A0A5K4EA46_SCHMA Loading...

Putative zinc finger protein

AlphaFold DB , UniProt , Accession A0A5K4EA46, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 262 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	42.7	Very low	45.7	Very low	229 Å²	229	180.5 Å²	180.5	100%	1.128	85%	0.852	S	S	*	*				0	84.7	0	-74.7	172.9	76.2	0	0	110.1
2	Y	41.2	Very low	45.4	Very low	241 Å²	241	184.8 Å²	184.8	95%	0.945	85%	0.854	S	S	*	*			trans	-126.4	93.7	166	-95.1	-89	0	0	0	108	H4	Y2-H4 PolarHBondContact O-N 2.94Å
3	L	42.3	Very low	45.3	Very low	173 Å²	173	185.2 Å²	185.2	91%	0.906	86%	0.856	S	S	*	*			trans	-82.5	101.6	175.2	-71.9	168.3	0	0	0	108.4	A5	L3-A5 PolarHBondContact O-N 3.38Å
4	H	47.4	Very low	44.9	Very low	158 Å²	158	182.7 Å²	182.7	73%	0.731	85%	0.845	S	S	*	*			trans	-83.7	87.5	169	-173.1	-66.4	0	0	0	109.3	Y2 R6	Y2-H4 PolarHBondContact O-N 2.94Å; H4-R6 PolarHBondContact O-N 3.3Å
5	A	45.9	Very low	44.9	Very low	91 Å²	91	179.9 Å²	179.9	75%	0.752	85%	0.845	S	S	*	*			trans	-63.8	104.9	170.5	0	0	0	0	0	109.9	L3 R7	L3-A5 PolarHBondContact O-N 3.38Å; A5-R7 PolarHBondContact O-N 2.99Å
6	R	49.6	Very low	45.6	Very low	216 Å²	216	179.4 Å²	179.4	82%	0.815	84%	0.839	S	S	*	*			trans	-74.1	107.2	169.9	-79.1	-175.9	172.5	173	-1.6	109	H4 H8	H4-R6 PolarHBondContact O-N 3.3Å; R6-H8 PolarHBondContact O-N 3.14Å
7	R	45.3	Very low	46.9	Very low	237 Å²	237	177.6 Å²	177.6	89%	0.894	84%	0.837	S	S	*	*			trans	-56.5	115.3	164	-97.6	175.4	165.5	151	-4.5	109.4	A5 V9	A5-R7 PolarHBondContact O-N 2.99Å; R7-V9 PolarHBondContact O-N 2.88Å; R7-V9 VanDerWaalsContact O-N 3.13Å
8	H	49.8	Very low	48.7	Very low	186 Å²	186	175 Å²	175	86%	0.861	82%	0.818	S	S	*	*			trans	-68.3	100.2	161.5	-93.3	-86.1	0	0	0	108.6	R6 S10	R6-H8 PolarHBondContact O-N 3.14Å; H8-S10 PolarHBondContact O-N 3.02Å
9	V	46.4	Very low	50.5	Low	118 Å²	118	167.6 Å²	167.6	72%	0.715	79%	0.786	S	S	*	*			trans	-83.1	99.9	164.7	-178.7	0	0	0	0	107.1	R7 R11	R7-V9 PolarHBondContact O-N 2.88Å; R7-V9 VanDerWaalsContact O-N 3.13Å; V9-R11 PolarHBondContact O-N 2.83Å
10	S	47.2	Very low	52.2	Low	109 Å²	109	163.2 Å²	163.2	76%	0.762	77%	0.771	S	S	*	*			trans	-60.8	98	166.1	-60.9	0	0	0	0	108.6	H8 R12	H8-S10 PolarHBondContact O-N 3.02Å; S10-R12 PolarHBondContact O-N 3.14Å
11	R	44.6	Very low	53.8	Low	228 Å²	228	155.5 Å²	155.5	86%	0.86	74%	0.735	S	S	*	*			trans	-66.5	114.2	171.6	-76.3	-170	177.2	-148.9	-0.1	108	V9	V9-R11 PolarHBondContact O-N 2.83Å
12	R	42.9	Very low	55.9	Low	232 Å²	232	149.6 Å²	149.6	88%	0.875	72%	0.717	S	S	*	*			trans	-51.2	136.4	166.7	-73.3	177.3	169.8	175.3	-4.1	108.8	S10 E14	S10-R12 PolarHBondContact O-N 3.14Å; R12-E14 VanDerWaalsContact C-N 3.27Å; R12-E14 PolarHBondContact O-N 3.23Å
13	H	43.7	Very low	57.9	Low	190 Å²	190	143 Å²	143	88%	0.88	70%	0.701	S	S	*	*			trans	-62.4	88.5	168.8	-80.3	-89.7	0	0	0	109	V15	H13-V15 PolarHBondContact O-N 2.8Å
14	E	39.6	Very low	59.8	Low	150 Å²	150	137.9 Å²	137.9	70%	0.701	68%	0.679	S	S	*	*			trans	-64.7	119.5	156.2	-76.3	179.4	171.9	0	0	106.7	R12 F16	R12-E14 VanDerWaalsContact C-N 3.27Å; R12-E14 PolarHBondContact O-N 3.23Å; E14-F16 HydrophobicContact CB-CD2 4.22Å; E14-F16 HydrophobicContact CB-CE2 4.3Å; E14-F16 PolarHBondContact O-N 3.4Å
15	V	45.2	Very low	61.5	Low	141 Å²	141	133 Å²	133	86%	0.855	67%	0.672	S	S	*	*			trans	-66.7	82.2	174.6	-178.5	0	0	0	0	107.1	H13 D17	H13-V15 PolarHBondContact O-N 2.8Å; V15-D17 PolarHBondContact O-N 3.07Å; V15-D17 VanDerWaalsContact O-N 3.1Å
16	F	56.4	Low	63.2	Low	171 Å²	171	131.2 Å²	131.2	75%	0.75	65%	0.647	S	S	*	*			trans	-66	108	165	-93.5	-92.8	0	0	0	106.5	E14 R18	E14-F16 HydrophobicContact CB-CD2 4.22Å; E14-F16 HydrophobicContact CB-CE2 4.3Å; E14-F16 PolarHBondContact O-N 3.4Å; F16-R18 VanDerWaalsContact C-N 3.33Å; F16-R18 PolarHBondContact O-N 2.92Å
17	D	67.2	Low	64.8	Low	149 Å²	149	121.9 Å²	121.9	80%	0.797	62%	0.618	S	S	*	*			trans	-56.7	98.2	173.2	-170	13	0	0	0	108.4	V15 P19	V15-D17 PolarHBondContact O-N 3.07Å; V15-D17 VanDerWaalsContact O-N 3.1Å; D17-P19 WeakPolarHBondContact O-CD 3.33Å
18	R	79.3	Confident	66.8	Low	131 Å²	131	111.7 Å²	111.7	49%	0.494	58%	0.58	S	S	.	*			trans	-71.1	125.6	-173.2	-174.9	-178.7	-122.4	-150.4	11.8	107.2	F16 T20 G27 F28	F16-R18 VanDerWaalsContact C-N 3.33Å; F16-R18 PolarHBondContact O-N 2.92Å; R18-T20 VanDerWaalsContact O-CG2 3.22Å; R18-T20 WeakPolarHBondContact O-CG2 3.46Å; R18-T20 PolarHBondContact O-N 2.99Å; R18-G27 PolarHBondContact NH1-O 3.26Å; R18-F28 WeakPolarHBondContact CG-O 3.29Å
19	P	82.9	Confident	68.5	Low	34 Å²	34	107.6 Å²	107.6	22%	0.221	57%	0.573	C	S	.	*			trans	-53.2	115.8	177	-27.7	33.8	0	0	0	111.4	D17 F28 T31 L34	D17-P19 WeakPolarHBondContact O-CD 3.33Å; P19-F28 WeakPolarHBondContact CD-O 3.48Å; P19-F28 PolarHBondContact O-N 3.41Å; P19-T31 HydrophobicContact CB-CG2 4.25Å; P19-T31 HydrophobicContact CG-CG2 3.69Å; P19-L34 HydrophobicContact CB-CB 4.11Å; P19-L34 HydrophobicContact CB-CD2 3.7Å
20	T	84.5	Confident	70.4	Confident	79 Å²	79	104 Å²	104	49%	0.485	55%	0.553	S	S	.	*	B	Isolated β-bridge	trans	-107.9	148.8	-178.4	58	0	0	0	0	111.9	R18 K26 L34	R18-T20 VanDerWaalsContact O-CG2 3.22Å; R18-T20 WeakPolarHBondContact O-CG2 3.46Å; R18-T20 PolarHBondContact O-N 2.99Å; T20-K26 CarbonylContact C-O 3.58Å; T20-K26 WeakPolarHBondContact CA-O 3.33Å; T20-L34 VanDerWaalsContact O-CD2 3.27Å; T20-L34 WeakPolarHBondContact O-CD2 3.42Å
21	C	85.5	Confident	72.3	Confident	2 Å²	2	104 Å²	104	1%	0.014	55%	0.548	C	S	.	.			trans	-79.3	121.9	172.7	-173.5	0	0	0	0	110.5	V23 G25 K26 F28 L34 H37 H41	C21-V23 PolarHBondContact O-N 3.46Å; C21-V23 PolarHBondContact SG-N 3.24Å; C21-G25 WeakPolarHBondContact O-CA 3.25Å; C21-G25 PolarHBondContact O-N 3.32Å; C21-K26 PolarHBondContact N-O 3.42Å; C21-F28 HydrophobicContact CB-CE2 4.17Å; C21-L34 HydrophobicContact CB-CD1 3.73Å; C21-H37 WeakPolarHBondContact CB-NE2 3.44Å; C21-H37 VanDerWaalsContact SG-CD2 3.59Å; C21-H37 PolarHBondContact SG-NE2 2.75Å; C21-H41 VanDerWaalsContact SG-CD2 3.56Å; C21-H41 PolarHBondContact SG-NE2 3.22Å
22	S	87.4	Confident	74.3	Confident	106 Å²	106	98.7 Å²	98.7	74%	0.741	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.2	176.6	58	0	0	0	0	114.1
23	V	82.7	Confident	76.5	Confident	101 Å²	101	89.8 Å²	89.8	61%	0.612	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-40.6	-179	-178.2	0	0	0	0	112	C21	C21-V23 PolarHBondContact O-N 3.46Å; C21-V23 PolarHBondContact SG-N 3.24Å
24	C	82.3	Confident	78.6	Confident	67 Å²	67	81.7 Å²	81.7	45%	0.453	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	0.2	-176	69.4	0	0	0	0	115	K26 H37	C24-K26 PolarHBondContact O-N 3.45Å; C24-K26 VanDerWaalsContact O-N 3.12Å; C24-H37 VanDerWaalsContact SG-CE1 3.55Å; C24-H37 PolarHBondContact SG-NE2 3.49Å
25	G	83.2	Confident	80.9	Confident	56 Å²	56	77 Å²	77	58%	0.577	46%	0.46	S	S	*	.			trans	71.7	-4	-178.6	0	0	0	0	0	115.6	C21 G27	C21-G25 WeakPolarHBondContact O-CA 3.25Å; C21-G25 PolarHBondContact O-N 3.32Å; G25-G27 PolarHBondContact O-N 3.45Å
26	K	81.2	Confident	82.8	Confident	53 Å²	53	71 Å²	71	23%	0.23	42%	0.424	C	S	.	.			trans	-63	129.6	-176.8	-167.4	171	-176.4	-180	0	111	T20 C21 C24 F28 S246	T20-K26 CarbonylContact C-O 3.58Å; T20-K26 WeakPolarHBondContact CA-O 3.33Å; C21-K26 PolarHBondContact N-O 3.42Å; C24-K26 PolarHBondContact O-N 3.45Å; C24-K26 VanDerWaalsContact O-N 3.12Å; K26-F28 HydrophobicContact CB-CE2 3.92Å; K26-F28 HydrophobicContact CB-CZ 4.07Å; K26-F28 HydrophobicContact CD-CE1 4.46Å; K26-F28 HydrophobicContact CD-CZ 3.9Å; K26-F28 HydrophobicContact CG-CE2 4.07Å; K26-F28 HydrophobicContact CG-CZ 3.88Å; K26-F28 VanDerWaalsContact O-CD2 3.27Å; K26-F28 WeakPolarHBondContact O-CD2 3.45Å; K26-F28 WeakPolarHBondContact O-CE2 3.48Å; K26-S246 PolarHBondContact NZ-O 2.9Å
27	G	83.1	Confident	84.3	Confident	19 Å²	19	64 Å²	64	20%	0.196	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-94.4	137.1	178.7	0	0	0	0	0	113.1	R18 G25	R18-G27 PolarHBondContact NH1-O 3.26Å; G25-G27 PolarHBondContact O-N 3.45Å
28	F	87	Confident	85.2	Confident	24 Å²	24	61.2 Å²	61.2	11%	0.105	37%	0.374	C	S	.	.			trans	-118.8	147.7	-173.9	-66.1	-88.8	0	0	0	112.3	R18 P19 C21 K26 S30 L34 H37	R18-F28 WeakPolarHBondContact CG-O 3.29Å; P19-F28 WeakPolarHBondContact CD-O 3.48Å; P19-F28 PolarHBondContact O-N 3.41Å; C21-F28 HydrophobicContact CB-CE2 4.17Å; K26-F28 HydrophobicContact CB-CE2 3.92Å; K26-F28 HydrophobicContact CB-CZ 4.07Å; K26-F28 HydrophobicContact CD-CE1 4.46Å; K26-F28 HydrophobicContact CD-CZ 3.9Å; K26-F28 HydrophobicContact CG-CE2 4.07Å; K26-F28 HydrophobicContact CG-CZ 3.88Å; K26-F28 VanDerWaalsContact O-CD2 3.27Å; K26-F28 WeakPolarHBondContact O-CD2 3.45Å; K26-F28 WeakPolarHBondContact O-CE2 3.48Å; F28-S30 PolarHBondContact O-N 3.14Å; F28-L34 HydrophobicContact CB-CB 4.12Å; F28-L34 HydrophobicContact CD2-CB 3.86Å; F28-L34 HydrophobicContact CD2-CD1 3.62Å; F28-L34 HydrophobicContact CD2-CG 4.33Å; F28-L34 HydrophobicContact CE2-CD1 3.77Å; F28-L34 HydrophobicContact CG-CB 4.05Å; F28-H37 HydrophobicContact CD1-CB 4.4Å; F28-H37 HydrophobicContact CE1-CB 3.53Å; F28-H37 AromaticContact CE1-CG 3.8Å; F28-H37 HydrophobicContact CE2-CB 3.98Å; F28-H37 AromaticContact CE2-CD2 3.41Å; F28-H37 VanDerWaalsContact CE2-CD2 3.41Å; F28-H37 WeakPolarHBondContact CE2-CD2 3.19Å; F28-H37 AromaticContact CE2-CG 3.67Å; F28-H37 AromaticContact CE2-NE2 3.96Å; F28-H37 HydrophobicContact CZ-CB 3.31Å; F28-H37 AromaticContact CZ-CD2 3.32Å; F28-H37 WeakPolarHBondContact CZ-CD2 3.4Å; F28-H37 AromaticContact CZ-CE1 3.92Å; F28-H37 AromaticContact CZ-CG 3.07Å; F28-H37 AromaticContact CZ-ND1 3.5Å; F28-H37 WeakPolarHBondContact CZ-ND1 3.33Å; F28-H37 AromaticContact CZ-NE2 3.83Å
29	S	85.7	Confident	85.5	Confident	100 Å²	100	58 Å²	58	70%	0.699	36%	0.362	S	S	*	.	S	Bend	trans	-67.6	-16.7	178.1	53.5	0	0	0	0	114.6
30	S	86.4	Confident	85.4	Confident	43 Å²	43	60 Å²	60	30%	0.301	37%	0.37	S	S	.	.	S	Bend	trans	-148.7	156.1	179	77.1	0	0	0	0	111.5	F28 N32 S33 L34	F28-S30 PolarHBondContact O-N 3.14Å; S30-N32 PolarHBondContact O-N 3.5Å; S30-S33 PolarHBondContact O-N 3.26Å; S30-S33 WeakPolarHBondContact OG-CB 3.42Å; S30-S33 PolarHBondContact OG-N 3.16Å; S30-S33 PolarHBondContact OG-OG 2.95Å; S30-L34 PolarHBondContact O-N 2.69Å; S30-L34 VanDerWaalsContact O-N 3.13Å
31	T	87.4	Confident	85.3	Confident	107 Å²	107	59.5 Å²	59.5	66%	0.656	36%	0.363	S	S	*	.	H	α-helix	trans	-62.2	-33.5	173.4	50	0	0	0	0	111.6	P19 L34 A35	P19-T31 HydrophobicContact CB-CG2 4.25Å; P19-T31 HydrophobicContact CG-CG2 3.69Å; T31-L34 PolarHBondContact O-N 2.74Å; T31-A35 WeakPolarHBondContact O-CB 3.21Å; T31-A35 PolarHBondContact O-N 3.32Å
32	N	87.6	Confident	85.2	Confident	117 Å²	117	69.6 Å²	69.6	63%	0.626	40%	0.4	S	S	*	.	H	α-helix	trans	-66.2	-42.5	176.6	-156	57.7	0	0	0	111.6	S30 L34 A35 V36	S30-N32 PolarHBondContact O-N 3.5Å; N32-L34 VanDerWaalsContact C-N 3.33Å; N32-L34 PolarHBondContact O-N 3.09Å; N32-A35 PolarHBondContact O-N 3.26Å; N32-V36 WeakPolarHBondContact O-CG2 3.05Å; N32-V36 PolarHBondContact O-N 3.04Å
33	S	87.2	Confident	84.7	Confident	46 Å²	46	70.8 Å²	70.8	32%	0.322	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-40.9	173.9	-59	0	0	0	0	111.7	S30 V36 H37	S30-S33 PolarHBondContact O-N 3.26Å; S30-S33 WeakPolarHBondContact OG-CB 3.42Å; S30-S33 PolarHBondContact OG-N 3.16Å; S30-S33 PolarHBondContact OG-OG 2.95Å; S33-V36 PolarHBondContact O-N 2.87Å; S33-H37 WeakPolarHBondContact O-CB 3.49Å; S33-H37 PolarHBondContact O-N 2.92Å
34	L	87.8	Confident	84.7	Confident	19 Å²	19	70.9 Å²	70.9	10%	0.099	39%	0.392	C	S	.	.	H	α-helix	trans	-64.1	-44	174	172.7	61.6	0	0	0	112	P19 T20 C21 F28 S30 T31 N32 V36 H37 K38	P19-L34 HydrophobicContact CB-CB 4.11Å; P19-L34 HydrophobicContact CB-CD2 3.7Å; T20-L34 VanDerWaalsContact O-CD2 3.27Å; T20-L34 WeakPolarHBondContact O-CD2 3.42Å; C21-L34 HydrophobicContact CB-CD1 3.73Å; F28-L34 HydrophobicContact CB-CB 4.12Å; F28-L34 HydrophobicContact CD2-CB 3.86Å; F28-L34 HydrophobicContact CD2-CD1 3.62Å; F28-L34 HydrophobicContact CD2-CG 4.33Å; F28-L34 HydrophobicContact CE2-CD1 3.77Å; F28-L34 HydrophobicContact CG-CB 4.05Å; S30-L34 PolarHBondContact O-N 2.69Å; S30-L34 VanDerWaalsContact O-N 3.13Å; T31-L34 PolarHBondContact O-N 2.74Å; N32-L34 VanDerWaalsContact C-N 3.33Å; N32-L34 PolarHBondContact O-N 3.09Å; L34-V36 VanDerWaalsContact C-N 3.32Å; L34-V36 PolarHBondContact O-N 3.09Å; L34-H37 WeakPolarHBondContact O-CB 3.41Å; L34-H37 PolarHBondContact O-N 3.04Å; L34-K38 HydrophobicContact CD1-CG 4.24Å; L34-K38 WeakPolarHBondContact O-CG 3.48Å; L34-K38 PolarHBondContact O-N 3.23Å
35	A	88.4	Confident	84.7	Confident	51 Å²	51	70.9 Å²	70.9	42%	0.421	39%	0.386	S	S	.	.	H	α-helix	trans	-61.2	-41.7	177.9	0	0	0	0	0	111.7	T31 N32 K38	T31-A35 WeakPolarHBondContact O-CB 3.21Å; T31-A35 PolarHBondContact O-N 3.32Å; N32-A35 PolarHBondContact O-N 3.26Å; A35-K38 PolarHBondContact O-N 3.39Å
36	V	85.6	Confident	84.8	Confident	16 Å²	16	70.8 Å²	70.8	10%	0.097	38%	0.375	C	S	.	.	H	α-helix	trans	-63.8	-43.7	174.3	-179.4	0	0	0	0	111.3	N32 S33 L34 K38 R39 Q58	N32-V36 WeakPolarHBondContact O-CG2 3.05Å; N32-V36 PolarHBondContact O-N 3.04Å; S33-V36 PolarHBondContact O-N 2.87Å; L34-V36 VanDerWaalsContact C-N 3.32Å; L34-V36 PolarHBondContact O-N 3.09Å; V36-K38 PolarHBondContact O-N 2.83Å; V36-R39 VanDerWaalsContact O-CB 3.28Å; V36-R39 WeakPolarHBondContact O-CB 3.2Å; V36-R39 PolarHBondContact O-N 3.18Å; V36-Q58 HydrophobicContact CG1-CG 3.41Å; V36-Q58 VanDerWaalsContact CG1-CG 3.41Å; V36-Q58 VanDerWaalsContact CG1-NE2 3.28Å
37	H	87.1	Confident	85	Confident	24 Å²	24	72 Å²	72	11%	0.111	38%	0.379	C	S	.	.	H	α-helix	trans	-62.2	-40.7	177.1	163.8	76.3	0	0	0	112.7	C21 C24 F28 S33 L34 R39 L40 H41	C21-H37 WeakPolarHBondContact CB-NE2 3.44Å; C21-H37 VanDerWaalsContact SG-CD2 3.59Å; C21-H37 PolarHBondContact SG-NE2 2.75Å; C24-H37 VanDerWaalsContact SG-CE1 3.55Å; C24-H37 PolarHBondContact SG-NE2 3.49Å; F28-H37 HydrophobicContact CD1-CB 4.4Å; F28-H37 HydrophobicContact CE1-CB 3.53Å; F28-H37 AromaticContact CE1-CG 3.8Å; F28-H37 HydrophobicContact CE2-CB 3.98Å; F28-H37 AromaticContact CE2-CD2 3.41Å; F28-H37 VanDerWaalsContact CE2-CD2 3.41Å; F28-H37 WeakPolarHBondContact CE2-CD2 3.19Å; F28-H37 AromaticContact CE2-CG 3.67Å; F28-H37 AromaticContact CE2-NE2 3.96Å; F28-H37 HydrophobicContact CZ-CB 3.31Å; F28-H37 AromaticContact CZ-CD2 3.32Å; F28-H37 WeakPolarHBondContact CZ-CD2 3.4Å; F28-H37 AromaticContact CZ-CE1 3.92Å; F28-H37 AromaticContact CZ-CG 3.07Å; F28-H37 AromaticContact CZ-ND1 3.5Å; F28-H37 WeakPolarHBondContact CZ-ND1 3.33Å; F28-H37 AromaticContact CZ-NE2 3.83Å; S33-H37 WeakPolarHBondContact O-CB 3.49Å; S33-H37 PolarHBondContact O-N 2.92Å; L34-H37 WeakPolarHBondContact O-CB 3.41Å; L34-H37 PolarHBondContact O-N 3.04Å; H37-R39 PolarHBondContact O-N 3.45Å; H37-R39 VanDerWaalsContact O-N 3.12Å; H37-L40 VanDerWaalsContact O-CB 3.28Å; H37-L40 WeakPolarHBondContact O-CB 3.29Å; H37-L40 PolarHBondContact O-N 3.13Å; H37-H41 AromaticContact CE1-NE2 3.55Å; H37-H41 AromaticContact NE2-CD2 3.73Å; H37-H41 AromaticContact NE2-NE2 3.13Å; H37-H41 PolarHBondContact NE2-NE2 3.17Å; H37-H41 VanDerWaalsContact NE2-NE2 3.13Å
38	K	86.5	Confident	84.9	Confident	90 Å²	90	77.5 Å²	77.5	39%	0.391	40%	0.395	S	S	.	.	H	α-helix	trans	-59.1	-24.4	176.9	-75.9	-176.8	177.8	-175.5	0	113.2	L34 A35 V36 L40 H41	L34-K38 HydrophobicContact CD1-CG 4.24Å; L34-K38 WeakPolarHBondContact O-CG 3.48Å; L34-K38 PolarHBondContact O-N 3.23Å; A35-K38 PolarHBondContact O-N 3.39Å; V36-K38 PolarHBondContact O-N 2.83Å; K38-L40 VanDerWaalsContact C-N 3.26Å; K38-L40 PolarHBondContact O-N 3.15Å; K38-H41 PolarHBondContact O-N 3.19Å
39	R	86.2	Confident	84.3	Confident	63 Å²	63	76.7 Å²	76.7	24%	0.238	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-32.8	172.8	-69.4	-171.5	-90	-145.5	-9.4	112.8	V36 H37 R42 N43 H44 A57	V36-R39 VanDerWaalsContact O-CB 3.28Å; V36-R39 WeakPolarHBondContact O-CB 3.2Å; V36-R39 PolarHBondContact O-N 3.18Å; H37-R39 PolarHBondContact O-N 3.45Å; H37-R39 VanDerWaalsContact O-N 3.12Å; R39-R42 PolarHBondContact O-N 2.86Å; R39-N43 PolarHBondContact O-N 3.02Å; R39-H44 HydrophobicContact CB-CB 4.39Å; R39-H44 WeakPolarHBondContact CB-O 3.35Å; R39-H44 PolarHBondContact O-N 3.21Å; R39-A57 VanDerWaalsContact CZ-O 3.29Å; R39-A57 PolarHBondContact NE-O 2.86Å
40	L	80.6	Confident	84	Confident	77 Å²	77	79.9 Å²	79.9	40%	0.403	40%	0.396	S	S	.	.	H	α-helix	trans	-65.7	-39.3	178.6	-58.1	175.2	0	0	0	111.5	H37 K38 R42 N43 M45 A57	H37-L40 VanDerWaalsContact O-CB 3.28Å; H37-L40 WeakPolarHBondContact O-CB 3.29Å; H37-L40 PolarHBondContact O-N 3.13Å; K38-L40 VanDerWaalsContact C-N 3.26Å; K38-L40 PolarHBondContact O-N 3.15Å; L40-R42 PolarHBondContact O-N 3.33Å; L40-N43 PolarHBondContact O-N 2.72Å; L40-N43 VanDerWaalsContact O-N 3.14Å; L40-M45 HydrophobicContact CD2-CE 4.05Å; L40-M45 HydrophobicContact CD2-SD 4.24Å; L40-A57 HydrophobicContact CD2-CB 3.94Å
41	H	81.8	Confident	83.1	Confident	69 Å²	69	83.3 Å²	83.3	32%	0.319	41%	0.41	S	S	.	.	H	α-helix	trans	-63.2	-27	176.5	-72.3	-55.8	0	0	0	113.8	C21 H37 K38	C21-H41 VanDerWaalsContact SG-CD2 3.56Å; C21-H41 PolarHBondContact SG-NE2 3.22Å; H37-H41 AromaticContact CE1-NE2 3.55Å; H37-H41 AromaticContact NE2-CD2 3.73Å; H37-H41 AromaticContact NE2-NE2 3.13Å; H37-H41 PolarHBondContact NE2-NE2 3.17Å; H37-H41 VanDerWaalsContact NE2-NE2 3.13Å; K38-H41 PolarHBondContact O-N 3.19Å
42	R	84.1	Confident	82.4	Confident	213 Å²	213	80.1 Å²	80.1	80%	0.804	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	5.7	179.4	-62.7	-177.9	179	175.5	-2.6	112.8	R39 L40 H44	R39-R42 PolarHBondContact O-N 2.86Å; L40-R42 PolarHBondContact O-N 3.33Å; R42-H44 HydrophobicContact CB-CB 4.21Å; R42-H44 PolarHBondContact O-N 3.09Å
43	N	76.4	Confident	81.9	Confident	132 Å²	132	80.4 Å²	80.4	71%	0.706	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	28.9	-168.7	-65.7	-52.8	0	0	0	113.3	R39 L40 M45	R39-N43 PolarHBondContact O-N 3.02Å; L40-N43 PolarHBondContact O-N 2.72Å; L40-N43 VanDerWaalsContact O-N 3.14Å; N43-M45 PolarHBondContact O-N 2.6Å
44	H	83.8	Confident	81.3	Confident	103 Å²	103	79.5 Å²	79.5	48%	0.477	40%	0.398	S	S	.	.			trans	-85.7	96.6	-175.5	-178	-104.9	0	0	0	109.8	R39 R42 P46	R39-H44 HydrophobicContact CB-CB 4.39Å; R39-H44 WeakPolarHBondContact CB-O 3.35Å; R39-H44 PolarHBondContact O-N 3.21Å; R42-H44 HydrophobicContact CB-CB 4.21Å; R42-H44 PolarHBondContact O-N 3.09Å; H44-P46 WeakPolarHBondContact O-CD 3.35Å
45	M	82.4	Confident	81.1	Confident	67 Å²	67	82.8 Å²	82.8	33%	0.33	42%	0.416	S	S	.	.			trans	-114.3	79.1	-175.2	-60.4	-62.6	-132.4	0	0	110.3	L40 N43 Y47 N55 F56 A57	L40-M45 HydrophobicContact CD2-CE 4.05Å; L40-M45 HydrophobicContact CD2-SD 4.24Å; N43-M45 PolarHBondContact O-N 2.6Å; M45-Y47 PolarHBondContact O-N 2.91Å; M45-Y47 VanDerWaalsContact O-N 3.14Å; M45-N55 HydrophobicContact CB-CB 3.61Å; M45-N55 HydrophobicContact CG-CB 4.3Å; M45-F56 CarbonylContact C-O 3.51Å; M45-F56 WeakPolarHBondContact CA-O 3.47Å; M45-F56 VanDerWaalsContact SD-C 3.54Å; M45-A57 VanDerWaalsContact SD-CA 3.54Å; M45-A57 HydrophobicContact SD-CB 3.52Å; M45-A57 VanDerWaalsContact SD-CB 3.52Å; M45-A57 PolarHBondContact SD-N 3.21Å
46	P	84	Confident	80.8	Confident	54 Å²	54	82.3 Å²	82.3	35%	0.351	40%	0.404	S	S	.	.			trans	-70.7	-10.8	-169.6	28.6	-35.7	0	0	0	114.2	H44	H44-P46 WeakPolarHBondContact O-CD 3.35Å
47	Y	86.4	Confident	80.8	Confident	79 Å²	79	81.8 Å²	81.8	31%	0.31	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	108.1	-178.8	-55.6	-77.5	0	0	0	109.3	M45 N55 F56 K59	M45-Y47 PolarHBondContact O-N 2.91Å; M45-Y47 VanDerWaalsContact O-N 3.14Å; Y47-N55 CarbonylContact O-C 3.58Å; Y47-F56 PolarHBondContact N-O 3.37Å; Y47-F56 PolarHBondContact O-N 3.47Å; Y47-K59 HydrophobicContact CD1-CB 3.96Å; Y47-K59 HydrophobicContact CD1-CG 4.3Å; Y47-K59 HydrophobicContact CE1-CB 3.65Å; Y47-K59 HydrophobicContact CE1-CD 4.42Å; Y47-K59 HydrophobicContact CE1-CG 4.14Å; Y47-K59 HydrophobicContact CE2-CB 4.3Å; Y47-K59 HydrophobicContact CG-CB 4.4Å
48	Y	81.1	Confident	80.7	Confident	134 Å²	134	83.7 Å²	83.7	53%	0.525	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	149.5	-178.5	59.1	-85.4	0	0	0	110.8	Q50 N55 L62	Y48-Q50 HydrophobicContact CD2-CG 4.28Å; Y48-Q50 HydrophobicContact CE2-CG 3.86Å; Y48-N55 WeakPolarHBondContact CB-OD1 3.39Å; Y48-L62 WeakPolarHBondContact O-CD2 3.28Å
49	C	73.4	Confident	80.7	Confident	7 Å²	7	86.6 Å²	86.6	5%	0.047	42%	0.424	C	S	.	.			trans	-76.7	131.7	168.6	-172.2	0	0	0	0	109.1	L51 C52 A54 L62 H65 H70	C49-L51 PolarHBondContact SG-N 3.15Å; C49-C52 WeakPolarHBondContact CB-O 3.43Å; C49-A54 HydrophobicContact CB-CB 4.43Å; C49-A54 PolarHBondContact N-O 2.77Å; C49-L62 HydrophobicContact CB-CD1 4.14Å; C49-H65 PolarHBondContact SG-NE2 3.2Å; C49-H70 PolarHBondContact SG-CD2 3.39Å; C49-H70 PolarHBondContact SG-NE2 3.13Å
50	Q	78.8	Confident	80.7	Confident	167 Å²	167	86.4 Å²	86.4	78%	0.78	43%	0.432	S	S	*	.	S	Bend	trans	-79	-12.7	174.3	-69.2	-179.8	-19.5	0	0	112.7	Y48	Y48-Q50 HydrophobicContact CD2-CG 4.28Å; Y48-Q50 HydrophobicContact CE2-CG 3.86Å
51	L	68.1	Low	80.9	Confident	114 Å²	114	86.7 Å²	86.7	60%	0.597	43%	0.431	S	S	*	.	S	Bend	trans	-105	-9.6	-175	-58.6	173.4	0	0	0	113.1	C49 H70	C49-L51 PolarHBondContact SG-N 3.15Å; L51-H70 WeakPolarHBondContact CB-CE1 3.35Å; L51-H70 WeakPolarHBondContact CB-ND1 3.44Å; L51-H70 HydrophobicContact CD1-CB 3.6Å
52	C	72.1	Confident	80.9	Confident	40 Å²	40	84.5 Å²	84.5	27%	0.27	42%	0.422	S	S	.	.	S	Bend	trans	-158	169.6	173.8	75.2	0	0	0	0	111.2	C49 A54 H65 H70	C49-C52 WeakPolarHBondContact CB-O 3.43Å; C52-A54 PolarHBondContact O-N 3.49Å; C52-A54 VanDerWaalsContact SG-CB 3.53Å; C52-H65 VanDerWaalsContact SG-CE1 3.54Å; C52-H65 PolarHBondContact SG-NE2 2.78Å; C52-H70 PolarHBondContact SG-NE2 2.88Å
53	S	77.7	Confident	80.8	Confident	124 Å²	124	80.6 Å²	80.6	87%	0.867	41%	0.41	S	S	*	.	S	Bend	trans	-73.6	15.4	-176.7	-42.8	0	0	0	0	115.4	N55	S53-N55 PolarHBondContact O-ND2 3.11Å
54	A	75.1	Confident	80.9	Confident	27 Å²	27	79.1 Å²	79.1	22%	0.223	40%	0.402	C	S	.	.			trans	-81.7	134.8	-177.1	0	0	0	0	0	112.3	C49 C52 F56	C49-A54 HydrophobicContact CB-CB 4.43Å; C49-A54 PolarHBondContact N-O 2.77Å; C52-A54 PolarHBondContact O-N 3.49Å; C52-A54 VanDerWaalsContact SG-CB 3.53Å; A54-F56 HydrophobicContact CB-CE2 3.77Å; A54-F56 HydrophobicContact CB-CZ 3.75Å
55	N	83.8	Confident	80.5	Confident	88 Å²	88	75.2 Å²	75.2	47%	0.471	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.7	179.5	-55.3	-74.1	0	0	0	111.2	M45 Y47 Y48 S53	M45-N55 HydrophobicContact CB-CB 3.61Å; M45-N55 HydrophobicContact CG-CB 4.3Å; Y47-N55 CarbonylContact O-C 3.58Å; Y48-N55 WeakPolarHBondContact CB-OD1 3.39Å; S53-N55 PolarHBondContact O-ND2 3.11Å
56	F	82.6	Confident	80.1	Confident	40 Å²	40	74.9 Å²	74.9	18%	0.175	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.5	-171.9	-55.4	-85.2	0	0	0	112.9	M45 Y47 A54 Q58 H61 L62 H65	M45-F56 CarbonylContact C-O 3.51Å; M45-F56 WeakPolarHBondContact CA-O 3.47Å; M45-F56 VanDerWaalsContact SD-C 3.54Å; Y47-F56 PolarHBondContact N-O 3.37Å; Y47-F56 PolarHBondContact O-N 3.47Å; A54-F56 HydrophobicContact CB-CE2 3.77Å; A54-F56 HydrophobicContact CB-CZ 3.75Å; F56-Q58 VanDerWaalsContact C-N 3.29Å; F56-Q58 PolarHBondContact O-N 3.06Å; F56-H61 HydrophobicContact CB-CB 4.11Å; F56-H61 HydrophobicContact CD1-CB 3.8Å; F56-H61 HydrophobicContact CG-CB 4.21Å; F56-L62 HydrophobicContact CB-CB 4.33Å; F56-L62 HydrophobicContact CD2-CB 3.84Å; F56-L62 HydrophobicContact CD2-CD1 3.81Å; F56-L62 HydrophobicContact CD2-CG 4.43Å; F56-L62 HydrophobicContact CE2-CD1 3.95Å; F56-L62 HydrophobicContact CG-CB 4.25Å; F56-H65 HydrophobicContact CE1-CB 3.83Å; F56-H65 HydrophobicContact CE2-CB 3.63Å; F56-H65 AromaticContact CE2-CD2 3.73Å; F56-H65 AromaticContact CE2-CG 3.51Å; F56-H65 HydrophobicContact CZ-CB 3.24Å; F56-H65 AromaticContact CZ-CD2 3.86Å; F56-H65 AromaticContact CZ-CG 3.18Å; F56-H65 AromaticContact CZ-ND1 3.42Å; F56-H65 WeakPolarHBondContact CZ-ND1 3.43Å
57	A	85.1	Confident	79.5	Confident	5 Å²	5	75.7 Å²	75.7	4%	0.041	39%	0.385	C	S	.	.	S	Bend	trans	-76.1	-19	176.6	0	0	0	0	0	112.9	R39 L40 M45	R39-A57 VanDerWaalsContact CZ-O 3.29Å; R39-A57 PolarHBondContact NE-O 2.86Å; L40-A57 HydrophobicContact CD2-CB 3.94Å; M45-A57 VanDerWaalsContact SD-CA 3.54Å; M45-A57 HydrophobicContact SD-CB 3.52Å; M45-A57 VanDerWaalsContact SD-CB 3.52Å; M45-A57 PolarHBondContact SD-N 3.21Å
58	Q	84.1	Confident	78.6	Confident	65 Å²	65	74 Å²	74	30%	0.304	38%	0.384	S	S	.	.	S	Bend	trans	-134	141.3	-173.3	-59.6	-174.6	31.4	0	0	111.1	V36 F56 S60 H61 L62	V36-Q58 HydrophobicContact CG1-CG 3.41Å; V36-Q58 VanDerWaalsContact CG1-CG 3.41Å; V36-Q58 VanDerWaalsContact CG1-NE2 3.28Å; F56-Q58 VanDerWaalsContact C-N 3.29Å; F56-Q58 PolarHBondContact O-N 3.06Å; Q58-S60 VanDerWaalsContact C-N 3.3Å; Q58-S60 PolarHBondContact O-N 3.49Å; Q58-S60 PolarHBondContact OE1-OG 3.2Å; Q58-H61 HydrophobicContact CB-CB 4.4Å; Q58-H61 PolarHBondContact O-N 3.3Å; Q58-H61 VanDerWaalsContact O-N 3.16Å; Q58-L62 PolarHBondContact O-N 2.83Å; Q58-L62 VanDerWaalsContact O-N 3.17Å
59	K	87.1	Confident	77.9	Confident	151 Å²	151	72.9 Å²	72.9	66%	0.657	38%	0.383	S	S	*	.	H	α-helix	trans	-60.9	-37.5	176	-171.3	175.4	179	176.8	0	112.4	Y47 H61 L62 K63	Y47-K59 HydrophobicContact CD1-CB 3.96Å; Y47-K59 HydrophobicContact CD1-CG 4.3Å; Y47-K59 HydrophobicContact CE1-CB 3.65Å; Y47-K59 HydrophobicContact CE1-CD 4.42Å; Y47-K59 HydrophobicContact CE1-CG 4.14Å; Y47-K59 HydrophobicContact CE2-CB 4.3Å; Y47-K59 HydrophobicContact CG-CB 4.4Å; K59-H61 VanDerWaalsContact C-N 3.29Å; K59-H61 PolarHBondContact O-N 2.83Å; K59-L62 PolarHBondContact O-N 2.78Å; K59-K63 PolarHBondContact O-N 2.74Å
60	S	85.6	Confident	77.7	Confident	59 Å²	59	73.4 Å²	73.4	41%	0.413	39%	0.385	S	S	.	.	H	α-helix	trans	-60.4	-38.1	175.8	49.8	0	0	0	0	112.1	Q58 K63 L64	Q58-S60 VanDerWaalsContact C-N 3.3Å; Q58-S60 PolarHBondContact O-N 3.49Å; Q58-S60 PolarHBondContact OE1-OG 3.2Å; S60-K63 PolarHBondContact O-N 3.2Å; S60-L64 WeakPolarHBondContact O-CG 3.28Å; S60-L64 PolarHBondContact O-N 3.3Å
61	H	84.3	Confident	76.7	Confident	82 Å²	82	67.5 Å²	67.5	38%	0.38	37%	0.365	S	S	.	.	H	α-helix	trans	-73.1	-38.3	177.8	-62.2	179.4	0	0	0	111.7	F56 Q58 K59 K63 L64 H65	F56-H61 HydrophobicContact CB-CB 4.11Å; F56-H61 HydrophobicContact CD1-CB 3.8Å; F56-H61 HydrophobicContact CG-CB 4.21Å; Q58-H61 HydrophobicContact CB-CB 4.4Å; Q58-H61 PolarHBondContact O-N 3.3Å; Q58-H61 VanDerWaalsContact O-N 3.16Å; K59-H61 VanDerWaalsContact C-N 3.29Å; K59-H61 PolarHBondContact O-N 2.83Å; H61-K63 VanDerWaalsContact C-N 3.32Å; H61-L64 PolarHBondContact O-N 3Å; H61-H65 VanDerWaalsContact O-CB 3.31Å; H61-H65 WeakPolarHBondContact O-CB 3.32Å; H61-H65 PolarHBondContact O-N 2.76Å
62	L	82	Confident	75.9	Confident	24 Å²	24	66.5 Å²	66.5	13%	0.126	35%	0.354	C	S	.	.	H	α-helix	trans	-61.9	-42.3	170.1	173.2	62	0	0	0	110.8	Y48 C49 F56 Q58 K59 H65 L66	Y48-L62 WeakPolarHBondContact O-CD2 3.28Å; C49-L62 HydrophobicContact CB-CD1 4.14Å; F56-L62 HydrophobicContact CB-CB 4.33Å; F56-L62 HydrophobicContact CD2-CB 3.84Å; F56-L62 HydrophobicContact CD2-CD1 3.81Å; F56-L62 HydrophobicContact CD2-CG 4.43Å; F56-L62 HydrophobicContact CE2-CD1 3.95Å; F56-L62 HydrophobicContact CG-CB 4.25Å; Q58-L62 PolarHBondContact O-N 2.83Å; Q58-L62 VanDerWaalsContact O-N 3.17Å; K59-L62 PolarHBondContact O-N 2.78Å; L62-H65 CarbonylContact O-C 3.58Å; L62-H65 WeakPolarHBondContact O-CB 3.39Å; L62-H65 PolarHBondContact O-N 2.91Å; L62-L66 HydrophobicContact CD1-CD1 4.12Å; L62-L66 HydrophobicContact CD1-CG 4Å; L62-L66 HydrophobicContact CG-CD1 4.02Å; L62-L66 HydrophobicContact CG-CG 4.34Å; L62-L66 WeakPolarHBondContact O-CG 3.35Å; L62-L66 PolarHBondContact O-N 2.98Å
63	K	82.7	Confident	74.9	Confident	131 Å²	131	69.2 Å²	69.2	57%	0.57	37%	0.37	S	S	*	.	H	α-helix	trans	-61.3	-49.7	175.7	178.4	166.3	-178.6	168.2	0	111.3	K59 S60 H61 H65 L66 D67	K59-K63 PolarHBondContact O-N 2.74Å; S60-K63 PolarHBondContact O-N 3.2Å; H61-K63 VanDerWaalsContact C-N 3.32Å; K63-H65 PolarHBondContact O-N 3.21Å; K63-L66 PolarHBondContact O-N 3.2Å; K63-L66 VanDerWaalsContact O-N 3.16Å; K63-D67 WeakPolarHBondContact CE-OD2 3.46Å; K63-D67 WeakPolarHBondContact CG-OD2 3.35Å; K63-D67 WeakPolarHBondContact O-CB 3.11Å; K63-D67 PolarHBondContact O-N 3.19Å
64	L	78.1	Confident	73.1	Confident	101 Å²	101	70.9 Å²	70.9	53%	0.529	36%	0.364	S	S	.	.	H	α-helix	trans	-58.6	-38.2	174.8	-74.4	170.9	0	0	0	112	S60 H61 S68	S60-L64 WeakPolarHBondContact O-CG 3.28Å; S60-L64 PolarHBondContact O-N 3.3Å; H61-L64 PolarHBondContact O-N 3Å; L64-S68 WeakPolarHBondContact O-CB 3.48Å; L64-S68 PolarHBondContact O-N 3.48Å; L64-S68 PolarHBondContact O-OG 3.3Å
65	H	76.4	Confident	71.5	Confident	20 Å²	20	76.5 Å²	76.5	9%	0.093	39%	0.389	C	S	.	.	H	α-helix	trans	-63.7	-48.7	173.4	172.3	80.6	0	0	0	111.8	C49 C52 F56 H61 L62 K63 D67 S68 H69 H70	C49-H65 PolarHBondContact SG-NE2 3.2Å; C52-H65 VanDerWaalsContact SG-CE1 3.54Å; C52-H65 PolarHBondContact SG-NE2 2.78Å; F56-H65 HydrophobicContact CE1-CB 3.83Å; F56-H65 HydrophobicContact CE2-CB 3.63Å; F56-H65 AromaticContact CE2-CD2 3.73Å; F56-H65 AromaticContact CE2-CG 3.51Å; F56-H65 HydrophobicContact CZ-CB 3.24Å; F56-H65 AromaticContact CZ-CD2 3.86Å; F56-H65 AromaticContact CZ-CG 3.18Å; F56-H65 AromaticContact CZ-ND1 3.42Å; F56-H65 WeakPolarHBondContact CZ-ND1 3.43Å; H61-H65 VanDerWaalsContact O-CB 3.31Å; H61-H65 WeakPolarHBondContact O-CB 3.32Å; H61-H65 PolarHBondContact O-N 2.76Å; L62-H65 CarbonylContact O-C 3.58Å; L62-H65 WeakPolarHBondContact O-CB 3.39Å; L62-H65 PolarHBondContact O-N 2.91Å; K63-H65 PolarHBondContact O-N 3.21Å; H65-D67 VanDerWaalsContact C-N 3.35Å; H65-D67 PolarHBondContact O-N 2.77Å; H65-S68 WeakPolarHBondContact CA-OG 3.33Å; H65-S68 PolarHBondContact O-N 2.91Å; H65-S68 PolarHBondContact O-OG 3.31Å; H65-H69 VanDerWaalsContact CE1-CB 3.47Å; H65-H69 WeakPolarHBondContact CE1-CB 3.43Å; H65-H69 AromaticContact CE1-CD2 3.97Å; H65-H69 AromaticContact CE1-CG 3.41Å; H65-H69 VanDerWaalsContact CE1-CG 3.41Å; H65-H69 AromaticContact CE1-ND1 3.65Å; H65-H69 AromaticContact NE2-ND1 3.94Å; H65-H69 WeakPolarHBondContact O-CA 3.49Å; H65-H69 WeakPolarHBondContact O-CB 3.45Å; H65-H69 PolarHBondContact O-N 3.24Å; H65-H70 AromaticContact CD2-CD2 3.65Å; H65-H70 AromaticContact CD2-NE2 3.97Å; H65-H70 AromaticContact CE1-NE2 3.8Å; H65-H70 AromaticContact NE2-CD2 3.16Å; H65-H70 PolarHBondContact NE2-CD2 2.9Å; H65-H70 AromaticContact NE2-NE2 3.04Å; H65-H70 PolarHBondContact NE2-NE2 3.19Å
66	L	72.5	Confident	69.8	Low	61 Å²	61	80.6 Å²	80.6	32%	0.319	41%	0.411	S	S	.	.	I	π-helix	trans	-59.7	-48.7	175.9	-69.9	170.2	0	0	0	110.1	L62 K63 S68 H70 A71	L62-L66 HydrophobicContact CD1-CD1 4.12Å; L62-L66 HydrophobicContact CD1-CG 4Å; L62-L66 HydrophobicContact CG-CD1 4.02Å; L62-L66 HydrophobicContact CG-CG 4.34Å; L62-L66 WeakPolarHBondContact O-CG 3.35Å; L62-L66 PolarHBondContact O-N 2.98Å; K63-L66 PolarHBondContact O-N 3.2Å; K63-L66 VanDerWaalsContact O-N 3.16Å; L66-S68 PolarHBondContact O-N 3.16Å; L66-H70 HydrophobicContact CD2-CB 4.19Å; L66-H70 CarbonylContact O-C 3.47Å; L66-H70 VanDerWaalsContact O-CA 3.28Å; L66-H70 WeakPolarHBondContact O-CA 3.3Å; L66-H70 PolarHBondContact O-N 2.88Å; L66-A71 WeakPolarHBondContact O-CA 3.37Å; L66-A71 PolarHBondContact O-N 3.25Å
67	D	73.1	Confident	68.5	Low	71 Å²	71	87.1 Å²	87.1	38%	0.38	44%	0.442	S	S	.	.	I	π-helix	trans	-64.4	-23.6	179.4	-63.6	-12.8	0	0	0	112.7	K63 H65 A71	K63-D67 WeakPolarHBondContact CE-OD2 3.46Å; K63-D67 WeakPolarHBondContact CG-OD2 3.35Å; K63-D67 WeakPolarHBondContact O-CB 3.11Å; K63-D67 PolarHBondContact O-N 3.19Å; H65-D67 VanDerWaalsContact C-N 3.35Å; H65-D67 PolarHBondContact O-N 2.77Å; D67-A71 WeakPolarHBondContact O-CB 3.34Å
68	S	66.1	Low	67.1	Low	44 Å²	44	89.3 Å²	89.3	31%	0.308	46%	0.455	S	S	.	.	I	π-helix	trans	-102.2	-37.6	-175.8	60.7	0	0	0	0	115.5	L64 H65 L66 L92	L64-S68 WeakPolarHBondContact O-CB 3.48Å; L64-S68 PolarHBondContact O-N 3.48Å; L64-S68 PolarHBondContact O-OG 3.3Å; H65-S68 WeakPolarHBondContact CA-OG 3.33Å; H65-S68 PolarHBondContact O-N 2.91Å; H65-S68 PolarHBondContact O-OG 3.31Å; L66-S68 PolarHBondContact O-N 3.16Å; S68-L92 VanDerWaalsContact O-CD1 3.29Å; S68-L92 WeakPolarHBondContact O-CD1 3.1Å
69	H	66.8	Low	66	Low	109 Å²	109	91.3 Å²	91.3	51%	0.505	47%	0.473	S	S	.	.	I	π-helix	trans	-106.2	-30	-170.9	-170.7	-83.7	0	0	0	110.8	H65	H65-H69 VanDerWaalsContact CE1-CB 3.47Å; H65-H69 WeakPolarHBondContact CE1-CB 3.43Å; H65-H69 AromaticContact CE1-CD2 3.97Å; H65-H69 AromaticContact CE1-CG 3.41Å; H65-H69 VanDerWaalsContact CE1-CG 3.41Å; H65-H69 AromaticContact CE1-ND1 3.65Å; H65-H69 AromaticContact NE2-ND1 3.94Å; H65-H69 WeakPolarHBondContact O-CA 3.49Å; H65-H69 WeakPolarHBondContact O-CB 3.45Å; H65-H69 PolarHBondContact O-N 3.24Å
70	H	68.6	Low	65	Low	18 Å²	18	89.5 Å²	89.5	8%	0.083	47%	0.466	C	S	.	.	I	π-helix	trans	-122.6	-2.8	-174.7	-63.7	-69.7	0	0	0	115.7	C49 L51 C52 H65 L66 Y72 V73	C49-H70 PolarHBondContact SG-CD2 3.39Å; C49-H70 PolarHBondContact SG-NE2 3.13Å; L51-H70 WeakPolarHBondContact CB-CE1 3.35Å; L51-H70 WeakPolarHBondContact CB-ND1 3.44Å; L51-H70 HydrophobicContact CD1-CB 3.6Å; C52-H70 PolarHBondContact SG-NE2 2.88Å; H65-H70 AromaticContact CD2-CD2 3.65Å; H65-H70 AromaticContact CD2-NE2 3.97Å; H65-H70 AromaticContact CE1-NE2 3.8Å; H65-H70 AromaticContact NE2-CD2 3.16Å; H65-H70 PolarHBondContact NE2-CD2 2.9Å; H65-H70 AromaticContact NE2-NE2 3.04Å; H65-H70 PolarHBondContact NE2-NE2 3.19Å; L66-H70 HydrophobicContact CD2-CB 4.19Å; L66-H70 CarbonylContact O-C 3.47Å; L66-H70 VanDerWaalsContact O-CA 3.28Å; L66-H70 WeakPolarHBondContact O-CA 3.3Å; L66-H70 PolarHBondContact O-N 2.88Å; H70-Y72 PolarHBondContact O-N 3.22Å; H70-V73 HydrophobicContact CB-CG2 4.43Å; H70-V73 PolarHBondContact O-N 2.73Å; H70-V73 VanDerWaalsContact O-N 3.14Å
71	A	58.3	Low	64.5	Low	44 Å²	44	90.4 Å²	90.4	36%	0.364	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-16.9	-175.2	0	0	0	0	0	112.9	L66 D67	L66-A71 WeakPolarHBondContact O-CA 3.37Å; L66-A71 PolarHBondContact O-N 3.25Å; D67-A71 WeakPolarHBondContact O-CB 3.34Å
72	Y	52.1	Low	64.1	Low	92 Å²	92	89.9 Å²	89.9	36%	0.361	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.6	23.4	-171	-57.5	-58.5	0	0	0	113.3	H70 E74 T78 L92	H70-Y72 PolarHBondContact O-N 3.22Å; Y72-E74 PolarHBondContact O-N 3.26Å; Y72-T78 VanDerWaalsContact CB-OG1 3.25Å; Y72-T78 WeakPolarHBondContact CB-OG1 3.47Å; Y72-T78 HydrophobicContact CD1-CG2 3.2Å; Y72-T78 HydrophobicContact CE1-CG2 4.09Å; Y72-T78 HydrophobicContact CG-CG2 3.75Å; Y72-L92 HydrophobicContact CD2-CD1 4.41Å; Y72-L92 HydrophobicContact CD2-CD2 3.77Å; Y72-L92 HydrophobicContact CE2-CD2 3.65Å
73	V	49.8	Very low	63.8	Low	98 Å²	98	92 Å²	92	59%	0.594	48%	0.481	S	S	*	.			trans	-79.9	54.5	170.3	-173.1	0	0	0	0	109.2	H70	H70-V73 HydrophobicContact CB-CG2 4.43Å; H70-V73 PolarHBondContact O-N 2.73Å; H70-V73 VanDerWaalsContact O-N 3.14Å
74	E	39.9	Very low	63.6	Low	159 Å²	159	85.8 Å²	85.8	74%	0.743	45%	0.454	S	S	*	.	S	Bend	trans	-154.6	116	150	-67.2	-160.3	167.7	0	0	105.1	Y72	Y72-E74 PolarHBondContact O-N 3.26Å
75	L	43.2	Very low	63.8	Low	145 Å²	145	90.5 Å²	90.5	76%	0.759	47%	0.47	S	S	*	.			trans	81.4	127.4	164.8	-53.7	153.8	0	0	0	117.7	E77	L75-E77 PolarHBondContact O-N 3.3Å
76	D	48.1	Very low	63.7	Low	174 Å²	174	94 Å²	94	93%	0.93	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	9.9	-179.7	-133.9	-12.4	0	0	0	115.3
77	E	54.8	Low	63.9	Low	176 Å²	176	93.8 Å²	93.8	82%	0.822	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.6	12.4	-167.5	-60.7	-154.7	154.5	0	0	114.6	L75 P79	L75-E77 PolarHBondContact O-N 3.3Å; E77-P79 WeakPolarHBondContact O-CD 3.29Å
78	T	54.9	Low	64.1	Low	52 Å²	52	96.6 Å²	96.6	32%	0.319	51%	0.511	S	S	.	.			trans	-76.1	123.1	-172	45.4	0	0	0	0	112.6	Y72 K80	Y72-T78 VanDerWaalsContact CB-OG1 3.25Å; Y72-T78 WeakPolarHBondContact CB-OG1 3.47Å; Y72-T78 HydrophobicContact CD1-CG2 3.2Å; Y72-T78 HydrophobicContact CE1-CG2 4.09Å; Y72-T78 HydrophobicContact CG-CG2 3.75Å; T78-K80 PolarHBondContact O-N 3.38Å; T78-K80 VanDerWaalsContact O-N 3.14Å
79	P	61.2	Low	64.4	Low	106 Å²	106	102 Å²	102	69%	0.688	53%	0.525	S	S	*	.			trans	-70.7	115.4	-174.6	26.3	-31.8	0	0	0	109.6	E77 P81	E77-P79 WeakPolarHBondContact O-CD 3.29Å; P79-P81 WeakPolarHBondContact O-CD 3.46Å; P79-P81 VanDerWaalsContact O-N 3.15Å
80	K	66.3	Low	64.8	Low	113 Å²	113	97.4 Å²	97.4	49%	0.491	51%	0.506	S	S	.	.			trans	-64.5	109	171.1	-72	155.8	175.8	179.2	0	108.5	T78 F82 V83 G90 L92	T78-K80 PolarHBondContact O-N 3.38Å; T78-K80 VanDerWaalsContact O-N 3.14Å; K80-F82 PolarHBondContact O-N 3.09Å; K80-V83 VanDerWaalsContact O-CG2 3.29Å; K80-V83 WeakPolarHBondContact O-CG2 3.34Å; K80-G90 VanDerWaalsContact CB-CA 3.44Å; K80-G90 WeakPolarHBondContact CD-O 3.47Å; K80-L92 HydrophobicContact CG-CD2 4.13Å
81	P	74.5	Confident	64.8	Low	79 Å²	79	98 Å²	98	51%	0.513	51%	0.509	S	S	.	.	S	Bend	trans	-68.4	-24	-167.9	25.7	-33.7	0	0	0	113	P79	P79-P81 WeakPolarHBondContact O-CD 3.46Å; P79-P81 VanDerWaalsContact O-N 3.15Å
82	F	77.6	Confident	65.1	Low	70 Å²	70	98.7 Å²	98.7	31%	0.307	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	92.2	-179.5	-58	-71.7	0	0	0	109.9	K80 G90 F91 L92 F93 I94 L97	K80-F82 PolarHBondContact O-N 3.09Å; F82-G90 CarbonylContact O-C 3.56Å; F82-G90 WeakPolarHBondContact O-CA 3.2Å; F82-F91 HydrophobicContact CB-CB 4.19Å; F82-F91 WeakPolarHBondContact CB-O 3.47Å; F82-F91 PolarHBondContact N-O 3.13Å; F82-F91 WeakPolarHBondContact O-CD2 3.45Å; F82-F91 PolarHBondContact O-N 3.1Å; F82-L92 WeakPolarHBondContact CD2-O 3.5Å; F82-L92 WeakPolarHBondContact CE2-O 3.47Å; F82-F93 VanDerWaalsContact CD2-C 3.42Å; F82-I94 HydrophobicContact CD1-CB 4.01Å; F82-I94 HydrophobicContact CD1-CG1 4.25Å; F82-I94 HydrophobicContact CE1-CB 3.8Å; F82-I94 HydrophobicContact CE1-CD1 4.3Å; F82-I94 HydrophobicContact CE1-CG1 4.22Å; F82-I94 HydrophobicContact CE2-CB 4.34Å; F82-I94 HydrophobicContact CG-CB 4.36Å; F82-I94 HydrophobicContact CZ-CB 3.97Å; F82-L97 HydrophobicContact CB-CB 3.92Å; F82-L97 HydrophobicContact CB-CD2 3.75Å; F82-L97 HydrophobicContact CB-CG 4.39Å
83	V	75.6	Confident	65.8	Low	69 Å²	69	97.2 Å²	97.2	42%	0.418	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	133.1	179.5	-174.7	0	0	0	0	110.8	K80 K85 D88	K80-V83 VanDerWaalsContact O-CG2 3.29Å; K80-V83 WeakPolarHBondContact O-CG2 3.34Å; V83-K85 PolarHBondContact O-N 2.85Å; V83-D88 HydrophobicContact CG1-CB 4.4Å
84	C	77.7	Confident	66.9	Low	0 Å²	0	95.8 Å²	95.8	0%	0	49%	0.49	C	S	.	.			trans	-70.6	113.1	169.6	179.4	0	0	0	0	110.1	T86 C87 D88 R89 F91 L97 H100 H104	C84-T86 PolarHBondContact O-N 2.81Å; C84-T86 PolarHBondContact SG-N 3.35Å; C84-T86 VanDerWaalsContact SG-N 3.35Å; C84-C87 PolarHBondContact O-N 3.44Å; C84-D88 WeakPolarHBondContact O-CA 3.42Å; C84-D88 PolarHBondContact O-N 3.46Å; C84-R89 WeakPolarHBondContact CB-O 3.29Å; C84-R89 PolarHBondContact N-O 3.04Å; C84-F91 HydrophobicContact CB-CE2 4.27Å; C84-L97 HydrophobicContact CB-CD1 3.85Å; C84-H100 WeakPolarHBondContact CB-NE2 3.42Å; C84-H100 PolarHBondContact SG-NE2 3.45Å; C84-H104 PolarHBondContact SG-CD2 3.18Å; C84-H104 PolarHBondContact SG-NE2 3.27Å
85	K	81.4	Confident	68.3	Low	201 Å²	201	93.4 Å²	93.4	87%	0.874	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-7.4	176.3	-61.3	-174	177.1	-175.7	0	114.7	V83	V83-K85 PolarHBondContact O-N 2.85Å
86	T	75.3	Confident	69.7	Low	94 Å²	94	88.7 Å²	88.7	58%	0.577	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-24.5	-179.3	-46.8	0	0	0	0	113.1	C84 H104	C84-T86 PolarHBondContact O-N 2.81Å; C84-T86 PolarHBondContact SG-N 3.35Å; C84-T86 VanDerWaalsContact SG-N 3.35Å; T86-H104 HydrophobicContact CG2-CB 4.03Å; T86-H104 WeakPolarHBondContact CG2-ND1 3.47Å
87	C	77.3	Confident	71	Confident	56 Å²	56	81.5 Å²	81.5	38%	0.378	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.6	9.6	179.8	71.6	0	0	0	0	114.6	C84 R89 H100 H104	C84-C87 PolarHBondContact O-N 3.44Å; C87-R89 PolarHBondContact O-N 3.16Å; C87-R89 WeakPolarHBondContact SG-CB 3.28Å; C87-H100 PolarHBondContact SG-CE1 3.17Å; C87-H100 PolarHBondContact SG-NE2 3.3Å; C87-H104 VanDerWaalsContact CB-CE1 3.48Å; C87-H104 WeakPolarHBondContact CB-CE1 3.32Å; C87-H104 VanDerWaalsContact SG-CE1 3.51Å; C87-H104 PolarHBondContact SG-NE2 3.26Å
88	D	76.2	Confident	71.8	Confident	129 Å²	129	77.2 Å²	77.2	69%	0.69	40%	0.402	S	S	*	.			trans	55.9	13.6	-179.1	-54.5	-47.4	0	0	0	115	V83 C84 G90	V83-D88 HydrophobicContact CG1-CB 4.4Å; C84-D88 WeakPolarHBondContact O-CA 3.42Å; C84-D88 PolarHBondContact O-N 3.46Å; D88-G90 PolarHBondContact O-N 3.4Å
89	R	73.6	Confident	72.4	Confident	159 Å²	159	78.7 Å²	78.7	60%	0.6	41%	0.405	S	S	*	.			trans	-69.9	118.8	173.5	-169.3	168	-176.3	157.8	5.1	109.2	C84 C87 F91	C84-R89 WeakPolarHBondContact CB-O 3.29Å; C84-R89 PolarHBondContact N-O 3.04Å; C87-R89 PolarHBondContact O-N 3.16Å; C87-R89 WeakPolarHBondContact SG-CB 3.28Å; R89-F91 HydrophobicContact CB-CE2 3.98Å; R89-F91 HydrophobicContact CB-CZ 4.18Å; R89-F91 HydrophobicContact CG-CE2 3.88Å; R89-F91 HydrophobicContact CG-CZ 3.69Å; R89-F91 VanDerWaalsContact O-CD2 3.31Å; R89-F91 WeakPolarHBondContact O-CD2 3.46Å; R89-F91 WeakPolarHBondContact O-CE2 3.1Å
90	G	73.8	Confident	72.9	Confident	12 Å²	12	74.8 Å²	74.8	12%	0.124	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	148.7	173.8	0	0	0	0	0	113.6	K80 F82 D88	K80-G90 VanDerWaalsContact CB-CA 3.44Å; K80-G90 WeakPolarHBondContact CD-O 3.47Å; F82-G90 CarbonylContact O-C 3.56Å; F82-G90 WeakPolarHBondContact O-CA 3.2Å; D88-G90 PolarHBondContact O-N 3.4Å
91	F	69.4	Low	73	Confident	29 Å²	29	72.3 Å²	72.3	13%	0.127	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	147.2	176.8	-61.8	-89	0	0	0	109.8	F82 C84 R89 L97 H100	F82-F91 HydrophobicContact CB-CB 4.19Å; F82-F91 WeakPolarHBondContact CB-O 3.47Å; F82-F91 PolarHBondContact N-O 3.13Å; F82-F91 WeakPolarHBondContact O-CD2 3.45Å; F82-F91 PolarHBondContact O-N 3.1Å; C84-F91 HydrophobicContact CB-CE2 4.27Å; R89-F91 HydrophobicContact CB-CE2 3.98Å; R89-F91 HydrophobicContact CB-CZ 4.18Å; R89-F91 HydrophobicContact CG-CE2 3.88Å; R89-F91 HydrophobicContact CG-CZ 3.69Å; R89-F91 VanDerWaalsContact O-CD2 3.31Å; R89-F91 WeakPolarHBondContact O-CD2 3.46Å; R89-F91 WeakPolarHBondContact O-CE2 3.1Å; F91-L97 HydrophobicContact CB-CB 4.06Å; F91-L97 HydrophobicContact CD2-CB 3.88Å; F91-L97 HydrophobicContact CD2-CD1 3.65Å; F91-L97 HydrophobicContact CD2-CG 4.37Å; F91-L97 HydrophobicContact CE2-CD1 3.97Å; F91-L97 HydrophobicContact CG-CB 4.04Å; F91-H100 HydrophobicContact CD1-CB 4.43Å; F91-H100 HydrophobicContact CE1-CB 3.57Å; F91-H100 AromaticContact CE1-CG 3.88Å; F91-H100 HydrophobicContact CE2-CB 3.76Å; F91-H100 AromaticContact CE2-CD2 3.11Å; F91-H100 WeakPolarHBondContact CE2-CD2 3.31Å; F91-H100 AromaticContact CE2-CG 3.4Å; F91-H100 VanDerWaalsContact CE2-CG 3.4Å; F91-H100 AromaticContact CE2-NE2 3.57Å; F91-H100 HydrophobicContact CZ-CB 3.21Å; F91-H100 AromaticContact CZ-CD2 3.27Å; F91-H100 WeakPolarHBondContact CZ-CD2 3.43Å; F91-H100 AromaticContact CZ-CE1 3.81Å; F91-H100 AromaticContact CZ-CG 3Å; F91-H100 AromaticContact CZ-ND1 3.41Å; F91-H100 WeakPolarHBondContact CZ-ND1 3.48Å; F91-H100 AromaticContact CZ-NE2 3.72Å
92	L	64.4	Low	72.7	Confident	60 Å²	60	71.2 Å²	71.2	31%	0.314	36%	0.359	S	S	.	.	S	Bend	trans	-78	-27.2	176	-56.6	-176.9	0	0	0	111.9	S68 Y72 K80 F82	S68-L92 VanDerWaalsContact O-CD1 3.29Å; S68-L92 WeakPolarHBondContact O-CD1 3.1Å; Y72-L92 HydrophobicContact CD2-CD1 4.41Å; Y72-L92 HydrophobicContact CD2-CD2 3.77Å; Y72-L92 HydrophobicContact CE2-CD2 3.65Å; K80-L92 HydrophobicContact CG-CD2 4.13Å; F82-L92 WeakPolarHBondContact CD2-O 3.5Å; F82-L92 WeakPolarHBondContact CE2-O 3.47Å
93	F	67.4	Low	72.1	Confident	60 Å²	60	74.7 Å²	74.7	26%	0.263	38%	0.376	S	S	.	.	S	Bend	trans	-125.2	144.1	-179.9	-60.2	-77.2	0	0	0	112.2	F82 I95 S96 L97	F82-F93 VanDerWaalsContact CD2-C 3.42Å; F93-I95 PolarHBondContact O-N 3.4Å; F93-S96 WeakPolarHBondContact O-CB 3.41Å; F93-S96 PolarHBondContact O-N 2.86Å; F93-S96 VanDerWaalsContact O-N 3.1Å; F93-L97 PolarHBondContact O-N 3.31Å
94	I	72.9	Confident	71.7	Confident	68 Å²	68	74.2 Å²	74.2	35%	0.349	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-34.2	172.8	-164.6	169.4	0	0	0	112.3	F82 S96 L97 Q98 L256	F82-I94 HydrophobicContact CD1-CB 4.01Å; F82-I94 HydrophobicContact CD1-CG1 4.25Å; F82-I94 HydrophobicContact CE1-CB 3.8Å; F82-I94 HydrophobicContact CE1-CD1 4.3Å; F82-I94 HydrophobicContact CE1-CG1 4.22Å; F82-I94 HydrophobicContact CE2-CB 4.34Å; F82-I94 HydrophobicContact CG-CB 4.36Å; F82-I94 HydrophobicContact CZ-CB 3.97Å; I94-S96 VanDerWaalsContact C-N 3.31Å; I94-S96 PolarHBondContact O-N 2.63Å; I94-L97 PolarHBondContact O-N 3.1Å; I94-Q98 HydrophobicContact CG1-CG 4.38Å; I94-Q98 WeakPolarHBondContact O-CB 3.38Å; I94-Q98 VanDerWaalsContact O-CG 3.25Å; I94-Q98 WeakPolarHBondContact O-CG 3.23Å; I94-Q98 PolarHBondContact O-N 3.42Å; I94-L256 HydrophobicContact CD1-CD1 4.34Å
95	I	68.7	Low	70.7	Confident	109 Å²	109	77.3 Å²	77.3	56%	0.559	39%	0.39	S	S	*	.	H	α-helix	trans	-63.7	-40.4	176.9	-62.3	173.5	0	0	0	110.1	F93 Q98 Q99	F93-I95 PolarHBondContact O-N 3.4Å; I95-Q98 PolarHBondContact O-N 2.88Å; I95-Q99 WeakPolarHBondContact O-CB 3.42Å; I95-Q99 PolarHBondContact O-N 2.83Å
96	S	73.3	Confident	69.4	Low	47 Å²	47	77.4 Å²	77.4	33%	0.329	39%	0.391	S	S	.	.	H	α-helix	trans	-68.1	-42	176.2	-52.4	0	0	0	0	111.5	F93 I94 Q99 H100	F93-S96 WeakPolarHBondContact O-CB 3.41Å; F93-S96 PolarHBondContact O-N 2.86Å; F93-S96 VanDerWaalsContact O-N 3.1Å; I94-S96 VanDerWaalsContact C-N 3.31Å; I94-S96 PolarHBondContact O-N 2.63Å; S96-Q99 PolarHBondContact O-N 3.39Å; S96-H100 VanDerWaalsContact O-CB 3.26Å; S96-H100 WeakPolarHBondContact O-CB 3.31Å; S96-H100 PolarHBondContact O-N 3.42Å
97	L	74.8	Confident	67.8	Low	22 Å²	22	80.6 Å²	80.6	12%	0.115	40%	0.404	C	S	.	.	H	α-helix	trans	-60.3	-47.2	172.2	173.8	62.6	0	0	0	110.9	F82 C84 F91 F93 I94 Q99 H100 L101	F82-L97 HydrophobicContact CB-CB 3.92Å; F82-L97 HydrophobicContact CB-CD2 3.75Å; F82-L97 HydrophobicContact CB-CG 4.39Å; C84-L97 HydrophobicContact CB-CD1 3.85Å; F91-L97 HydrophobicContact CB-CB 4.06Å; F91-L97 HydrophobicContact CD2-CB 3.88Å; F91-L97 HydrophobicContact CD2-CD1 3.65Å; F91-L97 HydrophobicContact CD2-CG 4.37Å; F91-L97 HydrophobicContact CE2-CD1 3.97Å; F91-L97 HydrophobicContact CG-CB 4.04Å; F93-L97 PolarHBondContact O-N 3.31Å; I94-L97 PolarHBondContact O-N 3.1Å; L97-Q99 PolarHBondContact O-N 3.26Å; L97-H100 CarbonylContact O-C 3.35Å; L97-H100 WeakPolarHBondContact O-CB 3.12Å; L97-H100 PolarHBondContact O-N 3.32Å; L97-H100 VanDerWaalsContact O-N 3.13Å; L97-L101 HydrophobicContact CD1-CD1 4.12Å; L97-L101 HydrophobicContact CD1-CD2 4.21Å; L97-L101 HydrophobicContact CD1-CG 3.88Å; L97-L101 HydrophobicContact CD2-CD1 4.45Å; L97-L101 HydrophobicContact CG-CD1 3.91Å; L97-L101 HydrophobicContact CG-CG 4.15Å; L97-L101 VanDerWaalsContact O-CG 3.27Å; L97-L101 WeakPolarHBondContact O-CG 3.44Å; L97-L101 PolarHBondContact O-N 2.99Å
98	Q	72.4	Confident	66.5	Low	87 Å²	87	82.6 Å²	82.6	41%	0.407	42%	0.418	S	S	.	.	H	α-helix	trans	-58.4	-47.2	178.4	-77.2	174.5	-9.2	0	0	111.5	I94 I95 H100 L101 L102	I94-Q98 HydrophobicContact CG1-CG 4.38Å; I94-Q98 WeakPolarHBondContact O-CB 3.38Å; I94-Q98 VanDerWaalsContact O-CG 3.25Å; I94-Q98 WeakPolarHBondContact O-CG 3.23Å; I94-Q98 PolarHBondContact O-N 3.42Å; I95-Q98 PolarHBondContact O-N 2.88Å; Q98-H100 VanDerWaalsContact C-N 3.27Å; Q98-H100 PolarHBondContact O-N 3.3Å; Q98-L101 PolarHBondContact O-N 3.27Å; Q98-L102 WeakPolarHBondContact O-CG 3.32Å; Q98-L102 PolarHBondContact O-N 2.98Å
99	Q	66.2	Low	65.1	Low	83 Å²	83	81.8 Å²	81.8	39%	0.388	42%	0.42	S	S	.	.	H	α-helix	trans	-63.4	-36.2	176.7	-172.8	175	16	0	0	111.9	I95 S96 L97 L102	I95-Q99 WeakPolarHBondContact O-CB 3.42Å; I95-Q99 PolarHBondContact O-N 2.83Å; S96-Q99 PolarHBondContact O-N 3.39Å; L97-Q99 PolarHBondContact O-N 3.26Å; Q99-L102 WeakPolarHBondContact O-CB 3.11Å; Q99-L102 PolarHBondContact O-N 2.73Å
100	H	72.6	Confident	63.9	Low	24 Å²	24	82.5 Å²	82.5	11%	0.111	43%	0.427	C	S	.	.	H	α-helix	trans	-70.6	-39	175.3	163.4	78	0	0	0	113.2	C84 C87 F91 S96 L97 Q98 L102 Q103 H104	C84-H100 WeakPolarHBondContact CB-NE2 3.42Å; C84-H100 PolarHBondContact SG-NE2 3.45Å; C87-H100 PolarHBondContact SG-CE1 3.17Å; C87-H100 PolarHBondContact SG-NE2 3.3Å; F91-H100 HydrophobicContact CD1-CB 4.43Å; F91-H100 HydrophobicContact CE1-CB 3.57Å; F91-H100 AromaticContact CE1-CG 3.88Å; F91-H100 HydrophobicContact CE2-CB 3.76Å; F91-H100 AromaticContact CE2-CD2 3.11Å; F91-H100 WeakPolarHBondContact CE2-CD2 3.31Å; F91-H100 AromaticContact CE2-CG 3.4Å; F91-H100 VanDerWaalsContact CE2-CG 3.4Å; F91-H100 AromaticContact CE2-NE2 3.57Å; F91-H100 HydrophobicContact CZ-CB 3.21Å; F91-H100 AromaticContact CZ-CD2 3.27Å; F91-H100 WeakPolarHBondContact CZ-CD2 3.43Å; F91-H100 AromaticContact CZ-CE1 3.81Å; F91-H100 AromaticContact CZ-CG 3Å; F91-H100 AromaticContact CZ-ND1 3.41Å; F91-H100 WeakPolarHBondContact CZ-ND1 3.48Å; F91-H100 AromaticContact CZ-NE2 3.72Å; S96-H100 VanDerWaalsContact O-CB 3.26Å; S96-H100 WeakPolarHBondContact O-CB 3.31Å; S96-H100 PolarHBondContact O-N 3.42Å; L97-H100 CarbonylContact O-C 3.35Å; L97-H100 WeakPolarHBondContact O-CB 3.12Å; L97-H100 PolarHBondContact O-N 3.32Å; L97-H100 VanDerWaalsContact O-N 3.13Å; Q98-H100 VanDerWaalsContact C-N 3.27Å; Q98-H100 PolarHBondContact O-N 3.3Å; H100-L102 PolarHBondContact O-N 3.14Å; H100-Q103 WeakPolarHBondContact O-CA 3.37Å; H100-Q103 WeakPolarHBondContact O-CB 3.48Å; H100-Q103 WeakPolarHBondContact O-CG 3.08Å; H100-Q103 PolarHBondContact O-N 3.19Å; H100-H104 AromaticContact CD2-CD2 3.9Å; H100-H104 AromaticContact CD2-NE2 3.94Å; H100-H104 AromaticContact CE1-CD2 3.66Å; H100-H104 AromaticContact CE1-NE2 3.01Å; H100-H104 PolarHBondContact CE1-NE2 3.38Å; H100-H104 AromaticContact ND1-NE2 3.98Å; H100-H104 AromaticContact NE2-CD2 3.39Å; H100-H104 PolarHBondContact NE2-CD2 3.12Å; H100-H104 AromaticContact NE2-NE2 2.98Å; H100-H104 PolarHBondContact NE2-NE2 3.01Å
101	L	68.9	Low	63.2	Low	60 Å²	60	90.2 Å²	90.2	31%	0.314	46%	0.457	S	S	.	.	H	α-helix	trans	-59.7	-28.4	176.5	-72.6	171.2	0	0	0	111.5	L97 Q98 Q103 H104 C105	L97-L101 HydrophobicContact CD1-CD1 4.12Å; L97-L101 HydrophobicContact CD1-CD2 4.21Å; L97-L101 HydrophobicContact CD1-CG 3.88Å; L97-L101 HydrophobicContact CD2-CD1 4.45Å; L97-L101 HydrophobicContact CG-CD1 3.91Å; L97-L101 HydrophobicContact CG-CG 4.15Å; L97-L101 VanDerWaalsContact O-CG 3.27Å; L97-L101 WeakPolarHBondContact O-CG 3.44Å; L97-L101 PolarHBondContact O-N 2.99Å; Q98-L101 PolarHBondContact O-N 3.27Å; L101-Q103 PolarHBondContact O-N 3.41Å; L101-H104 PolarHBondContact O-N 3.22Å; L101-C105 PolarHBondContact O-N 3.49Å
102	L	67.1	Low	63.2	Low	56 Å²	56	92.1 Å²	92.1	29%	0.293	47%	0.469	S	S	.	.	H	α-helix	trans	-60.9	-21.8	170.8	-58.6	174.3	0	0	0	113.3	Q98 Q99 H100 A123	Q98-L102 WeakPolarHBondContact O-CG 3.32Å; Q98-L102 PolarHBondContact O-N 2.98Å; Q99-L102 WeakPolarHBondContact O-CB 3.11Å; Q99-L102 PolarHBondContact O-N 2.73Å; H100-L102 PolarHBondContact O-N 3.14Å; L102-A123 HydrophobicContact CD1-CB 3.97Å
103	Q	65.3	Low	63.7	Low	143 Å²	143	91.4 Å²	91.4	67%	0.668	47%	0.465	S	S	*	.	H	α-helix	trans	-79.2	-27.3	174	-54.3	-62.5	-56.2	0	0	112.3	H100 L101	H100-Q103 WeakPolarHBondContact O-CA 3.37Å; H100-Q103 WeakPolarHBondContact O-CB 3.48Å; H100-Q103 WeakPolarHBondContact O-CG 3.08Å; H100-Q103 PolarHBondContact O-N 3.19Å; L101-Q103 PolarHBondContact O-N 3.41Å
104	H	66.4	Low	64.4	Low	59 Å²	59	91.4 Å²	91.4	27%	0.273	47%	0.471	S	S	.	.	H	α-helix	trans	-83.3	-36.6	177.8	-72.5	-61.4	0	0	0	112.7	C84 T86 C87 H100 L101 K106	C84-H104 PolarHBondContact SG-CD2 3.18Å; C84-H104 PolarHBondContact SG-NE2 3.27Å; T86-H104 HydrophobicContact CG2-CB 4.03Å; T86-H104 WeakPolarHBondContact CG2-ND1 3.47Å; C87-H104 VanDerWaalsContact CB-CE1 3.48Å; C87-H104 WeakPolarHBondContact CB-CE1 3.32Å; C87-H104 VanDerWaalsContact SG-CE1 3.51Å; C87-H104 PolarHBondContact SG-NE2 3.26Å; H100-H104 AromaticContact CD2-CD2 3.9Å; H100-H104 AromaticContact CD2-NE2 3.94Å; H100-H104 AromaticContact CE1-CD2 3.66Å; H100-H104 AromaticContact CE1-NE2 3.01Å; H100-H104 PolarHBondContact CE1-NE2 3.38Å; H100-H104 AromaticContact ND1-NE2 3.98Å; H100-H104 AromaticContact NE2-CD2 3.39Å; H100-H104 PolarHBondContact NE2-CD2 3.12Å; H100-H104 AromaticContact NE2-NE2 2.98Å; H100-H104 PolarHBondContact NE2-NE2 3.01Å; L101-H104 PolarHBondContact O-N 3.22Å; H104-K106 PolarHBondContact O-N 3.19Å
105	C	57.2	Low	64.8	Low	66 Å²	66	88.3 Å²	88.3	45%	0.446	46%	0.455	S	S	.	.			trans	-75.7	88.5	177.1	-63.2	0	0	0	0	110	L101 L107	L101-C105 PolarHBondContact O-N 3.49Å; C105-L107 PolarHBondContact O-N 2.98Å
106	K	55.1	Low	65.5	Low	203 Å²	203	92.2 Å²	92.2	88%	0.883	47%	0.468	S	S	*	.	S	Bend	trans	-61.4	-14.4	162.9	-76.4	-176.5	173.9	176.2	0	112.3	H104	H104-K106 PolarHBondContact O-N 3.19Å
107	L	41.7	Very low	66	Low	161 Å²	161	94.9 Å²	94.9	84%	0.843	48%	0.482	S	S	*	.	S	Bend	trans	-152.3	105	-176.1	-71.8	157.6	0	0	0	110.6	C105	C105-L107 PolarHBondContact O-N 2.98Å
108	S	49.5	Very low	66.3	Low	98 Å²	98	96.3 Å²	96.3	69%	0.685	49%	0.494	S	S	*	.			trans	156.8	140.3	154	176	0	0	0	0	112.1
109	P	45.6	Very low	66.7	Low	111 Å²	111	99.2 Å²	99.2	72%	0.721	51%	0.505	S	S	*	.			trans	-109.8	97.9	-135.6	38	-28.4	0	0	0	114.3
110	K	49.9	Very low	67.2	Low	174 Å²	174	101.6 Å²	101.6	76%	0.757	51%	0.514	S	S	*	.	S	Bend		-86.9	107.3	122.8	-113.8	-179.5	-179.8	176.8	0	104	L112	K110-L112 VanDerWaalsContact C-N 3.35Å; K110-L112 PolarHBondContact O-N 3.32Å
111	K	57.5	Low	67.6	Low	175 Å²	175	105.1 Å²	105.1	76%	0.761	53%	0.534	S	S	*	.			trans	-40.8	99.4	-178.3	-178.3	177.2	-177.9	175.7	0	108.8	L113	K111-L113 PolarHBondContact O-N 3.49Å
112	L	70	Confident	68	Low	69 Å²	69	103.9 Å²	103.9	36%	0.361	53%	0.525	S	S	.	.			trans	-55.1	141.6	171.6	-70.3	173.8	0	0	0	106	K110 P114 N121	K110-L112 VanDerWaalsContact C-N 3.35Å; K110-L112 PolarHBondContact O-N 3.32Å; L112-P114 WeakPolarHBondContact O-CD 3.37Å; L112-N121 HydrophobicContact CB-CB 3.92Å; L112-N121 HydrophobicContact CD1-CB 3.93Å; L112-N121 HydrophobicContact CG-CB 4.45Å
113	L	76	Confident	68.4	Low	44 Å²	44	102.7 Å²	102.7	23%	0.23	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	102.6	-172.1	-61.7	167.7	0	0	0	106.9	K111 F122 Q125 L128	K111-L113 PolarHBondContact O-N 3.49Å; L113-F122 PolarHBondContact N-O 2.92Å; L113-F122 PolarHBondContact O-N 3.29Å; L113-F122 VanDerWaalsContact O-N 3.09Å; L113-Q125 HydrophobicContact CD1-CB 3.74Å; L113-Q125 VanDerWaalsContact CD1-N 3.29Å; L113-L128 HydrophobicContact CB-CB 4.34Å; L113-L128 HydrophobicContact CB-CD2 3.7Å
114	P	81.3	Confident	69	Low	61 Å²	61	99.9 Å²	99.9	40%	0.396	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	136.5	-179.3	30.9	-35.8	0	0	0	109.2	L112 K116 K120	L112-P114 WeakPolarHBondContact O-CD 3.37Å; P114-K116 PolarHBondContact O-N 3.29Å; P114-K120 CarbonylContact C-O 3.54Å; P114-K120 WeakPolarHBondContact CA-O 3.05Å
115	C	81.6	Confident	69.7	Low	3 Å²	3	101.4 Å²	101.4	2%	0.02	52%	0.518	C	S	.	.			trans	-60.8	125.3	163.9	-178.8	0	0	0	0	109.4	V117 K119 K120 F122 L128 H131 H135	C115-V117 PolarHBondContact O-N 3.18Å; C115-V117 PolarHBondContact SG-N 3.17Å; C115-K119 WeakPolarHBondContact O-CA 3.42Å; C115-K119 PolarHBondContact O-N 2.96Å; C115-K120 PolarHBondContact N-O 3.33Å; C115-F122 HydrophobicContact CB-CE2 4.22Å; C115-L128 HydrophobicContact CB-CD1 3.92Å; C115-H131 PolarHBondContact SG-NE2 2.94Å; C115-H135 PolarHBondContact SG-CD2 3.42Å; C115-H135 PolarHBondContact SG-NE2 2.85Å
116	K	83.5	Confident	70.9	Confident	191 Å²	191	101.8 Å²	101.8	83%	0.83	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-30.1	179	-66.3	-176	179.8	-180	0	112.6	P114	P114-K116 PolarHBondContact O-N 3.29Å
117	V	83.6	Confident	72.1	Confident	102 Å²	102	94.3 Å²	94.3	62%	0.618	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-58	-176.2	-175.2	0	0	0	0	112	C115 H135	C115-V117 PolarHBondContact O-N 3.18Å; C115-V117 PolarHBondContact SG-N 3.17Å; V117-H135 HydrophobicContact CB-CB 4.47Å; V117-H135 HydrophobicContact CG1-CB 4.43Å; V117-H135 HydrophobicContact CG2-CB 4.13Å
118	C	81.4	Confident	74.1	Confident	53 Å²	53	87.8 Å²	87.8	36%	0.358	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	3.6	-172.8	71.3	0	0	0	0	114.7	K120 H131	C118-K120 PolarHBondContact O-N 2.91Å; C118-H131 PolarHBondContact SG-NE2 3.35Å
119	K	80.4	Confident	75.7	Confident	147 Å²	147	88.1 Å²	88.1	64%	0.639	45%	0.446	S	S	*	.			trans	59.3	10.1	179.2	-51.3	-59.7	-175	-172.9	0	116	C115	C115-K119 WeakPolarHBondContact O-CA 3.42Å; C115-K119 PolarHBondContact O-N 2.96Å
120	K	76.9	Confident	77.5	Confident	134 Å²	134	87.6 Å²	87.6	58%	0.583	43%	0.43	S	S	*	.			trans	-61.7	137	169.7	-74.6	-171.7	177.8	-174	0	110.5	P114 C115 C118 F122	P114-K120 CarbonylContact C-O 3.54Å; P114-K120 WeakPolarHBondContact CA-O 3.05Å; C115-K120 PolarHBondContact N-O 3.33Å; C118-K120 PolarHBondContact O-N 2.91Å; K120-F122 HydrophobicContact CB-CE2 3.88Å; K120-F122 HydrophobicContact CB-CZ 4.07Å; K120-F122 WeakPolarHBondContact O-CD2 3.41Å; K120-F122 WeakPolarHBondContact O-CE2 3.27Å
121	N	80	Confident	79.1	Confident	98 Å²	98	80.3 Å²	80.3	52%	0.524	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.3	-176.6	-73.6	-39.1	0	0	0	111.4	L112	L112-N121 HydrophobicContact CB-CB 3.92Å; L112-N121 HydrophobicContact CD1-CB 3.93Å; L112-N121 HydrophobicContact CG-CB 4.45Å
122	F	77.9	Confident	80.3	Confident	33 Å²	33	74.4 Å²	74.4	15%	0.145	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	144.4	179	-64.7	-83.3	0	0	0	111.1	L113 C115 K120 E127 L128 H131	L113-F122 PolarHBondContact N-O 2.92Å; L113-F122 PolarHBondContact O-N 3.29Å; L113-F122 VanDerWaalsContact O-N 3.09Å; C115-F122 HydrophobicContact CB-CE2 4.22Å; K120-F122 HydrophobicContact CB-CE2 3.88Å; K120-F122 HydrophobicContact CB-CZ 4.07Å; K120-F122 WeakPolarHBondContact O-CD2 3.41Å; K120-F122 WeakPolarHBondContact O-CE2 3.27Å; F122-E127 HydrophobicContact CB-CB 4.14Å; F122-E127 HydrophobicContact CD1-CB 3.71Å; F122-E127 HydrophobicContact CG-CB 4.26Å; F122-L128 HydrophobicContact CB-CB 4.04Å; F122-L128 HydrophobicContact CD2-CB 3.95Å; F122-L128 HydrophobicContact CD2-CD1 3.71Å; F122-L128 HydrophobicContact CD2-CG 4.42Å; F122-L128 HydrophobicContact CE2-CD1 4.05Å; F122-L128 HydrophobicContact CG-CB 4.07Å; F122-H131 HydrophobicContact CD1-CB 4.46Å; F122-H131 HydrophobicContact CE1-CB 3.67Å; F122-H131 AromaticContact CE1-CG 3.9Å; F122-H131 HydrophobicContact CE2-CB 3.83Å; F122-H131 AromaticContact CE2-CD2 3.37Å; F122-H131 WeakPolarHBondContact CE2-CD2 3.11Å; F122-H131 AromaticContact CE2-CG 3.49Å; F122-H131 VanDerWaalsContact CE2-CG 3.49Å; F122-H131 AromaticContact CE2-NE2 3.9Å; F122-H131 HydrophobicContact CZ-CB 3.34Å; F122-H131 AromaticContact CZ-CD2 3.46Å; F122-H131 VanDerWaalsContact CZ-CD2 3.46Å; F122-H131 WeakPolarHBondContact CZ-CD2 3.15Å; F122-H131 AromaticContact CZ-CE1 3.82Å; F122-H131 AromaticContact CZ-CG 3.07Å; F122-H131 AromaticContact CZ-ND1 3.35Å; F122-H131 VanDerWaalsContact CZ-ND1 3.35Å; F122-H131 WeakPolarHBondContact CZ-ND1 3.48Å; F122-H131 AromaticContact CZ-NE2 3.91Å
123	A	76.2	Confident	80.8	Confident	31 Å²	31	73.1 Å²	73.1	26%	0.256	37%	0.372	S	S	.	.	S	Bend	trans	-76.5	-30.9	179.6	0	0	0	0	0	111.6	L102 E127	L102-A123 HydrophobicContact CD1-CB 3.97Å; A123-E127 PolarHBondContact N-OE2 3.44Å
124	H	77.5	Confident	80.9	Confident	84 Å²	84	75.2 Å²	75.2	39%	0.389	38%	0.382	S	S	.	.	S	Bend	trans	-129.9	147.9	-177.8	-54.1	98.6	0	0	0	112.1	S126 E127 L128	H124-S126 VanDerWaalsContact C-N 3.27Å; H124-S126 PolarHBondContact O-N 2.93Å; H124-E127 HydrophobicContact CB-CG 4.16Å; H124-E127 PolarHBondContact N-OE2 3.41Å; H124-E127 IonicContact ND1-OE1 3.59Å; H124-E127 IonicContact ND1-OE2 3.83Å; H124-E127 WeakPolarHBondContact O-CB 3.41Å; H124-E127 PolarHBondContact O-N 3.42Å; H124-L128 PolarHBondContact O-N 3.14Å
125	Q	80.3	Confident	80.9	Confident	92 Å²	92	75.2 Å²	75.2	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-59.5	-38.2	178.5	177.3	62.8	26.4	0	0	112	L113 E127 L128 E129	L113-Q125 HydrophobicContact CD1-CB 3.74Å; L113-Q125 VanDerWaalsContact CD1-N 3.29Å; Q125-E127 PolarHBondContact O-N 2.77Å; Q125-L128 PolarHBondContact O-N 3.3Å; Q125-L128 VanDerWaalsContact O-N 3.15Å; Q125-E129 HydrophobicContact CG-CG 4.44Å; Q125-E129 WeakPolarHBondContact CG-OE1 3.14Å; Q125-E129 PolarHBondContact NE2-OE1 3.18Å; Q125-E129 WeakPolarHBondContact O-CG 3.22Å; Q125-E129 PolarHBondContact O-N 3.45Å
126	S	82.2	Confident	80.5	Confident	74 Å²	74	79 Å²	79	52%	0.517	40%	0.4	S	S	.	.	H	α-helix	trans	-61.3	-31.8	175.8	56.9	0	0	0	0	113.1	H124 R130	H124-S126 VanDerWaalsContact C-N 3.27Å; H124-S126 PolarHBondContact O-N 2.93Å; S126-R130 VanDerWaalsContact O-CB 3.26Å; S126-R130 WeakPolarHBondContact O-CB 3.48Å; S126-R130 PolarHBondContact O-N 3.49Å
127	E	81	Confident	79.6	Confident	45 Å²	45	79.2 Å²	79.2	21%	0.21	40%	0.401	C	S	.	.	H	α-helix	trans	-74.7	-39.9	175.5	-62	175	162	0	0	111.3	F122 A123 H124 Q125 R130 H131	F122-E127 HydrophobicContact CB-CB 4.14Å; F122-E127 HydrophobicContact CD1-CB 3.71Å; F122-E127 HydrophobicContact CG-CB 4.26Å; A123-E127 PolarHBondContact N-OE2 3.44Å; H124-E127 HydrophobicContact CB-CG 4.16Å; H124-E127 PolarHBondContact N-OE2 3.41Å; H124-E127 IonicContact ND1-OE1 3.59Å; H124-E127 IonicContact ND1-OE2 3.83Å; H124-E127 WeakPolarHBondContact O-CB 3.41Å; H124-E127 PolarHBondContact O-N 3.42Å; Q125-E127 PolarHBondContact O-N 2.77Å; E127-R130 PolarHBondContact O-N 3.18Å; E127-H131 WeakPolarHBondContact O-CB 2.87Å; E127-H131 PolarHBondContact O-N 3.44Å
128	L	83.5	Confident	78.5	Confident	25 Å²	25	78.6 Å²	78.6	13%	0.131	40%	0.4	C	S	.	.	H	α-helix	trans	-63.9	-43.2	174.3	172.7	60.2	0	0	0	111.5	L113 C115 F122 H124 Q125 H131 S132	L113-L128 HydrophobicContact CB-CB 4.34Å; L113-L128 HydrophobicContact CB-CD2 3.7Å; C115-L128 HydrophobicContact CB-CD1 3.92Å; F122-L128 HydrophobicContact CB-CB 4.04Å; F122-L128 HydrophobicContact CD2-CB 3.95Å; F122-L128 HydrophobicContact CD2-CD1 3.71Å; F122-L128 HydrophobicContact CD2-CG 4.42Å; F122-L128 HydrophobicContact CE2-CD1 4.05Å; F122-L128 HydrophobicContact CG-CB 4.07Å; H124-L128 PolarHBondContact O-N 3.14Å; Q125-L128 PolarHBondContact O-N 3.3Å; Q125-L128 VanDerWaalsContact O-N 3.15Å; L128-H131 CarbonylContact O-C 3.55Å; L128-H131 WeakPolarHBondContact O-CB 3.2Å; L128-H131 PolarHBondContact O-N 3.34Å; L128-S132 WeakPolarHBondContact O-CB 3.49Å; L128-S132 PolarHBondContact O-N 3.3Å
129	E	83.3	Confident	77.7	Confident	104 Å²	104	77.6 Å²	77.6	49%	0.486	39%	0.394	S	S	.	.	H	α-helix	trans	-63.6	-46.8	176	-75.6	168.4	-174.6	0	0	111.4	Q125 H131 S132	Q125-E129 HydrophobicContact CG-CG 4.44Å; Q125-E129 WeakPolarHBondContact CG-OE1 3.14Å; Q125-E129 PolarHBondContact NE2-OE1 3.18Å; Q125-E129 WeakPolarHBondContact O-CG 3.22Å; Q125-E129 PolarHBondContact O-N 3.45Å; E129-H131 PolarHBondContact O-N 3.13Å; E129-S132 PolarHBondContact O-N 2.76Å; E129-S132 VanDerWaalsContact O-N 3.16Å; E129-S132 PolarHBondContact O-OG 2.91Å
130	R	82.7	Confident	77.6	Confident	101 Å²	101	74.6 Å²	74.6	38%	0.381	39%	0.389	S	S	.	.	H	α-helix	trans	-60.8	-37.4	174.2	-177.8	175.1	64.6	-156.2	-2.8	111.7	S126 E127 R152	S126-R130 VanDerWaalsContact O-CB 3.26Å; S126-R130 WeakPolarHBondContact O-CB 3.48Å; S126-R130 PolarHBondContact O-N 3.49Å; E127-R130 PolarHBondContact O-N 3.18Å; R130-R152 HydrophobicContact CG-CG 4.43Å
131	H	84.3	Confident	77.8	Confident	21 Å²	21	71.9 Å²	71.9	10%	0.097	38%	0.376	C	S	.	.	H	α-helix	trans	-68.9	-38.5	175.7	170.5	79.4	0	0	0	112.1	C115 C118 F122 E127 L128 E129 I133 I134 H135	C115-H131 PolarHBondContact SG-NE2 2.94Å; C118-H131 PolarHBondContact SG-NE2 3.35Å; F122-H131 HydrophobicContact CD1-CB 4.46Å; F122-H131 HydrophobicContact CE1-CB 3.67Å; F122-H131 AromaticContact CE1-CG 3.9Å; F122-H131 HydrophobicContact CE2-CB 3.83Å; F122-H131 AromaticContact CE2-CD2 3.37Å; F122-H131 WeakPolarHBondContact CE2-CD2 3.11Å; F122-H131 AromaticContact CE2-CG 3.49Å; F122-H131 VanDerWaalsContact CE2-CG 3.49Å; F122-H131 AromaticContact CE2-NE2 3.9Å; F122-H131 HydrophobicContact CZ-CB 3.34Å; F122-H131 AromaticContact CZ-CD2 3.46Å; F122-H131 VanDerWaalsContact CZ-CD2 3.46Å; F122-H131 WeakPolarHBondContact CZ-CD2 3.15Å; F122-H131 AromaticContact CZ-CE1 3.82Å; F122-H131 AromaticContact CZ-CG 3.07Å; F122-H131 AromaticContact CZ-ND1 3.35Å; F122-H131 VanDerWaalsContact CZ-ND1 3.35Å; F122-H131 WeakPolarHBondContact CZ-ND1 3.48Å; F122-H131 AromaticContact CZ-NE2 3.91Å; E127-H131 WeakPolarHBondContact O-CB 2.87Å; E127-H131 PolarHBondContact O-N 3.44Å; L128-H131 CarbonylContact O-C 3.55Å; L128-H131 WeakPolarHBondContact O-CB 3.2Å; L128-H131 PolarHBondContact O-N 3.34Å; E129-H131 PolarHBondContact O-N 3.13Å; H131-I133 PolarHBondContact O-N 3.01Å; H131-I133 VanDerWaalsContact O-N 3.15Å; H131-I134 WeakPolarHBondContact CE1-CD1 3.44Å; H131-I134 WeakPolarHBondContact ND1-CD1 3.44Å; H131-I134 WeakPolarHBondContact O-CG1 3.37Å; H131-I134 WeakPolarHBondContact O-CG2 3.25Å; H131-I134 PolarHBondContact O-N 3.04Å; H131-H135 AromaticContact CD2-NE2 3.74Å; H131-H135 AromaticContact CE1-NE2 3.71Å; H131-H135 AromaticContact NE2-CD2 3.88Å; H131-H135 AromaticContact NE2-CE1 3.96Å; H131-H135 AromaticContact NE2-NE2 3.01Å; H131-H135 PolarHBondContact NE2-NE2 3.14Å
132	S	82.2	Confident	77.8	Confident	50 Å²	50	75.9 Å²	75.9	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-62.7	-25.6	-175.4	70.3	0	0	0	0	112.8	L128 E129 I134 H135 T136	L128-S132 WeakPolarHBondContact O-CB 3.49Å; L128-S132 PolarHBondContact O-N 3.3Å; E129-S132 PolarHBondContact O-N 2.76Å; E129-S132 VanDerWaalsContact O-N 3.16Å; E129-S132 PolarHBondContact O-OG 2.91Å; S132-I134 PolarHBondContact O-N 2.81Å; S132-H135 WeakPolarHBondContact O-CB 3.37Å; S132-H135 PolarHBondContact O-N 2.9Å; S132-T136 PolarHBondContact O-N 3.04Å
133	I	81	Confident	77.9	Confident	42 Å²	42	74.6 Å²	74.6	22%	0.215	38%	0.379	C	S	.	.	H	α-helix	trans	-54.8	-31.6	172	-58.9	172.9	0	0	0	112	H131 H135 T136 C138 T151	H131-I133 PolarHBondContact O-N 3.01Å; H131-I133 VanDerWaalsContact O-N 3.15Å; I133-H135 PolarHBondContact O-N 3.25Å; I133-T136 PolarHBondContact O-N 3.21Å; I133-T136 PolarHBondContact O-OG1 3.14Å; I133-C138 VanDerWaalsContact CG2-O 3.25Å; I133-C138 WeakPolarHBondContact CG2-O 3.48Å; I133-T151 HydrophobicContact CG2-CG2 4.01Å
134	I	78.5	Confident	78.2	Confident	88 Å²	88	78.2 Å²	78.2	45%	0.451	40%	0.402	S	S	.	.	H	α-helix	trans	-67.2	-27.3	178.9	82.8	-177.3	0	0	0	112.1	H131 S132 T151	H131-I134 WeakPolarHBondContact CE1-CD1 3.44Å; H131-I134 WeakPolarHBondContact ND1-CD1 3.44Å; H131-I134 WeakPolarHBondContact O-CG1 3.37Å; H131-I134 WeakPolarHBondContact O-CG2 3.25Å; H131-I134 PolarHBondContact O-N 3.04Å; S132-I134 PolarHBondContact O-N 2.81Å; I134-T151 HydrophobicContact CG2-CG2 4.34Å
135	H	80.4	Confident	78.1	Confident	62 Å²	62	80.1 Å²	80.1	29%	0.287	41%	0.41	S	S	.	.	H	α-helix	trans	-83	-26.2	-178.5	-62.2	-57.4	0	0	0	112.2	C115 V117 H131 S132 I133 K137	C115-H135 PolarHBondContact SG-CD2 3.42Å; C115-H135 PolarHBondContact SG-NE2 2.85Å; V117-H135 HydrophobicContact CB-CB 4.47Å; V117-H135 HydrophobicContact CG1-CB 4.43Å; V117-H135 HydrophobicContact CG2-CB 4.13Å; H131-H135 AromaticContact CD2-NE2 3.74Å; H131-H135 AromaticContact CE1-NE2 3.71Å; H131-H135 AromaticContact NE2-CD2 3.88Å; H131-H135 AromaticContact NE2-CE1 3.96Å; H131-H135 AromaticContact NE2-NE2 3.01Å; H131-H135 PolarHBondContact NE2-NE2 3.14Å; S132-H135 WeakPolarHBondContact O-CB 3.37Å; S132-H135 PolarHBondContact O-N 2.9Å; I133-H135 PolarHBondContact O-N 3.25Å; H135-K137 PolarHBondContact O-N 3.14Å
136	T	73.2	Confident	78	Confident	83 Å²	83	77.6 Å²	77.6	51%	0.509	40%	0.402	S	S	.	.	H	α-helix	trans	-76.4	-11.5	178.4	61.4	0	0	0	0	112.5	S132 I133 C138	S132-T136 PolarHBondContact O-N 3.04Å; I133-T136 PolarHBondContact O-N 3.21Å; I133-T136 PolarHBondContact O-OG1 3.14Å; T136-C138 PolarHBondContact O-N 3.2Å; T136-C138 PolarHBondContact O-SG 3.4Å; T136-C138 VanDerWaalsContact O-SG 3.42Å; T136-C138 PolarHBondContact OG1-N 3.45Å
137	K	64.7	Low	77.9	Confident	194 Å²	194	79.4 Å²	79.4	84%	0.843	42%	0.415	S	S	*	.			trans	52.6	9.8	-169.1	-62.3	-178.8	179.6	177.6	0	113.7	H135	H135-K137 PolarHBondContact O-N 3.14Å
138	C	60.3	Low	77.8	Confident	89 Å²	89	84.9 Å²	84.9	60%	0.601	43%	0.433	S	S	*	.			trans	-103.7	101.8	179.5	-70.6	0	0	0	0	108	I133 T136	I133-C138 VanDerWaalsContact CG2-O 3.25Å; I133-C138 WeakPolarHBondContact CG2-O 3.48Å; T136-C138 PolarHBondContact O-N 3.2Å; T136-C138 PolarHBondContact O-SG 3.4Å; T136-C138 VanDerWaalsContact O-SG 3.42Å; T136-C138 PolarHBondContact OG1-N 3.45Å
139	S	66.2	Low	77.5	Confident	32 Å²	32	86.5 Å²	86.5	22%	0.224	44%	0.444	C	S	.	.			trans	-89.1	120.4	174.8	-82.2	0	0	0	0	109.4	Y141 T149 F150	S139-Y141 PolarHBondContact O-N 3.23Å; S139-T149 VanDerWaalsContact CB-OG1 3.26Å; S139-T149 WeakPolarHBondContact CB-OG1 3.37Å; S139-F150 VanDerWaalsContact CB-O 3.3Å; S139-F150 WeakPolarHBondContact CB-O 3.47Å
140	P	76.7	Confident	77.3	Confident	84 Å²	84	83.4 Å²	83.4	55%	0.545	43%	0.429	S	S	.	.	S	Bend	trans	-68.4	-18.8	-175.2	23.1	-30.5	0	0	0	113.6
141	Y	80.8	Confident	77.1	Confident	78 Å²	78	80.5 Å²	80.5	31%	0.306	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	105.9	-175.3	-55.4	-73.5	0	0	0	110.5	S139 T149 F150 S153	S139-Y141 PolarHBondContact O-N 3.23Å; Y141-T149 CarbonylContact O-C 3.56Å; Y141-T149 VanDerWaalsContact O-CA 3.29Å; Y141-T149 WeakPolarHBondContact O-CA 3.26Å; Y141-F150 WeakPolarHBondContact CB-O 3.19Å; Y141-F150 WeakPolarHBondContact CD2-O 3.45Å; Y141-F150 PolarHBondContact N-O 3.32Å; Y141-F150 PolarHBondContact O-N 3.43Å; Y141-S153 VanDerWaalsContact CE2-N 3.29Å
142	R	80.8	Confident	76.9	Confident	181 Å²	181	83.9 Å²	83.9	68%	0.683	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	140.2	177.1	176	177.9	-80.1	-156.1	-1.9	110.6	T149 L156	R142-T149 HydrophobicContact CB-CG2 4.16Å; R142-T149 HydrophobicContact CG-CG2 4.25Å; R142-L156 WeakPolarHBondContact O-CD2 3.48Å
143	C	80	Confident	77	Confident	6 Å²	6	83.3 Å²	83.3	4%	0.041	43%	0.431	C	S	.	.			trans	-71.6	135.9	170.3	-173.4	0	0	0	0	111	F145 C146 R148 F150 L156 H159	C143-F145 VanDerWaalsContact C-N 3.34Å; C143-F145 PolarHBondContact SG-N 3.2Å; C143-F145 VanDerWaalsContact SG-N 3.43Å; C143-C146 WeakPolarHBondContact CB-O 3.27Å; C143-R148 PolarHBondContact N-O 2.87Å; C143-F150 HydrophobicContact CB-CE2 4.39Å; C143-L156 HydrophobicContact CB-CD1 3.88Å; C143-H159 PolarHBondContact SG-CD2 3.37Å; C143-H159 PolarHBondContact SG-NE2 2.75Å
144	S	82.6	Confident	76.9	Confident	107 Å²	107	84.4 Å²	84.4	75%	0.748	44%	0.437	S	S	*	.	S	Bend	trans	-73.7	-26.5	175.4	48.3	0	0	0	0	112.9
145	F	75.3	Confident	77.1	Confident	124 Å²	124	82.2 Å²	82.2	54%	0.544	43%	0.426	S	S	.	.	S	Bend	trans	-94.2	-15.1	-176	-58	-77.4	0	0	0	113.7	C143 H163 T164	C143-F145 VanDerWaalsContact C-N 3.34Å; C143-F145 PolarHBondContact SG-N 3.2Å; C143-F145 VanDerWaalsContact SG-N 3.43Å; F145-H163 HydrophobicContact CB-CB 4.04Å; F145-H163 VanDerWaalsContact CB-CG 3.46Å; F145-H163 WeakPolarHBondContact CB-ND1 3.28Å; F145-H163 HydrophobicContact CD1-CB 4.41Å; F145-H163 HydrophobicContact CD2-CB 3.71Å; F145-H163 AromaticContact CD2-CD2 3.9Å; F145-H163 AromaticContact CD2-CG 3.86Å; F145-H163 HydrophobicContact CE2-CB 4.26Å; F145-H163 HydrophobicContact CG-CB 3.8Å; F145-H163 AromaticContact CG-CG 3.78Å; F145-T164 HydrophobicContact CE2-CG2 3.91Å; F145-T164 HydrophobicContact CZ-CG2 3.9Å
146	C	78.8	Confident	77.2	Confident	39 Å²	39	81 Å²	81	26%	0.264	42%	0.421	S	S	.	.	S	Bend	trans	-155.2	168.1	178.4	75.2	0	0	0	0	112.5	C143 R148 H159	C143-C146 WeakPolarHBondContact CB-O 3.27Å; C146-R148 PolarHBondContact O-N 3.45Å; C146-H159 PolarHBondContact SG-NE2 3.43Å
147	S	80.6	Confident	77.6	Confident	113 Å²	113	84.2 Å²	84.2	79%	0.79	43%	0.428	S	S	*	.	S	Bend	trans	-71.3	5.6	-177.3	-47.9	0	0	0	0	115
148	R	77.2	Confident	78.2	Confident	159 Å²	159	77.3 Å²	77.3	60%	0.6	40%	0.401	S	S	*	.			trans	-74.8	142.9	-178.7	-68.8	-172.4	177.9	-173.5	1.9	111.5	C143 C146 F150	C143-R148 PolarHBondContact N-O 2.87Å; C146-R148 PolarHBondContact O-N 3.45Å; R148-F150 HydrophobicContact CB-CE2 3.92Å; R148-F150 HydrophobicContact CB-CZ 4.02Å
149	T	78.7	Confident	79.2	Confident	60 Å²	60	73.8 Å²	73.8	37%	0.368	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.6	178.8	65.1	0	0	0	0	110.6	S139 Y141 R142	S139-T149 VanDerWaalsContact CB-OG1 3.26Å; S139-T149 WeakPolarHBondContact CB-OG1 3.37Å; Y141-T149 CarbonylContact O-C 3.56Å; Y141-T149 VanDerWaalsContact O-CA 3.29Å; Y141-T149 WeakPolarHBondContact O-CA 3.26Å; R142-T149 HydrophobicContact CB-CG2 4.16Å; R142-T149 HydrophobicContact CG-CG2 4.25Å
150	F	77.6	Confident	79.8	Confident	38 Å²	38	73.4 Å²	73.4	17%	0.167	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	146.2	-171.2	-59.9	-88.9	0	0	0	111.1	S139 Y141 C143 R148 R152 L155 L156 H159	S139-F150 VanDerWaalsContact CB-O 3.3Å; S139-F150 WeakPolarHBondContact CB-O 3.47Å; Y141-F150 WeakPolarHBondContact CB-O 3.19Å; Y141-F150 WeakPolarHBondContact CD2-O 3.45Å; Y141-F150 PolarHBondContact N-O 3.32Å; Y141-F150 PolarHBondContact O-N 3.43Å; C143-F150 HydrophobicContact CB-CE2 4.39Å; R148-F150 HydrophobicContact CB-CE2 3.92Å; R148-F150 HydrophobicContact CB-CZ 4.02Å; F150-R152 VanDerWaalsContact C-N 3.31Å; F150-L155 HydrophobicContact CB-CB 4.19Å; F150-L155 HydrophobicContact CD1-CB 3.77Å; F150-L155 HydrophobicContact CG-CB 4.28Å; F150-L156 HydrophobicContact CB-CB 4.19Å; F150-L156 HydrophobicContact CD2-CB 3.86Å; F150-L156 HydrophobicContact CD2-CD1 3.79Å; F150-L156 HydrophobicContact CD2-CG 4.42Å; F150-L156 HydrophobicContact CE2-CD1 3.99Å; F150-L156 HydrophobicContact CG-CB 4.13Å; F150-H159 HydrophobicContact CE1-CB 3.73Å; F150-H159 HydrophobicContact CE2-CB 3.77Å; F150-H159 AromaticContact CE2-CD2 3.34Å; F150-H159 WeakPolarHBondContact CE2-CD2 3.34Å; F150-H159 AromaticContact CE2-CG 3.55Å; F150-H159 HydrophobicContact CZ-CB 3.26Å; F150-H159 AromaticContact CZ-CD2 3.41Å; F150-H159 VanDerWaalsContact CZ-CD2 3.41Å; F150-H159 WeakPolarHBondContact CZ-CD2 3.48Å; F150-H159 AromaticContact CZ-CG 3.1Å; F150-H159 AromaticContact CZ-ND1 3.69Å
151	T	79.7	Confident	79.9	Confident	41 Å²	41	72.3 Å²	72.3	25%	0.252	36%	0.363	S	S	.	.	S	Bend	trans	-81.9	-12	178.2	56	0	0	0	0	113	I133 I134	I133-T151 HydrophobicContact CG2-CG2 4.01Å; I134-T151 HydrophobicContact CG2-CG2 4.34Å
152	R	78.6	Confident	79.6	Confident	92 Å²	92	71.8 Å²	71.8	35%	0.347	37%	0.366	S	S	.	.	S	Bend	trans	-140.4	143.4	-179.4	-55.8	172.9	60.9	151.6	1.2	111	R130 F150 N154 L155 L156	R130-R152 HydrophobicContact CG-CG 4.43Å; F150-R152 VanDerWaalsContact C-N 3.31Å; R152-N154 VanDerWaalsContact C-N 3.35Å; R152-N154 WeakPolarHBondContact CB-OD1 3.42Å; R152-N154 PolarHBondContact NE-OD1 3.26Å; R152-N154 VanDerWaalsContact NE-OD1 3.14Å; R152-N154 PolarHBondContact O-N 3.21Å; R152-L155 HydrophobicContact CB-CB 4.48Å; R152-L155 HydrophobicContact CB-CD1 4.04Å; R152-L155 HydrophobicContact CB-CG 4.03Å; R152-L155 HydrophobicContact CG-CD1 4.22Å; R152-L155 WeakPolarHBondContact O-CB 3.12Å; R152-L155 PolarHBondContact O-N 3.46Å; R152-L156 PolarHBondContact O-N 3.19Å
153	S	84.2	Confident	79.3	Confident	38 Å²	38	67 Å²	67	27%	0.266	35%	0.351	S	S	.	.	H	α-helix	trans	-62.8	-38.3	179.9	60.2	0	0	0	0	112.9	Y141 L155 L156 K157	Y141-S153 VanDerWaalsContact CE2-N 3.29Å; S153-L155 VanDerWaalsContact C-N 3.29Å; S153-L155 PolarHBondContact O-N 3.11Å; S153-L156 PolarHBondContact O-N 3.45Å; S153-K157 WeakPolarHBondContact O-CG 3.38Å; S153-K157 PolarHBondContact O-N 3.44Å
154	N	80.5	Confident	78.8	Confident	65 Å²	65	70.9 Å²	70.9	35%	0.348	37%	0.374	S	S	.	.	H	α-helix	trans	-65	-32.8	177.6	69.4	-45.7	0	0	0	112.5	R152 K157 N158	R152-N154 VanDerWaalsContact C-N 3.35Å; R152-N154 WeakPolarHBondContact CB-OD1 3.42Å; R152-N154 PolarHBondContact NE-OD1 3.26Å; R152-N154 VanDerWaalsContact NE-OD1 3.14Å; R152-N154 PolarHBondContact O-N 3.21Å; N154-K157 PolarHBondContact O-N 3.47Å; N154-N158 WeakPolarHBondContact O-CB 3.47Å; N154-N158 PolarHBondContact O-N 3.21Å
155	L	82.4	Confident	78	Confident	42 Å²	42	68.1 Å²	68.1	22%	0.22	35%	0.351	C	S	.	.	H	α-helix	trans	-69.1	-40.1	173.8	-62.5	177.1	0	0	0	111.3	F150 R152 S153 H159 Y183	F150-L155 HydrophobicContact CB-CB 4.19Å; F150-L155 HydrophobicContact CD1-CB 3.77Å; F150-L155 HydrophobicContact CG-CB 4.28Å; R152-L155 HydrophobicContact CB-CB 4.48Å; R152-L155 HydrophobicContact CB-CD1 4.04Å; R152-L155 HydrophobicContact CB-CG 4.03Å; R152-L155 HydrophobicContact CG-CD1 4.22Å; R152-L155 WeakPolarHBondContact O-CB 3.12Å; R152-L155 PolarHBondContact O-N 3.46Å; S153-L155 VanDerWaalsContact C-N 3.29Å; S153-L155 PolarHBondContact O-N 3.11Å; L155-H159 VanDerWaalsContact O-CB 3.3Å; L155-H159 WeakPolarHBondContact O-CB 3.45Å; L155-H159 PolarHBondContact O-N 2.95Å; L155-Y183 WeakPolarHBondContact CD2-OH 3.5Å
156	L	82.2	Confident	77.2	Confident	35 Å²	35	68.5 Å²	68.5	18%	0.183	37%	0.366	C	S	.	.	H	α-helix	trans	-62.7	-45.2	172	171.3	61.9	0	0	0	111.2	R142 C143 F150 R152 S153 N158 H159 A160	R142-L156 WeakPolarHBondContact O-CD2 3.48Å; C143-L156 HydrophobicContact CB-CD1 3.88Å; F150-L156 HydrophobicContact CB-CB 4.19Å; F150-L156 HydrophobicContact CD2-CB 3.86Å; F150-L156 HydrophobicContact CD2-CD1 3.79Å; F150-L156 HydrophobicContact CD2-CG 4.42Å; F150-L156 HydrophobicContact CE2-CD1 3.99Å; F150-L156 HydrophobicContact CG-CB 4.13Å; R152-L156 PolarHBondContact O-N 3.19Å; S153-L156 PolarHBondContact O-N 3.45Å; L156-N158 PolarHBondContact O-N 3.49Å; L156-H159 CarbonylContact O-C 3.55Å; L156-H159 WeakPolarHBondContact O-CB 3.3Å; L156-H159 PolarHBondContact O-N 3.12Å; L156-H159 VanDerWaalsContact O-N 3.14Å; L156-A160 WeakPolarHBondContact O-CB 3.11Å; L156-A160 PolarHBondContact O-N 2.92Å
157	K	81.6	Confident	76.6	Confident	151 Å²	151	70.8 Å²	70.8	66%	0.657	38%	0.383	S	S	*	.	H	α-helix	trans	-57.6	-50.1	177.3	-74.2	-176.8	177.5	-172.5	0	111.2	S153 N154 H159 A160 L161	S153-K157 WeakPolarHBondContact O-CG 3.38Å; S153-K157 PolarHBondContact O-N 3.44Å; N154-K157 PolarHBondContact O-N 3.47Å; K157-H159 VanDerWaalsContact C-N 3.29Å; K157-H159 PolarHBondContact O-N 3.42Å; K157-A160 PolarHBondContact O-N 2.96Å; K157-L161 PolarHBondContact O-N 3.2Å
158	N	78	Confident	76.2	Confident	50 Å²	50	66.9 Å²	66.9	27%	0.267	35%	0.353	S	S	.	.	H	α-helix	trans	-61.6	-38.7	175.7	-70.4	-4.9	0	0	0	111.6	N154 L156 A179	N154-N158 WeakPolarHBondContact O-CB 3.47Å; N154-N158 PolarHBondContact O-N 3.21Å; L156-N158 PolarHBondContact O-N 3.49Å; N158-A179 WeakPolarHBondContact O-CB 3.45Å
159	H	81	Confident	76	Confident	15 Å²	15	62.6 Å²	62.6	7%	0.069	34%	0.341	C	S	.	.	H	α-helix	trans	-66.6	-39.2	175.3	170.5	66.8	0	0	0	113	C143 C146 F150 L155 L156 K157 L161 L162 H163	C143-H159 PolarHBondContact SG-CD2 3.37Å; C143-H159 PolarHBondContact SG-NE2 2.75Å; C146-H159 PolarHBondContact SG-NE2 3.43Å; F150-H159 HydrophobicContact CE1-CB 3.73Å; F150-H159 HydrophobicContact CE2-CB 3.77Å; F150-H159 AromaticContact CE2-CD2 3.34Å; F150-H159 WeakPolarHBondContact CE2-CD2 3.34Å; F150-H159 AromaticContact CE2-CG 3.55Å; F150-H159 HydrophobicContact CZ-CB 3.26Å; F150-H159 AromaticContact CZ-CD2 3.41Å; F150-H159 VanDerWaalsContact CZ-CD2 3.41Å; F150-H159 WeakPolarHBondContact CZ-CD2 3.48Å; F150-H159 AromaticContact CZ-CG 3.1Å; F150-H159 AromaticContact CZ-ND1 3.69Å; L155-H159 VanDerWaalsContact O-CB 3.3Å; L155-H159 WeakPolarHBondContact O-CB 3.45Å; L155-H159 PolarHBondContact O-N 2.95Å; L156-H159 CarbonylContact O-C 3.55Å; L156-H159 WeakPolarHBondContact O-CB 3.3Å; L156-H159 PolarHBondContact O-N 3.12Å; L156-H159 VanDerWaalsContact O-N 3.14Å; K157-H159 VanDerWaalsContact C-N 3.29Å; K157-H159 PolarHBondContact O-N 3.42Å; H159-L161 PolarHBondContact O-N 3.25Å; H159-L162 WeakPolarHBondContact O-CB 3.41Å; H159-L162 PolarHBondContact O-N 2.98Å; H159-H163 AromaticContact CE1-NE2 3.45Å; H159-H163 PolarHBondContact CE1-NE2 3.02Å; H159-H163 AromaticContact NE2-CD2 3.78Å; H159-H163 AromaticContact NE2-NE2 3.11Å; H159-H163 PolarHBondContact NE2-NE2 3.4Å; H159-H163 VanDerWaalsContact NE2-NE2 3.11Å
160	A	78.1	Confident	75.7	Confident	24 Å²	24	63.5 Å²	63.5	20%	0.198	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-33.2	-178.6	0	0	0	0	0	111.6	L156 K157 L162 H163 T164	L156-A160 WeakPolarHBondContact O-CB 3.11Å; L156-A160 PolarHBondContact O-N 2.92Å; K157-A160 PolarHBondContact O-N 2.96Å; A160-L162 PolarHBondContact O-N 3.29Å; A160-H163 WeakPolarHBondContact O-CB 3.28Å; A160-H163 PolarHBondContact O-N 3.41Å; A160-T164 PolarHBondContact O-N 3.31Å; A160-T164 PolarHBondContact O-OG1 2.88Å
161	L	78.6	Confident	75.6	Confident	60 Å²	60	61.8 Å²	61.8	31%	0.314	34%	0.339	S	S	.	.	H	α-helix	trans	-56.2	-30.5	172	-64.2	174.6	0	0	0	112.3	K157 H159 H163 T164 D165 L168 A179	K157-L161 PolarHBondContact O-N 3.2Å; H159-L161 PolarHBondContact O-N 3.25Å; L161-H163 PolarHBondContact O-N 3.24Å; L161-T164 PolarHBondContact O-N 2.73Å; L161-D165 HydrophobicContact CB-CB 4.31Å; L161-D165 HydrophobicContact CD2-CB 4.43Å; L161-D165 VanDerWaalsContact O-CB 3.23Å; L161-D165 WeakPolarHBondContact O-CB 3.41Å; L161-D165 PolarHBondContact O-N 2.92Å; L161-L168 HydrophobicContact CB-CD2 4.18Å; L161-A179 HydrophobicContact CB-CB 3.73Å; L161-A179 HydrophobicContact CD1-CB 4.22Å
162	L	74.1	Confident	75.5	Confident	67 Å²	67	64.8 Å²	64.8	35%	0.351	36%	0.361	S	S	.	.	H	α-helix	trans	-63.5	-19.9	175.5	-60.2	175.6	0	0	0	113.7	H159 A160 L168 A179	H159-L162 WeakPolarHBondContact O-CB 3.41Å; H159-L162 PolarHBondContact O-N 2.98Å; A160-L162 PolarHBondContact O-N 3.29Å; L162-L168 HydrophobicContact CD2-CD1 3.98Å; L162-L168 HydrophobicContact CD2-CD2 4.05Å; L162-A179 HydrophobicContact CD2-CB 3.84Å; L162-A179 HydrophobicContact CG-CB 4.09Å
163	H	74.8	Confident	75.3	Confident	82 Å²	82	66.3 Å²	66.3	38%	0.38	37%	0.368	S	S	.	.	H	α-helix	trans	-96.7	-30.1	177.5	-63.3	-76.5	0	0	0	112.7	F145 H159 A160 L161	F145-H163 HydrophobicContact CB-CB 4.04Å; F145-H163 VanDerWaalsContact CB-CG 3.46Å; F145-H163 WeakPolarHBondContact CB-ND1 3.28Å; F145-H163 HydrophobicContact CD1-CB 4.41Å; F145-H163 HydrophobicContact CD2-CB 3.71Å; F145-H163 AromaticContact CD2-CD2 3.9Å; F145-H163 AromaticContact CD2-CG 3.86Å; F145-H163 HydrophobicContact CE2-CB 4.26Å; F145-H163 HydrophobicContact CG-CB 3.8Å; F145-H163 AromaticContact CG-CG 3.78Å; H159-H163 AromaticContact CE1-NE2 3.45Å; H159-H163 PolarHBondContact CE1-NE2 3.02Å; H159-H163 AromaticContact NE2-CD2 3.78Å; H159-H163 AromaticContact NE2-NE2 3.11Å; H159-H163 PolarHBondContact NE2-NE2 3.4Å; H159-H163 VanDerWaalsContact NE2-NE2 3.11Å; A160-H163 WeakPolarHBondContact O-CB 3.28Å; A160-H163 PolarHBondContact O-N 3.41Å; L161-H163 PolarHBondContact O-N 3.24Å
164	T	70.8	Confident	75.1	Confident	86 Å²	86	66.7 Å²	66.7	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-108.3	-22.7	-168	57.5	0	0	0	0	114.3	F145 A160 L161	F145-T164 HydrophobicContact CE2-CG2 3.91Å; F145-T164 HydrophobicContact CZ-CG2 3.9Å; A160-T164 PolarHBondContact O-N 3.31Å; A160-T164 PolarHBondContact O-OG1 2.88Å; L161-T164 PolarHBondContact O-N 2.73Å
165	D	65.1	Low	74.9	Confident	49 Å²	49	68.3 Å²	68.3	26%	0.262	39%	0.386	S	S	.	.			trans	-106	118.5	-168.5	-164.4	-9.9	0	0	0	111.2	L161 S167 L168	L161-D165 HydrophobicContact CB-CB 4.31Å; L161-D165 HydrophobicContact CD2-CB 4.43Å; L161-D165 VanDerWaalsContact O-CB 3.23Å; L161-D165 WeakPolarHBondContact O-CB 3.41Å; L161-D165 PolarHBondContact O-N 2.92Å; D165-S167 VanDerWaalsContact C-N 3.29Å; D165-S167 WeakPolarHBondContact OD1-CA 3.46Å; D165-S167 VanDerWaalsContact OD1-CB 3.28Å; D165-S167 WeakPolarHBondContact OD1-CB 3.3Å; D165-S167 PolarHBondContact OD1-N 3.33Å; D165-S167 PolarHBondContact OD1-OG 3.13Å; D165-S167 PolarHBondContact OD2-OG 2.9Å; D165-S167 VanDerWaalsContact OD2-OG 3.09Å; D165-L168 HydrophobicContact CB-CD2 4.15Å; D165-L168 HydrophobicContact CB-CG 4.14Å; D165-L168 WeakPolarHBondContact O-CD1 3.45Å; D165-L168 WeakPolarHBondContact O-CG 3.48Å
166	P	59.1	Low	74.7	Confident	132 Å²	132	73.6 Å²	73.6	86%	0.857	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.7	169.8	9.1	0.2	0	0	0	113.1	L168	P166-L168 PolarHBondContact O-N 3.37Å
167	S	65.9	Low	74.4	Confident	88 Å²	88	75.3 Å²	75.3	62%	0.615	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	17.7	-176.6	74.5	0	0	0	0	114.4	D165	D165-S167 VanDerWaalsContact C-N 3.29Å; D165-S167 WeakPolarHBondContact OD1-CA 3.46Å; D165-S167 VanDerWaalsContact OD1-CB 3.28Å; D165-S167 WeakPolarHBondContact OD1-CB 3.3Å; D165-S167 PolarHBondContact OD1-N 3.33Å; D165-S167 PolarHBondContact OD1-OG 3.13Å; D165-S167 PolarHBondContact OD2-OG 2.9Å; D165-S167 VanDerWaalsContact OD2-OG 3.09Å
168	L	71.9	Confident	73.8	Confident	30 Å²	30	69.9 Å²	69.9	16%	0.157	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-64.4	150.5	-178.6	-63.2	164.1	0	0	0	112.3	L161 L162 D165 P166 V177 A179	L161-L168 HydrophobicContact CB-CD2 4.18Å; L162-L168 HydrophobicContact CD2-CD1 3.98Å; L162-L168 HydrophobicContact CD2-CD2 4.05Å; D165-L168 HydrophobicContact CB-CD2 4.15Å; D165-L168 HydrophobicContact CB-CG 4.14Å; D165-L168 WeakPolarHBondContact O-CD1 3.45Å; D165-L168 WeakPolarHBondContact O-CG 3.48Å; P166-L168 PolarHBondContact O-N 3.37Å; L168-V177 HydrophobicContact CB-CG1 3.18Å; L168-V177 HydrophobicContact CD1-CG1 3.54Å; L168-V177 HydrophobicContact CG-CG1 3.97Å; L168-A179 VanDerWaalsContact CD2-CA 3.44Å; L168-A179 HydrophobicContact CD2-CB 3.7Å
169	L	72.4	Confident	73.5	Confident	69 Å²	69	68.7 Å²	68.7	36%	0.361	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.3	-175	-55	175.2	0	0	0	110.2	V177 Y178 R181 L184	L169-V177 CarbonylContact O-C 3.55Å; L169-Y178 PolarHBondContact N-O 2.89Å; L169-Y178 PolarHBondContact O-N 3.25Å; L169-R181 VanDerWaalsContact CD1-CA 3.49Å; L169-R181 HydrophobicContact CD1-CB 3.83Å; L169-L184 HydrophobicContact CB-CD2 3.56Å; L169-L184 HydrophobicContact CD1-CD2 4.31Å
170	T	72.6	Confident	72.9	Confident	80 Å²	80	69.2 Å²	69.2	49%	0.491	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137	179.1	-56.4	0	0	0	0	111	C172 R176	T170-C172 PolarHBondContact O-N 2.73Å; T170-R176 CarbonylContact C-O 3.55Å; T170-R176 WeakPolarHBondContact CA-O 3.47Å
171	C	76.7	Confident	72.6	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.007	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-71	124	170.1	179.9	0	0	0	0	110.7	Y173 S175 R176 Y178 L184 H187	C171-Y173 PolarHBondContact O-N 3.29Å; C171-Y173 PolarHBondContact SG-N 3.48Å; C171-Y173 VanDerWaalsContact SG-N 3.37Å; C171-S175 WeakPolarHBondContact O-CA 3.29Å; C171-S175 PolarHBondContact O-N 3.29Å; C171-R176 HydrophobicContact CB-CB 4.45Å; C171-R176 PolarHBondContact N-O 3.13Å; C171-Y178 HydrophobicContact CB-CE2 4.22Å; C171-L184 HydrophobicContact CB-CD1 3.8Å; C171-H187 WeakPolarHBondContact CB-NE2 3.19Å; C171-H187 PolarHBondContact SG-CD2 3.26Å; C171-H187 PolarHBondContact SG-NE2 2.82Å
172	C	76.9	Confident	72.3	Confident	104 Å²	104	75.2 Å²	75.2	70%	0.703	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.7	176.9	55.8	0	0	0	0	114.1	T170	T170-C172 PolarHBondContact O-N 2.73Å
173	Y	74.3	Confident	72.3	Confident	124 Å²	124	77 Å²	77	49%	0.486	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-21.6	-178.4	-60.3	-72.7	0	0	0	114.9	C171 I188 H191	C171-Y173 PolarHBondContact O-N 3.29Å; C171-Y173 PolarHBondContact SG-N 3.48Å; C171-Y173 VanDerWaalsContact SG-N 3.37Å; Y173-I188 HydrophobicContact CE2-CG2 3.96Å; Y173-H191 WeakPolarHBondContact CB-ND1 3.37Å; Y173-H191 HydrophobicContact CD2-CB 3.94Å; Y173-H191 AromaticContact CD2-CG 3.97Å; Y173-H191 HydrophobicContact CE2-CB 4.5Å; Y173-H191 HydrophobicContact CG-CB 4.16Å; Y173-H191 AromaticContact CG-CG 3.96Å
174	C	79.3	Confident	72.3	Confident	47 Å²	47	73.6 Å²	73.6	32%	0.318	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.1	17.3	-177.1	71.1	0	0	0	0	115.7	R176 H187 H191	C174-R176 PolarHBondContact O-N 3.17Å; C174-R176 VanDerWaalsContact SG-CG 3.56Å; C174-H187 PolarHBondContact SG-CE1 2.98Å; C174-H187 PolarHBondContact SG-NE2 3.16Å; C174-H191 PolarHBondContact SG-NE2 2.97Å
175	S	77.9	Confident	72.4	Confident	98 Å²	98	72.6 Å²	72.6	69%	0.685	40%	0.399	S	S	*	.			trans	56.5	14.4	175.8	-49.4	0	0	0	0	115.3	C171	C171-S175 WeakPolarHBondContact O-CA 3.29Å; C171-S175 PolarHBondContact O-N 3.29Å
176	R	78.1	Confident	73	Confident	154 Å²	154	75.1 Å²	75.1	58%	0.581	41%	0.409	S	S	*	.			trans	-73.5	138.5	175.1	-75	-177.8	-178.8	-170.1	-0.8	110.3	T170 C171 C174 Y178	T170-R176 CarbonylContact C-O 3.55Å; T170-R176 WeakPolarHBondContact CA-O 3.47Å; C171-R176 HydrophobicContact CB-CB 4.45Å; C171-R176 PolarHBondContact N-O 3.13Å; C174-R176 PolarHBondContact O-N 3.17Å; C174-R176 VanDerWaalsContact SG-CG 3.56Å; R176-Y178 HydrophobicContact CB-CD2 4.49Å; R176-Y178 HydrophobicContact CB-CE2 3.55Å; R176-Y178 WeakPolarHBondContact O-CD2 3.48Å; R176-Y178 WeakPolarHBondContact O-CE2 3.46Å
177	V	74.3	Confident	73.8	Confident	70 Å²	70	69.9 Å²	69.9	42%	0.424	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.7	-174.2	-177.1	0	0	0	0	110.8	L168 L169	L168-V177 HydrophobicContact CB-CG1 3.18Å; L168-V177 HydrophobicContact CD1-CG1 3.54Å; L168-V177 HydrophobicContact CG-CG1 3.97Å; L169-V177 CarbonylContact O-C 3.55Å
178	Y	70.7	Confident	74.2	Confident	38 Å²	38	66.9 Å²	66.9	15%	0.149	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135.7	-173.5	-66.4	-93.5	0	0	0	111.6	L169 C171 R176 S180 L184 H187	L169-Y178 PolarHBondContact N-O 2.89Å; L169-Y178 PolarHBondContact O-N 3.25Å; C171-Y178 HydrophobicContact CB-CE2 4.22Å; R176-Y178 HydrophobicContact CB-CD2 4.49Å; R176-Y178 HydrophobicContact CB-CE2 3.55Å; R176-Y178 WeakPolarHBondContact O-CD2 3.48Å; R176-Y178 WeakPolarHBondContact O-CE2 3.46Å; Y178-S180 VanDerWaalsContact C-N 3.34Å; Y178-L184 HydrophobicContact CD2-CB 4.21Å; Y178-L184 HydrophobicContact CD2-CD1 3.66Å; Y178-L184 HydrophobicContact CE2-CD1 4.03Å; Y178-L184 HydrophobicContact CG-CB 4.03Å; Y178-L184 HydrophobicContact CG-CD1 4.34Å; Y178-H187 HydrophobicContact CE1-CB 3.91Å; Y178-H187 HydrophobicContact CE2-CB 4.24Å; Y178-H187 AromaticContact CE2-CD2 3.32Å; Y178-H187 WeakPolarHBondContact CE2-CD2 3.46Å; Y178-H187 AromaticContact CE2-CG 3.87Å; Y178-H187 AromaticContact CE2-NE2 3.91Å; Y178-H187 AromaticContact CZ-CD2 3.38Å; Y178-H187 AromaticContact CZ-CG 3.41Å; Y178-H187 VanDerWaalsContact CZ-CG 3.41Å; Y178-H187 WeakPolarHBondContact OH-CB 3.42Å; Y178-H187 PolarHBondContact OH-CD2 2.84Å; Y178-H187 PolarHBondContact OH-CE1 3.43Å; Y178-H187 PolarHBondContact OH-ND1 2.78Å; Y178-H187 PolarHBondContact OH-NE2 3.32Å
179	A	71.7	Confident	74.5	Confident	25 Å²	25	70.7 Å²	70.7	21%	0.207	37%	0.366	C	S	.	.	S	Bend	trans	-85.4	-1.9	177.3	0	0	0	0	0	115.1	N158 L161 L162 L168	N158-A179 WeakPolarHBondContact O-CB 3.45Å; L161-A179 HydrophobicContact CB-CB 3.73Å; L161-A179 HydrophobicContact CD1-CB 4.22Å; L162-A179 HydrophobicContact CD2-CB 3.84Å; L162-A179 HydrophobicContact CG-CB 4.09Å; L168-A179 VanDerWaalsContact CD2-CA 3.44Å; L168-A179 HydrophobicContact CD2-CB 3.7Å
180	S	68.3	Low	74.9	Confident	26 Å²	26	72.7 Å²	72.7	18%	0.182	37%	0.372	C	S	.	.			trans	-147.8	134.9	179.3	161.9	0	0	0	0	110.1	Y178 S182 Y183 L184	Y178-S180 VanDerWaalsContact C-N 3.34Å; S180-S182 VanDerWaalsContact C-N 3.25Å; S180-S182 PolarHBondContact O-N 3.05Å; S180-S182 PolarHBondContact OG-N 3.33Å; S180-Y183 PolarHBondContact O-N 3.15Å; S180-Y183 VanDerWaalsContact O-N 3.13Å; S180-L184 PolarHBondContact O-N 3.18Å; S180-L184 VanDerWaalsContact O-N 3.09Å
181	R	72.1	Confident	75.1	Confident	121 Å²	121	70.3 Å²	70.3	46%	0.457	36%	0.356	S	S	.	.	H	α-helix	trans	-54	-41.6	176.8	-177.1	176.7	171.3	84.2	1.2	112	L169 Y183 L184 L185	L169-R181 VanDerWaalsContact CD1-CA 3.49Å; L169-R181 HydrophobicContact CD1-CB 3.83Å; R181-Y183 VanDerWaalsContact C-N 3.33Å; R181-Y183 PolarHBondContact O-N 3.17Å; R181-L184 PolarHBondContact O-N 2.83Å; R181-L185 HydrophobicContact CG-CD1 3.94Å; R181-L185 HydrophobicContact CG-CG 4.21Å; R181-L185 WeakPolarHBondContact O-CG 3.4Å; R181-L185 PolarHBondContact O-N 3.3Å
182	S	70.9	Confident	74.9	Confident	89 Å²	89	74.8 Å²	74.8	62%	0.622	38%	0.376	S	S	*	.	H	α-helix	trans	-61.3	-40.1	179.6	-52.1	0	0	0	0	112.5	S180 Q186	S180-S182 VanDerWaalsContact C-N 3.25Å; S180-S182 PolarHBondContact O-N 3.05Å; S180-S182 PolarHBondContact OG-N 3.33Å; S182-Q186 WeakPolarHBondContact O-CB 3.5Å; S182-Q186 PolarHBondContact O-N 2.85Å; S182-Q186 VanDerWaalsContact O-N 3.1Å
183	Y	73.8	Confident	74.5	Confident	104 Å²	104	75.3 Å²	75.3	41%	0.408	37%	0.368	S	S	.	.	H	α-helix	trans	-72.9	-34.8	176.8	-74.4	-60.3	0	0	0	112.7	L155 S180 R181 H187	L155-Y183 WeakPolarHBondContact CD2-OH 3.5Å; S180-Y183 PolarHBondContact O-N 3.15Å; S180-Y183 VanDerWaalsContact O-N 3.13Å; R181-Y183 VanDerWaalsContact C-N 3.33Å; R181-Y183 PolarHBondContact O-N 3.17Å; Y183-H187 WeakPolarHBondContact O-CB 3.41Å; Y183-H187 PolarHBondContact O-N 2.77Å
184	L	75.1	Confident	74	Confident	11 Å²	11	76.6 Å²	76.6	6%	0.058	38%	0.376	C	S	.	.	H	α-helix	trans	-65	-47.1	173.6	174.4	59.8	0	0	0	111.1	L169 C171 Y178 S180 R181 Q186 H187 I188	L169-L184 HydrophobicContact CB-CD2 3.56Å; L169-L184 HydrophobicContact CD1-CD2 4.31Å; C171-L184 HydrophobicContact CB-CD1 3.8Å; Y178-L184 HydrophobicContact CD2-CB 4.21Å; Y178-L184 HydrophobicContact CD2-CD1 3.66Å; Y178-L184 HydrophobicContact CE2-CD1 4.03Å; Y178-L184 HydrophobicContact CG-CB 4.03Å; Y178-L184 HydrophobicContact CG-CD1 4.34Å; S180-L184 PolarHBondContact O-N 3.18Å; S180-L184 VanDerWaalsContact O-N 3.09Å; R181-L184 PolarHBondContact O-N 2.83Å; L184-Q186 PolarHBondContact O-N 2.96Å; L184-H187 CarbonylContact O-C 3.17Å; L184-H187 WeakPolarHBondContact O-CA 3.32Å; L184-H187 WeakPolarHBondContact O-CB 3.1Å; L184-H187 PolarHBondContact O-N 3.09Å; L184-I188 HydrophobicContact CD1-CD1 3.83Å; L184-I188 HydrophobicContact CD1-CG1 3.97Å; L184-I188 HydrophobicContact CD2-CD1 4.34Å; L184-I188 HydrophobicContact CG-CD1 3.76Å; L184-I188 HydrophobicContact CG-CG1 4.33Å; L184-I188 WeakPolarHBondContact O-CG1 3.41Å; L184-I188 PolarHBondContact O-N 3.15Å
185	L	73.6	Confident	73.1	Confident	65 Å²	65	79 Å²	79	34%	0.34	39%	0.385	S	S	.	.	H	α-helix	trans	-60.4	-47.3	178.6	-69.5	175.3	0	0	0	111.2	R181 H187 I188 E189	R181-L185 HydrophobicContact CG-CD1 3.94Å; R181-L185 HydrophobicContact CG-CG 4.21Å; R181-L185 WeakPolarHBondContact O-CG 3.4Å; R181-L185 PolarHBondContact O-N 3.3Å; L185-H187 PolarHBondContact O-N 3.02Å; L185-I188 PolarHBondContact O-N 3.15Å; L185-I188 VanDerWaalsContact O-N 3.09Å; L185-E189 WeakPolarHBondContact O-CG 3.33Å; L185-E189 PolarHBondContact O-N 3.5Å
186	Q	77.2	Confident	71.9	Confident	102 Å²	102	79.7 Å²	79.7	48%	0.477	38%	0.377	S	S	.	.	H	α-helix	trans	-60.3	-29	174.3	-169.7	-178.3	32.3	0	0	112.8	S182 L184	S182-Q186 WeakPolarHBondContact O-CB 3.5Å; S182-Q186 PolarHBondContact O-N 2.85Å; S182-Q186 VanDerWaalsContact O-N 3.1Å; L184-Q186 PolarHBondContact O-N 2.96Å
187	H	76.9	Confident	70.8	Confident	21 Å²	21	77.8 Å²	77.8	10%	0.097	38%	0.377	C	S	.	.	H	α-helix	trans	-76.6	-39.9	174.7	166.6	59.2	0	0	0	112.7	C171 C174 Y178 Y183 L184 L185 E189 K190 H191	C171-H187 WeakPolarHBondContact CB-NE2 3.19Å; C171-H187 PolarHBondContact SG-CD2 3.26Å; C171-H187 PolarHBondContact SG-NE2 2.82Å; C174-H187 PolarHBondContact SG-CE1 2.98Å; C174-H187 PolarHBondContact SG-NE2 3.16Å; Y178-H187 HydrophobicContact CE1-CB 3.91Å; Y178-H187 HydrophobicContact CE2-CB 4.24Å; Y178-H187 AromaticContact CE2-CD2 3.32Å; Y178-H187 WeakPolarHBondContact CE2-CD2 3.46Å; Y178-H187 AromaticContact CE2-CG 3.87Å; Y178-H187 AromaticContact CE2-NE2 3.91Å; Y178-H187 AromaticContact CZ-CD2 3.38Å; Y178-H187 AromaticContact CZ-CG 3.41Å; Y178-H187 VanDerWaalsContact CZ-CG 3.41Å; Y178-H187 WeakPolarHBondContact OH-CB 3.42Å; Y178-H187 PolarHBondContact OH-CD2 2.84Å; Y178-H187 PolarHBondContact OH-CE1 3.43Å; Y178-H187 PolarHBondContact OH-ND1 2.78Å; Y178-H187 PolarHBondContact OH-NE2 3.32Å; Y183-H187 WeakPolarHBondContact O-CB 3.41Å; Y183-H187 PolarHBondContact O-N 2.77Å; L184-H187 CarbonylContact O-C 3.17Å; L184-H187 WeakPolarHBondContact O-CA 3.32Å; L184-H187 WeakPolarHBondContact O-CB 3.1Å; L184-H187 PolarHBondContact O-N 3.09Å; L185-H187 PolarHBondContact O-N 3.02Å; H187-E189 VanDerWaalsContact C-N 3.33Å; H187-K190 WeakPolarHBondContact O-CB 3.26Å; H187-K190 PolarHBondContact O-N 2.92Å; H187-K190 VanDerWaalsContact O-N 3.15Å; H187-H191 AromaticContact CE1-CD2 3.49Å; H187-H191 PolarHBondContact CE1-CD2 2.81Å; H187-H191 VanDerWaalsContact CE1-CD2 3.49Å; H187-H191 AromaticContact CE1-NE2 3.06Å; H187-H191 PolarHBondContact CE1-NE2 3.36Å; H187-H191 AromaticContact NE2-CD2 3.55Å; H187-H191 AromaticContact NE2-NE2 3.15Å; H187-H191 PolarHBondContact NE2-NE2 2.97Å; H187-H191 VanDerWaalsContact NE2-NE2 3.15Å; H187-H191 PolarHBondContact O-N 3Å
188	I	74.2	Confident	69.6	Low	25 Å²	25	77.2 Å²	77.2	13%	0.128	38%	0.376	C	S	.	.	H	α-helix	trans	-62.5	-41.5	175.1	-70.4	168.1	0	0	0	110.2	Y173 L184 L185 K190 H191 E192	Y173-I188 HydrophobicContact CE2-CG2 3.96Å; L184-I188 HydrophobicContact CD1-CD1 3.83Å; L184-I188 HydrophobicContact CD1-CG1 3.97Å; L184-I188 HydrophobicContact CD2-CD1 4.34Å; L184-I188 HydrophobicContact CG-CD1 3.76Å; L184-I188 HydrophobicContact CG-CG1 4.33Å; L184-I188 WeakPolarHBondContact O-CG1 3.41Å; L184-I188 PolarHBondContact O-N 3.15Å; L185-I188 PolarHBondContact O-N 3.15Å; L185-I188 VanDerWaalsContact O-N 3.09Å; I188-K190 PolarHBondContact O-N 3.24Å; I188-H191 WeakPolarHBondContact O-CA 3.47Å; I188-H191 VanDerWaalsContact O-CB 3.28Å; I188-H191 WeakPolarHBondContact O-CB 3.35Å; I188-H191 PolarHBondContact O-N 3.01Å; I188-E192 PolarHBondContact O-N 3.46Å
189	E	78	Confident	68.4	Low	110 Å²	110	83.7 Å²	83.7	51%	0.514	40%	0.4	S	S	.	.	H	α-helix	trans	-53	-38.6	172.7	-73.7	170.4	-177.2	0	0	111.7	L185 H187 H191 E192 E193	L185-E189 WeakPolarHBondContact O-CG 3.33Å; L185-E189 PolarHBondContact O-N 3.5Å; H187-E189 VanDerWaalsContact C-N 3.33Å; E189-H191 VanDerWaalsContact C-N 3.33Å; E189-H191 PolarHBondContact O-N 3.23Å; E189-E192 WeakPolarHBondContact O-CB 3.46Å; E189-E192 PolarHBondContact O-N 3.37Å; E189-E193 WeakPolarHBondContact O-CG 3.46Å; E189-E193 PolarHBondContact O-N 3.3Å
190	K	79.9	Confident	67.1	Low	112 Å²	112	87.7 Å²	87.7	49%	0.487	42%	0.417	S	S	.	.	H	α-helix	trans	-72.4	-23.2	176	-66.2	-179.9	-178.2	-175.3	0	114	H187 I188 K194	H187-K190 WeakPolarHBondContact O-CB 3.26Å; H187-K190 PolarHBondContact O-N 2.92Å; H187-K190 VanDerWaalsContact O-N 3.15Å; I188-K190 PolarHBondContact O-N 3.24Å; K190-K194 VanDerWaalsContact O-CG 3.3Å; K190-K194 WeakPolarHBondContact O-CG 3.46Å; K190-K194 PolarHBondContact O-N 2.86Å
191	H	77.1	Confident	66.1	Low	30 Å²	30	91.2 Å²	91.2	14%	0.139	44%	0.442	C	S	.	.	H	α-helix	trans	-70	-44	167.8	-81.1	-76.4	0	0	0	109.9	Y173 C174 H187 I188 E189 K194 M195	Y173-H191 WeakPolarHBondContact CB-ND1 3.37Å; Y173-H191 HydrophobicContact CD2-CB 3.94Å; Y173-H191 AromaticContact CD2-CG 3.97Å; Y173-H191 HydrophobicContact CE2-CB 4.5Å; Y173-H191 HydrophobicContact CG-CB 4.16Å; Y173-H191 AromaticContact CG-CG 3.96Å; C174-H191 PolarHBondContact SG-NE2 2.97Å; H187-H191 AromaticContact CE1-CD2 3.49Å; H187-H191 PolarHBondContact CE1-CD2 2.81Å; H187-H191 VanDerWaalsContact CE1-CD2 3.49Å; H187-H191 AromaticContact CE1-NE2 3.06Å; H187-H191 PolarHBondContact CE1-NE2 3.36Å; H187-H191 AromaticContact NE2-CD2 3.55Å; H187-H191 AromaticContact NE2-NE2 3.15Å; H187-H191 PolarHBondContact NE2-NE2 2.97Å; H187-H191 VanDerWaalsContact NE2-NE2 3.15Å; H187-H191 PolarHBondContact O-N 3Å; I188-H191 WeakPolarHBondContact O-CA 3.47Å; I188-H191 VanDerWaalsContact O-CB 3.28Å; I188-H191 WeakPolarHBondContact O-CB 3.35Å; I188-H191 PolarHBondContact O-N 3.01Å; E189-H191 VanDerWaalsContact C-N 3.33Å; E189-H191 PolarHBondContact O-N 3.23Å; H191-K194 PolarHBondContact O-N 3.12Å; H191-M195 WeakPolarHBondContact O-CB 3.21Å; H191-M195 WeakPolarHBondContact O-CG 3.23Å; H191-M195 PolarHBondContact O-N 2.89Å
192	E	72.2	Confident	65.1	Low	94 Å²	94	89.8 Å²	89.8	44%	0.439	45%	0.451	S	S	.	.	H	α-helix	trans	-62.1	-44.6	177.1	-65.4	-177.5	172.9	0	0	111.6	I188 E189 K194 M195 Q196	I188-E192 PolarHBondContact O-N 3.46Å; E189-E192 WeakPolarHBondContact O-CB 3.46Å; E189-E192 PolarHBondContact O-N 3.37Å; E192-K194 VanDerWaalsContact C-N 3.29Å; E192-K194 PolarHBondContact O-N 3.41Å; E192-M195 CarbonylContact O-C 3.56Å; E192-M195 PolarHBondContact O-N 3.21Å; E192-M195 VanDerWaalsContact O-N 3.13Å; E192-Q196 WeakPolarHBondContact O-CB 3.25Å; E192-Q196 VanDerWaalsContact O-CG 3.29Å; E192-Q196 WeakPolarHBondContact O-CG 2.93Å; E192-Q196 PolarHBondContact O-N 2.76Å
193	E	69.3	Low	63.6	Low	115 Å²	115	91 Å²	91	54%	0.537	45%	0.449	S	S	.	.	H	α-helix	trans	-55.4	-45.5	173.4	-73.8	176	175.6	0	0	111.2	E189 Q196 I197	E189-E193 WeakPolarHBondContact O-CG 3.46Å; E189-E193 PolarHBondContact O-N 3.3Å; E193-Q196 PolarHBondContact O-N 3.25Å; E193-I197 WeakPolarHBondContact O-CB 3.27Å; E193-I197 WeakPolarHBondContact O-CD1 3.27Å; E193-I197 WeakPolarHBondContact O-CG1 3.4Å; E193-I197 PolarHBondContact O-N 2.99Å
194	K	64.6	Low	61.9	Low	151 Å²	151	89 Å²	89	66%	0.657	46%	0.461	S	S	*	.	H	α-helix	trans	-67.6	-36	178	-73.4	178.9	178.7	-169.3	0	113	K190 H191 E192 S198	K190-K194 VanDerWaalsContact O-CG 3.3Å; K190-K194 WeakPolarHBondContact O-CG 3.46Å; K190-K194 PolarHBondContact O-N 2.86Å; H191-K194 PolarHBondContact O-N 3.12Å; E192-K194 VanDerWaalsContact C-N 3.29Å; E192-K194 PolarHBondContact O-N 3.41Å; K194-S198 PolarHBondContact O-N 3.19Å; K194-S198 PolarHBondContact O-OG 3.16Å
195	M	59.4	Low	59.9	Low	99 Å²	99	95.6 Å²	95.6	49%	0.488	50%	0.501	S	S	.	.	H	α-helix	trans	-75.1	-31	177.2	-68.8	-66.7	-179.7	0	0	112.2	H191 E192 S198 R199	H191-M195 WeakPolarHBondContact O-CB 3.21Å; H191-M195 WeakPolarHBondContact O-CG 3.23Å; H191-M195 PolarHBondContact O-N 2.89Å; E192-M195 CarbonylContact O-C 3.56Å; E192-M195 PolarHBondContact O-N 3.21Å; E192-M195 VanDerWaalsContact O-N 3.13Å; M195-S198 WeakPolarHBondContact CA-OG 3.44Å; M195-S198 PolarHBondContact O-OG 3.44Å; M195-R199 WeakPolarHBondContact O-CB 3.16Å; M195-R199 WeakPolarHBondContact O-CG 3.34Å; M195-R199 PolarHBondContact O-N 3.45Å; M195-R199 VanDerWaalsContact O-N 3.07Å
196	Q	52.3	Low	58.1	Low	112 Å²	112	98.2 Å²	98.2	52%	0.523	52%	0.52	S	S	.	.	H	α-helix	trans	-73	-43.2	172	-73.6	-178.6	15.6	0	0	110.3	E192 E193 S198 R199 I200	E192-Q196 WeakPolarHBondContact O-CB 3.25Å; E192-Q196 VanDerWaalsContact O-CG 3.29Å; E192-Q196 WeakPolarHBondContact O-CG 2.93Å; E192-Q196 PolarHBondContact O-N 2.76Å; E193-Q196 PolarHBondContact O-N 3.25Å; Q196-S198 VanDerWaalsContact C-N 3.29Å; Q196-S198 PolarHBondContact O-N 3.18Å; Q196-R199 PolarHBondContact O-N 2.88Å; Q196-I200 WeakPolarHBondContact O-CB 3.26Å; Q196-I200 WeakPolarHBondContact O-CD1 3.38Å; Q196-I200 WeakPolarHBondContact O-CG1 3.41Å; Q196-I200 PolarHBondContact O-N 3.48Å
197	I	54.7	Low	56.2	Low	113 Å²	113	98.3 Å²	98.3	58%	0.579	53%	0.532	S	S	*	.	H	α-helix	trans	-58.6	-42.8	173.2	-69.9	162.4	0	0	0	110.4	E193 I200 S201	E193-I197 WeakPolarHBondContact O-CB 3.27Å; E193-I197 WeakPolarHBondContact O-CD1 3.27Å; E193-I197 WeakPolarHBondContact O-CG1 3.4Å; E193-I197 PolarHBondContact O-N 2.99Å; I197-I200 PolarHBondContact O-N 3.4Å; I197-S201 WeakPolarHBondContact O-CB 3.44Å; I197-S201 PolarHBondContact O-N 3.39Å; I197-S201 PolarHBondContact O-OG 2.9Å
198	S	49.8	Very low	54.3	Low	59 Å²	59	105.4 Å²	105.4	41%	0.413	57%	0.569	S	S	.	*	H	α-helix	trans	-66.7	-38.9	177.7	67.5	0	0	0	0	112.7	K194 M195 Q196 S201 S202	K194-S198 PolarHBondContact O-N 3.19Å; K194-S198 PolarHBondContact O-OG 3.16Å; M195-S198 WeakPolarHBondContact CA-OG 3.44Å; M195-S198 PolarHBondContact O-OG 3.44Å; Q196-S198 VanDerWaalsContact C-N 3.29Å; Q196-S198 PolarHBondContact O-N 3.18Å; S198-S201 WeakPolarHBondContact CA-OG 3.03Å; S198-S201 PolarHBondContact O-N 3.42Å; S198-S201 PolarHBondContact O-OG 2.83Å; S198-S202 PolarHBondContact O-N 3.1Å; S198-S202 PolarHBondContact O-OG 3.4Å
199	R	44.7	Very low	52.4	Low	173 Å²	173	108.4 Å²	108.4	65%	0.653	59%	0.592	S	S	*	*	H	α-helix	trans	-68.5	-38.7	173.9	-75.4	178.7	-173	170.8	2.8	113.5	M195 Q196 S201 S202 L203	M195-R199 WeakPolarHBondContact O-CB 3.16Å; M195-R199 WeakPolarHBondContact O-CG 3.34Å; M195-R199 PolarHBondContact O-N 3.45Å; M195-R199 VanDerWaalsContact O-N 3.07Å; Q196-R199 PolarHBondContact O-N 2.88Å; R199-S201 VanDerWaalsContact C-N 3.32Å; R199-S202 PolarHBondContact O-N 3.32Å; R199-S202 PolarHBondContact O-OG 3.22Å; R199-L203 WeakPolarHBondContact O-CB 3.17Å; R199-L203 WeakPolarHBondContact O-CG 3.47Å; R199-L203 PolarHBondContact O-N 3.25Å
200	I	44.4	Very low	50.3	Low	109 Å²	109	111.5 Å²	111.5	56%	0.559	61%	0.607	S	S	*	*	H	α-helix	trans	-70.8	-31.9	176.5	-65.4	163.7	0	0	0	110.2	Q196 I197 S202 L203	Q196-I200 WeakPolarHBondContact O-CB 3.26Å; Q196-I200 WeakPolarHBondContact O-CD1 3.38Å; Q196-I200 WeakPolarHBondContact O-CG1 3.41Å; Q196-I200 PolarHBondContact O-N 3.48Å; I197-I200 PolarHBondContact O-N 3.4Å; I200-S202 VanDerWaalsContact C-N 3.29Å; I200-S202 PolarHBondContact O-N 2.78Å; I200-L203 CarbonylContact O-C 3.57Å
201	S	48.4	Very low	48.1	Very low	100 Å²	100	113.8 Å²	113.8	70%	0.699	63%	0.63	S	S	*	*	H	α-helix	trans	-71.4	-22.7	174.6	68.9	0	0	0	0	113.6	I197 S198 R199	I197-S201 WeakPolarHBondContact O-CB 3.44Å; I197-S201 PolarHBondContact O-N 3.39Å; I197-S201 PolarHBondContact O-OG 2.9Å; S198-S201 WeakPolarHBondContact CA-OG 3.03Å; S198-S201 PolarHBondContact O-N 3.42Å; S198-S201 PolarHBondContact O-OG 2.83Å; R199-S201 VanDerWaalsContact C-N 3.32Å
202	S	50.2	Low	45.9	Very low	92 Å²	92	115.1 Å²	115.1	64%	0.643	65%	0.651	S	S	*	*	H	α-helix	trans	-95.1	-21.6	175.3	60.2	0	0	0	0	113.9	S198 R199 I200	S198-S202 PolarHBondContact O-N 3.1Å; S198-S202 PolarHBondContact O-OG 3.4Å; R199-S202 PolarHBondContact O-N 3.32Å; R199-S202 PolarHBondContact O-OG 3.22Å; I200-S202 VanDerWaalsContact C-N 3.29Å; I200-S202 PolarHBondContact O-N 2.78Å
203	L	40.8	Very low	43.9	Very low	114 Å²	114	117.4 Å²	117.4	60%	0.597	67%	0.672	S	S	*	*	S	Bend	trans	-106.4	101.6	176.2	-68.5	159.4	0	0	0	108.6	R199 I200	R199-L203 WeakPolarHBondContact O-CB 3.17Å; R199-L203 WeakPolarHBondContact O-CG 3.47Å; R199-L203 PolarHBondContact O-N 3.25Å; I200-L203 CarbonylContact O-C 3.57Å
204	G	37	Very low	42	Very low	63 Å²	63	116.9 Å²	116.9	65%	0.649	68%	0.681	S	S	*	*			trans	-44.1	141.8	174.6	0	0	0	0	0	112.6	T206	G204-T206 PolarHBondContact O-N 3.05Å; G204-T206 VanDerWaalsContact O-N 3.14Å
205	T	34.2	Very low	40.4	Very low	148 Å²	148	115.5 Å²	115.5	91%	0.908	68%	0.68	S	S	*	*			trans	-23	104.5	-175.6	54.1	0	0	0	0	115
206	T	35.1	Very low	39.1	Very low	120 Å²	120	118.3 Å²	118.3	74%	0.736	70%	0.696	S	S	*	*			trans	-126.7	138.5	163.6	40.6	0	0	0	0	109.9	G204	G204-T206 PolarHBondContact O-N 3.05Å; G204-T206 VanDerWaalsContact O-N 3.14Å
207	S	36.6	Very low	38	Very low	104 Å²	104	119.7 Å²	119.7	73%	0.727	71%	0.707	S	S	*	*			trans	-51.5	129.9	-173.6	167.8	0	0	0	0	114	S209	S207-S209 VanDerWaalsContact C-N 3.31Å; S207-S209 PolarHBondContact O-N 3.23Å; S207-S209 PolarHBondContact OG-OG 3.13Å
208	I	36.7	Very low	36.9	Very low	170 Å²	170	120.5 Å²	120.5	87%	0.872	71%	0.712	S	S	*	*	S	Bend	trans	-81.8	66.4	-178.2	-52.6	171.9	0	0	0	110.5
209	S	36.2	Very low	36	Very low	88 Å²	88	124.7 Å²	124.7	62%	0.615	72%	0.724	S	S	*	*	S	Bend	trans	-120.4	-4.1	177.3	51.7	0	0	0	0	116	S207	S207-S209 VanDerWaalsContact C-N 3.31Å; S207-S209 PolarHBondContact O-N 3.23Å; S207-S209 PolarHBondContact OG-OG 3.13Å
210	E	32.9	Very low	35.2	Very low	176 Å²	176	127.4 Å²	127.4	82%	0.822	73%	0.734	S	S	*	*			trans	-138.7	17	-163.4	-68.4	-174.6	172.5	0	0	118.4
211	V	34.5	Very low	34.4	Very low	159 Å²	159	128.4 Å²	128.4	96%	0.964	75%	0.745	S	S	*	*			trans	-112.9	81.9	175.9	-166.8	0	0	0	0	111.4
212	G	29.9	Very low	33.4	Very low	58 Å²	58	130.7 Å²	130.7	60%	0.598	75%	0.749	S	S	*	*			trans	-110.3	143.2	165.2	0	0	0	0	0	111.6
213	T	30.1	Very low	32.1	Very low	142 Å²	142	132.7 Å²	132.7	87%	0.871	76%	0.757	S	S	*	*			trans	101.1	136.9	153.7	70.1	0	0	0	0	121.7
214	S	30.5	Very low	31.6	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	77%	0.765	S	S	*	*			trans	72.2	126.4	170	88.2	0	0	0	0	115.5
215	I	31	Very low	31.2	Very low	121 Å²	121	138.4 Å²	138.4	62%	0.621	77%	0.774	S	S	*	*				-152.9	121.7	73.6	-72.7	143.8	0	0	0	110.1	N218	I215-N218 HydrophobicContact CG2-CB 4.18Å
216	L	30.9	Very low	30.9	Very low	158 Å²	158	139.7 Å²	139.7	83%	0.827	77%	0.77	S	S	*	*			trans	-104	3.2	161.3	-90.9	171.4	0	0	0	112.8
217	D	30.4	Very low	30.6	Very low	141 Å²	141	141.9 Å²	141.9	75%	0.754	77%	0.774	S	S	*	*			trans	-99.5	4.4	-164.3	-69.4	-42.6	0	0	0	117.2
218	N	30.3	Very low	30	Very low	130 Å²	130	144.5 Å²	144.5	70%	0.695	78%	0.779	S	S	*	*			trans	-103.2	20.1	-172.2	-78.3	-19.9	0	0	0	116.7	I215	I215-N218 HydrophobicContact CG2-CB 4.18Å
219	F	31	Very low	29.6	Very low	148 Å²	148	146.2 Å²	146.2	65%	0.649	78%	0.78	S	S	*	*			trans	-105.9	60.5	169.5	-74.4	-81.1	0	0	0	111.7
220	R	27.7	Very low	29.1	Very low	230 Å²	230	147.7 Å²	147.7	87%	0.868	79%	0.785	S	S	*	*			trans	-119.9	142.7	154.8	-96.7	-176.9	174.7	178.2	-0.2	107.9
221	V	27.2	Very low	28.9	Very low	130 Å²	130	145.6 Å²	145.6	79%	0.788	79%	0.789	S	S	*	*			trans	79.1	97	165.3	-135.6	0	0	0	0	117.7
222	N	28.6	Very low	28.3	Very low	148 Å²	148	146.8 Å²	146.8	79%	0.791	78%	0.784	S	S	*	*				-171.4	102.3	111.2	-101.1	-21.9	0	0	0	110.3
223	V	23.6	Very low	28.1	Very low	134 Å²	134	147.3 Å²	147.3	81%	0.812	79%	0.789	S	S	*	*			trans	-100.6	110.8	159.1	177.2	0	0	0	0	105.4
224	P	30.4	Very low	28	Very low	118 Å²	118	146.1 Å²	146.1	77%	0.766	79%	0.787	S	S	*	*			trans	-82.5	114.3	163.8	-9.7	27.6	0	0	0	108.8
225	E	26.7	Very low	27.6	Very low	179 Å²	179	147.2 Å²	147.2	84%	0.836	79%	0.789	S	S	*	*			trans	-64.1	127.3	157	-71	174	147.7	0	0	108.2
226	E	28.1	Very low	27.5	Very low	175 Å²	175	147.4 Å²	147.4	82%	0.818	80%	0.799	S	S	*	*			trans	158.1	139.5	130.8	-89.8	-170	160	0	0	113.2
227	M	28.4	Very low	27.2	Very low	166 Å²	166	148.1 Å²	148.1	82%	0.818	80%	0.795	S	S	*	*			trans	91.7	87.1	153.2	-70.8	-177.8	153.8	0	0	120.3
228	D	24.3	Very low	27	Very low	158 Å²	158	148.2 Å²	148.2	85%	0.845	80%	0.795	S	S	*	*				3.9	118.9	124.7	-66.9	-46.6	0	0	0	117.1
229	K	29.5	Very low	26.9	Very low	206 Å²	206	151 Å²	151	90%	0.896	81%	0.81	S	S	*	*				-166.3	119.3	121.3	-103.8	166.1	-169	-178.1	0	111.5
230	V	25	Very low	26.6	Very low	119 Å²	119	149.8 Å²	149.8	72%	0.721	82%	0.818	S	S	*	*			trans	-45.5	133.2	166.2	176.5	0	0	0	0	111.3	E232	V230-E232 HydrophobicContact CG1-CG 4.15Å
231	C	27.9	Very low	26.6	Very low	133 Å²	133	145.7 Å²	145.7	90%	0.899	81%	0.813	S	S	*	*			trans	-144.2	109	142.5	-98	0	0	0	0	108.6
232	E	22.9	Very low	26.7	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	81%	0.811	S	S	*	*			trans	-59.6	151.5	168.3	-62.9	172.8	148.3	0	0	111	V230	V230-E232 HydrophobicContact CG1-CG 4.15Å
233	G	25.1	Very low	26.6	Very low	69 Å²	69	147.2 Å²	147.2	71%	0.711	81%	0.811	S	S	*	*			trans	114.3	100.7	162.8	0	0	0	0	0	113.3
234	S	28	Very low	26.9	Very low	118 Å²	118	146.7 Å²	146.7	83%	0.825	80%	0.803	S	S	*	*			trans	149.7	99.6	131.9	-64.5	0	0	0	0	109.6	P236	S234-P236 WeakPolarHBondContact O-CD 3.22Å
235	T	23.1	Very low	26.8	Very low	127 Å²	127	147 Å²	147	78%	0.779	80%	0.802	S	S	*	*			trans	-69.8	134.3	165.7	52.4	0	0	0	0	110.3
236	P	28	Very low	26.8	Very low	126 Å²	126	141.8 Å²	141.8	82%	0.818	79%	0.785	S	S	*	*			trans	-102.6	105.8	154.2	-7.7	28.1	0	0	0	109.6	S234	S234-P236 WeakPolarHBondContact O-CD 3.22Å
237	K	25.9	Very low	26.9	Very low	172 Å²	172	138.7 Å²	138.7	75%	0.748	78%	0.781	S	S	*	*			trans	-62.8	153.4	158	-66.9	174.7	173.2	172.2	0	108.9
238	D	25.7	Very low	26.8	Very low	143 Å²	143	137 Å²	137	77%	0.765	78%	0.775	S	S	*	*			trans	75.5	86	155.6	-49.1	-41.7	0	0	0	118.8
239	L	28.3	Very low	27.1	Very low	190 Å²	190	136.8 Å²	136.8	100%	0.995	78%	0.779	S	S	*	*			trans	-133.8	68.7	146	-81.1	171.1	0	0	0	109.7
240	C	24.5	Very low	27	Very low	122 Å²	122	129.5 Å²	129.5	82%	0.824	76%	0.763	S	S	*	*			trans	-89.4	109.6	161.2	-171.3	0	0	0	0	108
241	N	27.9	Very low	27.2	Very low	144 Å²	144	133.8 Å²	133.8	77%	0.77	77%	0.772	S	S	*	*			trans	-160.3	81.1	152.9	-133.1	-9.5	0	0	0	110.9	Q243	N241-Q243 PolarHBondContact O-N 3.35Å
242	D	28.7	Very low	27.2	Very low	138 Å²	138	134.5 Å²	134.5	74%	0.738	77%	0.766	S	S	*	*			trans	-80.2	103.3	166.1	-84.1	-41.2	0	0	0	109.8
243	Q	26.5	Very low	27.5	Very low	171 Å²	171	135 Å²	135	80%	0.799	77%	0.768	S	S	*	*			trans	-125.4	81	158.1	-75.6	-169	-5.4	0	0	109	N241	N241-Q243 PolarHBondContact O-N 3.35Å
244	I	29.4	Very low	27.7	Very low	123 Å²	123	136.2 Å²	136.2	63%	0.631	77%	0.771	S	S	*	*			trans	-132.6	96.1	157.5	-58.6	178.4	0	0	0	108	S246	I244-S246 PolarHBondContact O-N 2.96Å; I244-S246 VanDerWaalsContact O-N 3.17Å
245	V	28.3	Very low	28	Very low	124 Å²	124	138.2 Å²	138.2	75%	0.752	77%	0.772	S	S	*	*			trans	-58.2	110.5	166.5	177.7	0	0	0	0	108.1
246	S	27.1	Very low	28.5	Very low	70 Å²	70	137.8 Å²	137.8	49%	0.49	76%	0.764	S	S	.	*	P	Polyproline II helix	trans	-64.4	130.5	167.7	-50.4	0	0	0	0	109.6	K26 I244	K26-S246 PolarHBondContact NZ-O 2.9Å; I244-S246 PolarHBondContact O-N 2.96Å; I244-S246 VanDerWaalsContact O-N 3.17Å
247	P	30.2	Very low	29	Very low	111 Å²	111	141.8 Å²	141.8	72%	0.721	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-69.9	131.9	164.8	7.6	5.5	0	0	0	109	V249	P247-V249 PolarHBondContact O-N 2.86Å
248	D	27.7	Very low	29.6	Very low	131 Å²	131	142.5 Å²	142.5	70%	0.701	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-52.5	118.7	167.6	-91.1	-37.3	0	0	0	110	G250	D248-G250 VanDerWaalsContact C-N 3.27Å; D248-G250 PolarHBondContact O-N 3.17Å
249	V	30.3	Very low	30.3	Very low	152 Å²	152	143.7 Å²	143.7	92%	0.921	77%	0.772	S	S	*	*			trans	-94.3	70.6	163.2	-165.6	0	0	0	0	106.9	P247	P247-V249 PolarHBondContact O-N 2.86Å
250	G	26.6	Very low	30.8	Very low	54 Å²	54	142.2 Å²	142.2	56%	0.557	77%	0.765	S	S	*	*			trans	-99.3	144.6	160.9	0	0	0	0	0	108.4	D248	D248-G250 VanDerWaalsContact C-N 3.27Å; D248-G250 PolarHBondContact O-N 3.17Å
251	F	29.3	Very low	31.5	Very low	208 Å²	208	143.6 Å²	143.6	91%	0.912	76%	0.761	S	S	*	*			trans	85.8	78.4	-175.2	-70.5	-94.4	0	0	0	116.6
252	L	28.1	Very low	32	Very low	148 Å²	148	148.1 Å²	148.1	78%	0.775	79%	0.785	S	S	*	*			trans	-155.5	74.6	136.4	-89.2	-176.2	0	0	0	108.9
253	H	28.2	Very low	32.2	Very low	193 Å²	193	148.7 Å²	148.7	89%	0.894	79%	0.788	S	S	*	*	S	Bend	trans	-147.8	73.9	168	-153.3	-101.8	0	0	0	109
254	A	31.3	Very low	32.5	Very low	95 Å²	95	147.5 Å²	147.5	79%	0.785	79%	0.787	S	S	*	*	S	Bend	trans	-163.8	-3.9	174.8	0	0	0	0	0	118.2
255	L	32.5	Very low	32.6	Very low	161 Å²	161	148.8 Å²	148.8	84%	0.843	80%	0.796	S	S	*	*	S	Bend	trans	-127.3	15.9	-164.8	-76.6	175.4	0	0	0	118.3
256	L	35.2	Very low	32.9	Very low	117 Å²	117	150.3 Å²	150.3	61%	0.613	80%	0.798	S	S	*	*	S	Bend	trans	-134.4	26.2	176.6	-68.7	174.5	0	0	0	115.1	I94	I94-L256 HydrophobicContact CD1-CD1 4.34Å
257	Y	36.8	Very low	33.3	Very low	210 Å²	210	155.3 Å²	155.3	82%	0.824	82%	0.817	S	S	*	*	S	Bend	trans	-90.4	3	170.1	-136.3	-90.3	0	0	0	113.7
258	E	38.7	Very low	33.5	Very low	187 Å²	187	158.3 Å²	158.3	87%	0.874	82%	0.824	S	S	*	*	S	Bend	trans	-116.4	11.3	-175.5	-69.1	-167	162.8	0	0	115.2
259	Q	40.6	Very low	33.9	Very low	169 Å²	169	160.2 Å²	160.2	79%	0.79	83%	0.833	S	S	*	*	S	Bend	trans	-120.1	13.6	177.6	-70.3	-156.6	-34.8	0	0	115.5
260	N	40	Very low	34.1	Very low	158 Å²	158	160.8 Å²	160.8	85%	0.845	83%	0.826	S	S	*	*	S	Bend	trans	-128.1	25.5	175.5	-100	-7.6	0	0	0	113.1
261	M	38.6	Very low	34.8	Very low	151 Å²	151	169.8 Å²	169.8	74%	0.744	85%	0.848	S	S	*	*			trans	-131.4	64.9	173.7	-69.6	-72.2	-176.8	0	0	108.9
262	N	38.1	Very low	35.3	Very low	240 Å²	240	166.3 Å²	166.3	100%	1.283	84%	0.843	S	S	*	*			trans	-177.3	0	154.1	-95.8	-18	0	0	0	109.7

Retrieved 262 of 262 residues in 94.2 ms (Link to these results)

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