A0A077ZJJ2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZJJ2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 312 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.7	Very low	24.8	Very low	247 Å²	247	152.7 Å²	152.7	100%	1.217	81%	0.807	S	S	*	*				0	102.8	0	-80	179.5	177.6	0	0	106.7	S3	M1-S3 PolarHBondContact O-N 3.08Å
2	E	24.1	Very low	24.8	Very low	200 Å²	200	145.8 Å²	145.8	94%	0.935	79%	0.788	S	S	*	*			trans	-74.6	114.8	177.7	-74.1	177.1	155.6	0	0	108.9
3	S	23	Very low	24.8	Very low	100 Å²	100	138.7 Å²	138.7	70%	0.699	76%	0.755	S	S	*	*			trans	-68.7	137.4	167.9	47.7	0	0	0	0	109.4	M1 T5	M1-S3 PolarHBondContact O-N 3.08Å; S3-T5 PolarHBondContact O-N 3.37Å; S3-T5 VanDerWaalsContact O-N 3.15Å
4	P	24.5	Very low	25	Very low	120 Å²	120	136.2 Å²	136.2	78%	0.779	74%	0.74	S	S	*	*			trans	-61	122.5	177.6	26.2	-32.7	0	0	0	109.1	Q6	P4-Q6 PolarHBondContact O-N 3.22Å
5	T	24.2	Very low	25.2	Very low	129 Å²	129	131.7 Å²	131.7	79%	0.791	72%	0.722	S	S	*	*			trans	-58	99.4	174.6	29.3	0	0	0	0	109.6	S3 H7	S3-T5 PolarHBondContact O-N 3.37Å; S3-T5 VanDerWaalsContact O-N 3.15Å; T5-H7 PolarHBondContact O-N 3.37Å; T5-H7 VanDerWaalsContact O-N 3.17Å
6	Q	24.2	Very low	25.5	Very low	180 Å²	180	130.4 Å²	130.4	84%	0.841	71%	0.71	S	S	*	*			trans	-58.8	115.4	163.7	-78	179.3	-18.6	0	0	107.9	P4 K8	P4-Q6 PolarHBondContact O-N 3.22Å; Q6-K8 PolarHBondContact O-N 3.1Å
7	H	24.2	Very low	25.9	Very low	178 Å²	178	128.1 Å²	128.1	82%	0.824	69%	0.688	S	S	*	*			trans	-60.7	100.4	169.6	-75.5	-60.2	0	0	0	109.1	T5 I9	T5-H7 PolarHBondContact O-N 3.37Å; T5-H7 VanDerWaalsContact O-N 3.17Å; H7-I9 VanDerWaalsContact C-N 3.3Å; H7-I9 PolarHBondContact O-N 3.03Å
8	K	23.9	Very low	26.3	Very low	204 Å²	204	129.7 Å²	129.7	89%	0.887	68%	0.683	S	S	*	*			trans	-67.1	92.7	162	-88.6	-177.1	174.7	177.7	0	107.6	Q6 S10	Q6-K8 PolarHBondContact O-N 3.1Å; K8-S10 PolarHBondContact O-N 3.32Å; K8-S10 VanDerWaalsContact O-N 3.12Å
9	I	26.3	Very low	26.8	Very low	128 Å²	128	128.8 Å²	128.8	66%	0.656	68%	0.679	S	S	*	*			trans	-63.8	111.7	161.1	-62.9	174.6	0	0	0	105.9	H7 V11	H7-I9 VanDerWaalsContact C-N 3.3Å; H7-I9 PolarHBondContact O-N 3.03Å; I9-V11 PolarHBondContact O-N 3.49Å
10	S	23.5	Very low	27.2	Very low	77 Å²	77	125.4 Å²	125.4	54%	0.538	66%	0.659	S	S	.	*			trans	-61.9	129.7	-176.3	58.3	0	0	0	0	110.6	K8 A12 C13	K8-S10 PolarHBondContact O-N 3.32Å; K8-S10 VanDerWaalsContact O-N 3.12Å; S10-A12 PolarHBondContact O-N 3.1Å; S10-C13 WeakPolarHBondContact O-CB 3.29Å; S10-C13 PolarHBondContact O-N 3.3Å
11	V	24.6	Very low	27.7	Very low	117 Å²	117	122.4 Å²	122.4	71%	0.709	65%	0.645	S	S	*	*	H	α-helix	trans	-48.8	-24.4	178.9	176.9	0	0	0	0	113.7	I9 C13 L14 S15	I9-V11 PolarHBondContact O-N 3.49Å; V11-C13 VanDerWaalsContact C-N 3.27Å; V11-C13 PolarHBondContact O-N 3.12Å; V11-L14 PolarHBondContact O-N 2.96Å; V11-S15 PolarHBondContact O-OG 3.42Å
12	A	24.1	Very low	27.9	Very low	70 Å²	70	115.5 Å²	115.5	58%	0.579	62%	0.617	S	S	*	*	H	α-helix	trans	-61.5	-28.8	174.5	0	0	0	0	0	114.3	S10 S15 H16	S10-A12 PolarHBondContact O-N 3.1Å; A12-S15 PolarHBondContact O-OG 3.3Å; A12-H16 PolarHBondContact O-N 3Å
13	C	25.7	Very low	28.5	Very low	53 Å²	53	107.6 Å²	107.6	36%	0.358	58%	0.584	S	S	.	*	H	α-helix	trans	-71.1	-42.9	179.4	-143.8	0	0	0	0	110.8	S10 V11 S15 H16 W17	S10-C13 WeakPolarHBondContact O-CB 3.29Å; S10-C13 PolarHBondContact O-N 3.3Å; V11-C13 VanDerWaalsContact C-N 3.27Å; V11-C13 PolarHBondContact O-N 3.12Å; C13-S15 VanDerWaalsContact C-N 3.34Å; C13-S15 PolarHBondContact O-N 2.93Å; C13-H16 PolarHBondContact O-N 3.43Å; C13-H16 VanDerWaalsContact O-N 3.13Å; C13-W17 VanDerWaalsContact O-CG 3.27Å; C13-W17 PolarHBondContact O-N 3.49Å; C13-W17 PolarHBondContact SG-NE1 3.11Å
14	L	27.2	Very low	29.1	Very low	104 Å²	104	107 Å²	107	55%	0.545	59%	0.585	S	S	.	*	H	α-helix	trans	-60.6	-37.7	178.7	-78.1	160.3	0	0	0	113.3	V11 W17 W18	V11-L14 PolarHBondContact O-N 2.96Å; L14-W17 WeakPolarHBondContact O-CB 3.5Å; L14-W17 PolarHBondContact O-N 3.4Å; L14-W18 PolarHBondContact O-N 3.3Å; L14-W18 VanDerWaalsContact O-N 3.12Å
15	S	28.1	Very low	29.8	Very low	68 Å²	68	104.9 Å²	104.9	48%	0.476	57%	0.567	S	S	.	*	H	α-helix	trans	-71	-32.6	175.6	33.2	0	0	0	0	113.3	V11 A12 C13 W17	V11-S15 PolarHBondContact O-OG 3.42Å; A12-S15 PolarHBondContact O-OG 3.3Å; C13-S15 VanDerWaalsContact C-N 3.34Å; C13-S15 PolarHBondContact O-N 2.93Å; S15-W17 VanDerWaalsContact C-N 3.35Å
16	H	30.4	Very low	30.5	Very low	112 Å²	112	102.7 Å²	102.7	52%	0.519	56%	0.555	S	S	.	*	H	α-helix	trans	-70.6	-35	171.9	-161.5	64	0	0	0	111.2	A12 C13 N19 H20	A12-H16 PolarHBondContact O-N 3Å; C13-H16 PolarHBondContact O-N 3.43Å; C13-H16 VanDerWaalsContact O-N 3.13Å; H16-N19 PolarHBondContact O-N 2.9Å; H16-H20 AromaticContact CD2-CD2 3.65Å; H16-H20 AromaticContact CD2-NE2 3.55Å; H16-H20 AromaticContact CE1-NE2 3.31Å; H16-H20 PolarHBondContact CE1-NE2 2.96Å; H16-H20 VanDerWaalsContact CE1-NE2 3.31Å; H16-H20 AromaticContact ND1-NE2 3.97Å; H16-H20 AromaticContact NE2-CD2 3.6Å; H16-H20 AromaticContact NE2-NE2 2.98Å; H16-H20 PolarHBondContact NE2-NE2 3.19Å; H16-H20 PolarHBondContact O-CD2 3.13Å; H16-H20 PolarHBondContact O-N 2.96Å
17	W	31.8	Very low	31.3	Very low	90 Å²	90	99.7 Å²	99.7	34%	0.341	55%	0.545	S	S	.	.	H	α-helix	trans	-64.3	-42.5	177.5	-70.6	21.4	0	0	0	112.4	C13 L14 S15 N19 H20 V21 T36	C13-W17 VanDerWaalsContact O-CG 3.27Å; C13-W17 PolarHBondContact O-N 3.49Å; C13-W17 PolarHBondContact SG-NE1 3.11Å; L14-W17 WeakPolarHBondContact O-CB 3.5Å; L14-W17 PolarHBondContact O-N 3.4Å; S15-W17 VanDerWaalsContact C-N 3.35Å; W17-N19 VanDerWaalsContact C-N 3.34Å; W17-N19 PolarHBondContact O-N 3.15Å; W17-H20 PolarHBondContact O-N 3.5Å; W17-V21 VanDerWaalsContact O-CG2 3.31Å; W17-V21 WeakPolarHBondContact O-CG2 3.39Å; W17-V21 PolarHBondContact O-N 2.93Å; W17-T36 HydrophobicContact CE3-CG2 4.4Å; W17-T36 HydrophobicContact CH2-CG2 3.31Å; W17-T36 HydrophobicContact CZ2-CG2 4.21Å; W17-T36 HydrophobicContact CZ3-CG2 3.43Å; W17-T36 VanDerWaalsContact CZ3-CG2 3.43Å
18	W	33.6	Very low	32.2	Very low	158 Å²	158	93.7 Å²	93.7	60%	0.598	52%	0.52	S	S	*	.	H	α-helix	trans	-57.9	-48.1	179.5	-158.7	-110.5	0	0	0	110.8	L14 H20 V21 V22	L14-W18 PolarHBondContact O-N 3.3Å; L14-W18 VanDerWaalsContact O-N 3.12Å; W18-H20 VanDerWaalsContact C-N 3.26Å; W18-H20 PolarHBondContact O-N 3.37Å; W18-V21 PolarHBondContact O-N 3.47Å; W18-V22 WeakPolarHBondContact O-CG2 3.28Å; W18-V22 PolarHBondContact O-N 3.41Å
19	N	35.3	Very low	33	Very low	113 Å²	113	86.3 Å²	86.3	60%	0.604	49%	0.49	S	S	*	.	H	α-helix	trans	-59.6	-30.8	179.2	-70.8	-20.1	0	0	0	114.2	H16 W17	H16-N19 PolarHBondContact O-N 2.9Å; W17-N19 VanDerWaalsContact C-N 3.34Å; W17-N19 PolarHBondContact O-N 3.15Å
20	H	35.6	Very low	33.7	Very low	60 Å²	60	85.7 Å²	85.7	28%	0.278	48%	0.48	S	S	.	.	H	α-helix	trans	-88.4	-27.7	178.6	-70.1	-64.2	0	0	0	113.6	H16 W17 W18 V22 S23 V28 L32	H16-H20 AromaticContact CD2-CD2 3.65Å; H16-H20 AromaticContact CD2-NE2 3.55Å; H16-H20 AromaticContact CE1-NE2 3.31Å; H16-H20 PolarHBondContact CE1-NE2 2.96Å; H16-H20 VanDerWaalsContact CE1-NE2 3.31Å; H16-H20 AromaticContact ND1-NE2 3.97Å; H16-H20 AromaticContact NE2-CD2 3.6Å; H16-H20 AromaticContact NE2-NE2 2.98Å; H16-H20 PolarHBondContact NE2-NE2 3.19Å; H16-H20 PolarHBondContact O-CD2 3.13Å; H16-H20 PolarHBondContact O-N 2.96Å; W17-H20 PolarHBondContact O-N 3.5Å; W18-H20 VanDerWaalsContact C-N 3.26Å; W18-H20 PolarHBondContact O-N 3.37Å; H20-V22 VanDerWaalsContact C-N 3.34Å; H20-S23 WeakPolarHBondContact O-CB 3.33Å; H20-S23 PolarHBondContact O-N 3.28Å; H20-V28 HydrophobicContact CB-CG1 4.32Å; H20-L32 HydrophobicContact CB-CD1 4.47Å; H20-L32 HydrophobicContact CB-CD2 4.47Å
21	V	36.7	Very low	34.6	Very low	62 Å²	62	86 Å²	86	38%	0.376	48%	0.476	S	S	.	.	H	α-helix	trans	-71.8	-30	172	173.9	0	0	0	0	111.3	W17 W18 S23 L32	W17-V21 VanDerWaalsContact O-CG2 3.31Å; W17-V21 WeakPolarHBondContact O-CG2 3.39Å; W17-V21 PolarHBondContact O-N 2.93Å; W18-V21 PolarHBondContact O-N 3.47Å; V21-S23 PolarHBondContact O-N 2.88Å; V21-L32 HydrophobicContact CG2-CD2 3.64Å
22	V	35.5	Very low	35.3	Very low	103 Å²	103	82.2 Å²	82.2	62%	0.624	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	4.2	170.6	-135.7	0	0	0	0	113.2	W18 H20 A24	W18-V22 WeakPolarHBondContact O-CG2 3.28Å; W18-V22 PolarHBondContact O-N 3.41Å; H20-V22 VanDerWaalsContact C-N 3.34Å; V22-A24 PolarHBondContact O-N 3.43Å
23	S	35.8	Very low	36	Very low	34 Å²	34	82.3 Å²	82.3	24%	0.238	44%	0.441	C	S	.	.			trans	-65.6	126.7	177.8	-176.3	0	0	0	0	110.7	H20 V21 N25 I29	H20-S23 WeakPolarHBondContact O-CB 3.33Å; H20-S23 PolarHBondContact O-N 3.28Å; V21-S23 PolarHBondContact O-N 2.88Å; S23-N25 PolarHBondContact O-N 2.91Å; S23-N25 VanDerWaalsContact O-N 3.09Å; S23-N25 PolarHBondContact OG-N 3.47Å; S23-I29 VanDerWaalsContact O-CD1 3.24Å; S23-I29 WeakPolarHBondContact O-CD1 3.35Å
24	A	35.3	Very low	36.6	Very low	88 Å²	88	87.3 Å²	87.3	73%	0.727	45%	0.453	S	S	*	.	S	Bend	trans	-67.2	-5.4	172.5	0	0	0	0	0	113.1	V22 P26	V22-A24 PolarHBondContact O-N 3.43Å; A24-P26 VanDerWaalsContact O-CD 3.32Å; A24-P26 WeakPolarHBondContact O-CD 3.45Å
25	N	39	Very low	36.9	Very low	74 Å²	74	89.4 Å²	89.4	40%	0.396	46%	0.459	S	S	.	.			trans	-93.8	107.3	179.7	-172.3	-17.5	0	0	0	111.2	S23 N27 V28 I29	S23-N25 PolarHBondContact O-N 2.91Å; S23-N25 VanDerWaalsContact O-N 3.09Å; S23-N25 PolarHBondContact OG-N 3.47Å; N25-N27 PolarHBondContact O-N 2.81Å; N25-N27 WeakPolarHBondContact OD1-CB 3.3Å; N25-N27 PolarHBondContact OD1-N 3.39Å; N25-N27 VanDerWaalsContact OD1-N 3.11Å; N25-V28 HydrophobicContact CB-CG2 4.12Å; N25-V28 PolarHBondContact O-N 3.15Å; N25-I29 PolarHBondContact O-N 3.06Å
26	P	40.1	Very low	37.1	Very low	83 Å²	83	88.8 Å²	88.8	54%	0.539	45%	0.453	S	S	.	.	H	α-helix	trans	-63.8	-22.6	-176.7	24	-32.5	0	0	0	114	A24 W30	A24-P26 VanDerWaalsContact O-CD 3.32Å; A24-P26 WeakPolarHBondContact O-CD 3.45Å; P26-W30 WeakPolarHBondContact O-CB 3.45Å; P26-W30 PolarHBondContact O-N 3.38Å
27	N	41	Very low	37.1	Very low	117 Å²	117	86.9 Å²	86.9	63%	0.626	45%	0.449	S	S	*	.	H	α-helix	trans	-71.1	-34.6	177.9	-66	-31.8	0	0	0	112.2	N25 W30 D31	N25-N27 PolarHBondContact O-N 2.81Å; N25-N27 WeakPolarHBondContact OD1-CB 3.3Å; N25-N27 PolarHBondContact OD1-N 3.39Å; N25-N27 VanDerWaalsContact OD1-N 3.11Å; N27-W30 PolarHBondContact O-N 3.45Å; N27-D31 PolarHBondContact O-N 3.05Å; N27-D31 VanDerWaalsContact O-N 3.09Å
28	V	42.6	Very low	37	Very low	52 Å²	52	90.9 Å²	90.9	32%	0.315	47%	0.471	S	S	.	.	H	α-helix	trans	-70.5	-39.9	177.4	176.6	0	0	0	0	110.6	H20 N25 W30 L32	H20-V28 HydrophobicContact CB-CG1 4.32Å; N25-V28 HydrophobicContact CB-CG2 4.12Å; N25-V28 PolarHBondContact O-N 3.15Å; V28-W30 VanDerWaalsContact C-N 3.33Å; V28-L32 WeakPolarHBondContact O-CB 3.43Å; V28-L32 PolarHBondContact O-N 3.18Å; V28-L32 VanDerWaalsContact O-N 3.13Å
29	I	40.9	Very low	36.7	Very low	49 Å²	49	87.9 Å²	87.9	25%	0.251	46%	0.464	S	S	.	.	H	α-helix	trans	-63.9	-40.8	174.6	-64.4	176.4	0	0	0	110.4	S23 N25 L32 L33	S23-I29 VanDerWaalsContact O-CD1 3.24Å; S23-I29 WeakPolarHBondContact O-CD1 3.35Å; N25-I29 PolarHBondContact O-N 3.06Å; I29-L32 WeakPolarHBondContact O-CB 3.2Å; I29-L32 PolarHBondContact O-N 3.09Å; I29-L33 HydrophobicContact CG2-CD1 3.87Å; I29-L33 HydrophobicContact CG2-CG 4.31Å; I29-L33 WeakPolarHBondContact O-CB 3.12Å; I29-L33 VanDerWaalsContact O-CG 3.24Å; I29-L33 WeakPolarHBondContact O-CG 3.11Å; I29-L33 PolarHBondContact O-N 3.37Å
30	W	41.8	Very low	36.4	Very low	115 Å²	115	88.1 Å²	88.1	44%	0.436	46%	0.461	S	S	.	.	H	α-helix	trans	-67.4	-43.8	-179.6	-171.3	-112.2	0	0	0	113.3	P26 N27 V28 L32 L33 R34	P26-W30 WeakPolarHBondContact O-CB 3.45Å; P26-W30 PolarHBondContact O-N 3.38Å; N27-W30 PolarHBondContact O-N 3.45Å; V28-W30 VanDerWaalsContact C-N 3.33Å; W30-L32 VanDerWaalsContact C-N 3.27Å; W30-L32 PolarHBondContact O-N 2.85Å; W30-L33 HydrophobicContact CE3-CD1 4.01Å; W30-L33 HydrophobicContact CZ3-CD1 4.43Å; W30-L33 PolarHBondContact O-N 3.06Å; W30-R34 WeakPolarHBondContact O-CB 3.29Å; W30-R34 PolarHBondContact O-N 2.68Å
31	D	42.6	Very low	36	Very low	85 Å²	85	86.6 Å²	86.6	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-64.6	-34.6	174.6	-87.5	-20.2	0	0	0	111.7	N27 R34 H35	N27-D31 PolarHBondContact O-N 3.05Å; N27-D31 VanDerWaalsContact O-N 3.09Å; D31-R34 WeakPolarHBondContact O-CB 3.26Å; D31-R34 PolarHBondContact O-N 3.5Å; D31-R34 IonicContact OD1-NH1 3Å; D31-H35 PolarHBondContact O-N 2.89Å; D31-H35 PolarHBondContact O-ND1 2.89Å
32	L	37.8	Very low	35.6	Very low	36 Å²	36	85.8 Å²	85.8	19%	0.188	45%	0.448	C	S	.	.	H	α-helix	trans	-64.4	-47.1	172.9	-160.5	86.4	0	0	0	111.6	H20 V21 V28 I29 W30 R34 H35 T36	H20-L32 HydrophobicContact CB-CD1 4.47Å; H20-L32 HydrophobicContact CB-CD2 4.47Å; V21-L32 HydrophobicContact CG2-CD2 3.64Å; V28-L32 WeakPolarHBondContact O-CB 3.43Å; V28-L32 PolarHBondContact O-N 3.18Å; V28-L32 VanDerWaalsContact O-N 3.13Å; I29-L32 WeakPolarHBondContact O-CB 3.2Å; I29-L32 PolarHBondContact O-N 3.09Å; W30-L32 VanDerWaalsContact C-N 3.27Å; W30-L32 PolarHBondContact O-N 2.85Å; L32-R34 VanDerWaalsContact C-N 3.25Å; L32-R34 PolarHBondContact O-N 3.21Å; L32-H35 PolarHBondContact O-N 3.17Å; L32-H35 VanDerWaalsContact O-N 3.07Å; L32-T36 WeakPolarHBondContact O-CB 3.17Å; L32-T36 PolarHBondContact O-N 3.12Å; L32-T36 VanDerWaalsContact O-N 3.1Å; L32-T36 PolarHBondContact O-OG1 2.82Å
33	L	39.5	Very low	35.2	Very low	72 Å²	72	86.9 Å²	86.9	38%	0.377	45%	0.45	S	S	.	.	H	α-helix	trans	-59.5	-36.7	175.8	-73.2	167.5	0	0	0	112	I29 W30 H35 T36	I29-L33 HydrophobicContact CG2-CD1 3.87Å; I29-L33 HydrophobicContact CG2-CG 4.31Å; I29-L33 WeakPolarHBondContact O-CB 3.12Å; I29-L33 VanDerWaalsContact O-CG 3.24Å; I29-L33 WeakPolarHBondContact O-CG 3.11Å; I29-L33 PolarHBondContact O-N 3.37Å; W30-L33 HydrophobicContact CE3-CD1 4.01Å; W30-L33 HydrophobicContact CZ3-CD1 4.43Å; W30-L33 PolarHBondContact O-N 3.06Å; L33-H35 VanDerWaalsContact C-N 3.29Å; L33-H35 PolarHBondContact O-N 2.91Å; L33-T36 PolarHBondContact O-N 3.35Å
34	R	38.3	Very low	35.2	Very low	159 Å²	159	89.7 Å²	89.7	60%	0.6	46%	0.463	S	S	*	.	H	α-helix	trans	-66.1	-28.3	176	-157.8	-177.4	-149.8	162.6	4.6	113.3	W30 D31 L32 L52	W30-R34 WeakPolarHBondContact O-CB 3.29Å; W30-R34 PolarHBondContact O-N 2.68Å; D31-R34 WeakPolarHBondContact O-CB 3.26Å; D31-R34 PolarHBondContact O-N 3.5Å; D31-R34 IonicContact OD1-NH1 3Å; L32-R34 VanDerWaalsContact C-N 3.25Å; L32-R34 PolarHBondContact O-N 3.21Å; R34-L52 WeakPolarHBondContact O-CD1 3.42Å; R34-L52 VanDerWaalsContact O-CD2 3.26Å; R34-L52 WeakPolarHBondContact O-CD2 3.43Å
35	H	33.4	Very low	35.5	Very low	148 Å²	148	87.3 Å²	87.3	69%	0.685	44%	0.436	S	S	*	.	H	α-helix	trans	-93.9	-9.6	179.3	-72.9	68.1	0	0	0	113.3	D31 L32 L33 L52	D31-H35 PolarHBondContact O-N 2.89Å; D31-H35 PolarHBondContact O-ND1 2.89Å; L32-H35 PolarHBondContact O-N 3.17Å; L32-H35 VanDerWaalsContact O-N 3.07Å; L33-H35 VanDerWaalsContact C-N 3.29Å; L33-H35 PolarHBondContact O-N 2.91Å; H35-L52 WeakPolarHBondContact O-CD1 3.31Å
36	T	32.3	Very low	35.7	Very low	54 Å²	54	86 Å²	86	33%	0.331	44%	0.436	S	S	.	.			trans	-116.2	69.7	-170.3	-44	0	0	0	0	111.4	W17 L32 L33	W17-T36 HydrophobicContact CE3-CG2 4.4Å; W17-T36 HydrophobicContact CH2-CG2 3.31Å; W17-T36 HydrophobicContact CZ2-CG2 4.21Å; W17-T36 HydrophobicContact CZ3-CG2 3.43Å; W17-T36 VanDerWaalsContact CZ3-CG2 3.43Å; L32-T36 WeakPolarHBondContact O-CB 3.17Å; L32-T36 PolarHBondContact O-N 3.12Å; L32-T36 VanDerWaalsContact O-N 3.1Å; L32-T36 PolarHBondContact O-OG1 2.82Å; L33-T36 PolarHBondContact O-N 3.35Å
37	V	31.1	Very low	36.2	Very low	73 Å²	73	83.2 Å²	83.2	44%	0.442	42%	0.416	S	S	.	.			trans	-144	96	173.4	-169.5	0	0	0	0	109.9	L52	V37-L52 HydrophobicContact CB-CD1 4Å; V37-L52 HydrophobicContact CB-CD2 3.83Å; V37-L52 HydrophobicContact CB-CG 3.98Å; V37-L52 HydrophobicContact CG2-CD1 4.46Å; V37-L52 HydrophobicContact CG2-CD2 4.04Å
38	Q	28.3	Very low	36.5	Very low	173 Å²	173	78.9 Å²	78.9	81%	0.808	40%	0.396	S	S	*	.	S	Bend	trans	-102.8	126.3	139.3	-92	-176.5	-27	0	0	106.2
39	H	28.4	Very low	36.7	Very low	96 Å²	96	77.6 Å²	77.6	44%	0.444	39%	0.388	S	S	.	.			trans	14.2	126.4	176.8	-54.4	-49.9	0	0	0	119.2	A48	H39-A48 WeakPolarHBondContact CE1-CA 3.28Å; H39-A48 WeakPolarHBondContact CE1-CB 3.49Å
40	Q	28.9	Very low	36.7	Very low	117 Å²	117	78.4 Å²	78.4	55%	0.547	40%	0.396	S	S	.	.				176	134.9	108.3	-93.9	166.5	3.2	0	0	112.7	N225	Q40-N225 HydrophobicContact CB-CB 4.49Å; Q40-N225 PolarHBondContact OE1-ND2 3.09Å
41	M	27.5	Very low	36.7	Very low	28 Å²	28	79.4 Å²	79.4	14%	0.138	40%	0.404	C	S	.	.			trans	-115.7	146.7	159	-89.6	-129.1	32	0	0	108.3	A46 L205 P227 G229	M41-A46 HydrophobicContact CB-CB 4.15Å; M41-A46 HydrophobicContact CG-CB 4.28Å; M41-L205 HydrophobicContact CE-CB 4.28Å; M41-L205 HydrophobicContact CE-CD1 3.76Å; M41-L205 HydrophobicContact SD-CB 4.48Å; M41-P227 HydrophobicContact CB-CB 4.3Å; M41-P227 HydrophobicContact CE-CB 3.59Å; M41-P227 HydrophobicContact CG-CB 3.45Å; M41-P227 VanDerWaalsContact CG-CB 3.45Å; M41-P227 HydrophobicContact SD-CB 3.4Å; M41-P227 WeakPolarHBondContact SD-CB 3.4Å; M41-G229 WeakPolarHBondContact SD-CA 3.2Å; M41-G229 PolarHBondContact SD-N 2.62Å
42	L	27.5	Very low	36.8	Very low	46 Å²	46	77.8 Å²	77.8	24%	0.241	40%	0.395	C	S	.	.	S	Bend	trans	-131.1	126.5	-174.2	-126.7	151.1	0	0	0	108.1	F254	L42-F254 WeakPolarHBondContact CD2-O 3.49Å
43	N	28.3	Very low	37.1	Very low	125 Å²	125	79.3 Å²	79.3	67%	0.668	41%	0.409	S	S	*	.	S	Bend	trans	65.2	83.6	-158.7	-72.5	-11	0	0	0	115
44	N	35.1	Very low	37.7	Very low	93 Å²	93	77.6 Å²	77.6	50%	0.497	40%	0.4	S	S	.	.	S	Bend	trans	101	46	165.8	-47.2	-46	0	0	0	118.3
45	E	42.5	Very low	38.4	Very low	38 Å²	38	72.8 Å²	72.8	18%	0.178	39%	0.386	C	S	.	.			trans	64.4	105	131.5	-16.2	-158.9	114.6	0	0	117.6	R250 G251 E252 N253	E45-R250 HydrophobicContact CG-CB 4.18Å; E45-R250 WeakPolarHBondContact OE2-CA 3.34Å; E45-R250 VanDerWaalsContact OE2-CB 3.22Å; E45-R250 WeakPolarHBondContact OE2-CB 3.43Å; E45-G251 WeakPolarHBondContact CB-O 3.27Å; E45-G251 VanDerWaalsContact CD-CA 3.44Å; E45-G251 VanDerWaalsContact CG-O 3.23Å; E45-G251 WeakPolarHBondContact CG-O 3.32Å; E45-G251 WeakPolarHBondContact OE2-CA 3.32Å; E45-G251 PolarHBondContact OE2-N 3.29Å; E45-E252 WeakPolarHBondContact OE1-CA 3.2Å; E45-E252 PolarHBondContact OE1-N 3.25Å; E45-E252 PolarHBondContact OE2-N 3.19Å; E45-N253 PolarHBondContact OE1-N 3.15Å
46	A	42.8	Very low	39.6	Very low	46 Å²	46	73.8 Å²	73.8	38%	0.38	38%	0.384	S	S	.	.			trans	-111.2	142.5	177.3	0	0	0	0	0	110.7	M41	M41-A46 HydrophobicContact CB-CB 4.15Å; M41-A46 HydrophobicContact CG-CB 4.28Å
47	I	49.3	Very low	41	Very low	25 Å²	25	75.4 Å²	75.4	13%	0.128	39%	0.386	C	S	.	.			trans	-65.8	134.7	168.4	-47.8	166	0	0	0	109.4	L49 Y83 I230 L232	I47-L49 PolarHBondContact O-N 2.91Å; I47-Y83 HydrophobicContact CB-CD2 4.34Å; I47-Y83 HydrophobicContact CB-CE2 4.36Å; I47-Y83 HydrophobicContact CD1-CD2 3.92Å; I47-Y83 HydrophobicContact CD1-CE2 4.08Å; I47-Y83 HydrophobicContact CD1-CG 4.31Å; I47-Y83 HydrophobicContact CG1-CD2 4.13Å; I47-Y83 HydrophobicContact CG1-CE2 3.91Å; I47-Y83 HydrophobicContact CG2-CD2 3.28Å; I47-Y83 HydrophobicContact CG2-CE2 3.6Å; I47-Y83 HydrophobicContact CG2-CG 4.36Å; I47-I230 HydrophobicContact CD1-CB 4.36Å; I47-I230 HydrophobicContact CD1-CG2 3.84Å; I47-I230 HydrophobicContact CG1-CG2 4.46Å; I47-L232 HydrophobicContact CD1-CD1 3.32Å; I47-L232 HydrophobicContact CD1-CD2 3.58Å; I47-L232 HydrophobicContact CD1-CG 3.42Å; I47-L232 VanDerWaalsContact CD1-CG 3.42Å; I47-L232 HydrophobicContact CG1-CD1 3.8Å; I47-L232 HydrophobicContact CG1-CG 3.99Å
48	A	48.1	Very low	42.5	Very low	26 Å²	26	72.4 Å²	72.4	22%	0.215	37%	0.367	C	S	.	.			trans	-69.6	109.8	168.8	0	0	0	0	0	111.6	H39 P80	H39-A48 WeakPolarHBondContact CE1-CA 3.28Å; H39-A48 WeakPolarHBondContact CE1-CB 3.49Å; A48-P80 HydrophobicContact CB-CB 4.42Å
49	L	47.3	Very low	44.1	Very low	25 Å²	25	69 Å²	69	13%	0.131	35%	0.349	C	S	.	.			trans	-82	123.3	163.9	-64.2	-177.4	0	0	0	108.9	I47 F51 L55 Y58 I230	I47-L49 PolarHBondContact O-N 2.91Å; L49-F51 PolarHBondContact O-N 3.35Å; L49-L55 HydrophobicContact CD1-CB 3.9Å; L49-L55 HydrophobicContact CD1-CD1 4.03Å; L49-L55 HydrophobicContact CD1-CG 3.85Å; L49-Y58 HydrophobicContact CD1-CD2 4.04Å; L49-Y58 HydrophobicContact CD1-CG 4.47Å; L49-Y58 HydrophobicContact CD2-CD1 4.1Å; L49-Y58 HydrophobicContact CD2-CD2 3.33Å; L49-Y58 HydrophobicContact CD2-CE1 4.04Å; L49-Y58 HydrophobicContact CD2-CE2 3.27Å; L49-Y58 HydrophobicContact CD2-CG 3.78Å; L49-Y58 HydrophobicContact CG-CD2 4.35Å; L49-I230 HydrophobicContact CD1-CD1 4.11Å; L49-I230 HydrophobicContact CG-CD1 4.43Å
50	P	40.5	Very low	45.8	Very low	66 Å²	66	66.2 Å²	66.2	43%	0.429	34%	0.338	S	S	.	.	S	Bend	trans	-65	-31.1	-177.7	23.5	-30.5	0	0	0	112.1
51	F	41.9	Very low	47.5	Very low	137 Å²	137	61.2 Å²	61.2	60%	0.601	31%	0.314	S	S	*	.			trans	-134.9	141.1	175.3	-56	-77.4	0	0	0	111.6	L49 S53 D54	L49-F51 PolarHBondContact O-N 3.35Å; F51-S53 WeakPolarHBondContact CB-OG 3.36Å; F51-S53 PolarHBondContact O-N 2.79Å; F51-D54 VanDerWaalsContact O-CB 3.25Å; F51-D54 WeakPolarHBondContact O-CB 3.37Å; F51-D54 PolarHBondContact O-N 2.9Å
52	L	43.6	Very low	49.6	Very low	50 Å²	50	60 Å²	60	26%	0.262	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-60.1	-32.1	174.7	-102.6	168.1	0	0	0	113.1	R34 H35 V37 D54 L55	R34-L52 WeakPolarHBondContact O-CD1 3.42Å; R34-L52 VanDerWaalsContact O-CD2 3.26Å; R34-L52 WeakPolarHBondContact O-CD2 3.43Å; H35-L52 WeakPolarHBondContact O-CD1 3.31Å; V37-L52 HydrophobicContact CB-CD1 4Å; V37-L52 HydrophobicContact CB-CD2 3.83Å; V37-L52 HydrophobicContact CB-CG 3.98Å; V37-L52 HydrophobicContact CG2-CD1 4.46Å; V37-L52 HydrophobicContact CG2-CD2 4.04Å; L52-D54 PolarHBondContact O-N 3.11Å; L52-D54 VanDerWaalsContact O-N 3.12Å; L52-L55 HydrophobicContact CD2-CD1 4.03Å; L52-L55 WeakPolarHBondContact O-CB 3.46Å; L52-L55 PolarHBondContact O-N 2.93Å; L52-L55 VanDerWaalsContact O-N 3.09Å
53	S	45.5	Very low	51.8	Low	69 Å²	69	57.9 Å²	57.9	48%	0.483	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-57.7	-23.4	172.7	53.3	0	0	0	0	112.7	F51 L55 R56	F51-S53 WeakPolarHBondContact CB-OG 3.36Å; F51-S53 PolarHBondContact O-N 2.79Å; S53-L55 VanDerWaalsContact C-N 3.31Å; S53-R56 WeakPolarHBondContact O-CD 3.43Å; S53-R56 VanDerWaalsContact O-CG 3.26Å; S53-R56 WeakPolarHBondContact O-CG 3.28Å; S53-R56 PolarHBondContact O-NE 3.12Å
54	D	50.6	Low	54	Low	35 Å²	35	51.9 Å²	51.9	19%	0.187	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-79.7	-18.5	-178.3	-60	-19.9	0	0	0	112.2	F51 L52 R56 F57 Y58	F51-D54 VanDerWaalsContact O-CB 3.25Å; F51-D54 WeakPolarHBondContact O-CB 3.37Å; F51-D54 PolarHBondContact O-N 2.9Å; L52-D54 PolarHBondContact O-N 3.11Å; L52-D54 VanDerWaalsContact O-N 3.12Å; D54-R56 PolarHBondContact O-N 3.17Å; D54-R56 VanDerWaalsContact O-N 3.07Å; D54-F57 HydrophobicContact CB-CD2 4.12Å; D54-F57 WeakPolarHBondContact O-CA 3.49Å; D54-F57 VanDerWaalsContact O-CB 3.28Å; D54-F57 WeakPolarHBondContact O-CB 3.43Å; D54-F57 WeakPolarHBondContact O-CD2 3.28Å; D54-F57 PolarHBondContact O-N 2.94Å; D54-Y58 HydrophobicContact CB-CE2 4.12Å; D54-Y58 WeakPolarHBondContact O-CD2 3.41Å
55	L	53.6	Low	55.9	Low	59 Å²	59	47.9 Å²	47.9	31%	0.309	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-56.6	-30.4	-178.3	-152.4	142.4	0	0	0	112.1	L49 L52 S53 F57 Y58	L49-L55 HydrophobicContact CD1-CB 3.9Å; L49-L55 HydrophobicContact CD1-CD1 4.03Å; L49-L55 HydrophobicContact CD1-CG 3.85Å; L52-L55 HydrophobicContact CD2-CD1 4.03Å; L52-L55 WeakPolarHBondContact O-CB 3.46Å; L52-L55 PolarHBondContact O-N 2.93Å; L52-L55 VanDerWaalsContact O-N 3.09Å; S53-L55 VanDerWaalsContact C-N 3.31Å; L55-F57 PolarHBondContact O-N 3.33Å; L55-F57 VanDerWaalsContact O-N 3.14Å; L55-Y58 CarbonylContact O-C 3.56Å; L55-Y58 PolarHBondContact O-N 2.83Å
56	R	58.2	Low	57.4	Low	169 Å²	169	49.9 Å²	49.9	64%	0.638	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-61	-20.3	172.8	75.8	-169	173.7	171.6	-4.8	114.4	S53 D54 K59	S53-R56 WeakPolarHBondContact O-CD 3.43Å; S53-R56 VanDerWaalsContact O-CG 3.26Å; S53-R56 WeakPolarHBondContact O-CG 3.28Å; S53-R56 PolarHBondContact O-NE 3.12Å; D54-R56 PolarHBondContact O-N 3.17Å; D54-R56 VanDerWaalsContact O-N 3.07Å; R56-K59 WeakPolarHBondContact O-CE 3.47Å; R56-K59 WeakPolarHBondContact O-CG 3.32Å
57	F	61.2	Low	58.7	Low	87 Å²	87	53.8 Å²	53.8	38%	0.382	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-93.9	-12.2	178	-52.3	-63.9	0	0	0	112.9	D54 L55 P85	D54-F57 HydrophobicContact CB-CD2 4.12Å; D54-F57 WeakPolarHBondContact O-CA 3.49Å; D54-F57 VanDerWaalsContact O-CB 3.28Å; D54-F57 WeakPolarHBondContact O-CB 3.43Å; D54-F57 WeakPolarHBondContact O-CD2 3.28Å; D54-F57 PolarHBondContact O-N 2.94Å; L55-F57 PolarHBondContact O-N 3.33Å; L55-F57 VanDerWaalsContact O-N 3.14Å; F57-P85 HydrophobicContact CB-CB 3.75Å; F57-P85 HydrophobicContact CB-CG 3.87Å; F57-P85 HydrophobicContact CG-CG 4.4Å
58	Y	63.8	Low	59.3	Low	10 Å²	10	60.9 Å²	60.9	4%	0.039	30%	0.295	C	S	.	.	S	Bend	trans	-112.3	40.3	179.1	-61.8	-93.4	0	0	0	111.1	L49 D54 L55 V64 Y83 P85 V200	L49-Y58 HydrophobicContact CD1-CD2 4.04Å; L49-Y58 HydrophobicContact CD1-CG 4.47Å; L49-Y58 HydrophobicContact CD2-CD1 4.1Å; L49-Y58 HydrophobicContact CD2-CD2 3.33Å; L49-Y58 HydrophobicContact CD2-CE1 4.04Å; L49-Y58 HydrophobicContact CD2-CE2 3.27Å; L49-Y58 HydrophobicContact CD2-CG 3.78Å; L49-Y58 HydrophobicContact CG-CD2 4.35Å; D54-Y58 HydrophobicContact CB-CE2 4.12Å; D54-Y58 WeakPolarHBondContact O-CD2 3.41Å; L55-Y58 CarbonylContact O-C 3.56Å; L55-Y58 PolarHBondContact O-N 2.83Å; Y58-V64 HydrophobicContact CD1-CG1 3.6Å; Y58-V64 HydrophobicContact CE1-CB 4.32Å; Y58-V64 HydrophobicContact CE1-CG1 3.63Å; Y58-Y83 PolarHBondContact OH-O 2.93Å; Y58-P85 WeakPolarHBondContact OH-CD 3.25Å; Y58-V200 HydrophobicContact CD1-CG2 4.15Å; Y58-V200 WeakPolarHBondContact O-CG1 3.47Å
59	K	62.2	Low	59.7	Low	102 Å²	102	60.8 Å²	60.8	44%	0.443	29%	0.293	S	S	.	.			trans	-58.2	158.9	175.2	-59	-176.9	-168.5	165.9	0	110.2	R56 H61 A62 E88 V200	R56-K59 WeakPolarHBondContact O-CE 3.47Å; R56-K59 WeakPolarHBondContact O-CG 3.32Å; K59-H61 PolarHBondContact O-N 2.8Å; K59-A62 WeakPolarHBondContact O-CB 3.07Å; K59-A62 PolarHBondContact O-N 2.94Å; K59-E88 IonicContact NZ-OE1 3.22Å; K59-E88 PolarHBondContact NZ-OE1 3.46Å; K59-V200 WeakPolarHBondContact O-CG1 3.48Å
60	L	62.6	Low	60	Low	38 Å²	38	62.7 Å²	62.7	20%	0.199	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.4	126.4	168.1	-164.6	70.2	0	0	0	111.3	A62 V107 N201 E202	L60-A62 VanDerWaalsContact C-N 3.32Å; L60-A62 PolarHBondContact O-N 3.1Å; L60-V107 HydrophobicContact CD2-CG1 3.43Å; L60-V107 VanDerWaalsContact CD2-CG1 3.43Å; L60-V107 HydrophobicContact CG-CG1 4.39Å; L60-N201 WeakPolarHBondContact CD1-OD1 3.42Å; L60-E202 HydrophobicContact CD1-CB 4Å; L60-E202 HydrophobicContact CD1-CG 4.45Å
61	H	65.9	Low	60.5	Low	12 Å²	12	63.8 Å²	63.8	6%	0.056	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	30.1	-174.4	-46.3	-65.5	0	0	0	115	K59 L89 L104 V107 F171 V200	K59-H61 PolarHBondContact O-N 2.8Å; H61-L89 HydrophobicContact CB-CB 4.43Å; H61-L89 HydrophobicContact CB-CD2 4.28Å; H61-L89 WeakPolarHBondContact O-CB 3.44Å; H61-L89 PolarHBondContact O-N 2.82Å; H61-L89 VanDerWaalsContact O-N 3.09Å; H61-L104 HydrophobicContact CB-CD2 3.75Å; H61-L104 VanDerWaalsContact CD2-CD2 3.44Å; H61-L104 WeakPolarHBondContact CD2-CD2 3.19Å; H61-V107 WeakPolarHBondContact NE2-CG1 3.37Å; H61-F171 AromaticContact ND1-CE2 3.92Å; H61-F171 AromaticContact ND1-CZ 3.89Å; H61-V200 VanDerWaalsContact CA-O 3.29Å; H61-V200 WeakPolarHBondContact CA-O 3.35Å; H61-V200 PolarHBondContact N-O 3.35Å
62	A	70.4	Confident	60.8	Low	3 Å²	3	60.3 Å²	60.3	3%	0.025	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	139.9	162.3	0	0	0	0	0	110.2	K59 L60 G87 V200	K59-A62 WeakPolarHBondContact O-CB 3.07Å; K59-A62 PolarHBondContact O-N 2.94Å; L60-A62 VanDerWaalsContact C-N 3.32Å; L60-A62 PolarHBondContact O-N 3.1Å; A62-G87 CarbonylContact C-O 3.54Å; A62-G87 WeakPolarHBondContact CA-O 3.44Å; A62-V200 HydrophobicContact CB-CB 4.32Å; A62-V200 HydrophobicContact CB-CG2 4.41Å; A62-V200 WeakPolarHBondContact O-CB 3.41Å; A62-V200 PolarHBondContact O-N 2.75Å
63	G	73.5	Confident	61.2	Low	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.1	164.9	0	0	0	0	0	109.7	A86 G87 Y198	G63-A86 WeakPolarHBondContact O-CA 3.32Å; G63-A86 VanDerWaalsContact O-CB 3.32Å; G63-A86 WeakPolarHBondContact O-CB 3.4Å; G63-A86 PolarHBondContact O-N 2.79Å; G63-G87 PolarHBondContact N-O 2.85Å; G63-G87 PolarHBondContact O-N 3.07Å; G63-Y198 CarbonylContact C-O 3.52Å; G63-Y198 WeakPolarHBondContact CA-O 3.49Å
64	V	75.9	Confident	61.7	Low	0 Å²	0	63 Å²	63	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.6	174.7	-50	0	0	0	0	110.3	Y58 Y83 Q84 Y198 V200 L232	Y58-V64 HydrophobicContact CD1-CG1 3.6Å; Y58-V64 HydrophobicContact CE1-CB 4.32Å; Y58-V64 HydrophobicContact CE1-CG1 3.63Å; V64-Y83 HydrophobicContact CG2-CD1 3.87Å; V64-Y83 HydrophobicContact CG2-CG 4.24Å; V64-Q84 CarbonylContact C-O 3.54Å; V64-Q84 VanDerWaalsContact CA-O 3.28Å; V64-Q84 WeakPolarHBondContact CA-O 3.18Å; V64-Q84 WeakPolarHBondContact CB-O 3.19Å; V64-Y198 PolarHBondContact N-O 2.65Å; V64-Y198 WeakPolarHBondContact O-CB 3.34Å; V64-Y198 PolarHBondContact O-N 3.11Å; V64-V200 HydrophobicContact CG1-CG2 3.58Å; V64-V200 HydrophobicContact CG2-CG2 4.12Å; V64-L232 HydrophobicContact CG2-CD2 3.98Å
65	V	75	Confident	61.4	Low	9 Å²	9	66.8 Å²	66.8	6%	0.055	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	138.9	176.1	-108.4	0	0	0	0	109.2	R67 Y83 Q84 A86 I186 A187 P194	V65-R67 PolarHBondContact O-N 3.3Å; V65-Y83 CarbonylContact O-C 3.56Å; V65-Y83 WeakPolarHBondContact O-CA 3.36Å; V65-Q84 HydrophobicContact CG2-CB 4.47Å; V65-Q84 PolarHBondContact N-O 3.3Å; V65-Q84 PolarHBondContact O-N 3.09Å; V65-A86 HydrophobicContact CG2-CB 4.22Å; V65-I186 HydrophobicContact CG2-CG2 4.39Å; V65-A187 HydrophobicContact CG1-CB 4.47Å; V65-P194 HydrophobicContact CG1-CB 3.43Å; V65-P194 VanDerWaalsContact CG1-CB 3.43Å; V65-P194 HydrophobicContact CG1-CG 3.76Å
66	K	74.1	Confident	61.3	Low	79 Å²	79	69.5 Å²	69.5	34%	0.343	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	124.7	174.8	177.1	178	177	-175.4	0	109	L68 V81 Y83 Y198	K66-L68 PolarHBondContact O-N 3.08Å; K66-V81 HydrophobicContact CD-CG1 4.01Å; K66-V81 HydrophobicContact CG-CG1 3.91Å; K66-Y83 HydrophobicContact CB-CD1 4.29Å; K66-Y83 HydrophobicContact CB-CE1 4.22Å; K66-Y198 HydrophobicContact CB-CD2 4.3Å; K66-Y198 HydrophobicContact CB-CE2 3.61Å
67	R	69.4	Low	61	Low	128 Å²	128	67 Å²	67	48%	0.483	35%	0.35	S	S	.	.			trans	-69.5	133	169.3	-84.9	-169.3	165.3	-172.2	-3.8	109.7	V65 S69 Q82 Q84	V65-R67 PolarHBondContact O-N 3.3Å; R67-S69 PolarHBondContact O-N 3.42Å; R67-Q82 HydrophobicContact CB-CB 4.26Å; R67-Q82 PolarHBondContact N-O 3.12Å; R67-Q84 HydrophobicContact CG-CB 4.02Å
68	L	61.1	Low	60.5	Low	175 Å²	175	65.6 Å²	65.6	92%	0.916	36%	0.36	S	S	*	.			trans	-67.2	98.8	172.3	-74.7	164.8	0	0	0	108.7	K66	K66-L68 PolarHBondContact O-N 3.08Å
69	S	58	Low	59.9	Low	24 Å²	24	68.5 Å²	68.5	17%	0.168	37%	0.374	C	S	.	.			trans	-97	134.3	160	62.1	0	0	0	0	109.1	R67 T71 R74	R67-S69 PolarHBondContact O-N 3.42Å; S69-T71 PolarHBondContact O-N 2.87Å; S69-R74 WeakPolarHBondContact OG-CD 3.03Å; S69-R74 WeakPolarHBondContact OG-CG 3.26Å
70	S	52.7	Low	59.4	Low	64 Å²	64	67.1 Å²	67.1	45%	0.448	38%	0.375	S	S	.	.			trans	-57.7	142.2	179.1	72.8	0	0	0	0	109.7	A72 K73 R74	S70-A72 PolarHBondContact O-N 3.2Å; S70-K73 PolarHBondContact O-N 3.14Å; S70-K73 WeakPolarHBondContact OG-CB 3.19Å; S70-K73 VanDerWaalsContact OG-CG 3.29Å; S70-K73 WeakPolarHBondContact OG-CG 3.48Å; S70-K73 PolarHBondContact OG-N 3.14Å; S70-R74 PolarHBondContact O-N 3.24Å; S70-R74 VanDerWaalsContact O-N 3.13Å
71	T	51.7	Low	59.2	Low	90 Å²	90	67.5 Å²	67.5	55%	0.552	38%	0.379	S	S	*	.	H	α-helix	trans	-57	-35.2	179.7	-52.6	0	0	0	0	111.1	S69 R74 V75	S69-T71 PolarHBondContact O-N 2.87Å; T71-R74 PolarHBondContact O-N 2.92Å; T71-R74 PolarHBondContact OG1-NH2 2.83Å; T71-V75 HydrophobicContact CG2-CG2 4Å; T71-V75 WeakPolarHBondContact O-CB 3.39Å; T71-V75 WeakPolarHBondContact O-CG2 3.49Å; T71-V75 PolarHBondContact O-N 2.99Å
72	A	46.8	Very low	59.2	Low	63 Å²	63	71 Å²	71	52%	0.521	40%	0.395	S	S	.	.	H	α-helix	trans	-58.1	-47.4	172.4	0	0	0	0	0	112.1	S70 R74 V76	S70-A72 PolarHBondContact O-N 3.2Å; A72-R74 PolarHBondContact O-N 2.86Å; A72-V76 WeakPolarHBondContact O-CA 3.23Å; A72-V76 WeakPolarHBondContact O-CB 3.44Å; A72-V76 VanDerWaalsContact O-CG2 3.3Å; A72-V76 WeakPolarHBondContact O-CG2 3.49Å; A72-V76 PolarHBondContact O-N 2.81Å
73	K	53.4	Low	59.2	Low	96 Å²	96	72.2 Å²	72.2	42%	0.417	40%	0.4	S	S	.	.	H	α-helix	trans	-62.1	-40.4	177	-75.8	-172.2	169.9	-157.8	0	112.8	S70 L77 G78 E79	S70-K73 PolarHBondContact O-N 3.14Å; S70-K73 WeakPolarHBondContact OG-CB 3.19Å; S70-K73 VanDerWaalsContact OG-CG 3.29Å; S70-K73 WeakPolarHBondContact OG-CG 3.48Å; S70-K73 PolarHBondContact OG-N 3.14Å; K73-L77 HydrophobicContact CB-CD1 4.39Å; K73-L77 HydrophobicContact CG-CD1 3.98Å; K73-L77 CarbonylContact O-C 3.6Å; K73-L77 WeakPolarHBondContact O-CA 3.25Å; K73-L77 VanDerWaalsContact O-CB 3.26Å; K73-L77 WeakPolarHBondContact O-CB 2.92Å; K73-L77 PolarHBondContact O-N 3.46Å; K73-L77 VanDerWaalsContact O-N 3.11Å; K73-G78 PolarHBondContact O-N 2.8Å; K73-E79 WeakPolarHBondContact CD-OE2 3.25Å; K73-E79 PolarHBondContact O-N 3.41Å
74	R	54.9	Low	59.2	Low	80 Å²	80	75 Å²	75	30%	0.302	41%	0.412	S	S	.	.	H	α-helix	trans	-68.4	-45.8	178.7	-70.3	-174	-71.7	153.8	6.7	113.3	S69 S70 T71 A72 G78	S69-R74 WeakPolarHBondContact OG-CD 3.03Å; S69-R74 WeakPolarHBondContact OG-CG 3.26Å; S70-R74 PolarHBondContact O-N 3.24Å; S70-R74 VanDerWaalsContact O-N 3.13Å; T71-R74 PolarHBondContact O-N 2.92Å; T71-R74 PolarHBondContact OG1-NH2 2.83Å; A72-R74 PolarHBondContact O-N 2.86Å; R74-G78 WeakPolarHBondContact O-CA 3.04Å; R74-G78 PolarHBondContact O-N 3.33Å
75	V	45.9	Very low	59	Low	115 Å²	115	77.1 Å²	77.1	70%	0.697	43%	0.426	S	S	*	.	H	α-helix	trans	-82.2	-39.5	-172.9	178.2	0	0	0	0	111.4	T71	T71-V75 HydrophobicContact CG2-CG2 4Å; T71-V75 WeakPolarHBondContact O-CB 3.39Å; T71-V75 WeakPolarHBondContact O-CG2 3.49Å; T71-V75 PolarHBondContact O-N 2.99Å
76	V	49.9	Very low	58.9	Low	115 Å²	115	77.3 Å²	77.3	70%	0.697	43%	0.429	S	S	*	.	H	α-helix	trans	-90.6	-40.2	-173.6	-174.6	0	0	0	0	111.9	A72	A72-V76 WeakPolarHBondContact O-CA 3.23Å; A72-V76 WeakPolarHBondContact O-CB 3.44Å; A72-V76 VanDerWaalsContact O-CG2 3.3Å; A72-V76 WeakPolarHBondContact O-CG2 3.49Å; A72-V76 PolarHBondContact O-N 2.81Å
77	L	53.4	Low	58.7	Low	118 Å²	118	74.9 Å²	74.9	62%	0.618	43%	0.427	S	S	*	.	S	Bend	trans	-98.7	-3.8	-177.4	-54.2	174.1	0	0	0	113	K73 E79	K73-L77 HydrophobicContact CB-CD1 4.39Å; K73-L77 HydrophobicContact CG-CD1 3.98Å; K73-L77 CarbonylContact O-C 3.6Å; K73-L77 WeakPolarHBondContact O-CA 3.25Å; K73-L77 VanDerWaalsContact O-CB 3.26Å; K73-L77 WeakPolarHBondContact O-CB 2.92Å; K73-L77 PolarHBondContact O-N 3.46Å; K73-L77 VanDerWaalsContact O-N 3.11Å; L77-E79 PolarHBondContact O-N 2.89Å
78	G	49.5	Very low	58.9	Low	56 Å²	56	72.3 Å²	72.3	58%	0.577	42%	0.42	S	S	*	.			trans	62.6	21.2	-176	0	0	0	0	0	113.3	K73 R74 P80	K73-G78 PolarHBondContact O-N 2.8Å; R74-G78 WeakPolarHBondContact O-CA 3.04Å; R74-G78 PolarHBondContact O-N 3.33Å; G78-P80 WeakPolarHBondContact O-CD 3.48Å
79	E	51.2	Low	59.3	Low	71 Å²	71	64.1 Å²	64.1	33%	0.332	38%	0.377	S	S	.	.			trans	-62.4	122.5	179	-90	-173.2	-178.2	0	0	109.6	K73 L77	K73-E79 WeakPolarHBondContact CD-OE2 3.25Å; K73-E79 PolarHBondContact O-N 3.41Å; L77-E79 PolarHBondContact O-N 2.89Å
80	P	52.4	Low	60	Low	74 Å²	74	66.5 Å²	66.5	48%	0.481	39%	0.394	S	S	.	.			trans	-64.6	151.3	-178.9	24.8	-32	0	0	0	110.7	A48 G78 Q82	A48-P80 HydrophobicContact CB-CB 4.42Å; G78-P80 WeakPolarHBondContact O-CD 3.48Å; P80-Q82 PolarHBondContact O-N 2.93Å
81	V	58.8	Low	61	Low	46 Å²	46	70.6 Å²	70.6	28%	0.279	40%	0.403	S	S	.	.			trans	-61.8	115	173.9	177.6	0	0	0	0	108.5	K66 Y83	K66-V81 HydrophobicContact CD-CG1 4.01Å; K66-V81 HydrophobicContact CG-CG1 3.91Å; V81-Y83 HydrophobicContact CB-CE2 4.26Å; V81-Y83 HydrophobicContact CG1-CD2 4.37Å; V81-Y83 HydrophobicContact CG1-CE1 4.43Å; V81-Y83 HydrophobicContact CG1-CE2 3.68Å
82	Q	65.7	Low	61.9	Low	84 Å²	84	66.5 Å²	66.5	39%	0.393	38%	0.378	S	S	.	.			trans	-90.8	142	176.8	-65.7	-170.2	-6.9	0	0	110.5	R67 P80	R67-Q82 HydrophobicContact CB-CB 4.26Å; R67-Q82 PolarHBondContact N-O 3.12Å; P80-Q82 PolarHBondContact O-N 2.93Å
83	Y	70.9	Confident	63.3	Low	30 Å²	30	64.6 Å²	64.6	12%	0.118	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.7	172.2	-61.5	-94.4	0	0	0	108	I47 Y58 V64 V65 K66 V81 Y198 L232	I47-Y83 HydrophobicContact CB-CD2 4.34Å; I47-Y83 HydrophobicContact CB-CE2 4.36Å; I47-Y83 HydrophobicContact CD1-CD2 3.92Å; I47-Y83 HydrophobicContact CD1-CE2 4.08Å; I47-Y83 HydrophobicContact CD1-CG 4.31Å; I47-Y83 HydrophobicContact CG1-CD2 4.13Å; I47-Y83 HydrophobicContact CG1-CE2 3.91Å; I47-Y83 HydrophobicContact CG2-CD2 3.28Å; I47-Y83 HydrophobicContact CG2-CE2 3.6Å; I47-Y83 HydrophobicContact CG2-CG 4.36Å; Y58-Y83 PolarHBondContact OH-O 2.93Å; V64-Y83 HydrophobicContact CG2-CD1 3.87Å; V64-Y83 HydrophobicContact CG2-CG 4.24Å; V65-Y83 CarbonylContact O-C 3.56Å; V65-Y83 WeakPolarHBondContact O-CA 3.36Å; K66-Y83 HydrophobicContact CB-CD1 4.29Å; K66-Y83 HydrophobicContact CB-CE1 4.22Å; V81-Y83 HydrophobicContact CB-CE2 4.26Å; V81-Y83 HydrophobicContact CG1-CD2 4.37Å; V81-Y83 HydrophobicContact CG1-CE1 4.43Å; V81-Y83 HydrophobicContact CG1-CE2 3.68Å; Y83-Y198 HydrophobicContact CD1-CD2 4.12Å; Y83-Y198 HydrophobicContact CD1-CG 4.42Å; Y83-Y198 HydrophobicContact CE1-CD1 4.4Å; Y83-Y198 AromaticContact CE1-CD2 3.88Å; Y83-Y198 HydrophobicContact CE1-CD2 3.88Å; Y83-Y198 HydrophobicContact CE1-CE2 4.07Å; Y83-Y198 HydrophobicContact CE1-CG 4.03Å; Y83-L232 HydrophobicContact CD1-CD1 3.76Å; Y83-L232 HydrophobicContact CD2-CD1 4.32Å; Y83-L232 HydrophobicContact CE1-CD1 3.2Å; Y83-L232 HydrophobicContact CE2-CD1 3.84Å; Y83-L232 HydrophobicContact CG-CD1 4.27Å; Y83-L232 WeakPolarHBondContact OH-CD1 3.3Å
84	Q	72.1	Confident	64.4	Low	57 Å²	57	64.6 Å²	64.6	27%	0.266	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.5	173.9	176.3	168.7	-21.4	0	0	107.8	V64 V65 R67 A86	V64-Q84 CarbonylContact C-O 3.54Å; V64-Q84 VanDerWaalsContact CA-O 3.28Å; V64-Q84 WeakPolarHBondContact CA-O 3.18Å; V64-Q84 WeakPolarHBondContact CB-O 3.19Å; V65-Q84 HydrophobicContact CG2-CB 4.47Å; V65-Q84 PolarHBondContact N-O 3.3Å; V65-Q84 PolarHBondContact O-N 3.09Å; R67-Q84 HydrophobicContact CG-CB 4.02Å; Q84-A86 PolarHBondContact O-N 3.05Å
85	P	72.6	Confident	65.2	Low	45 Å²	45	66.5 Å²	66.5	29%	0.292	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	129.2	175.3	26.9	-32.2	0	0	0	109.7	F57 Y58	F57-P85 HydrophobicContact CB-CB 3.75Å; F57-P85 HydrophobicContact CB-CG 3.87Å; F57-P85 HydrophobicContact CG-CG 4.4Å; Y58-P85 WeakPolarHBondContact OH-CD 3.25Å
86	A	72.9	Confident	66.7	Low	14 Å²	14	62.9 Å²	62.9	12%	0.116	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-27.1	172.4	0	0	0	0	0	111.9	G63 V65 Q84 L92 L183 I186	G63-A86 WeakPolarHBondContact O-CA 3.32Å; G63-A86 VanDerWaalsContact O-CB 3.32Å; G63-A86 WeakPolarHBondContact O-CB 3.4Å; G63-A86 PolarHBondContact O-N 2.79Å; V65-A86 HydrophobicContact CG2-CB 4.22Å; Q84-A86 PolarHBondContact O-N 3.05Å; A86-L92 HydrophobicContact CB-CD1 3.91Å; A86-L92 HydrophobicContact CB-CD2 4.41Å; A86-L183 HydrophobicContact CB-CD2 4.33Å; A86-I186 HydrophobicContact CB-CG2 3.94Å; A86-I186 WeakPolarHBondContact O-CD1 3.46Å
87	G	70.3	Confident	67.9	Low	28 Å²	28	59.1 Å²	59.1	29%	0.289	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	135.7	-175.6	176.3	0	0	0	0	0	112.3	A62 G63	A62-G87 CarbonylContact C-O 3.54Å; A62-G87 WeakPolarHBondContact CA-O 3.44Å; G63-G87 PolarHBondContact N-O 2.85Å; G63-G87 PolarHBondContact O-N 3.07Å
88	E	71.9	Confident	69	Low	73 Å²	73	59.4 Å²	59.4	34%	0.341	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	133	173.4	-70.3	174.1	172.7	0	0	109.2	K59 S90 K91 L92	K59-E88 IonicContact NZ-OE1 3.22Å; K59-E88 PolarHBondContact NZ-OE1 3.46Å; E88-S90 PolarHBondContact O-N 2.83Å; E88-S90 VanDerWaalsContact O-N 3.13Å; E88-K91 HydrophobicContact CB-CG 4.45Å; E88-K91 WeakPolarHBondContact O-CB 3.19Å; E88-K91 PolarHBondContact O-N 2.89Å; E88-K91 IonicContact OE2-NZ 3.98Å; E88-L92 PolarHBondContact O-N 3.14Å
89	L	71.2	Confident	70.1	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.016	33%	0.331	C	S	.	.	H	α-helix	trans	-53.3	-37.4	-177	176.3	67.2	0	0	0	112	H61 K91 L92 I93 L104 F171 I199	H61-L89 HydrophobicContact CB-CB 4.43Å; H61-L89 HydrophobicContact CB-CD2 4.28Å; H61-L89 WeakPolarHBondContact O-CB 3.44Å; H61-L89 PolarHBondContact O-N 2.82Å; H61-L89 VanDerWaalsContact O-N 3.09Å; L89-K91 PolarHBondContact O-N 2.88Å; L89-K91 VanDerWaalsContact O-N 3.14Å; L89-L92 PolarHBondContact O-N 3.09Å; L89-L92 VanDerWaalsContact O-N 3.08Å; L89-I93 HydrophobicContact CD1-CD1 3.73Å; L89-I93 HydrophobicContact CD1-CG1 3.99Å; L89-I93 HydrophobicContact CD2-CD1 4.19Å; L89-I93 HydrophobicContact CG-CD1 3.46Å; L89-I93 VanDerWaalsContact CG-CD1 3.46Å; L89-I93 HydrophobicContact CG-CG1 4.21Å; L89-I93 VanDerWaalsContact O-CD1 3.3Å; L89-I93 WeakPolarHBondContact O-CD1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.13Å; L89-I93 VanDerWaalsContact O-N 3.12Å; L89-L104 HydrophobicContact CD2-CD1 4.41Å; L89-F171 HydrophobicContact CD2-CE2 3.92Å; L89-F171 HydrophobicContact CD2-CZ 3.91Å; L89-I199 HydrophobicContact CD1-CD1 4.01Å; L89-I199 HydrophobicContact CD1-CG1 4.4Å; L89-I199 HydrophobicContact CD2-CD1 4.01Å; L89-I199 HydrophobicContact CD2-CG2 4.33Å
90	S	71.2	Confident	71	Confident	74 Å²	74	58.5 Å²	58.5	52%	0.517	32%	0.315	S	S	.	.	H	α-helix	trans	-59	-23.3	175.6	55.1	0	0	0	0	115	E88	E88-S90 PolarHBondContact O-N 2.83Å; E88-S90 VanDerWaalsContact O-N 3.13Å
91	K	74	Confident	71.9	Confident	150 Å²	150	59.2 Å²	59.2	65%	0.652	31%	0.311	S	S	*	.	H	α-helix	trans	-92	-22.1	177.4	-62.7	-177.3	-177.8	178.1	0	113	E88 L89	E88-K91 HydrophobicContact CB-CG 4.45Å; E88-K91 WeakPolarHBondContact O-CB 3.19Å; E88-K91 PolarHBondContact O-N 2.89Å; E88-K91 IonicContact OE2-NZ 3.98Å; L89-K91 PolarHBondContact O-N 2.88Å; L89-K91 VanDerWaalsContact O-N 3.14Å
92	L	71.7	Confident	72.5	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-83.9	-26.5	178.6	-63.3	170.2	0	0	0	111.1	A86 E88 L89 V178 N179 L182 L183 I186	A86-L92 HydrophobicContact CB-CD1 3.91Å; A86-L92 HydrophobicContact CB-CD2 4.41Å; E88-L92 PolarHBondContact O-N 3.14Å; L89-L92 PolarHBondContact O-N 3.09Å; L89-L92 VanDerWaalsContact O-N 3.08Å; L92-V178 HydrophobicContact CB-CG1 3.87Å; L92-V178 WeakPolarHBondContact O-CG1 3.4Å; L92-N179 PolarHBondContact O-N 3.25Å; L92-L182 HydrophobicContact CD2-CD2 4.33Å; L92-L183 HydrophobicContact CD1-CD2 4.48Å; L92-L183 HydrophobicContact CD2-CD2 4.25Å; L92-L183 HydrophobicContact CD2-CG 4.36Å; L92-I186 HydrophobicContact CD2-CD1 3.9Å
93	I	74.7	Confident	72.6	Confident	23 Å²	23	58.5 Å²	58.5	12%	0.118	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	128.6	-176.7	-65.5	161.9	0	0	0	111.6	L89 E95 M96 L176 R177 V178	L89-I93 HydrophobicContact CD1-CD1 3.73Å; L89-I93 HydrophobicContact CD1-CG1 3.99Å; L89-I93 HydrophobicContact CD2-CD1 4.19Å; L89-I93 HydrophobicContact CG-CD1 3.46Å; L89-I93 VanDerWaalsContact CG-CD1 3.46Å; L89-I93 HydrophobicContact CG-CG1 4.21Å; L89-I93 VanDerWaalsContact O-CD1 3.3Å; L89-I93 WeakPolarHBondContact O-CD1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.13Å; L89-I93 VanDerWaalsContact O-N 3.12Å; I93-E95 WeakPolarHBondContact CG2-O 3.19Å; I93-M96 HydrophobicContact CD1-CG 4.43Å; I93-M96 HydrophobicContact CD1-SD 3.5Å; I93-M96 VanDerWaalsContact CD1-SD 3.5Å; I93-M96 HydrophobicContact CG2-CB 3.84Å; I93-L176 HydrophobicContact CD1-CD2 3.27Å; I93-L176 HydrophobicContact CG1-CD2 3.94Å; I93-L176 HydrophobicContact CG2-CD2 4.46Å; I93-R177 CarbonylContact C-O 3.51Å; I93-R177 WeakPolarHBondContact CG2-O 3.2Å; I93-V178 HydrophobicContact CG1-CG1 4.47Å
94	V	76.8	Confident	72.3	Confident	97 Å²	97	58.6 Å²	58.6	59%	0.588	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	-41.8	168.7	179.3	0	0	0	0	110.3	R177 N179	V94-R177 PolarHBondContact N-O 3.43Å; V94-N179 HydrophobicContact CG2-CB 3.6Å
95	E	72.6	Confident	72.1	Confident	120 Å²	120	58.5 Å²	58.5	56%	0.561	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.8	127.7	-174.8	-137.9	173	-173.9	0	0	110.7	I93 R177	I93-E95 WeakPolarHBondContact CG2-O 3.19Å; E95-R177 HydrophobicContact CB-CB 3.85Å; E95-R177 PolarHBondContact N-O 3.46Å; E95-R177 VanDerWaalsContact N-O 3.1Å; E95-R177 PolarHBondContact O-N 2.85Å; E95-R177 IonicContact OE2-NH1 3.97Å
96	M	76.6	Confident	71.6	Confident	39 Å²	39	59.3 Å²	59.3	19%	0.192	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.3	-177.9	-162.5	154.5	66.3	0	0	109.6	I93 C100 K101 L104 L176	I93-M96 HydrophobicContact CD1-CG 4.43Å; I93-M96 HydrophobicContact CD1-SD 3.5Å; I93-M96 VanDerWaalsContact CD1-SD 3.5Å; I93-M96 HydrophobicContact CG2-CB 3.84Å; M96-C100 HydrophobicContact CG-CB 3.6Å; M96-C100 VanDerWaalsContact CG-SG 3.59Å; M96-C100 HydrophobicContact SD-CB 4.45Å; M96-K101 HydrophobicContact CB-CG 4.23Å; M96-K101 HydrophobicContact CE-CB 4.14Å; M96-K101 HydrophobicContact CE-CG 3.32Å; M96-K101 HydrophobicContact CG-CG 4.07Å; M96-K101 WeakPolarHBondContact O-CE 3.39Å; M96-K101 HydrophobicContact SD-CG 4.47Å; M96-L104 HydrophobicContact CE-CD1 3.71Å; M96-L104 HydrophobicContact SD-CD1 3.39Å; M96-L104 WeakPolarHBondContact SD-CD1 3.23Å; M96-L176 HydrophobicContact CG-CD2 3.85Å; M96-L176 HydrophobicContact SD-CD2 3.93Å
97	S	76.4	Confident	70.7	Confident	35 Å²	35	58.8 Å²	58.8	25%	0.245	31%	0.314	C	S	.	.			trans	-61.1	150.9	175.5	82.1	0	0	0	0	110.6	I99 C100 K101 D175	S97-I99 PolarHBondContact O-N 3Å; S97-C100 WeakPolarHBondContact O-CA 3.47Å; S97-C100 VanDerWaalsContact O-CB 3.28Å; S97-C100 WeakPolarHBondContact O-CB 3.41Å; S97-C100 PolarHBondContact O-N 3.03Å; S97-C100 WeakPolarHBondContact OG-CB 2.9Å; S97-C100 PolarHBondContact OG-N 3.05Å; S97-C100 VanDerWaalsContact OG-N 3.11Å; S97-K101 PolarHBondContact O-N 3.22Å; S97-D175 PolarHBondContact N-O 3.42Å; S97-D175 PolarHBondContact OG-OD1 2.96Å
98	E	75.6	Confident	69.9	Low	124 Å²	124	60.3 Å²	60.3	58%	0.579	32%	0.324	S	S	*	.	H	α-helix	trans	-60.9	-32.7	176.3	-75.6	-56.2	135.7	0	0	112.2	C100 K101 T102	E98-C100 VanDerWaalsContact C-N 3.3Å; E98-C100 PolarHBondContact O-N 2.79Å; E98-K101 PolarHBondContact O-N 2.98Å; E98-K101 WeakPolarHBondContact OE1-CD 3.47Å; E98-K101 IonicContact OE1-NZ 3.87Å; E98-K101 PolarHBondContact OE1-NZ 2.82Å; E98-T102 WeakPolarHBondContact O-CB 3.3Å; E98-T102 PolarHBondContact O-N 2.8Å; E98-T102 PolarHBondContact O-OG1 3.06Å
99	I	72.4	Confident	69	Low	109 Å²	109	63.6 Å²	63.6	56%	0.559	33%	0.333	S	S	*	.	H	α-helix	trans	-60.7	-45.2	173.3	-64.4	172.4	0	0	0	109.8	S97 T102 K103	S97-I99 PolarHBondContact O-N 3Å; I99-T102 WeakPolarHBondContact O-CB 3.43Å; I99-T102 PolarHBondContact O-N 2.65Å; I99-K103 HydrophobicContact CG2-CD 4.3Å; I99-K103 WeakPolarHBondContact O-CG 3.04Å; I99-K103 PolarHBondContact O-N 3.33Å
100	C	71	Confident	67.8	Low	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-66.7	-43.2	-179.3	-165.5	0	0	0	0	112.6	M96 S97 E98 T102 K103 L104 F171 D175 L176	M96-C100 HydrophobicContact CG-CB 3.6Å; M96-C100 VanDerWaalsContact CG-SG 3.59Å; M96-C100 HydrophobicContact SD-CB 4.45Å; S97-C100 WeakPolarHBondContact O-CA 3.47Å; S97-C100 VanDerWaalsContact O-CB 3.28Å; S97-C100 WeakPolarHBondContact O-CB 3.41Å; S97-C100 PolarHBondContact O-N 3.03Å; S97-C100 WeakPolarHBondContact OG-CB 2.9Å; S97-C100 PolarHBondContact OG-N 3.05Å; S97-C100 VanDerWaalsContact OG-N 3.11Å; E98-C100 VanDerWaalsContact C-N 3.3Å; E98-C100 PolarHBondContact O-N 2.79Å; C100-T102 VanDerWaalsContact C-N 3.31Å; C100-T102 PolarHBondContact O-N 2.75Å; C100-K103 PolarHBondContact O-N 3.46Å; C100-L104 PolarHBondContact O-N 3.3Å; C100-F171 WeakPolarHBondContact SG-CD1 3.2Å; C100-F171 WeakPolarHBondContact SG-CE1 3.36Å; C100-D175 HydrophobicContact CB-CB 3.84Å; C100-L176 WeakPolarHBondContact SG-CD2 3.34Å
101	K	70.4	Confident	66.5	Low	89 Å²	89	65.3 Å²	65.3	39%	0.387	34%	0.338	S	S	.	.	H	α-helix	trans	-56.9	-44.6	169.4	-70.8	171.8	-170.1	173.2	0	111.9	M96 S97 E98 L104 S105	M96-K101 HydrophobicContact CB-CG 4.23Å; M96-K101 HydrophobicContact CE-CB 4.14Å; M96-K101 HydrophobicContact CE-CG 3.32Å; M96-K101 HydrophobicContact CG-CG 4.07Å; M96-K101 WeakPolarHBondContact O-CE 3.39Å; M96-K101 HydrophobicContact SD-CG 4.47Å; S97-K101 PolarHBondContact O-N 3.22Å; E98-K101 PolarHBondContact O-N 2.98Å; E98-K101 WeakPolarHBondContact OE1-CD 3.47Å; E98-K101 IonicContact OE1-NZ 3.87Å; E98-K101 PolarHBondContact OE1-NZ 2.82Å; K101-L104 PolarHBondContact O-N 3.34Å; K101-S105 WeakPolarHBondContact O-CB 3.09Å; K101-S105 PolarHBondContact O-N 2.95Å
102	T	71.7	Confident	64.7	Low	69 Å²	69	61.7 Å²	61.7	42%	0.423	34%	0.335	S	S	.	.	H	α-helix	trans	-65.7	-43.5	179.9	-56.5	0	0	0	0	111.3	E98 I99 C100 S105 N106	E98-T102 WeakPolarHBondContact O-CB 3.3Å; E98-T102 PolarHBondContact O-N 2.8Å; E98-T102 PolarHBondContact O-OG1 3.06Å; I99-T102 WeakPolarHBondContact O-CB 3.43Å; I99-T102 PolarHBondContact O-N 2.65Å; C100-T102 VanDerWaalsContact C-N 3.31Å; C100-T102 PolarHBondContact O-N 2.75Å; T102-S105 PolarHBondContact O-N 3.13Å; T102-N106 VanDerWaalsContact O-CB 3.3Å; T102-N106 WeakPolarHBondContact O-CB 3.19Å; T102-N106 PolarHBondContact O-N 3.1Å; T102-N106 PolarHBondContact O-ND2 3.02Å
103	K	67.5	Low	62.9	Low	46 Å²	46	63.2 Å²	63.2	20%	0.2	35%	0.349	C	S	.	.	H	α-helix	trans	-56.2	-53.3	173.5	-75.7	173.7	-178.8	175.6	0	110.9	I99 C100 S105 N106 V107 K170 D175	I99-K103 HydrophobicContact CG2-CD 4.3Å; I99-K103 WeakPolarHBondContact O-CG 3.04Å; I99-K103 PolarHBondContact O-N 3.33Å; C100-K103 PolarHBondContact O-N 3.46Å; K103-S105 PolarHBondContact O-N 3.31Å; K103-N106 PolarHBondContact O-N 3.01Å; K103-V107 WeakPolarHBondContact O-CB 3.26Å; K103-V107 WeakPolarHBondContact O-CG2 3.26Å; K103-V107 PolarHBondContact O-N 3.36Å; K103-K170 PolarHBondContact NZ-O 3.34Å; K103-D175 IonicContact NZ-OD2 2.72Å; K103-D175 PolarHBondContact NZ-OD2 3.33Å
104	L	65.6	Low	61	Low	31 Å²	31	65 Å²	65	16%	0.162	36%	0.358	C	S	.	.	H	α-helix	trans	-56.8	-46.9	177.8	-93.8	154.2	0	0	0	112.4	H61 L89 M96 C100 K101 V107 A108 F171	H61-L104 HydrophobicContact CB-CD2 3.75Å; H61-L104 VanDerWaalsContact CD2-CD2 3.44Å; H61-L104 WeakPolarHBondContact CD2-CD2 3.19Å; L89-L104 HydrophobicContact CD2-CD1 4.41Å; M96-L104 HydrophobicContact CE-CD1 3.71Å; M96-L104 HydrophobicContact SD-CD1 3.39Å; M96-L104 WeakPolarHBondContact SD-CD1 3.23Å; C100-L104 PolarHBondContact O-N 3.3Å; K101-L104 PolarHBondContact O-N 3.34Å; L104-V107 PolarHBondContact O-N 2.79Å; L104-A108 WeakPolarHBondContact O-CB 3.33Å; L104-A108 PolarHBondContact O-N 3.07Å; L104-F171 HydrophobicContact CD1-CE1 4.08Å; L104-F171 HydrophobicContact CD1-CZ 4.22Å; L104-F171 HydrophobicContact CD2-CZ 4.38Å; L104-F171 HydrophobicContact CG-CE1 4.07Å; L104-F171 HydrophobicContact CG-CZ 3.98Å
105	S	66.7	Low	58.9	Low	56 Å²	56	64 Å²	64	39%	0.392	35%	0.349	S	S	.	.	H	α-helix	trans	-65.4	-43.2	179.7	-171.9	0	0	0	0	112.2	K101 T102 K103 V107 A108 R109	K101-S105 WeakPolarHBondContact O-CB 3.09Å; K101-S105 PolarHBondContact O-N 2.95Å; T102-S105 PolarHBondContact O-N 3.13Å; K103-S105 PolarHBondContact O-N 3.31Å; S105-V107 VanDerWaalsContact C-N 3.35Å; S105-V107 PolarHBondContact O-N 3.22Å; S105-A108 PolarHBondContact O-N 3.2Å; S105-R109 VanDerWaalsContact O-CB 3.3Å; S105-R109 WeakPolarHBondContact O-CB 3.34Å; S105-R109 PolarHBondContact O-N 3.33Å; S105-R109 PolarHBondContact OG-NH2 2.63Å; S105-R109 VanDerWaalsContact OG-NH2 3.08Å
106	N	62.4	Low	56.9	Low	62 Å²	62	62.3 Å²	62.3	33%	0.332	35%	0.351	S	S	.	.	H	α-helix	trans	-64.6	-41.1	178.9	-75.6	-15.6	0	0	0	111.5	T102 K103 R109 N110	T102-N106 VanDerWaalsContact O-CB 3.3Å; T102-N106 WeakPolarHBondContact O-CB 3.19Å; T102-N106 PolarHBondContact O-N 3.1Å; T102-N106 PolarHBondContact O-ND2 3.02Å; K103-N106 PolarHBondContact O-N 3.01Å; N106-R109 PolarHBondContact O-N 3.38Å; N106-R109 PolarHBondContact OD1-NH1 3.36Å; N106-N110 VanDerWaalsContact O-CB 3.27Å; N106-N110 WeakPolarHBondContact O-CB 3.29Å; N106-N110 PolarHBondContact O-N 2.92Å; N106-N110 PolarHBondContact O-ND2 3.46Å
107	V	53.8	Low	54.5	Low	3 Å²	3	66.4 Å²	66.4	2%	0.018	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-49.1	175.1	168.7	0	0	0	0	110.8	L60 H61 K103 L104 S105 R109 N110 T111 L165 A168	L60-V107 HydrophobicContact CD2-CG1 3.43Å; L60-V107 VanDerWaalsContact CD2-CG1 3.43Å; L60-V107 HydrophobicContact CG-CG1 4.39Å; H61-V107 WeakPolarHBondContact NE2-CG1 3.37Å; K103-V107 WeakPolarHBondContact O-CB 3.26Å; K103-V107 WeakPolarHBondContact O-CG2 3.26Å; K103-V107 PolarHBondContact O-N 3.36Å; L104-V107 PolarHBondContact O-N 2.79Å; S105-V107 VanDerWaalsContact C-N 3.35Å; S105-V107 PolarHBondContact O-N 3.22Å; V107-R109 VanDerWaalsContact C-N 3.31Å; V107-R109 PolarHBondContact O-N 3.03Å; V107-N110 PolarHBondContact O-N 3.38Å; V107-T111 WeakPolarHBondContact O-CB 3.49Å; V107-T111 PolarHBondContact O-N 2.76Å; V107-T111 PolarHBondContact O-OG1 3.29Å; V107-L165 HydrophobicContact CB-CD2 4.42Å; V107-L165 HydrophobicContact CG1-CD2 3.55Å; V107-L165 HydrophobicContact CG2-CD2 4.32Å; V107-A168 HydrophobicContact CG2-CB 3.61Å
108	A	53.6	Low	52.4	Low	60 Å²	60	67.3 Å²	67.3	50%	0.496	37%	0.369	S	S	.	.	H	α-helix	trans	-57.6	-43.9	177.2	0	0	0	0	0	112.2	L104 S105 A112	L104-A108 WeakPolarHBondContact O-CB 3.33Å; L104-A108 PolarHBondContact O-N 3.07Å; S105-A108 PolarHBondContact O-N 3.2Å; A108-A112 PolarHBondContact O-N 3.42Å
109	R	52.8	Low	50.3	Low	141 Å²	141	67.8 Å²	67.8	53%	0.532	37%	0.366	S	S	.	.	H	α-helix	trans	-66.8	-45.7	-179.6	-160.4	-175.2	-57	122.3	5	112.2	S105 N106 V107 T111 A112 A113	S105-R109 VanDerWaalsContact O-CB 3.3Å; S105-R109 WeakPolarHBondContact O-CB 3.34Å; S105-R109 PolarHBondContact O-N 3.33Å; S105-R109 PolarHBondContact OG-NH2 2.63Å; S105-R109 VanDerWaalsContact OG-NH2 3.08Å; N106-R109 PolarHBondContact O-N 3.38Å; N106-R109 PolarHBondContact OD1-NH1 3.36Å; V107-R109 VanDerWaalsContact C-N 3.31Å; V107-R109 PolarHBondContact O-N 3.03Å; R109-T111 VanDerWaalsContact C-N 3.32Å; R109-T111 PolarHBondContact O-N 3.04Å; R109-A112 PolarHBondContact O-N 3.11Å; R109-A113 VanDerWaalsContact O-CB 3.32Å; R109-A113 WeakPolarHBondContact O-CB 3.48Å; R109-A113 PolarHBondContact O-N 2.98Å
110	N	45.8	Very low	48.1	Very low	86 Å²	86	70 Å²	70	46%	0.46	37%	0.374	S	S	.	.	H	α-helix	trans	-68	-33.3	-179.2	-72.6	-17	0	0	0	112.2	N106 V107 N114	N106-N110 VanDerWaalsContact O-CB 3.27Å; N106-N110 WeakPolarHBondContact O-CB 3.29Å; N106-N110 PolarHBondContact O-N 2.92Å; N106-N110 PolarHBondContact O-ND2 3.46Å; V107-N110 PolarHBondContact O-N 3.38Å; N110-N114 VanDerWaalsContact O-CB 3.26Å; N110-N114 WeakPolarHBondContact O-CB 3.35Å; N110-N114 PolarHBondContact O-N 2.61Å; N110-N114 VanDerWaalsContact O-N 3.1Å; N110-N114 PolarHBondContact O-ND2 2.95Å
111	T	45.1	Very low	46.1	Very low	28 Å²	28	73.4 Å²	73.4	17%	0.172	40%	0.402	C	S	.	.	H	α-helix	trans	-68.4	-47.3	177.9	-47.2	0	0	0	0	110.8	V107 R109 I115	V107-T111 WeakPolarHBondContact O-CB 3.49Å; V107-T111 PolarHBondContact O-N 2.76Å; V107-T111 PolarHBondContact O-OG1 3.29Å; R109-T111 VanDerWaalsContact C-N 3.32Å; R109-T111 PolarHBondContact O-N 3.04Å; T111-I115 HydrophobicContact CG2-CD1 3.75Å; T111-I115 WeakPolarHBondContact O-CB 3.21Å; T111-I115 VanDerWaalsContact O-CD1 3.31Å; T111-I115 WeakPolarHBondContact O-CD1 3.39Å; T111-I115 WeakPolarHBondContact O-CG1 3.23Å; T111-I115 PolarHBondContact O-N 2.72Å
112	A	36.1	Very low	44.1	Very low	73 Å²	73	72.1 Å²	72.1	60%	0.603	41%	0.407	S	S	*	.	H	α-helix	trans	-67.8	-41.7	179.1	0	0	0	0	0	113.1	A108 R109	A108-A112 PolarHBondContact O-N 3.42Å; R109-A112 PolarHBondContact O-N 3.11Å
113	A	33	Very low	41.9	Very low	37 Å²	37	75.8 Å²	75.8	31%	0.306	42%	0.424	S	S	.	.	H	α-helix	trans	-70	-46.6	-177.6	0	0	0	0	0	112.4	R109 S116	R109-A113 VanDerWaalsContact O-CB 3.32Å; R109-A113 WeakPolarHBondContact O-CB 3.48Å; R109-A113 PolarHBondContact O-N 2.98Å; A113-S116 PolarHBondContact O-N 2.74Å; A113-S116 PolarHBondContact O-OG 3.31Å
114	N	34.5	Very low	40	Very low	59 Å²	59	77 Å²	77	32%	0.316	44%	0.438	S	S	.	.	H	α-helix	trans	-79.3	-25.8	-172.6	-67.8	-24	0	0	0	113.5	N110 S116	N110-N114 VanDerWaalsContact O-CB 3.26Å; N110-N114 WeakPolarHBondContact O-CB 3.35Å; N110-N114 PolarHBondContact O-N 2.61Å; N110-N114 VanDerWaalsContact O-N 3.1Å; N110-N114 PolarHBondContact O-ND2 2.95Å; N114-S116 PolarHBondContact O-N 3.17Å
115	I	34.5	Very low	38.1	Very low	77 Å²	77	82.2 Å²	82.2	40%	0.395	47%	0.466	S	S	.	.	H	α-helix	trans	-66.7	-27.4	171.8	-67.9	171.4	0	0	0	110.4	T111 W119	T111-I115 HydrophobicContact CG2-CD1 3.75Å; T111-I115 WeakPolarHBondContact O-CB 3.21Å; T111-I115 VanDerWaalsContact O-CD1 3.31Å; T111-I115 WeakPolarHBondContact O-CD1 3.39Å; T111-I115 WeakPolarHBondContact O-CG1 3.23Å; T111-I115 PolarHBondContact O-N 2.72Å; I115-W119 PolarHBondContact O-NE1 2.78Å
116	S	29.3	Very low	36.2	Very low	85 Å²	85	88.2 Å²	88.2	59%	0.594	49%	0.485	S	S	*	.	H	α-helix	trans	-83.6	-23.6	-180	70.2	0	0	0	0	114.7	A113 N114	A113-S116 PolarHBondContact O-N 2.74Å; A113-S116 PolarHBondContact O-OG 3.31Å; N114-S116 PolarHBondContact O-N 3.17Å
117	Q	27.4	Very low	34.5	Very low	124 Å²	124	97 Å²	97	58%	0.579	51%	0.514	S	S	*	.	H	α-helix	trans	-102	-4.6	-162.3	-72.3	-175.3	-10.4	0	0	116.6
118	H	32.2	Very low	33.3	Very low	54 Å²	54	100 Å²	100	25%	0.25	55%	0.545	C	S	.	.	S	Bend	trans	-117.5	9.1	-176	-68.1	-36.5	0	0	0	115.6	H120 I139 N141	H118-H120 PolarHBondContact O-N 2.67Å; H118-I139 PolarHBondContact CD2-O 3.12Å; H118-N141 PolarHBondContact NE2-ND2 2.93Å
119	W	30.2	Very low	32	Very low	135 Å²	135	100.8 Å²	100.8	51%	0.511	56%	0.559	S	S	.	*			trans	-89.2	76.8	172.3	-53.4	91.8	0	0	0	110.2	I115 L138	I115-W119 PolarHBondContact O-NE1 2.78Å; W119-L138 HydrophobicContact CE3-CD1 3.97Å; W119-L138 HydrophobicContact CH2-CD1 4.17Å; W119-L138 HydrophobicContact CH2-CD2 3.79Å; W119-L138 HydrophobicContact CH2-CG 4.47Å; W119-L138 HydrophobicContact CZ2-CD2 4.12Å; W119-L138 HydrophobicContact CZ3-CD1 3.64Å; W119-L138 HydrophobicContact CZ3-CD2 4.13Å; W119-L138 HydrophobicContact CZ3-CG 4.35Å
120	H	27.3	Very low	30.7	Very low	156 Å²	156	102.6 Å²	102.6	72%	0.722	57%	0.574	S	S	*	*			trans	-87.9	105.1	165.5	-76.8	-65.7	0	0	0	109.4	H118 A122	H118-H120 PolarHBondContact O-N 2.67Å; H120-A122 PolarHBondContact O-N 2.76Å
121	A	29.2	Very low	29.9	Very low	71 Å²	71	104.3 Å²	104.3	59%	0.587	59%	0.587	S	S	*	*			trans	-73.2	103.2	161.1	0	0	0	0	0	108.2	L123	A121-L123 PolarHBondContact O-N 2.87Å
122	A	26.6	Very low	29	Very low	61 Å²	61	111 Å²	111	50%	0.504	61%	0.614	S	S	.	*			trans	-84.5	90.9	166.6	0	0	0	0	0	108.3	H120 S124 T134	H120-A122 PolarHBondContact O-N 2.76Å; A122-S124 PolarHBondContact O-N 3.33Å; A122-T134 VanDerWaalsContact O-CG2 3.3Å; A122-T134 WeakPolarHBondContact O-CG2 3.42Å
123	L	25.6	Very low	28.7	Very low	147 Å²	147	109.7 Å²	109.7	77%	0.77	61%	0.608	S	S	*	*			trans	-73.2	100.5	165.1	-82.4	158.4	0	0	0	107.9	A121 D125	A121-L123 PolarHBondContact O-N 2.87Å; L123-D125 VanDerWaalsContact C-N 3.31Å; L123-D125 PolarHBondContact O-N 3.28Å; L123-D125 VanDerWaalsContact O-N 3.12Å
124	S	28.3	Very low	28.4	Very low	72 Å²	72	110.7 Å²	110.7	50%	0.503	61%	0.61	S	S	.	*			trans	-78.2	84	166.8	163.6	0	0	0	0	108.7	A122	A122-S124 PolarHBondContact O-N 3.33Å
125	D	25.7	Very low	28.1	Very low	139 Å²	139	114.6 Å²	114.6	74%	0.743	63%	0.63	S	S	*	*			trans	-87.6	113.6	162.2	-171.1	8.9	0	0	0	108.9	L123	L123-D125 VanDerWaalsContact C-N 3.31Å; L123-D125 PolarHBondContact O-N 3.28Å; L123-D125 VanDerWaalsContact O-N 3.12Å
126	K	27.7	Very low	27.8	Very low	183 Å²	183	115.4 Å²	115.4	80%	0.796	63%	0.63	S	S	*	*			trans	-145.2	118.8	155	-72.9	-159.6	177.5	-177.1	0	110.8
127	R	26.8	Very low	27.7	Very low	246 Å²	246	118.7 Å²	118.7	93%	0.928	63%	0.634	S	S	*	*	S	Bend	trans	-50	132.8	156.3	-68.5	177.5	179.5	-167.9	-1.7	109.9
128	G	27.2	Very low	27.8	Very low	66 Å²	66	116.5 Å²	116.5	68%	0.68	63%	0.626	S	S	*	*	S	Bend	trans	108.7	122.4	178.4	0	0	0	0	0	111.5
129	G	26.4	Very low	27.6	Very low	77 Å²	77	117 Å²	117	79%	0.794	63%	0.629	S	S	*	*	S	Bend	trans	-49.7	155.5	-168.8	0	0	0	0	0	116.2
130	E	25.2	Very low	27.6	Very low	179 Å²	179	115 Å²	115	84%	0.836	64%	0.637	S	S	*	*			trans	88.5	70.7	-168.5	-58.1	-168.7	164.7	0	0	115.2	K132	E130-K132 PolarHBondContact O-N 3.04Å
131	T	30.4	Very low	27.6	Very low	121 Å²	121	111 Å²	111	74%	0.742	62%	0.62	S	S	*	*			trans	-72.6	106.4	168.8	-34.2	0	0	0	0	110.1
132	K	26.5	Very low	27.7	Very low	168 Å²	168	109.9 Å²	109.9	73%	0.73	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-75.1	130.9	167.5	-70.4	179.1	178.6	175.7	0	108.8	E130	E130-K132 PolarHBondContact O-N 3.04Å
133	G	28.1	Very low	27.8	Very low	46 Å²	46	111.1 Å²	111.1	47%	0.474	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-57.6	149.1	-173.3	0	0	0	0	0	114.5	I135	G133-I135 PolarHBondContact O-N 2.81Å
134	T	27.4	Very low	27.8	Very low	58 Å²	58	110.5 Å²	110.5	36%	0.356	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-77.5	116.9	175	-49.8	0	0	0	0	109.9	A122 F136	A122-T134 VanDerWaalsContact O-CG2 3.3Å; A122-T134 WeakPolarHBondContact O-CG2 3.42Å; T134-F136 HydrophobicContact CG2-CD2 4.02Å; T134-F136 HydrophobicContact CG2-CE1 4.31Å; T134-F136 HydrophobicContact CG2-CE2 3.48Å; T134-F136 VanDerWaalsContact CG2-CE2 3.48Å; T134-F136 HydrophobicContact CG2-CZ 3.65Å
135	I	28.3	Very low	27.6	Very low	141 Å²	141	118.7 Å²	118.7	72%	0.723	63%	0.627	S	S	*	*			trans	-93.7	112.7	171	-60.3	172.5	0	0	0	107.3	G133	G133-I135 PolarHBondContact O-N 2.81Å
136	F	28.2	Very low	27.5	Very low	94 Å²	94	118 Å²	118	41%	0.412	63%	0.63	S	S	.	*			trans	-86.2	119.3	162.7	-65.1	-85.3	0	0	0	107.6	T134 L208	T134-F136 HydrophobicContact CG2-CD2 4.02Å; T134-F136 HydrophobicContact CG2-CE1 4.31Å; T134-F136 HydrophobicContact CG2-CE2 3.48Å; T134-F136 VanDerWaalsContact CG2-CE2 3.48Å; T134-F136 HydrophobicContact CG2-CZ 3.65Å; F136-L208 HydrophobicContact CB-CD1 4.11Å; F136-L208 WeakPolarHBondContact O-CD1 3.3Å
137	K	27.7	Very low	27.3	Very low	155 Å²	155	118.1 Å²	118.1	67%	0.674	64%	0.636	S	S	*	*			trans	-104.8	94.1	174.6	-165.7	-173.8	-176.1	-172.7	0	108	I139	K137-I139 HydrophobicContact CD-CD1 3.75Å; K137-I139 HydrophobicContact CD-CG1 3.82Å; K137-I139 HydrophobicContact CG-CD1 4.27Å; K137-I139 HydrophobicContact CG-CG1 3.74Å; K137-I139 PolarHBondContact O-N 2.98Å
138	L	29.8	Very low	27.2	Very low	78 Å²	78	114.1 Å²	114.1	41%	0.408	63%	0.632	S	S	.	*			trans	-80.2	101.5	164.2	-106.2	98.2	0	0	0	108.4	W119 A206	W119-L138 HydrophobicContact CE3-CD1 3.97Å; W119-L138 HydrophobicContact CH2-CD1 4.17Å; W119-L138 HydrophobicContact CH2-CD2 3.79Å; W119-L138 HydrophobicContact CH2-CG 4.47Å; W119-L138 HydrophobicContact CZ2-CD2 4.12Å; W119-L138 HydrophobicContact CZ3-CD1 3.64Å; W119-L138 HydrophobicContact CZ3-CD2 4.13Å; W119-L138 HydrophobicContact CZ3-CG 4.35Å; L138-A206 HydrophobicContact CD2-CB 3.97Å
139	I	27.2	Very low	27	Very low	63 Å²	63	119.2 Å²	119.2	32%	0.323	64%	0.643	S	S	.	*			trans	-93	103.9	164	-47.5	179.8	0	0	0	106.2	H118 K137 N141	H118-I139 PolarHBondContact CD2-O 3.12Å; K137-I139 HydrophobicContact CD-CD1 3.75Å; K137-I139 HydrophobicContact CD-CG1 3.82Å; K137-I139 HydrophobicContact CG-CD1 4.27Å; K137-I139 HydrophobicContact CG-CG1 3.74Å; K137-I139 PolarHBondContact O-N 2.98Å; I139-N141 VanDerWaalsContact C-N 3.34Å; I139-N141 WeakPolarHBondContact CG2-OD1 3.38Å; I139-N141 PolarHBondContact O-N 3.21Å; I139-N141 VanDerWaalsContact O-N 3.16Å
140	S	30.1	Very low	26.7	Very low	95 Å²	95	127.2 Å²	127.2	66%	0.664	65%	0.649	S	S	*	*			trans	-72.7	100.4	155	178.5	0	0	0	0	106.2	Q142	S140-Q142 PolarHBondContact O-N 3.36Å; S140-Q142 VanDerWaalsContact O-N 3.09Å
141	N	28.2	Very low	26.5	Very low	71 Å²	71	123.8 Å²	123.8	38%	0.38	65%	0.651	S	S	.	*			trans	-70.2	104.6	179.6	-95.6	-29	0	0	0	109.8	H118 I139	H118-N141 PolarHBondContact NE2-ND2 2.93Å; I139-N141 VanDerWaalsContact C-N 3.34Å; I139-N141 WeakPolarHBondContact CG2-OD1 3.38Å; I139-N141 PolarHBondContact O-N 3.21Å; I139-N141 VanDerWaalsContact O-N 3.16Å
142	Q	31.1	Very low	26.1	Very low	48 Å²	48	121.7 Å²	121.7	22%	0.224	65%	0.646	C	S	.	*			trans	-126.6	122	150.3	-77	170.2	-17.4	0	0	107	S140 C163 E164 L165	S140-Q142 PolarHBondContact O-N 3.36Å; S140-Q142 VanDerWaalsContact O-N 3.09Å; Q142-C163 PolarHBondContact OE1-SG 3.45Å; Q142-E164 HydrophobicContact CB-CB 4.14Å; Q142-E164 HydrophobicContact CB-CG 4.07Å; Q142-E164 HydrophobicContact CG-CB 3.81Å; Q142-E164 HydrophobicContact CG-CG 4.27Å; Q142-L165 VanDerWaalsContact NE2-CB 3.28Å
143	T	27.5	Very low	26.1	Very low	87 Å²	87	120.7 Å²	120.7	53%	0.534	65%	0.654	S	S	.	*			trans	-87.2	153.7	-139.5	19.5	0	0	0	0	117.6
144	T	25.6	Very low	26	Very low	133 Å²	133	124.3 Å²	124.3	82%	0.816	67%	0.667	S	S	*	*			trans	77	87.6	150.8	40.2	0	0	0	0	122.7
145	R	24.1	Very low	25.8	Very low	244 Å²	244	130.6 Å²	130.6	92%	0.921	69%	0.692	S	S	*	*				179.4	142.1	117.8	-108.6	-176.7	177.2	-179.6	0.2	110.9
146	P	24.6	Very low	25.7	Very low	125 Å²	125	129.8 Å²	129.8	81%	0.812	69%	0.688	S	S	*	*			trans	-87.8	142.2	178.2	34.7	-30	0	0	0	111.4
147	M	24.1	Very low	25.5	Very low	186 Å²	186	133 Å²	133	92%	0.916	71%	0.705	S	S	*	*			trans	-139.6	145.7	160.9	-148.6	168.6	164.7	0	0	110.6
148	L	22.8	Very low	25.5	Very low	162 Å²	162	131.6 Å²	131.6	85%	0.848	70%	0.703	S	S	*	*			trans	-60.5	143.4	-152.2	-73.3	123.3	0	0	0	117.8
149	L	23.2	Very low	25.4	Very low	173 Å²	173	134.1 Å²	134.1	91%	0.906	72%	0.716	S	S	*	*			trans	-90.3	129.9	157.9	-88.9	152.3	0	0	0	110
150	R	21.3	Very low	25.6	Very low	244 Å²	244	137 Å²	137	92%	0.921	73%	0.731	S	S	*	*			trans	-111.3	127.5	157.5	-94.5	-172.8	176.8	-170.2	0	109.3
151	A	20.9	Very low	25.5	Very low	107 Å²	107	137.3 Å²	137.3	88%	0.884	73%	0.733	S	S	*	*			trans	-80.8	127.1	178.6	0	0	0	0	0	111.7
152	A	21.5	Very low	25.9	Very low	78 Å²	78	136.8 Å²	136.8	65%	0.645	75%	0.745	S	S	*	*	S	Bend	trans	-174	128.7	137.2	0	0	0	0	0	105.4	T154	A152-T154 PolarHBondContact O-N 3.48Å; A152-T154 PolarHBondContact O-OG1 3.5Å
153	V	27.4	Very low	26.2	Very low	147 Å²	147	136 Å²	136	89%	0.891	74%	0.744	S	S	*	*	S	Bend	trans	-48	90.5	-167.9	-177	0	0	0	0	113.1
154	T	24.3	Very low	26.8	Very low	122 Å²	122	136.8 Å²	136.8	75%	0.748	74%	0.742	S	S	*	*	S	Bend	trans	-174.9	124.5	171.8	12.4	0	0	0	0	106.5	A152	A152-T154 PolarHBondContact O-N 3.48Å; A152-T154 PolarHBondContact O-OG1 3.5Å
155	E	23.8	Very low	27.5	Very low	189 Å²	189	132.5 Å²	132.5	88%	0.883	71%	0.713	S	S	*	*			trans	75.8	110.3	178.7	-61.4	179.3	162.5	0	0	116.9
156	I	26.3	Very low	28.4	Very low	125 Å²	125	123.1 Å²	123.1	64%	0.641	68%	0.68	S	S	*	*			trans	-93.2	99.2	159.8	-61.4	176.8	0	0	0	105.3	L210	I156-L210 HydrophobicContact CD1-CD1 3.59Å; I156-L210 HydrophobicContact CD1-CD2 3.76Å; I156-L210 HydrophobicContact CD1-CG 4.31Å
157	E	24.9	Very low	29.4	Very low	162 Å²	162	125.2 Å²	125.2	76%	0.757	68%	0.676	S	S	*	*			trans	-87.6	117.8	172.5	-161.9	178.5	-164.7	0	0	108.9	I159	E157-I159 HydrophobicContact CG-CG1 4.12Å
158	L	27.8	Very low	30.6	Very low	124 Å²	124	118 Å²	118	65%	0.649	65%	0.647	S	S	*	*			trans	-101.3	93.3	-179.8	-132.3	140.6	0	0	0	108	I160	L158-I160 HydrophobicContact CD2-CD1 4.35Å; L158-I160 HydrophobicContact CD2-CG1 4.22Å
159	I	27.2	Very low	31.8	Very low	131 Å²	131	110.4 Å²	110.4	67%	0.672	61%	0.607	S	S	*	*			trans	-85	112.9	-179.8	-58.1	174.3	0	0	0	108.8	E157	E157-I159 HydrophobicContact CG-CG1 4.12Å
160	I	31	Very low	33.3	Very low	124 Å²	124	106.9 Å²	106.9	64%	0.636	58%	0.584	S	S	*	*			trans	-108.1	107.2	171.6	-54.9	179.5	0	0	0	107.2	L158 L205	L158-I160 HydrophobicContact CD2-CD1 4.35Å; L158-I160 HydrophobicContact CD2-CG1 4.22Å; I160-L205 HydrophobicContact CD1-CD2 3.54Å
161	S	28.5	Very low	35.1	Very low	101 Å²	101	95.4 Å²	95.4	71%	0.706	54%	0.541	S	S	*	.			trans	-117.3	129.2	-179.7	102.4	0	0	0	0	111.4
162	G	35.1	Very low	37.3	Very low	61 Å²	61	95.8 Å²	95.8	63%	0.629	53%	0.525	S	S	*	.			trans	60.8	84.9	153.8	0	0	0	0	0	116.9	E164	G162-E164 PolarHBondContact O-N 3.07Å
163	C	38.1	Very low	39.1	Very low	32 Å²	32	94.1 Å²	94.1	22%	0.216	51%	0.508	C	S	.	.			trans	-79.3	105.1	-177.7	-167.3	0	0	0	0	111.9	Q142 L165 E166	Q142-C163 PolarHBondContact OE1-SG 3.45Å; C163-L165 PolarHBondContact O-N 3.22Å; C163-E166 HydrophobicContact CB-CB 4.16Å; C163-E166 WeakPolarHBondContact O-CA 3.44Å; C163-E166 WeakPolarHBondContact O-CB 3.39Å; C163-E166 PolarHBondContact O-N 2.77Å
164	E	40.7	Very low	41.1	Very low	102 Å²	102	92.6 Å²	92.6	48%	0.477	50%	0.495	S	S	.	.	H	α-helix	trans	-58	-25	175.9	-68.7	-159.2	158	0	0	114.7	Q142 G162 E166 K167 A168	Q142-E164 HydrophobicContact CB-CB 4.14Å; Q142-E164 HydrophobicContact CB-CG 4.07Å; Q142-E164 HydrophobicContact CG-CB 3.81Å; Q142-E164 HydrophobicContact CG-CG 4.27Å; G162-E164 PolarHBondContact O-N 3.07Å; E164-E166 PolarHBondContact O-N 3.18Å; E164-K167 PolarHBondContact O-N 3.12Å; E164-K167 VanDerWaalsContact O-N 3.11Å; E164-A168 WeakPolarHBondContact O-CB 3.48Å; E164-A168 PolarHBondContact O-N 3.2Å
165	L	40.5	Very low	43.2	Very low	43 Å²	43	87.5 Å²	87.5	23%	0.225	46%	0.464	C	S	.	.	H	α-helix	trans	-60.6	-35.3	171.8	-92.5	155.5	0	0	0	110.5	V107 Q142 C163 A169	V107-L165 HydrophobicContact CB-CD2 4.42Å; V107-L165 HydrophobicContact CG1-CD2 3.55Å; V107-L165 HydrophobicContact CG2-CD2 4.32Å; Q142-L165 VanDerWaalsContact NE2-CB 3.28Å; C163-L165 PolarHBondContact O-N 3.22Å; L165-A169 VanDerWaalsContact O-CB 3.23Å; L165-A169 WeakPolarHBondContact O-CB 3.28Å; L165-A169 PolarHBondContact O-N 2.93Å; L165-A169 VanDerWaalsContact O-N 3.07Å
166	E	42.5	Very low	45.5	Very low	48 Å²	48	78.8 Å²	78.8	22%	0.224	42%	0.423	C	S	.	.	H	α-helix	trans	-68.6	-35.8	176.2	-156.7	178.5	-149.6	0	0	111.2	C163 E164 R203 R250	C163-E166 HydrophobicContact CB-CB 4.16Å; C163-E166 WeakPolarHBondContact O-CA 3.44Å; C163-E166 WeakPolarHBondContact O-CB 3.39Å; C163-E166 PolarHBondContact O-N 2.77Å; E164-E166 PolarHBondContact O-N 3.18Å; E166-R203 VanDerWaalsContact CD-CZ 3.48Å; E166-R203 IonicContact OE1-CZ 3.66Å; E166-R203 IonicContact OE1-NH1 3.89Å; E166-R203 PolarHBondContact OE1-NH1 3.49Å; E166-R203 IonicContact OE1-NH2 2.69Å; E166-R203 PolarHBondContact OE1-NH2 3.4Å; E166-R203 IonicContact OE2-CZ 2.76Å; E166-R203 IonicContact OE2-NH1 3.66Å; E166-R203 IonicContact OE2-NH2 2.87Å; E166-R203 PolarHBondContact OE2-NH2 3.5Å; E166-R250 IonicContact OE1-CZ 3.62Å; E166-R250 IonicContact OE1-NH2 3.09Å; E166-R250 PolarHBondContact OE1-NH2 2.98Å
167	K	46.4	Very low	48.1	Very low	168 Å²	168	77.8 Å²	77.8	73%	0.73	41%	0.411	S	S	*	.	H	α-helix	trans	-75.1	-39.3	175.5	-71.1	-176	179	176.9	0	112.5	E164 K170	E164-K167 PolarHBondContact O-N 3.12Å; E164-K167 VanDerWaalsContact O-N 3.11Å; K167-K170 PolarHBondContact O-N 2.89Å
168	A	48.1	Very low	50.7	Low	35 Å²	35	70.3 Å²	70.3	29%	0.289	38%	0.376	S	S	.	.	H	α-helix	trans	-74.1	-28.5	-177.7	0	0	0	0	0	113	V107 E164 K170	V107-A168 HydrophobicContact CG2-CB 3.61Å; E164-A168 WeakPolarHBondContact O-CB 3.48Å; E164-A168 PolarHBondContact O-N 3.2Å; A168-K170 VanDerWaalsContact C-N 3.28Å; A168-K170 PolarHBondContact O-N 3.28Å
169	A	48.5	Very low	53.2	Low	2 Å²	2	67.2 Å²	67.2	2%	0.017	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-3.2	178	0	0	0	0	0	114.1	L165 F171	L165-A169 VanDerWaalsContact O-CB 3.23Å; L165-A169 WeakPolarHBondContact O-CB 3.28Å; L165-A169 PolarHBondContact O-N 2.93Å; L165-A169 VanDerWaalsContact O-N 3.07Å; A169-F171 WeakPolarHBondContact O-CD2 3.49Å; A169-F171 WeakPolarHBondContact O-CE2 3.36Å; A169-F171 PolarHBondContact O-N 3.13Å
170	K	55.5	Low	55.5	Low	99 Å²	99	62.4 Å²	62.4	43%	0.43	34%	0.336	S	S	.	.			trans	-77.4	107.1	177.4	-133.9	-177.6	-178.1	-169.7	0	109.6	K103 K167 A168	K103-K170 PolarHBondContact NZ-O 3.34Å; K167-K170 PolarHBondContact O-N 2.89Å; A168-K170 VanDerWaalsContact C-N 3.28Å; A168-K170 PolarHBondContact O-N 3.28Å
171	F	58.8	Low	57.6	Low	3 Å²	3	64.2 Å²	64.2	1%	0.013	34%	0.341	C	S	.	.			trans	-86.8	129.6	173.3	-57.3	-69.6	0	0	0	109.9	H61 L89 C100 L104 A169 L176 I199 Y235	H61-F171 AromaticContact ND1-CE2 3.92Å; H61-F171 AromaticContact ND1-CZ 3.89Å; L89-F171 HydrophobicContact CD2-CE2 3.92Å; L89-F171 HydrophobicContact CD2-CZ 3.91Å; C100-F171 WeakPolarHBondContact SG-CD1 3.2Å; C100-F171 WeakPolarHBondContact SG-CE1 3.36Å; L104-F171 HydrophobicContact CD1-CE1 4.08Å; L104-F171 HydrophobicContact CD1-CZ 4.22Å; L104-F171 HydrophobicContact CD2-CZ 4.38Å; L104-F171 HydrophobicContact CG-CE1 4.07Å; L104-F171 HydrophobicContact CG-CZ 3.98Å; A169-F171 WeakPolarHBondContact O-CD2 3.49Å; A169-F171 WeakPolarHBondContact O-CE2 3.36Å; A169-F171 PolarHBondContact O-N 3.13Å; F171-L176 HydrophobicContact CB-CD1 3.65Å; F171-L176 HydrophobicContact CB-CG 4.35Å; F171-L176 HydrophobicContact CD1-CD1 4.11Å; F171-L176 HydrophobicContact CD2-CD1 4.17Å; F171-L176 HydrophobicContact CG-CD1 3.71Å; F171-I199 HydrophobicContact CD2-CD1 3.82Å; F171-I199 HydrophobicContact CE2-CD1 4.12Å; F171-I199 HydrophobicContact CE2-CG2 4.26Å; F171-Y235 HydrophobicContact CB-CE1 4.48Å
172	E	66.6	Low	60	Low	115 Å²	115	62.3 Å²	62.3	54%	0.537	32%	0.323	S	S	.	.			trans	-79.4	161.6	172	-63.7	-61.3	151.8	0	0	110.2	D174 D175	E172-D174 VanDerWaalsContact C-N 3.31Å; E172-D174 PolarHBondContact O-N 2.97Å; E172-D175 WeakPolarHBondContact CB-OD2 2.75Å; E172-D175 PolarHBondContact N-OD2 3.42Å; E172-D175 VanDerWaalsContact O-CB 3.26Å; E172-D175 WeakPolarHBondContact O-CB 3.22Å; E172-D175 PolarHBondContact O-N 3.43Å
173	S	59.3	Low	61.9	Low	43 Å²	43	59.4 Å²	59.4	30%	0.301	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-65.8	-34.2	-171.7	52.9	0	0	0	0	114.4	D175 V243	S173-D175 VanDerWaalsContact C-N 3.25Å; S173-D175 PolarHBondContact O-N 3.31Å; S173-V243 CarbonylContact C-O 3.54Å; S173-V243 WeakPolarHBondContact CA-O 3.24Å; S173-V243 WeakPolarHBondContact CB-O 3.04Å; S173-V243 VanDerWaalsContact O-O 3.05Å
174	D	68.2	Low	63.5	Low	115 Å²	115	58.1 Å²	58.1	62%	0.615	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-83.2	-1.8	177.5	-63.8	-45.7	0	0	0	112.7	E172 L176 K242	E172-D174 VanDerWaalsContact C-N 3.31Å; E172-D174 PolarHBondContact O-N 2.97Å; D174-L176 VanDerWaalsContact C-N 3.33Å; D174-K242 IonicContact OD1-NZ 2.89Å; D174-K242 PolarHBondContact OD1-NZ 3.26Å
175	D	68.6	Low	65.2	Low	16 Å²	16	59 Å²	59	9%	0.086	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-77.5	-20	179.9	-80.1	-29.4	0	0	0	112.8	S97 C100 K103 E172 S173	S97-D175 PolarHBondContact N-O 3.42Å; S97-D175 PolarHBondContact OG-OD1 2.96Å; C100-D175 HydrophobicContact CB-CB 3.84Å; K103-D175 IonicContact NZ-OD2 2.72Å; K103-D175 PolarHBondContact NZ-OD2 3.33Å; E172-D175 WeakPolarHBondContact CB-OD2 2.75Å; E172-D175 PolarHBondContact N-OD2 3.42Å; E172-D175 VanDerWaalsContact O-CB 3.26Å; E172-D175 WeakPolarHBondContact O-CB 3.22Å; E172-D175 PolarHBondContact O-N 3.43Å; S173-D175 VanDerWaalsContact C-N 3.25Å; S173-D175 PolarHBondContact O-N 3.31Å
176	L	73.6	Confident	66.8	Low	5 Å²	5	59 Å²	59	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	128.4	-164.7	-67.3	179.8	0	0	0	112.8	I93 M96 C100 F171 D174 I199 V243	I93-L176 HydrophobicContact CD1-CD2 3.27Å; I93-L176 HydrophobicContact CG1-CD2 3.94Å; I93-L176 HydrophobicContact CG2-CD2 4.46Å; M96-L176 HydrophobicContact CG-CD2 3.85Å; M96-L176 HydrophobicContact SD-CD2 3.93Å; C100-L176 WeakPolarHBondContact SG-CD2 3.34Å; F171-L176 HydrophobicContact CB-CD1 3.65Å; F171-L176 HydrophobicContact CB-CG 4.35Å; F171-L176 HydrophobicContact CD1-CD1 4.11Å; F171-L176 HydrophobicContact CD2-CD1 4.17Å; F171-L176 HydrophobicContact CG-CD1 3.71Å; D174-L176 VanDerWaalsContact C-N 3.33Å; L176-I199 HydrophobicContact CD1-CD1 4.34Å; L176-V243 HydrophobicContact CB-CB 4.18Å; L176-V243 HydrophobicContact CB-CG2 3.82Å; L176-V243 PolarHBondContact O-N 3.04Å
177	R	79.9	Confident	67.9	Low	105 Å²	105	58.7 Å²	58.7	40%	0.396	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	121.5	170	-154.6	176.9	-177.6	-174.9	0.7	110.7	I93 V94 E95 D240 G241	I93-R177 CarbonylContact C-O 3.51Å; I93-R177 WeakPolarHBondContact CG2-O 3.2Å; V94-R177 PolarHBondContact N-O 3.43Å; E95-R177 HydrophobicContact CB-CB 3.85Å; E95-R177 PolarHBondContact N-O 3.46Å; E95-R177 VanDerWaalsContact N-O 3.1Å; E95-R177 PolarHBondContact O-N 2.85Å; E95-R177 IonicContact OE2-NH1 3.97Å; R177-D240 PolarHBondContact NE-O 3.34Å; R177-D240 PolarHBondContact NH2-O 3.36Å; R177-D240 VanDerWaalsContact NH2-O 3.11Å; R177-G241 CarbonylContact C-O 3.58Å; R177-G241 WeakPolarHBondContact CA-O 3.15Å
178	V	78.9	Confident	69	Low	5 Å²	5	53.7 Å²	53.7	3%	0.03	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	151.2	-167.3	-129.1	0	0	0	0	111.6	L92 I93 I180 L183 L237 G241 V243	L92-V178 HydrophobicContact CB-CG1 3.87Å; L92-V178 WeakPolarHBondContact O-CG1 3.4Å; I93-V178 HydrophobicContact CG1-CG1 4.47Å; V178-I180 PolarHBondContact O-N 3.41Å; V178-I180 VanDerWaalsContact O-N 3.09Å; V178-L183 HydrophobicContact CB-CD1 3.82Å; V178-L183 HydrophobicContact CG1-CD1 3.54Å; V178-L237 HydrophobicContact CB-CD2 4.06Å; V178-L237 HydrophobicContact CG2-CD2 3.43Å; V178-L237 VanDerWaalsContact CG2-CD2 3.43Å; V178-G241 WeakPolarHBondContact CG2-O 3.43Å; V178-G241 PolarHBondContact N-O 2.94Å; V178-V243 HydrophobicContact CG2-CG2 3.04Å
179	N	80.4	Confident	69.8	Low	58 Å²	58	56.6 Å²	56.6	31%	0.31	30%	0.301	S	S	.	.			trans	-77	98.5	175.4	-172.4	-28.8	0	0	0	108.9	L92 V94 E181 L182 L183	L92-N179 PolarHBondContact O-N 3.25Å; V94-N179 HydrophobicContact CG2-CB 3.6Å; N179-E181 PolarHBondContact O-N 3.09Å; N179-E181 PolarHBondContact OD1-N 3.01Å; N179-L182 HydrophobicContact CB-CB 3.93Å; N179-L182 PolarHBondContact O-N 3.18Å; N179-L182 PolarHBondContact OD1-N 3.23Å; N179-L183 PolarHBondContact O-N 3.43Å
180	I	75.3	Confident	70.2	Confident	31 Å²	31	64.5 Å²	64.5	16%	0.159	34%	0.335	C	S	.	.	H	α-helix	trans	-60.1	-45.5	-179.4	-69.8	178.6	0	0	0	111.1	V178 L182 L183 S184 P193 E238 S239	V178-I180 PolarHBondContact O-N 3.41Å; V178-I180 VanDerWaalsContact O-N 3.09Å; I180-L182 VanDerWaalsContact C-N 3.32Å; I180-L182 PolarHBondContact O-N 2.9Å; I180-L183 PolarHBondContact O-N 3.37Å; I180-L183 VanDerWaalsContact O-N 3.15Å; I180-S184 WeakPolarHBondContact O-CB 3.44Å; I180-S184 PolarHBondContact O-N 2.88Å; I180-S184 PolarHBondContact O-OG 3.43Å; I180-P193 HydrophobicContact CG2-CB 3.79Å; I180-P193 HydrophobicContact CG2-CG 4.16Å; I180-E238 WeakPolarHBondContact CD1-O 3.4Å; I180-S239 VanDerWaalsContact CD1-O 3.28Å; I180-S239 WeakPolarHBondContact CD1-O 3.46Å
181	E	76.6	Confident	70.5	Confident	161 Å²	161	69 Å²	69	75%	0.752	36%	0.357	S	S	*	.	H	α-helix	trans	-59.5	-45.3	-177.5	-67	-179.9	171.7	0	0	111.3	N179 L183 S184 E185	N179-E181 PolarHBondContact O-N 3.09Å; N179-E181 PolarHBondContact OD1-N 3.01Å; E181-L183 PolarHBondContact O-N 3.5Å; E181-S184 PolarHBondContact O-N 3.08Å; E181-E185 WeakPolarHBondContact O-CB 3.23Å; E181-E185 PolarHBondContact O-N 2.73Å
182	L	79.4	Confident	70.8	Confident	61 Å²	61	70.9 Å²	70.9	32%	0.319	37%	0.373	S	S	.	.	H	α-helix	trans	-63.2	-42.4	176.3	-179.7	62.1	0	0	0	111.8	L92 N179 I180 E185 I186	L92-L182 HydrophobicContact CD2-CD2 4.33Å; N179-L182 HydrophobicContact CB-CB 3.93Å; N179-L182 PolarHBondContact O-N 3.18Å; N179-L182 PolarHBondContact OD1-N 3.23Å; I180-L182 VanDerWaalsContact C-N 3.32Å; I180-L182 PolarHBondContact O-N 2.9Å; L182-E185 PolarHBondContact O-N 2.91Å; L182-I186 HydrophobicContact CD1-CD1 4.08Å; L182-I186 HydrophobicContact CD1-CG1 4.46Å; L182-I186 HydrophobicContact CG-CD1 3.91Å; L182-I186 WeakPolarHBondContact O-CB 3.31Å; L182-I186 WeakPolarHBondContact O-CD1 3.44Å; L182-I186 WeakPolarHBondContact O-CG1 3.24Å; L182-I186 PolarHBondContact O-N 2.78Å
183	L	73.4	Confident	70.7	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-66	-40.7	177.9	-89.4	163.2	0	0	0	112.5	A86 L92 V178 N179 I180 E181 I186 A187 P194 L197 L237	A86-L183 HydrophobicContact CB-CD2 4.33Å; L92-L183 HydrophobicContact CD1-CD2 4.48Å; L92-L183 HydrophobicContact CD2-CD2 4.25Å; L92-L183 HydrophobicContact CD2-CG 4.36Å; V178-L183 HydrophobicContact CB-CD1 3.82Å; V178-L183 HydrophobicContact CG1-CD1 3.54Å; N179-L183 PolarHBondContact O-N 3.43Å; I180-L183 PolarHBondContact O-N 3.37Å; I180-L183 VanDerWaalsContact O-N 3.15Å; E181-L183 PolarHBondContact O-N 3.5Å; L183-I186 PolarHBondContact O-N 2.97Å; L183-A187 VanDerWaalsContact O-CB 3.29Å; L183-A187 WeakPolarHBondContact O-CB 3.48Å; L183-A187 PolarHBondContact O-N 2.99Å; L183-P194 HydrophobicContact CB-CG 4.17Å; L183-P194 HydrophobicContact CD2-CG 4.49Å; L183-L197 HydrophobicContact CD2-CD1 4.01Å; L183-L237 HydrophobicContact CD1-CD1 4.01Å; L183-L237 HydrophobicContact CD1-CD2 4.29Å
184	S	72.3	Confident	71.1	Confident	4 Å²	4	66.5 Å²	66.5	3%	0.028	35%	0.354	C	S	.	.	H	α-helix	trans	-61.5	-44.9	174.4	-65.1	0	0	0	0	111.1	I180 E181 I186 A187 G188 D189 A192 P193	I180-S184 WeakPolarHBondContact O-CB 3.44Å; I180-S184 PolarHBondContact O-N 2.88Å; I180-S184 PolarHBondContact O-OG 3.43Å; E181-S184 PolarHBondContact O-N 3.08Å; S184-I186 PolarHBondContact O-N 3.39Å; S184-A187 PolarHBondContact O-N 2.91Å; S184-G188 PolarHBondContact O-N 3.1Å; S184-G188 VanDerWaalsContact O-N 3.1Å; S184-D189 CarbonylContact C-O 3.59Å; S184-D189 VanDerWaalsContact CB-O 3.28Å; S184-D189 WeakPolarHBondContact CB-O 3.33Å; S184-D189 CarbonylContact O-C 3.49Å; S184-D189 PolarHBondContact O-N 2.94Å; S184-A192 VanDerWaalsContact OG-C 3.26Å; S184-A192 PolarHBondContact OG-O 3.04Å; S184-A192 VanDerWaalsContact OG-O 3.12Å; S184-P193 WeakPolarHBondContact OG-CA 3.12Å
185	E	77.4	Confident	71.1	Confident	121 Å²	121	70 Å²	70	57%	0.565	37%	0.367	S	S	*	.	H	α-helix	trans	-61.3	-45.4	176	-174	175.5	-164.8	0	0	111.9	E181 L182 A187 G188	E181-E185 WeakPolarHBondContact O-CB 3.23Å; E181-E185 PolarHBondContact O-N 2.73Å; L182-E185 PolarHBondContact O-N 2.91Å; E185-A187 VanDerWaalsContact C-N 3.34Å; E185-A187 PolarHBondContact O-N 2.72Å; E185-G188 PolarHBondContact O-N 2.69Å; E185-G188 VanDerWaalsContact O-N 3.1Å
186	I	72.2	Confident	71.3	Confident	44 Å²	44	69.9 Å²	69.9	23%	0.226	37%	0.368	C	S	.	.	H	α-helix	trans	-64.4	-38.7	177.3	-70.1	164.8	0	0	0	111.8	V65 A86 L92 L182 L183 S184 G188	V65-I186 HydrophobicContact CG2-CG2 4.39Å; A86-I186 HydrophobicContact CB-CG2 3.94Å; A86-I186 WeakPolarHBondContact O-CD1 3.46Å; L92-I186 HydrophobicContact CD2-CD1 3.9Å; L182-I186 HydrophobicContact CD1-CD1 4.08Å; L182-I186 HydrophobicContact CD1-CG1 4.46Å; L182-I186 HydrophobicContact CG-CD1 3.91Å; L182-I186 WeakPolarHBondContact O-CB 3.31Å; L182-I186 WeakPolarHBondContact O-CD1 3.44Å; L182-I186 WeakPolarHBondContact O-CG1 3.24Å; L182-I186 PolarHBondContact O-N 2.78Å; L183-I186 PolarHBondContact O-N 2.97Å; S184-I186 PolarHBondContact O-N 3.39Å; I186-G188 PolarHBondContact O-N 3.11Å
187	A	67.6	Low	71.4	Confident	40 Å²	40	69.7 Å²	69.7	33%	0.331	37%	0.367	S	S	.	.	H	α-helix	trans	-71.1	-11.8	176.8	0	0	0	0	0	112.8	V65 L183 S184 E185 D189 P194	V65-A187 HydrophobicContact CG1-CB 4.47Å; L183-A187 VanDerWaalsContact O-CB 3.29Å; L183-A187 WeakPolarHBondContact O-CB 3.48Å; L183-A187 PolarHBondContact O-N 2.99Å; S184-A187 PolarHBondContact O-N 2.91Å; E185-A187 VanDerWaalsContact C-N 3.34Å; E185-A187 PolarHBondContact O-N 2.72Å; A187-D189 VanDerWaalsContact C-N 3.32Å; A187-P194 HydrophobicContact CB-CB 3.96Å; A187-P194 HydrophobicContact CB-CG 4.22Å
188	G	67.8	Low	71.2	Confident	64 Å²	64	65.3 Å²	65.3	66%	0.66	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	8.9	-179.6	0	0	0	0	0	114.1	S184 E185 I186	S184-G188 PolarHBondContact O-N 3.1Å; S184-G188 VanDerWaalsContact O-N 3.1Å; E185-G188 PolarHBondContact O-N 2.69Å; E185-G188 VanDerWaalsContact O-N 3.1Å; I186-G188 PolarHBondContact O-N 3.11Å
189	D	65	Low	70.8	Confident	95 Å²	95	65.1 Å²	65.1	51%	0.508	35%	0.349	S	S	.	.			trans	-123.3	86.5	-176.7	-146	-12.6	0	0	0	108.7	S184 A187 E191 A192	S184-D189 CarbonylContact C-O 3.59Å; S184-D189 VanDerWaalsContact CB-O 3.28Å; S184-D189 WeakPolarHBondContact CB-O 3.33Å; S184-D189 CarbonylContact O-C 3.49Å; S184-D189 PolarHBondContact O-N 2.94Å; A187-D189 VanDerWaalsContact C-N 3.32Å; D189-E191 PolarHBondContact O-N 3.36Å; D189-E191 VanDerWaalsContact O-N 3.08Å; D189-A192 PolarHBondContact O-N 2.86Å
190	K	58.6	Low	70.1	Confident	169 Å²	169	62.4 Å²	62.4	74%	0.735	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.6	-168	-67.6	-170.6	176.6	-169.9	0	113.9
191	E	60.6	Low	69.3	Low	192 Å²	192	61.1 Å²	61.1	90%	0.897	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-7.1	-172.3	-63.4	-170.1	171.7	0	0	113.8	D189	D189-E191 PolarHBondContact O-N 3.36Å; D189-E191 VanDerWaalsContact O-N 3.08Å
192	A	65.1	Low	68.2	Low	43 Å²	43	54.6 Å²	54.6	36%	0.355	30%	0.298	S	S	.	.	S	Bend	trans	-147.5	135.8	-178.1	0	0	0	0	0	113.2	S184 D189	S184-A192 VanDerWaalsContact OG-C 3.26Å; S184-A192 PolarHBondContact OG-O 3.04Å; S184-A192 VanDerWaalsContact OG-O 3.12Å; D189-A192 PolarHBondContact O-N 2.86Å
193	P	64.8	Low	66.5	Low	51 Å²	51	54.1 Å²	54.1	33%	0.331	29%	0.292	S	S	.	.			trans	-55.4	142.3	171.7	18	-27	0	0	0	110.4	I180 S184 Q195	I180-P193 HydrophobicContact CG2-CB 3.79Å; I180-P193 HydrophobicContact CG2-CG 4.16Å; S184-P193 WeakPolarHBondContact OG-CA 3.12Å; P193-Q195 PolarHBondContact O-N 3.21Å
194	P	67.3	Low	65	Low	16 Å²	16	59.2 Å²	59.2	10%	0.104	31%	0.311	C	S	.	.			trans	-57	133.1	173.2	21.9	-30.6	0	0	0	109.8	V65 L183 A187 A196 L237	V65-P194 HydrophobicContact CG1-CB 3.43Å; V65-P194 VanDerWaalsContact CG1-CB 3.43Å; V65-P194 HydrophobicContact CG1-CG 3.76Å; L183-P194 HydrophobicContact CB-CG 4.17Å; L183-P194 HydrophobicContact CD2-CG 4.49Å; A187-P194 HydrophobicContact CB-CB 3.96Å; A187-P194 HydrophobicContact CB-CG 4.22Å; P194-A196 PolarHBondContact O-N 3.4Å; P194-L237 HydrophobicContact CG-CD1 4.16Å
195	Q	67.8	Low	63.2	Low	188 Å²	188	61.5 Å²	61.5	88%	0.879	32%	0.323	S	S	*	.	S	Bend	trans	-57.4	-17.5	-176.7	-67.2	-175.2	1.6	0	0	114.3	P193	P193-Q195 PolarHBondContact O-N 3.21Å
196	A	74.4	Confident	61	Low	13 Å²	13	57.8 Å²	57.8	11%	0.107	31%	0.314	C	S	.	.			trans	-152.3	128.7	176.4	0	0	0	0	0	111.2	P194 Y198 K234	P194-A196 PolarHBondContact O-N 3.4Å; A196-Y198 HydrophobicContact CB-CD2 4.35Å; A196-Y198 HydrophobicContact CB-CE2 3.54Å; A196-K234 HydrophobicContact CB-CG 4.25Å
197	L	75	Confident	59.1	Low	1 Å²	1	57.3 Å²	57.3	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	133.8	162.6	178	64.4	0	0	0	108.4	L183 Y235 L237	L183-L197 HydrophobicContact CD2-CD1 4.01Å; L197-Y235 PolarHBondContact N-O 3.35Å; L197-Y235 PolarHBondContact O-N 3.46Å; L197-L237 HydrophobicContact CB-CD1 3.95Å; L197-L237 HydrophobicContact CB-CG 4.42Å
198	Y	75.7	Confident	57.4	Low	14 Å²	14	57.9 Å²	57.9	6%	0.055	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.7	174.1	-61.9	-83.7	0	0	0	109.4	G63 V64 K66 Y83 A196 L232 F233 K234 I249	G63-Y198 CarbonylContact C-O 3.52Å; G63-Y198 WeakPolarHBondContact CA-O 3.49Å; V64-Y198 PolarHBondContact N-O 2.65Å; V64-Y198 WeakPolarHBondContact O-CB 3.34Å; V64-Y198 PolarHBondContact O-N 3.11Å; K66-Y198 HydrophobicContact CB-CD2 4.3Å; K66-Y198 HydrophobicContact CB-CE2 3.61Å; Y83-Y198 HydrophobicContact CD1-CD2 4.12Å; Y83-Y198 HydrophobicContact CD1-CG 4.42Å; Y83-Y198 HydrophobicContact CE1-CD1 4.4Å; Y83-Y198 AromaticContact CE1-CD2 3.88Å; Y83-Y198 HydrophobicContact CE1-CD2 3.88Å; Y83-Y198 HydrophobicContact CE1-CE2 4.07Å; Y83-Y198 HydrophobicContact CE1-CG 4.03Å; A196-Y198 HydrophobicContact CB-CD2 4.35Å; A196-Y198 HydrophobicContact CB-CE2 3.54Å; Y198-L232 HydrophobicContact CD1-CB 4.19Å; Y198-L232 HydrophobicContact CD1-CD1 4.16Å; Y198-L232 HydrophobicContact CG-CD1 4.2Å; Y198-F233 CarbonylContact C-O 3.59Å; Y198-F233 VanDerWaalsContact CA-O 3.25Å; Y198-F233 WeakPolarHBondContact CA-O 3.24Å; Y198-K234 HydrophobicContact CD1-CB 3.98Å; Y198-K234 HydrophobicContact CD1-CG 4.24Å; Y198-K234 HydrophobicContact CE1-CB 3.64Å; Y198-K234 HydrophobicContact CE1-CD 4.22Å; Y198-K234 HydrophobicContact CE1-CG 3.6Å; Y198-I249 HydrophobicContact CD1-CD1 4.3Å; Y198-I249 HydrophobicContact CE1-CD1 3.36Å; Y198-I249 HydrophobicContact CE1-CG1 4.02Å
199	I	70.8	Confident	55.6	Low	1 Å²	1	61 Å²	61	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.7	172.7	-56.8	-179.1	0	0	0	108	L89 F171 L176 F233 Y235	L89-I199 HydrophobicContact CD1-CD1 4.01Å; L89-I199 HydrophobicContact CD1-CG1 4.4Å; L89-I199 HydrophobicContact CD2-CD1 4.01Å; L89-I199 HydrophobicContact CD2-CG2 4.33Å; F171-I199 HydrophobicContact CD2-CD1 3.82Å; F171-I199 HydrophobicContact CE2-CD1 4.12Å; F171-I199 HydrophobicContact CE2-CG2 4.26Å; L176-I199 HydrophobicContact CD1-CD1 4.34Å; I199-F233 PolarHBondContact N-O 3.38Å; I199-F233 PolarHBondContact O-N 3.49Å; I199-Y235 HydrophobicContact CB-CD2 4.37Å; I199-Y235 HydrophobicContact CB-CE2 3.87Å; I199-Y235 HydrophobicContact CD1-CD2 3.75Å; I199-Y235 HydrophobicContact CD1-CE2 3.37Å; I199-Y235 HydrophobicContact CG1-CD2 3.73Å; I199-Y235 HydrophobicContact CG1-CE2 3.57Å
200	V	65.5	Low	54.1	Low	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	127.3	176.9	168	0	0	0	0	110	Y58 K59 H61 A62 V64 E202 I230 L232	Y58-V200 HydrophobicContact CD1-CG2 4.15Å; Y58-V200 WeakPolarHBondContact O-CG1 3.47Å; K59-V200 WeakPolarHBondContact O-CG1 3.48Å; H61-V200 VanDerWaalsContact CA-O 3.29Å; H61-V200 WeakPolarHBondContact CA-O 3.35Å; H61-V200 PolarHBondContact N-O 3.35Å; A62-V200 HydrophobicContact CB-CB 4.32Å; A62-V200 HydrophobicContact CB-CG2 4.41Å; A62-V200 WeakPolarHBondContact O-CB 3.41Å; A62-V200 PolarHBondContact O-N 2.75Å; V64-V200 HydrophobicContact CG1-CG2 3.58Å; V64-V200 HydrophobicContact CG2-CG2 4.12Å; V200-E202 HydrophobicContact CG1-CG 4.44Å; V200-I230 HydrophobicContact CB-CG2 4.32Å; V200-I230 HydrophobicContact CG1-CG2 3.62Å; V200-I230 HydrophobicContact CG2-CG2 4.24Å; V200-L232 HydrophobicContact CB-CD2 4.42Å; V200-L232 HydrophobicContact CG2-CD2 3.7Å
201	N	59.1	Low	52.8	Low	4 Å²	4	53.7 Å²	53.7	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.3	166.1	-161.9	12.9	0	0	0	109.3	L60 V231 F233	L60-N201 WeakPolarHBondContact CD1-OD1 3.42Å; N201-V231 HydrophobicContact CB-CB 4.47Å; N201-V231 PolarHBondContact N-O 3.02Å; N201-V231 PolarHBondContact O-N 3.3Å; N201-F233 HydrophobicContact CB-CD2 4.05Å; N201-F233 HydrophobicContact CB-CE2 3.6Å
202	E	52.6	Low	51.3	Low	25 Å²	25	48.1 Å²	48.1	12%	0.117	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.3	179.5	-66.4	179.7	158	0	0	109.8	L60 V200 Y204 I230	L60-E202 HydrophobicContact CD1-CB 4Å; L60-E202 HydrophobicContact CD1-CG 4.45Å; V200-E202 HydrophobicContact CG1-CG 4.44Å; E202-Y204 HydrophobicContact CB-CD2 4.45Å; E202-Y204 HydrophobicContact CB-CE2 3.8Å; E202-Y204 WeakPolarHBondContact OE2-CE2 3.43Å; E202-Y204 PolarHBondContact OE2-OH 3Å; E202-I230 HydrophobicContact CG-CG1 4.47Å
203	R	43.4	Very low	49.5	Very low	51 Å²	51	49.3 Å²	49.3	19%	0.192	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	113.4	167.4	-85.2	-168.1	146.1	148.8	-6.1	109.5	E166 G229 V231	E166-R203 VanDerWaalsContact CD-CZ 3.48Å; E166-R203 IonicContact OE1-CZ 3.66Å; E166-R203 IonicContact OE1-NH1 3.89Å; E166-R203 PolarHBondContact OE1-NH1 3.49Å; E166-R203 IonicContact OE1-NH2 2.69Å; E166-R203 PolarHBondContact OE1-NH2 3.4Å; E166-R203 IonicContact OE2-CZ 2.76Å; E166-R203 IonicContact OE2-NH1 3.66Å; E166-R203 IonicContact OE2-NH2 2.87Å; E166-R203 PolarHBondContact OE2-NH2 3.5Å; R203-G229 PolarHBondContact N-O 3.27Å; R203-G229 PolarHBondContact O-N 3.4Å; R203-G229 VanDerWaalsContact O-O 3.1Å; R203-V231 HydrophobicContact CB-CG2 4.47Å; R203-V231 HydrophobicContact CG-CG2 4.03Å
204	Y	41.4	Very low	47.9	Very low	107 Å²	107	53.9 Å²	53.9	42%	0.42	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	111.7	169.2	-62.5	-87.4	0	0	0	108.6	E202 V228	E202-Y204 HydrophobicContact CB-CD2 4.45Å; E202-Y204 HydrophobicContact CB-CE2 3.8Å; E202-Y204 WeakPolarHBondContact OE2-CE2 3.43Å; E202-Y204 PolarHBondContact OE2-OH 3Å; Y204-V228 HydrophobicContact CD1-CG1 4.19Å; Y204-V228 HydrophobicContact CD1-CG2 4.32Å; Y204-V228 HydrophobicContact CE1-CG1 4.13Å
205	L	35.1	Very low	46.4	Very low	52 Å²	52	56.5 Å²	56.5	27%	0.272	31%	0.308	S	S	.	.			trans	-119.3	87.5	175.7	-94.8	153.7	0	0	0	108.1	M41 I160 P227	M41-L205 HydrophobicContact CE-CB 4.28Å; M41-L205 HydrophobicContact CE-CD1 3.76Å; M41-L205 HydrophobicContact SD-CB 4.48Å; I160-L205 HydrophobicContact CD1-CD2 3.54Å; L205-P227 CarbonylContact C-O 3.58Å; L205-P227 VanDerWaalsContact C-O 3.28Å; L205-P227 HydrophobicContact CB-CB 4.01Å; L205-P227 HydrophobicContact CB-CG 4.27Å; L205-P227 PolarHBondContact N-O 3.18Å; L205-P227 VanDerWaalsContact N-O 3.1Å; L205-P227 CarbonylContact O-C 3.28Å; L205-P227 VanDerWaalsContact O-CB 3.32Å; L205-P227 WeakPolarHBondContact O-CB 3.34Å; L205-P227 WeakPolarHBondContact O-CD 3.43Å; L205-P227 WeakPolarHBondContact O-CG 3.46Å
206	A	31.7	Very low	44.9	Very low	44 Å²	44	57.2 Å²	57.2	36%	0.364	31%	0.311	S	S	.	.			trans	-71.7	134.6	177.9	0	0	0	0	0	112	L138 F226	L138-A206 HydrophobicContact CD2-CB 3.97Å; A206-F226 VanDerWaalsContact CA-CE1 3.49Å; A206-F226 VanDerWaalsContact CA-CZ 3.44Å; A206-F226 HydrophobicContact CB-CE1 3.53Å; A206-F226 HydrophobicContact CB-CE2 3.92Å; A206-F226 HydrophobicContact CB-CZ 3.15Å
207	T	31.4	Very low	42.9	Very low	33 Å²	33	63.3 Å²	63.3	20%	0.202	34%	0.337	C	S	.	.			trans	-107.3	138	167.2	-52.5	0	0	0	0	111.5	Y223 F226 P227	T207-Y223 HydrophobicContact CG2-CD1 3.26Å; T207-Y223 HydrophobicContact CG2-CD2 4.01Å; T207-Y223 HydrophobicContact CG2-CE1 3.75Å; T207-Y223 HydrophobicContact CG2-CE2 4.44Å; T207-Y223 HydrophobicContact CG2-CG 3.38Å; T207-F226 WeakPolarHBondContact O-CD2 3.4Å; T207-F226 WeakPolarHBondContact O-CE2 3.3Å; T207-P227 WeakPolarHBondContact OG1-CD 2.95Å
208	L	32.2	Very low	41.1	Very low	52 Å²	52	67.4 Å²	67.4	27%	0.272	36%	0.363	S	S	.	.			trans	-87.5	150.3	-165.3	-155.9	83.5	0	0	0	113.3	F136 L210	F136-L208 HydrophobicContact CB-CD1 4.11Å; F136-L208 WeakPolarHBondContact O-CD1 3.3Å; L208-L210 HydrophobicContact CD2-CD1 4.1Å; L208-L210 HydrophobicContact CD2-CG 4.31Å
209	Y	31.2	Very low	39.2	Very low	130 Å²	130	71 Å²	71	51%	0.51	38%	0.379	S	S	.	.			trans	-87.8	130.9	163	-73.5	-98.3	0	0	0	110.6	V222	Y209-V222 HydrophobicContact CD1-CG2 3.98Å; Y209-V222 HydrophobicContact CE1-CB 4.13Å; Y209-V222 HydrophobicContact CE1-CG1 3.7Å; Y209-V222 HydrophobicContact CE1-CG2 3.62Å
210	L	32.3	Very low	37.7	Very low	57 Å²	57	75.6 Å²	75.6	30%	0.298	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	111.4	178.5	-107.2	143.3	0	0	0	109.7	I156 L208	I156-L210 HydrophobicContact CD1-CD1 3.59Å; I156-L210 HydrophobicContact CD1-CD2 3.76Å; I156-L210 HydrophobicContact CD1-CG 4.31Å; L208-L210 HydrophobicContact CD2-CD1 4.1Å; L208-L210 HydrophobicContact CD2-CG 4.31Å
211	S	30.6	Very low	36.3	Very low	54 Å²	54	78.7 Å²	78.7	38%	0.378	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.6	167.7	62.5	0	0	0	0	109.5
212	T	29.9	Very low	35.4	Very low	74 Å²	74	79.8 Å²	79.8	45%	0.454	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.9	169.4	51.8	0	0	0	0	109.2	K219	T212-K219 PolarHBondContact O-N 3.46Å
213	T	28.4	Very low	34.5	Very low	68 Å²	68	81.1 Å²	81.1	42%	0.417	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.4	178.1	-37.2	0	0	0	0	107.5
214	I	29.2	Very low	34.1	Very low	147 Å²	147	83.6 Å²	83.6	75%	0.754	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.7	108.8	171.1	-58.8	176.8	0	0	0	106.6
215	G	37.7	Very low	33.8	Very low	72 Å²	72	82.2 Å²	82.2	74%	0.742	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	-138.4	-174.8	0	0	0	0	0	112.9	Q217	G215-Q217 VanDerWaalsContact C-N 3.34Å
216	Q	34.7	Very low	33.8	Very low	203 Å²	203	83.6 Å²	83.6	95%	0.949	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	0.6	-180	-69.9	-174	-13.8	0	0	114.5
217	Q	32.6	Very low	34.3	Very low	140 Å²	140	82 Å²	82	65%	0.654	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	113.2	-179.6	-69.9	-171.6	-2.3	0	0	111.1	G215	G215-Q217 VanDerWaalsContact C-N 3.34Å
218	T	37.6	Very low	34.7	Very low	88 Å²	88	83.3 Å²	83.3	54%	0.54	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	120.5	171.3	-41.3	0	0	0	0	109.1	Q220	T218-Q220 HydrophobicContact CG2-CG 4.13Å
219	K	36.8	Very low	35.4	Very low	90 Å²	90	81 Å²	81	39%	0.391	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	111.7	166.7	-69.4	-178	-175.3	173	0	108	T212 F221	T212-K219 PolarHBondContact O-N 3.46Å; K219-F221 HydrophobicContact CB-CD2 4.48Å; K219-F221 HydrophobicContact CB-CE2 3.73Å; K219-F221 HydrophobicContact CB-CZ 4.27Å
220	Q	38.1	Very low	36.4	Very low	96 Å²	96	75.4 Å²	75.4	45%	0.449	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	127.2	175	-68.6	-179.8	-14.9	0	0	109.1	T218 I261	T218-Q220 HydrophobicContact CG2-CG 4.13Å; Q220-I261 PolarHBondContact O-N 3.44Å
221	F	37.3	Very low	37.7	Very low	66 Å²	66	73.1 Å²	73.1	29%	0.289	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.9	172.6	-63.8	-89.6	0	0	0	107.5	K219 R260	K219-F221 HydrophobicContact CB-CD2 4.48Å; K219-F221 HydrophobicContact CB-CE2 3.73Å; K219-F221 HydrophobicContact CB-CZ 4.27Å; F221-R260 HydrophobicContact CD1-CB 4.32Å; F221-R260 HydrophobicContact CD1-CG 4.46Å; F221-R260 HydrophobicContact CE1-CB 4.05Å; F221-R260 HydrophobicContact CE1-CG 3.94Å
222	V	38.2	Very low	39.2	Very low	26 Å²	26	70.7 Å²	70.7	16%	0.158	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.5	173.6	171.5	0	0	0	0	107	Y209 E224 I261	Y209-V222 HydrophobicContact CD1-CG2 3.98Å; Y209-V222 HydrophobicContact CE1-CB 4.13Å; Y209-V222 HydrophobicContact CE1-CG1 3.7Å; Y209-V222 HydrophobicContact CE1-CG2 3.62Å; V222-E224 HydrophobicContact CG1-CG 4.45Å; V222-E224 PolarHBondContact O-N 3.28Å; V222-I261 HydrophobicContact CB-CD1 3.77Å; V222-I261 HydrophobicContact CB-CG1 4.27Å; V222-I261 HydrophobicContact CG2-CD1 3.23Å; V222-I261 HydrophobicContact CG2-CG1 4.1Å
223	Y	35	Very low	41	Very low	54 Å²	54	67.4 Å²	67.4	21%	0.212	35%	0.354	C	S	.	.			trans	-81.3	102.6	164.7	-159.9	-98.1	0	0	0	107	T207 W258	T207-Y223 HydrophobicContact CG2-CD1 3.26Å; T207-Y223 HydrophobicContact CG2-CD2 4.01Å; T207-Y223 HydrophobicContact CG2-CE1 3.75Å; T207-Y223 HydrophobicContact CG2-CE2 4.44Å; T207-Y223 HydrophobicContact CG2-CG 3.38Å; Y223-W258 AromaticContact CD2-CD2 3.64Å; Y223-W258 HydrophobicContact CD2-CD2 3.64Å; Y223-W258 AromaticContact CD2-CE2 3.54Å; Y223-W258 AromaticContact CD2-CE3 3.67Å; Y223-W258 HydrophobicContact CD2-CE3 3.67Å; Y223-W258 HydrophobicContact CD2-CG 4.4Å; Y223-W258 AromaticContact CD2-CH2 3.52Å; Y223-W258 HydrophobicContact CD2-CH2 3.52Å; Y223-W258 AromaticContact CD2-CZ2 3.49Å; Y223-W258 HydrophobicContact CD2-CZ2 3.49Å; Y223-W258 VanDerWaalsContact CD2-CZ2 3.49Å; Y223-W258 AromaticContact CD2-CZ3 3.61Å; Y223-W258 HydrophobicContact CD2-CZ3 3.61Å; Y223-W258 HydrophobicContact CE2-CD2 4.07Å; Y223-W258 AromaticContact CE2-CE2 3.68Å; Y223-W258 HydrophobicContact CE2-CH2 4.29Å; Y223-W258 AromaticContact CE2-CZ2 3.8Å; Y223-W258 HydrophobicContact CE2-CZ2 3.8Å; Y223-W258 AromaticContact CE2-NE1 3.93Å; Y223-W258 HydrophobicContact CG-CH2 4.16Å; Y223-W258 HydrophobicContact CG-CZ2 4.49Å; Y223-W258 HydrophobicContact CG-CZ3 4.19Å
224	E	33.9	Very low	43.3	Very low	102 Å²	102	67 Å²	67	48%	0.477	35%	0.347	S	S	.	.			trans	-66.6	140.3	167.5	-72.7	-178.8	163.1	0	0	108.3	V222 K259	V222-E224 HydrophobicContact CG1-CG 4.45Å; V222-E224 PolarHBondContact O-N 3.28Å; E224-K259 WeakPolarHBondContact OE2-CD 3.3Å; E224-K259 WeakPolarHBondContact OE2-CE 3.21Å; E224-K259 IonicContact OE2-NZ 2.72Å; E224-K259 PolarHBondContact OE2-NZ 3.31Å
225	N	36	Very low	45.4	Very low	79 Å²	79	60.1 Å²	60.1	42%	0.422	31%	0.311	S	S	.	.			trans	79.4	84.6	177.5	-51.5	-28.9	0	0	0	115.6	Q40 P227	Q40-N225 HydrophobicContact CB-CB 4.49Å; Q40-N225 PolarHBondContact OE1-ND2 3.09Å; N225-P227 VanDerWaalsContact O-CD 3.3Å; N225-P227 WeakPolarHBondContact O-CD 3.41Å
226	F	35.6	Very low	47.4	Very low	80 Å²	80	61.2 Å²	61.2	35%	0.351	30%	0.295	S	S	.	.			trans	-72.7	117.4	172.6	-156	-91.9	0	0	0	110.5	A206 T207 V228	A206-F226 VanDerWaalsContact CA-CE1 3.49Å; A206-F226 VanDerWaalsContact CA-CZ 3.44Å; A206-F226 HydrophobicContact CB-CE1 3.53Å; A206-F226 HydrophobicContact CB-CE2 3.92Å; A206-F226 HydrophobicContact CB-CZ 3.15Å; T207-F226 WeakPolarHBondContact O-CD2 3.4Å; T207-F226 WeakPolarHBondContact O-CE2 3.3Å; F226-V228 PolarHBondContact O-N 3.2Å
227	P	40.7	Very low	49.3	Very low	11 Å²	11	52.3 Å²	52.3	7%	0.071	25%	0.254	C	S	.	.			trans	-77	114.6	-173.4	-1.9	9.3	0	0	0	114.6	M41 L205 T207 N225	M41-P227 HydrophobicContact CB-CB 4.3Å; M41-P227 HydrophobicContact CE-CB 3.59Å; M41-P227 HydrophobicContact CG-CB 3.45Å; M41-P227 VanDerWaalsContact CG-CB 3.45Å; M41-P227 HydrophobicContact SD-CB 3.4Å; M41-P227 WeakPolarHBondContact SD-CB 3.4Å; L205-P227 CarbonylContact C-O 3.58Å; L205-P227 VanDerWaalsContact C-O 3.28Å; L205-P227 HydrophobicContact CB-CB 4.01Å; L205-P227 HydrophobicContact CB-CG 4.27Å; L205-P227 PolarHBondContact N-O 3.18Å; L205-P227 VanDerWaalsContact N-O 3.1Å; L205-P227 CarbonylContact O-C 3.28Å; L205-P227 VanDerWaalsContact O-CB 3.32Å; L205-P227 WeakPolarHBondContact O-CB 3.34Å; L205-P227 WeakPolarHBondContact O-CD 3.43Å; L205-P227 WeakPolarHBondContact O-CG 3.46Å; T207-P227 WeakPolarHBondContact OG1-CD 2.95Å; N225-P227 VanDerWaalsContact O-CD 3.3Å; N225-P227 WeakPolarHBondContact O-CD 3.41Å
228	V	40.8	Very low	51.7	Low	61 Å²	61	48.6 Å²	48.6	37%	0.37	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	116.8	157	-178.9	0	0	0	0	107.1	Y204 F226	Y204-V228 HydrophobicContact CD1-CG1 4.19Å; Y204-V228 HydrophobicContact CD1-CG2 4.32Å; Y204-V228 HydrophobicContact CE1-CG1 4.13Å; F226-V228 PolarHBondContact O-N 3.2Å
229	G	47.8	Very low	53.6	Low	3 Å²	3	49.8 Å²	49.8	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.8	-174.7	0	0	0	0	0	112.1	M41 R203	M41-G229 WeakPolarHBondContact SD-CA 3.2Å; M41-G229 PolarHBondContact SD-N 2.62Å; R203-G229 PolarHBondContact N-O 3.27Å; R203-G229 PolarHBondContact O-N 3.4Å; R203-G229 VanDerWaalsContact O-O 3.1Å
230	I	51.2	Low	55.8	Low	13 Å²	13	48.8 Å²	48.8	7%	0.067	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	118	172.9	-64.4	166.3	0	0	0	107.9	I47 L49 V200 E202 L232	I47-I230 HydrophobicContact CD1-CB 4.36Å; I47-I230 HydrophobicContact CD1-CG2 3.84Å; I47-I230 HydrophobicContact CG1-CG2 4.46Å; L49-I230 HydrophobicContact CD1-CD1 4.11Å; L49-I230 HydrophobicContact CG-CD1 4.43Å; V200-I230 HydrophobicContact CB-CG2 4.32Å; V200-I230 HydrophobicContact CG1-CG2 3.62Å; V200-I230 HydrophobicContact CG2-CG2 4.24Å; E202-I230 HydrophobicContact CG-CG1 4.47Å; I230-L232 HydrophobicContact CG2-CD2 4.18Å
231	V	58.7	Low	57.7	Low	9 Å²	9	44.3 Å²	44.3	6%	0.055	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.6	168.1	177	0	0	0	0	108.6	N201 R203 F233 E248	N201-V231 HydrophobicContact CB-CB 4.47Å; N201-V231 PolarHBondContact N-O 3.02Å; N201-V231 PolarHBondContact O-N 3.3Å; R203-V231 HydrophobicContact CB-CG2 4.47Å; R203-V231 HydrophobicContact CG-CG2 4.03Å; V231-F233 HydrophobicContact CG1-CE2 4.3Å; V231-F233 HydrophobicContact CG1-CZ 4.25Å; V231-E248 HydrophobicContact CG1-CG 3.86Å; V231-E248 WeakPolarHBondContact CG1-OE1 3.26Å
232	L	63.3	Low	59.8	Low	3 Å²	3	45.1 Å²	45.1	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.5	173.3	-69.6	-178.8	0	0	0	111.5	I47 V64 Y83 Y198 V200 I230 I249	I47-L232 HydrophobicContact CD1-CD1 3.32Å; I47-L232 HydrophobicContact CD1-CD2 3.58Å; I47-L232 HydrophobicContact CD1-CG 3.42Å; I47-L232 VanDerWaalsContact CD1-CG 3.42Å; I47-L232 HydrophobicContact CG1-CD1 3.8Å; I47-L232 HydrophobicContact CG1-CG 3.99Å; V64-L232 HydrophobicContact CG2-CD2 3.98Å; Y83-L232 HydrophobicContact CD1-CD1 3.76Å; Y83-L232 HydrophobicContact CD2-CD1 4.32Å; Y83-L232 HydrophobicContact CE1-CD1 3.2Å; Y83-L232 HydrophobicContact CE2-CD1 3.84Å; Y83-L232 HydrophobicContact CG-CD1 4.27Å; Y83-L232 WeakPolarHBondContact OH-CD1 3.3Å; Y198-L232 HydrophobicContact CD1-CB 4.19Å; Y198-L232 HydrophobicContact CD1-CD1 4.16Å; Y198-L232 HydrophobicContact CG-CD1 4.2Å; V200-L232 HydrophobicContact CB-CD2 4.42Å; V200-L232 HydrophobicContact CG2-CD2 3.7Å; I230-L232 HydrophobicContact CG2-CD2 4.18Å; L232-I249 HydrophobicContact CB-CB 4.4Å; L232-I249 PolarHBondContact O-N 3.16Å
233	F	67.2	Low	61.6	Low	5 Å²	5	44.1 Å²	44.1	2%	0.022	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	123	165.4	-64.5	-75.4	0	0	0	109.3	Y198 I199 N201 V231 Y235 F245 E248	Y198-F233 CarbonylContact C-O 3.59Å; Y198-F233 VanDerWaalsContact CA-O 3.25Å; Y198-F233 WeakPolarHBondContact CA-O 3.24Å; I199-F233 PolarHBondContact N-O 3.38Å; I199-F233 PolarHBondContact O-N 3.49Å; N201-F233 HydrophobicContact CB-CD2 4.05Å; N201-F233 HydrophobicContact CB-CE2 3.6Å; V231-F233 HydrophobicContact CG1-CE2 4.3Å; V231-F233 HydrophobicContact CG1-CZ 4.25Å; F233-Y235 HydrophobicContact CB-CD2 4.24Å; F233-Y235 HydrophobicContact CB-CE2 3.37Å; F233-Y235 WeakPolarHBondContact O-CD2 3.4Å; F233-F245 HydrophobicContact CB-CE2 4.38Å; F233-F245 AromaticContact CD1-CE2 3.83Å; F233-F245 HydrophobicContact CD1-CE2 3.83Å; F233-F245 HydrophobicContact CD1-CZ 4.48Å; F233-E248 HydrophobicContact CD1-CB 3.94Å; F233-E248 HydrophobicContact CD1-CG 3.71Å; F233-E248 HydrophobicContact CE1-CB 4.04Å; F233-E248 VanDerWaalsContact CE1-CD 3.48Å; F233-E248 HydrophobicContact CE1-CG 3.57Å; F233-E248 HydrophobicContact CZ-CG 4.41Å
234	K	76.2	Confident	63.8	Low	60 Å²	60	46 Å²	46	26%	0.261	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	128.6	174.5	-172.3	-173.7	-179.4	-168.6	0	109.2	A196 Y198 A246 K247 I249	A196-K234 HydrophobicContact CB-CG 4.25Å; Y198-K234 HydrophobicContact CD1-CB 3.98Å; Y198-K234 HydrophobicContact CD1-CG 4.24Å; Y198-K234 HydrophobicContact CE1-CB 3.64Å; Y198-K234 HydrophobicContact CE1-CD 4.22Å; Y198-K234 HydrophobicContact CE1-CG 3.6Å; K234-A246 HydrophobicContact CB-CB 4.48Å; K234-A246 HydrophobicContact CD-CB 4.2Å; K234-A246 HydrophobicContact CG-CB 4.2Å; K234-A246 WeakPolarHBondContact O-CB 3.4Å; K234-A246 PolarHBondContact O-N 3.33Å; K234-K247 WeakPolarHBondContact CA-O 2.97Å; K234-K247 HydrophobicContact CB-CG 4.02Å; K234-K247 VanDerWaalsContact CB-O 3.25Å; K234-K247 WeakPolarHBondContact CB-O 3.07Å; K234-K247 HydrophobicContact CD-CG 4.17Å; K234-K247 PolarHBondContact N-O 2.84Å; K234-K247 PolarHBondContact O-N 3.37Å; K234-I249 HydrophobicContact CB-CD1 4.24Å; K234-I249 HydrophobicContact CB-CG1 4.01Å; K234-I249 HydrophobicContact CD-CD1 4.36Å
235	Y	74	Confident	65.9	Low	2 Å²	2	44.3 Å²	44.3	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	146.1	170	-61.6	-93.4	0	0	0	110.9	F171 L197 I199 F233 V243 E244 F245	F171-Y235 HydrophobicContact CB-CE1 4.48Å; L197-Y235 PolarHBondContact N-O 3.35Å; L197-Y235 PolarHBondContact O-N 3.46Å; I199-Y235 HydrophobicContact CB-CD2 4.37Å; I199-Y235 HydrophobicContact CB-CE2 3.87Å; I199-Y235 HydrophobicContact CD1-CD2 3.75Å; I199-Y235 HydrophobicContact CD1-CE2 3.37Å; I199-Y235 HydrophobicContact CG1-CD2 3.73Å; I199-Y235 HydrophobicContact CG1-CE2 3.57Å; F233-Y235 HydrophobicContact CB-CD2 4.24Å; F233-Y235 HydrophobicContact CB-CE2 3.37Å; F233-Y235 WeakPolarHBondContact O-CD2 3.4Å; Y235-V243 HydrophobicContact CD1-CG1 3.49Å; Y235-V243 VanDerWaalsContact CD1-CG1 3.49Å; Y235-V243 HydrophobicContact CE1-CG1 4.47Å; Y235-V243 HydrophobicContact CG-CG1 3.56Å; Y235-E244 CarbonylContact C-O 3.39Å; Y235-E244 VanDerWaalsContact CA-O 3.23Å; Y235-E244 WeakPolarHBondContact CA-O 3.32Å; Y235-F245 HydrophobicContact CD1-CB 4.09Å; Y235-F245 HydrophobicContact CD1-CD2 4.25Å; Y235-F245 HydrophobicContact CE1-CB 3.87Å; Y235-F245 AromaticContact CE1-CD2 3.68Å; Y235-F245 HydrophobicContact CE1-CD2 3.68Å; Y235-F245 HydrophobicContact CE1-CG 4.29Å; Y235-F245 AromaticContact CZ-CD2 3.91Å
236	K	79.2	Confident	67.8	Low	94 Å²	94	43 Å²	43	41%	0.409	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	138.6	169	-173	-172.7	173.9	-142.6	0	108.1	E238 V243 E244	K236-E238 VanDerWaalsContact CE-OE1 3.31Å; K236-E238 WeakPolarHBondContact CE-OE1 3.48Å; K236-E238 IonicContact NZ-OE1 2.68Å; K236-E238 PolarHBondContact NZ-OE1 2.94Å; K236-E238 IonicContact NZ-OE2 3.89Å; K236-V243 CarbonylContact O-C 3.56Å; K236-V243 WeakPolarHBondContact O-CA 3.11Å; K236-E244 HydrophobicContact CB-CB 4.37Å; K236-E244 PolarHBondContact N-O 3.1Å; K236-E244 PolarHBondContact O-N 2.9Å
237	L	75.8	Confident	69.8	Low	16 Å²	16	44.6 Å²	44.6	8%	0.084	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	124.7	174.2	-78.7	155.8	0	0	0	108.7	V178 L183 P194 L197 V243	V178-L237 HydrophobicContact CB-CD2 4.06Å; V178-L237 HydrophobicContact CG2-CD2 3.43Å; V178-L237 VanDerWaalsContact CG2-CD2 3.43Å; L183-L237 HydrophobicContact CD1-CD1 4.01Å; L183-L237 HydrophobicContact CD1-CD2 4.29Å; P194-L237 HydrophobicContact CG-CD1 4.16Å; L197-L237 HydrophobicContact CB-CD1 3.95Å; L197-L237 HydrophobicContact CB-CG 4.42Å; L237-V243 HydrophobicContact CD2-CG2 4.29Å
238	E	81.7	Confident	71.1	Confident	63 Å²	63	46.4 Å²	46.4	29%	0.294	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-84	161.4	169.6	-65.3	-56.5	144.8	0	0	110.7	I180 K236 D240 G241 K242	I180-E238 WeakPolarHBondContact CD1-O 3.4Å; K236-E238 VanDerWaalsContact CE-OE1 3.31Å; K236-E238 WeakPolarHBondContact CE-OE1 3.48Å; K236-E238 IonicContact NZ-OE1 2.68Å; K236-E238 PolarHBondContact NZ-OE1 2.94Å; K236-E238 IonicContact NZ-OE2 3.89Å; E238-D240 WeakPolarHBondContact CB-OD1 3Å; E238-D240 PolarHBondContact O-N 3.2Å; E238-D240 VanDerWaalsContact O-N 3.17Å; E238-G241 PolarHBondContact O-N 3.24Å; E238-G241 VanDerWaalsContact O-N 3.11Å; E238-K242 HydrophobicContact CB-CB 4.31Å; E238-K242 PolarHBondContact N-O 3.11Å
239	S	79.1	Confident	71.8	Confident	112 Å²	112	45.2 Å²	45.2	78%	0.783	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.9	-176.1	55.4	0	0	0	0	114.6	I180 G241	I180-S239 VanDerWaalsContact CD1-O 3.28Å; I180-S239 WeakPolarHBondContact CD1-O 3.46Å; S239-G241 VanDerWaalsContact C-N 3.34Å
240	D	82.9	Confident	72.1	Confident	70 Å²	70	49.7 Å²	49.7	37%	0.374	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	3.2	178.6	70.8	-15.6	0	0	0	113.5	R177 E238 K242	R177-D240 PolarHBondContact NE-O 3.34Å; R177-D240 PolarHBondContact NH2-O 3.36Å; R177-D240 VanDerWaalsContact NH2-O 3.11Å; E238-D240 WeakPolarHBondContact CB-OD1 3Å; E238-D240 PolarHBondContact O-N 3.2Å; E238-D240 VanDerWaalsContact O-N 3.17Å; D240-K242 VanDerWaalsContact OD1-CB 3.28Å; D240-K242 WeakPolarHBondContact OD1-CB 3.19Å; D240-K242 WeakPolarHBondContact OD1-CG 3.44Å; D240-K242 PolarHBondContact OD1-N 3.19Å; D240-K242 WeakPolarHBondContact OD2-CD 3.31Å; D240-K242 WeakPolarHBondContact OD2-CG 2.91Å
241	G	76.7	Confident	71.8	Confident	2 Å²	2	51.6 Å²	51.6	2%	0.021	27%	0.27	C	S	.	.	S	Bend	trans	89.8	-1.3	-178.8	0	0	0	0	0	113.7	R177 V178 E238 S239	R177-G241 CarbonylContact C-O 3.58Å; R177-G241 WeakPolarHBondContact CA-O 3.15Å; V178-G241 WeakPolarHBondContact CG2-O 3.43Å; V178-G241 PolarHBondContact N-O 2.94Å; E238-G241 PolarHBondContact O-N 3.24Å; E238-G241 VanDerWaalsContact O-N 3.11Å; S239-G241 VanDerWaalsContact C-N 3.34Å
242	K	81.7	Confident	70.6	Confident	83 Å²	83	59.1 Å²	59.1	36%	0.361	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-68	149	175.1	-74.5	-173.8	172.6	-153.5	0	111.5	D174 E238 D240	D174-K242 IonicContact OD1-NZ 2.89Å; D174-K242 PolarHBondContact OD1-NZ 3.26Å; E238-K242 HydrophobicContact CB-CB 4.31Å; E238-K242 PolarHBondContact N-O 3.11Å; D240-K242 VanDerWaalsContact OD1-CB 3.28Å; D240-K242 WeakPolarHBondContact OD1-CB 3.19Å; D240-K242 WeakPolarHBondContact OD1-CG 3.44Å; D240-K242 PolarHBondContact OD1-N 3.19Å; D240-K242 WeakPolarHBondContact OD2-CD 3.31Å; D240-K242 WeakPolarHBondContact OD2-CG 2.91Å
243	V	76.7	Confident	69	Low	4 Å²	4	64.9 Å²	64.9	2%	0.024	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.3	-178.6	-169.3	0	0	0	0	108.2	S173 L176 V178 Y235 K236 L237	S173-V243 CarbonylContact C-O 3.54Å; S173-V243 WeakPolarHBondContact CA-O 3.24Å; S173-V243 WeakPolarHBondContact CB-O 3.04Å; S173-V243 VanDerWaalsContact O-O 3.05Å; L176-V243 HydrophobicContact CB-CB 4.18Å; L176-V243 HydrophobicContact CB-CG2 3.82Å; L176-V243 PolarHBondContact O-N 3.04Å; V178-V243 HydrophobicContact CG2-CG2 3.04Å; Y235-V243 HydrophobicContact CD1-CG1 3.49Å; Y235-V243 VanDerWaalsContact CD1-CG1 3.49Å; Y235-V243 HydrophobicContact CE1-CG1 4.47Å; Y235-V243 HydrophobicContact CG-CG1 3.56Å; K236-V243 CarbonylContact O-C 3.56Å; K236-V243 WeakPolarHBondContact O-CA 3.11Å; L237-V243 HydrophobicContact CD2-CG2 4.29Å
244	E	79.9	Confident	67.4	Low	94 Å²	94	73 Å²	73	44%	0.439	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.6	173.5	-168.1	-172.5	-176.7	0	0	109.8	Y235 K236 A246	Y235-E244 CarbonylContact C-O 3.39Å; Y235-E244 VanDerWaalsContact CA-O 3.23Å; Y235-E244 WeakPolarHBondContact CA-O 3.32Å; K236-E244 HydrophobicContact CB-CB 4.37Å; K236-E244 PolarHBondContact N-O 3.1Å; K236-E244 PolarHBondContact O-N 2.9Å; E244-A246 PolarHBondContact O-N 3.16Å; E244-A246 VanDerWaalsContact O-N 3.14Å
245	F	78.1	Confident	65.1	Low	66 Å²	66	76.6 Å²	76.6	29%	0.289	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	115.6	174.2	177.1	-101.6	0	0	0	109.9	F233 Y235 K247	F233-F245 HydrophobicContact CB-CE2 4.38Å; F233-F245 AromaticContact CD1-CE2 3.83Å; F233-F245 HydrophobicContact CD1-CE2 3.83Å; F233-F245 HydrophobicContact CD1-CZ 4.48Å; Y235-F245 HydrophobicContact CD1-CB 4.09Å; Y235-F245 HydrophobicContact CD1-CD2 4.25Å; Y235-F245 HydrophobicContact CE1-CB 3.87Å; Y235-F245 AromaticContact CE1-CD2 3.68Å; Y235-F245 HydrophobicContact CE1-CD2 3.68Å; Y235-F245 HydrophobicContact CE1-CG 4.29Å; Y235-F245 AromaticContact CZ-CD2 3.91Å; F245-K247 VanDerWaalsContact CZ-C 3.49Å
246	A	77.2	Confident	63.2	Low	52 Å²	52	78.5 Å²	78.5	43%	0.43	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-54.8	-178.4	0	0	0	0	0	111.4	K234 E244	K234-A246 HydrophobicContact CB-CB 4.48Å; K234-A246 HydrophobicContact CD-CB 4.2Å; K234-A246 HydrophobicContact CG-CB 4.2Å; K234-A246 WeakPolarHBondContact O-CB 3.4Å; K234-A246 PolarHBondContact O-N 3.33Å; E244-A246 PolarHBondContact O-N 3.16Å; E244-A246 VanDerWaalsContact O-N 3.14Å
247	K	77.2	Confident	61	Low	114 Å²	114	82.5 Å²	82.5	50%	0.496	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	161.5	176.8	62.7	173.4	-176.9	169.7	0	111.8	K234 F245 I249	K234-K247 WeakPolarHBondContact CA-O 2.97Å; K234-K247 HydrophobicContact CB-CG 4.02Å; K234-K247 VanDerWaalsContact CB-O 3.25Å; K234-K247 WeakPolarHBondContact CB-O 3.07Å; K234-K247 HydrophobicContact CD-CG 4.17Å; K234-K247 PolarHBondContact N-O 2.84Å; K234-K247 PolarHBondContact O-N 3.37Å; F245-K247 VanDerWaalsContact CZ-C 3.49Å; K247-I249 HydrophobicContact CD-CG1 4.47Å; K247-I249 HydrophobicContact CG-CG1 4.25Å
248	E	67.9	Low	59	Low	48 Å²	48	88.9 Å²	88.9	22%	0.224	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	132.6	160.8	-166.8	175.2	155.1	0	0	109.6	V231 F233 R250	V231-E248 HydrophobicContact CG1-CG 3.86Å; V231-E248 WeakPolarHBondContact CG1-OE1 3.26Å; F233-E248 HydrophobicContact CD1-CB 3.94Å; F233-E248 HydrophobicContact CD1-CG 3.71Å; F233-E248 HydrophobicContact CE1-CB 4.04Å; F233-E248 VanDerWaalsContact CE1-CD 3.48Å; F233-E248 HydrophobicContact CE1-CG 3.57Å; F233-E248 HydrophobicContact CZ-CG 4.41Å; E248-R250 HydrophobicContact CG-CG 4.24Å; E248-R250 IonicContact OE1-CZ 3.82Å; E248-R250 IonicContact OE1-NE 2.74Å; E248-R250 PolarHBondContact OE1-NE 3.18Å; E248-R250 IonicContact OE1-NH2 2.78Å; E248-R250 PolarHBondContact OE1-NH2 3.09Å; E248-R250 IonicContact OE2-CZ 2.99Å; E248-R250 IonicContact OE2-NE 2.67Å; E248-R250 IonicContact OE2-NH2 3.18Å; E248-R250 PolarHBondContact OE2-NH2 3.29Å
249	I	55.7	Low	56.7	Low	36 Å²	36	91.6 Å²	91.6	19%	0.185	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	107.2	170.9	-56.8	-152.7	0	0	0	108.4	Y198 L232 K234 K247	Y198-I249 HydrophobicContact CD1-CD1 4.3Å; Y198-I249 HydrophobicContact CE1-CD1 3.36Å; Y198-I249 HydrophobicContact CE1-CG1 4.02Å; L232-I249 HydrophobicContact CB-CB 4.4Å; L232-I249 PolarHBondContact O-N 3.16Å; K234-I249 HydrophobicContact CB-CD1 4.24Å; K234-I249 HydrophobicContact CB-CG1 4.01Å; K234-I249 HydrophobicContact CD-CD1 4.36Å; K247-I249 HydrophobicContact CD-CG1 4.47Å; K247-I249 HydrophobicContact CG-CG1 4.25Å
250	R	54.4	Low	54.5	Low	98 Å²	98	92.6 Å²	92.6	37%	0.37	46%	0.46	S	S	.	.			trans	-103.1	130.3	157.3	-50	179.8	-175.2	-168.2	0.1	103.8	E45 E166 E248	E45-R250 HydrophobicContact CG-CB 4.18Å; E45-R250 WeakPolarHBondContact OE2-CA 3.34Å; E45-R250 VanDerWaalsContact OE2-CB 3.22Å; E45-R250 WeakPolarHBondContact OE2-CB 3.43Å; E166-R250 IonicContact OE1-CZ 3.62Å; E166-R250 IonicContact OE1-NH2 3.09Å; E166-R250 PolarHBondContact OE1-NH2 2.98Å; E248-R250 HydrophobicContact CG-CG 4.24Å; E248-R250 IonicContact OE1-CZ 3.82Å; E248-R250 IonicContact OE1-NE 2.74Å; E248-R250 PolarHBondContact OE1-NE 3.18Å; E248-R250 IonicContact OE1-NH2 2.78Å; E248-R250 PolarHBondContact OE1-NH2 3.09Å; E248-R250 IonicContact OE2-CZ 2.99Å; E248-R250 IonicContact OE2-NE 2.67Å; E248-R250 IonicContact OE2-NH2 3.18Å; E248-R250 PolarHBondContact OE2-NH2 3.29Å
251	G	44.6	Very low	52.5	Low	52 Å²	52	92.8 Å²	92.8	54%	0.536	46%	0.46	S	S	.	.			trans	-99.3	108	177.5	0	0	0	0	0	118.8	E45	E45-G251 WeakPolarHBondContact CB-O 3.27Å; E45-G251 VanDerWaalsContact CD-CA 3.44Å; E45-G251 VanDerWaalsContact CG-O 3.23Å; E45-G251 WeakPolarHBondContact CG-O 3.32Å; E45-G251 WeakPolarHBondContact OE2-CA 3.32Å; E45-G251 PolarHBondContact OE2-N 3.29Å
252	E	32.5	Very low	50.3	Low	167 Å²	167	96.7 Å²	96.7	78%	0.78	48%	0.484	S	S	*	.			trans	-46.9	127.7	-160.5	-70.2	174.8	179.6	0	0	120.2	E45	E45-E252 WeakPolarHBondContact OE1-CA 3.2Å; E45-E252 PolarHBondContact OE1-N 3.25Å; E45-E252 PolarHBondContact OE2-N 3.19Å
253	N	31	Very low	47.9	Very low	125 Å²	125	101.2 Å²	101.2	67%	0.668	51%	0.506	S	S	*	.			trans	95.5	139.6	156.7	-61.7	-55.9	0	0	0	119.8	E45	E45-N253 PolarHBondContact OE1-N 3.15Å
254	F	32.2	Very low	45.7	Very low	175 Å²	175	107.1 Å²	107.1	77%	0.768	54%	0.542	S	S	*	.			trans	161	146.1	133.2	-82.2	-66	0	0	0	111.6	L42	L42-F254 WeakPolarHBondContact CD2-O 3.49Å
255	T	29.1	Very low	43.2	Very low	135 Å²	135	108 Å²	108	83%	0.828	56%	0.556	S	S	*	*			trans	-104.3	150	-175.4	44	0	0	0	0	113.4
256	G	33.6	Very low	40.8	Very low	42 Å²	42	113.3 Å²	113.3	43%	0.433	58%	0.581	S	S	.	*			trans	-138.3	155.7	-174.3	0	0	0	0	0	114.2
257	E	32.3	Very low	38.6	Very low	179 Å²	179	117 Å²	117	84%	0.836	60%	0.601	S	S	*	*			trans	-126.5	143.3	-169.4	-66.5	-172.7	158.9	0	0	113.3
258	W	33.7	Very low	36.3	Very low	149 Å²	149	120.4 Å²	120.4	56%	0.564	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-74.1	127.6	173	-72.7	87.1	0	0	0	111.3	Y223	Y223-W258 AromaticContact CD2-CD2 3.64Å; Y223-W258 HydrophobicContact CD2-CD2 3.64Å; Y223-W258 AromaticContact CD2-CE2 3.54Å; Y223-W258 AromaticContact CD2-CE3 3.67Å; Y223-W258 HydrophobicContact CD2-CE3 3.67Å; Y223-W258 HydrophobicContact CD2-CG 4.4Å; Y223-W258 AromaticContact CD2-CH2 3.52Å; Y223-W258 HydrophobicContact CD2-CH2 3.52Å; Y223-W258 AromaticContact CD2-CZ2 3.49Å; Y223-W258 HydrophobicContact CD2-CZ2 3.49Å; Y223-W258 VanDerWaalsContact CD2-CZ2 3.49Å; Y223-W258 AromaticContact CD2-CZ3 3.61Å; Y223-W258 HydrophobicContact CD2-CZ3 3.61Å; Y223-W258 HydrophobicContact CE2-CD2 4.07Å; Y223-W258 AromaticContact CE2-CE2 3.68Å; Y223-W258 HydrophobicContact CE2-CH2 4.29Å; Y223-W258 AromaticContact CE2-CZ2 3.8Å; Y223-W258 HydrophobicContact CE2-CZ2 3.8Å; Y223-W258 AromaticContact CE2-NE1 3.93Å; Y223-W258 HydrophobicContact CG-CH2 4.16Å; Y223-W258 HydrophobicContact CG-CZ2 4.49Å; Y223-W258 HydrophobicContact CG-CZ3 4.19Å
259	K	34.1	Very low	34.4	Very low	120 Å²	120	127.5 Å²	127.5	52%	0.522	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.8	129.6	171.2	-71.3	-172.2	-168.8	154.8	0	112	E224	E224-K259 WeakPolarHBondContact OE2-CD 3.3Å; E224-K259 WeakPolarHBondContact OE2-CE 3.21Å; E224-K259 IonicContact OE2-NZ 2.72Å; E224-K259 PolarHBondContact OE2-NZ 3.31Å
260	R	33.4	Very low	33	Very low	134 Å²	134	134.5 Å²	134.5	51%	0.506	68%	0.684	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.1	122.5	171.6	-177.4	178.4	179.2	-165.4	-8.6	108.8	F221 T262	F221-R260 HydrophobicContact CD1-CB 4.32Å; F221-R260 HydrophobicContact CD1-CG 4.46Å; F221-R260 HydrophobicContact CE1-CB 4.05Å; F221-R260 HydrophobicContact CE1-CG 3.94Å; R260-T262 HydrophobicContact CG-CG2 4.25Å; R260-T262 PolarHBondContact O-N 3.27Å
261	I	39.7	Very low	31.8	Very low	74 Å²	74	138.1 Å²	138.1	38%	0.379	71%	0.71	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.6	100.7	168.7	-53.4	-168.2	0	0	0	106.5	Q220 V222	Q220-I261 PolarHBondContact O-N 3.44Å; V222-I261 HydrophobicContact CB-CD1 3.77Å; V222-I261 HydrophobicContact CB-CG1 4.27Å; V222-I261 HydrophobicContact CG2-CD1 3.23Å; V222-I261 HydrophobicContact CG2-CG1 4.1Å
262	T	32	Very low	31	Very low	84 Å²	84	138.9 Å²	138.9	52%	0.515	72%	0.718	S	S	.	*			trans	-106.5	131.2	172.5	6.9	0	0	0	0	110.2	R260	R260-T262 HydrophobicContact CG-CG2 4.25Å; R260-T262 PolarHBondContact O-N 3.27Å
263	Q	30.3	Very low	30.8	Very low	178 Å²	178	140.2 Å²	140.2	83%	0.832	72%	0.724	S	S	*	*			trans	88.9	84.1	169.1	-60.8	-179.5	-6.8	0	0	116.1
264	T	30.7	Very low	30.6	Very low	128 Å²	128	138.7 Å²	138.7	79%	0.785	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-53.6	125.2	143.3	-28.3	0	0	0	0	107.8	Q266	T264-Q266 PolarHBondContact O-N 3.19Å
265	P	27.4	Very low	30.7	Very low	111 Å²	111	136 Å²	136	72%	0.721	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-58.8	132.3	166.2	-13.1	26.6	0	0	0	107.4
266	Q	27.7	Very low	30.7	Very low	178 Å²	178	136.8 Å²	136.8	83%	0.832	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-57.5	134.8	165.9	-77.7	-174.6	-28.6	0	0	107.6	T264 E268	T264-Q266 PolarHBondContact O-N 3.19Å; Q266-E268 PolarHBondContact O-N 3.48Å; Q266-E268 VanDerWaalsContact O-N 3.16Å
267	P	31.7	Very low	30.4	Very low	131 Å²	131	137.9 Å²	137.9	85%	0.851	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-58.2	124.2	172.5	-17.2	29.1	0	0	0	108.4
268	E	29.1	Very low	30.4	Very low	185 Å²	185	139 Å²	139	86%	0.864	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-53.1	146.1	173.6	-69.3	176.2	156.7	0	0	110.8	Q266 Q270	Q266-E268 PolarHBondContact O-N 3.48Å; Q266-E268 VanDerWaalsContact O-N 3.16Å; E268-Q270 PolarHBondContact O-N 3.23Å
269	E	27.7	Very low	30.2	Very low	196 Å²	196	140.1 Å²	140.1	92%	0.916	76%	0.761	S	S	*	*			trans	-34.4	105.1	171.6	-68.3	167.4	140.4	0	0	112.9
270	Q	27	Very low	30.1	Very low	184 Å²	184	139.9 Å²	139.9	86%	0.86	77%	0.772	S	S	*	*			trans	-131.3	98.7	153.5	-76.1	-172.1	4.5	0	0	107.5	E268	E268-Q270 PolarHBondContact O-N 3.23Å
271	L	28	Very low	29.9	Very low	174 Å²	174	138.2 Å²	138.2	91%	0.911	78%	0.781	S	S	*	*			trans	-166.2	83.9	140.7	-98.5	161	0	0	0	107.2
272	G	28.1	Very low	29.6	Very low	68 Å²	68	139.4 Å²	139.4	70%	0.701	80%	0.802	S	S	*	*			trans	-82	128.2	159.7	0	0	0	0	0	109.9
273	E	28.6	Very low	29.4	Very low	194 Å²	194	141.2 Å²	141.2	91%	0.907	82%	0.815	S	S	*	*			trans	72	135.4	153.3	-58.4	-177.8	162.1	0	0	117.9
274	A	27.3	Very low	29.3	Very low	93 Å²	93	138.3 Å²	138.3	77%	0.769	81%	0.814	S	S	*	*			cis	-159.9	178.2	27.6	0	0	0	0	0	111.5
275	P	32.7	Very low	29.4	Very low	119 Å²	119	138.2 Å²	138.2	77%	0.773	82%	0.816	S	S	*	*			trans	-95.2	-168.6	-144.9	40.6	-40.1	0	0	0	116.1
276	V	29.2	Very low	29.6	Very low	152 Å²	152	142.6 Å²	142.6	92%	0.921	82%	0.824	S	S	*	*			trans	104	121.2	176	-173.3	0	0	0	0	111.4
277	G	28.2	Very low	29.7	Very low	65 Å²	65	145.9 Å²	145.9	67%	0.67	83%	0.828	S	S	*	*			cis	179.3	160.5	4	0	0	0	0	0	108.2
278	E	31	Very low	29.8	Very low	201 Å²	201	149 Å²	149	94%	0.939	83%	0.829	S	S	*	*			trans	68.5	106.7	164.9	-61.1	-175.4	166.9	0	0	119.8
279	E	30.6	Very low	29.8	Very low	173 Å²	173	150.1 Å²	150.1	81%	0.808	83%	0.831	S	S	*	*			trans	-69.5	155.2	157.1	-128.6	-176	177.8	0	0	110.1
280	P	32.1	Very low	30	Very low	116 Å²	116	145.5 Å²	145.5	75%	0.753	83%	0.826	S	S	*	*				-150.4	141.8	79.6	34.8	-14	0	0	0	117.7
281	S	29.1	Very low	30.2	Very low	99 Å²	99	145.4 Å²	145.4	69%	0.692	83%	0.826	S	S	*	*				49.4	102.9	128.1	-46.7	0	0	0	0	121.1
282	A	32.8	Very low	30.3	Very low	99 Å²	99	141.8 Å²	141.8	82%	0.818	82%	0.815	S	S	*	*			trans	-157	153.1	144.2	0	0	0	0	0	111.5
283	P	28.7	Very low	30.4	Very low	121 Å²	121	144.4 Å²	144.4	79%	0.786	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-90.9	152.7	-139.7	34.6	-35.4	0	0	0	115.8
284	S	26.8	Very low	30.5	Very low	118 Å²	118	146.3 Å²	146.3	83%	0.825	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-60.7	130.6	176.8	-50.4	0	0	0	0	113.7
285	P	34.7	Very low	30.8	Very low	126 Å²	126	148.2 Å²	148.2	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-82.4	131.5	165.9	-3	21.2	0	0	0	110.6	R287	P285-R287 PolarHBondContact O-N 3.39Å
286	K	30.5	Very low	30.8	Very low	203 Å²	203	147.6 Å²	147.6	88%	0.883	82%	0.816	S	S	*	*			trans	-43.6	123.9	176.9	-67.5	172.8	177.6	175.5	0	113.2	K288	K286-K288 PolarHBondContact O-N 3.47Å; K286-K288 VanDerWaalsContact O-N 3.08Å
287	R	29.9	Very low	30.9	Very low	246 Å²	246	144.9 Å²	144.9	93%	0.928	80%	0.797	S	S	*	*			trans	-59.2	104.8	170.1	-162.2	175.8	-174.7	177.9	2.2	109.9	P285 K289	P285-R287 PolarHBondContact O-N 3.39Å; R287-K289 PolarHBondContact O-N 3.17Å
288	K	33	Very low	31.2	Very low	198 Å²	198	147.2 Å²	147.2	86%	0.861	79%	0.793	S	S	*	*			trans	-64.8	124.3	164.4	-75.9	-176.8	177.9	178.2	0	107.9	K286 A290	K286-K288 PolarHBondContact O-N 3.47Å; K286-K288 VanDerWaalsContact O-N 3.08Å; K288-A290 PolarHBondContact O-N 2.9Å; K288-A290 VanDerWaalsContact O-N 3.08Å
289	K	30.7	Very low	31.4	Very low	208 Å²	208	147.1 Å²	147.1	90%	0.904	78%	0.784	S	S	*	*			trans	-56.1	112.3	169.3	-78.7	-179.4	175.8	179.1	0	108	R287 Q291	R287-K289 PolarHBondContact O-N 3.17Å; K289-Q291 PolarHBondContact O-N 3.12Å
290	A	31.5	Very low	31.9	Very low	99 Å²	99	145.7 Å²	145.7	82%	0.818	78%	0.781	S	S	*	*			trans	-63.8	115.8	172.7	0	0	0	0	0	108.6	K288 S292	K288-A290 PolarHBondContact O-N 2.9Å; K288-A290 VanDerWaalsContact O-N 3.08Å; A290-S292 PolarHBondContact O-N 3.04Å
291	Q	29.8	Very low	32.1	Very low	182 Å²	182	146.4 Å²	146.4	85%	0.85	78%	0.778	S	S	*	*			trans	-61.8	125.4	162.2	-81.9	173.6	-26.6	0	0	107.9	K289	K289-Q291 PolarHBondContact O-N 3.12Å
292	S	30.7	Very low	32.2	Very low	98 Å²	98	150 Å²	150	69%	0.685	78%	0.782	S	S	*	*			trans	-50.2	125.2	168.3	153.3	0	0	0	0	109.6	A290 R294	A290-S292 PolarHBondContact O-N 3.04Å; S292-R294 PolarHBondContact O-N 3.07Å; S292-R294 VanDerWaalsContact O-N 3.15Å
293	P	31.6	Very low	32.2	Very low	122 Å²	122	149 Å²	149	79%	0.792	77%	0.768	S	S	*	*			trans	-68.4	112.5	168.8	-10.5	25.6	0	0	0	107.7	T295	P293-T295 PolarHBondContact O-N 3.31Å
294	R	30.1	Very low	32.2	Very low	234 Å²	234	149 Å²	149	88%	0.883	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-60.1	122.7	168.7	-80.1	179.5	171	170.1	-3.4	108.8	S292	S292-R294 PolarHBondContact O-N 3.07Å; S292-R294 VanDerWaalsContact O-N 3.15Å
295	T	34	Very low	32.6	Very low	134 Å²	134	153.2 Å²	153.2	82%	0.822	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-57.1	125.1	166.5	-35.4	0	0	0	0	108.6	P293 D297	P293-T295 PolarHBondContact O-N 3.31Å; T295-D297 PolarHBondContact O-N 3.39Å
296	P	31.9	Very low	32.5	Very low	105 Å²	105	156.7 Å²	156.7	68%	0.682	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-69.3	132.1	175.7	25.8	-29.6	0	0	0	109.9	L298	P296-L298 PolarHBondContact O-N 2.75Å
297	D	32.1	Very low	32.5	Very low	95 Å²	95	152.1 Å²	152.1	51%	0.508	77%	0.768	S	S	.	*			trans	-73.2	108.8	177.8	-170.2	-11	0	0	0	110.1	T295 R299 L300	T295-D297 PolarHBondContact O-N 3.39Å; D297-R299 PolarHBondContact O-N 3.15Å; D297-R299 WeakPolarHBondContact OD1-CB 3.33Å; D297-R299 WeakPolarHBondContact OD1-CG 3.39Å; D297-R299 PolarHBondContact OD1-N 3.16Å; D297-R299 VanDerWaalsContact OD1-N 3.15Å; D297-L300 PolarHBondContact O-N 3.14Å
298	L	33	Very low	32.7	Very low	114 Å²	114	150.1 Å²	150.1	60%	0.597	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-69.1	-8.6	-176.8	-66.9	169.9	0	0	0	113.5	P296 L300 L301	P296-L298 PolarHBondContact O-N 2.75Å; L298-L300 PolarHBondContact O-N 3.24Å; L298-L301 HydrophobicContact CD2-CD1 3.81Å; L298-L301 PolarHBondContact O-N 3.19Å
299	R	36.2	Very low	32.8	Very low	200 Å²	200	146.2 Å²	146.2	76%	0.755	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-68.8	-18.9	176.6	-63.3	174.1	-171	165.5	3.4	113.2	D297 L301	D297-R299 PolarHBondContact O-N 3.15Å; D297-R299 WeakPolarHBondContact OD1-CB 3.33Å; D297-R299 WeakPolarHBondContact OD1-CG 3.39Å; D297-R299 PolarHBondContact OD1-N 3.16Å; D297-R299 VanDerWaalsContact OD1-N 3.15Å; R299-L301 VanDerWaalsContact C-N 3.3Å
300	L	40.9	Very low	32.9	Very low	142 Å²	142	141.9 Å²	141.9	74%	0.743	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-76.7	-14.4	175.5	-71.4	168.6	0	0	0	113.5	D297 L298	D297-L300 PolarHBondContact O-N 3.14Å; L298-L300 PolarHBondContact O-N 3.24Å
301	L	35.9	Very low	33.5	Very low	131 Å²	131	147 Å²	147	69%	0.686	76%	0.755	S	S	*	*	S	Bend	trans	-87.3	-16.6	179.6	-71.8	167.2	0	0	0	113.7	L298 R299	L298-L301 HydrophobicContact CD2-CD1 3.81Å; L298-L301 PolarHBondContact O-N 3.19Å; R299-L301 VanDerWaalsContact C-N 3.3Å
302	F	32.4	Very low	34	Very low	175 Å²	175	150.9 Å²	150.9	77%	0.768	77%	0.774	S	S	*	*	S	Bend	trans	-116.8	18.7	-176.9	-62.1	-73.7	0	0	0	114
303	S	31	Very low	34.2	Very low	77 Å²	77	153.6 Å²	153.6	54%	0.538	78%	0.778	S	S	.	*	S	Bend	trans	-73.1	126.4	170.8	-67.7	0	0	0	0	109.8	K305	S303-K305 PolarHBondContact O-N 3.08Å; S303-K305 VanDerWaalsContact O-N 3.07Å
304	P	30.1	Very low	34.4	Very low	121 Å²	121	155.2 Å²	155.2	79%	0.786	78%	0.777	S	S	*	*			trans	-58.2	119.1	174.4	-14.2	25.5	0	0	0	108.1	K306	P304-K306 PolarHBondContact O-N 3.2Å
305	K	35.1	Very low	34.6	Very low	207 Å²	207	150.8 Å²	150.8	90%	0.9	77%	0.772	S	S	*	*			trans	-59.5	107.7	170.7	-79.4	-177.4	178.5	173.8	0	107.1	S303 S307	S303-K305 PolarHBondContact O-N 3.08Å; S303-K305 VanDerWaalsContact O-N 3.07Å; K305-S307 PolarHBondContact O-N 3.5Å
306	K	32.3	Very low	34.6	Very low	200 Å²	200	151.8 Å²	151.8	87%	0.87	77%	0.769	S	S	*	*			trans	-49.9	116.3	163.2	-82.4	-176.9	175.7	179.6	0	107.1	P304 K308	P304-K306 PolarHBondContact O-N 3.2Å; K306-K308 PolarHBondContact O-N 3.38Å; K306-K308 VanDerWaalsContact O-N 3.14Å
307	S	31.2	Very low	34.8	Very low	107 Å²	107	154.8 Å²	154.8	75%	0.748	77%	0.774	S	S	*	*			trans	-51	117.8	168.3	42.5	0	0	0	0	108.3	K305 T309	K305-S307 PolarHBondContact O-N 3.5Å; S307-T309 PolarHBondContact O-N 3.29Å
308	K	34.2	Very low	35	Very low	204 Å²	204	158.7 Å²	158.7	89%	0.887	79%	0.792	S	S	*	*			trans	-76.9	100.1	158.8	-82	-174	176.4	-178.9	0	106.1	K306	K306-K308 PolarHBondContact O-N 3.38Å; K306-K308 VanDerWaalsContact O-N 3.14Å
309	T	33.9	Very low	35.1	Very low	116 Å²	116	161.9 Å²	161.9	71%	0.712	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-54.2	129.9	159.6	-26	0	0	0	0	107.8	S307 K311	S307-T309 PolarHBondContact O-N 3.29Å; T309-K311 PolarHBondContact O-N 3.08Å
310	P	34.1	Very low	35	Very low	116 Å²	116	159 Å²	159	75%	0.753	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-62.8	126	165.3	-8.5	23.6	0	0	0	106.9	Q312	P310-Q312 PolarHBondContact O-N 3.37Å
311	K	43.4	Very low	34.5	Very low	206 Å²	206	160.4 Å²	160.4	90%	0.896	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-66	134.1	165.5	-81.2	-174.3	173.9	-175	0	107.9	T309	T309-K311 PolarHBondContact O-N 3.08Å
312	Q	41	Very low	34.4	Very low	265 Å²	265	163.1 Å²	163.1	100%	1.238	83%	0.827	S	S	*	*			trans	-50.4	0	162.5	-70.1	174.1	-31.9	0	0	111.4	P310	P310-Q312 PolarHBondContact O-N 3.37Å

Retrieved 312 of 312 residues in 466.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).