A0A077ZN59_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZN59, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 214 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	22.7	Very low	27	Very low	245 Å²	245	128.4 Å²	128.4	100%	1.207	73%	0.726	S	S	*	*				0	121.1	0	-166.7	-179.8	-109.7	0	0	106.4
2	S	19.8	Very low	27.3	Very low	105 Å²	105	128.3 Å²	128.3	73%	0.734	72%	0.715	S	S	*	*			trans	-94.5	116.8	-174	55.9	0	0	0	0	110.5
3	I	21.6	Very low	27.6	Very low	131 Å²	131	127.9 Å²	127.9	67%	0.672	72%	0.718	S	S	*	*			trans	-71.1	129.6	166.7	-57.2	169.3	0	0	0	107	E122	I3-E122 WeakPolarHBondContact CG2-OE1 3.31Å
4	R	20.3	Very low	27.7	Very low	233 Å²	233	126.7 Å²	126.7	88%	0.879	70%	0.704	S	S	*	*			trans	-105.6	119.4	172	-78	-159.1	-177	-164	3.7	109.3
5	R	25	Very low	27.9	Very low	160 Å²	160	121.4 Å²	121.4	60%	0.604	69%	0.69	S	S	*	*			trans	-68.4	135.7	173.3	-175.9	-179.8	-175.6	-179.1	3	110.2	N7 E14	R5-N7 PolarHBondContact O-N 3.01Å; R5-E14 IonicContact CZ-OE1 3.27Å; R5-E14 IonicContact NH2-OE1 2.74Å; R5-E14 PolarHBondContact NH2-OE1 2.94Å
6	A	28.6	Very low	28	Very low	80 Å²	80	118.8 Å²	118.8	66%	0.661	67%	0.673	S	S	*	*			trans	-68.2	109.1	159.5	0	0	0	0	0	107.3
7	N	26.8	Very low	28.1	Very low	128 Å²	128	120.4 Å²	120.4	68%	0.684	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-79.5	126.9	176.4	-74.4	-30.2	0	0	0	108.1	R5	R5-N7 PolarHBondContact O-N 3.01Å
8	P	29.8	Very low	28.6	Very low	57 Å²	57	114.7 Å²	114.7	37%	0.37	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-58.9	150.2	174.1	25	-32.7	0	0	0	110.5	E12	P8-E12 HydrophobicContact CB-CB 3.99Å
9	A	32.6	Very low	29.3	Very low	48 Å²	48	109.3 Å²	109.3	40%	0.397	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-62.7	153.2	178.5	0	0	0	0	0	110.6	G11 E12	A9-G11 PolarHBondContact O-N 3.33Å; A9-E12 HydrophobicContact CB-CG 4.08Å; A9-E12 WeakPolarHBondContact CB-OE2 3.4Å; A9-E12 PolarHBondContact N-OE2 3.35Å; A9-E12 VanDerWaalsContact N-OE2 3.13Å; A9-E12 WeakPolarHBondContact O-CB 3.29Å; A9-E12 PolarHBondContact O-N 3.22Å
10	P	34.7	Very low	30	Very low	142 Å²	142	103.9 Å²	103.9	92%	0.922	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	112.2	179.6	-23	33	0	0	0	111.5
11	G	35.3	Very low	30.8	Very low	83 Å²	83	99.1 Å²	99.1	86%	0.856	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	105.2	-11.2	-176.8	0	0	0	0	0	114.7	A9 T13	A9-G11 PolarHBondContact O-N 3.33Å; G11-T13 PolarHBondContact O-N 3.19Å
12	E	30.3	Very low	31.8	Very low	127 Å²	127	87.7 Å²	87.7	59%	0.593	50%	0.496	S	S	*	.			trans	-81.7	112.7	169.1	-66.5	-176.4	159.3	0	0	109.3	P8 A9	P8-E12 HydrophobicContact CB-CB 3.99Å; A9-E12 HydrophobicContact CB-CG 4.08Å; A9-E12 WeakPolarHBondContact CB-OE2 3.4Å; A9-E12 PolarHBondContact N-OE2 3.35Å; A9-E12 VanDerWaalsContact N-OE2 3.13Å; A9-E12 WeakPolarHBondContact O-CB 3.29Å; A9-E12 PolarHBondContact O-N 3.22Å
13	T	30.8	Very low	33.1	Very low	124 Å²	124	83 Å²	83	76%	0.761	46%	0.463	S	S	*	.			trans	-67.3	140	159.7	40.2	0	0	0	0	107.7	G11 G15	G11-T13 PolarHBondContact O-N 3.19Å; T13-G15 VanDerWaalsContact C-N 3.33Å; T13-G15 WeakPolarHBondContact O-CA 3.22Å; T13-G15 PolarHBondContact O-N 2.98Å
14	E	30.1	Very low	34.2	Very low	111 Å²	111	81.5 Å²	81.5	52%	0.519	45%	0.453	S	S	.	.			trans	-40.9	96.8	176.5	-88.5	174.7	165	0	0	110.6	R5 N16	R5-E14 IonicContact CZ-OE1 3.27Å; R5-E14 IonicContact NH2-OE1 2.74Å; R5-E14 PolarHBondContact NH2-OE1 2.94Å; E14-N16 PolarHBondContact O-N 2.9Å
15	G	30.1	Very low	35.2	Very low	47 Å²	47	76.3 Å²	76.3	49%	0.485	44%	0.443	S	S	.	.			trans	-99.4	78.5	-157.4	0	0	0	0	0	109.8	T13 F17	T13-G15 VanDerWaalsContact C-N 3.33Å; T13-G15 WeakPolarHBondContact O-CA 3.22Å; T13-G15 PolarHBondContact O-N 2.98Å; G15-F17 WeakPolarHBondContact O-CD2 3.33Å; G15-F17 PolarHBondContact O-N 3.04Å
16	N	30.2	Very low	36.1	Very low	80 Å²	80	69.5 Å²	69.5	43%	0.428	42%	0.418	S	S	.	.			trans	35.5	29	132.3	-66.7	-51.9	0	0	0	120.6	E14 Y18 N35	E14-N16 PolarHBondContact O-N 2.9Å; N16-Y18 HydrophobicContact CB-CE2 3.78Å; N16-Y18 WeakPolarHBondContact O-CD2 3.42Å; N16-Y18 VanDerWaalsContact O-CE2 3.25Å; N16-Y18 WeakPolarHBondContact O-CE2 3.38Å; N16-Y18 PolarHBondContact O-N 3.2Å; N16-Y18 PolarHBondContact OD1-OH 3.27Å; N16-N35 VanDerWaalsContact O-CB 3.25Å; N16-N35 WeakPolarHBondContact O-CB 3.38Å
17	F	28.9	Very low	36.6	Very low	145 Å²	145	71 Å²	71	64%	0.636	42%	0.415	S	S	*	.			trans	-80.5	114	170.8	-90.7	-82.2	0	0	0	109.3	G15	G15-F17 WeakPolarHBondContact O-CD2 3.33Å; G15-F17 PolarHBondContact O-N 3.04Å
18	Y	37	Very low	37.1	Very low	19 Å²	19	67 Å²	67	8%	0.075	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-117.2	98.4	176.9	-57	-87.3	0	0	0	109.1	N16 A20 N35 I36 I120 A133 W136	N16-Y18 HydrophobicContact CB-CE2 3.78Å; N16-Y18 WeakPolarHBondContact O-CD2 3.42Å; N16-Y18 VanDerWaalsContact O-CE2 3.25Å; N16-Y18 WeakPolarHBondContact O-CE2 3.38Å; N16-Y18 PolarHBondContact O-N 3.2Å; N16-Y18 PolarHBondContact OD1-OH 3.27Å; Y18-A20 VanDerWaalsContact C-N 3.33Å; Y18-A20 PolarHBondContact O-N 3.25Å; Y18-N35 CarbonylContact C-O 3.57Å; Y18-N35 HydrophobicContact CD2-CB 3.68Å; Y18-N35 HydrophobicContact CE2-CB 4.33Å; Y18-N35 PolarHBondContact N-O 2.98Å; Y18-I36 WeakPolarHBondContact O-CA 3.37Å; Y18-I120 HydrophobicContact CE1-CD1 3.94Å; Y18-A133 HydrophobicContact CE1-CB 3.35Å; Y18-A133 VanDerWaalsContact CZ-CB 3.47Å; Y18-A133 WeakPolarHBondContact OH-CB 3.18Å; Y18-W136 AromaticContact CD1-CD1 3.22Å; Y18-W136 HydrophobicContact CD1-CD2 4.01Å; Y18-W136 AromaticContact CD1-CE2 3.62Å; Y18-W136 AromaticContact CD1-CG 3.75Å; Y18-W136 HydrophobicContact CD1-CG 3.75Å; Y18-W136 HydrophobicContact CD1-CZ2 4.35Å; Y18-W136 AromaticContact CD1-NE1 3.15Å; Y18-W136 HydrophobicContact CE1-CB 4.1Å; Y18-W136 AromaticContact CE1-CD1 3.51Å; Y18-W136 HydrophobicContact CE1-CD2 4.33Å; Y18-W136 AromaticContact CE1-CG 3.75Å; Y18-W136 HydrophobicContact CE1-CG 3.75Å; Y18-W136 AromaticContact CE1-NE1 3.93Å; Y18-W136 AromaticContact CG-CD1 3.71Å; Y18-W136 AromaticContact CG-NE1 3.47Å
19	V	41.4	Very low	37.6	Very low	12 Å²	12	65.2 Å²	65.2	7%	0.073	39%	0.385	C	S	.	.			trans	-84.4	80.7	178.9	-174.9	0	0	0	0	109.9	G21 F39 L44 F116	V19-G21 PolarHBondContact O-N 3.18Å; V19-F39 HydrophobicContact CG1-CD2 3.57Å; V19-F39 HydrophobicContact CG1-CE2 3.82Å; V19-F39 HydrophobicContact CG2-CE2 4.36Å; V19-L44 HydrophobicContact CB-CD1 4.21Å; V19-L44 HydrophobicContact CG1-CD1 3.21Å; V19-L44 HydrophobicContact CG1-CD2 4.31Å; V19-L44 HydrophobicContact CG1-CG 4.41Å; V19-L44 HydrophobicContact CG2-CD1 4.4Å; V19-F116 HydrophobicContact CB-CB 4.43Å; V19-F116 HydrophobicContact CB-CD1 4.05Å; V19-F116 CarbonylContact O-C 3.48Å; V19-F116 VanDerWaalsContact O-CB 3.29Å; V19-F116 WeakPolarHBondContact O-CB 3.29Å; V19-F116 PolarHBondContact O-N 2.73Å
20	A	43.8	Very low	37.6	Very low	0 Å²	0	70.1 Å²	70.1	0%	0	40%	0.397	C	S	.	.			trans	-91.1	86.3	179.2	0	0	0	0	0	110.7	Y18 I36 V115 R141 I145	Y18-A20 VanDerWaalsContact C-N 3.33Å; Y18-A20 PolarHBondContact O-N 3.25Å; A20-I36 HydrophobicContact CB-CG2 3.86Å; A20-I36 WeakPolarHBondContact O-CG2 3.37Å; A20-V115 HydrophobicContact CB-CG1 4.1Å; A20-R141 HydrophobicContact CB-CG 4.09Å; A20-I145 HydrophobicContact CB-CD1 3.88Å; A20-I145 VanDerWaalsContact O-CD1 3.31Å; A20-I145 WeakPolarHBondContact O-CD1 3.37Å
21	G	46	Very low	37.6	Very low	5 Å²	5	65.7 Å²	65.7	5%	0.052	36%	0.364	C	S	.	.			trans	133.5	123.5	162.8	0	0	0	0	0	114.7	V19 M38 F39 L114	V19-G21 PolarHBondContact O-N 3.18Å; G21-M38 CarbonylContact O-C 3.43Å; G21-M38 VanDerWaalsContact O-CA 3.32Å; G21-M38 WeakPolarHBondContact O-CA 3.47Å; G21-F39 PolarHBondContact O-N 2.88Å; G21-L114 CarbonylContact C-O 3.52Å; G21-L114 WeakPolarHBondContact CA-O 3.43Å
22	T	45.7	Very low	37.5	Very low	4 Å²	4	70.1 Å²	70.1	3%	0.025	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	136.6	153.9	72.4	0	0	0	0	110.9	F39 L44 F79 L114	T22-F39 CarbonylContact C-O 3.56Å; T22-F39 WeakPolarHBondContact CA-O 3.3Å; T22-L44 HydrophobicContact CG2-CB 3.81Å; T22-L44 HydrophobicContact CG2-CD2 3.26Å; T22-L44 HydrophobicContact CG2-CG 4.16Å; T22-F79 HydrophobicContact CG2-CE1 4.22Å; T22-L114 PolarHBondContact N-O 3.32Å; T22-L114 WeakPolarHBondContact OG1-CB 3.37Å
23	L	46.8	Very low	37.7	Very low	7 Å²	7	72 Å²	72	4%	0.037	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.7	163.8	-60.1	166.9	0	0	0	106.6	N25 Q26 F39 G40 V41 L91 M110 F150	L23-N25 PolarHBondContact O-N 2.79Å; L23-Q26 HydrophobicContact CB-CB 3.86Å; L23-Q26 HydrophobicContact CB-CG 3.66Å; L23-Q26 HydrophobicContact CD1-CB 4.35Å; L23-Q26 HydrophobicContact CD1-CG 4.28Å; L23-F39 PolarHBondContact N-O 3.44Å; L23-G40 VanDerWaalsContact O-CA 3.24Å; L23-G40 WeakPolarHBondContact O-CA 3.42Å; L23-V41 PolarHBondContact O-N 3.24Å; L23-L91 HydrophobicContact CD1-CD1 4.02Å; L23-L91 HydrophobicContact CD1-CD2 4.05Å; L23-L91 HydrophobicContact CD2-CD1 3.99Å; L23-L91 HydrophobicContact CD2-CD2 4.3Å; L23-M110 HydrophobicContact CD2-CE 4.26Å; L23-M110 HydrophobicContact CD2-SD 3.63Å; L23-F150 HydrophobicContact CD2-CZ 3.99Å
24	E	43.9	Very low	38	Very low	100 Å²	100	67.7 Å²	67.7	47%	0.467	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	129.2	174	-73.5	174.4	-167.2	0	0	109.2	V41 R81	E24-V41 HydrophobicContact CG-CG2 4.01Å; E24-R81 IonicContact OE1-NH2 3.99Å
25	N	41.7	Very low	38	Very low	124 Å²	124	66.8 Å²	66.8	66%	0.663	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	35.7	175.2	-50.2	-44.9	0	0	0	118.2	L23	L23-N25 PolarHBondContact O-N 2.79Å
26	Q	43.4	Very low	38.4	Very low	16 Å²	16	64.8 Å²	64.8	8%	0.075	33%	0.327	C	S	.	.			trans	-132.2	149.1	-175	-60.3	-90	-52	0	0	113.9	L23 G40 R99 M108	L23-Q26 HydrophobicContact CB-CB 3.86Å; L23-Q26 HydrophobicContact CB-CG 3.66Å; L23-Q26 HydrophobicContact CD1-CB 4.35Å; L23-Q26 HydrophobicContact CD1-CG 4.28Å; Q26-G40 WeakPolarHBondContact O-CA 3.27Å; Q26-G40 PolarHBondContact O-N 3.31Å; Q26-R99 VanDerWaalsContact OE1-NE 3.16Å; Q26-M108 PolarHBondContact NE2-SD 2.87Å
27	D	38.2	Very low	38.9	Very low	113 Å²	113	61.8 Å²	61.8	60%	0.604	31%	0.312	S	S	*	.			trans	-78.5	149.9	170.4	-62.7	-57.9	0	0	0	111.1	K102	D27-K102 IonicContact OD2-NZ 3.86Å
28	C	38	Very low	39.7	Very low	43 Å²	43	55.1 Å²	55.1	29%	0.291	28%	0.283	S	S	.	.			trans	-49	134.5	-174.3	-171	0	0	0	0	113.8	F30 V37 M38 F39	C28-F30 HydrophobicContact CB-CD2 4.44Å; C28-F30 HydrophobicContact CB-CE2 3.92Å; C28-F30 HydrophobicContact CB-CZ 4.42Å; C28-F30 WeakPolarHBondContact SG-CE2 3.19Å; C28-F30 WeakPolarHBondContact SG-CZ 3.29Å; C28-V37 WeakPolarHBondContact SG-CG1 3.27Å; C28-M38 CarbonylContact C-O 3.54Å; C28-M38 VanDerWaalsContact CA-O 3.3Å; C28-M38 WeakPolarHBondContact CA-O 3.35Å; C28-M38 PolarHBondContact SG-O 3.31Å; C28-F39 HydrophobicContact CB-CD1 4.04Å; C28-F39 HydrophobicContact CB-CE1 4.34Å
29	V	40.4	Very low	40	Very low	20 Å²	20	55.5 Å²	55.5	12%	0.121	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	113.7	169.3	-174.7	0	0	0	0	108.1	M38 F149	V29-M38 HydrophobicContact CB-CB 4.39Å; V29-M38 HydrophobicContact CB-CE 3.7Å; V29-M38 HydrophobicContact CG1-CE 3.89Å; V29-M38 HydrophobicContact CG2-CE 4.23Å; V29-M38 PolarHBondContact N-O 3.24Å; V29-M38 PolarHBondContact O-N 2.98Å; V29-M38 VanDerWaalsContact O-N 3.1Å; V29-F149 HydrophobicContact CG1-CE1 3.67Å; V29-F149 HydrophobicContact CG1-CZ 4.07Å
30	F	32.9	Very low	40.2	Very low	151 Å²	151	55 Å²	55	66%	0.662	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	137.7	175.9	-67.2	-87.7	0	0	0	110.2	C28 V37	C28-F30 HydrophobicContact CB-CD2 4.44Å; C28-F30 HydrophobicContact CB-CE2 3.92Å; C28-F30 HydrophobicContact CB-CZ 4.42Å; C28-F30 WeakPolarHBondContact SG-CE2 3.19Å; C28-F30 WeakPolarHBondContact SG-CZ 3.29Å; F30-V37 HydrophobicContact CD1-CG1 3.87Å; F30-V37 HydrophobicContact CD1-CG2 4.12Å; F30-V37 HydrophobicContact CE1-CG1 3.71Å; F30-V37 HydrophobicContact CE1-CG2 4.2Å; F30-V37 HydrophobicContact CZ-CG1 4.3Å
31	E	34.6	Very low	40.4	Very low	49 Å²	49	57.4 Å²	57.4	23%	0.229	30%	0.297	C	S	.	.			trans	-103.4	111	165.8	-172.7	-179.7	-170	0	0	108.4	N33 T34 Q148	E31-N33 PolarHBondContact O-N 2.79Å; E31-T34 WeakPolarHBondContact CB-OG1 3.23Å; E31-T34 VanDerWaalsContact CD-OG1 3.24Å; E31-T34 HydrophobicContact CG-CG2 3.87Å; E31-T34 PolarHBondContact O-N 3.19Å; E31-T34 VanDerWaalsContact O-O 3.14Å; E31-T34 VanDerWaalsContact OE1-CG2 3.32Å; E31-T34 WeakPolarHBondContact OE1-CG2 3.44Å; E31-T34 VanDerWaalsContact OE2-CB 3.29Å; E31-T34 WeakPolarHBondContact OE2-CB 3.46Å; E31-T34 WeakPolarHBondContact OE2-CG2 3.24Å; E31-T34 PolarHBondContact OE2-OG1 3.48Å; E31-Q148 PolarHBondContact OE1-NE2 2.7Å; E31-Q148 PolarHBondContact OE1-OE1 3.13Å
32	E	32.6	Very low	40.7	Very low	176 Å²	176	61.5 Å²	61.5	82%	0.822	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	130.3	168	-70	-177.5	173.1	0	0	108.4
33	N	34.1	Very low	40.9	Very low	167 Å²	167	62.5 Å²	62.5	89%	0.893	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	3.6	-175.7	-44.3	-63.2	0	0	0	116.8	E31	E31-N33 PolarHBondContact O-N 2.79Å
34	T	37.2	Very low	41.2	Very low	33 Å²	33	62.2 Å²	62.2	20%	0.202	33%	0.327	C	S	.	.	S	Bend	trans	-126.3	147	163.3	85.5	0	0	0	0	111.4	E31 I36	E31-T34 WeakPolarHBondContact CB-OG1 3.23Å; E31-T34 VanDerWaalsContact CD-OG1 3.24Å; E31-T34 HydrophobicContact CG-CG2 3.87Å; E31-T34 PolarHBondContact O-N 3.19Å; E31-T34 VanDerWaalsContact O-O 3.14Å; E31-T34 VanDerWaalsContact OE1-CG2 3.32Å; E31-T34 WeakPolarHBondContact OE1-CG2 3.44Å; E31-T34 VanDerWaalsContact OE2-CB 3.29Å; E31-T34 WeakPolarHBondContact OE2-CB 3.46Å; E31-T34 WeakPolarHBondContact OE2-CG2 3.24Å; E31-T34 PolarHBondContact OE2-OG1 3.48Å; T34-I36 PolarHBondContact O-N 3.22Å; T34-I36 WeakPolarHBondContact OG1-CB 3.24Å; T34-I36 WeakPolarHBondContact OG1-CG1 3.47Å; T34-I36 PolarHBondContact OG1-N 2.6Å
35	N	31.6	Very low	41.5	Very low	91 Å²	91	60 Å²	60	49%	0.487	32%	0.318	S	S	.	.	S	Bend	trans	-73.8	22.2	173.4	-61.9	-35.2	0	0	0	112	N16 Y18	N16-N35 VanDerWaalsContact O-CB 3.25Å; N16-N35 WeakPolarHBondContact O-CB 3.38Å; Y18-N35 CarbonylContact C-O 3.57Å; Y18-N35 HydrophobicContact CD2-CB 3.68Å; Y18-N35 HydrophobicContact CE2-CB 4.33Å; Y18-N35 PolarHBondContact N-O 2.98Å
36	I	37.9	Very low	42	Very low	5 Å²	5	58.7 Å²	58.7	3%	0.026	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-95.5	129.7	177.5	-51.3	171.1	0	0	0	109	Y18 A20 T34 M38 R141	Y18-I36 WeakPolarHBondContact O-CA 3.37Å; A20-I36 HydrophobicContact CB-CG2 3.86Å; A20-I36 WeakPolarHBondContact O-CG2 3.37Å; T34-I36 PolarHBondContact O-N 3.22Å; T34-I36 WeakPolarHBondContact OG1-CB 3.24Å; T34-I36 WeakPolarHBondContact OG1-CG1 3.47Å; T34-I36 PolarHBondContact OG1-N 2.6Å; I36-M38 HydrophobicContact CG2-CG 4.27Å; I36-R141 HydrophobicContact CD1-CG 4.19Å; I36-R141 VanDerWaalsContact CD1-NH2 3.27Å; I36-R141 VanDerWaalsContact CG1-NE 3.25Å
37	V	40.6	Very low	42.4	Very low	18 Å²	18	59.5 Å²	59.5	11%	0.109	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.3	166.5	-169.4	0	0	0	0	107.1	C28 F30 F39	C28-V37 WeakPolarHBondContact SG-CG1 3.27Å; F30-V37 HydrophobicContact CD1-CG1 3.87Å; F30-V37 HydrophobicContact CD1-CG2 4.12Å; F30-V37 HydrophobicContact CE1-CG1 3.71Å; F30-V37 HydrophobicContact CE1-CG2 4.2Å; F30-V37 HydrophobicContact CZ-CG1 4.3Å; V37-F39 HydrophobicContact CB-CD2 4.11Å; V37-F39 HydrophobicContact CB-CE2 3.54Å; V37-F39 HydrophobicContact CB-CZ 4.04Å; V37-F39 HydrophobicContact CG1-CD1 4.36Å; V37-F39 HydrophobicContact CG1-CD2 3.73Å; V37-F39 HydrophobicContact CG1-CE1 3.89Å; V37-F39 HydrophobicContact CG1-CE2 3.23Å; V37-F39 HydrophobicContact CG1-CG 4.3Å; V37-F39 HydrophobicContact CG1-CZ 3.32Å
38	M	45.1	Very low	42.9	Very low	5 Å²	5	55.7 Å²	55.7	3%	0.025	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	122.7	171.3	-65.2	-169.5	-52.6	0	0	108.1	G21 C28 V29 I36 I145 F149	G21-M38 CarbonylContact O-C 3.43Å; G21-M38 VanDerWaalsContact O-CA 3.32Å; G21-M38 WeakPolarHBondContact O-CA 3.47Å; C28-M38 CarbonylContact C-O 3.54Å; C28-M38 VanDerWaalsContact CA-O 3.3Å; C28-M38 WeakPolarHBondContact CA-O 3.35Å; C28-M38 PolarHBondContact SG-O 3.31Å; V29-M38 HydrophobicContact CB-CB 4.39Å; V29-M38 HydrophobicContact CB-CE 3.7Å; V29-M38 HydrophobicContact CG1-CE 3.89Å; V29-M38 HydrophobicContact CG2-CE 4.23Å; V29-M38 PolarHBondContact N-O 3.24Å; V29-M38 PolarHBondContact O-N 2.98Å; V29-M38 VanDerWaalsContact O-N 3.1Å; I36-M38 HydrophobicContact CG2-CG 4.27Å; M38-I145 HydrophobicContact SD-CG1 4.5Å; M38-I145 HydrophobicContact SD-CG2 3.93Å; M38-F149 HydrophobicContact CE-CB 4.42Å; M38-F149 HydrophobicContact CE-CD1 3.58Å; M38-F149 HydrophobicContact CE-CD2 3.34Å; M38-F149 HydrophobicContact CE-CE1 3.52Å; M38-F149 HydrophobicContact CE-CE2 3.27Å; M38-F149 HydrophobicContact CE-CG 3.49Å; M38-F149 VanDerWaalsContact CE-CG 3.49Å; M38-F149 HydrophobicContact CE-CZ 3.36Å; M38-F149 HydrophobicContact SD-CD2 3.58Å; M38-F149 VanDerWaalsContact SD-CD2 3.58Å; M38-F149 HydrophobicContact SD-CE2 3.69Å; M38-F149 HydrophobicContact SD-CG 4.17Å; M38-F149 HydrophobicContact SD-CZ 4.36Å
39	F	43.7	Very low	43.4	Very low	26 Å²	26	58 Å²	58	11%	0.114	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	164.2	-178.9	-74	-83.9	0	0	0	111.5	V19 G21 T22 L23 C28 V37 G43 L44 A47	V19-F39 HydrophobicContact CG1-CD2 3.57Å; V19-F39 HydrophobicContact CG1-CE2 3.82Å; V19-F39 HydrophobicContact CG2-CE2 4.36Å; G21-F39 PolarHBondContact O-N 2.88Å; T22-F39 CarbonylContact C-O 3.56Å; T22-F39 WeakPolarHBondContact CA-O 3.3Å; L23-F39 PolarHBondContact N-O 3.44Å; C28-F39 HydrophobicContact CB-CD1 4.04Å; C28-F39 HydrophobicContact CB-CE1 4.34Å; V37-F39 HydrophobicContact CB-CD2 4.11Å; V37-F39 HydrophobicContact CB-CE2 3.54Å; V37-F39 HydrophobicContact CB-CZ 4.04Å; V37-F39 HydrophobicContact CG1-CD1 4.36Å; V37-F39 HydrophobicContact CG1-CD2 3.73Å; V37-F39 HydrophobicContact CG1-CE1 3.89Å; V37-F39 HydrophobicContact CG1-CE2 3.23Å; V37-F39 HydrophobicContact CG1-CG 4.3Å; V37-F39 HydrophobicContact CG1-CZ 3.32Å; F39-G43 VanDerWaalsContact CD1-C 3.47Å; F39-G43 WeakPolarHBondContact CD1-O 3.44Å; F39-L44 HydrophobicContact CB-CB 3.58Å; F39-L44 HydrophobicContact CB-CD1 4.35Å; F39-L44 VanDerWaalsContact CB-N 3.34Å; F39-L44 HydrophobicContact CD2-CB 4.35Å; F39-L44 HydrophobicContact CD2-CD1 3.55Å; F39-L44 HydrophobicContact CE2-CD1 3.98Å; F39-L44 HydrophobicContact CG-CB 4.06Å; F39-L44 HydrophobicContact CG-CD1 4.1Å; F39-A47 HydrophobicContact CD1-CB 4.01Å; F39-A47 HydrophobicContact CE1-CB 3.26Å; F39-A47 HydrophobicContact CE2-CB 4.12Å; F39-A47 HydrophobicContact CZ-CB 3.3Å
40	G	45.2	Very low	43.7	Very low	2 Å²	2	60.4 Å²	60.4	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	162.3	150.6	0	0	0	0	0	110.5	L23 Q26 D42 G43 L44	L23-G40 VanDerWaalsContact O-CA 3.24Å; L23-G40 WeakPolarHBondContact O-CA 3.42Å; Q26-G40 WeakPolarHBondContact O-CA 3.27Å; Q26-G40 PolarHBondContact O-N 3.31Å; G40-D42 PolarHBondContact O-N 3.13Å; G40-G43 PolarHBondContact O-N 2.86Å; G40-L44 WeakPolarHBondContact O-CB 3.33Å; G40-L44 PolarHBondContact O-N 3.47Å
41	V	49.4	Very low	44.2	Very low	50 Å²	50	60.8 Å²	60.8	30%	0.303	32%	0.318	S	S	.	.	H	α-helix	trans	-53.6	-48.4	167.5	174	0	0	0	0	110.1	L23 E24 L44 I45	L23-V41 PolarHBondContact O-N 3.24Å; E24-V41 HydrophobicContact CG-CG2 4.01Å; V41-L44 PolarHBondContact O-N 2.83Å; V41-I45 HydrophobicContact CG1-CD1 3.9Å; V41-I45 VanDerWaalsContact O-CG1 3.27Å; V41-I45 WeakPolarHBondContact O-CG1 2.92Å; V41-I45 PolarHBondContact O-N 3.27Å
42	D	51.4	Low	44.5	Very low	92 Å²	92	60.2 Å²	60.2	49%	0.492	32%	0.316	S	S	.	.	H	α-helix	trans	-65.9	-41.1	177.1	-58.6	-36.2	0	0	0	112.5	G40 L44 I45 N46	G40-D42 PolarHBondContact O-N 3.13Å; D42-L44 VanDerWaalsContact C-N 3.26Å; D42-L44 PolarHBondContact O-N 3.48Å; D42-I45 PolarHBondContact O-N 3.03Å; D42-N46 VanDerWaalsContact O-CB 3.3Å; D42-N46 WeakPolarHBondContact O-CB 3.12Å; D42-N46 PolarHBondContact O-N 3.23Å; D42-N46 PolarHBondContact O-ND2 3.34Å; D42-N46 VanDerWaalsContact O-ND2 3.16Å
43	G	50.5	Low	44.7	Very low	25 Å²	25	54.7 Å²	54.7	26%	0.258	29%	0.292	S	S	.	.	H	α-helix	trans	-61.1	-38.6	176.4	0	0	0	0	0	111.7	F39 G40 A47	F39-G43 VanDerWaalsContact CD1-C 3.47Å; F39-G43 WeakPolarHBondContact CD1-O 3.44Å; G40-G43 PolarHBondContact O-N 2.86Å; G43-A47 VanDerWaalsContact O-CB 3.27Å; G43-A47 WeakPolarHBondContact O-CB 3.45Å; G43-A47 PolarHBondContact O-N 2.74Å
44	L	52.1	Low	45	Very low	1 Å²	1	52.4 Å²	52.4	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-69.2	-52.1	179.3	179.7	58.3	0	0	0	109.2	V19 T22 F39 G40 V41 D42 N46 A47 V48 F79 F116	V19-L44 HydrophobicContact CB-CD1 4.21Å; V19-L44 HydrophobicContact CG1-CD1 3.21Å; V19-L44 HydrophobicContact CG1-CD2 4.31Å; V19-L44 HydrophobicContact CG1-CG 4.41Å; V19-L44 HydrophobicContact CG2-CD1 4.4Å; T22-L44 HydrophobicContact CG2-CB 3.81Å; T22-L44 HydrophobicContact CG2-CD2 3.26Å; T22-L44 HydrophobicContact CG2-CG 4.16Å; F39-L44 HydrophobicContact CB-CB 3.58Å; F39-L44 HydrophobicContact CB-CD1 4.35Å; F39-L44 VanDerWaalsContact CB-N 3.34Å; F39-L44 HydrophobicContact CD2-CB 4.35Å; F39-L44 HydrophobicContact CD2-CD1 3.55Å; F39-L44 HydrophobicContact CE2-CD1 3.98Å; F39-L44 HydrophobicContact CG-CB 4.06Å; F39-L44 HydrophobicContact CG-CD1 4.1Å; G40-L44 WeakPolarHBondContact O-CB 3.33Å; G40-L44 PolarHBondContact O-N 3.47Å; V41-L44 PolarHBondContact O-N 2.83Å; D42-L44 VanDerWaalsContact C-N 3.26Å; D42-L44 PolarHBondContact O-N 3.48Å; L44-N46 PolarHBondContact O-N 3.28Å; L44-A47 PolarHBondContact O-N 2.77Å; L44-V48 HydrophobicContact CD1-CG1 3.69Å; L44-V48 HydrophobicContact CG-CG1 4.26Å; L44-V48 WeakPolarHBondContact O-CG2 3.38Å; L44-V48 PolarHBondContact O-N 3.12Å; L44-F79 HydrophobicContact CD2-CE1 3.27Å; L44-F79 HydrophobicContact CD2-CZ 3.42Å; L44-F79 VanDerWaalsContact CD2-CZ 3.42Å; L44-F79 HydrophobicContact CG-CZ 4.49Å; L44-F116 HydrophobicContact CD2-CB 4.32Å
45	I	51.4	Low	45.1	Very low	54 Å²	54	56.4 Å²	56.4	28%	0.277	30%	0.304	S	S	.	.	H	α-helix	trans	-51.4	-51.5	177.1	-70.3	167.6	0	0	0	108	V41 D42 A47 V48 R49	V41-I45 HydrophobicContact CG1-CD1 3.9Å; V41-I45 VanDerWaalsContact O-CG1 3.27Å; V41-I45 WeakPolarHBondContact O-CG1 2.92Å; V41-I45 PolarHBondContact O-N 3.27Å; D42-I45 PolarHBondContact O-N 3.03Å; I45-A47 VanDerWaalsContact C-N 3.31Å; I45-A47 PolarHBondContact O-N 2.7Å; I45-V48 PolarHBondContact O-N 3.01Å; I45-R49 WeakPolarHBondContact O-CA 3Å; I45-R49 WeakPolarHBondContact O-CB 3.39Å; I45-R49 PolarHBondContact O-N 3.03Å
46	N	51.8	Low	45.4	Very low	96 Å²	96	57.8 Å²	57.8	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-64.1	-31.1	179.5	-70.8	-28.6	0	0	0	114.2	D42 L44 P50	D42-N46 VanDerWaalsContact O-CB 3.3Å; D42-N46 WeakPolarHBondContact O-CB 3.12Å; D42-N46 PolarHBondContact O-N 3.23Å; D42-N46 PolarHBondContact O-ND2 3.34Å; D42-N46 VanDerWaalsContact O-ND2 3.16Å; L44-N46 PolarHBondContact O-N 3.28Å; N46-P50 WeakPolarHBondContact O-CD 3.5Å
47	A	50.9	Low	45.1	Very low	33 Å²	33	61 Å²	61	27%	0.273	34%	0.341	S	S	.	.	H	α-helix	trans	-77.6	-38.8	177.7	0	0	0	0	0	112.9	F39 G43 L44 I45 Y51	F39-A47 HydrophobicContact CD1-CB 4.01Å; F39-A47 HydrophobicContact CE1-CB 3.26Å; F39-A47 HydrophobicContact CE2-CB 4.12Å; F39-A47 HydrophobicContact CZ-CB 3.3Å; G43-A47 VanDerWaalsContact O-CB 3.27Å; G43-A47 WeakPolarHBondContact O-CB 3.45Å; G43-A47 PolarHBondContact O-N 2.74Å; L44-A47 PolarHBondContact O-N 2.77Å; I45-A47 VanDerWaalsContact C-N 3.31Å; I45-A47 PolarHBondContact O-N 2.7Å; A47-Y51 WeakPolarHBondContact O-CD2 3.37Å
48	V	50.7	Low	44.7	Very low	32 Å²	32	61 Å²	61	19%	0.194	35%	0.345	C	S	.	.	H	α-helix	trans	-81.6	-27.6	177	-57.3	0	0	0	0	111.7	L44 I45 Y51 L52	L44-V48 HydrophobicContact CD1-CG1 3.69Å; L44-V48 HydrophobicContact CG-CG1 4.26Å; L44-V48 WeakPolarHBondContact O-CG2 3.38Å; L44-V48 PolarHBondContact O-N 3.12Å; I45-V48 PolarHBondContact O-N 3.01Å; V48-Y51 CarbonylContact O-C 3.52Å; V48-Y51 WeakPolarHBondContact O-CA 3.27Å; V48-Y51 VanDerWaalsContact O-CB 3.29Å; V48-Y51 WeakPolarHBondContact O-CB 3.3Å; V48-Y51 PolarHBondContact O-N 3.35Å; V48-L52 HydrophobicContact CB-CG 4.5Å; V48-L52 HydrophobicContact CG2-CD1 4.01Å; V48-L52 HydrophobicContact CG2-CG 4.3Å; V48-L52 WeakPolarHBondContact O-CG 3.38Å; V48-L52 PolarHBondContact O-N 2.81Å
49	R	47.9	Very low	43.9	Very low	93 Å²	93	65.4 Å²	65.4	35%	0.351	37%	0.373	S	S	.	.	H	α-helix	trans	-55.4	-42.8	-173.7	175.3	175.2	-163.9	165.7	9.4	113.9	I45 Y51 L52 D53	I45-R49 WeakPolarHBondContact O-CA 3Å; I45-R49 WeakPolarHBondContact O-CB 3.39Å; I45-R49 PolarHBondContact O-N 3.03Å; R49-Y51 VanDerWaalsContact C-N 3.26Å; R49-Y51 PolarHBondContact O-N 2.99Å; R49-L52 CarbonylContact O-C 3.51Å; R49-L52 PolarHBondContact O-N 2.74Å; R49-D53 WeakPolarHBondContact CG-OD2 3.45Å; R49-D53 IonicContact NE-OD2 3.6Å; R49-D53 PolarHBondContact NE-OD2 2.75Å; R49-D53 VanDerWaalsContact O-CB 3.24Å; R49-D53 WeakPolarHBondContact O-CB 3.18Å; R49-D53 PolarHBondContact O-N 2.88Å
50	P	46.4	Very low	43.3	Very low	69 Å²	69	65.9 Å²	65.9	45%	0.448	38%	0.381	S	S	.	.	H	α-helix	trans	-56.9	-39.6	171.8	-26.9	34.5	0	0	0	112.7	N46 L52 V54	N46-P50 WeakPolarHBondContact O-CD 3.5Å; P50-L52 VanDerWaalsContact C-N 3.34Å; P50-V54 WeakPolarHBondContact O-CB 3.39Å; P50-V54 WeakPolarHBondContact O-CG2 3.48Å; P50-V54 PolarHBondContact O-N 3.14Å
51	Y	43.1	Very low	42.5	Very low	160 Å²	160	73.1 Å²	73.1	63%	0.627	41%	0.414	S	S	*	.	H	α-helix	trans	-70.1	-31.4	175.7	-61.1	-85.5	0	0	0	112.3	A47 V48 R49	A47-Y51 WeakPolarHBondContact O-CD2 3.37Å; V48-Y51 CarbonylContact O-C 3.52Å; V48-Y51 WeakPolarHBondContact O-CA 3.27Å; V48-Y51 VanDerWaalsContact O-CB 3.29Å; V48-Y51 WeakPolarHBondContact O-CB 3.3Å; V48-Y51 PolarHBondContact O-N 3.35Å; R49-Y51 VanDerWaalsContact C-N 3.26Å; R49-Y51 PolarHBondContact O-N 2.99Å
52	L	41.2	Very low	41.6	Very low	37 Å²	37	79.6 Å²	79.6	19%	0.194	44%	0.441	C	S	.	.	H	α-helix	trans	-76.1	-42	175.5	-55.5	-168.2	0	0	0	112.8	V48 R49 P50 H56 L75	V48-L52 HydrophobicContact CB-CG 4.5Å; V48-L52 HydrophobicContact CG2-CD1 4.01Å; V48-L52 HydrophobicContact CG2-CG 4.3Å; V48-L52 WeakPolarHBondContact O-CG 3.38Å; V48-L52 PolarHBondContact O-N 2.81Å; R49-L52 CarbonylContact O-C 3.51Å; R49-L52 PolarHBondContact O-N 2.74Å; P50-L52 VanDerWaalsContact C-N 3.34Å; L52-H56 WeakPolarHBondContact O-CA 3.21Å; L52-H56 WeakPolarHBondContact O-CB 3.4Å; L52-H56 PolarHBondContact O-N 3.34Å; L52-H56 VanDerWaalsContact O-N 3.16Å; L52-L75 HydrophobicContact CD1-CD1 4.15Å; L52-L75 HydrophobicContact CD2-CB 4.42Å; L52-L75 HydrophobicContact CD2-CD1 3.35Å; L52-L75 HydrophobicContact CD2-CD2 3.85Å; L52-L75 HydrophobicContact CD2-CG 4.03Å; L52-L75 HydrophobicContact CG-CD1 4.28Å
53	D	37.2	Very low	40.5	Very low	60 Å²	60	78.1 Å²	78.1	32%	0.321	44%	0.438	S	S	.	.	H	α-helix	trans	-78.4	-40.2	-173.4	-75.1	-15	0	0	0	111	R49 G57	R49-D53 WeakPolarHBondContact CG-OD2 3.45Å; R49-D53 IonicContact NE-OD2 3.6Å; R49-D53 PolarHBondContact NE-OD2 2.75Å; R49-D53 VanDerWaalsContact O-CB 3.24Å; R49-D53 WeakPolarHBondContact O-CB 3.18Å; R49-D53 PolarHBondContact O-N 2.88Å; D53-G57 PolarHBondContact O-N 3.01Å
54	V	40.1	Very low	39.6	Very low	118 Å²	118	85.1 Å²	85.1	72%	0.715	46%	0.462	S	S	*	.	H	α-helix	trans	-73.5	-37.1	-175.3	175.6	0	0	0	0	112.2	P50	P50-V54 WeakPolarHBondContact O-CB 3.39Å; P50-V54 WeakPolarHBondContact O-CG2 3.48Å; P50-V54 PolarHBondContact O-N 3.14Å
55	D	39.4	Very low	38.7	Very low	117 Å²	117	90.5 Å²	90.5	63%	0.626	49%	0.487	S	S	*	.	H	α-helix	trans	-104	-17.3	-176.5	-76.3	-25	0	0	0	114.7
56	H	36.7	Very low	38.2	Very low	120 Å²	120	95.4 Å²	95.4	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-131.8	4.3	-171	-63.3	-42.8	0	0	0	116.6	L52 G58 L75	L52-H56 WeakPolarHBondContact O-CA 3.21Å; L52-H56 WeakPolarHBondContact O-CB 3.4Å; L52-H56 PolarHBondContact O-N 3.34Å; L52-H56 VanDerWaalsContact O-N 3.16Å; H56-G58 PolarHBondContact O-N 2.81Å; H56-L75 VanDerWaalsContact CD2-CD2 3.48Å; H56-L75 WeakPolarHBondContact CD2-CD2 3.34Å
57	G	33.4	Very low	37.3	Very low	72 Å²	72	94 Å²	94	74%	0.742	51%	0.512	S	S	*	.			trans	55.6	19.7	171.1	0	0	0	0	0	114.6	D53	D53-G57 PolarHBondContact O-N 3.01Å
58	G	30.5	Very low	36.5	Very low	19 Å²	19	94.9 Å²	94.9	20%	0.196	51%	0.511	C	S	.	.			trans	-103.9	100.1	-173.1	0	0	0	0	0	110.2	H56 A60	H56-G58 PolarHBondContact O-N 2.81Å; G58-A60 PolarHBondContact O-N 2.96Å
59	T	29.6	Very low	35.6	Very low	98 Å²	98	95.8 Å²	95.8	60%	0.601	52%	0.518	S	S	*	.			trans	-58.3	106.6	171.1	46.6	0	0	0	0	110.1	Q61	T59-Q61 PolarHBondContact O-N 3.47Å; T59-Q61 VanDerWaalsContact O-N 3.14Å
60	A	31.2	Very low	35	Very low	36 Å²	36	98 Å²	98	30%	0.298	53%	0.532	S	S	.	.			trans	-64.8	110.7	169.4	0	0	0	0	0	108.7	G58	G58-A60 PolarHBondContact O-N 2.96Å
61	Q	27.6	Very low	34.3	Very low	153 Å²	153	102.5 Å²	102.5	72%	0.715	54%	0.54	S	S	*	.			trans	-96.2	146.1	170.8	-69	-172.1	-8.8	0	0	109.4	T59 S63	T59-Q61 PolarHBondContact O-N 3.47Å; T59-Q61 VanDerWaalsContact O-N 3.14Å; Q61-S63 PolarHBondContact O-N 2.96Å; Q61-S63 PolarHBondContact O-OG 3.41Å; Q61-S63 VanDerWaalsContact O-OG 3.05Å
62	E	31.3	Very low	33.7	Very low	186 Å²	186	99.7 Å²	99.7	87%	0.869	53%	0.529	S	S	*	.			trans	-46.5	110.6	167.5	-72.4	179.1	176.1	0	0	108.6
63	S	28.2	Very low	33.5	Very low	61 Å²	61	104.6 Å²	104.6	43%	0.427	55%	0.545	S	S	.	.			trans	-125.8	128	-177	32.8	0	0	0	0	108.2	Q61	Q61-S63 PolarHBondContact O-N 2.96Å; Q61-S63 PolarHBondContact O-OG 3.41Å; Q61-S63 VanDerWaalsContact O-OG 3.05Å
64	K	31.1	Very low	33.4	Very low	172 Å²	172	108.5 Å²	108.5	75%	0.748	56%	0.559	S	S	*	*			trans	-59.7	145.6	162.6	-55.3	179.9	177	-178.4	0	107.1	D66 S67 I68	K64-D66 PolarHBondContact O-N 2.84Å; K64-S67 WeakPolarHBondContact CA-OG 3.36Å; K64-S67 VanDerWaalsContact CB-OG 3.29Å; K64-S67 WeakPolarHBondContact CB-OG 3.27Å; K64-S67 PolarHBondContact N-OG 3.28Å; K64-S67 WeakPolarHBondContact O-CA 3.29Å; K64-S67 PolarHBondContact O-N 3.4Å; K64-S67 PolarHBondContact O-OG 3.22Å; K64-I68 PolarHBondContact O-N 3.16Å
65	E	32.7	Very low	33.5	Very low	115 Å²	115	106 Å²	106	54%	0.537	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-44.8	-42.4	-178.1	-170.6	173.8	172.5	0	0	112.6	S67 I68	E65-S67 VanDerWaalsContact C-N 3.31Å; E65-S67 PolarHBondContact O-N 2.94Å; E65-I68 PolarHBondContact O-N 3.37Å
66	D	40.7	Very low	33.7	Very low	157 Å²	157	105.2 Å²	105.2	84%	0.84	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-71.1	-22.5	179.4	-55.7	-32.9	0	0	0	114.6	K64	K64-D66 PolarHBondContact O-N 2.84Å
67	S	32.5	Very low	34.1	Very low	67 Å²	67	99.7 Å²	99.7	47%	0.469	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-91.5	-4.5	-179.4	25.4	0	0	0	0	113.5	K64 E65 P69	K64-S67 WeakPolarHBondContact CA-OG 3.36Å; K64-S67 VanDerWaalsContact CB-OG 3.29Å; K64-S67 WeakPolarHBondContact CB-OG 3.27Å; K64-S67 PolarHBondContact N-OG 3.28Å; K64-S67 WeakPolarHBondContact O-CA 3.29Å; K64-S67 PolarHBondContact O-N 3.4Å; K64-S67 PolarHBondContact O-OG 3.22Å; E65-S67 VanDerWaalsContact C-N 3.31Å; E65-S67 PolarHBondContact O-N 2.94Å; S67-P69 WeakPolarHBondContact O-CD 3.32Å
68	I	34.7	Very low	34.7	Very low	50 Å²	50	100 Å²	100	26%	0.256	50%	0.497	S	S	.	.	S	Bend	trans	-70.7	107	175.6	-59.6	173.8	0	0	0	107.8	K64 E65 E70	K64-I68 PolarHBondContact O-N 3.16Å; E65-I68 PolarHBondContact O-N 3.37Å; I68-E70 PolarHBondContact O-N 2.76Å
69	P	32.4	Very low	35.8	Very low	52 Å²	52	103.2 Å²	103.2	34%	0.338	51%	0.506	S	S	.	.			trans	-60.4	140.5	-177.8	-21	33.4	0	0	0	109.8	S67 R71 Y72	S67-P69 WeakPolarHBondContact O-CD 3.32Å; P69-R71 HydrophobicContact CB-CG 4.24Å; P69-R71 PolarHBondContact O-N 3.01Å; P69-Y72 HydrophobicContact CB-CD2 3.82Å; P69-Y72 HydrophobicContact CB-CE2 4.06Å; P69-Y72 HydrophobicContact CG-CD2 3.81Å; P69-Y72 HydrophobicContact CG-CE2 3.82Å; P69-Y72 PolarHBondContact O-N 2.73Å
70	E	35.1	Very low	36.9	Very low	138 Å²	138	100.4 Å²	100.4	65%	0.645	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-48.5	-38.6	-171.5	-154.1	171.1	-157.7	0	0	112.2	I68 Y72 R73 F74	I68-E70 PolarHBondContact O-N 2.76Å; E70-Y72 PolarHBondContact O-N 3.27Å; E70-Y72 VanDerWaalsContact O-N 3.08Å; E70-R73 VanDerWaalsContact O-CB 3.24Å; E70-R73 WeakPolarHBondContact O-CB 3.03Å; E70-R73 PolarHBondContact O-N 3.32Å; E70-F74 HydrophobicContact CG-CE2 4.33Å; E70-F74 WeakPolarHBondContact O-CD2 3.24Å; E70-F74 WeakPolarHBondContact O-CE2 2.88Å
71	R	31.9	Very low	38.2	Very low	165 Å²	165	103.6 Å²	103.6	62%	0.623	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-55.6	-22.2	175.8	72.3	177.5	-178.1	-98.3	0.1	116.1	P69 F74	P69-R71 HydrophobicContact CB-CG 4.24Å; P69-R71 PolarHBondContact O-N 3.01Å; R71-F74 VanDerWaalsContact CA-CD2 3.48Å; R71-F74 WeakPolarHBondContact O-CD2 3.35Å
72	Y	30.7	Very low	40	Very low	101 Å²	101	98.6 Å²	98.6	40%	0.396	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-94.1	-7.1	176.7	-60.8	-80.3	0	0	0	113.3	P69 E70 F74	P69-Y72 HydrophobicContact CB-CD2 3.82Å; P69-Y72 HydrophobicContact CB-CE2 4.06Å; P69-Y72 HydrophobicContact CG-CD2 3.81Å; P69-Y72 HydrophobicContact CG-CE2 3.82Å; P69-Y72 PolarHBondContact O-N 2.73Å; E70-Y72 PolarHBondContact O-N 3.27Å; E70-Y72 VanDerWaalsContact O-N 3.08Å; Y72-F74 PolarHBondContact O-N 2.9Å
73	R	36.8	Very low	41.7	Very low	140 Å²	140	94 Å²	94	53%	0.528	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-6.7	164.3	-59.5	-179	174	178.9	-5.6	112.2	E70	E70-R73 VanDerWaalsContact O-CB 3.24Å; E70-R73 WeakPolarHBondContact O-CB 3.03Å; E70-R73 PolarHBondContact O-N 3.32Å
74	F	34.4	Very low	43.7	Very low	142 Å²	142	91.6 Å²	91.6	62%	0.623	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	10.8	-169.5	-65.9	-88.5	0	0	0	115.3	E70 R71 Y72 N76	E70-F74 HydrophobicContact CG-CE2 4.33Å; E70-F74 WeakPolarHBondContact O-CD2 3.24Å; E70-F74 WeakPolarHBondContact O-CE2 2.88Å; R71-F74 VanDerWaalsContact CA-CD2 3.48Å; R71-F74 WeakPolarHBondContact O-CD2 3.35Å; Y72-F74 PolarHBondContact O-N 2.9Å; F74-N76 PolarHBondContact O-N 2.81Å
75	L	42	Very low	46	Very low	65 Å²	65	88.4 Å²	88.4	34%	0.34	43%	0.425	S	S	.	.	S	Bend	trans	-77.5	48.3	164.2	-73.1	150.7	0	0	0	109.6	L52 H56 G77	L52-L75 HydrophobicContact CD1-CD1 4.15Å; L52-L75 HydrophobicContact CD2-CB 4.42Å; L52-L75 HydrophobicContact CD2-CD1 3.35Å; L52-L75 HydrophobicContact CD2-CD2 3.85Å; L52-L75 HydrophobicContact CD2-CG 4.03Å; L52-L75 HydrophobicContact CG-CD1 4.28Å; H56-L75 VanDerWaalsContact CD2-CD2 3.48Å; H56-L75 WeakPolarHBondContact CD2-CD2 3.34Å; L75-G77 PolarHBondContact O-N 3.39Å
76	N	44.5	Very low	48.3	Very low	100 Å²	100	88.1 Å²	88.1	54%	0.535	42%	0.424	S	S	.	.	S	Bend	trans	41.6	6.1	-171.6	-69.2	-30	0	0	0	116.8	F74 I118 L119	F74-N76 PolarHBondContact O-N 2.81Å; N76-I118 HydrophobicContact CB-CG2 4.24Å; N76-I118 CarbonylContact O-C 3.48Å; N76-I118 WeakPolarHBondContact O-CA 3.06Å; N76-L119 WeakPolarHBondContact CB-O 3.15Å; N76-L119 WeakPolarHBondContact O-CB 3.32Å; N76-L119 PolarHBondContact O-N 2.83Å
77	G	45	Very low	50.1	Low	5 Å²	5	81.9 Å²	81.9	5%	0.052	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.5	-171.3	0	0	0	0	0	110.7	L75 C117	L75-G77 PolarHBondContact O-N 3.39Å; G77-C117 CarbonylContact C-O 3.51Å; G77-C117 WeakPolarHBondContact CA-O 3.03Å
78	I	46	Very low	52.4	Low	77 Å²	77	84.1 Å²	84.1	40%	0.395	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.6	170.2	57.2	170.9	0	0	0	109.4	V80 C117	I78-V80 HydrophobicContact CB-CG2 4.38Å; I78-V80 HydrophobicContact CD1-CG2 3.57Å; I78-V80 HydrophobicContact CG1-CG2 3.69Å; I78-C117 HydrophobicContact CG1-CB 4.03Å; I78-C117 PolarHBondContact N-O 2.76Å; I78-C117 PolarHBondContact O-N 3.04Å
79	F	54	Low	54.6	Low	88 Å²	88	81.7 Å²	81.7	39%	0.386	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	126.2	162.8	-72.1	-79.4	0	0	0	108.3	T22 L44 L114 V115 F116	T22-F79 HydrophobicContact CG2-CE1 4.22Å; L44-F79 HydrophobicContact CD2-CE1 3.27Å; L44-F79 HydrophobicContact CD2-CZ 3.42Å; L44-F79 VanDerWaalsContact CD2-CZ 3.42Å; L44-F79 HydrophobicContact CG-CZ 4.49Å; F79-L114 HydrophobicContact CB-CD2 4.42Å; F79-V115 CarbonylContact C-O 3.59Å; F79-V115 WeakPolarHBondContact CA-O 3.41Å; F79-F116 HydrophobicContact CD1-CB 3.98Å; F79-F116 AromaticContact CD1-CD2 3.89Å; F79-F116 HydrophobicContact CD1-CD2 3.89Å; F79-F116 HydrophobicContact CD1-CG 4.41Å; F79-F116 AromaticContact CD2-CD2 3.84Å; F79-F116 HydrophobicContact CD2-CD2 3.84Å; F79-F116 HydrophobicContact CD2-CE2 4.23Å; F79-F116 HydrophobicContact CE1-CB 3.71Å; F79-F116 AromaticContact CE1-CD2 3.62Å; F79-F116 HydrophobicContact CE1-CD2 3.62Å; F79-F116 HydrophobicContact CE1-CG 4.01Å; F79-F116 AromaticContact CE2-CD2 3.56Å; F79-F116 HydrophobicContact CE2-CD2 3.56Å; F79-F116 AromaticContact CE2-CE2 3.79Å; F79-F116 HydrophobicContact CE2-CE2 3.79Å; F79-F116 AromaticContact CG-CD2 4Å; F79-F116 HydrophobicContact CG-CD2 4Å; F79-F116 HydrophobicContact CZ-CB 4.32Å; F79-F116 AromaticContact CZ-CD2 3.44Å; F79-F116 HydrophobicContact CZ-CD2 3.44Å; F79-F116 VanDerWaalsContact CZ-CD2 3.44Å; F79-F116 AromaticContact CZ-CE2 3.98Å; F79-F116 HydrophobicContact CZ-CE2 3.98Å; F79-F116 HydrophobicContact CZ-CG 4.12Å
80	V	51.7	Low	56.9	Low	38 Å²	38	81.3 Å²	81.3	23%	0.23	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	117.3	175	-164.3	0	0	0	0	107.9	I78 Q82 V115	I78-V80 HydrophobicContact CB-CG2 4.38Å; I78-V80 HydrophobicContact CD1-CG2 3.57Å; I78-V80 HydrophobicContact CG1-CG2 3.69Å; V80-Q82 HydrophobicContact CG1-CG 4.44Å; V80-Q82 PolarHBondContact O-N 3.04Å; V80-V115 PolarHBondContact N-O 2.82Å; V80-V115 PolarHBondContact O-N 2.72Å
81	R	59.8	Low	58.9	Low	104 Å²	104	74.9 Å²	74.9	39%	0.392	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	117.8	168.2	-175.5	172.7	-68.3	-86.2	1.9	108.4	E24 S112 V113 L114	E24-R81 IonicContact OE1-NH2 3.99Å; R81-S112 PolarHBondContact NH1-OG 2.72Å; R81-S112 VanDerWaalsContact NH1-OG 3.13Å; R81-V113 WeakPolarHBondContact CA-O 3.46Å; R81-L114 HydrophobicContact CB-CD2 4.32Å
82	Q	64.3	Low	60.8	Low	48 Å²	48	68.5 Å²	68.5	22%	0.224	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.5	179.9	-70.7	-67.1	-38.9	0	0	109	V80 S112 V113 V115 V142	V80-Q82 HydrophobicContact CG1-CG 4.44Å; V80-Q82 PolarHBondContact O-N 3.04Å; Q82-S112 CarbonylContact O-C 3.56Å; Q82-S112 WeakPolarHBondContact O-CA 3.29Å; Q82-S112 WeakPolarHBondContact O-CB 3.35Å; Q82-V113 HydrophobicContact CB-CG2 4.48Å; Q82-V113 PolarHBondContact N-O 3.43Å; Q82-V113 PolarHBondContact O-N 2.81Å; Q82-V115 HydrophobicContact CB-CG2 4.13Å; Q82-V115 HydrophobicContact CG-CB 4.46Å; Q82-V115 HydrophobicContact CG-CG2 3.96Å; Q82-V142 HydrophobicContact CB-CG1 4.26Å; Q82-V142 HydrophobicContact CB-CG2 3.63Å; Q82-V142 HydrophobicContact CG-CG2 3.79Å
83	P	66.2	Low	62.6	Low	89 Å²	89	65 Å²	65	58%	0.578	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	148.9	172.9	29.4	-33.8	0	0	0	110.2	D111	P83-D111 WeakPolarHBondContact CA-O 3.41Å
84	L	72.3	Confident	64.2	Low	10 Å²	10	65.1 Å²	65.1	5%	0.052	33%	0.332	C	S	.	.			trans	-74.5	141.7	170.1	-63.7	-179.6	0	0	0	109.8	H86 G87 M110 D111 V113 E146 F150	L84-H86 VanDerWaalsContact C-N 3.33Å; L84-H86 PolarHBondContact O-N 3.4Å; L84-G87 WeakPolarHBondContact CB-O 3.48Å; L84-G87 PolarHBondContact O-N 3.03Å; L84-G87 VanDerWaalsContact O-N 3.11Å; L84-M110 HydrophobicContact CD1-CB 4.39Å; L84-M110 WeakPolarHBondContact CD1-O 3.48Å; L84-D111 PolarHBondContact N-O 3.16Å; L84-V113 HydrophobicContact CD2-CG1 4.02Å; L84-V113 HydrophobicContact CD2-CG2 4.28Å; L84-E146 HydrophobicContact CD2-CB 4.21Å; L84-E146 HydrophobicContact CD2-CG 4.05Å; L84-F150 HydrophobicContact CD1-CD1 3.65Å; L84-F150 HydrophobicContact CD1-CE1 3.99Å; L84-F150 HydrophobicContact CD1-CG 4.05Å; L84-F150 HydrophobicContact CD2-CD2 4.4Å; L84-F150 HydrophobicContact CD2-CG 4.44Å
85	E	78.3	Confident	66.3	Low	105 Å²	105	64.2 Å²	64.2	49%	0.491	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-37	-177.3	-171.9	166	-147.5	0	0	111.9	G87 R143 E146	E85-G87 VanDerWaalsContact C-N 3.3Å; E85-R143 IonicContact OE1-CZ 3.22Å; E85-R143 IonicContact OE1-NE 3.82Å; E85-R143 PolarHBondContact OE1-NE 3.13Å; E85-R143 IonicContact OE1-NH2 3.46Å; E85-R143 PolarHBondContact OE1-NH2 2.83Å; E85-R143 WeakPolarHBondContact OE2-CG 3.2Å; E85-R143 IonicContact OE2-NE 2.85Å; E85-R143 PolarHBondContact OE2-NE 2.84Å; E85-R143 VanDerWaalsContact OE2-NE 3.08Å; E85-E146 WeakPolarHBondContact CB-OE2 2.8Å; E85-E146 VanDerWaalsContact N-CD 3.29Å; E85-E146 PolarHBondContact N-OE1 3.41Å; E85-E146 VanDerWaalsContact N-OE1 3.16Å; E85-E146 PolarHBondContact N-OE2 2.66Å
86	H	80.3	Confident	67.9	Low	109 Å²	109	63.4 Å²	63.4	51%	0.505	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	2.9	177.2	-53.6	89.8	0	0	0	113	L84 E146 P152	L84-H86 VanDerWaalsContact C-N 3.33Å; L84-H86 PolarHBondContact O-N 3.4Å; H86-E146 WeakPolarHBondContact CB-OE1 3.5Å; H86-E146 IonicContact CE1-OE1 2.72Å; H86-E146 IonicContact CG-OE1 3.08Å; H86-E146 PolarHBondContact N-OE1 3.24Å; H86-E146 IonicContact ND1-OE1 3.41Å; H86-E146 PolarHBondContact ND1-OE1 2.83Å; H86-E146 IonicContact ND1-OE2 3.85Å; H86-P152 HydrophobicContact CB-CB 4.06Å; H86-P152 HydrophobicContact CB-CG 3.67Å
87	G	78.8	Confident	69.5	Low	27 Å²	27	61 Å²	61	28%	0.278	33%	0.333	S	S	.	.	S	Bend	trans	68.1	-136.5	-172.8	0	0	0	0	0	112	L84 E85 S89	L84-G87 WeakPolarHBondContact CB-O 3.48Å; L84-G87 PolarHBondContact O-N 3.03Å; L84-G87 VanDerWaalsContact O-N 3.11Å; E85-G87 VanDerWaalsContact C-N 3.3Å; G87-S89 PolarHBondContact O-N 3.14Å; G87-S89 VanDerWaalsContact O-N 3.14Å; G87-S89 PolarHBondContact O-OG 2.88Å
88	M	81.9	Confident	71.3	Confident	113 Å²	113	63.5 Å²	63.5	56%	0.557	35%	0.348	S	S	*	.	S	Bend	trans	-61.5	118.4	-172.8	-160.1	179.3	-60.3	0	0	111.7	M110 V153	M88-M110 CarbonylContact C-O 3.52Å; M88-M110 WeakPolarHBondContact CA-O 3.33Å; M88-V153 HydrophobicContact CG-CG2 4.36Å; M88-V153 WeakPolarHBondContact O-CB 3.27Å; M88-V153 WeakPolarHBondContact O-CG2 3.25Å; M88-V153 PolarHBondContact O-N 2.7Å
89	S	79.6	Confident	72.5	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	145.6	-172.8	-62.5	0	0	0	0	111.3	G87 T109 M110 K151	G87-S89 PolarHBondContact O-N 3.14Å; G87-S89 VanDerWaalsContact O-N 3.14Å; G87-S89 PolarHBondContact O-OG 2.88Å; S89-T109 CarbonylContact O-C 3.57Å; S89-T109 VanDerWaalsContact O-CA 3.24Å; S89-T109 WeakPolarHBondContact O-CA 3.34Å; S89-M110 PolarHBondContact N-O 3.05Å; S89-M110 PolarHBondContact O-N 2.77Å; S89-K151 CarbonylContact C-O 3.58Å; S89-K151 VanDerWaalsContact CA-O 3.23Å; S89-K151 WeakPolarHBondContact CA-O 3.1Å; S89-K151 WeakPolarHBondContact CB-O 3.46Å
90	Y	81.7	Confident	73.5	Confident	44 Å²	44	62.9 Å²	62.9	17%	0.173	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	130.8	169.8	-65.9	-67.9	0	0	0	110.1	P98 P107 M108 T109 F150 K151 V153	Y90-P98 HydrophobicContact CD1-CB 4.37Å; Y90-P98 HydrophobicContact CG-CB 4.45Å; Y90-P107 HydrophobicContact CD1-CB 3.72Å; Y90-P107 HydrophobicContact CE1-CB 3.72Å; Y90-M108 WeakPolarHBondContact CA-O 3.44Å; Y90-T109 HydrophobicContact CD1-CG2 3.71Å; Y90-T109 HydrophobicContact CE1-CG2 3.76Å; Y90-F150 CarbonylContact O-C 3.54Å; Y90-F150 VanDerWaalsContact O-CA 3.27Å; Y90-F150 WeakPolarHBondContact O-CA 3.44Å; Y90-K151 PolarHBondContact N-O 2.91Å; Y90-K151 PolarHBondContact O-N 3.27Å; Y90-V153 HydrophobicContact CD1-CG2 4.32Å; Y90-V153 HydrophobicContact CD2-CG2 3.85Å; Y90-V153 HydrophobicContact CE1-CG2 4.19Å; Y90-V153 HydrophobicContact CE2-CB 4.1Å; Y90-V153 HydrophobicContact CE2-CG1 3.99Å; Y90-V153 HydrophobicContact CE2-CG2 3.72Å; Y90-V153 HydrophobicContact CG-CG2 4.15Å
91	L	76.1	Confident	74.3	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.016	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	134.3	164.9	179.3	64.7	0	0	0	108.9	L23 P98 R99 M108 F149 F150	L23-L91 HydrophobicContact CD1-CD1 4.02Å; L23-L91 HydrophobicContact CD1-CD2 4.05Å; L23-L91 HydrophobicContact CD2-CD1 3.99Å; L23-L91 HydrophobicContact CD2-CD2 4.3Å; L91-P98 CarbonylContact O-C 3.55Å; L91-P98 WeakPolarHBondContact O-CA 3.11Å; L91-R99 HydrophobicContact CB-CB 4.49Å; L91-R99 HydrophobicContact CD2-CB 4.32Å; L91-R99 HydrophobicContact CG-CB 4.18Å; L91-R99 PolarHBondContact O-N 2.72Å; L91-M108 HydrophobicContact CB-CB 4.29Å; L91-M108 HydrophobicContact CD2-CE 4.49Å; L91-M108 HydrophobicContact CD2-SD 4.32Å; L91-M108 PolarHBondContact N-O 3.3Å; L91-F149 CarbonylContact C-O 3.34Å; L91-F149 WeakPolarHBondContact CA-O 3.48Å; L91-F149 HydrophobicContact CD1-CB 4.36Å; L91-F150 HydrophobicContact CB-CE1 4.32Å; L91-F150 HydrophobicContact CD1-CE1 3.9Å; L91-F150 HydrophobicContact CD1-CE2 4.33Å; L91-F150 HydrophobicContact CD1-CZ 3.82Å
92	L	73	Confident	74.7	Confident	30 Å²	30	66.1 Å²	66.1	16%	0.157	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-100	143.1	-177.8	-56.5	-177.5	0	0	0	111.4	S97 F149 K151	L92-S97 CarbonylContact C-O 3.58Å; L92-S97 WeakPolarHBondContact CA-O 3.42Å; L92-F149 WeakPolarHBondContact CB-O 3.25Å; L92-F149 WeakPolarHBondContact CG-O 3.21Å; L92-F149 PolarHBondContact N-O 3.34Å; L92-K151 HydrophobicContact CD1-CB 4.23Å; L92-K151 HydrophobicContact CD2-CB 3.91Å; L92-K151 HydrophobicContact CG-CB 4.35Å
93	A	68.5	Low	74.8	Confident	27 Å²	27	68.9 Å²	68.9	22%	0.223	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-83.2	170.1	166.5	0	0	0	0	0	110.7	N95 G96 S97 R99	A93-N95 PolarHBondContact O-N 2.88Å; A93-G96 WeakPolarHBondContact O-CA 3.19Å; A93-G96 PolarHBondContact O-N 2.89Å; A93-S97 PolarHBondContact N-O 2.98Å; A93-R99 HydrophobicContact CB-CB 4.39Å
94	N	70.1	Confident	75.4	Confident	144 Å²	144	68.7 Å²	68.7	77%	0.77	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.4	-177.3	-63	0.2	0	0	0	114	G96	N94-G96 VanDerWaalsContact C-N 3.33Å
95	N	77.8	Confident	75.6	Confident	122 Å²	122	70.1 Å²	70.1	65%	0.652	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	7.2	175.8	64.8	2.7	0	0	0	113.3	A93 S97	A93-N95 PolarHBondContact O-N 2.88Å; N95-S97 VanDerWaalsContact C-N 3.25Å; N95-S97 PolarHBondContact ND2-OG 3.05Å; N95-S97 VanDerWaalsContact ND2-OG 3.12Å; N95-S97 PolarHBondContact O-N 3.2Å; N95-S97 WeakPolarHBondContact OD1-CB 3.39Å; N95-S97 PolarHBondContact OD1-N 3.24Å; N95-S97 PolarHBondContact OD1-OG 3.33Å
96	G	75.1	Confident	75.8	Confident	49 Å²	49	71 Å²	71	51%	0.505	40%	0.403	S	S	.	.	S	Bend	trans	77	0.8	-177.4	0	0	0	0	0	115.3	A93 N94	A93-G96 WeakPolarHBondContact O-CA 3.19Å; A93-G96 PolarHBondContact O-N 2.89Å; N94-G96 VanDerWaalsContact C-N 3.33Å
97	S	79.5	Confident	75.7	Confident	50 Å²	50	68.1 Å²	68.1	35%	0.35	39%	0.394	S	S	.	.	S	Bend	trans	-73.3	153.7	173.1	-42.4	0	0	0	0	110.4	L92 A93 N95 R99	L92-S97 CarbonylContact C-O 3.58Å; L92-S97 WeakPolarHBondContact CA-O 3.42Å; A93-S97 PolarHBondContact N-O 2.98Å; N95-S97 VanDerWaalsContact C-N 3.25Å; N95-S97 PolarHBondContact ND2-OG 3.05Å; N95-S97 VanDerWaalsContact ND2-OG 3.12Å; N95-S97 PolarHBondContact O-N 3.2Å; N95-S97 WeakPolarHBondContact OD1-CB 3.39Å; N95-S97 PolarHBondContact OD1-N 3.24Å; N95-S97 PolarHBondContact OD1-OG 3.33Å; S97-R99 PolarHBondContact O-N 2.74Å
98	P	81.3	Confident	75.5	Confident	57 Å²	57	68.4 Å²	68.4	37%	0.37	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-56	129.8	165.1	-22.2	33.7	0	0	0	110.5	Y90 L91 P107	Y90-P98 HydrophobicContact CD1-CB 4.37Å; Y90-P98 HydrophobicContact CG-CB 4.45Å; L91-P98 CarbonylContact O-C 3.55Å; L91-P98 WeakPolarHBondContact O-CA 3.11Å; P98-P107 HydrophobicContact CB-CB 3.87Å; P98-P107 HydrophobicContact CB-CG 4.36Å
99	R	72	Confident	75.3	Confident	59 Å²	59	66.2 Å²	66.2	22%	0.223	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-72.4	136.7	174.3	-165.6	179.7	-103.3	-124.9	2.7	108.7	Q26 L91 A93 S97 P107 M108	Q26-R99 VanDerWaalsContact OE1-NE 3.16Å; L91-R99 HydrophobicContact CB-CB 4.49Å; L91-R99 HydrophobicContact CD2-CB 4.32Å; L91-R99 HydrophobicContact CG-CB 4.18Å; L91-R99 PolarHBondContact O-N 2.72Å; A93-R99 HydrophobicContact CB-CB 4.39Å; S97-R99 PolarHBondContact O-N 2.74Å; R99-P107 WeakPolarHBondContact O-CA 3.31Å; R99-M108 PolarHBondContact O-N 2.81Å
100	L	74.5	Confident	75	Confident	93 Å²	93	67.9 Å²	67.9	49%	0.487	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-96.3	137.9	-177.5	-53.4	-178.1	0	0	0	110.4	K102 Q106 P107	L100-K102 PolarHBondContact O-N 3.32Å; L100-Q106 CarbonylContact C-O 3.43Å; L100-Q106 WeakPolarHBondContact CA-O 3.49Å; L100-P107 HydrophobicContact CD2-CB 4.5Å; L100-P107 HydrophobicContact CD2-CG 4.05Å
101	D	68.3	Low	74.6	Confident	43 Å²	43	70.3 Å²	70.3	23%	0.23	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-64.9	128.6	168.4	174.7	-87.4	0	0	0	109.1	S103 T104 G105 Q106 M108	D101-S103 PolarHBondContact O-N 3Å; D101-S103 WeakPolarHBondContact OD1-CA 3.37Å; D101-S103 WeakPolarHBondContact OD1-CB 3.26Å; D101-S103 PolarHBondContact OD1-N 2.82Å; D101-S103 PolarHBondContact OD1-OG 3.46Å; D101-T104 WeakPolarHBondContact CB-OG1 3.5Å; D101-T104 PolarHBondContact OD1-N 3.1Å; D101-T104 PolarHBondContact OD1-OG1 2.94Å; D101-G105 VanDerWaalsContact O-CA 3.22Å; D101-G105 WeakPolarHBondContact O-CA 3.29Å; D101-G105 PolarHBondContact O-N 3.43Å; D101-Q106 PolarHBondContact N-O 3.37Å; D101-M108 HydrophobicContact CB-CG 3.81Å; D101-M108 HydrophobicContact CB-SD 4.45Å
102	K	69.7	Low	74	Confident	167 Å²	167	70.8 Å²	70.8	73%	0.726	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-24.2	-173.7	-68.6	-179.4	-179.2	172.1	0	113	D27 L100	D27-K102 IonicContact OD2-NZ 3.86Å; L100-K102 PolarHBondContact O-N 3.32Å
103	S	66.3	Low	73.5	Confident	106 Å²	106	69.5 Å²	69.5	74%	0.741	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-36.5	-176.3	72.3	0	0	0	0	112.8	D101	D101-S103 PolarHBondContact O-N 3Å; D101-S103 WeakPolarHBondContact OD1-CA 3.37Å; D101-S103 WeakPolarHBondContact OD1-CB 3.26Å; D101-S103 PolarHBondContact OD1-N 2.82Å; D101-S103 PolarHBondContact OD1-OG 3.46Å
104	T	78.2	Confident	72.9	Confident	85 Å²	85	69.1 Å²	69.1	52%	0.521	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-18.7	-175.4	62.6	0	0	0	0	113.2	D101 Q106	D101-T104 WeakPolarHBondContact CB-OG1 3.5Å; D101-T104 PolarHBondContact OD1-N 3.1Å; D101-T104 PolarHBondContact OD1-OG1 2.94Å; T104-Q106 PolarHBondContact O-N 3.11Å; T104-Q106 PolarHBondContact OG1-N 2.81Å
105	G	76.8	Confident	72.4	Confident	39 Å²	39	62.3 Å²	62.3	40%	0.402	36%	0.361	S	S	.	.			trans	67.9	7.7	-172	0	0	0	0	0	113.9	D101	D101-G105 VanDerWaalsContact O-CA 3.22Å; D101-G105 WeakPolarHBondContact O-CA 3.29Å; D101-G105 PolarHBondContact O-N 3.43Å
106	Q	81.3	Confident	71.5	Confident	123 Å²	123	57.6 Å²	57.6	58%	0.575	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-90.7	150.2	-177.2	-63	-56.2	-37.6	0	0	111.7	L100 D101 T104 M108	L100-Q106 CarbonylContact C-O 3.43Å; L100-Q106 WeakPolarHBondContact CA-O 3.49Å; D101-Q106 PolarHBondContact N-O 3.37Å; T104-Q106 PolarHBondContact O-N 3.11Å; T104-Q106 PolarHBondContact OG1-N 2.81Å; Q106-M108 PolarHBondContact O-N 3.42Å
107	P	79.7	Confident	70.3	Confident	50 Å²	50	55.4 Å²	55.4	33%	0.325	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-53.9	126.9	171.9	-26.5	35.9	0	0	0	111.6	Y90 P98 R99 L100	Y90-P107 HydrophobicContact CD1-CB 3.72Å; Y90-P107 HydrophobicContact CE1-CB 3.72Å; P98-P107 HydrophobicContact CB-CB 3.87Å; P98-P107 HydrophobicContact CB-CG 4.36Å; R99-P107 WeakPolarHBondContact O-CA 3.31Å; L100-P107 HydrophobicContact CD2-CB 4.5Å; L100-P107 HydrophobicContact CD2-CG 4.05Å
108	M	72.9	Confident	68.9	Low	33 Å²	33	55.2 Å²	55.2	16%	0.163	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-73.7	132.7	175.6	-65.6	178.8	71.9	0	0	110	Q26 Y90 L91 R99 D101 Q106	Q26-M108 PolarHBondContact NE2-SD 2.87Å; Y90-M108 WeakPolarHBondContact CA-O 3.44Å; L91-M108 HydrophobicContact CB-CB 4.29Å; L91-M108 HydrophobicContact CD2-CE 4.49Å; L91-M108 HydrophobicContact CD2-SD 4.32Å; L91-M108 PolarHBondContact N-O 3.3Å; R99-M108 PolarHBondContact O-N 2.81Å; D101-M108 HydrophobicContact CB-CG 3.81Å; D101-M108 HydrophobicContact CB-SD 4.45Å; Q106-M108 PolarHBondContact O-N 3.42Å
109	T	79	Confident	67.1	Low	67 Å²	67	55.1 Å²	55.1	41%	0.411	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	146.5	170.4	57.3	0	0	0	0	110.5	S89 Y90 V153	S89-T109 CarbonylContact O-C 3.57Å; S89-T109 VanDerWaalsContact O-CA 3.24Å; S89-T109 WeakPolarHBondContact O-CA 3.34Å; Y90-T109 HydrophobicContact CD1-CG2 3.71Å; Y90-T109 HydrophobicContact CE1-CG2 3.76Å; T109-V153 HydrophobicContact CG2-CG2 3.81Å
110	M	72.6	Confident	65.8	Low	35 Å²	35	55.2 Å²	55.2	17%	0.172	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	150.6	175.4	-56	-172.2	78.3	0	0	109.3	L23 L84 M88 S89 S112 F150	L23-M110 HydrophobicContact CD2-CE 4.26Å; L23-M110 HydrophobicContact CD2-SD 3.63Å; L84-M110 HydrophobicContact CD1-CB 4.39Å; L84-M110 WeakPolarHBondContact CD1-O 3.48Å; M88-M110 CarbonylContact C-O 3.52Å; M88-M110 WeakPolarHBondContact CA-O 3.33Å; S89-M110 PolarHBondContact N-O 3.05Å; S89-M110 PolarHBondContact O-N 2.77Å; M110-S112 WeakPolarHBondContact CE-O 3.42Å; M110-F150 HydrophobicContact CB-CE1 3.9Å; M110-F150 HydrophobicContact CG-CE1 4.12Å; M110-F150 HydrophobicContact SD-CE1 3.82Å; M110-F150 HydrophobicContact SD-CZ 4.08Å
111	D	73.3	Confident	64.2	Low	94 Å²	94	53.4 Å²	53.4	50%	0.503	30%	0.299	S	S	.	.	S	Bend	trans	-115.5	-7.5	172.8	64.2	-7.5	0	0	0	112.4	P83 L84	P83-D111 WeakPolarHBondContact CA-O 3.41Å; L84-D111 PolarHBondContact N-O 3.16Å
112	S	63.6	Low	63.1	Low	14 Å²	14	57.7 Å²	57.7	10%	0.098	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	156.3	-178.6	58.9	0	0	0	0	111	R81 Q82 M110	R81-S112 PolarHBondContact NH1-OG 2.72Å; R81-S112 VanDerWaalsContact NH1-OG 3.13Å; Q82-S112 CarbonylContact O-C 3.56Å; Q82-S112 WeakPolarHBondContact O-CA 3.29Å; Q82-S112 WeakPolarHBondContact O-CB 3.35Å; M110-S112 WeakPolarHBondContact CE-O 3.42Å
113	V	63.7	Low	62	Low	3 Å²	3	54.7 Å²	54.7	2%	0.018	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.7	174.8	-68.8	0	0	0	0	110	R81 Q82 L84 V115 V142 F150	R81-V113 WeakPolarHBondContact CA-O 3.46Å; Q82-V113 HydrophobicContact CB-CG2 4.48Å; Q82-V113 PolarHBondContact N-O 3.43Å; Q82-V113 PolarHBondContact O-N 2.81Å; L84-V113 HydrophobicContact CD2-CG1 4.02Å; L84-V113 HydrophobicContact CD2-CG2 4.28Å; V113-V115 HydrophobicContact CG2-CG2 4.01Å; V113-V142 HydrophobicContact CG2-CG1 4.37Å; V113-F150 HydrophobicContact CG1-CE1 4.3Å; V113-F150 HydrophobicContact CG1-CE2 3.84Å; V113-F150 HydrophobicContact CG1-CZ 3.45Å; V113-F150 VanDerWaalsContact CG1-CZ 3.45Å
114	L	55.9	Low	61	Low	19 Å²	19	53.4 Å²	53.4	10%	0.099	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	118	172.6	-86.6	156.7	0	0	0	108.6	G21 T22 F79 R81	G21-L114 CarbonylContact C-O 3.52Å; G21-L114 WeakPolarHBondContact CA-O 3.43Å; T22-L114 PolarHBondContact N-O 3.32Å; T22-L114 WeakPolarHBondContact OG1-CB 3.37Å; F79-L114 HydrophobicContact CB-CD2 4.42Å; R81-L114 HydrophobicContact CB-CD2 4.32Å
115	V	59.1	Low	59.4	Low	1 Å²	1	54.6 Å²	54.6	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	129.6	179.6	-174.1	0	0	0	0	108.8	A20 F79 V80 Q82 V113 V142	A20-V115 HydrophobicContact CB-CG1 4.1Å; F79-V115 CarbonylContact C-O 3.59Å; F79-V115 WeakPolarHBondContact CA-O 3.41Å; V80-V115 PolarHBondContact N-O 2.82Å; V80-V115 PolarHBondContact O-N 2.72Å; Q82-V115 HydrophobicContact CB-CG2 4.13Å; Q82-V115 HydrophobicContact CG-CB 4.46Å; Q82-V115 HydrophobicContact CG-CG2 3.96Å; V113-V115 HydrophobicContact CG2-CG2 4.01Å; V115-V142 HydrophobicContact CG2-CG2 3.81Å
116	F	58.4	Low	58.2	Low	23 Å²	23	60.5 Å²	60.5	10%	0.101	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113	172	-175.9	-108.8	0	0	0	109.7	V19 L44 F79 I118	V19-F116 HydrophobicContact CB-CB 4.43Å; V19-F116 HydrophobicContact CB-CD1 4.05Å; V19-F116 CarbonylContact O-C 3.48Å; V19-F116 VanDerWaalsContact O-CB 3.29Å; V19-F116 WeakPolarHBondContact O-CB 3.29Å; V19-F116 PolarHBondContact O-N 2.73Å; L44-F116 HydrophobicContact CD2-CB 4.32Å; F79-F116 HydrophobicContact CD1-CB 3.98Å; F79-F116 AromaticContact CD1-CD2 3.89Å; F79-F116 HydrophobicContact CD1-CD2 3.89Å; F79-F116 HydrophobicContact CD1-CG 4.41Å; F79-F116 AromaticContact CD2-CD2 3.84Å; F79-F116 HydrophobicContact CD2-CD2 3.84Å; F79-F116 HydrophobicContact CD2-CE2 4.23Å; F79-F116 HydrophobicContact CE1-CB 3.71Å; F79-F116 AromaticContact CE1-CD2 3.62Å; F79-F116 HydrophobicContact CE1-CD2 3.62Å; F79-F116 HydrophobicContact CE1-CG 4.01Å; F79-F116 AromaticContact CE2-CD2 3.56Å; F79-F116 HydrophobicContact CE2-CD2 3.56Å; F79-F116 AromaticContact CE2-CE2 3.79Å; F79-F116 HydrophobicContact CE2-CE2 3.79Å; F79-F116 AromaticContact CG-CD2 4Å; F79-F116 HydrophobicContact CG-CD2 4Å; F79-F116 HydrophobicContact CZ-CB 4.32Å; F79-F116 AromaticContact CZ-CD2 3.44Å; F79-F116 HydrophobicContact CZ-CD2 3.44Å; F79-F116 VanDerWaalsContact CZ-CD2 3.44Å; F79-F116 AromaticContact CZ-CE2 3.98Å; F79-F116 HydrophobicContact CZ-CE2 3.98Å; F79-F116 HydrophobicContact CZ-CG 4.12Å; F116-I118 HydrophobicContact CD1-CD1 4.23Å; F116-I118 HydrophobicContact CD1-CG1 3.79Å; F116-I118 HydrophobicContact CE1-CD1 3.77Å; F116-I118 HydrophobicContact CE1-CG1 3.41Å; F116-I118 VanDerWaalsContact CE1-CG1 3.41Å; F116-I118 HydrophobicContact CZ-CG1 4.27Å
117	C	50.5	Low	57.1	Low	2 Å²	2	60.1 Å²	60.1	1%	0.014	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	106.9	-175.2	-60.2	0	0	0	0	109.6	G77 I78 Y132 W136	G77-C117 CarbonylContact C-O 3.51Å; G77-C117 WeakPolarHBondContact CA-O 3.03Å; I78-C117 HydrophobicContact CG1-CB 4.03Å; I78-C117 PolarHBondContact N-O 2.76Å; I78-C117 PolarHBondContact O-N 3.04Å; C117-Y132 HydrophobicContact CB-CE1 4.14Å; C117-W136 HydrophobicContact CB-CH2 3.91Å; C117-W136 HydrophobicContact CB-CZ3 4.22Å
118	I	48.8	Very low	55.5	Low	46 Å²	46	60.5 Å²	60.5	24%	0.236	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.7	172.6	-55.3	174.1	0	0	0	109.3	N76 F116 I120	N76-I118 HydrophobicContact CB-CG2 4.24Å; N76-I118 CarbonylContact O-C 3.48Å; N76-I118 WeakPolarHBondContact O-CA 3.06Å; F116-I118 HydrophobicContact CD1-CD1 4.23Å; F116-I118 HydrophobicContact CD1-CG1 3.79Å; F116-I118 HydrophobicContact CE1-CD1 3.77Å; F116-I118 HydrophobicContact CE1-CG1 3.41Å; F116-I118 VanDerWaalsContact CE1-CG1 3.41Å; F116-I118 HydrophobicContact CZ-CG1 4.27Å; I118-I120 PolarHBondContact O-N 3.05Å
119	L	44.4	Very low	54	Low	56 Å²	56	61.5 Å²	61.5	29%	0.293	35%	0.351	S	S	.	.			trans	-72.4	109.1	168	-173.7	68.9	0	0	0	108.9	N76 P130 N131	N76-L119 WeakPolarHBondContact CB-O 3.15Å; N76-L119 WeakPolarHBondContact O-CB 3.32Å; N76-L119 PolarHBondContact O-N 2.83Å; L119-P130 HydrophobicContact CD1-CB 3.83Å; L119-N131 WeakPolarHBondContact CD1-O 3.42Å
120	I	45.7	Very low	52.4	Low	60 Å²	60	60.9 Å²	60.9	31%	0.308	35%	0.349	S	S	.	.			trans	-82.9	-23.8	-176.3	-56.5	-152.5	0	0	0	112	Y18 I118 A133	Y18-I120 HydrophobicContact CE1-CD1 3.94Å; I118-I120 PolarHBondContact O-N 3.05Å; I120-A133 HydrophobicContact CB-CB 4.42Å; I120-A133 HydrophobicContact CD1-CB 3.49Å; I120-A133 VanDerWaalsContact CD1-CB 3.49Å; I120-A133 HydrophobicContact CG1-CB 3.97Å
121	T	40.7	Very low	50.9	Low	55 Å²	55	61.6 Å²	61.6	34%	0.337	35%	0.353	S	S	.	.			trans	-129.9	132.9	-177.2	57.9	0	0	0	0	112.8	T123 N131	T121-T123 PolarHBondContact O-N 3.42Å; T121-N131 VanDerWaalsContact OG1-CB 3.27Å; T121-N131 WeakPolarHBondContact OG1-CB 3.46Å; T121-N131 PolarHBondContact OG1-ND2 3.42Å; T121-N131 VanDerWaalsContact OG1-ND2 3.12Å; T121-N131 PolarHBondContact OG1-O 2.95Å
122	E	45.2	Very low	49.6	Very low	133 Å²	133	59.3 Å²	59.3	62%	0.621	34%	0.338	S	S	*	.	S	Bend	trans	-65.5	-20.1	-179.2	-69.5	-176.2	174.9	0	0	113.3	I3 P124	I3-E122 WeakPolarHBondContact CG2-OE1 3.31Å; E122-P124 WeakPolarHBondContact O-CD 3.01Å
123	T	45.5	Very low	48.7	Very low	104 Å²	104	59.1 Å²	59.1	64%	0.638	34%	0.337	S	S	*	.	S	Bend	trans	-88.6	105	-176.8	-35.5	0	0	0	0	110	T121 N131	T121-T123 PolarHBondContact O-N 3.42Å; T123-N131 VanDerWaalsContact O-CB 3.25Å; T123-N131 WeakPolarHBondContact O-CB 3.31Å; T123-N131 PolarHBondContact O-ND2 2.87Å
124	P	45.1	Very low	47.7	Very low	80 Å²	80	68.1 Å²	68.1	52%	0.519	38%	0.376	S	S	.	.			trans	-58.6	151.3	170	24.2	-32.7	0	0	0	110.1	E122	E122-P124 WeakPolarHBondContact O-CD 3.01Å
125	K	46.1	Very low	47.3	Very low	110 Å²	110	75 Å²	75	48%	0.478	41%	0.413	S	S	.	.			trans	-60.5	156.9	169.4	-71.5	179.2	-179.6	174.4	0	109.2	D127 G128 T129 N131	K125-D127 WeakPolarHBondContact CB-OD1 3.24Å; K125-D127 PolarHBondContact O-N 2.81Å; K125-G128 PolarHBondContact O-N 3.35Å; K125-T129 PolarHBondContact N-O 3Å; K125-N131 WeakPolarHBondContact CE-OD1 2.97Å; K125-N131 HydrophobicContact CG-CB 4.47Å
126	V	50.6	Low	47	Very low	162 Å²	162	76.2 Å²	76.2	98%	0.982	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.3	-176.5	-179.8	0	0	0	0	112.6	G128	V126-G128 VanDerWaalsContact C-N 3.32Å
127	D	57.6	Low	47.1	Very low	115 Å²	115	78.6 Å²	78.6	62%	0.615	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	3	176.4	64.6	-13.9	0	0	0	114.1	K125 T129	K125-D127 WeakPolarHBondContact CB-OD1 3.24Å; K125-D127 PolarHBondContact O-N 2.81Å; D127-T129 VanDerWaalsContact C-N 3.27Å; D127-T129 PolarHBondContact O-N 3.21Å; D127-T129 VanDerWaalsContact OD1-CB 3.29Å; D127-T129 WeakPolarHBondContact OD1-CB 3.43Å; D127-T129 PolarHBondContact OD1-N 3.29Å; D127-T129 PolarHBondContact OD1-OG1 2.97Å; D127-T129 PolarHBondContact OD2-OG1 2.9Å
128	G	45.7	Very low	47.3	Very low	58 Å²	58	79.1 Å²	79.1	60%	0.598	43%	0.434	S	S	*	.	S	Bend	trans	81.1	2.6	-176.3	0	0	0	0	0	114	K125 V126	K125-G128 PolarHBondContact O-N 3.35Å; V126-G128 VanDerWaalsContact C-N 3.32Å
129	T	43.5	Very low	48	Very low	54 Å²	54	80.1 Å²	80.1	33%	0.331	44%	0.443	S	S	.	.			trans	-74.2	132.5	178.8	-54.8	0	0	0	0	110.1	K125 D127 N131	K125-T129 PolarHBondContact N-O 3Å; D127-T129 VanDerWaalsContact C-N 3.27Å; D127-T129 PolarHBondContact O-N 3.21Å; D127-T129 VanDerWaalsContact OD1-CB 3.29Å; D127-T129 WeakPolarHBondContact OD1-CB 3.43Å; D127-T129 PolarHBondContact OD1-N 3.29Å; D127-T129 PolarHBondContact OD1-OG1 2.97Å; D127-T129 PolarHBondContact OD2-OG1 2.9Å; T129-N131 PolarHBondContact O-N 3.16Å
130	P	43.8	Very low	49	Very low	55 Å²	55	80.5 Å²	80.5	36%	0.357	45%	0.45	S	S	.	.			trans	-55.5	136.1	174.2	-22.9	31.8	0	0	0	111.4	L119 Y132	L119-P130 HydrophobicContact CD1-CB 3.83Å; P130-Y132 HydrophobicContact CB-CE1 4.15Å; P130-Y132 HydrophobicContact CB-CE2 4.18Å; P130-Y132 WeakPolarHBondContact O-CD2 3.48Å; P130-Y132 PolarHBondContact O-N 3.5Å
131	N	40.8	Very low	50	Low	49 Å²	49	80.4 Å²	80.4	26%	0.262	45%	0.446	S	S	.	.			trans	-93.3	83.3	-176.2	-154.6	21	0	0	0	109.1	L119 T121 T123 K125 T129	L119-N131 WeakPolarHBondContact CD1-O 3.42Å; T121-N131 VanDerWaalsContact OG1-CB 3.27Å; T121-N131 WeakPolarHBondContact OG1-CB 3.46Å; T121-N131 PolarHBondContact OG1-ND2 3.42Å; T121-N131 VanDerWaalsContact OG1-ND2 3.12Å; T121-N131 PolarHBondContact OG1-O 2.95Å; T123-N131 VanDerWaalsContact O-CB 3.25Å; T123-N131 WeakPolarHBondContact O-CB 3.31Å; T123-N131 PolarHBondContact O-ND2 2.87Å; K125-N131 WeakPolarHBondContact CE-OD1 2.97Å; K125-N131 HydrophobicContact CG-CB 4.47Å; T129-N131 PolarHBondContact O-N 3.16Å
132	Y	47.6	Very low	51.2	Low	47 Å²	47	78.2 Å²	78.2	18%	0.184	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-63.4	164.5	170	-50.2	-70.2	0	0	0	110.3	C117 P130 W136 P138	C117-Y132 HydrophobicContact CB-CE1 4.14Å; P130-Y132 HydrophobicContact CB-CE1 4.15Å; P130-Y132 HydrophobicContact CB-CE2 4.18Å; P130-Y132 WeakPolarHBondContact O-CD2 3.48Å; P130-Y132 PolarHBondContact O-N 3.5Å; Y132-W136 VanDerWaalsContact CB-CE3 3.46Å; Y132-W136 WeakPolarHBondContact CB-O 3.06Å; Y132-W136 AromaticContact CD1-CE3 3.72Å; Y132-W136 HydrophobicContact CD1-CE3 3.72Å; Y132-W136 AromaticContact CD1-CZ3 3.43Å; Y132-W136 HydrophobicContact CD1-CZ3 3.43Å; Y132-W136 VanDerWaalsContact CD1-CZ3 3.43Å; Y132-W136 HydrophobicContact CD2-CE3 4.31Å; Y132-W136 HydrophobicContact CD2-CZ3 4.47Å; Y132-W136 AromaticContact CE1-CZ3 3.93Å; Y132-W136 HydrophobicContact CE1-CZ3 3.93Å; Y132-W136 AromaticContact CG-CE3 3.56Å; Y132-W136 HydrophobicContact CG-CE3 3.56Å; Y132-W136 AromaticContact CG-CZ3 3.75Å; Y132-W136 HydrophobicContact CG-CZ3 3.75Å; Y132-P138 HydrophobicContact CD2-CG 4.28Å; Y132-P138 HydrophobicContact CE2-CG 3.76Å
133	A	43.7	Very low	52.4	Low	10 Å²	10	76.5 Å²	76.5	8%	0.083	42%	0.42	C	S	.	.	S	Bend	trans	-53.9	155	-179.9	0	0	0	0	0	113.3	Y18 I120 N135 W136	Y18-A133 HydrophobicContact CE1-CB 3.35Å; Y18-A133 VanDerWaalsContact CZ-CB 3.47Å; Y18-A133 WeakPolarHBondContact OH-CB 3.18Å; I120-A133 HydrophobicContact CB-CB 4.42Å; I120-A133 HydrophobicContact CD1-CB 3.49Å; I120-A133 VanDerWaalsContact CD1-CB 3.49Å; I120-A133 HydrophobicContact CG1-CB 3.97Å; A133-N135 PolarHBondContact O-N 2.96Å; A133-N135 VanDerWaalsContact O-N 3.15Å; A133-W136 HydrophobicContact CB-CB 4.08Å; A133-W136 WeakPolarHBondContact O-CA 3.4Å; A133-W136 VanDerWaalsContact O-CB 3.25Å; A133-W136 WeakPolarHBondContact O-CB 3.35Å; A133-W136 PolarHBondContact O-N 3.3Å
134	K	42.5	Very low	53.6	Low	191 Å²	191	73 Å²	73	83%	0.83	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	123.4	-179.2	-166.8	176.3	-178.5	-179.2	0	110.2	W136	K134-W136 VanDerWaalsContact C-N 3.31Å
135	N	48.8	Very low	54.7	Low	164 Å²	164	69.3 Å²	69.3	88%	0.877	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	12.7	-175.4	-45.5	-39.9	0	0	0	115.9	A133	A133-N135 PolarHBondContact O-N 2.96Å; A133-N135 VanDerWaalsContact O-N 3.15Å
136	W	51.7	Low	56	Low	26 Å²	26	64.2 Å²	64.2	10%	0.098	35%	0.354	C	S	.	.			trans	-100.6	110.5	174.4	-159.6	89.8	0	0	0	110.2	Y18 C117 Y132 A133 K134 P138	Y18-W136 AromaticContact CD1-CD1 3.22Å; Y18-W136 HydrophobicContact CD1-CD2 4.01Å; Y18-W136 AromaticContact CD1-CE2 3.62Å; Y18-W136 AromaticContact CD1-CG 3.75Å; Y18-W136 HydrophobicContact CD1-CG 3.75Å; Y18-W136 HydrophobicContact CD1-CZ2 4.35Å; Y18-W136 AromaticContact CD1-NE1 3.15Å; Y18-W136 HydrophobicContact CE1-CB 4.1Å; Y18-W136 AromaticContact CE1-CD1 3.51Å; Y18-W136 HydrophobicContact CE1-CD2 4.33Å; Y18-W136 AromaticContact CE1-CG 3.75Å; Y18-W136 HydrophobicContact CE1-CG 3.75Å; Y18-W136 AromaticContact CE1-NE1 3.93Å; Y18-W136 AromaticContact CG-CD1 3.71Å; Y18-W136 AromaticContact CG-NE1 3.47Å; C117-W136 HydrophobicContact CB-CH2 3.91Å; C117-W136 HydrophobicContact CB-CZ3 4.22Å; Y132-W136 VanDerWaalsContact CB-CE3 3.46Å; Y132-W136 WeakPolarHBondContact CB-O 3.06Å; Y132-W136 AromaticContact CD1-CE3 3.72Å; Y132-W136 HydrophobicContact CD1-CE3 3.72Å; Y132-W136 AromaticContact CD1-CZ3 3.43Å; Y132-W136 HydrophobicContact CD1-CZ3 3.43Å; Y132-W136 VanDerWaalsContact CD1-CZ3 3.43Å; Y132-W136 HydrophobicContact CD2-CE3 4.31Å; Y132-W136 HydrophobicContact CD2-CZ3 4.47Å; Y132-W136 AromaticContact CE1-CZ3 3.93Å; Y132-W136 HydrophobicContact CE1-CZ3 3.93Å; Y132-W136 AromaticContact CG-CE3 3.56Å; Y132-W136 HydrophobicContact CG-CE3 3.56Å; Y132-W136 AromaticContact CG-CZ3 3.75Å; Y132-W136 HydrophobicContact CG-CZ3 3.75Å; A133-W136 HydrophobicContact CB-CB 4.08Å; A133-W136 WeakPolarHBondContact O-CA 3.4Å; A133-W136 VanDerWaalsContact O-CB 3.25Å; A133-W136 WeakPolarHBondContact O-CB 3.35Å; A133-W136 PolarHBondContact O-N 3.3Å; K134-W136 VanDerWaalsContact C-N 3.31Å; W136-P138 HydrophobicContact CH2-CB 4.2Å; W136-P138 HydrophobicContact CZ3-CB 3.83Å; W136-P138 HydrophobicContact CZ3-CG 4.25Å
137	D	59.9	Low	57.2	Low	73 Å²	73	65.5 Å²	65.5	39%	0.39	34%	0.341	S	S	.	.			trans	-115.7	119.6	171.9	169.8	58.3	0	0	0	108.5	V139 S140 R141	D137-V139 VanDerWaalsContact C-N 3.27Å; D137-V139 PolarHBondContact O-N 2.86Å; D137-S140 PolarHBondContact O-N 3.28Å; D137-S140 WeakPolarHBondContact OD2-CB 3.41Å; D137-S140 PolarHBondContact OD2-N 3.36Å; D137-S140 PolarHBondContact OD2-OG 2.54Å; D137-R141 PolarHBondContact O-N 2.93Å
138	P	56.4	Low	57.8	Low	13 Å²	13	63.6 Å²	63.6	8%	0.084	33%	0.328	C	S	.	.	H	α-helix	trans	-60.3	-37.1	-175.4	21.7	-32	0	0	0	112.2	Y132 W136 R141 V142	Y132-P138 HydrophobicContact CD2-CG 4.28Å; Y132-P138 HydrophobicContact CE2-CG 3.76Å; W136-P138 HydrophobicContact CH2-CB 4.2Å; W136-P138 HydrophobicContact CZ3-CB 3.83Å; W136-P138 HydrophobicContact CZ3-CG 4.25Å; P138-R141 PolarHBondContact O-N 3.38Å; P138-V142 VanDerWaalsContact O-CG2 3.31Å; P138-V142 WeakPolarHBondContact O-CG2 3.46Å; P138-V142 PolarHBondContact O-N 3.08Å
139	V	62	Low	59.2	Low	68 Å²	68	62.3 Å²	62.3	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-65.9	-48.9	-179.7	179.2	0	0	0	0	110.9	D137 R141 V142 R143	D137-V139 VanDerWaalsContact C-N 3.27Å; D137-V139 PolarHBondContact O-N 2.86Å; V139-R141 PolarHBondContact O-N 2.96Å; V139-V142 PolarHBondContact O-N 2.85Å; V139-R143 WeakPolarHBondContact O-CG 3.49Å; V139-R143 PolarHBondContact O-N 2.97Å
140	S	66.4	Low	60.9	Low	64 Å²	64	60.1 Å²	60.1	45%	0.448	29%	0.292	S	S	.	.	H	α-helix	trans	-59.8	-30.9	175	-61.1	0	0	0	0	111.9	D137 S144	D137-S140 PolarHBondContact O-N 3.28Å; D137-S140 WeakPolarHBondContact OD2-CB 3.41Å; D137-S140 PolarHBondContact OD2-N 3.36Å; D137-S140 PolarHBondContact OD2-OG 2.54Å; S140-S144 PolarHBondContact O-N 2.89Å; S140-S144 VanDerWaalsContact O-N 3.12Å
141	R	66.3	Low	62.8	Low	58 Å²	58	63.5 Å²	63.5	22%	0.219	30%	0.301	C	S	.	.	H	α-helix	trans	-75.5	-42.5	177.6	-151.1	55.3	157.5	167.6	-1.3	112.8	A20 I36 D137 P138 V139 R143 S144 I145	A20-R141 HydrophobicContact CB-CG 4.09Å; I36-R141 HydrophobicContact CD1-CG 4.19Å; I36-R141 VanDerWaalsContact CD1-NH2 3.27Å; I36-R141 VanDerWaalsContact CG1-NE 3.25Å; D137-R141 PolarHBondContact O-N 2.93Å; P138-R141 PolarHBondContact O-N 3.38Å; V139-R141 PolarHBondContact O-N 2.96Å; R141-R143 VanDerWaalsContact C-N 3.27Å; R141-R143 PolarHBondContact O-N 2.83Å; R141-S144 WeakPolarHBondContact O-CB 3.25Å; R141-S144 PolarHBondContact O-N 3.08Å; R141-S144 VanDerWaalsContact O-N 3.09Å; R141-I145 WeakPolarHBondContact O-CG1 3.39Å; R141-I145 PolarHBondContact O-N 3.27Å
142	V	66.3	Low	64.9	Low	8 Å²	8	63.2 Å²	63.2	5%	0.048	30%	0.302	C	S	.	.	H	α-helix	trans	-56.5	-43.9	170.6	173.2	0	0	0	0	110.3	Q82 V113 V115 P138 V139 S144 I145 E146	Q82-V142 HydrophobicContact CB-CG1 4.26Å; Q82-V142 HydrophobicContact CB-CG2 3.63Å; Q82-V142 HydrophobicContact CG-CG2 3.79Å; V113-V142 HydrophobicContact CG2-CG1 4.37Å; V115-V142 HydrophobicContact CG2-CG2 3.81Å; P138-V142 VanDerWaalsContact O-CG2 3.31Å; P138-V142 WeakPolarHBondContact O-CG2 3.46Å; P138-V142 PolarHBondContact O-N 3.08Å; V139-V142 PolarHBondContact O-N 2.85Å; V142-S144 VanDerWaalsContact C-N 3.31Å; V142-S144 PolarHBondContact O-N 3.22Å; V142-I145 WeakPolarHBondContact O-CB 3.49Å; V142-I145 PolarHBondContact O-N 3.19Å; V142-E146 WeakPolarHBondContact O-CB 3.25Å; V142-E146 PolarHBondContact O-N 3.2Å
143	R	70.3	Confident	66.5	Low	97 Å²	97	62.3 Å²	62.3	37%	0.366	30%	0.302	S	S	.	.	H	α-helix	trans	-59	-40	174.6	-74.3	178.2	163	155.1	1.9	113.5	E85 V139 R141 R147	E85-R143 IonicContact OE1-CZ 3.22Å; E85-R143 IonicContact OE1-NE 3.82Å; E85-R143 PolarHBondContact OE1-NE 3.13Å; E85-R143 IonicContact OE1-NH2 3.46Å; E85-R143 PolarHBondContact OE1-NH2 2.83Å; E85-R143 WeakPolarHBondContact OE2-CG 3.2Å; E85-R143 IonicContact OE2-NE 2.85Å; E85-R143 PolarHBondContact OE2-NE 2.84Å; E85-R143 VanDerWaalsContact OE2-NE 3.08Å; V139-R143 WeakPolarHBondContact O-CG 3.49Å; V139-R143 PolarHBondContact O-N 2.97Å; R141-R143 VanDerWaalsContact C-N 3.27Å; R141-R143 PolarHBondContact O-N 2.83Å; R143-R147 VanDerWaalsContact O-CG 3.26Å; R143-R147 WeakPolarHBondContact O-CG 3.2Å; R143-R147 PolarHBondContact O-N 3.09Å
144	S	69.6	Low	67.7	Low	31 Å²	31	66.9 Å²	66.9	22%	0.217	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-46.3	176.7	-166.6	0	0	0	0	111	S140 R141 V142 R147 Q148	S140-S144 PolarHBondContact O-N 2.89Å; S140-S144 VanDerWaalsContact O-N 3.12Å; R141-S144 WeakPolarHBondContact O-CB 3.25Å; R141-S144 PolarHBondContact O-N 3.08Å; R141-S144 VanDerWaalsContact O-N 3.09Å; V142-S144 VanDerWaalsContact C-N 3.31Å; V142-S144 PolarHBondContact O-N 3.22Å; S144-R147 PolarHBondContact O-N 3.03Å; S144-Q148 WeakPolarHBondContact O-CG 3.37Å; S144-Q148 PolarHBondContact O-N 3.31Å
145	I	68.7	Low	68.2	Low	2 Å²	2	64.1 Å²	64.1	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-48.1	177	-71.1	165.6	0	0	0	110.1	A20 M38 R141 V142 R147 Q148 F149 F150	A20-I145 HydrophobicContact CB-CD1 3.88Å; A20-I145 VanDerWaalsContact O-CD1 3.31Å; A20-I145 WeakPolarHBondContact O-CD1 3.37Å; M38-I145 HydrophobicContact SD-CG1 4.5Å; M38-I145 HydrophobicContact SD-CG2 3.93Å; R141-I145 WeakPolarHBondContact O-CG1 3.39Å; R141-I145 PolarHBondContact O-N 3.27Å; V142-I145 WeakPolarHBondContact O-CB 3.49Å; V142-I145 PolarHBondContact O-N 3.19Å; I145-R147 PolarHBondContact O-N 3.12Å; I145-Q148 PolarHBondContact O-N 3.38Å; I145-F149 HydrophobicContact CG2-CD2 4.09Å; I145-F149 WeakPolarHBondContact O-CD2 3.43Å; I145-F149 PolarHBondContact O-N 2.78Å; I145-F150 HydrophobicContact CG2-CD2 4.25Å; I145-F150 HydrophobicContact CG2-CE2 3.78Å
146	E	73.2	Confident	68.1	Low	4 Å²	4	61.8 Å²	61.8	2%	0.019	31%	0.311	C	S	.	.	H	α-helix	trans	-58.2	-47.1	179.4	-169.8	174.8	179.1	0	0	111.9	L84 E85 H86 V142 Q148 F150	L84-E146 HydrophobicContact CD2-CB 4.21Å; L84-E146 HydrophobicContact CD2-CG 4.05Å; E85-E146 WeakPolarHBondContact CB-OE2 2.8Å; E85-E146 VanDerWaalsContact N-CD 3.29Å; E85-E146 PolarHBondContact N-OE1 3.41Å; E85-E146 VanDerWaalsContact N-OE1 3.16Å; E85-E146 PolarHBondContact N-OE2 2.66Å; H86-E146 WeakPolarHBondContact CB-OE1 3.5Å; H86-E146 IonicContact CE1-OE1 2.72Å; H86-E146 IonicContact CG-OE1 3.08Å; H86-E146 PolarHBondContact N-OE1 3.24Å; H86-E146 IonicContact ND1-OE1 3.41Å; H86-E146 PolarHBondContact ND1-OE1 2.83Å; H86-E146 IonicContact ND1-OE2 3.85Å; V142-E146 WeakPolarHBondContact O-CB 3.25Å; V142-E146 PolarHBondContact O-N 3.2Å; E146-Q148 VanDerWaalsContact C-N 3.26Å; E146-Q148 PolarHBondContact O-N 2.97Å; E146-F150 HydrophobicContact CG-CB 3.99Å; E146-F150 CarbonylContact O-C 3.54Å; E146-F150 VanDerWaalsContact O-CA 3.29Å; E146-F150 WeakPolarHBondContact O-CA 3.29Å; E146-F150 VanDerWaalsContact O-CB 3.27Å; E146-F150 WeakPolarHBondContact O-CB 3.4Å; E146-F150 PolarHBondContact O-N 3.3Å
147	R	76.8	Confident	67.6	Low	188 Å²	188	63 Å²	63	71%	0.709	33%	0.327	S	S	*	.	H	α-helix	trans	-63.7	-29.5	179.4	-73.2	172.6	-175.3	-179.1	2	114.2	R143 S144 I145	R143-R147 VanDerWaalsContact O-CG 3.26Å; R143-R147 WeakPolarHBondContact O-CG 3.2Å; R143-R147 PolarHBondContact O-N 3.09Å; S144-R147 PolarHBondContact O-N 3.03Å; I145-R147 PolarHBondContact O-N 3.12Å
148	Q	70.7	Confident	66.6	Low	75 Å²	75	62.1 Å²	62.1	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-90	-44.3	-175.6	-70.1	-177.7	17	0	0	112.2	E31 S144 I145 E146	E31-Q148 PolarHBondContact OE1-NE2 2.7Å; E31-Q148 PolarHBondContact OE1-OE1 3.13Å; S144-Q148 WeakPolarHBondContact O-CG 3.37Å; S144-Q148 PolarHBondContact O-N 3.31Å; I145-Q148 PolarHBondContact O-N 3.38Å; E146-Q148 VanDerWaalsContact C-N 3.26Å; E146-Q148 PolarHBondContact O-N 2.97Å
149	F	73.9	Confident	65.6	Low	32 Å²	32	66.2 Å²	66.2	14%	0.14	35%	0.354	C	S	.	.	H	α-helix	trans	-109.8	-7.6	-168.8	-57.2	-70.4	0	0	0	113.3	V29 M38 L91 L92 I145	V29-F149 HydrophobicContact CG1-CE1 3.67Å; V29-F149 HydrophobicContact CG1-CZ 4.07Å; M38-F149 HydrophobicContact CE-CB 4.42Å; M38-F149 HydrophobicContact CE-CD1 3.58Å; M38-F149 HydrophobicContact CE-CD2 3.34Å; M38-F149 HydrophobicContact CE-CE1 3.52Å; M38-F149 HydrophobicContact CE-CE2 3.27Å; M38-F149 HydrophobicContact CE-CG 3.49Å; M38-F149 VanDerWaalsContact CE-CG 3.49Å; M38-F149 HydrophobicContact CE-CZ 3.36Å; M38-F149 HydrophobicContact SD-CD2 3.58Å; M38-F149 VanDerWaalsContact SD-CD2 3.58Å; M38-F149 HydrophobicContact SD-CE2 3.69Å; M38-F149 HydrophobicContact SD-CG 4.17Å; M38-F149 HydrophobicContact SD-CZ 4.36Å; L91-F149 CarbonylContact C-O 3.34Å; L91-F149 WeakPolarHBondContact CA-O 3.48Å; L91-F149 HydrophobicContact CD1-CB 4.36Å; L92-F149 WeakPolarHBondContact CB-O 3.25Å; L92-F149 WeakPolarHBondContact CG-O 3.21Å; L92-F149 PolarHBondContact N-O 3.34Å; I145-F149 HydrophobicContact CG2-CD2 4.09Å; I145-F149 WeakPolarHBondContact O-CD2 3.43Å; I145-F149 PolarHBondContact O-N 2.78Å
150	F	79.3	Confident	64.4	Low	8 Å²	8	66.3 Å²	66.3	4%	0.035	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	141.9	-176.7	-62.4	-92.3	0	0	0	110.9	L23 L84 Y90 L91 M110 V113 I145 E146	L23-F150 HydrophobicContact CD2-CZ 3.99Å; L84-F150 HydrophobicContact CD1-CD1 3.65Å; L84-F150 HydrophobicContact CD1-CE1 3.99Å; L84-F150 HydrophobicContact CD1-CG 4.05Å; L84-F150 HydrophobicContact CD2-CD2 4.4Å; L84-F150 HydrophobicContact CD2-CG 4.44Å; Y90-F150 CarbonylContact O-C 3.54Å; Y90-F150 VanDerWaalsContact O-CA 3.27Å; Y90-F150 WeakPolarHBondContact O-CA 3.44Å; L91-F150 HydrophobicContact CB-CE1 4.32Å; L91-F150 HydrophobicContact CD1-CE1 3.9Å; L91-F150 HydrophobicContact CD1-CE2 4.33Å; L91-F150 HydrophobicContact CD1-CZ 3.82Å; M110-F150 HydrophobicContact CB-CE1 3.9Å; M110-F150 HydrophobicContact CG-CE1 4.12Å; M110-F150 HydrophobicContact SD-CE1 3.82Å; M110-F150 HydrophobicContact SD-CZ 4.08Å; V113-F150 HydrophobicContact CG1-CE1 4.3Å; V113-F150 HydrophobicContact CG1-CE2 3.84Å; V113-F150 HydrophobicContact CG1-CZ 3.45Å; V113-F150 VanDerWaalsContact CG1-CZ 3.45Å; I145-F150 HydrophobicContact CG2-CD2 4.25Å; I145-F150 HydrophobicContact CG2-CE2 3.78Å; E146-F150 HydrophobicContact CG-CB 3.99Å; E146-F150 CarbonylContact O-C 3.54Å; E146-F150 VanDerWaalsContact O-CA 3.29Å; E146-F150 WeakPolarHBondContact O-CA 3.29Å; E146-F150 VanDerWaalsContact O-CB 3.27Å; E146-F150 WeakPolarHBondContact O-CB 3.4Å; E146-F150 PolarHBondContact O-N 3.3Å
151	K	84.2	Confident	63	Low	125 Å²	125	66.6 Å²	66.6	54%	0.543	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.3	170.9	-173.6	175.3	-178.6	177.8	0	108.8	S89 Y90 L92 V153	S89-K151 CarbonylContact C-O 3.58Å; S89-K151 VanDerWaalsContact CA-O 3.23Å; S89-K151 WeakPolarHBondContact CA-O 3.1Å; S89-K151 WeakPolarHBondContact CB-O 3.46Å; Y90-K151 PolarHBondContact N-O 2.91Å; Y90-K151 PolarHBondContact O-N 3.27Å; L92-K151 HydrophobicContact CD1-CB 4.23Å; L92-K151 HydrophobicContact CD2-CB 3.91Å; L92-K151 HydrophobicContact CG-CB 4.35Å; K151-V153 PolarHBondContact O-N 3.36Å
152	P	85.3	Confident	61.5	Low	44 Å²	44	66.3 Å²	66.3	29%	0.286	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	136.3	177.9	-26.1	33.5	0	0	0	110.7	H86 N154	H86-P152 HydrophobicContact CB-CB 4.06Å; H86-P152 HydrophobicContact CB-CG 3.67Å; P152-N154 PolarHBondContact O-N 2.62Å
153	V	81.4	Confident	60.2	Low	28 Å²	28	73 Å²	73	17%	0.17	42%	0.419	C	S	.	.			trans	-70.8	86.8	169.3	-178.4	0	0	0	0	106.6	M88 Y90 T109 K151 N155	M88-V153 HydrophobicContact CG-CG2 4.36Å; M88-V153 WeakPolarHBondContact O-CB 3.27Å; M88-V153 WeakPolarHBondContact O-CG2 3.25Å; M88-V153 PolarHBondContact O-N 2.7Å; Y90-V153 HydrophobicContact CD1-CG2 4.32Å; Y90-V153 HydrophobicContact CD2-CG2 3.85Å; Y90-V153 HydrophobicContact CE1-CG2 4.19Å; Y90-V153 HydrophobicContact CE2-CB 4.1Å; Y90-V153 HydrophobicContact CE2-CG1 3.99Å; Y90-V153 HydrophobicContact CE2-CG2 3.72Å; Y90-V153 HydrophobicContact CG-CG2 4.15Å; T109-V153 HydrophobicContact CG2-CG2 3.81Å; K151-V153 PolarHBondContact O-N 3.36Å; V153-N155 PolarHBondContact O-N 2.82Å
154	N	68.7	Low	58.5	Low	106 Å²	106	72.4 Å²	72.4	57%	0.567	44%	0.435	S	S	*	.			trans	-62.3	109.2	163.6	-82	-10.3	0	0	0	106	P152 T156 A157	P152-N154 PolarHBondContact O-N 2.62Å; N154-T156 PolarHBondContact O-N 2.9Å; N154-A157 PolarHBondContact O-N 3.21Å; N154-A157 VanDerWaalsContact O-N 3.13Å
155	N	51.6	Low	56.5	Low	132 Å²	132	74.1 Å²	74.1	71%	0.706	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	4.2	178.1	-94.5	-12.5	0	0	0	114.4	V153	V153-N155 PolarHBondContact O-N 2.82Å
156	T	47.5	Very low	54.8	Low	116 Å²	116	79.8 Å²	79.8	71%	0.712	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-24.3	169.9	34.7	0	0	0	0	114.1	N154	N154-T156 PolarHBondContact O-N 2.9Å
157	A	40.6	Very low	52.8	Low	52 Å²	52	88.3 Å²	88.3	43%	0.43	53%	0.528	S	S	.	.	S	Bend	trans	-95.4	-22.3	-173.9	0	0	0	0	0	115.3	N154 T159 A160 A161	N154-A157 PolarHBondContact O-N 3.21Å; N154-A157 VanDerWaalsContact O-N 3.13Å; A157-T159 PolarHBondContact O-N 3.22Å; A157-A160 PolarHBondContact O-N 2.69Å; A157-A161 PolarHBondContact O-N 2.88Å
158	A	38.5	Very low	50.8	Low	54 Å²	54	85.1 Å²	85.1	45%	0.446	53%	0.531	S	S	.	.	H	α-helix	trans	-62.2	-26.1	174.9	0	0	0	0	0	111.9	A160 G162	A158-A160 VanDerWaalsContact C-N 3.32Å; A158-A160 PolarHBondContact O-N 3.46Å; A158-G162 PolarHBondContact O-N 3.15Å
159	T	36.1	Very low	49	Very low	98 Å²	98	85.4 Å²	85.4	60%	0.601	55%	0.546	S	S	*	.	H	α-helix	trans	-72.2	-22.1	173.8	-21.5	0	0	0	0	113.4	A157	A157-T159 PolarHBondContact O-N 3.22Å
160	A	37.1	Very low	47.1	Very low	70 Å²	70	89.9 Å²	89.9	58%	0.579	58%	0.579	S	S	*	*	H	α-helix	trans	-88.4	-38.7	179.7	0	0	0	0	0	112.3	A157 A158 N163	A157-A160 PolarHBondContact O-N 2.69Å; A158-A160 VanDerWaalsContact C-N 3.32Å; A158-A160 PolarHBondContact O-N 3.46Å; A160-N163 PolarHBondContact O-N 3.43Å
161	A	37.1	Very low	44.9	Very low	70 Å²	70	98.3 Å²	98.3	58%	0.579	62%	0.618	S	S	*	*	H	α-helix	trans	-75	-29.7	176.6	0	0	0	0	0	112.6	A157 N163 A164 A165	A157-A161 PolarHBondContact O-N 2.88Å; A161-N163 PolarHBondContact O-N 2.98Å; A161-A164 PolarHBondContact O-N 2.81Å; A161-A165 PolarHBondContact O-N 3.21Å
162	G	35.1	Very low	42.5	Very low	53 Å²	53	97 Å²	97	55%	0.546	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.3	-19.1	172.7	0	0	0	0	0	114.5	A158	A158-G162 PolarHBondContact O-N 3.15Å
163	N	38.4	Very low	40	Very low	149 Å²	149	100.8 Å²	100.8	80%	0.797	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-2.6	176.4	-80.7	-4.1	0	0	0	114	A160 A161	A160-N163 PolarHBondContact O-N 3.43Å; A161-N163 PolarHBondContact O-N 2.98Å
164	A	34.3	Very low	37.8	Very low	83 Å²	83	108.8 Å²	108.8	69%	0.686	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	4	177.5	0	0	0	0	0	113.8	A161 P166	A161-A164 PolarHBondContact O-N 2.81Å; A164-P166 WeakPolarHBondContact O-CD 2.96Å
165	A	28.6	Very low	36.1	Very low	68 Å²	68	112.8 Å²	112.8	56%	0.562	70%	0.704	S	S	*	*	S	Bend	trans	-73.6	118.3	167.9	0	0	0	0	0	108.8	A161 Q167	A161-A165 PolarHBondContact O-N 3.21Å; A165-Q167 PolarHBondContact O-N 2.98Å
166	P	32.1	Very low	35.2	Very low	121 Å²	121	115 Å²	115	79%	0.786	71%	0.71	S	S	*	*			trans	-59	125.6	180	22.2	-29.9	0	0	0	109.1	A164	A164-P166 WeakPolarHBondContact O-CD 2.96Å
167	Q	32.1	Very low	34.6	Very low	183 Å²	183	115.1 Å²	115.1	86%	0.855	71%	0.713	S	S	*	*			trans	-45.3	129.3	175.3	-90.4	173.1	-83	0	0	109.4	A165 A169	A165-Q167 PolarHBondContact O-N 2.98Å; Q167-A169 PolarHBondContact O-N 3.27Å
168	P	33.7	Very low	34.3	Very low	120 Å²	120	117 Å²	117	78%	0.779	73%	0.728	S	S	*	*			trans	-55	119.9	178.4	19.2	-28.9	0	0	0	108.8
169	A	33.2	Very low	34.2	Very low	81 Å²	81	119.9 Å²	119.9	67%	0.669	74%	0.742	S	S	*	*			trans	-51.2	130	171	0	0	0	0	0	108	Q167 Q171	Q167-A169 PolarHBondContact O-N 3.27Å; A169-Q171 PolarHBondContact O-N 3.18Å
170	P	33.6	Very low	34.2	Very low	127 Å²	127	122.4 Å²	122.4	83%	0.825	75%	0.752	S	S	*	*			trans	-58.2	110.5	-175.4	20.4	-29.8	0	0	0	108.8	A172	P170-A172 PolarHBondContact O-N 3.12Å
171	Q	33.6	Very low	34.3	Very low	185 Å²	185	124.6 Å²	124.6	86%	0.864	76%	0.76	S	S	*	*			trans	-60.1	109.1	171.4	-83.5	176.7	-15.8	0	0	107.7	A169 T173	A169-Q171 PolarHBondContact O-N 3.18Å; Q171-T173 VanDerWaalsContact C-N 3.31Å; Q171-T173 PolarHBondContact O-N 3.15Å
172	A	34.1	Very low	34.2	Very low	98 Å²	98	129.3 Å²	129.3	81%	0.81	78%	0.775	S	S	*	*			trans	-67.1	84	175.3	0	0	0	0	0	110.2	P170	P170-A172 PolarHBondContact O-N 3.12Å
173	T	32.8	Very low	34.2	Very low	122 Å²	122	131.4 Å²	131.4	75%	0.748	79%	0.787	S	S	*	*			trans	-158.3	78.9	159.4	41.6	0	0	0	0	109.3	Q171	Q171-T173 VanDerWaalsContact C-N 3.31Å; Q171-T173 PolarHBondContact O-N 3.15Å
174	Q	35.1	Very low	33.9	Very low	196 Å²	196	129.3 Å²	129.3	92%	0.916	79%	0.791	S	S	*	*			trans	-138.8	112.6	138.4	-75.6	-149.4	59.8	0	0	108.4	Q176	Q174-Q176 PolarHBondContact O-N 2.74Å
175	Q	32.7	Very low	33.8	Very low	190 Å²	190	129.3 Å²	129.3	89%	0.888	79%	0.791	S	S	*	*			trans	-48.7	117.6	173.3	-72.5	162.1	-33	0	0	109.3	P177	Q175-P177 VanDerWaalsContact O-CD 3.29Å; Q175-P177 WeakPolarHBondContact O-CD 3.04Å
176	Q	33.4	Very low	34.1	Very low	179 Å²	179	132.8 Å²	132.8	84%	0.836	81%	0.805	S	S	*	*			trans	-53.5	115.4	171.6	-164.7	170.9	-21.6	0	0	109	Q174 A178	Q174-Q176 PolarHBondContact O-N 2.74Å; Q176-A178 PolarHBondContact O-N 3.49Å
177	P	33.9	Very low	34.1	Very low	119 Å²	119	135.5 Å²	135.5	77%	0.773	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-62	129.4	169	-16.5	30	0	0	0	108	Q175	Q175-P177 VanDerWaalsContact O-CD 3.29Å; Q175-P177 WeakPolarHBondContact O-CD 3.04Å
178	A	35.1	Very low	34.3	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-53.3	134.2	178.4	0	0	0	0	0	110.1	Q176 D180	Q176-A178 PolarHBondContact O-N 3.49Å; A178-D180 PolarHBondContact O-N 3.05Å
179	P	35.5	Very low	34.3	Very low	115 Å²	115	138.5 Å²	138.5	75%	0.747	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-67.8	118.6	-177.8	25.6	-31.3	0	0	0	110	P181	P179-P181 VanDerWaalsContact O-CD 3.31Å; P179-P181 WeakPolarHBondContact O-CD 3.45Å
180	D	37.7	Very low	34.6	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	82%	0.819	S	S	*	*			trans	-66	113.3	170	-131.2	-37.7	0	0	0	108.7	A178 L182	A178-D180 PolarHBondContact O-N 3.05Å; D180-L182 VanDerWaalsContact C-N 3.27Å; D180-L182 PolarHBondContact O-N 2.85Å
181	P	37.6	Very low	34.8	Very low	115 Å²	115	138.5 Å²	138.5	75%	0.747	81%	0.811	S	S	*	*	S	Bend	trans	-87.3	63.4	-172.6	35.8	-33.3	0	0	0	110.5	P179	P179-P181 VanDerWaalsContact O-CD 3.31Å; P179-P181 WeakPolarHBondContact O-CD 3.45Å
182	L	35	Very low	35.3	Very low	169 Å²	169	135.7 Å²	135.7	89%	0.885	81%	0.809	S	S	*	*			trans	-158.1	45.2	164.6	-142.3	77	0	0	0	114.5	D180	D180-L182 VanDerWaalsContact C-N 3.27Å; D180-L182 PolarHBondContact O-N 2.85Å
183	A	35.2	Very low	35.7	Very low	97 Å²	97	140.2 Å²	140.2	80%	0.802	81%	0.813	S	S	*	*			trans	-137.8	52.5	167.8	0	0	0	0	0	111.4	A185	A183-A185 PolarHBondContact O-N 3.34Å
184	A	32	Very low	36.1	Very low	106 Å²	106	139.9 Å²	139.9	88%	0.876	81%	0.813	S	S	*	*			trans	-78.9	98.2	160.2	0	0	0	0	0	108.4
185	A	33.9	Very low	36.4	Very low	82 Å²	82	138.3 Å²	138.3	68%	0.678	81%	0.811	S	S	*	*			trans	176.9	143.6	143	0	0	0	0	0	111.3	A183	A183-A185 PolarHBondContact O-N 3.34Å
186	T	34.1	Very low	36.6	Very low	142 Å²	142	135.5 Å²	135.5	87%	0.871	81%	0.806	S	S	*	*			trans	90.9	83.9	163.1	67	0	0	0	0	118.3
187	Q	31.8	Very low	36.5	Very low	178 Å²	178	131.6 Å²	131.6	83%	0.832	81%	0.805	S	S	*	*			trans	-30.7	144.8	145.7	-57.2	176	-2	0	0	115
188	Q	36.3	Very low	36.8	Very low	187 Å²	187	135.2 Å²	135.2	87%	0.874	81%	0.812	S	S	*	*				-178.9	139.9	106.7	-97.7	177.7	-6.1	0	0	112.3
189	Q	34	Very low	37	Very low	178 Å²	178	136.4 Å²	136.4	83%	0.832	81%	0.811	S	S	*	*			trans	-105.9	140.9	-175.9	-170.6	-176.7	-5.6	0	0	108.7
190	P	39	Very low	37.1	Very low	130 Å²	130	139.6 Å²	139.6	84%	0.844	82%	0.817	S	S	*	*			trans	-123.8	135.1	145.5	7.2	14	0	0	0	111.6
191	A	38.8	Very low	37.5	Very low	79 Å²	79	138.4 Å²	138.4	65%	0.653	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-81	164.3	-173.3	0	0	0	0	0	113.8
192	P	42.5	Very low	37.5	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-80.5	142.5	-171	-4.9	23.3	0	0	0	113.4
193	Q	43.4	Very low	37.5	Very low	193 Å²	193	133.8 Å²	133.8	90%	0.902	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-81.5	131.2	171.2	-79	-178.8	-47.2	0	0	111.7
194	P	40.9	Very low	37.8	Very low	115 Å²	115	134 Å²	134	75%	0.747	82%	0.823	S	S	*	*			trans	-94.1	113.9	168.8	32.5	-24.2	0	0	0	109.9
195	N	41.4	Very low	38	Very low	162 Å²	162	133.5 Å²	133.5	87%	0.866	82%	0.818	S	S	*	*			trans	-106.7	91.9	169.1	-121	34.7	0	0	0	110.7
196	V	38	Very low	38.5	Very low	131 Å²	131	136 Å²	136	79%	0.794	83%	0.827	S	S	*	*			trans	-6.6	126.4	149.9	-119	0	0	0	0	116.9
197	A	31.5	Very low	38.8	Very low	98 Å²	98	132.9 Å²	132.9	81%	0.81	82%	0.824	S	S	*	*			trans	-70.5	140	162.8	0	0	0	0	0	111.6
198	Q	38.4	Very low	39.1	Very low	195 Å²	195	129.5 Å²	129.5	91%	0.911	82%	0.82	S	S	*	*			trans	-142.4	152.9	158.1	-99.1	-170.4	-43.8	0	0	110.4
199	P	39.4	Very low	38.9	Very low	114 Å²	114	126.8 Å²	126.8	74%	0.74	82%	0.816	S	S	*	*			trans	-110.9	168.4	-145.8	23.3	-3.1	0	0	0	115.2
200	Q	37.3	Very low	39.2	Very low	183 Å²	183	122.7 Å²	122.7	86%	0.855	81%	0.813	S	S	*	*			trans	-34.6	162.4	149	-92.6	172.8	-76	0	0	113
201	P	47.2	Very low	39.8	Very low	126 Å²	126	122.2 Å²	122.2	82%	0.818	81%	0.81	S	S	*	*			cis	-147.4	174.8	32.1	35.9	-13.1	0	0	0	116
202	G	36.8	Very low	40	Very low	76 Å²	76	123.3 Å²	123.3	78%	0.784	82%	0.819	S	S	*	*			trans	-171	77.9	167.7	0	0	0	0	0	112.4	A204	G202-A204 PolarHBondContact O-N 3.01Å
203	A	35.7	Very low	39.5	Very low	111 Å²	111	122.3 Å²	122.3	92%	0.917	81%	0.814	S	S	*	*			trans	-68.2	121.6	167.8	0	0	0	0	0	109.7
204	A	40.4	Very low	39.5	Very low	103 Å²	103	126.8 Å²	126.8	85%	0.851	83%	0.831	S	S	*	*			trans	-105.8	121.3	165	0	0	0	0	0	108.6	G202	G202-A204 PolarHBondContact O-N 3.01Å
205	A	37.4	Very low	39.4	Very low	95 Å²	95	127.4 Å²	127.4	79%	0.785	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-67.8	161	-172.5	0	0	0	0	0	113.9
206	P	44.8	Very low	39.3	Very low	134 Å²	134	125.5 Å²	125.5	87%	0.87	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-81.6	124.5	-174.2	31.1	-30.6	0	0	0	112.3
207	G	39.6	Very low	39.3	Very low	77 Å²	77	125.2 Å²	125.2	79%	0.794	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-99.2	118.9	176.5	0	0	0	0	0	112.7
208	S	37.5	Very low	39.8	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	84%	0.838	S	S	*	*			trans	-38.8	131.7	169.9	47.9	0	0	0	0	119.5
209	T	33.1	Very low	39.9	Very low	130 Å²	130	122.6 Å²	122.6	80%	0.798	83%	0.833	S	S	*	*			trans	40	127.1	132.1	58.2	0	0	0	0	123.8
210	A	41	Very low	39.9	Very low	92 Å²	92	123.1 Å²	123.1	76%	0.76	84%	0.839	S	S	*	*			trans	79.3	166.9	131.1	0	0	0	0	0	118.9
211	P	50.2	Low	40.1	Very low	120 Å²	120	118.9 Å²	118.9	78%	0.779	84%	0.838	S	S	*	*			cis	-132.4	170.6	-48	35.2	-20.2	0	0	0	111.1
212	A	43.5	Very low	39.6	Very low	102 Å²	102	118.3 Å²	118.3	84%	0.843	84%	0.84	S	S	*	*			trans	-157.1	113.1	156.1	0	0	0	0	0	111.9
213	S	31.2	Very low	39.8	Very low	104 Å²	104	121.8 Å²	121.8	73%	0.727	84%	0.844	S	S	*	*			trans	-67	146.5	166.4	-25.9	0	0	0	0	111.4
214	F	43.4	Very low	40.2	Very low	287 Å²	287	122.8 Å²	122.8	100%	1.259	84%	0.838	S	S	*	*			trans	-151.6	0	132.3	-86.6	-71.2	0	0	0	108.5

Retrieved 214 of 214 residues in 113.6 ms (Link to these results)

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