89%	0.888	56%	0.555	S	S	*	*			trans	-78.5	116	172.9	-76.9	-14.2	0	0	0	107.6
3	L	61.3	Low	61	Low	100 Å²	100	113.6 Å²	113.6	52%	0.524	57%	0.566	S	S	.	*			trans	-82	112.2	168.8	-77	155	0	0	0	106.8	M1 F5 P31	M1-L3 PolarHBondContact O-N 2.87Å; L3-F5 HydrophobicContact CB-CD2 4.5Å; L3-F5 HydrophobicContact CB-CE2 3.89Å; L3-F5 HydrophobicContact CB-CZ 4.29Å; L3-F5 WeakPolarHBondContact O-CD2 3.49Å; L3-P31 HydrophobicContact CD2-CB 4Å
4	E	62.4	Low	60.9	Low	130 Å²	130	109.9 Å²	109.9	61%	0.607	56%	0.556	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.1	138.6	167	-70.5	-177.5	170.9	0	0	107.6	P31 W32	E4-P31 CarbonylContact O-C 3.55Å; E4-P31 WeakPolarHBondContact O-CA 3.15Å; E4-W32 HydrophobicContact CB-CB 4.35Å; E4-W32 WeakPolarHBondContact O-CA 3.5Å; E4-W32 PolarHBondContact O-N 3.3Å
5	F	63.5	Low	60.3	Low	129 Å²	129	109.9 Å²	109.9	57%	0.566	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.1	124.4	177.6	-73.7	-91.8	0	0	0	107.9	L3 T29 P31	L3-F5 HydrophobicContact CB-CD2 4.5Å; L3-F5 HydrophobicContact CB-CE2 3.89Å; L3-F5 HydrophobicContact CB-CZ 4.29Å; L3-F5 WeakPolarHBondContact O-CD2 3.49Å; F5-T29 HydrophobicContact CB-CG2 3.61Å; F5-P31 HydrophobicContact CD1-CB 4.15Å; F5-P31 HydrophobicContact CE1-CB 3.95Å; F5-P31 HydrophobicContact CE1-CG 4.14Å
6	V	62	Low	60.1	Low	59 Å²	59	107 Å²	107	36%	0.358	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118	132.2	-177.2	179.3	0	0	0	0	109.1	R8 L30 W32	V6-R8 PolarHBondContact O-N 3.17Å; V6-L30 PolarHBondContact N-O 3.14Å; V6-L30 PolarHBondContact O-N 3.44Å; V6-W32 HydrophobicContact CB-CB 4.18Å; V6-W32 HydrophobicContact CG2-CB 3.49Å; V6-W32 VanDerWaalsContact CG2-CB 3.49Å; V6-W32 HydrophobicContact CG2-CD2 4.28Å; V6-W32 HydrophobicContact CG2-CE3 4.45Å; V6-W32 HydrophobicContact CG2-CG 3.86Å
7	N	66	Low	60.3	Low	107 Å²	107	108.1 Å²	108.1	57%	0.572	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-67.6	119.7	174.5	-161	1.9	0	0	0	109.2	G28	N7-G28 PolarHBondContact OD1-O 3.38Å
8	R	59.4	Low	60.6	Low	73 Å²	73	111.3 Å²	111.3	28%	0.275	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.7	138.6	-178.7	-66.7	-159.8	-179	173.3	-2.5	110.6	V6 I27 G28 L30 W32	V6-R8 PolarHBondContact O-N 3.17Å; R8-I27 PolarHBondContact O-N 3.42Å; R8-G28 PolarHBondContact N-O 3.22Å; R8-G28 PolarHBondContact O-N 3.33Å; R8-L30 HydrophobicContact CB-CD1 4.09Å; R8-L30 HydrophobicContact CG-CB 4.2Å; R8-L30 HydrophobicContact CG-CD1 4.2Å; R8-W32 VanDerWaalsContact NH2-CE3 3.31Å
9	T	64.9	Low	60.1	Low	69 Å²	69	110.5 Å²	110.5	42%	0.423	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.8	142.5	170.8	62	0	0	0	0	109.2	T24 V25 P26	T9-T24 WeakPolarHBondContact OG1-CB 3.45Å; T9-V25 CarbonylContact C-O 3.19Å; T9-V25 WeakPolarHBondContact CA-O 3.2Å; T9-P26 HydrophobicContact CG2-CB 4.49Å
10	L	59.1	Low	60.2	Low	91 Å²	91	114.3 Å²	114.3	48%	0.476	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.5	120.4	171.3	-166.3	68.9	0	0	0	107.6	I12 T24 V25 I27	L10-I12 PolarHBondContact O-N 3.24Å; L10-T24 CarbonylContact O-C 3.57Å; L10-T24 VanDerWaalsContact O-CA 3.27Å; L10-T24 WeakPolarHBondContact O-CA 2.92Å; L10-V25 PolarHBondContact N-O 3.41Å; L10-V25 PolarHBondContact O-N 3.42Å; L10-I27 HydrophobicContact CB-CD1 3.51Å; L10-I27 HydrophobicContact CB-CG1 3.7Å; L10-I27 HydrophobicContact CD1-CD1 3.86Å; L10-I27 HydrophobicContact CG-CD1 4.23Å
11	P	62.7	Low	60.4	Low	63 Å²	63	112.9 Å²	112.9	41%	0.409	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-66.4	126	167.9	28	-31.6	0	0	0	108.9	Y13	P11-Y13 HydrophobicContact CB-CE2 4.16Å; P11-Y13 HydrophobicContact CG-CE2 4.48Å
12	I	68.6	Low	61	Low	79 Å²	79	110.2 Å²	110.2	41%	0.405	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.4	122.8	169.8	-55.6	-170.8	0	0	0	107.1	L10 W22 S23 V25	L10-I12 PolarHBondContact O-N 3.24Å; I12-W22 WeakPolarHBondContact O-CA 2.97Å; I12-S23 PolarHBondContact N-O 3.24Å; I12-S23 PolarHBondContact O-N 3.34Å; I12-V25 HydrophobicContact CD1-CB 4.08Å; I12-V25 HydrophobicContact CD1-CG2 3.29Å; I12-V25 HydrophobicContact CG1-CG2 4.07Å
13	Y	59	Low	61.6	Low	176 Å²	176	105.5 Å²	105.5	69%	0.69	54%	0.536	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.3	172.8	-55.8	-84.3	0	0	0	108	P11 W22	P11-Y13 HydrophobicContact CB-CE2 4.16Å; P11-Y13 HydrophobicContact CG-CE2 4.48Å; Y13-W22 HydrophobicContact CD1-CB 4.2Å; Y13-W22 HydrophobicContact CE1-CB 4.38Å
14	S	59.7	Low	61.8	Low	61 Å²	61	103.5 Å²	103.5	43%	0.427	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.1	163.8	73.5	0	0	0	0	108.4	D21	S14-D21 PolarHBondContact N-O 3.16Å; S14-D21 PolarHBondContact O-N 3.18Å; S14-D21 VanDerWaalsContact O-N 3.09Å; S14-D21 PolarHBondContact OG-O 3.12Å
15	V	52.3	Low	61.9	Low	110 Å²	110	100.5 Å²	100.5	67%	0.667	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	112	175.6	-176.7	0	0	0	0	106.4	Y20	V15-Y20 HydrophobicContact CG1-CE1 4.35Å; V15-Y20 HydrophobicContact CG2-CD1 4.18Å; V15-Y20 HydrophobicContact CG2-CE1 4.19Å
16	S	57.1	Low	62	Low	64 Å²	64	98.8 Å²	98.8	45%	0.448	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	161.7	168.2	67	0	0	0	0	109.4	D18 N19	S16-D18 PolarHBondContact O-N 3.36Å; S16-N19 PolarHBondContact N-O 3.02Å; S16-N19 VanDerWaalsContact N-O 3.09Å; S16-N19 PolarHBondContact O-N 3.24Å; S16-N19 PolarHBondContact OG-O 2.85Å; S16-N19 VanDerWaalsContact OG-O 3.05Å
17	D	63	Low	62.3	Low	126 Å²	126	100.2 Å²	100.2	67%	0.674	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.2	-35.1	-162.6	-67.6	-26.4	0	0	0	115.9	R100	D17-R100 IonicContact OD1-CZ 3.97Å; D17-R100 IonicContact OD1-NH2 3.91Å; D17-R100 PolarHBondContact OD1-NH2 2.8Å; D17-R100 IonicContact OD2-CZ 3.8Å; D17-R100 IonicContact OD2-NH2 2.65Å; D17-R100 PolarHBondContact OD2-NH2 3.5Å
18	D	65.5	Low	62.4	Low	165 Å²	165	96.5 Å²	96.5	88%	0.882	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	10.3	177.7	-66.3	-53.2	0	0	0	113.8	S16	S16-D18 PolarHBondContact O-N 3.36Å
19	N	52.5	Low	62.5	Low	97 Å²	97	97.2 Å²	97.2	52%	0.519	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	122.3	-175.8	-162	36.7	0	0	0	112.3	S16 D21	S16-N19 PolarHBondContact N-O 3.02Å; S16-N19 VanDerWaalsContact N-O 3.09Å; S16-N19 PolarHBondContact O-N 3.24Å; S16-N19 PolarHBondContact OG-O 2.85Å; S16-N19 VanDerWaalsContact OG-O 3.05Å; N19-D21 PolarHBondContact O-N 3.3Å
20	Y	61.4	Low	62.3	Low	186 Å²	186	94.6 Å²	94.6	73%	0.729	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	99.5	164.8	-66.6	-85.8	0	0	0	107.5	V15	V15-Y20 HydrophobicContact CG1-CE1 4.35Å; V15-Y20 HydrophobicContact CG2-CD1 4.18Å; V15-Y20 HydrophobicContact CG2-CE1 4.19Å
21	D	64.4	Low	62.2	Low	85 Å²	85	91.1 Å²	91.1	46%	0.455	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	118.5	170.8	-167.4	10.9	0	0	0	108.6	S14 N19	S14-D21 PolarHBondContact N-O 3.16Å; S14-D21 PolarHBondContact O-N 3.18Å; S14-D21 VanDerWaalsContact O-N 3.09Å; S14-D21 PolarHBondContact OG-O 3.12Å; N19-D21 PolarHBondContact O-N 3.3Å
22	W	62.1	Low	61.8	Low	178 Å²	178	93.8 Å²	93.8	67%	0.674	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	118.2	173.4	62.1	-82.4	0	0	0	107.4	I12 Y13 T24	I12-W22 WeakPolarHBondContact O-CA 2.97Å; Y13-W22 HydrophobicContact CD1-CB 4.2Å; Y13-W22 HydrophobicContact CE1-CB 4.38Å; W22-T24 HydrophobicContact CE3-CG2 4.16Å; W22-T24 HydrophobicContact CZ3-CG2 4.12Å
23	S	66	Low	61.1	Low	68 Å²	68	91.4 Å²	91.4	48%	0.476	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	163.9	170.6	-169.6	0	0	0	0	108.9	I12	I12-S23 PolarHBondContact N-O 3.24Å; I12-S23 PolarHBondContact O-N 3.34Å
24	T	65.6	Low	61.1	Low	58 Å²	58	90.6 Å²	90.6	36%	0.356	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126.6	173.4	71.7	0	0	0	0	109.6	T9 L10 W22	T9-T24 WeakPolarHBondContact OG1-CB 3.45Å; L10-T24 CarbonylContact O-C 3.57Å; L10-T24 VanDerWaalsContact O-CA 3.27Å; L10-T24 WeakPolarHBondContact O-CA 2.92Å; W22-T24 HydrophobicContact CE3-CG2 4.16Å; W22-T24 HydrophobicContact CZ3-CG2 4.12Å
25	V	65.7	Low	60.7	Low	67 Å²	67	93.7 Å²	93.7	41%	0.406	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.3	175.7	173.7	0	0	0	0	108.7	T9 L10 I12 I27	T9-V25 CarbonylContact C-O 3.19Å; T9-V25 WeakPolarHBondContact CA-O 3.2Å; L10-V25 PolarHBondContact N-O 3.41Å; L10-V25 PolarHBondContact O-N 3.42Å; I12-V25 HydrophobicContact CD1-CB 4.08Å; I12-V25 HydrophobicContact CD1-CG2 3.29Å; I12-V25 HydrophobicContact CG1-CG2 4.07Å; V25-I27 PolarHBondContact O-N 3.33Å
26	P	64.3	Low	60.4	Low	93 Å²	93	92.7 Å²	92.7	60%	0.604	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	124.5	174.5	26.5	-32.9	0	0	0	110.4	T9	T9-P26 HydrophobicContact CG2-CB 4.49Å
27	I	69.5	Low	59.9	Low	89 Å²	89	95.7 Å²	95.7	46%	0.456	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-11.6	172.7	-38	175.9	0	0	0	110.3	R8 L10 V25	R8-I27 PolarHBondContact O-N 3.42Å; L10-I27 HydrophobicContact CB-CD1 3.51Å; L10-I27 HydrophobicContact CB-CG1 3.7Å; L10-I27 HydrophobicContact CD1-CD1 3.86Å; L10-I27 HydrophobicContact CG-CD1 4.23Å; V25-I27 PolarHBondContact O-N 3.33Å
28	G	67.9	Low	59.1	Low	29 Å²	29	94 Å²	94	30%	0.299	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	101.4	-170.8	-177.3	0	0	0	0	0	112.7	N7 R8	N7-G28 PolarHBondContact OD1-O 3.38Å; R8-G28 PolarHBondContact N-O 3.22Å; R8-G28 PolarHBondContact O-N 3.33Å
29	T	60.4	Low	58	Low	88 Å²	88	87.4 Å²	87.4	54%	0.54	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	116.2	-173.6	-37.2	0	0	0	0	110.7	F5	F5-T29 HydrophobicContact CB-CG2 3.61Å
30	L	61.1	Low	57.7	Low	14 Å²	14	87.5 Å²	87.5	7%	0.073	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	146.2	179.4	-70.4	170	0	0	0	110.5	V6 R8 W32 L40 A43	V6-L30 PolarHBondContact N-O 3.14Å; V6-L30 PolarHBondContact O-N 3.44Å; R8-L30 HydrophobicContact CB-CD1 4.09Å; R8-L30 HydrophobicContact CG-CB 4.2Å; R8-L30 HydrophobicContact CG-CD1 4.2Å; L30-W32 PolarHBondContact O-N 3.44Å; L30-L40 HydrophobicContact CD1-CD2 3.52Å; L30-L40 HydrophobicContact CD1-CG 4.41Å; L30-L40 HydrophobicContact CD2-CD2 4.21Å; L30-A43 HydrophobicContact CD2-CB 3.7Å
31	P	57	Low	56.9	Low	17 Å²	17	87.4 Å²	87.4	11%	0.11	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	130	175.5	13.1	-13.4	0	0	0	110.4	L3 E4 F5 H39	L3-P31 HydrophobicContact CD2-CB 4Å; E4-P31 CarbonylContact O-C 3.55Å; E4-P31 WeakPolarHBondContact O-CA 3.15Å; F5-P31 HydrophobicContact CD1-CB 4.15Å; F5-P31 HydrophobicContact CE1-CB 3.95Å; F5-P31 HydrophobicContact CE1-CG 4.14Å; P31-H39 HydrophobicContact CG-CB 3.91Å; P31-H39 PolarHBondContact O-CD2 3.35Å; P31-H39 VanDerWaalsContact O-CD2 3.3Å
32	W	54.2	Low	55.9	Low	120 Å²	120	87 Å²	87	46%	0.455	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114	173.4	-175.3	-93.7	0	0	0	108.5	E4 V6 R8 L30	E4-W32 HydrophobicContact CB-CB 4.35Å; E4-W32 WeakPolarHBondContact O-CA 3.5Å; E4-W32 PolarHBondContact O-N 3.3Å; V6-W32 HydrophobicContact CB-CB 4.18Å; V6-W32 HydrophobicContact CG2-CB 3.49Å; V6-W32 VanDerWaalsContact CG2-CB 3.49Å; V6-W32 HydrophobicContact CG2-CD2 4.28Å; V6-W32 HydrophobicContact CG2-CE3 4.45Å; V6-W32 HydrophobicContact CG2-CG 3.86Å; R8-W32 VanDerWaalsContact NH2-CE3 3.31Å; L30-W32 PolarHBondContact O-N 3.44Å
33	G	55.7	Low	55	Low	29 Å²	29	80.5 Å²	80.5	30%	0.299	46%	0.458	S	S	.	.			trans	-131.6	153.8	166.8	0	0	0	0	0	108.8	N35	G33-N35 PolarHBondContact O-N 3.35Å
34	N	57.7	Low	54.1	Low	159 Å²	159	82 Å²	82	85%	0.85	46%	0.458	S	S	*	.	S	Bend	trans	-61.5	-11.6	173.8	-68.8	-16.5	0	0	0	112.9	S36	N34-S36 PolarHBondContact O-N 3.16Å
35	N	52.5	Low	53.2	Low	126 Å²	126	84.4 Å²	84.4	67%	0.674	46%	0.464	S	S	*	.	S	Bend	trans	-88.7	91.2	174	-74.8	7.4	0	0	0	110.3	G33	G33-N35 PolarHBondContact O-N 3.35Å
36	S	45.1	Very low	52.3	Low	88 Å²	88	87.1 Å²	87.1	62%	0.615	47%	0.474	S	S	*	.			trans	7.8	116	154.1	59.5	0	0	0	0	118.3	N34 T38	N34-S36 PolarHBondContact O-N 3.16Å; S36-T38 PolarHBondContact O-N 1.98Å; S36-T38 PolarHBondContact O-OG1 2.98Å
37	V	46.9	Very low	51.4	Low	128 Å²	128	85.4 Å²	85.4	78%	0.776	47%	0.468	S	S	*	.	S	Bend	trans	57	-8.2	141.3	-168	0	0	0	0	119.4	H39	V37-H39 PolarHBondContact O-N 2.83Å
38	T	45.5	Very low	50.2	Low	91 Å²	91	84.5 Å²	84.5	56%	0.558	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.2	-176.1	43.1	0	0	0	0	114.3	S36 L40 R41	S36-T38 PolarHBondContact O-N 1.98Å; S36-T38 PolarHBondContact O-OG1 2.98Å; T38-L40 PolarHBondContact O-N 3.08Å; T38-R41 PolarHBondContact O-N 3.33Å
39	H	42.7	Very low	49.2	Very low	26 Å²	26	90.2 Å²	90.2	12%	0.12	49%	0.487	C	S	.	.	H	α-helix	trans	-74.6	-15.5	-172.9	-69.4	-54.6	0	0	0	116.1	P31 V37 R41 A43	P31-H39 HydrophobicContact CG-CB 3.91Å; P31-H39 PolarHBondContact O-CD2 3.35Å; P31-H39 VanDerWaalsContact O-CD2 3.3Å; V37-H39 PolarHBondContact O-N 2.83Å; H39-R41 VanDerWaalsContact C-N 3.29Å; H39-R41 PolarHBondContact O-N 3.29Å; H39-A43 PolarHBondContact O-N 3.33Å
40	L	46.4	Very low	48.5	Very low	98 Å²	98	91.3 Å²	91.3	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-65.5	-36.5	174	-79.2	169.1	0	0	0	111.4	L30 T38 Q44	L30-L40 HydrophobicContact CD1-CD2 3.52Å; L30-L40 HydrophobicContact CD1-CG 4.41Å; L30-L40 HydrophobicContact CD2-CD2 4.21Å; T38-L40 PolarHBondContact O-N 3.08Å; L40-Q44 PolarHBondContact O-N 3.46Å
41	R	44	Very low	47.9	Very low	185 Å²	185	94.5 Å²	94.5	70%	0.698	51%	0.51	S	S	*	.	H	α-helix	trans	-69.3	-40.7	-179.8	-163.1	168.9	175.3	140.6	-0.4	112	T38 H39 Q44 E45	T38-R41 PolarHBondContact O-N 3.33Å; H39-R41 VanDerWaalsContact C-N 3.29Å; H39-R41 PolarHBondContact O-N 3.29Å; R41-Q44 PolarHBondContact O-N 2.82Å; R41-E45 IonicContact NE-OE1 2.67Å; R41-E45 PolarHBondContact O-N 3.3Å; R41-E45 VanDerWaalsContact O-N 3.08Å
42	L	44.2	Very low	47.4	Very low	77 Å²	77	99.8 Å²	99.8	40%	0.403	54%	0.538	S	S	.	.	H	α-helix	trans	-67.1	-37.1	177.8	-77.9	164.4	0	0	0	113.3	Q44 E45 M46	L42-Q44 VanDerWaalsContact C-N 3.28Å; L42-Q44 PolarHBondContact O-N 3.21Å; L42-E45 PolarHBondContact O-N 3.48Å; L42-M46 PolarHBondContact O-N 2.91Å; L42-M46 VanDerWaalsContact O-N 3.14Å
43	A	43.6	Very low	47.2	Very low	40 Å²	40	98.1 Å²	98.1	33%	0.331	55%	0.549	S	S	.	.	H	α-helix	trans	-65.1	-35	176	0	0	0	0	0	111.8	L30 H39 A47	L30-A43 HydrophobicContact CD2-CB 3.7Å; H39-A43 PolarHBondContact O-N 3.33Å; A43-A47 PolarHBondContact O-N 3.28Å
44	Q	47	Very low	46.6	Very low	101 Å²	101	103.5 Å²	103.5	47%	0.472	57%	0.571	S	S	.	*	H	α-helix	trans	-68.8	-41.3	175	-168.8	170.6	0.1	0	0	111.9	L40 R41 L42 A47 C48	L40-Q44 PolarHBondContact O-N 3.46Å; R41-Q44 PolarHBondContact O-N 2.82Å; L42-Q44 VanDerWaalsContact C-N 3.28Å; L42-Q44 PolarHBondContact O-N 3.21Å; Q44-A47 PolarHBondContact O-N 2.89Å; Q44-C48 PolarHBondContact O-N 3.12Å
45	E	45.9	Very low	46.1	Very low	107 Å²	107	100.4 Å²	100.4	50%	0.5	56%	0.558	S	S	.	*	H	α-helix	trans	-64	-42.8	178.7	-74.3	171.3	-173	0	0	112.7	R41 L42 A47 C48 E49	R41-E45 IonicContact NE-OE1 2.67Å; R41-E45 PolarHBondContact O-N 3.3Å; R41-E45 VanDerWaalsContact O-N 3.08Å; L42-E45 PolarHBondContact O-N 3.48Å; E45-A47 VanDerWaalsContact C-N 3.34Å; E45-A47 PolarHBondContact O-N 2.89Å; E45-C48 PolarHBondContact O-N 2.85Å; E45-E49 PolarHBondContact O-N 3.19Å
46	M	46.2	Very low	45.3	Very low	125 Å²	125	97.4 Å²	97.4	62%	0.616	56%	0.556	S	S	*	*	H	α-helix	trans	-68.7	-29.8	176.5	-69.3	-170.8	-154.3	0	0	113.5	L42 N50	L42-M46 PolarHBondContact O-N 2.91Å; L42-M46 VanDerWaalsContact O-N 3.14Å; M46-N50 PolarHBondContact O-N 3.35Å
47	A	45.9	Very low	45.3	Very low	56 Å²	56	100 Å²	100	46%	0.463	56%	0.563	S	S	.	*	H	α-helix	trans	-69.3	-37.2	177.2	0	0	0	0	0	111.6	A43 Q44 E45 N50 T51	A43-A47 PolarHBondContact O-N 3.28Å; Q44-A47 PolarHBondContact O-N 2.89Å; E45-A47 VanDerWaalsContact C-N 3.34Å; E45-A47 PolarHBondContact O-N 2.89Å; A47-N50 PolarHBondContact O-N 2.95Å; A47-T51 PolarHBondContact O-N 3.24Å; A47-T51 PolarHBondContact O-OG1 3.16Å
48	C	45	Very low	45.1	Very low	70 Å²	70	100.2 Å²	100.2	47%	0.473	57%	0.565	S	S	.	*	H	α-helix	trans	-64.2	-39.7	175	-70.7	0	0	0	0	112.3	Q44 E45 N50 T51 D52	Q44-C48 PolarHBondContact O-N 3.12Å; E45-C48 PolarHBondContact O-N 2.85Å; C48-N50 VanDerWaalsContact C-N 3.28Å; C48-N50 PolarHBondContact O-N 3.39Å; C48-T51 WeakPolarHBondContact CA-OG1 3.39Å; C48-T51 PolarHBondContact O-N 2.76Å; C48-T51 VanDerWaalsContact O-N 3.16Å; C48-T51 PolarHBondContact O-OG1 2.83Å; C48-D52 PolarHBondContact O-N 3.16Å
49	E	46.8	Very low	44.9	Very low	149 Å²	149	100.2 Å²	100.2	70%	0.696	57%	0.574	S	S	*	*	H	α-helix	trans	-65.5	-32	-179.7	-155.4	173.5	-164.1	0	0	112.1	E45	E45-E49 PolarHBondContact O-N 3.19Å
50	N	46	Very low	44.6	Very low	111 Å²	111	107.7 Å²	107.7	59%	0.594	61%	0.606	S	S	*	*	H	α-helix	trans	-76.8	-25.5	175.2	-74.8	-30.6	0	0	0	113.7	M46 A47 C48	M46-N50 PolarHBondContact O-N 3.35Å; A47-N50 PolarHBondContact O-N 2.95Å; C48-N50 VanDerWaalsContact C-N 3.28Å; C48-N50 PolarHBondContact O-N 3.39Å
51	T	48.5	Very low	43.8	Very low	82 Å²	82	109.3 Å²	109.3	50%	0.503	62%	0.62	S	S	.	*	H	α-helix	trans	-77.8	-30	176.5	48.2	0	0	0	0	113	A47 C48 A53 L54 T55	A47-T51 PolarHBondContact O-N 3.24Å; A47-T51 PolarHBondContact O-OG1 3.16Å; C48-T51 WeakPolarHBondContact CA-OG1 3.39Å; C48-T51 PolarHBondContact O-N 2.76Å; C48-T51 VanDerWaalsContact O-N 3.16Å; C48-T51 PolarHBondContact O-OG1 2.83Å; T51-A53 PolarHBondContact O-N 3.45Å; T51-L54 PolarHBondContact O-N 3.21Å; T51-T55 PolarHBondContact O-N 3.34Å; T51-T55 VanDerWaalsContact O-N 3.12Å; T51-T55 PolarHBondContact O-OG1 3.28Å
52	D	45.8	Very low	43.3	Very low	128 Å²	128	109 Å²	109	68%	0.684	63%	0.629	S	S	*	*	H	α-helix	trans	-65.7	-27.1	173.8	-83	-18.7	0	0	0	112.4	C48 L54 T55	C48-D52 PolarHBondContact O-N 3.16Å; D52-L54 VanDerWaalsContact C-N 3.3Å; D52-T55 PolarHBondContact O-OG1 2.87Å
53	A	49.3	Very low	42.7	Very low	84 Å²	84	111.1 Å²	111.1	69%	0.694	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-18.8	172.2	0	0	0	0	0	113.4	T51	T51-A53 PolarHBondContact O-N 3.45Å
54	L	44.7	Very low	42.2	Very low	143 Å²	143	116.7 Å²	116.7	75%	0.749	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-9.7	-175.9	-97.7	130.5	0	0	0	114.2	T51 D52 G56	T51-L54 PolarHBondContact O-N 3.21Å; D52-L54 VanDerWaalsContact C-N 3.3Å; L54-G56 PolarHBondContact O-N 3.49Å
55	T	46.9	Very low	41.6	Very low	94 Å²	94	120 Å²	120	58%	0.577	69%	0.688	S	S	*	*			trans	-76.2	5.8	172.6	29.4	0	0	0	0	113.9	T51 D52 D57	T51-T55 PolarHBondContact O-N 3.34Å; T51-T55 VanDerWaalsContact O-N 3.12Å; T51-T55 PolarHBondContact O-OG1 3.28Å; D52-T55 PolarHBondContact O-OG1 2.87Å; T55-D57 VanDerWaalsContact C-N 3.32Å; T55-D57 PolarHBondContact O-N 3.39Å
56	G	35.5	Very low	40.7	Very low	62 Å²	62	123.3 Å²	123.3	64%	0.639	70%	0.703	S	S	*	*	S	Bend	trans	-61.4	89.5	161.9	0	0	0	0	0	112.1	L54	L54-G56 PolarHBondContact O-N 3.49Å
57	D	45.1	Very low	40.2	Very low	143 Å²	143	126.4 Å²	126.4	77%	0.765	71%	0.714	S	S	*	*	S	Bend	trans	87.8	21	146.3	-120.3	2	0	0	0	120.8	T55	T55-D57 VanDerWaalsContact C-N 3.32Å; T55-D57 PolarHBondContact O-N 3.39Å
58	T	42.2	Very low	39.4	Very low	132 Å²	132	130 Å²	130	81%	0.81	73%	0.725	S	S	*	*			trans	-127.2	6.2	168.6	49	0	0	0	0	116.9	K60	T58-K60 VanDerWaalsContact C-N 3.33Å; T58-K60 PolarHBondContact O-N 3.35Å
59	A	40.8	Very low	38.7	Very low	92 Å²	92	134.2 Å²	134.2	76%	0.76	74%	0.738	S	S	*	*			trans	-90.3	20.4	175.2	0	0	0	0	0	114.7	T61	A59-T61 PolarHBondContact O-N 3.43Å; A59-T61 VanDerWaalsContact O-N 3.17Å
60	K	36.6	Very low	38.1	Very low	182 Å²	182	133.6 Å²	133.6	79%	0.791	74%	0.744	S	S	*	*			trans	-78.6	94.3	161.2	-79.5	178.6	-178.2	163.6	0	107.6	T58	T58-K60 VanDerWaalsContact C-N 3.33Å; T58-K60 PolarHBondContact O-N 3.35Å
61	T	30.1	Very low	37.5	Very low	132 Å²	132	133 Å²	133	81%	0.81	75%	0.749	S	S	*	*			trans	146.2	86.2	146.3	-52.8	0	0	0	0	108.8	A59	A59-T61 PolarHBondContact O-N 3.43Å; A59-T61 VanDerWaalsContact O-N 3.17Å
62	M	33.3	Very low	36.7	Very low	178 Å²	178	136.7 Å²	136.7	88%	0.877	77%	0.765	S	S	*	*				-153.4	144.7	129	-77.8	-142.7	-177.1	0	0	108.9
63	P	30.9	Very low	36.3	Very low	122 Å²	122	134.6 Å²	134.6	79%	0.792	77%	0.766	S	S	*	*			trans	-84.4	137.2	-160.1	-2.1	21.7	0	0	0	112	M65	P63-M65 PolarHBondContact O-N 3.26Å
64	I	34.4	Very low	35.5	Very low	157 Å²	157	137.3 Å²	137.3	81%	0.805	77%	0.769	S	S	*	*			trans	-66.5	115	173.8	-61.1	161.5	0	0	0	107.9
65	M	33.8	Very low	35.1	Very low	172 Å²	172	138.1 Å²	138.1	85%	0.847	77%	0.774	S	S	*	*			trans	-81.3	113.7	160.8	-95	-175.4	-107.9	0	0	107.8	P63 F67	P63-M65 PolarHBondContact O-N 3.26Å; M65-F67 PolarHBondContact O-N 3.49Å
66	E	26.7	Very low	34.6	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.6	116.1	172.8	-69.7	176.7	154.1	0	0	109.8
67	F	35.4	Very low	34.6	Very low	191 Å²	191	140 Å²	140	84%	0.838	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-101.5	116.9	157.1	-92.3	-85.9	0	0	0	108.7	M65	M65-F67 PolarHBondContact O-N 3.49Å
68	N	28.8	Very low	34.3	Very low	131 Å²	131	142.1 Å²	142.1	70%	0.701	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-62.6	133.8	176.2	-95.8	-9.8	0	0	0	112.4
69	E	32.1	Very low	33.7	Very low	159 Å²	159	140.2 Å²	140.2	74%	0.743	78%	0.783	S	S	*	*			trans	53	114.6	132.8	-56.4	-177.5	161.2	0	0	119.3
70	T	32.5	Very low	33.8	Very low	136 Å²	136	142 Å²	142	83%	0.834	78%	0.784	S	S	*	*				-175.7	137.1	93	24.7	0	0	0	0	111.3
71	S	34	Very low	33.5	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	78%	0.784	S	S	*	*			trans	-54.6	138.2	165.1	43.2	0	0	0	0	112.5
72	D	31.4	Very low	33.8	Very low	158 Å²	158	143 Å²	143	85%	0.845	78%	0.783	S	S	*	*				-161.4	107.2	120.7	-90.5	-23.9	0	0	0	109.7
73	A	36.9	Very low	33.9	Very low	85 Å²	85	139.1 Å²	139.1	70%	0.702	77%	0.773	S	S	*	*			trans	-70.5	122.8	154.5	0	0	0	0	0	107.3
74	D	33.4	Very low	34.1	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	77%	0.771	S	S	*	*				175.9	113.7	128.9	-91.6	-31.1	0	0	0	111.4	A76	D74-A76 PolarHBondContact O-N 3.49Å
75	N	35.9	Very low	34.3	Very low	160 Å²	160	138.5 Å²	138.5	86%	0.856	77%	0.766	S	S	*	*			trans	25.8	88.1	139	-62.6	-52.7	0	0	0	117.4
76	A	36	Very low	34.2	Very low	80 Å²	80	137.1 Å²	137.1	66%	0.661	76%	0.758	S	S	*	*			trans	-144.1	104.4	148.5	0	0	0	0	0	107.7	D74 E78	D74-A76 PolarHBondContact O-N 3.49Å; A76-E78 PolarHBondContact O-N 3Å
77	S	36.7	Very low	34.8	Very low	116 Å²	116	132 Å²	132	81%	0.811	75%	0.745	S	S	*	*			trans	-3.1	96.4	151.5	43.1	0	0	0	0	112.9	S79	S77-S79 PolarHBondContact O-N 3.17Å
78	E	37.7	Very low	35.1	Very low	187 Å²	187	129.2 Å²	129.2	87%	0.874	74%	0.739	S	S	*	*			trans	-65.2	85.3	171.8	-80.4	-174.3	152.8	0	0	107.2	A76 V80	A76-E78 PolarHBondContact O-N 3Å; E78-V80 VanDerWaalsContact C-N 3.35Å; E78-V80 PolarHBondContact O-N 3.01Å
79	S	30.8	Very low	35.6	Very low	91 Å²	91	130 Å²	130	64%	0.636	74%	0.743	S	S	*	*			trans	-54.3	111.8	153.7	55.3	0	0	0	0	104.5	S77 Q81	S77-S79 PolarHBondContact O-N 3.17Å; S79-Q81 PolarHBondContact O-N 3.3Å
80	V	42.3	Very low	36.3	Very low	129 Å²	129	127.1 Å²	127.1	78%	0.782	73%	0.729	S	S	*	*			trans	-57	91	165.3	178.5	0	0	0	0	104.5	E78 Q82	E78-V80 VanDerWaalsContact C-N 3.35Å; E78-V80 PolarHBondContact O-N 3.01Å; V80-Q82 HydrophobicContact CG1-CG 4.29Å; V80-Q82 PolarHBondContact O-N 3.32Å
81	Q	30.7	Very low	37.1	Very low	169 Å²	169	124.2 Å²	124.2	79%	0.79	71%	0.708	S	S	*	*			trans	-61.7	94.8	161	-78.2	-175.4	-7.4	0	0	102.9	S79 S83	S79-Q81 PolarHBondContact O-N 3.3Å; Q81-S83 PolarHBondContact O-N 2.69Å
82	Q	36.4	Very low	37.9	Very low	166 Å²	166	122.7 Å²	122.7	78%	0.776	69%	0.692	S	S	*	*			trans	-57.1	90.3	151.8	-71.4	-176.4	-18.9	0	0	103.2	V80 V84	V80-Q82 HydrophobicContact CG1-CG 4.29Å; V80-Q82 PolarHBondContact O-N 3.32Å; Q82-V84 PolarHBondContact O-N 3.04Å
83	S	36.2	Very low	39.1	Very low	98 Å²	98	117.7 Å²	117.7	69%	0.685	67%	0.665	S	S	*	*			trans	-53.6	97.5	160.1	173.4	0	0	0	0	103.1	Q81 M85	Q81-S83 PolarHBondContact O-N 2.69Å; S83-M85 PolarHBondContact O-N 3.25Å
84	V	35	Very low	40.3	Very low	123 Å²	123	122.7 Å²	122.7	75%	0.745	67%	0.674	S	S	*	*			trans	-62.9	84.4	156.7	-175.8	0	0	0	0	101.6	Q82 E86	Q82-V84 PolarHBondContact O-N 3.04Å; V84-E86 PolarHBondContact O-N 2.89Å
85	M	36.8	Very low	41.4	Very low	142 Å²	142	125.2 Å²	125.2	70%	0.7	67%	0.674	S	S	*	*			trans	-64.1	95.1	167.6	-156.3	172.9	95.8	0	0	101.1	S83 A87	S83-M85 PolarHBondContact O-N 3.25Å; M85-A87 PolarHBondContact O-N 2.73Å
86	E	31.9	Very low	42.2	Very low	143 Å²	143	119.9 Å²	119.9	67%	0.668	66%	0.657	S	S	*	*			trans	-41.4	123.4	163.7	-72	-179.2	154.1	0	0	103.8	V84 D88	V84-E86 PolarHBondContact O-N 2.89Å; E86-D88 PolarHBondContact O-N 2.95Å
87	A	40.9	Very low	43	Very low	68 Å²	68	119.3 Å²	119.3	56%	0.562	65%	0.647	S	S	*	*			trans	-68.3	65.1	177.2	0	0	0	0	0	106.6	M85 D89 F90	M85-A87 PolarHBondContact O-N 2.73Å; A87-D89 PolarHBondContact O-N 3.37Å; A87-F90 HydrophobicContact CB-CD2 3.9Å; A87-F90 HydrophobicContact CB-CE2 3.86Å
88	D	41.4	Very low	43.6	Very low	133 Å²	133	121.6 Å²	121.6	71%	0.711	64%	0.639	S	S	*	*			trans	-56.5	94.7	171.7	-90.6	-15.9	0	0	0	104.1	E86 F90	E86-D88 PolarHBondContact O-N 2.95Å; D88-F90 VanDerWaalsContact C-N 3.3Å; D88-F90 PolarHBondContact O-N 3.22Å
89	D	38.3	Very low	44.1	Very low	146 Å²	146	118.2 Å²	118.2	78%	0.781	62%	0.622	S	S	*	*			trans	28.9	70.5	170.1	-63.9	-38.1	0	0	0	110.5	A87 N91	A87-D89 PolarHBondContact O-N 3.37Å; D89-N91 PolarHBondContact O-N 3.39Å
90	F	47.3	Very low	45	Very low	100 Å²	100	123.4 Å²	123.4	44%	0.439	63%	0.627	S	S	.	*			trans	-41.9	122.6	158.8	-84.4	-68.7	0	0	0	104.1	A87 D88 L92 Y98	A87-F90 HydrophobicContact CB-CD2 3.9Å; A87-F90 HydrophobicContact CB-CE2 3.86Å; D88-F90 VanDerWaalsContact C-N 3.3Å; D88-F90 PolarHBondContact O-N 3.22Å; F90-L92 HydrophobicContact CB-CD1 3.71Å; F90-L92 HydrophobicContact CB-CD2 4.3Å; F90-L92 HydrophobicContact CB-CG 3.72Å; F90-L92 WeakPolarHBondContact O-CB 3.46Å; F90-L92 WeakPolarHBondContact O-CG 3.35Å; F90-L92 PolarHBondContact O-N 2.71Å; F90-Y98 HydrophobicContact CB-CE1 4.23Å; F90-Y98 AromaticContact CD1-CE1 3.57Å; F90-Y98 HydrophobicContact CD1-CE1 3.57Å; F90-Y98 HydrophobicContact CE1-CE1 4.19Å; F90-Y98 HydrophobicContact CG-CE1 4.13Å
91	N	49.7	Very low	45.1	Very low	75 Å²	75	125.9 Å²	125.9	40%	0.401	62%	0.622	S	S	.	*	S	Bend	trans	-70.4	64.8	-163.1	-150	17.7	0	0	0	108.1	D89 K99	D89-N91 PolarHBondContact O-N 3.39Å; N91-K99 WeakPolarHBondContact O-CA 3.46Å; N91-K99 VanDerWaalsContact O-CB 3.22Å; N91-K99 WeakPolarHBondContact O-CB 3.2Å; N91-K99 WeakPolarHBondContact O-CG 3.45Å; N91-K99 PolarHBondContact O-N 2.83Å
92	L	50.6	Low	45.9	Very low	66 Å²	66	127.3 Å²	127.3	35%	0.346	63%	0.626	S	S	.	*	B	Isolated β-bridge	trans	-93.2	144.4	-167.9	-63.6	164	0	0	0	106.2	F90 G96 C97 Y98 K99	F90-L92 HydrophobicContact CB-CD1 3.71Å; F90-L92 HydrophobicContact CB-CD2 4.3Å; F90-L92 HydrophobicContact CB-CG 3.72Å; F90-L92 WeakPolarHBondContact O-CB 3.46Å; F90-L92 WeakPolarHBondContact O-CG 3.35Å; F90-L92 PolarHBondContact O-N 2.71Å; L92-G96 WeakPolarHBondContact CD2-O 3.5Å; L92-C97 CarbonylContact C-O 3.43Å; L92-C97 WeakPolarHBondContact CA-O 3.36Å; L92-Y98 HydrophobicContact CD2-CD1 3.95Å; L92-Y98 HydrophobicContact CD2-CD2 4.26Å; L92-Y98 HydrophobicContact CD2-CE1 4.18Å; L92-Y98 HydrophobicContact CD2-CE2 4.46Å; L92-Y98 HydrophobicContact CD2-CG 4Å; L92-K99 WeakPolarHBondContact O-CE 3.41Å
93	D	55.8	Low	46.4	Very low	53 Å²	53	124.3 Å²	124.3	28%	0.283	63%	0.63	S	S	.	*			trans	-73.7	178.4	166.1	65	17.2	0	0	0	110.8	Y95 G96 C97 K99	D93-Y95 PolarHBondContact O-N 3.48Å; D93-Y95 WeakPolarHBondContact OD1-CA 3.44Å; D93-Y95 WeakPolarHBondContact OD1-CB 3.25Å; D93-Y95 PolarHBondContact OD1-N 3.23Å; D93-G96 PolarHBondContact O-N 3.07Å; D93-G96 PolarHBondContact OD1-N 3.02Å; D93-C97 PolarHBondContact N-O 3.02Å; D93-C97 WeakPolarHBondContact OD1-CA 3.48Å; D93-C97 WeakPolarHBondContact OD1-CB 3.28Å; D93-C97 PolarHBondContact OD1-N 2.91Å; D93-C97 WeakPolarHBondContact OD2-CB 3.13Å; D93-K99 HydrophobicContact CB-CG 4.07Å
94	E	63.3	Low	47.1	Very low	190 Å²	190	123.7 Å²	123.7	89%	0.888	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-15.2	179.3	-167.7	174.3	176.8	0	0	113
95	Y	55.3	Low	48	Very low	195 Å²	195	122.7 Å²	122.7	77%	0.765	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	0.7	177.8	-57.2	-73.1	0	0	0	113.3	D93 C97	D93-Y95 PolarHBondContact O-N 3.48Å; D93-Y95 WeakPolarHBondContact OD1-CA 3.44Å; D93-Y95 WeakPolarHBondContact OD1-CB 3.25Å; D93-Y95 PolarHBondContact OD1-N 3.23Å; Y95-C97 VanDerWaalsContact C-N 3.34Å
96	G	52.6	Low	48.8	Very low	47 Å²	47	121.2 Å²	121.2	49%	0.485	61%	0.611	S	S	.	*	S	Bend	trans	75.6	22.9	-175	0	0	0	0	0	113.2	L92 D93	L92-G96 WeakPolarHBondContact CD2-O 3.5Å; D93-G96 PolarHBondContact O-N 3.07Å; D93-G96 PolarHBondContact OD1-N 3.02Å
97	C	53.6	Low	50	Low	69 Å²	69	117 Å²	117	47%	0.466	60%	0.601	S	S	.	*			trans	-98.4	138.9	174.1	-61.4	0	0	0	0	110.3	L92 D93 Y95 K99	L92-C97 CarbonylContact C-O 3.43Å; L92-C97 WeakPolarHBondContact CA-O 3.36Å; D93-C97 PolarHBondContact N-O 3.02Å; D93-C97 WeakPolarHBondContact OD1-CA 3.48Å; D93-C97 WeakPolarHBondContact OD1-CB 3.28Å; D93-C97 PolarHBondContact OD1-N 2.91Å; D93-C97 WeakPolarHBondContact OD2-CB 3.13Å; Y95-C97 VanDerWaalsContact C-N 3.34Å; C97-K99 PolarHBondContact O-N 3.3Å
98	Y	50.2	Low	50.9	Low	163 Å²	163	115.9 Å²	115.9	64%	0.639	59%	0.592	S	S	*	*	B	Isolated β-bridge	trans	-59	115	176.6	-68.4	-83.9	0	0	0	110.7	F90 L92 R100	F90-Y98 HydrophobicContact CB-CE1 4.23Å; F90-Y98 AromaticContact CD1-CE1 3.57Å; F90-Y98 HydrophobicContact CD1-CE1 3.57Å; F90-Y98 HydrophobicContact CE1-CE1 4.19Å; F90-Y98 HydrophobicContact CG-CE1 4.13Å; L92-Y98 HydrophobicContact CD2-CD1 3.95Å; L92-Y98 HydrophobicContact CD2-CD2 4.26Å; L92-Y98 HydrophobicContact CD2-CE1 4.18Å; L92-Y98 HydrophobicContact CD2-CE2 4.46Å; L92-Y98 HydrophobicContact CD2-CG 4Å; Y98-R100 PolarHBondContact O-N 3.33Å
99	K	46.1	Very low	51.9	Low	117 Å²	117	113.6 Å²	113.6	51%	0.509	58%	0.578	S	S	.	*			trans	-58.1	125.3	167.1	-67.9	179.5	-177.2	169.6	0	107.4	N91 L92 D93 C97 R101	N91-K99 WeakPolarHBondContact O-CA 3.46Å; N91-K99 VanDerWaalsContact O-CB 3.22Å; N91-K99 WeakPolarHBondContact O-CB 3.2Å; N91-K99 WeakPolarHBondContact O-CG 3.45Å; N91-K99 PolarHBondContact O-N 2.83Å; L92-K99 WeakPolarHBondContact O-CE 3.41Å; D93-K99 HydrophobicContact CB-CG 4.07Å; C97-K99 PolarHBondContact O-N 3.3Å; K99-R101 PolarHBondContact O-N 2.9Å
100	R	49.7	Very low	53.1	Low	199 Å²	199	109 Å²	109	75%	0.751	56%	0.557	S	S	*	*			trans	-49.8	98.4	177.8	-70.9	-177.6	177.4	179	-1.6	109.9	D17 Y98	D17-R100 IonicContact OD1-CZ 3.97Å; D17-R100 IonicContact OD1-NH2 3.91Å; D17-R100 PolarHBondContact OD1-NH2 2.8Å; D17-R100 IonicContact OD2-CZ 3.8Å; D17-R100 IonicContact OD2-NH2 2.65Å; D17-R100 PolarHBondContact OD2-NH2 3.5Å; Y98-R100 PolarHBondContact O-N 3.33Å
101	R	45.9	Very low	53.7	Low	181 Å²	181	110 Å²	110	68%	0.683	56%	0.564	S	S	*	*			trans	-64.4	139.6	157.2	-75.2	-172.4	174.4	177.1	2	105.9	K99 A103	K99-R101 PolarHBondContact O-N 2.9Å; R101-A103 PolarHBondContact O-N 2.95Å
102	K	47.3	Very low	54.1	Low	199 Å²	199	115.1 Å²	115.1	87%	0.865	58%	0.577	S	S	*	*	S	Bend	trans	-26.5	128.1	180	-83.7	178.4	173.1	177.3	0	111.4	V104	K102-V104 PolarHBondContact O-N 3.32Å
103	A	46.6	Very low	54.7	Low	103 Å²	103	115.5 Å²	115.5	85%	0.851	58%	0.582	S	S	*	*			trans	-19	97.3	176.6	0	0	0	0	0	111.1	R101 D105	R101-A103 PolarHBondContact O-N 2.95Å; A103-D105 PolarHBondContact O-N 2.96Å; A103-D105 VanDerWaalsContact O-N 3.08Å
104	V	49.8	Very low	54.9	Low	86 Å²	86	119.7 Å²	119.7	52%	0.521	60%	0.598	S	S	.	*			trans	-66.7	114.3	176.9	175.6	0	0	0	0	104.6	K102 V106 I109	K102-V104 PolarHBondContact O-N 3.32Å; V104-V106 VanDerWaalsContact C-N 3.32Å; V104-V106 PolarHBondContact O-N 3.2Å; V104-I109 HydrophobicContact CG1-CD1 3.12Å; V104-I109 HydrophobicContact CG1-CG1 3.88Å
105	D	55.2	Low	54.7	Low	101 Å²	101	114.3 Å²	114.3	54%	0.54	58%	0.575	S	S	.	*			trans	-63.7	98.6	178.7	-173.8	-9.8	0	0	0	108.2	A103 A107 A108 I109	A103-D105 PolarHBondContact O-N 2.96Å; A103-D105 VanDerWaalsContact O-N 3.08Å; D105-A107 PolarHBondContact O-N 3.41Å; D105-A107 VanDerWaalsContact OD1-CB 3.28Å; D105-A107 WeakPolarHBondContact OD1-CB 3.46Å; D105-A107 PolarHBondContact OD1-N 3.08Å; D105-A108 HydrophobicContact CB-CB 3.9Å; D105-A108 WeakPolarHBondContact O-CB 3.41Å; D105-A108 PolarHBondContact O-N 3.37Å; D105-A108 PolarHBondContact OD1-N 2.87Å; D105-I109 PolarHBondContact O-N 2.67Å
106	V	54.3	Low	54.6	Low	111 Å²	111	113.1 Å²	113.1	67%	0.673	57%	0.57	S	S	*	*	H	α-helix	trans	-59.9	-29.8	-178.6	180	0	0	0	0	110	V104 I109 S110	V104-V106 VanDerWaalsContact C-N 3.32Å; V104-V106 PolarHBondContact O-N 3.2Å; V106-I109 PolarHBondContact O-N 2.85Å; V106-S110 WeakPolarHBondContact O-CB 3.43Å; V106-S110 PolarHBondContact O-N 2.87Å; V106-S110 PolarHBondContact O-OG 3.09Å
107	A	56.1	Low	54.9	Low	56 Å²	56	116.1 Å²	116.1	46%	0.463	57%	0.573	S	S	.	*	H	α-helix	trans	-68.1	-41.1	175	0	0	0	0	0	111.1	D105 I109 S110 Q111	D105-A107 PolarHBondContact O-N 3.41Å; D105-A107 VanDerWaalsContact OD1-CB 3.28Å; D105-A107 WeakPolarHBondContact OD1-CB 3.46Å; D105-A107 PolarHBondContact OD1-N 3.08Å; A107-I109 PolarHBondContact O-N 2.68Å; A107-S110 PolarHBondContact O-N 2.72Å; A107-S110 PolarHBondContact O-OG 2.99Å; A107-Q111 WeakPolarHBondContact O-CB 3.41Å; A107-Q111 PolarHBondContact O-N 2.73Å
108	A	60.5	Low	54.8	Low	44 Å²	44	123.2 Å²	123.2	36%	0.364	59%	0.59	S	S	.	*	H	α-helix	trans	-66.4	-37.1	176.2	0	0	0	0	0	112.7	D105 R112	D105-A108 HydrophobicContact CB-CB 3.9Å; D105-A108 WeakPolarHBondContact O-CB 3.41Å; D105-A108 PolarHBondContact O-N 3.37Å; D105-A108 PolarHBondContact OD1-N 2.87Å; A108-R112 WeakPolarHBondContact O-CG 3.37Å; A108-R112 PolarHBondContact O-N 3.05Å
109	I	62.3	Low	54.9	Low	85 Å²	85	117.1 Å²	117.1	44%	0.436	57%	0.571	S	S	.	*	H	α-helix	trans	-70.1	-46.5	175.9	-67.2	-166.7	0	0	0	111.2	V104 D105 V106 A107 Q111 R112 V113	V104-I109 HydrophobicContact CG1-CD1 3.12Å; V104-I109 HydrophobicContact CG1-CG1 3.88Å; D105-I109 PolarHBondContact O-N 2.67Å; V106-I109 PolarHBondContact O-N 2.85Å; A107-I109 PolarHBondContact O-N 2.68Å; I109-Q111 VanDerWaalsContact C-N 3.25Å; I109-Q111 PolarHBondContact O-N 3.02Å; I109-R112 PolarHBondContact O-N 2.75Å; I109-R112 VanDerWaalsContact O-N 3.16Å; I109-V113 HydrophobicContact CG2-CG2 4.26Å; I109-V113 WeakPolarHBondContact O-CG2 3.27Å; I109-V113 PolarHBondContact O-N 2.73Å
110	S	62.2	Low	55	Low	48 Å²	48	112.6 Å²	112.6	34%	0.336	56%	0.557	S	S	.	*	H	α-helix	trans	-60.6	-41.2	-179.9	66.6	0	0	0	0	110.4	V106 A107 R112 V113 F114	V106-S110 WeakPolarHBondContact O-CB 3.43Å; V106-S110 PolarHBondContact O-N 2.87Å; V106-S110 PolarHBondContact O-OG 3.09Å; A107-S110 PolarHBondContact O-N 2.72Å; A107-S110 PolarHBondContact O-OG 2.99Å; S110-R112 PolarHBondContact O-N 2.78Å; S110-V113 PolarHBondContact O-N 2.77Å; S110-F114 WeakPolarHBondContact O-CB 3.47Å; S110-F114 WeakPolarHBondContact O-CD2 3.17Å; S110-F114 PolarHBondContact O-N 3.21Å
111	Q	60.3	Low	55.2	Low	123 Å²	123	112.9 Å²	112.9	58%	0.575	56%	0.564	S	S	*	*	H	α-helix	trans	-56.1	-50.2	173.9	-156.5	108.4	7.9	0	0	111.6	A107 I109 V113 F114 D115	A107-Q111 WeakPolarHBondContact O-CB 3.41Å; A107-Q111 PolarHBondContact O-N 2.73Å; I109-Q111 VanDerWaalsContact C-N 3.25Å; I109-Q111 PolarHBondContact O-N 3.02Å; Q111-V113 VanDerWaalsContact C-N 3.32Å; Q111-V113 PolarHBondContact O-N 3.09Å; Q111-F114 CarbonylContact O-C 3.42Å; Q111-F114 WeakPolarHBondContact O-CB 3.37Å; Q111-F114 PolarHBondContact O-N 2.65Å; Q111-F114 VanDerWaalsContact O-N 3.16Å; Q111-D115 WeakPolarHBondContact O-CB 3.48Å; Q111-D115 PolarHBondContact O-N 2.79Å
112	R	58.7	Low	54.9	Low	181 Å²	181	106.4 Å²	106.4	68%	0.683	55%	0.554	S	S	*	*	H	α-helix	trans	-61.8	-36.9	177.9	-72.9	177.5	-179.1	-170.5	-0.3	113.6	A108 I109 S110 R116	A108-R112 WeakPolarHBondContact O-CG 3.37Å; A108-R112 PolarHBondContact O-N 3.05Å; I109-R112 PolarHBondContact O-N 2.75Å; I109-R112 VanDerWaalsContact O-N 3.16Å; S110-R112 PolarHBondContact O-N 2.78Å; R112-R116 WeakPolarHBondContact O-CB 3.22Å; R112-R116 WeakPolarHBondContact O-CG 3.17Å; R112-R116 PolarHBondContact O-N 3.06Å
113	V	62	Low	54.8	Low	75 Å²	75	106.2 Å²	106.2	46%	0.455	56%	0.557	S	S	.	*	H	α-helix	trans	-68.9	-43.2	176.1	173.5	0	0	0	0	109.9	I109 S110 Q111 R116 I117	I109-V113 HydrophobicContact CG2-CG2 4.26Å; I109-V113 WeakPolarHBondContact O-CG2 3.27Å; I109-V113 PolarHBondContact O-N 2.73Å; S110-V113 PolarHBondContact O-N 2.77Å; Q111-V113 VanDerWaalsContact C-N 3.32Å; Q111-V113 PolarHBondContact O-N 3.09Å; V113-R116 PolarHBondContact O-N 2.91Å; V113-I117 HydrophobicContact CG1-CD1 3.75Å; V113-I117 HydrophobicContact CG1-CG1 4.4Å; V113-I117 WeakPolarHBondContact O-CB 3.4Å; V113-I117 VanDerWaalsContact O-CG1 3.25Å; V113-I117 WeakPolarHBondContact O-CG1 3.43Å; V113-I117 PolarHBondContact O-N 2.57Å
114	F	60.4	Low	54.7	Low	141 Å²	141	105.4 Å²	105.4	62%	0.618	54%	0.543	S	S	*	.	H	α-helix	trans	-61.8	-44	174.1	-85.5	-66.8	0	0	0	111.8	S110 Q111 I117 R118	S110-F114 WeakPolarHBondContact O-CB 3.47Å; S110-F114 WeakPolarHBondContact O-CD2 3.17Å; S110-F114 PolarHBondContact O-N 3.21Å; Q111-F114 CarbonylContact O-C 3.42Å; Q111-F114 WeakPolarHBondContact O-CB 3.37Å; Q111-F114 PolarHBondContact O-N 2.65Å; Q111-F114 VanDerWaalsContact O-N 3.16Å; F114-I117 PolarHBondContact O-N 2.76Å; F114-R118 WeakPolarHBondContact O-CB 3.35Å; F114-R118 PolarHBondContact O-N 3.05Å
115	D	59.5	Low	54.1	Low	76 Å²	76	112.6 Å²	112.6	41%	0.406	58%	0.578	S	S	.	*	H	α-helix	trans	-60.3	-47.4	176	-64.6	-24.7	0	0	0	109.8	Q111 I117 R118 C119	Q111-D115 WeakPolarHBondContact O-CB 3.48Å; Q111-D115 PolarHBondContact O-N 2.79Å; D115-I117 PolarHBondContact O-N 3Å; D115-R118 PolarHBondContact O-N 2.64Å; D115-C119 WeakPolarHBondContact O-CB 3.5Å; D115-C119 PolarHBondContact O-N 2.78Å; D115-C119 PolarHBondContact O-SG 2.83Å
116	R	54.2	Low	54.1	Low	171 Å²	171	113.2 Å²	113.2	65%	0.645	58%	0.58	S	S	*	*	H	α-helix	trans	-63.4	-36.8	175.9	-79.2	-179	174.6	-169.5	-3.2	114.4	R112 V113 G120	R112-R116 WeakPolarHBondContact O-CB 3.22Å; R112-R116 WeakPolarHBondContact O-CG 3.17Å; R112-R116 PolarHBondContact O-N 3.06Å; V113-R116 PolarHBondContact O-N 2.91Å; R116-G120 CarbonylContact O-C 3.57Å; R116-G120 WeakPolarHBondContact O-CA 3.5Å; R116-G120 PolarHBondContact O-N 2.78Å
117	I	58.1	Low	54.1	Low	110 Å²	110	113.3 Å²	113.3	56%	0.564	58%	0.575	S	S	*	*	H	α-helix	trans	-69.2	-42.4	176.2	-70.3	168.1	0	0	0	109.8	V113 F114 D115	V113-I117 HydrophobicContact CG1-CD1 3.75Å; V113-I117 HydrophobicContact CG1-CG1 4.4Å; V113-I117 WeakPolarHBondContact O-CB 3.4Å; V113-I117 VanDerWaalsContact O-CG1 3.25Å; V113-I117 WeakPolarHBondContact O-CG1 3.43Å; V113-I117 PolarHBondContact O-N 2.57Å; F114-I117 PolarHBondContact O-N 2.76Å; D115-I117 PolarHBondContact O-N 3Å
118	R	51.7	Low	54	Low	218 Å²	218	116.5 Å²	116.5	82%	0.823	58%	0.581	S	S	*	*	H	α-helix	trans	-69.7	-36.8	-177.8	-172.8	175	-178.6	153	1.2	112.5	F114 D115	F114-R118 WeakPolarHBondContact O-CB 3.35Å; F114-R118 PolarHBondContact O-N 3.05Å; D115-R118 PolarHBondContact O-N 2.64Å
119	C	52.1	Low	53.6	Low	35 Å²	35	120.8 Å²	120.8	24%	0.236	59%	0.594	C	S	.	*	H	α-helix	trans	-94.9	-2.2	-175	-52.1	0	0	0	0	112.9	D115 G122 C124	D115-C119 WeakPolarHBondContact O-CB 3.5Å; D115-C119 PolarHBondContact O-N 2.78Å; D115-C119 PolarHBondContact O-SG 2.83Å; C119-G122 WeakPolarHBondContact CB-O 3.44Å; C119-C124 HydrophobicContact CB-CB 3.71Å; C119-C124 WeakPolarHBondContact CB-SG 3.4Å; C119-C124 WeakPolarHBondContact SG-CB 3.4Å; C119-C124 CovalentContact SG-SG 1.98Å; C119-C124 PolarHBondContact SG-SG 2.98Å
120	G	49.1	Very low	53	Low	21 Å²	21	123 Å²	123	22%	0.216	60%	0.604	C	S	.	*	T	Hydrogen-bonded Turn	trans	61.2	-179.1	-160.9	0	0	0	0	0	110	R116 G122	R116-G120 CarbonylContact O-C 3.57Å; R116-G120 WeakPolarHBondContact O-CA 3.5Å; R116-G120 PolarHBondContact O-N 2.78Å; G120-G122 PolarHBondContact O-N 3.03Å; G120-G122 VanDerWaalsContact O-O 3.12Å
121	F	52.3	Low	52.4	Low	205 Å²	205	128 Å²	128	90%	0.899	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	12	173.2	-70.1	-91.5	0	0	0	113.6
122	G	39.9	Very low	51.9	Low	46 Å²	46	128.4 Å²	128.4	47%	0.474	63%	0.625	S	S	.	*	S	Bend	trans	-87.3	130.6	166.3	0	0	0	0	0	109.4	C119 G120 C124	C119-G122 WeakPolarHBondContact CB-O 3.44Å; G120-G122 PolarHBondContact O-N 3.03Å; G120-G122 VanDerWaalsContact O-O 3.12Å; G122-C124 PolarHBondContact O-N 2.96Å; G122-C124 VanDerWaalsContact O-N 3.12Å
123	E	45.3	Very low	51.3	Low	195 Å²	195	124.3 Å²	124.3	91%	0.911	62%	0.621	S	S	*	*			trans	-50.2	117.9	176.3	-61.9	177.1	153.2	0	0	109.9	L125	E123-L125 PolarHBondContact O-N 3.21Å; E123-L125 VanDerWaalsContact O-N 3.16Å
124	C	43.9	Very low	50.4	Low	85 Å²	85	128.4 Å²	128.4	57%	0.574	64%	0.635	S	S	*	*			trans	-70.9	109.5	159.1	-99.6	0	0	0	0	107.2	C119 G122	C119-C124 HydrophobicContact CB-CB 3.71Å; C119-C124 WeakPolarHBondContact CB-SG 3.4Å; C119-C124 WeakPolarHBondContact SG-CB 3.4Å; C119-C124 CovalentContact SG-SG 1.98Å; C119-C124 PolarHBondContact SG-SG 2.98Å; G122-C124 PolarHBondContact O-N 2.96Å; G122-C124 VanDerWaalsContact O-N 3.12Å
125	L	38.9	Very low	49.5	Very low	238 Å²	238	127.3 Å²	127.3	100%	1.246	64%	0.636	S	S	*	*			trans	-42.3	0	160.1	-72.2	158.4	0	0	0	111.8	E123	E123-L125 PolarHBondContact O-N 3.21Å; E123-L125 VanDerWaalsContact O-N 3.16Å

Retrieved 125 of 125 residues in 166.9 ms (Link to these results)

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