A0A077ZJP1_TRITR Loading...

RuvB-like helicase

AlphaFold DB , UniProt , Accession A0A077ZJP1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 446 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.9	Very low	30.1	Very low	240 Å²	240	142.6 Å²	142.6	100%	1.182	79%	0.787	S	S	*	*				0	104.5	0	-84.6	174.2	170.9	0	0	106.3	S3	M1-S3 PolarHBondContact O-N 2.71Å; M1-S3 VanDerWaalsContact O-N 3.13Å
2	N	33.7	Very low	30	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	79%	0.787	S	S	*	*			trans	-67.2	105.7	-171.3	-68.6	-10.9	0	0	0	109.4	D4	N2-D4 VanDerWaalsContact C-N 3.31Å; N2-D4 PolarHBondContact O-N 3.31Å
3	S	35.6	Very low	30.2	Very low	109 Å²	109	151.8 Å²	151.8	76%	0.762	80%	0.795	S	S	*	*			trans	-75.5	95.6	157.4	55	0	0	0	0	106.5	M1 V5	M1-S3 PolarHBondContact O-N 2.71Å; M1-S3 VanDerWaalsContact O-N 3.13Å; S3-V5 PolarHBondContact O-N 2.77Å
4	D	33.9	Very low	31.4	Very low	136 Å²	136	146.4 Å²	146.4	73%	0.727	77%	0.766	S	S	*	*			trans	-49.8	109.5	164.2	-70.1	-43.7	0	0	0	108	N2 V6	N2-D4 VanDerWaalsContact C-N 3.31Å; N2-D4 PolarHBondContact O-N 3.31Å; D4-V6 PolarHBondContact O-N 2.84Å
5	V	33.8	Very low	33.4	Very low	134 Å²	134	141.5 Å²	141.5	81%	0.812	75%	0.749	S	S	*	*			trans	-61.3	96.5	155	177.6	0	0	0	0	103.5	S3 A7	S3-V5 PolarHBondContact O-N 2.77Å; V5-A7 PolarHBondContact O-N 3.2Å
6	V	30.4	Very low	35.4	Very low	124 Å²	124	136.2 Å²	136.2	75%	0.752	73%	0.731	S	S	*	*			trans	-55.7	95.8	159.3	178.6	0	0	0	0	103.3	D4 S8	D4-V6 PolarHBondContact O-N 2.84Å; V6-S8 PolarHBondContact O-N 2.83Å
7	A	28.6	Very low	37.8	Very low	73 Å²	73	131.1 Å²	131.1	60%	0.603	70%	0.702	S	S	*	*			trans	-52.7	98.7	164.8	0	0	0	0	0	103.3	V5 T9	V5-A7 PolarHBondContact O-N 3.2Å; A7-T9 PolarHBondContact O-N 3.42Å; A7-T9 PolarHBondContact O-OG1 2.8Å
8	S	26.6	Very low	39.7	Very low	103 Å²	103	127.9 Å²	127.9	72%	0.72	69%	0.692	S	S	*	*			trans	-55.6	100.1	169.2	48.6	0	0	0	0	102.7	V6 Q10	V6-S8 PolarHBondContact O-N 2.83Å; S8-Q10 PolarHBondContact O-N 2.76Å
9	T	25.8	Very low	41.8	Very low	106 Å²	106	124.5 Å²	124.5	65%	0.65	67%	0.671	S	S	*	*			trans	-65	99.1	-179.8	-42.5	0	0	0	0	100.9	A7 W11	A7-T9 PolarHBondContact O-N 3.42Å; A7-T9 PolarHBondContact O-OG1 2.8Å; T9-W11 VanDerWaalsContact O-CD1 3.25Å; T9-W11 PolarHBondContact O-N 3.39Å
10	Q	25.3	Very low	43.9	Very low	172 Å²	172	118.4 Å²	118.4	80%	0.804	64%	0.638	S	S	*	*			trans	-57.4	93.7	169.5	-100.6	-173.6	-9.5	0	0	103.3	S8 Q12	S8-Q10 PolarHBondContact O-N 2.76Å; Q10-Q12 PolarHBondContact O-N 2.8Å
11	W	25.1	Very low	45.9	Very low	221 Å²	221	120.3 Å²	120.3	84%	0.837	64%	0.64	S	S	*	*			trans	-65.8	88.1	170.6	-74.7	4	0	0	0	103.5	T9 R13	T9-W11 VanDerWaalsContact O-CD1 3.25Å; T9-W11 PolarHBondContact O-N 3.39Å; W11-R13 PolarHBondContact O-N 2.84Å
12	Q	28.2	Very low	48.7	Very low	168 Å²	168	111.9 Å²	111.9	79%	0.785	60%	0.6	S	S	*	*			trans	-54.6	101.2	162.1	-81.3	-176.4	-16.3	0	0	104.2	Q10 I14	Q10-Q12 PolarHBondContact O-N 2.8Å; Q12-I14 PolarHBondContact O-N 3.27Å
13	R	32.7	Very low	51.6	Low	236 Å²	236	104.7 Å²	104.7	89%	0.891	56%	0.562	S	S	*	*			trans	-53	113.2	169.5	-76.9	-179.4	175	163.3	-1.5	104.9	W11 S15	W11-R13 PolarHBondContact O-N 2.84Å; R13-S15 PolarHBondContact O-N 3.39Å
14	I	47.7	Very low	54.3	Low	77 Å²	77	99.8 Å²	99.8	40%	0.395	53%	0.528	S	S	.	.			trans	-65.3	90	-179.7	-59.3	173.4	0	0	0	106.2	Q12 A16 A378 E379	Q12-I14 PolarHBondContact O-N 3.27Å; I14-A16 PolarHBondContact O-N 2.82Å; I14-A378 VanDerWaalsContact CD1-O 3.28Å; I14-A378 WeakPolarHBondContact CD1-O 3.38Å; I14-E379 HydrophobicContact CD1-CG 4.48Å
15	S	61.3	Low	57.3	Low	73 Å²	73	94.8 Å²	94.8	51%	0.51	50%	0.501	S	S	.	.			trans	-54.7	141.9	171.6	177.3	0	0	0	0	107.7	R13 H17 S18	R13-S15 PolarHBondContact O-N 3.39Å; S15-H17 PolarHBondContact O-N 2.85Å; S15-S18 PolarHBondContact O-N 3.25Å; S15-S18 PolarHBondContact O-OG 3.02Å
16	A	65.4	Low	60.1	Low	56 Å²	56	91 Å²	91	46%	0.463	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-24.5	-176.3	0	0	0	0	0	112.8	I14 H19	I14-A16 PolarHBondContact O-N 2.82Å; A16-H19 PolarHBondContact O-CE1 2.94Å; A16-H19 PolarHBondContact O-ND1 3.17Å
17	H	75.3	Confident	62.9	Low	50 Å²	50	94.4 Å²	94.4	23%	0.231	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	14.4	-175.6	-56.1	-55.9	0	0	0	114.6	S15 H19 V20 L80	S15-H17 PolarHBondContact O-N 2.85Å; H17-H19 PolarHBondContact O-N 2.8Å; H17-H19 VanDerWaalsContact O-N 3.13Å; H17-V20 HydrophobicContact CB-CG2 4.33Å; H17-V20 WeakPolarHBondContact O-CB 3.45Å; H17-V20 PolarHBondContact O-N 3.41Å; H17-V20 VanDerWaalsContact O-N 3.09Å; H17-L80 HydrophobicContact CB-CD1 3.5Å
18	S	72.4	Confident	65.8	Low	74 Å²	74	97.2 Å²	97.2	52%	0.517	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21	179.3	50.5	0	0	0	0	114.9	S15 V20	S15-S18 PolarHBondContact O-N 3.25Å; S15-S18 PolarHBondContact O-OG 3.02Å; S18-V20 VanDerWaalsContact C-N 3.35Å
19	H	79.2	Confident	68.7	Low	63 Å²	63	96.5 Å²	96.5	29%	0.292	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-15	178.3	58.3	-87.6	0	0	0	113.7	A16 H17 G37	A16-H19 PolarHBondContact O-CE1 2.94Å; A16-H19 PolarHBondContact O-ND1 3.17Å; H17-H19 PolarHBondContact O-N 2.8Å; H17-H19 VanDerWaalsContact O-N 3.13Å; H19-G37 PolarHBondContact CD2-O 3.47Å
20	V	83.4	Confident	71.9	Confident	2 Å²	2	96.7 Å²	96.7	1%	0.012	47%	0.465	C	S	.	.			trans	-78.2	125.4	179.8	-178.3	0	0	0	0	108.8	H17 S18 F38 A77 A81 Q84	H17-V20 HydrophobicContact CB-CG2 4.33Å; H17-V20 WeakPolarHBondContact O-CB 3.45Å; H17-V20 PolarHBondContact O-N 3.41Å; H17-V20 VanDerWaalsContact O-N 3.09Å; S18-V20 VanDerWaalsContact C-N 3.35Å; V20-F38 HydrophobicContact CG1-CD2 4.36Å; V20-F38 HydrophobicContact CG1-CE2 3.46Å; V20-F38 VanDerWaalsContact CG1-CE2 3.46Å; V20-F38 HydrophobicContact CG1-CZ 3.72Å; V20-F38 HydrophobicContact CG2-CE2 4.48Å; V20-F38 HydrophobicContact CG2-CZ 4.31Å; V20-A77 HydrophobicContact CG2-CB 4.07Å; V20-A81 HydrophobicContact CG1-CB 3.74Å; V20-Q84 PolarHBondContact O-NE2 2.78Å; V20-Q84 PolarHBondContact O-OE1 2.92Å; V20-Q84 VanDerWaalsContact O-OE1 3.1Å
21	K	86	Confident	75.2	Confident	159 Å²	159	89 Å²	89	69%	0.691	43%	0.431	S	S	*	.			trans	-117.2	-35.6	-176.5	-64	-175.2	-178.8	-178.8	0	113.8	G36 Q84	K21-G36 PolarHBondContact N-O 3.35Å; K21-Q84 WeakPolarHBondContact O-CB 2.93Å; K21-Q84 PolarHBondContact O-OE1 3.05Å
22	D	91.8	Very high	78.5	Confident	62 Å²	62	83.8 Å²	83.8	33%	0.332	41%	0.414	S	S	.	.	S	Bend	trans	-162.1	-179.1	-177.5	60	56.8	0	0	0	108.9	G24 G36 F38 E85	D22-G24 VanDerWaalsContact C-N 3.27Å; D22-G24 PolarHBondContact O-N 3.28Å; D22-G24 VanDerWaalsContact OD1-CA 3.26Å; D22-G24 WeakPolarHBondContact OD1-CA 3.16Å; D22-G24 PolarHBondContact OD1-N 3.09Å; D22-G36 WeakPolarHBondContact O-CA 3.33Å; D22-G36 WeakPolarHBondContact OD1-CA 3.37Å; D22-F38 WeakPolarHBondContact O-CE2 3.46Å; D22-E85 HydrophobicContact CB-CG 4.47Å; D22-E85 WeakPolarHBondContact CB-OE1 3.42Å
23	L	94.5	Very high	81.5	Confident	1 Å²	1	80.3 Å²	80.3	1%	0.005	41%	0.406	C	S	.	.			trans	-78.5	-7.5	-179.4	-76.6	170.8	0	0	0	113.7	L25 R45 A48 V52 A81 I82 E85	L23-L25 HydrophobicContact CB-CD1 4.08Å; L23-L25 HydrophobicContact CB-CD2 4.17Å; L23-L25 HydrophobicContact CB-CG 3.76Å; L23-L25 HydrophobicContact CD1-CD1 4.26Å; L23-R45 HydrophobicContact CD2-CG 4.35Å; L23-R45 WeakPolarHBondContact O-CD 3.45Å; L23-R45 PolarHBondContact O-NH1 3.05Å; L23-A48 HydrophobicContact CD1-CB 3.78Å; L23-A48 HydrophobicContact CD2-CB 3.63Å; L23-A48 HydrophobicContact CG-CB 4.41Å; L23-V52 HydrophobicContact CD1-CG2 3.99Å; L23-A81 HydrophobicContact CD2-CB 3.52Å; L23-A81 HydrophobicContact CG-CB 3.91Å; L23-I82 HydrophobicContact CD1-CG1 4.38Å; L23-I82 HydrophobicContact CD2-CG1 4.48Å; L23-E85 HydrophobicContact CB-CG 4.18Å; L23-E85 HydrophobicContact CD1-CG 3.96Å; L23-E85 HydrophobicContact CG-CG 3.88Å; L23-E85 PolarHBondContact N-OE1 2.77Å
24	G	93.9	Very high	84.4	Confident	6 Å²	6	73.7 Å²	73.7	6%	0.062	39%	0.388	C	S	.	.			trans	66.1	38.2	179.9	0	0	0	0	0	113.5	D22 K32 R45	D22-G24 VanDerWaalsContact C-N 3.27Å; D22-G24 PolarHBondContact O-N 3.28Å; D22-G24 VanDerWaalsContact OD1-CA 3.26Å; D22-G24 WeakPolarHBondContact OD1-CA 3.16Å; D22-G24 PolarHBondContact OD1-N 3.09Å; G24-K32 PolarHBondContact O-N 2.88Å; G24-R45 PolarHBondContact O-NH1 3.32Å
25	L	94.9	Very high	86.4	Confident	30 Å²	30	71 Å²	71	16%	0.157	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-88.1	152.2	-179.5	-52.2	-179.3	0	0	0	111.4	L23 M30 A31 R45 G49	L23-L25 HydrophobicContact CB-CD1 4.08Å; L23-L25 HydrophobicContact CB-CD2 4.17Å; L23-L25 HydrophobicContact CB-CG 3.76Å; L23-L25 HydrophobicContact CD1-CD1 4.26Å; L25-M30 CarbonylContact C-O 3.6Å; L25-M30 WeakPolarHBondContact CA-O 3.43Å; L25-A31 HydrophobicContact CD2-CB 3.77Å; L25-R45 HydrophobicContact CD2-CB 4.41Å; L25-G49 VanDerWaalsContact CD1-CA 3.49Å
26	D	92.9	Very high	87.6	Confident	55 Å²	55	68.2 Å²	68.2	29%	0.294	36%	0.362	S	S	.	.			trans	-87.7	-176.7	166.6	68.9	15.5	0	0	0	112.3	N28 R29 M30 K32	D26-N28 PolarHBondContact O-N 2.86Å; D26-N28 WeakPolarHBondContact OD1-CA 3.24Å; D26-N28 WeakPolarHBondContact OD1-CB 3.22Å; D26-N28 PolarHBondContact OD1-N 2.81Å; D26-R29 PolarHBondContact O-N 3.27Å; D26-R29 PolarHBondContact OD1-N 2.79Å; D26-M30 VanDerWaalsContact CG-O 3.31Å; D26-M30 PolarHBondContact N-O 2.98Å; D26-M30 PolarHBondContact OD1-N 2.82Å; D26-K32 HydrophobicContact CB-CG 4.46Å
27	E	89.5	Confident	88.7	Confident	195 Å²	195	67 Å²	67	91%	0.911	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.2	179.5	-62.4	175.3	-171.2	0	0	113	R29	E27-R29 VanDerWaalsContact C-N 3.32Å
28	N	89.8	Confident	89.5	Confident	133 Å²	133	65.2 Å²	65.2	71%	0.711	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	10.5	178	-63.9	-41.3	0	0	0	112.8	D26 M30	D26-N28 PolarHBondContact O-N 2.86Å; D26-N28 WeakPolarHBondContact OD1-CA 3.24Å; D26-N28 WeakPolarHBondContact OD1-CB 3.22Å; D26-N28 PolarHBondContact OD1-N 2.81Å; N28-M30 HydrophobicContact CB-CG 4.39Å; N28-M30 PolarHBondContact O-N 2.83Å
29	R	88.4	Confident	90.5	Very high	88 Å²	88	62.2 Å²	62.2	33%	0.332	33%	0.325	S	S	.	.	S	Bend	trans	63.9	21.5	-175.5	-54.5	-59.8	-164.4	160.7	4	114.3	D26 E27 D53	D26-R29 PolarHBondContact O-N 3.27Å; D26-R29 PolarHBondContact OD1-N 2.79Å; E27-R29 VanDerWaalsContact C-N 3.32Å; R29-D53 IonicContact CZ-OD1 3.01Å; R29-D53 IonicContact CZ-OD2 3.75Å; R29-D53 IonicContact NE-OD1 3.6Å; R29-D53 IonicContact NE-OD2 3.8Å; R29-D53 PolarHBondContact NE-OD2 3.16Å; R29-D53 VanDerWaalsContact NE-OD2 3.15Å; R29-D53 IonicContact NH1-OD1 2.62Å; R29-D53 IonicContact NH2-OD1 3.23Å; R29-D53 PolarHBondContact NH2-OD1 3.46Å; R29-D53 IonicContact NH2-OD2 3.62Å; R29-D53 PolarHBondContact NH2-OD2 3.09Å
30	M	92.8	Very high	91.2	Very high	110 Å²	110	59.3 Å²	59.3	54%	0.542	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-95.2	131	175.7	-62.1	-60.2	-71.3	0	0	110.3	L25 D26 N28 K32	L25-M30 CarbonylContact C-O 3.6Å; L25-M30 WeakPolarHBondContact CA-O 3.43Å; D26-M30 VanDerWaalsContact CG-O 3.31Å; D26-M30 PolarHBondContact N-O 2.98Å; D26-M30 PolarHBondContact OD1-N 2.82Å; N28-M30 HydrophobicContact CB-CG 4.39Å; N28-M30 PolarHBondContact O-N 2.83Å; M30-K32 PolarHBondContact O-N 3.41Å
31	A	94.9	Very high	91.7	Very high	10 Å²	10	59.9 Å²	59.9	8%	0.083	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-70.1	120.5	179.1	0	0	0	0	0	111.7	L25 T42 R45 S46	L25-A31 HydrophobicContact CD2-CB 3.77Å; A31-T42 HydrophobicContact CB-CG2 4.31Å; A31-T42 VanDerWaalsContact CB-O 3.28Å; A31-T42 WeakPolarHBondContact CB-O 3.37Å; A31-T42 WeakPolarHBondContact O-CG2 3.42Å; A31-R45 HydrophobicContact CB-CB 3.67Å; A31-S46 PolarHBondContact N-OG 2.83Å; A31-S46 VanDerWaalsContact N-OG 3.09Å
32	K	93.3	Very high	92.2	Very high	111 Å²	111	55.1 Å²	55.1	48%	0.483	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-67.9	141.6	172.9	-63.7	179.2	-176.6	175.6	0	109.7	G24 D26 M30 L34 R45	G24-K32 PolarHBondContact O-N 2.88Å; D26-K32 HydrophobicContact CB-CG 4.46Å; M30-K32 PolarHBondContact O-N 3.41Å; K32-L34 WeakPolarHBondContact CB-O 3.37Å; K32-L34 PolarHBondContact O-N 2.65Å; K32-R45 PolarHBondContact O-NH1 2.88Å; K32-R45 PolarHBondContact O-NH2 3.03Å
33	P	91.9	Very high	92.3	Very high	95 Å²	95	59.2 Å²	59.2	62%	0.617	32%	0.316	S	S	*	.	S	Bend	trans	-51.9	-34.2	-179.6	-28.5	34.9	0	0	0	114.3	G40	P33-G40 PolarHBondContact O-N 3.08Å
34	L	92.1	Very high	92.5	Very high	98 Å²	98	59.2 Å²	59.2	51%	0.513	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.3	169.4	-66.7	168.3	0	0	0	108.5	K32 V39 K370	K32-L34 WeakPolarHBondContact CB-O 3.37Å; K32-L34 PolarHBondContact O-N 2.65Å; L34-V39 HydrophobicContact CD2-CB 4.1Å; L34-V39 HydrophobicContact CD2-CG1 3.94Å; L34-V39 HydrophobicContact CD2-CG2 3.7Å; L34-K370 HydrophobicContact CD2-CG 3.88Å
35	G	90.6	Very high	92.6	Very high	20 Å²	20	59 Å²	59	21%	0.206	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.7	149.4	-179.6	0	0	0	0	0	112.5	G37 F38	G35-G37 PolarHBondContact O-N 3.27Å; G35-G37 VanDerWaalsContact O-N 3.08Å; G35-F38 PolarHBondContact N-O 2.79Å; G35-F38 WeakPolarHBondContact O-CB 3.21Å; G35-F38 PolarHBondContact O-N 2.82Å
36	G	85.8	Confident	92.7	Very high	14 Å²	14	58.4 Å²	58.4	14%	0.144	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	12.8	176.1	0	0	0	0	0	116.2	K21 D22	K21-G36 PolarHBondContact N-O 3.35Å; D22-G36 WeakPolarHBondContact O-CA 3.33Å; D22-G36 WeakPolarHBondContact OD1-CA 3.37Å
37	G	88.5	Confident	92.9	Very high	32 Å²	32	57.4 Å²	57.4	33%	0.33	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-3.3	-169.3	0	0	0	0	0	114.1	H19 G35	H19-G37 PolarHBondContact CD2-O 3.47Å; G35-G37 PolarHBondContact O-N 3.27Å; G35-G37 VanDerWaalsContact O-N 3.08Å
38	F	93.2	Very high	93.2	Very high	12 Å²	12	48.2 Å²	48.2	5%	0.053	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	152.4	176.4	-69.7	-89.5	0	0	0	113.4	V20 D22 G35 A77 I78 A81	V20-F38 HydrophobicContact CG1-CD2 4.36Å; V20-F38 HydrophobicContact CG1-CE2 3.46Å; V20-F38 VanDerWaalsContact CG1-CE2 3.46Å; V20-F38 HydrophobicContact CG1-CZ 3.72Å; V20-F38 HydrophobicContact CG2-CE2 4.48Å; V20-F38 HydrophobicContact CG2-CZ 4.31Å; D22-F38 WeakPolarHBondContact O-CE2 3.46Å; G35-F38 PolarHBondContact N-O 2.79Å; G35-F38 WeakPolarHBondContact O-CB 3.21Å; G35-F38 PolarHBondContact O-N 2.82Å; F38-A77 HydrophobicContact CE1-CB 3.66Å; F38-A77 HydrophobicContact CZ-CB 3.98Å; F38-A77 WeakPolarHBondContact CZ-O 3.27Å; F38-I78 HydrophobicContact CE1-CG1 3.96Å; F38-I78 HydrophobicContact CZ-CG1 4.26Å; F38-A81 HydrophobicContact CE2-CB 3.59Å; F38-A81 HydrophobicContact CZ-CB 3.74Å
39	V	93.2	Very high	93.5	Very high	10 Å²	10	41.9 Å²	41.9	6%	0.061	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126	164	-175.9	0	0	0	0	107.2	L34 Y363 E367 K370 I371 I374	L34-V39 HydrophobicContact CD2-CB 4.1Å; L34-V39 HydrophobicContact CD2-CG1 3.94Å; L34-V39 HydrophobicContact CD2-CG2 3.7Å; V39-Y363 WeakPolarHBondContact O-CE1 3.43Å; V39-E367 HydrophobicContact CG1-CB 3.92Å; V39-E367 HydrophobicContact CG1-CG 4.06Å; V39-K370 HydrophobicContact CG1-CB 3.99Å; V39-K370 HydrophobicContact CG1-CG 4.16Å; V39-K370 HydrophobicContact CG2-CB 4.29Å; V39-K370 HydrophobicContact CG2-CG 3.91Å; V39-I371 HydrophobicContact CB-CD1 4.2Å; V39-I371 HydrophobicContact CB-CG1 3.6Å; V39-I371 HydrophobicContact CG1-CG1 4.18Å; V39-I371 HydrophobicContact CG2-CG1 3.71Å; V39-I374 HydrophobicContact CG2-CD1 3.59Å
40	G	93.5	Very high	93.8	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.021	24%	0.242	C	C	.	.	S	Bend	trans	67.8	-149.9	177.3	0	0	0	0	0	113.5	P33 T42 R45 E367	P33-G40 PolarHBondContact O-N 3.08Å; G40-T42 PolarHBondContact O-N 3.16Å; G40-R45 VanDerWaalsContact O-CZ 3.3Å; G40-R45 PolarHBondContact O-NE 3.27Å; G40-R45 PolarHBondContact O-NH2 2.83Å; G40-E367 WeakPolarHBondContact CA-OE1 3.42Å
41	Q	94.8	Very high	93.8	Very high	15 Å²	15	36.5 Å²	36.5	7%	0.07	22%	0.218	C	C	.	.			trans	45.9	43.6	-173.4	-70.3	-64	27.3	0	0	114.1	A44 R45 T73 M361 Y363	Q41-A44 HydrophobicContact CB-CB 4.39Å; Q41-A44 PolarHBondContact O-N 3.15Å; Q41-R45 WeakPolarHBondContact O-CB 2.84Å; Q41-R45 VanDerWaalsContact O-CG 3.3Å; Q41-R45 WeakPolarHBondContact O-CG 3.43Å; Q41-R45 PolarHBondContact O-N 2.76Å; Q41-R45 PolarHBondContact O-NE 3.21Å; Q41-T73 PolarHBondContact NE2-O 2.96Å; Q41-M361 PolarHBondContact NE2-O 3.13Å; Q41-Y363 HydrophobicContact CG-CE1 3.75Å
42	T	95.2	Very high	93.7	Very high	58 Å²	58	36 Å²	36	36%	0.356	21%	0.214	S	C	.	.	H	α-helix	trans	-62.9	-46.8	-174.4	49.9	0	0	0	0	111.4	A31 G40 A44 R45 S46	A31-T42 HydrophobicContact CB-CG2 4.31Å; A31-T42 VanDerWaalsContact CB-O 3.28Å; A31-T42 WeakPolarHBondContact CB-O 3.37Å; A31-T42 WeakPolarHBondContact O-CG2 3.42Å; G40-T42 PolarHBondContact O-N 3.16Å; T42-A44 PolarHBondContact O-N 2.84Å; T42-R45 PolarHBondContact O-N 2.79Å; T42-S46 WeakPolarHBondContact O-CB 2.95Å; T42-S46 PolarHBondContact O-N 2.93Å; T42-S46 PolarHBondContact O-OG 2.93Å; T42-S46 VanDerWaalsContact O-OG 3.09Å
43	E	95.2	Very high	93.7	Very high	149 Å²	149	32.4 Å²	32.4	70%	0.696	20%	0.2	S	C	*	.	H	α-helix	trans	-59.9	-47.9	178.6	-64.5	-178.2	176.8	0	0	112.5	R45 S46 A47	E43-R45 VanDerWaalsContact C-N 3.32Å; E43-R45 PolarHBondContact O-N 3.06Å; E43-S46 PolarHBondContact O-N 3.41Å; E43-A47 WeakPolarHBondContact O-CB 3.44Å; E43-A47 PolarHBondContact O-N 3.44Å
44	A	97.1	Very high	93.6	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-65.4	-36.2	-179.4	0	0	0	0	0	112.1	Q41 T42 A48 I78 V358 T360	Q41-A44 HydrophobicContact CB-CB 4.39Å; Q41-A44 PolarHBondContact O-N 3.15Å; T42-A44 PolarHBondContact O-N 2.84Å; A44-A48 WeakPolarHBondContact O-CB 3.45Å; A44-A48 PolarHBondContact O-N 2.69Å; A44-I78 HydrophobicContact CB-CD1 3.73Å; A44-V358 HydrophobicContact CB-CG1 3.93Å; A44-T360 HydrophobicContact CB-CG2 4.17Å
45	R	97.1	Very high	93.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-73.3	-40.6	176.3	-71.8	-172.7	-61.2	126.8	-8.1	112.6	L23 G24 L25 A31 K32 G40 Q41 T42 E43 A47 A48 G49 I78	L23-R45 HydrophobicContact CD2-CG 4.35Å; L23-R45 WeakPolarHBondContact O-CD 3.45Å; L23-R45 PolarHBondContact O-NH1 3.05Å; G24-R45 PolarHBondContact O-NH1 3.32Å; L25-R45 HydrophobicContact CD2-CB 4.41Å; A31-R45 HydrophobicContact CB-CB 3.67Å; K32-R45 PolarHBondContact O-NH1 2.88Å; K32-R45 PolarHBondContact O-NH2 3.03Å; G40-R45 VanDerWaalsContact O-CZ 3.3Å; G40-R45 PolarHBondContact O-NE 3.27Å; G40-R45 PolarHBondContact O-NH2 2.83Å; Q41-R45 WeakPolarHBondContact O-CB 2.84Å; Q41-R45 VanDerWaalsContact O-CG 3.3Å; Q41-R45 WeakPolarHBondContact O-CG 3.43Å; Q41-R45 PolarHBondContact O-N 2.76Å; Q41-R45 PolarHBondContact O-NE 3.21Å; T42-R45 PolarHBondContact O-N 2.79Å; E43-R45 VanDerWaalsContact C-N 3.32Å; E43-R45 PolarHBondContact O-N 3.06Å; R45-A47 VanDerWaalsContact C-N 3.32Å; R45-A47 PolarHBondContact O-N 2.53Å; R45-A48 WeakPolarHBondContact O-CB 3.39Å; R45-A48 PolarHBondContact O-N 2.87Å; R45-G49 PolarHBondContact O-N 2.87Å; R45-I78 HydrophobicContact CG-CG1 4.44Å
46	S	96.4	Very high	93.4	Very high	19 Å²	19	30.5 Å²	30.5	13%	0.133	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-43.7	172.7	-63.4	0	0	0	0	110.8	A31 T42 E43 A48 G49 V50	A31-S46 PolarHBondContact N-OG 2.83Å; A31-S46 VanDerWaalsContact N-OG 3.09Å; T42-S46 WeakPolarHBondContact O-CB 2.95Å; T42-S46 PolarHBondContact O-N 2.93Å; T42-S46 PolarHBondContact O-OG 2.93Å; T42-S46 VanDerWaalsContact O-OG 3.09Å; E43-S46 PolarHBondContact O-N 3.41Å; S46-A48 PolarHBondContact O-N 2.92Å; S46-G49 WeakPolarHBondContact O-CA 3.2Å; S46-G49 PolarHBondContact O-N 3.46Å; S46-G49 VanDerWaalsContact O-N 3.1Å; S46-V50 PolarHBondContact O-N 2.93Å; S46-V50 VanDerWaalsContact O-N 3.08Å
47	A	96.7	Very high	93.5	Very high	34 Å²	34	35.1 Å²	35.1	28%	0.281	19%	0.194	S	C	.	.	H	α-helix	trans	-62	-41	174.2	0	0	0	0	0	112.4	E43 R45 G49 V50 I51 V358	E43-A47 WeakPolarHBondContact O-CB 3.44Å; E43-A47 PolarHBondContact O-N 3.44Å; R45-A47 VanDerWaalsContact C-N 3.32Å; R45-A47 PolarHBondContact O-N 2.53Å; A47-G49 VanDerWaalsContact C-N 3.28Å; A47-G49 PolarHBondContact O-N 2.83Å; A47-V50 WeakPolarHBondContact O-CB 3.2Å; A47-V50 PolarHBondContact O-N 2.8Å; A47-I51 WeakPolarHBondContact O-CG1 3.49Å; A47-I51 PolarHBondContact O-N 2.95Å; A47-V358 HydrophobicContact CB-CG1 3.92Å; A47-V358 HydrophobicContact CB-CG2 3.9Å
48	A	96.5	Very high	93.3	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-35.7	172.4	0	0	0	0	0	112.4	L23 A44 R45 S46 I51 V52 I78 I82	L23-A48 HydrophobicContact CD1-CB 3.78Å; L23-A48 HydrophobicContact CD2-CB 3.63Å; L23-A48 HydrophobicContact CG-CB 4.41Å; A44-A48 WeakPolarHBondContact O-CB 3.45Å; A44-A48 PolarHBondContact O-N 2.69Å; R45-A48 WeakPolarHBondContact O-CB 3.39Å; R45-A48 PolarHBondContact O-N 2.87Å; S46-A48 PolarHBondContact O-N 2.92Å; A48-I51 WeakPolarHBondContact O-CB 3.39Å; A48-I51 PolarHBondContact O-N 2.84Å; A48-V52 WeakPolarHBondContact O-CG2 3.37Å; A48-V52 PolarHBondContact O-N 3.21Å; A48-I78 HydrophobicContact CB-CG2 3.73Å; A48-I82 HydrophobicContact CB-CD1 3.8Å; A48-I82 HydrophobicContact CB-CG1 3.77Å
49	G	95.4	Very high	92.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-44.5	172.1	0	0	0	0	0	112.7	L25 R45 S46 A47 I51 V52 D53	L25-G49 VanDerWaalsContact CD1-CA 3.49Å; R45-G49 PolarHBondContact O-N 2.87Å; S46-G49 WeakPolarHBondContact O-CA 3.2Å; S46-G49 PolarHBondContact O-N 3.46Å; S46-G49 VanDerWaalsContact O-N 3.1Å; A47-G49 VanDerWaalsContact C-N 3.28Å; A47-G49 PolarHBondContact O-N 2.83Å; G49-I51 VanDerWaalsContact C-N 3.31Å; G49-I51 PolarHBondContact O-N 2.86Å; G49-V52 WeakPolarHBondContact O-CB 3.26Å; G49-V52 PolarHBondContact O-N 2.81Å; G49-D53 PolarHBondContact O-N 3.06Å
50	V	94.7	Very high	92.4	Very high	80 Å²	80	50.6 Å²	50.6	49%	0.485	25%	0.247	S	C	.	.	H	α-helix	trans	-62.4	-39.8	174.2	178.8	0	0	0	0	111	S46 A47 D53 L54	S46-V50 PolarHBondContact O-N 2.93Å; S46-V50 VanDerWaalsContact O-N 3.08Å; A47-V50 WeakPolarHBondContact O-CB 3.2Å; A47-V50 PolarHBondContact O-N 2.8Å; V50-D53 PolarHBondContact O-N 2.79Å; V50-L54 HydrophobicContact CG1-CD1 4.32Å; V50-L54 HydrophobicContact CG1-CG 4.44Å; V50-L54 WeakPolarHBondContact O-CG 3.31Å; V50-L54 PolarHBondContact O-N 3.34Å
51	I	94	Very high	91.5	Very high	5 Å²	5	54.7 Å²	54.7	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-47.1	174.6	-70.2	160.4	0	0	0	110.8	A47 A48 G49 D53 L54 V55 V65 V358	A47-I51 WeakPolarHBondContact O-CG1 3.49Å; A47-I51 PolarHBondContact O-N 2.95Å; A48-I51 WeakPolarHBondContact O-CB 3.39Å; A48-I51 PolarHBondContact O-N 2.84Å; G49-I51 VanDerWaalsContact C-N 3.31Å; G49-I51 PolarHBondContact O-N 2.86Å; I51-D53 PolarHBondContact O-N 2.88Å; I51-L54 PolarHBondContact O-N 2.64Å; I51-V55 HydrophobicContact CG2-CG2 4.4Å; I51-V55 VanDerWaalsContact O-CG2 3.24Å; I51-V55 WeakPolarHBondContact O-CG2 3.26Å; I51-V55 PolarHBondContact O-N 3.21Å; I51-V65 HydrophobicContact CD1-CB 4.36Å; I51-V65 HydrophobicContact CD1-CG1 3.61Å; I51-V65 HydrophobicContact CD1-CG2 3.76Å; I51-V65 HydrophobicContact CG1-CG2 4.13Å; I51-V65 HydrophobicContact CG2-CG2 3.96Å; I51-V358 HydrophobicContact CD1-CG2 3.81Å
52	V	93.3	Very high	90.7	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-55.4	-41.9	175.6	167.9	0	0	0	0	110.9	L23 A48 G49 V55 K56 I82 E85 L86	L23-V52 HydrophobicContact CD1-CG2 3.99Å; A48-V52 WeakPolarHBondContact O-CG2 3.37Å; A48-V52 PolarHBondContact O-N 3.21Å; G49-V52 WeakPolarHBondContact O-CB 3.26Å; G49-V52 PolarHBondContact O-N 2.81Å; V52-V55 WeakPolarHBondContact O-CB 3.31Å; V52-V55 PolarHBondContact O-N 3.34Å; V52-K56 HydrophobicContact CG1-CD 3.99Å; V52-K56 WeakPolarHBondContact O-CG 3.11Å; V52-K56 PolarHBondContact O-N 2.84Å; V52-I82 HydrophobicContact CG2-CB 4.34Å; V52-I82 HydrophobicContact CG2-CG1 4.37Å; V52-I82 HydrophobicContact CG2-CG2 3.87Å; V52-E85 HydrophobicContact CG1-CB 4.09Å; V52-E85 HydrophobicContact CG2-CB 3.81Å; V52-L86 HydrophobicContact CG1-CD2 4.06Å
53	D	91.9	Very high	90.4	Very high	34 Å²	34	58.4 Å²	58.4	18%	0.182	30%	0.296	C	S	.	.	H	α-helix	trans	-69.3	-41.4	178.7	-72.3	-16.1	0	0	0	112.4	R29 G49 V50 I51 V55 K56 Q57	R29-D53 IonicContact CZ-OD1 3.01Å; R29-D53 IonicContact CZ-OD2 3.75Å; R29-D53 IonicContact NE-OD1 3.6Å; R29-D53 IonicContact NE-OD2 3.8Å; R29-D53 PolarHBondContact NE-OD2 3.16Å; R29-D53 VanDerWaalsContact NE-OD2 3.15Å; R29-D53 IonicContact NH1-OD1 2.62Å; R29-D53 IonicContact NH2-OD1 3.23Å; R29-D53 PolarHBondContact NH2-OD1 3.46Å; R29-D53 IonicContact NH2-OD2 3.62Å; R29-D53 PolarHBondContact NH2-OD2 3.09Å; G49-D53 PolarHBondContact O-N 3.06Å; V50-D53 PolarHBondContact O-N 2.79Å; I51-D53 PolarHBondContact O-N 2.88Å; D53-V55 VanDerWaalsContact C-N 3.27Å; D53-V55 PolarHBondContact O-N 3.12Å; D53-K56 PolarHBondContact O-N 3.23Å; D53-Q57 WeakPolarHBondContact O-CB 3.38Å; D53-Q57 WeakPolarHBondContact O-CG 3.47Å; D53-Q57 PolarHBondContact O-N 3.44Å
54	L	91.3	Very high	90.4	Very high	39 Å²	39	51.4 Å²	51.4	20%	0.204	26%	0.263	C	S	.	.	H	α-helix	trans	-60.3	-38.7	173.7	-71.7	172.8	0	0	0	111.9	V50 I51 K58 R59 M60 L356	V50-L54 HydrophobicContact CG1-CD1 4.32Å; V50-L54 HydrophobicContact CG1-CG 4.44Å; V50-L54 WeakPolarHBondContact O-CG 3.31Å; V50-L54 PolarHBondContact O-N 3.34Å; I51-L54 PolarHBondContact O-N 2.64Å; L54-K58 PolarHBondContact O-N 3.37Å; L54-R59 HydrophobicContact CD2-CB 4.13Å; L54-R59 PolarHBondContact O-N 3.02Å; L54-M60 HydrophobicContact CB-CG 3.9Å; L54-M60 HydrophobicContact CB-SD 3.79Å; L54-M60 HydrophobicContact CD1-SD 4.07Å; L54-L356 HydrophobicContact CD1-CD1 4.07Å
55	V	89.5	Confident	90.4	Very high	26 Å²	26	51.3 Å²	51.3	16%	0.158	26%	0.263	C	S	.	.	H	α-helix	trans	-64.6	-52.5	174.9	170.7	0	0	0	0	110.5	I51 V52 D53 Q57 K58 M60 L86 I324	I51-V55 HydrophobicContact CG2-CG2 4.4Å; I51-V55 VanDerWaalsContact O-CG2 3.24Å; I51-V55 WeakPolarHBondContact O-CG2 3.26Å; I51-V55 PolarHBondContact O-N 3.21Å; V52-V55 WeakPolarHBondContact O-CB 3.31Å; V52-V55 PolarHBondContact O-N 3.34Å; D53-V55 VanDerWaalsContact C-N 3.27Å; D53-V55 PolarHBondContact O-N 3.12Å; V55-Q57 PolarHBondContact O-N 2.9Å; V55-K58 PolarHBondContact O-N 3.04Å; V55-M60 HydrophobicContact CB-CG 4.46Å; V55-M60 HydrophobicContact CG2-CG 3.68Å; V55-L86 HydrophobicContact CB-CD2 3.85Å; V55-L86 HydrophobicContact CG1-CD1 3.94Å; V55-L86 HydrophobicContact CG1-CD2 3.43Å; V55-L86 VanDerWaalsContact CG1-CD2 3.43Å; V55-L86 HydrophobicContact CG1-CG 4.36Å; V55-I324 HydrophobicContact CB-CD1 4.08Å; V55-I324 HydrophobicContact CG1-CD1 3.39Å; V55-I324 HydrophobicContact CG1-CG1 4.31Å; V55-I324 HydrophobicContact CG2-CD1 3.46Å; V55-I324 VanDerWaalsContact CG2-CD1 3.46Å; V55-I324 HydrophobicContact CG2-CG1 3.83Å; V55-I324 HydrophobicContact CG2-CG2 4.47Å
56	K	88.3	Confident	90.4	Very high	109 Å²	109	51.3 Å²	51.3	47%	0.474	26%	0.263	S	S	.	.	H	α-helix	trans	-59.2	-32.5	179.5	-74	175.7	179.1	172.1	0	111.8	V52 D53 K58 E85 L86	V52-K56 HydrophobicContact CG1-CD 3.99Å; V52-K56 WeakPolarHBondContact O-CG 3.11Å; V52-K56 PolarHBondContact O-N 2.84Å; D53-K56 PolarHBondContact O-N 3.23Å; K56-K58 VanDerWaalsContact C-N 3.32Å; K56-E85 WeakPolarHBondContact CE-O 3.49Å; K56-E85 PolarHBondContact NZ-O 3.4Å; K56-L86 HydrophobicContact CG-CD2 4.21Å
57	Q	88.5	Confident	90.5	Very high	110 Å²	110	50.5 Å²	50.5	51%	0.514	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	1.7	175.5	-67	174.8	21.5	0	0	114.5	D53 V55 R59	D53-Q57 WeakPolarHBondContact O-CB 3.38Å; D53-Q57 WeakPolarHBondContact O-CG 3.47Å; D53-Q57 PolarHBondContact O-N 3.44Å; V55-Q57 PolarHBondContact O-N 2.9Å; Q57-R59 VanDerWaalsContact C-N 3.28Å; Q57-R59 HydrophobicContact CB-CG 4.2Å; Q57-R59 PolarHBondContact O-N 3.49Å
58	K	84	Confident	90.5	Very high	191 Å²	191	49.2 Å²	49.2	83%	0.83	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	34	-177.7	-55.2	-177.7	179	-178.1	0	113.9	L54 V55 K56	L54-K58 PolarHBondContact O-N 3.37Å; V55-K58 PolarHBondContact O-N 3.04Å; K56-K58 VanDerWaalsContact C-N 3.32Å
59	R	83.9	Confident	90.5	Very high	169 Å²	169	50 Å²	50	64%	0.638	25%	0.254	S	S	*	.			trans	-104.8	15.1	-178.2	-68.9	-176.3	173.8	-171.1	-2.2	114.3	L54 Q57	L54-R59 HydrophobicContact CD2-CB 4.13Å; L54-R59 PolarHBondContact O-N 3.02Å; Q57-R59 VanDerWaalsContact C-N 3.28Å; Q57-R59 HydrophobicContact CB-CG 4.2Å; Q57-R59 PolarHBondContact O-N 3.49Å
60	M	83	Confident	90.3	Very high	19 Å²	19	52.2 Å²	52.2	9%	0.094	27%	0.269	C	S	.	.			trans	-95.5	3.9	179.3	-73.1	-64.6	-63.3	0	0	114.5	L54 V55 G62 R63 V65 L356	L54-M60 HydrophobicContact CB-CG 3.9Å; L54-M60 HydrophobicContact CB-SD 3.79Å; L54-M60 HydrophobicContact CD1-SD 4.07Å; V55-M60 HydrophobicContact CB-CG 4.46Å; V55-M60 HydrophobicContact CG2-CG 3.68Å; M60-G62 PolarHBondContact O-N 3.15Å; M60-R63 HydrophobicContact CE-CB 4.23Å; M60-R63 PolarHBondContact O-N 3.49Å; M60-V65 HydrophobicContact CE-CG2 3.98Å; M60-L356 HydrophobicContact CE-CD1 4.34Å; M60-L356 HydrophobicContact SD-CD1 4.13Å
61	A	75.6	Confident	90	Very high	89 Å²	89	51.9 Å²	51.9	74%	0.736	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	129.4	-177.8	0	0	0	0	0	111.8	R63	A61-R63 PolarHBondContact O-N 3.37Å
62	G	77.8	Confident	89.8	Confident	26 Å²	26	53 Å²	53	27%	0.268	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	6.5	-179.5	0	0	0	0	0	115.5	M60 L317	M60-G62 PolarHBondContact O-N 3.15Å; G62-L317 WeakPolarHBondContact CA-O 3.47Å; G62-L317 PolarHBondContact N-O 2.87Å
63	R	88.4	Confident	89.7	Confident	125 Å²	125	53 Å²	53	47%	0.472	28%	0.278	S	S	.	.			trans	-116.5	148.8	-178.9	-60.5	-178.2	-177.4	-161.8	-2	111	M60 A61 R354	M60-R63 HydrophobicContact CE-CB 4.23Å; M60-R63 PolarHBondContact O-N 3.49Å; A61-R63 PolarHBondContact O-N 3.37Å; R63-R354 WeakPolarHBondContact CA-O 3.32Å
64	A	94.4	Very high	89.7	Confident	1 Å²	1	52 Å²	52	1%	0.008	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	169.1	170.2	0	0	0	0	0	110	L317 V325 R354 L355 L356	A64-L317 HydrophobicContact CB-CD1 3.9Å; A64-L317 HydrophobicContact CB-CD2 3.99Å; A64-V325 WeakPolarHBondContact CA-O 3.3Å; A64-V325 HydrophobicContact CB-CB 3.96Å; A64-V325 HydrophobicContact CB-CG1 4.42Å; A64-V325 WeakPolarHBondContact CB-O 3.39Å; A64-R354 PolarHBondContact N-O 3.2Å; A64-R354 VanDerWaalsContact N-O 3.14Å; A64-L355 HydrophobicContact CB-CD2 3.45Å; A64-L355 VanDerWaalsContact CB-CD2 3.45Å; A64-L355 CarbonylContact O-C 3.12Å; A64-L355 WeakPolarHBondContact O-CA 3.45Å; A64-L356 PolarHBondContact O-N 3.34Å
65	V	97.1	Very high	89.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.4	179.9	179.1	0	0	0	0	108.8	I51 M60 V325 I326 L327 L356 V358	I51-V65 HydrophobicContact CD1-CB 4.36Å; I51-V65 HydrophobicContact CD1-CG1 3.61Å; I51-V65 HydrophobicContact CD1-CG2 3.76Å; I51-V65 HydrophobicContact CG1-CG2 4.13Å; I51-V65 HydrophobicContact CG2-CG2 3.96Å; M60-V65 HydrophobicContact CE-CG2 3.98Å; V65-V325 PolarHBondContact N-O 2.9Å; V65-I326 HydrophobicContact CB-CG1 4.23Å; V65-I326 HydrophobicContact CB-CG2 4.39Å; V65-I326 HydrophobicContact CG1-CG2 4.39Å; V65-I326 CarbonylContact O-C 3.44Å; V65-I326 WeakPolarHBondContact O-CA 3.05Å; V65-L327 PolarHBondContact O-N 3.09Å; V65-L356 WeakPolarHBondContact CA-O 3.3Å; V65-V358 HydrophobicContact CG1-CG2 4.39Å
66	L	97.8	Very high	90	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.3	170.6	-178.5	64.5	0	0	0	110.2	A68 L327 T329 H345 I347 L352 L355 L356 I357 V358	L66-A68 HydrophobicContact CG-CB 4.44Å; L66-L327 CarbonylContact C-O 3.6Å; L66-L327 WeakPolarHBondContact CA-O 3.29Å; L66-L327 HydrophobicContact CD1-CB 3.67Å; L66-T329 HydrophobicContact CD1-CG2 3.87Å; L66-T329 HydrophobicContact CD2-CG2 4.47Å; L66-T329 HydrophobicContact CG-CG2 4.37Å; L66-H345 HydrophobicContact CD2-CB 4.4Å; L66-I347 HydrophobicContact CD1-CD1 3.81Å; L66-I347 HydrophobicContact CD2-CD1 3.98Å; L66-L352 HydrophobicContact CD2-CD1 4.28Å; L66-L355 HydrophobicContact CB-CB 4.12Å; L66-L355 HydrophobicContact CB-CD1 4.02Å; L66-L355 HydrophobicContact CB-CG 4.45Å; L66-L355 HydrophobicContact CD2-CD1 4.12Å; L66-L355 HydrophobicContact CG-CD1 4.49Å; L66-L356 PolarHBondContact N-O 2.88Å; L66-I357 HydrophobicContact CB-CG1 4.25Å; L66-I357 HydrophobicContact CD2-CD1 4.38Å; L66-I357 HydrophobicContact CD2-CG1 4.16Å; L66-I357 HydrophobicContact CD2-CG2 4.31Å; L66-I357 CarbonylContact O-C 3.56Å; L66-I357 WeakPolarHBondContact O-CA 3.36Å; L66-V358 PolarHBondContact O-N 3.35Å
67	L	98	Very high	90.2	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	106.3	168.9	-62	173	0	0	0	108.7	K75 I78 A79 F298 I326 L327 A328 T329 V358	L67-K75 HydrophobicContact CB-CB 4.07Å; L67-K75 HydrophobicContact CB-CD 4.06Å; L67-K75 HydrophobicContact CB-CG 3.99Å; L67-K75 HydrophobicContact CD1-CB 4.25Å; L67-K75 VanDerWaalsContact CD1-O 3.23Å; L67-K75 WeakPolarHBondContact CD1-O 3.45Å; L67-K75 WeakPolarHBondContact O-CD 3.34Å; L67-I78 HydrophobicContact CD2-CG2 4.19Å; L67-A79 HydrophobicContact CD1-CB 4.18Å; L67-F298 HydrophobicContact CD1-CE2 4.39Å; L67-I326 HydrophobicContact CD1-CG2 3.63Å; L67-I326 HydrophobicContact CG-CG2 3.94Å; L67-L327 PolarHBondContact N-O 3.13Å; L67-A328 HydrophobicContact CB-CB 4.31Å; L67-A328 WeakPolarHBondContact O-CA 3.22Å; L67-T329 PolarHBondContact O-N 2.7Å; L67-V358 WeakPolarHBondContact CA-O 3.32Å; L67-V358 HydrophobicContact CD2-CB 3.98Å; L67-V358 HydrophobicContact CD2-CG1 4.11Å
68	A	97.4	Very high	90.5	Very high	7 Å²	7	41.1 Å²	41.1	6%	0.058	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.4	-176.3	0	0	0	0	0	111.4	L66 T329 I357 V358 R359 T360	L66-A68 HydrophobicContact CG-CB 4.44Å; A68-T329 HydrophobicContact CB-CG2 4.06Å; A68-I357 HydrophobicContact CB-CG2 4.1Å; A68-V358 PolarHBondContact N-O 2.77Å; A68-R359 CarbonylContact O-C 3.56Å; A68-R359 WeakPolarHBondContact O-CA 3.45Å; A68-T360 PolarHBondContact O-N 2.86Å; A68-T360 PolarHBondContact O-OG1 3.02Å
69	G	95.1	Very high	91	Very high	18 Å²	18	32 Å²	32	19%	0.186	19%	0.188	C	C	.	.	S	Bend	trans	157.4	177.3	170.8	0	0	0	0	0	113.3	K75 T329 N330 T360	G69-K75 PolarHBondContact O-NZ 3.37Å; G69-T329 PolarHBondContact N-O 3.47Å; G69-T329 VanDerWaalsContact N-O 3.16Å; G69-N330 VanDerWaalsContact O-CA 3.27Å; G69-N330 WeakPolarHBondContact O-CA 3.31Å; G69-T360 WeakPolarHBondContact CA-OG1 3.43Å
70	P	91.8	Very high	91.4	Very high	47 Å²	47	26 Å²	26	31%	0.305	17%	0.168	S	C	.	.	S	Bend	trans	-53.6	160.6	-172.8	-27.3	35.4	0	0	0	114.4	T73 K75 L362	P70-T73 HydrophobicContact CB-CG2 3.83Å; P70-T73 HydrophobicContact CG-CG2 4.29Å; P70-T73 WeakPolarHBondContact O-CG2 3.32Å; P70-T73 PolarHBondContact O-OG1 3.4Å; P70-K75 PolarHBondContact O-NZ 3.18Å; P70-L362 HydrophobicContact CB-CD2 3.61Å; P70-L362 HydrophobicContact CB-CG 4.39Å; P70-L362 HydrophobicContact CG-CD2 3.79Å; P70-L362 HydrophobicContact CG-CG 4.02Å
71	P	89.8	Confident	91.9	Very high	72 Å²	72	25.1 Å²	25.1	47%	0.468	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	151.6	172.2	26.8	-34.2	0	0	0	111	T73	P71-T73 VanDerWaalsContact C-N 3.33Å; P71-T73 PolarHBondContact O-N 3.45Å
72	A	88.6	Confident	92.8	Very high	28 Å²	28	20.9 Å²	20.9	23%	0.231	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	29.2	177.4	0	0	0	0	0	116.1	Y363 L400 R401	A72-Y363 WeakPolarHBondContact O-CE2 3.46Å; A72-L400 HydrophobicContact CB-CB 4.38Å; A72-R401 HydrophobicContact CB-CB 4Å
73	T	92.4	Very high	93.4	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.012	12%	0.12	C	C	.	.	S	Bend	trans	-99.8	11	177	59.2	0	0	0	0	114.7	Q41 P70 P71 T360 M361 L362 Y363	Q41-T73 PolarHBondContact NE2-O 2.96Å; P70-T73 HydrophobicContact CB-CG2 3.83Å; P70-T73 HydrophobicContact CG-CG2 4.29Å; P70-T73 WeakPolarHBondContact O-CG2 3.32Å; P70-T73 PolarHBondContact O-OG1 3.4Å; P71-T73 VanDerWaalsContact C-N 3.33Å; P71-T73 PolarHBondContact O-N 3.45Å; T73-T360 WeakPolarHBondContact OG1-CB 3.48Å; T73-T360 PolarHBondContact OG1-OG1 3.13Å; T73-M361 VanDerWaalsContact CG2-O 3.25Å; T73-M361 WeakPolarHBondContact CG2-O 3.35Å; T73-L362 HydrophobicContact CG2-CD2 4.3Å; T73-Y363 PolarHBondContact O-OH 3.46Å
74	G	91.5	Very high	93.5	Very high	14 Å²	14	17.8 Å²	17.8	14%	0.144	11%	0.114	C	C	.	.	S	Bend	trans	88.3	14.4	175.2	0	0	0	0	0	116.4	T76 A77 I78	G74-T76 PolarHBondContact O-N 2.87Å; G74-A77 WeakPolarHBondContact O-CB 3.08Å; G74-A77 PolarHBondContact O-N 3.09Å; G74-A77 VanDerWaalsContact O-N 3.12Å; G74-I78 WeakPolarHBondContact O-CG1 3.28Å; G74-I78 PolarHBondContact O-N 2.87Å
75	K	94.4	Very high	93.4	Very high	14 Å²	14	19.9 Å²	19.9	6%	0.061	12%	0.124	C	C	.	.	H	α-helix	trans	-51.5	-54.4	178	-64.1	-173.7	-71.3	-76.8	0	113.1	L67 G69 P70 A77 I78 A79 A328 T329 T360	L67-K75 HydrophobicContact CB-CB 4.07Å; L67-K75 HydrophobicContact CB-CD 4.06Å; L67-K75 HydrophobicContact CB-CG 3.99Å; L67-K75 HydrophobicContact CD1-CB 4.25Å; L67-K75 VanDerWaalsContact CD1-O 3.23Å; L67-K75 WeakPolarHBondContact CD1-O 3.45Å; L67-K75 WeakPolarHBondContact O-CD 3.34Å; G69-K75 PolarHBondContact O-NZ 3.37Å; P70-K75 PolarHBondContact O-NZ 3.18Å; K75-A77 VanDerWaalsContact C-N 3.3Å; K75-A77 PolarHBondContact O-N 3.31Å; K75-I78 PolarHBondContact O-N 3.39Å; K75-A79 PolarHBondContact O-N 2.83Å; K75-A328 HydrophobicContact CB-CB 4.17Å; K75-A328 HydrophobicContact CD-CB 4.08Å; K75-T329 WeakPolarHBondContact CE-O 3.49Å; K75-T360 HydrophobicContact CG-CG2 3.94Å
76	T	92.2	Very high	93.1	Very high	36 Å²	36	21.5 Å²	21.5	22%	0.221	13%	0.132	C	C	.	.	H	α-helix	trans	-61.8	-37.5	177.5	-42.4	0	0	0	0	112.1	G74 A79 L80 F298 D300	G74-T76 PolarHBondContact O-N 2.87Å; T76-A79 PolarHBondContact O-N 2.9Å; T76-L80 HydrophobicContact CG2-CD1 4.49Å; T76-L80 WeakPolarHBondContact O-CG 3.29Å; T76-L80 PolarHBondContact O-N 3.08Å; T76-F298 HydrophobicContact CG2-CD1 4.48Å; T76-F298 HydrophobicContact CG2-CE1 3.73Å; T76-F298 HydrophobicContact CG2-CZ 4.17Å; T76-D300 PolarHBondContact OG1-OD2 3.05Å
77	A	92.9	Very high	92.6	Very high	5 Å²	5	22.6 Å²	22.6	4%	0.041	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-44.7	176	0	0	0	0	0	111.7	V20 F38 G74 K75 L80 A81	V20-A77 HydrophobicContact CG2-CB 4.07Å; F38-A77 HydrophobicContact CE1-CB 3.66Å; F38-A77 HydrophobicContact CZ-CB 3.98Å; F38-A77 WeakPolarHBondContact CZ-O 3.27Å; G74-A77 WeakPolarHBondContact O-CB 3.08Å; G74-A77 PolarHBondContact O-N 3.09Å; G74-A77 VanDerWaalsContact O-N 3.12Å; K75-A77 VanDerWaalsContact C-N 3.3Å; K75-A77 PolarHBondContact O-N 3.31Å; A77-L80 PolarHBondContact O-N 2.93Å; A77-A81 WeakPolarHBondContact O-CB 3.18Å; A77-A81 PolarHBondContact O-N 3.11Å
78	I	95.4	Very high	91.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-43	177.1	-66.8	164.4	0	0	0	110.4	F38 A44 R45 A48 L67 G74 K75 L80 A81 I82 T360	F38-I78 HydrophobicContact CE1-CG1 3.96Å; F38-I78 HydrophobicContact CZ-CG1 4.26Å; A44-I78 HydrophobicContact CB-CD1 3.73Å; R45-I78 HydrophobicContact CG-CG1 4.44Å; A48-I78 HydrophobicContact CB-CG2 3.73Å; L67-I78 HydrophobicContact CD2-CG2 4.19Å; G74-I78 WeakPolarHBondContact O-CG1 3.28Å; G74-I78 PolarHBondContact O-N 2.87Å; K75-I78 PolarHBondContact O-N 3.39Å; I78-L80 VanDerWaalsContact C-N 3.35Å; I78-L80 PolarHBondContact O-N 3.15Å; I78-A81 PolarHBondContact O-N 3.37Å; I78-I82 HydrophobicContact CG2-CD1 4.15Å; I78-I82 VanDerWaalsContact O-CG1 3.32Å; I78-I82 WeakPolarHBondContact O-CG1 3.49Å; I78-I82 PolarHBondContact O-N 3.17Å; I78-T360 HydrophobicContact CD1-CG2 3.88Å
79	A	93.9	Very high	91.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-42.3	176.7	0	0	0	0	0	112.6	L67 K75 T76 I82 S83 F92 F298 I326	L67-A79 HydrophobicContact CD1-CB 4.18Å; K75-A79 PolarHBondContact O-N 2.83Å; T76-A79 PolarHBondContact O-N 2.9Å; A79-I82 PolarHBondContact O-N 2.92Å; A79-S83 PolarHBondContact O-N 3.07Å; A79-F92 HydrophobicContact CB-CE2 4.31Å; A79-F92 HydrophobicContact CB-CZ 4.38Å; A79-F298 HydrophobicContact CB-CD2 3.4Å; A79-F298 HydrophobicContact CB-CE2 3.64Å; A79-F298 HydrophobicContact CB-CG 4.01Å; A79-F298 HydrophobicContact CB-CZ 4.42Å; A79-I326 HydrophobicContact CB-CD1 4.39Å; A79-I326 HydrophobicContact CB-CG2 4.25Å
80	L	91.8	Very high	90.9	Very high	43 Å²	43	34.4 Å²	34.4	23%	0.225	20%	0.203	C	C	.	.	H	α-helix	trans	-64.8	-40.9	174.4	-76.5	166.8	0	0	0	112.2	H17 T76 A77 I78 I82 S83 Q84 F92	H17-L80 HydrophobicContact CB-CD1 3.5Å; T76-L80 HydrophobicContact CG2-CD1 4.49Å; T76-L80 WeakPolarHBondContact O-CG 3.29Å; T76-L80 PolarHBondContact O-N 3.08Å; A77-L80 PolarHBondContact O-N 2.93Å; I78-L80 VanDerWaalsContact C-N 3.35Å; I78-L80 PolarHBondContact O-N 3.15Å; L80-I82 VanDerWaalsContact C-N 3.33Å; L80-I82 PolarHBondContact O-N 2.83Å; L80-S83 VanDerWaalsContact O-CB 3.32Å; L80-S83 WeakPolarHBondContact O-CB 3.31Å; L80-S83 PolarHBondContact O-N 2.86Å; L80-S83 VanDerWaalsContact O-N 3.14Å; L80-Q84 WeakPolarHBondContact O-CG 3.37Å; L80-Q84 PolarHBondContact O-N 2.83Å; L80-F92 HydrophobicContact CD2-CD1 3.7Å; L80-F92 HydrophobicContact CD2-CE1 3.36Å; L80-F92 HydrophobicContact CD2-CE2 4.28Å; L80-F92 HydrophobicContact CD2-CG 4.3Å; L80-F92 HydrophobicContact CD2-CZ 3.69Å; L80-F92 HydrophobicContact CG-CE1 4.07Å; L80-F92 HydrophobicContact CG-CZ 3.97Å
81	A	93.6	Very high	90.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-38.7	176.8	0	0	0	0	0	112.3	V20 L23 F38 A77 I78 S83 Q84 E85	V20-A81 HydrophobicContact CG1-CB 3.74Å; L23-A81 HydrophobicContact CD2-CB 3.52Å; L23-A81 HydrophobicContact CG-CB 3.91Å; F38-A81 HydrophobicContact CE2-CB 3.59Å; F38-A81 HydrophobicContact CZ-CB 3.74Å; A77-A81 WeakPolarHBondContact O-CB 3.18Å; A77-A81 PolarHBondContact O-N 3.11Å; I78-A81 PolarHBondContact O-N 3.37Å; A81-S83 VanDerWaalsContact C-N 3.3Å; A81-S83 PolarHBondContact O-N 2.71Å; A81-Q84 PolarHBondContact O-N 2.72Å; A81-E85 WeakPolarHBondContact O-CB 3.48Å; A81-E85 WeakPolarHBondContact O-CG 3.25Å; A81-E85 PolarHBondContact O-N 2.72Å
82	I	94.1	Very high	90.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-43.8	172.6	-67	165.7	0	0	0	110.1	L23 A48 V52 I78 A79 L80 Q84 E85 L86 I296 I326	L23-I82 HydrophobicContact CD1-CG1 4.38Å; L23-I82 HydrophobicContact CD2-CG1 4.48Å; A48-I82 HydrophobicContact CB-CD1 3.8Å; A48-I82 HydrophobicContact CB-CG1 3.77Å; V52-I82 HydrophobicContact CG2-CB 4.34Å; V52-I82 HydrophobicContact CG2-CG1 4.37Å; V52-I82 HydrophobicContact CG2-CG2 3.87Å; I78-I82 HydrophobicContact CG2-CD1 4.15Å; I78-I82 VanDerWaalsContact O-CG1 3.32Å; I78-I82 WeakPolarHBondContact O-CG1 3.49Å; I78-I82 PolarHBondContact O-N 3.17Å; A79-I82 PolarHBondContact O-N 2.92Å; L80-I82 VanDerWaalsContact C-N 3.33Å; L80-I82 PolarHBondContact O-N 2.83Å; I82-Q84 PolarHBondContact O-N 2.98Å; I82-E85 PolarHBondContact O-N 2.69Å; I82-L86 HydrophobicContact CG2-CD1 4.34Å; I82-L86 WeakPolarHBondContact O-CG 3.43Å; I82-L86 PolarHBondContact O-N 3.41Å; I82-L86 VanDerWaalsContact O-N 3.07Å; I82-I296 HydrophobicContact CB-CD1 4.25Å; I82-I296 HydrophobicContact CG2-CD1 3.7Å; I82-I326 HydrophobicContact CB-CD1 4.48Å; I82-I326 HydrophobicContact CD1-CD1 3.86Å; I82-I326 HydrophobicContact CG2-CD1 4.29Å
83	S	91.2	Very high	91.2	Very high	12 Å²	12	31.2 Å²	31.2	8%	0.084	18%	0.175	C	C	.	.	H	α-helix	trans	-59.2	-46.9	176.5	177.5	0	0	0	0	112.1	A79 L80 A81 E85 L86 G87	A79-S83 PolarHBondContact O-N 3.07Å; L80-S83 VanDerWaalsContact O-CB 3.32Å; L80-S83 WeakPolarHBondContact O-CB 3.31Å; L80-S83 PolarHBondContact O-N 2.86Å; L80-S83 VanDerWaalsContact O-N 3.14Å; A81-S83 VanDerWaalsContact C-N 3.3Å; A81-S83 PolarHBondContact O-N 2.71Å; S83-E85 VanDerWaalsContact C-N 3.32Å; S83-E85 PolarHBondContact O-N 3.27Å; S83-L86 PolarHBondContact O-N 3.03Å; S83-G87 PolarHBondContact O-N 2.97Å; S83-G87 VanDerWaalsContact O-N 3.09Å
84	Q	90.5	Very high	91.3	Very high	74 Å²	74	35 Å²	35	35%	0.346	20%	0.2	S	C	.	.	H	α-helix	trans	-62.8	-38.7	-180	-69.2	169.9	-20.1	0	0	112.1	V20 K21 L80 A81 I82 G87	V20-Q84 PolarHBondContact O-NE2 2.78Å; V20-Q84 PolarHBondContact O-OE1 2.92Å; V20-Q84 VanDerWaalsContact O-OE1 3.1Å; K21-Q84 WeakPolarHBondContact O-CB 2.93Å; K21-Q84 PolarHBondContact O-OE1 3.05Å; L80-Q84 WeakPolarHBondContact O-CG 3.37Å; L80-Q84 PolarHBondContact O-N 2.83Å; A81-Q84 PolarHBondContact O-N 2.72Å; I82-Q84 PolarHBondContact O-N 2.98Å; Q84-G87 PolarHBondContact O-N 2.95Å
85	E	91.8	Very high	91.4	Very high	45 Å²	45	34.7 Å²	34.7	21%	0.21	20%	0.195	C	C	.	.	H	α-helix	trans	-69.6	-27.9	176.7	-77.2	-78.1	-172.8	0	0	114.2	D22 L23 V52 K56 A81 I82 S83	D22-E85 HydrophobicContact CB-CG 4.47Å; D22-E85 WeakPolarHBondContact CB-OE1 3.42Å; L23-E85 HydrophobicContact CB-CG 4.18Å; L23-E85 HydrophobicContact CD1-CG 3.96Å; L23-E85 HydrophobicContact CG-CG 3.88Å; L23-E85 PolarHBondContact N-OE1 2.77Å; V52-E85 HydrophobicContact CG1-CB 4.09Å; V52-E85 HydrophobicContact CG2-CB 3.81Å; K56-E85 WeakPolarHBondContact CE-O 3.49Å; K56-E85 PolarHBondContact NZ-O 3.4Å; A81-E85 WeakPolarHBondContact O-CB 3.48Å; A81-E85 WeakPolarHBondContact O-CG 3.25Å; A81-E85 PolarHBondContact O-N 2.72Å; I82-E85 PolarHBondContact O-N 2.69Å; S83-E85 VanDerWaalsContact C-N 3.32Å; S83-E85 PolarHBondContact O-N 3.27Å
86	L	90.9	Very high	91.4	Very high	33 Å²	33	36.2 Å²	36.2	17%	0.173	21%	0.205	C	C	.	.	H	α-helix	trans	-75.7	-31.7	171.3	-66.8	177.1	0	0	0	111.7	V52 V55 K56 I82 S83 V90 I296 I324	V52-L86 HydrophobicContact CG1-CD2 4.06Å; V55-L86 HydrophobicContact CB-CD2 3.85Å; V55-L86 HydrophobicContact CG1-CD1 3.94Å; V55-L86 HydrophobicContact CG1-CD2 3.43Å; V55-L86 VanDerWaalsContact CG1-CD2 3.43Å; V55-L86 HydrophobicContact CG1-CG 4.36Å; K56-L86 HydrophobicContact CG-CD2 4.21Å; I82-L86 HydrophobicContact CG2-CD1 4.34Å; I82-L86 WeakPolarHBondContact O-CG 3.43Å; I82-L86 PolarHBondContact O-N 3.41Å; I82-L86 VanDerWaalsContact O-N 3.07Å; S83-L86 PolarHBondContact O-N 3.03Å; L86-V90 HydrophobicContact CB-CB 4.39Å; L86-V90 HydrophobicContact CB-CG1 4.28Å; L86-V90 HydrophobicContact CB-CG2 3.93Å; L86-V90 HydrophobicContact CD1-CG1 4.46Å; L86-I296 HydrophobicContact CD1-CD1 3.88Å; L86-I296 HydrophobicContact CD1-CG1 4.09Å; L86-I324 HydrophobicContact CD1-CD1 3.66Å
87	G	88.4	Confident	91.4	Very high	24 Å²	24	34.5 Å²	34.5	25%	0.247	20%	0.195	C	C	.	.			trans	141.8	154.4	169.5	0	0	0	0	0	113	S83 Q84 K89 V90	S83-G87 PolarHBondContact O-N 2.97Å; S83-G87 VanDerWaalsContact O-N 3.09Å; Q84-G87 PolarHBondContact O-N 2.95Å; G87-K89 PolarHBondContact O-N 3.44Å; G87-K89 VanDerWaalsContact O-N 3.08Å; G87-V90 WeakPolarHBondContact O-CB 3.45Å; G87-V90 WeakPolarHBondContact O-CG2 3.41Å; G87-V90 PolarHBondContact O-N 3.41Å
88	T	81.6	Confident	91.4	Very high	146 Å²	146	36.4 Å²	36.4	90%	0.896	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.9	-176.5	55.1	0	0	0	0	114.8
89	K	83.8	Confident	91.2	Very high	104 Å²	104	40.4 Å²	40.4	45%	0.452	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	5	179.2	-63.7	-175.7	161.3	-136.4	0	113.6	G87 R122 D235	G87-K89 PolarHBondContact O-N 3.44Å; G87-K89 VanDerWaalsContact O-N 3.08Å; K89-R122 VanDerWaalsContact CB-NH2 3.31Å; K89-D235 WeakPolarHBondContact CD-OD2 3.26Å; K89-D235 WeakPolarHBondContact CE-OD2 3.4Å; K89-D235 IonicContact NZ-OD2 2.83Å; K89-D235 PolarHBondContact NZ-OD2 2.95Å
90	V	87.8	Confident	91.2	Very high	24 Å²	24	40.4 Å²	40.4	15%	0.145	23%	0.229	C	C	.	.	S	Bend	trans	-82.1	123	178.7	178.2	0	0	0	0	108.4	L86 G87 F92	L86-V90 HydrophobicContact CB-CB 4.39Å; L86-V90 HydrophobicContact CB-CG1 4.28Å; L86-V90 HydrophobicContact CB-CG2 3.93Å; L86-V90 HydrophobicContact CD1-CG1 4.46Å; G87-V90 WeakPolarHBondContact O-CB 3.45Å; G87-V90 WeakPolarHBondContact O-CG2 3.41Å; G87-V90 PolarHBondContact O-N 3.41Å; V90-F92 PolarHBondContact O-N 2.86Å
91	P	91.2	Very high	91.1	Very high	24 Å²	24	42.7 Å²	42.7	16%	0.156	24%	0.236	C	C	.	.			trans	-60.4	138.5	178.8	-23.2	33.3	0	0	0	111.8	T237 G295 I296	P91-T237 HydrophobicContact CB-CG2 4.49Å; P91-G295 CarbonylContact O-C 3.56Å; P91-G295 WeakPolarHBondContact O-CA 3.49Å; P91-I296 PolarHBondContact O-N 3.23Å
92	F	92.1	Very high	90.8	Very high	49 Å²	49	44.7 Å²	44.7	22%	0.215	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	113.7	174	-177.1	-96	0	0	0	108.8	A79 L80 V90 P94 I296 F298	A79-F92 HydrophobicContact CB-CE2 4.31Å; A79-F92 HydrophobicContact CB-CZ 4.38Å; L80-F92 HydrophobicContact CD2-CD1 3.7Å; L80-F92 HydrophobicContact CD2-CE1 3.36Å; L80-F92 HydrophobicContact CD2-CE2 4.28Å; L80-F92 HydrophobicContact CD2-CG 4.3Å; L80-F92 HydrophobicContact CD2-CZ 3.69Å; L80-F92 HydrophobicContact CG-CE1 4.07Å; L80-F92 HydrophobicContact CG-CZ 3.97Å; V90-F92 PolarHBondContact O-N 2.86Å; F92-P94 HydrophobicContact CD1-CB 4.44Å; F92-P94 HydrophobicContact CD1-CG 4.21Å; F92-P94 HydrophobicContact CE1-CB 3.83Å; F92-P94 HydrophobicContact CE1-CG 4.04Å; F92-P94 VanDerWaalsContact O-CD 3.26Å; F92-P94 WeakPolarHBondContact O-CD 3.15Å; F92-I296 HydrophobicContact CD2-CB 3.88Å; F92-I296 HydrophobicContact CD2-CD1 4.47Å; F92-I296 HydrophobicContact CD2-CG2 3.96Å; F92-I296 HydrophobicContact CE2-CB 4.39Å; F92-I296 HydrophobicContact CE2-CG2 3.95Å; F92-F298 HydrophobicContact CE1-CB 4.38Å; F92-F298 HydrophobicContact CE2-CB 3.83Å; F92-F298 HydrophobicContact CZ-CB 3.56Å; F92-F298 HydrophobicContact CZ-CD1 4.21Å; F92-F298 AromaticContact CZ-CG 3.99Å; F92-F298 HydrophobicContact CZ-CG 3.99Å
93	A	94.1	Very high	90.4	Very high	6 Å²	6	52 Å²	52	5%	0.05	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	97.4	179.6	0	0	0	0	0	109.7	R117 A118 I296 L297 F298	A93-R117 HydrophobicContact CB-CB 4.01Å; A93-A118 HydrophobicContact CB-CB 3.92Å; A93-I296 PolarHBondContact N-O 3.15Å; A93-L297 HydrophobicContact CB-CD1 4.23Å; A93-F298 PolarHBondContact O-N 3.01Å
94	P	93.8	Very high	90.1	Very high	83 Å²	83	57.2 Å²	57.2	54%	0.539	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	134.8	170.9	30.7	-30	0	0	0	110.8	F92 F298	F92-P94 HydrophobicContact CD1-CB 4.44Å; F92-P94 HydrophobicContact CD1-CG 4.21Å; F92-P94 HydrophobicContact CE1-CB 3.83Å; F92-P94 HydrophobicContact CE1-CG 4.04Å; F92-P94 VanDerWaalsContact O-CD 3.26Å; F92-P94 WeakPolarHBondContact O-CD 3.15Å; P94-F298 CarbonylContact C-O 3.51Å; P94-F298 WeakPolarHBondContact CA-O 3.26Å; P94-F298 HydrophobicContact CB-CD1 4.37Å
95	M	93.8	Very high	89.9	Confident	6 Å²	6	54.1 Å²	54.1	3%	0.03	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	156.1	167.9	64.9	172.1	-70.3	0	0	110.3	V100 L111 N114 L297 F298 I299 D300	M95-V100 HydrophobicContact CE-CG1 3.69Å; M95-L111 HydrophobicContact CE-CD2 3.86Å; M95-L111 HydrophobicContact SD-CD2 4.09Å; M95-N114 HydrophobicContact SD-CB 3.87Å; M95-L297 HydrophobicContact CG-CD1 4.1Å; M95-L297 HydrophobicContact SD-CD1 4.01Å; M95-F298 PolarHBondContact N-O 2.62Å; M95-I299 HydrophobicContact CE-CG2 4.4Å; M95-I299 HydrophobicContact CG-CB 4.17Å; M95-I299 HydrophobicContact CG-CG1 3.76Å; M95-I299 HydrophobicContact CG-CG2 4.16Å; M95-I299 CarbonylContact O-C 3.51Å; M95-I299 WeakPolarHBondContact O-CA 3.46Å; M95-I299 HydrophobicContact SD-CD1 3.96Å; M95-I299 HydrophobicContact SD-CG1 3.85Å; M95-I299 HydrophobicContact SD-CG2 4.47Å; M95-D300 PolarHBondContact O-N 3.03Å
96	V	94.8	Very high	89.8	Confident	47 Å²	47	58.4 Å²	58.4	29%	0.285	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	144	170.1	-172.4	0	0	0	0	108.5	S98 D99 D300 E301	V96-S98 WeakPolarHBondContact CG1-OG 3.43Å; V96-S98 PolarHBondContact O-N 2.79Å; V96-S98 VanDerWaalsContact O-N 3.1Å; V96-D99 PolarHBondContact N-OD2 3.24Å; V96-D99 VanDerWaalsContact O-CB 3.22Å; V96-D99 WeakPolarHBondContact O-CB 3.29Å; V96-D99 PolarHBondContact O-N 2.85Å; V96-D300 CarbonylContact C-O 3.51Å; V96-E301 HydrophobicContact CG1-CB 4.14Å; V96-E301 HydrophobicContact CG1-CG 4.29Å
97	G	92.9	Very high	89.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-56.2	-29.4	-178.8	0	0	0	0	0	113.3	D99 V100 D300 L305	G97-D99 VanDerWaalsContact C-N 3.3Å; G97-D99 PolarHBondContact O-N 2.92Å; G97-V100 WeakPolarHBondContact O-CG2 3.43Å; G97-D300 PolarHBondContact N-O 3.17Å; G97-L305 WeakPolarHBondContact O-CD2 3.48Å
98	S	93	Very high	89.9	Confident	45 Å²	45	61.3 Å²	61.3	32%	0.315	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-71.2	-18.7	174.4	54.5	0	0	0	0	114.6	V96 V100 Y101	V96-S98 WeakPolarHBondContact CG1-OG 3.43Å; V96-S98 PolarHBondContact O-N 2.79Å; V96-S98 VanDerWaalsContact O-N 3.1Å; S98-V100 PolarHBondContact O-N 3.35Å; S98-Y101 WeakPolarHBondContact O-CD2 3.32Å; S98-Y101 PolarHBondContact O-N 2.85Å
99	D	91.3	Very high	90.4	Very high	83 Å²	83	54.5 Å²	54.5	44%	0.444	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-67.3	-18.6	-175.2	-65.1	-20	0	0	0	112.7	V96 G97 Y101	V96-D99 PolarHBondContact N-OD2 3.24Å; V96-D99 VanDerWaalsContact O-CB 3.22Å; V96-D99 WeakPolarHBondContact O-CB 3.29Å; V96-D99 PolarHBondContact O-N 2.85Å; G97-D99 VanDerWaalsContact C-N 3.3Å; G97-D99 PolarHBondContact O-N 2.92Å; D99-Y101 PolarHBondContact O-N 2.72Å
100	V	92.1	Very high	90.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-65.7	-23.2	176.4	-56.5	0	0	0	0	112.6	M95 G97 S98 S102 K107 L111 L305	M95-V100 HydrophobicContact CE-CG1 3.69Å; G97-V100 WeakPolarHBondContact O-CG2 3.43Å; S98-V100 PolarHBondContact O-N 3.35Å; V100-S102 PolarHBondContact O-N 3.19Å; V100-K107 HydrophobicContact CB-CB 4.2Å; V100-K107 WeakPolarHBondContact O-CA 3.26Å; V100-L111 HydrophobicContact CG1-CD2 3.81Å; V100-L111 HydrophobicContact CG1-CG 3.9Å; V100-L305 HydrophobicContact CB-CD2 4.41Å; V100-L305 HydrophobicContact CG1-CD2 3.57Å; V100-L305 HydrophobicContact CG2-CD2 3.95Å
101	Y	91.1	Very high	91	Very high	92 Å²	92	48.7 Å²	48.7	36%	0.361	26%	0.262	S	S	.	.			trans	-82	85.5	179	-59.1	-70.3	0	0	0	109.9	S98 D99 K107 M304 D306	S98-Y101 WeakPolarHBondContact O-CD2 3.32Å; S98-Y101 PolarHBondContact O-N 2.85Å; D99-Y101 PolarHBondContact O-N 2.72Å; Y101-K107 HydrophobicContact CD1-CD 4.36Å; Y101-K107 HydrophobicContact CE1-CD 4.15Å; Y101-M304 WeakPolarHBondContact CE2-O 3.49Å; Y101-M304 PolarHBondContact OH-O 3.47Å; Y101-M304 VanDerWaalsContact OH-O 3.14Å; Y101-D306 PolarHBondContact OH-OD2 2.86Å
102	S	86.4	Confident	91	Very high	41 Å²	41	49.8 Å²	49.8	29%	0.287	27%	0.265	S	S	.	.			trans	-107.3	143.5	175.8	178.8	0	0	0	0	111.3	V100 E104 L105	V100-S102 PolarHBondContact O-N 3.19Å; S102-E104 PolarHBondContact OG-N 2.59Å; S102-E104 VanDerWaalsContact OG-N 3.13Å; S102-L105 PolarHBondContact OG-N 2.85Å
103	V	86.9	Confident	91	Very high	155 Å²	155	48 Å²	48	94%	0.939	26%	0.257	S	S	*	.	S	Bend	trans	-77.5	-28.5	170.5	-177.6	0	0	0	0	110.9
104	E	83.4	Confident	91	Very high	120 Å²	120	48.1 Å²	48.1	56%	0.561	26%	0.257	S	S	*	.	S	Bend	trans	-91.3	-27.3	-174.3	-61.4	-173.8	163	0	0	113.2	S102 R266	S102-E104 PolarHBondContact OG-N 2.59Å; S102-E104 VanDerWaalsContact OG-N 3.13Å; E104-R266 WeakPolarHBondContact OE2-CB 3.49Å; E104-R266 PolarHBondContact OE2-N 3.14Å
105	L	86.9	Confident	91	Very high	9 Å²	9	44.8 Å²	44.8	5%	0.047	23%	0.234	C	C	.	.	S	Bend	trans	-130.4	148.8	-171.7	-63.3	176.2	0	0	0	111.2	S102 V110 R266 E268	S102-L105 PolarHBondContact OG-N 2.85Å; L105-V110 HydrophobicContact CB-CG2 3.93Å; L105-V110 HydrophobicContact CD1-CG2 4.3Å; L105-R266 HydrophobicContact CD1-CB 4.22Å; L105-R266 HydrophobicContact CG-CB 4.5Å; L105-E268 HydrophobicContact CD2-CB 3.66Å; L105-E268 HydrophobicContact CD2-CG 4.31Å
106	K	90.6	Very high	91	Very high	135 Å²	135	45.6 Å²	45.6	59%	0.587	24%	0.237	S	C	*	.			trans	-64.9	146.1	170.2	-62.6	173	-174.8	165.6	0	110.4	T108 A109 V110	K106-T108 VanDerWaalsContact C-N 3.27Å; K106-T108 PolarHBondContact O-N 3.19Å; K106-A109 HydrophobicContact CB-CB 4.24Å; K106-A109 WeakPolarHBondContact O-CA 3.47Å; K106-A109 WeakPolarHBondContact O-CB 3.34Å; K106-A109 PolarHBondContact O-N 3.01Å; K106-V110 PolarHBondContact O-N 2.71Å; K106-V110 VanDerWaalsContact O-N 3.1Å
107	K	91.7	Very high	90.9	Very high	62 Å²	62	47.1 Å²	47.1	27%	0.27	24%	0.238	S	C	.	.	H	α-helix	trans	-51.6	-45	177.9	-56.2	175.4	-162.7	160.4	0	112.7	V100 Y101 A109 V110 L111 D306 E308	V100-K107 HydrophobicContact CB-CB 4.2Å; V100-K107 WeakPolarHBondContact O-CA 3.26Å; Y101-K107 HydrophobicContact CD1-CD 4.36Å; Y101-K107 HydrophobicContact CE1-CD 4.15Å; K107-A109 VanDerWaalsContact C-N 3.32Å; K107-A109 PolarHBondContact O-N 2.87Å; K107-V110 PolarHBondContact O-N 2.86Å; K107-L111 PolarHBondContact O-N 2.88Å; K107-D306 WeakPolarHBondContact CD-OD2 3.31Å; K107-D306 WeakPolarHBondContact CE-OD2 3.4Å; K107-D306 IonicContact NZ-OD2 2.67Å; K107-D306 PolarHBondContact NZ-OD2 3.32Å; K107-E308 IonicContact NZ-OE2 2.92Å; K107-E308 PolarHBondContact NZ-OE2 3.04Å
108	T	89.2	Confident	90.9	Very high	57 Å²	57	47.1 Å²	47.1	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-66	-32.3	178.4	52	0	0	0	0	112.8	K106 L111 M112 Y312	K106-T108 VanDerWaalsContact C-N 3.27Å; K106-T108 PolarHBondContact O-N 3.19Å; T108-L111 PolarHBondContact O-N 3.06Å; T108-M112 WeakPolarHBondContact O-CB 3.04Å; T108-M112 PolarHBondContact O-N 3.19Å; T108-Y312 HydrophobicContact CG2-CD2 4.08Å; T108-Y312 HydrophobicContact CG2-CG 4.28Å
109	A	90.6	Very high	90.9	Very high	2 Å²	2	45.5 Å²	45.5	2%	0.017	23%	0.225	C	C	.	.	H	α-helix	trans	-68.4	-41.1	174.8	0	0	0	0	0	111.1	K106 K107 L111 M112 E113 E268	K106-A109 HydrophobicContact CB-CB 4.24Å; K106-A109 WeakPolarHBondContact O-CA 3.47Å; K106-A109 WeakPolarHBondContact O-CB 3.34Å; K106-A109 PolarHBondContact O-N 3.01Å; K107-A109 VanDerWaalsContact C-N 3.32Å; K107-A109 PolarHBondContact O-N 2.87Å; A109-L111 PolarHBondContact O-N 3.37Å; A109-M112 WeakPolarHBondContact O-CB 2.98Å; A109-M112 PolarHBondContact O-N 3.05Å; A109-E113 WeakPolarHBondContact O-CG 3.46Å; A109-E113 PolarHBondContact O-N 3.24Å; A109-E268 HydrophobicContact CB-CG 4.09Å
110	V	92.6	Very high	91	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-42.8	174.5	-179.8	0	0	0	0	111.3	L105 K106 K107 E113 N114	L105-V110 HydrophobicContact CB-CG2 3.93Å; L105-V110 HydrophobicContact CD1-CG2 4.3Å; K106-V110 PolarHBondContact O-N 2.71Å; K106-V110 VanDerWaalsContact O-N 3.1Å; K107-V110 PolarHBondContact O-N 2.86Å; V110-E113 PolarHBondContact O-N 3.12Å; V110-N114 PolarHBondContact O-N 3.34Å; V110-N114 PolarHBondContact O-ND2 2.73Å
111	L	93.1	Very high	91	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-50.9	173.4	-72.7	172.7	0	0	0	110.8	M95 V100 K107 T108 A109 E113 N114 F115 C309 Y312	M95-L111 HydrophobicContact CE-CD2 3.86Å; M95-L111 HydrophobicContact SD-CD2 4.09Å; V100-L111 HydrophobicContact CG1-CD2 3.81Å; V100-L111 HydrophobicContact CG1-CG 3.9Å; K107-L111 PolarHBondContact O-N 2.88Å; T108-L111 PolarHBondContact O-N 3.06Å; A109-L111 PolarHBondContact O-N 3.37Å; L111-E113 VanDerWaalsContact C-N 3.3Å; L111-E113 PolarHBondContact O-N 3.05Å; L111-N114 PolarHBondContact O-N 2.85Å; L111-F115 VanDerWaalsContact O-CD2 3.31Å; L111-F115 WeakPolarHBondContact O-CD2 3.48Å; L111-F115 PolarHBondContact O-N 2.81Å; L111-C309 HydrophobicContact CD1-CB 3.79Å; L111-Y312 HydrophobicContact CB-CD1 3.89Å; L111-Y312 HydrophobicContact CB-CE1 3.76Å; L111-Y312 HydrophobicContact CD1-CD1 3.81Å; L111-Y312 HydrophobicContact CD1-CG 4.41Å
112	M	91.7	Very high	91.1	Very high	46 Å²	46	39.5 Å²	39.5	23%	0.227	20%	0.198	C	C	.	.	H	α-helix	trans	-54.8	-43.1	178.7	-177.2	99.3	83.1	0	0	112.2	T108 A109 N114 F115 R116 R274 Y312	T108-M112 WeakPolarHBondContact O-CB 3.04Å; T108-M112 PolarHBondContact O-N 3.19Å; A109-M112 WeakPolarHBondContact O-CB 2.98Å; A109-M112 PolarHBondContact O-N 3.05Å; M112-N114 VanDerWaalsContact C-N 3.34Å; M112-N114 PolarHBondContact O-N 2.9Å; M112-F115 WeakPolarHBondContact O-CB 3.26Å; M112-F115 PolarHBondContact O-N 2.66Å; M112-R116 VanDerWaalsContact O-CG 3.3Å; M112-R116 WeakPolarHBondContact O-CG 3.21Å; M112-R116 PolarHBondContact O-N 2.88Å; M112-R274 VanDerWaalsContact CG-CZ 3.45Å; M112-Y312 WeakPolarHBondContact CA-OH 3.5Å; M112-Y312 WeakPolarHBondContact CB-OH 3.36Å; M112-Y312 PolarHBondContact SD-OH 3Å
113	E	92.1	Very high	91.4	Very high	11 Å²	11	38.5 Å²	38.5	5%	0.051	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-43.4	176.2	-75.7	-176.8	-171	0	0	112	A109 V110 L111 R116 R117 Y239	A109-E113 WeakPolarHBondContact O-CG 3.46Å; A109-E113 PolarHBondContact O-N 3.24Å; V110-E113 PolarHBondContact O-N 3.12Å; L111-E113 VanDerWaalsContact C-N 3.3Å; L111-E113 PolarHBondContact O-N 3.05Å; E113-R116 WeakPolarHBondContact O-CB 3.19Å; E113-R116 PolarHBondContact O-N 3.46Å; E113-R117 WeakPolarHBondContact O-CG 2.92Å; E113-R117 PolarHBondContact O-N 3.13Å; E113-Y239 HydrophobicContact CB-CD2 4.12Å; E113-Y239 HydrophobicContact CB-CE2 4.01Å; E113-Y239 HydrophobicContact CG-CD2 4.24Å; E113-Y239 HydrophobicContact CG-CE2 3.89Å
114	N	93.6	Very high	91.6	Very high	10 Å²	10	36.5 Å²	36.5	5%	0.053	17%	0.165	C	C	.	.	H	α-helix	trans	-70.1	-33.8	178.2	-73.7	-70.5	0	0	0	112.5	M95 V110 L111 M112 R116 R117 A118 L297	M95-N114 HydrophobicContact SD-CB 3.87Å; V110-N114 PolarHBondContact O-N 3.34Å; V110-N114 PolarHBondContact O-ND2 2.73Å; L111-N114 PolarHBondContact O-N 2.85Å; M112-N114 VanDerWaalsContact C-N 3.34Å; M112-N114 PolarHBondContact O-N 2.9Å; N114-R116 VanDerWaalsContact C-N 3.35Å; N114-R117 PolarHBondContact O-N 3.08Å; N114-A118 WeakPolarHBondContact O-CB 3.27Å; N114-A118 PolarHBondContact O-N 3.18Å; N114-L297 HydrophobicContact CB-CD1 3.73Å
115	F	93.8	Very high	91.8	Very high	13 Å²	13	34.7 Å²	34.7	6%	0.057	16%	0.157	C	C	.	.	H	α-helix	trans	-59.4	-45.5	168	-89.6	-88	0	0	0	111.5	L111 M112 R117 A118 I119 L297 Y312 L313 A316 P323 V325	L111-F115 VanDerWaalsContact O-CD2 3.31Å; L111-F115 WeakPolarHBondContact O-CD2 3.48Å; L111-F115 PolarHBondContact O-N 2.81Å; M112-F115 WeakPolarHBondContact O-CB 3.26Å; M112-F115 PolarHBondContact O-N 2.66Å; F115-R117 PolarHBondContact O-N 3.48Å; F115-A118 PolarHBondContact O-N 2.86Å; F115-I119 WeakPolarHBondContact O-CG1 3.42Å; F115-I119 PolarHBondContact O-N 2.95Å; F115-L297 HydrophobicContact CD1-CD2 4.32Å; F115-L297 HydrophobicContact CD2-CD2 3.72Å; F115-L297 HydrophobicContact CE1-CD2 4.17Å; F115-L297 HydrophobicContact CE2-CD2 3.56Å; F115-L297 HydrophobicContact CG-CD2 4.09Å; F115-L297 HydrophobicContact CZ-CD2 3.79Å; F115-Y312 HydrophobicContact CD2-CE1 4.15Å; F115-Y312 HydrophobicContact CE2-CE1 4.12Å; F115-L313 HydrophobicContact CE2-CD2 3.58Å; F115-L313 HydrophobicContact CZ-CD2 3.69Å; F115-A316 HydrophobicContact CD1-CB 4.43Å; F115-A316 HydrophobicContact CE1-CB 3.82Å; F115-A316 HydrophobicContact CE2-CB 4.05Å; F115-A316 HydrophobicContact CZ-CB 3.6Å; F115-P323 VanDerWaalsContact CD1-CD 3.49Å; F115-P323 HydrophobicContact CD1-CG 3.63Å; F115-P323 HydrophobicContact CE1-CG 4Å; F115-V325 HydrophobicContact CE1-CG2 3.93Å; F115-V325 HydrophobicContact CZ-CG2 3.91Å
116	R	92.9	Very high	91.8	Very high	22 Å²	22	40.2 Å²	40.2	8%	0.083	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-35	178.3	-70.9	-82.2	-178	156	-11.4	112.6	M112 E113 N114 A118 I119 L238 Y239 D242 N278	M112-R116 VanDerWaalsContact O-CG 3.3Å; M112-R116 WeakPolarHBondContact O-CG 3.21Å; M112-R116 PolarHBondContact O-N 2.88Å; E113-R116 WeakPolarHBondContact O-CB 3.19Å; E113-R116 PolarHBondContact O-N 3.46Å; N114-R116 VanDerWaalsContact C-N 3.35Å; R116-A118 VanDerWaalsContact C-N 3.34Å; R116-I119 PolarHBondContact O-N 3.35Å; R116-L238 HydrophobicContact CB-CB 4.3Å; R116-L238 PolarHBondContact O-N 3.41Å; R116-Y239 PolarHBondContact O-N 2.95Å; R116-D242 WeakPolarHBondContact CD-OD2 3.42Å; R116-D242 WeakPolarHBondContact CG-OD2 3.49Å; R116-D242 IonicContact CZ-OD1 2.71Å; R116-D242 IonicContact CZ-OD2 3.97Å; R116-D242 IonicContact NE-OD2 3.18Å; R116-D242 PolarHBondContact NE-OD2 2.83Å; R116-D242 IonicContact NH1-OD1 3.97Å; R116-D242 PolarHBondContact NH1-OD1 3.02Å; R116-D242 VanDerWaalsContact NH1-OD1 3.15Å; R116-D242 IonicContact NH1-OD2 3.91Å; R116-D242 PolarHBondContact NH1-OD2 3.47Å; R116-N278 PolarHBondContact NH1-OD1 3.17Å; R116-N278 VanDerWaalsContact NH1-OD1 3.08Å; R116-N278 PolarHBondContact NH2-ND2 2.98Å; R116-N278 VanDerWaalsContact NH2-ND2 3.19Å; R116-N278 PolarHBondContact NH2-OD1 3.08Å
117	R	93.8	Very high	91.7	Very high	79 Å²	79	35.9 Å²	35.9	30%	0.298	17%	0.166	S	C	.	.	H	α-helix	trans	-68.1	-32.8	173.1	-73.7	178.7	-178	157.2	1.9	112.7	A93 E113 N114 F115 I119 T237 Y239	A93-R117 HydrophobicContact CB-CB 4.01Å; E113-R117 WeakPolarHBondContact O-CG 2.92Å; E113-R117 PolarHBondContact O-N 3.13Å; N114-R117 PolarHBondContact O-N 3.08Å; F115-R117 PolarHBondContact O-N 3.48Å; R117-I119 VanDerWaalsContact C-N 3.27Å; R117-I119 PolarHBondContact O-N 2.98Å; R117-T237 WeakPolarHBondContact O-CG2 3.2Å; R117-Y239 VanDerWaalsContact CG-CB 3.47Å; R117-Y239 HydrophobicContact CG-CD1 3.7Å; R117-Y239 HydrophobicContact CG-CD2 4Å; R117-Y239 HydrophobicContact CG-CE1 4.45Å; R117-Y239 HydrophobicContact CG-CG 3.43Å; R117-Y239 VanDerWaalsContact CG-CG 3.43Å; R117-Y239 VanDerWaalsContact NH2-CZ 3.26Å; R117-Y239 PolarHBondContact NH2-OH 2.94Å
118	A	93.2	Very high	91.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-4.2	178.2	0	0	0	0	0	113.4	A93 N114 F115 R116 G295 L297 P323	A93-A118 HydrophobicContact CB-CB 3.92Å; N114-A118 WeakPolarHBondContact O-CB 3.27Å; N114-A118 PolarHBondContact O-N 3.18Å; F115-A118 PolarHBondContact O-N 2.86Å; R116-A118 VanDerWaalsContact C-N 3.34Å; A118-G295 CarbonylContact O-C 3.56Å; A118-G295 WeakPolarHBondContact O-CA 3.45Å; A118-G295 PolarHBondContact O-N 2.92Å; A118-L297 HydrophobicContact CB-CB 3.96Å; A118-P323 HydrophobicContact CB-CB 3.59Å; A118-P323 HydrophobicContact CB-CG 3.74Å
119	I	92.3	Very high	91.8	Very high	12 Å²	12	32.7 Å²	32.7	6%	0.062	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	116.4	176.4	-59.3	163.7	0	0	0	109.1	F115 R116 R117 T237 L238 L292 I321 P323	F115-I119 WeakPolarHBondContact O-CG1 3.42Å; F115-I119 PolarHBondContact O-N 2.95Å; R116-I119 PolarHBondContact O-N 3.35Å; R117-I119 VanDerWaalsContact C-N 3.27Å; R117-I119 PolarHBondContact O-N 2.98Å; I119-T237 WeakPolarHBondContact O-CA 3.45Å; I119-L238 HydrophobicContact CB-CD1 3.89Å; I119-L238 HydrophobicContact CB-CG 4.1Å; I119-L238 HydrophobicContact CD1-CD1 4.14Å; I119-L238 HydrophobicContact CG2-CD1 3.57Å; I119-L238 HydrophobicContact CG2-CG 3.85Å; I119-L238 PolarHBondContact O-N 3.26Å; I119-L292 HydrophobicContact CG2-CD2 3.9Å; I119-I321 WeakPolarHBondContact CD1-O 3.42Å; I119-P323 HydrophobicContact CG1-CB 4.38Å; I119-P323 HydrophobicContact CG1-CG 4.37Å
120	G	92.7	Very high	92	Very high	5 Å²	5	34 Å²	34	5%	0.052	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	150.7	175.7	0	0	0	0	0	112	V236 L292 V293	G120-V236 CarbonylContact C-O 3.6Å; G120-L292 WeakPolarHBondContact O-CA 3.34Å; G120-V293 PolarHBondContact N-O 3.45Å; G120-V293 PolarHBondContact O-N 2.95Å
121	L	93.2	Very high	92	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.9	166.6	-173.7	71.3	0	0	0	107.1	V123 V236 I241 V281 L284 I285 A290 L292	L121-V123 HydrophobicContact CD2-CG2 4.02Å; L121-V123 HydrophobicContact CG-CG2 4.11Å; L121-V236 PolarHBondContact N-O 3.42Å; L121-V236 PolarHBondContact O-N 3.23Å; L121-I241 HydrophobicContact CB-CD1 4.5Å; L121-I241 HydrophobicContact CD2-CD1 3.67Å; L121-V281 HydrophobicContact CD1-CG1 3.82Å; L121-V281 HydrophobicContact CD2-CG1 4.42Å; L121-V281 HydrophobicContact CD2-CG2 4.16Å; L121-L284 HydrophobicContact CD2-CD1 4.35Å; L121-I285 HydrophobicContact CD1-CG1 4.47Å; L121-A290 HydrophobicContact CD1-CB 3.71Å; L121-A290 HydrophobicContact CD2-CB 4.47Å; L121-A290 HydrophobicContact CG-CB 4.06Å; L121-L292 HydrophobicContact CD1-CD2 3.97Å; L121-L292 HydrophobicContact CD1-CG 4.46Å
122	R	93.3	Very high	92.2	Very high	40 Å²	40	34.6 Å²	34.6	15%	0.151	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	112.2	172.1	177.6	174.6	-60	135.7	7.3	109	K89 R124 V233 Q234 D235 A290 E291 V293	K89-R122 VanDerWaalsContact CB-NH2 3.31Å; R122-R124 HydrophobicContact CG-CG 4.27Å; R122-V233 HydrophobicContact CG-CG1 3.6Å; R122-Q234 CarbonylContact C-O 3.54Å; R122-Q234 WeakPolarHBondContact CA-O 3.37Å; R122-D235 WeakPolarHBondContact CB-OD1 3.43Å; R122-D235 WeakPolarHBondContact CG-OD1 3.31Å; R122-D235 IonicContact CZ-OD1 3.79Å; R122-D235 IonicContact NE-OD1 2.77Å; R122-D235 PolarHBondContact NE-OD1 3.48Å; R122-D235 IonicContact NE-OD2 3.4Å; R122-D235 IonicContact NH2-OD1 2.92Å; R122-D235 PolarHBondContact NH2-OD1 3.04Å; R122-A290 CarbonylContact O-C 3.57Å; R122-A290 WeakPolarHBondContact O-CA 3.32Å; R122-E291 HydrophobicContact CB-CG 3.77Å; R122-E291 VanDerWaalsContact CD-OE1 3.29Å; R122-E291 WeakPolarHBondContact CD-OE1 3.25Å; R122-E291 HydrophobicContact CG-CG 4.37Å; R122-E291 IonicContact CZ-OE1 2.86Å; R122-E291 PolarHBondContact N-O 3.1Å; R122-E291 IonicContact NE-OE1 3.75Å; R122-E291 IonicContact NH1-OE1 3.66Å; R122-E291 PolarHBondContact NH1-OE1 3.27Å; R122-E291 PolarHBondContact O-N 2.92Å; R122-V293 HydrophobicContact CB-CG2 4.1Å
123	V	92.6	Very high	92.4	Very high	19 Å²	19	32.4 Å²	32.4	12%	0.115	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.4	175	-172	0	0	0	0	108.7	L121 E125 V233 Q234 T289 A290	L121-V123 HydrophobicContact CD2-CG2 4.02Å; L121-V123 HydrophobicContact CG-CG2 4.11Å; V123-E125 HydrophobicContact CG1-CG 4.08Å; V123-V233 WeakPolarHBondContact O-CA 3.32Å; V123-Q234 PolarHBondContact N-O 2.8Å; V123-Q234 PolarHBondContact O-N 2.86Å; V123-T289 WeakPolarHBondContact CA-O 3.14Å; V123-A290 HydrophobicContact CG2-CB 4.1Å
124	R	91	Very high	92.6	Very high	113 Å²	113	31.9 Å²	31.9	43%	0.426	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114	176.3	-56.4	-170.9	-166.5	-178	6.1	108.8	R122 V233 T289 E291	R122-R124 HydrophobicContact CG-CG 4.27Å; R124-V233 HydrophobicContact CG-CG2 4.32Å; R124-T289 PolarHBondContact N-O 2.92Å; R124-E291 IonicContact CZ-OE1 3.49Å; R124-E291 IonicContact NE-OE1 2.87Å; R124-E291 IonicContact NH2-OE1 3.86Å; R124-E291 PolarHBondContact NH2-OE1 3.05Å; R124-E291 IonicContact NH2-OE2 3.78Å; R124-E291 PolarHBondContact NH2-OE2 3.08Å
125	E	86.1	Confident	92.7	Very high	83 Å²	83	33.9 Å²	33.9	39%	0.388	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.2	177.5	-68.1	-176.6	174.6	0	0	110.1	V123 K127 I232	V123-E125 HydrophobicContact CG1-CG 4.08Å; E125-K127 WeakPolarHBondContact OE2-CE 3.38Å; E125-I232 PolarHBondContact N-O 2.86Å; E125-I232 PolarHBondContact O-N 2.91Å
126	I	87.5	Confident	92.7	Very high	124 Å²	124	36 Å²	36	64%	0.636	17%	0.165	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	109.5	169.3	-59.7	174.7	0	0	0	107.2	K229	I126-K229 HydrophobicContact CG2-CB 3.88Å; I126-K229 HydrophobicContact CG2-CD 4.27Å; I126-K229 HydrophobicContact CG2-CG 4.31Å
127	K	87.7	Confident	92.8	Very high	44 Å²	44	36.9 Å²	36.9	19%	0.191	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	135.4	174.8	-62.6	-159.2	-173.2	178.9	0	110.5	E125 V129 E192 K229 K230 I232	E125-K127 WeakPolarHBondContact OE2-CE 3.38Å; K127-V129 HydrophobicContact CB-CG1 3.96Å; K127-E192 HydrophobicContact CD-CG 4.39Å; K127-E192 WeakPolarHBondContact CD-OE1 3.37Å; K127-E192 IonicContact NZ-OE1 2.72Å; K127-E192 PolarHBondContact NZ-OE1 2.92Å; K127-E192 IonicContact NZ-OE2 2.88Å; K127-E192 PolarHBondContact NZ-OE2 3.09Å; K127-K229 WeakPolarHBondContact O-CA 3.03Å; K127-K230 PolarHBondContact N-O 3.35Å; K127-K230 PolarHBondContact O-N 3.43Å; K127-I232 HydrophobicContact CB-CD1 4.24Å; K127-I232 HydrophobicContact CD-CD1 3.56Å; K127-I232 HydrophobicContact CG-CD1 3.86Å; K127-I232 HydrophobicContact CG-CG1 4.45Å
128	E	90.6	Very high	92.8	Very high	52 Å²	52	36 Å²	36	24%	0.243	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.9	163.8	-61.8	-153.5	157	0	0	109.2	T193 R227 K229	E128-T193 PolarHBondContact O-N 2.87Å; E128-T193 PolarHBondContact O-OG1 3.34Å; E128-T193 VanDerWaalsContact O-OG1 3.08Å; E128-R227 IonicContact OE1-NH2 3.17Å; E128-R227 IonicContact OE2-CZ 2.87Å; E128-R227 IonicContact OE2-NE 3.43Å; E128-R227 PolarHBondContact OE2-NE 3.22Å; E128-R227 IonicContact OE2-NH2 3.27Å; E128-R227 PolarHBondContact OE2-NH2 3.14Å; E128-K229 HydrophobicContact CG-CG 4.2Å; E128-K229 WeakPolarHBondContact OE1-CE 3.19Å; E128-K229 IonicContact OE1-NZ 3.34Å
129	V	93.1	Very high	92.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	147.7	-172.8	-53.3	0	0	0	0	110.3	K127 Y190 M191 R227 K228 K230	K127-V129 HydrophobicContact CB-CG1 3.96Å; V129-Y190 HydrophobicContact CB-CD2 4.12Å; V129-Y190 HydrophobicContact CB-CE2 3.54Å; V129-Y190 HydrophobicContact CG1-CD2 4.41Å; V129-Y190 HydrophobicContact CG1-CE2 3.39Å; V129-Y190 VanDerWaalsContact CG1-OH 3.26Å; V129-Y190 WeakPolarHBondContact CG1-OH 3.37Å; V129-Y190 HydrophobicContact CG2-CD2 4.33Å; V129-Y190 HydrophobicContact CG2-CE2 3.84Å; V129-M191 CarbonylContact C-O 3.58Å; V129-M191 WeakPolarHBondContact CA-O 3.4Å; V129-R227 WeakPolarHBondContact O-CA 3.32Å; V129-K228 HydrophobicContact CG2-CG 3.72Å; V129-K228 WeakPolarHBondContact CG2-O 3.35Å; V129-K228 PolarHBondContact N-O 3.41Å; V129-K228 PolarHBondContact O-N 2.95Å; V129-K230 HydrophobicContact CG1-CB 4.37Å; V129-K230 HydrophobicContact CG2-CB 3.92Å; V129-K230 HydrophobicContact CG2-CD 4.49Å
130	F	94.3	Very high	92.5	Very high	29 Å²	29	41.5 Å²	41.5	13%	0.127	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.7	164.9	-63.5	-85.9	0	0	0	108.5	L159 K166 L168 Y190 M191 T193 V226 R227	F130-L159 HydrophobicContact CB-CD1 3.83Å; F130-K166 HydrophobicContact CE1-CD 4.38Å; F130-L168 HydrophobicContact CB-CD1 3.91Å; F130-L168 HydrophobicContact CD1-CD1 3.65Å; F130-L168 HydrophobicContact CD1-CD2 3.86Å; F130-L168 HydrophobicContact CD1-CG 4.38Å; F130-L168 HydrophobicContact CD2-CD1 4.2Å; F130-L168 HydrophobicContact CE1-CD1 4.17Å; F130-L168 HydrophobicContact CE1-CD2 3.54Å; F130-L168 HydrophobicContact CG-CD1 3.66Å; F130-L168 HydrophobicContact CZ-CD2 4Å; F130-Y190 CarbonylContact O-C 3.53Å; F130-Y190 WeakPolarHBondContact O-CA 3.43Å; F130-M191 HydrophobicContact CB-CB 4.35Å; F130-M191 HydrophobicContact CB-CE 4.21Å; F130-M191 PolarHBondContact N-O 3.22Å; F130-M191 PolarHBondContact O-N 3.07Å; F130-T193 HydrophobicContact CE2-CG2 4.42Å; F130-T193 WeakPolarHBondContact CE2-OG1 3.47Å; F130-V226 CarbonylContact C-O 3.56Å; F130-V226 VanDerWaalsContact CA-O 3.31Å; F130-V226 WeakPolarHBondContact CA-O 3.43Å; F130-V226 HydrophobicContact CD1-CG1 4.21Å; F130-R227 HydrophobicContact CD1-CB 3.88Å; F130-R227 HydrophobicContact CD1-CG 4.24Å; F130-R227 HydrophobicContact CE1-CB 3.62Å; F130-R227 HydrophobicContact CE1-CG 3.74Å; F130-R227 HydrophobicContact CZ-CB 4.44Å; F130-R227 HydrophobicContact CZ-CG 4.07Å
131	E	94.2	Very high	92.1	Very high	21 Å²	21	46.3 Å²	46.3	10%	0.098	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130.4	179.7	-164.4	-174.8	114.8	0	0	109.1	T161 I189 L201 P222 V226 K228 K230	E131-T161 WeakPolarHBondContact O-CG2 3.47Å; E131-I189 WeakPolarHBondContact CA-O 3.4Å; E131-L201 HydrophobicContact CG-CD1 4.31Å; E131-P222 HydrophobicContact CG-CB 4.26Å; E131-P222 HydrophobicContact CG-CG 3.97Å; E131-P222 WeakPolarHBondContact OE1-CB 3.46Å; E131-V226 PolarHBondContact N-O 3.44Å; E131-K228 VanDerWaalsContact CD-CE 3.49Å; E131-K228 IonicContact OE1-NZ 3.54Å; E131-K228 PolarHBondContact OE1-NZ 3.46Å; E131-K228 WeakPolarHBondContact OE2-CE 3.46Å; E131-K228 IonicContact OE2-NZ 2.79Å; E131-K228 PolarHBondContact OE2-NZ 3.08Å; E131-K230 IonicContact OE2-NZ 2.82Å
132	G	95.6	Very high	91.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.3	164.6	-178.3	0	0	0	0	0	112.5	R160 V188 I189	G132-R160 CarbonylContact C-O 3.55Å; G132-R160 VanDerWaalsContact CA-O 3.31Å; G132-R160 WeakPolarHBondContact CA-O 3.49Å; G132-V188 WeakPolarHBondContact O-CA 3.26Å; G132-I189 PolarHBondContact N-O 2.81Å; G132-I189 PolarHBondContact O-N 2.97Å
133	E	96.1	Very high	90.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130.7	164.9	-176.4	-162.1	149.3	0	0	109.4	T135 L159 R160 D187 V188 S204 Y207 L221	E133-T135 PolarHBondContact O-N 3.1Å; E133-L159 CarbonylContact O-C 3.52Å; E133-L159 VanDerWaalsContact O-CA 3.31Å; E133-L159 WeakPolarHBondContact O-CA 2.93Å; E133-R160 PolarHBondContact N-O 3.43Å; E133-R160 PolarHBondContact O-N 3.04Å; E133-R160 IonicContact OE1-CZ 3.77Å; E133-R160 IonicContact OE1-NH2 2.76Å; E133-R160 PolarHBondContact OE1-NH2 2.85Å; E133-R160 IonicContact OE2-CZ 3.54Å; E133-R160 IonicContact OE2-NE 3.39Å; E133-R160 PolarHBondContact OE2-NE 3.13Å; E133-R160 IonicContact OE2-NH2 2.83Å; E133-R160 PolarHBondContact OE2-NH2 2.95Å; E133-D187 CarbonylContact C-O 3.44Å; E133-D187 VanDerWaalsContact CA-O 3.32Å; E133-D187 WeakPolarHBondContact CA-O 3.32Å; E133-V188 HydrophobicContact CB-CG2 4.32Å; E133-S204 PolarHBondContact OE2-OG 3.38Å; E133-Y207 WeakPolarHBondContact OE1-CE2 3.44Å; E133-Y207 PolarHBondContact OE1-OH 3.35Å; E133-L221 HydrophobicContact CB-CD2 4.21Å; E133-L221 WeakPolarHBondContact OE2-CD2 3.34Å
134	V	96.7	Very high	88.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	119.8	175.3	-179.6	0	0	0	0	109.7	I137 V157 G158 L159 I183 G186 D187 I189	V134-I137 HydrophobicContact CG1-CD1 3.88Å; V134-I137 HydrophobicContact CG1-CG1 3.49Å; V134-I137 VanDerWaalsContact CG1-CG1 3.49Å; V134-V157 HydrophobicContact CG1-CG1 4.33Å; V134-G158 CarbonylContact C-O 3.27Å; V134-G158 WeakPolarHBondContact CA-O 3.39Å; V134-L159 HydrophobicContact CG2-CD2 4.05Å; V134-I183 HydrophobicContact CG2-CG2 3.98Å; V134-G186 PolarHBondContact O-N 3.09Å; V134-D187 WeakPolarHBondContact CG2-O 3.49Å; V134-D187 PolarHBondContact N-O 3.18Å; V134-I189 HydrophobicContact CG2-CB 4.37Å; V134-I189 HydrophobicContact CG2-CD1 3.62Å; V134-I189 HydrophobicContact CG2-CG1 3.72Å; V134-I189 HydrophobicContact CG2-CG2 3.79Å
135	T	95.6	Very high	87.6	Confident	51 Å²	51	60.2 Å²	60.2	31%	0.313	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-26.6	177.7	57.8	0	0	0	0	113.2	E133 G158 R160 V185	E133-T135 PolarHBondContact O-N 3.1Å; T135-G158 PolarHBondContact N-O 2.84Å; T135-G158 VanDerWaalsContact OG1-C 3.26Å; T135-G158 WeakPolarHBondContact OG1-CA 3.49Å; T135-G158 PolarHBondContact OG1-O 3.45Å; T135-R160 HydrophobicContact CG2-CB 3.52Å; T135-V185 WeakPolarHBondContact O-CG1 3.43Å
136	E	95	Very high	86.6	Confident	57 Å²	57	59.8 Å²	59.8	27%	0.266	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	151	177.8	63.1	-176.3	-175.4	0	0	110.2	V157 G158 Q167	E136-V157 WeakPolarHBondContact O-CA 3.49Å; E136-G158 VanDerWaalsContact CG-N 3.35Å; E136-G158 PolarHBondContact O-N 3.5Å; E136-Q167 VanDerWaalsContact OE1-CG 3.24Å; E136-Q167 WeakPolarHBondContact OE1-CG 3.46Å; E136-Q167 PolarHBondContact OE1-NE2 2.83Å
137	I	94	Very high	85.4	Confident	42 Å²	42	56.7 Å²	56.7	22%	0.215	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	107.7	170.4	-53.9	174.8	0	0	0	106.3	V134 V155 V156 I178 I183	V134-I137 HydrophobicContact CG1-CD1 3.88Å; V134-I137 HydrophobicContact CG1-CG1 3.49Å; V134-I137 VanDerWaalsContact CG1-CG1 3.49Å; I137-V155 HydrophobicContact CG2-CG2 3.75Å; I137-V156 CarbonylContact C-O 3.58Å; I137-V156 WeakPolarHBondContact CA-O 3.48Å; I137-I178 HydrophobicContact CD1-CG2 4.02Å; I137-I178 HydrophobicContact CG2-CG2 4.42Å; I137-I183 HydrophobicContact CD1-CG2 4.2Å; I137-I183 WeakPolarHBondContact CD1-O 3.48Å
138	T	93.2	Very high	84.1	Confident	59 Å²	59	61.9 Å²	61.9	36%	0.362	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	98.3	-174.3	-54.3	0	0	0	0	109.8	V156	T138-V156 PolarHBondContact N-O 3.48Å; T138-V156 PolarHBondContact O-N 3.16Å
139	P	90	Very high	82.8	Confident	48 Å²	48	63.1 Å²	63.1	31%	0.312	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	136.4	174.3	28.7	-31.8	0	0	0	110.4	I152 Y175	P139-I152 HydrophobicContact CB-CD1 4.26Å; P139-I152 HydrophobicContact CB-CG2 4.26Å; P139-Y175 HydrophobicContact CB-CD2 4.44Å; P139-Y175 HydrophobicContact CB-CE2 3.95Å; P139-Y175 HydrophobicContact CG-CE2 4.21Å
140	H	89	Confident	81.8	Confident	80 Å²	80	70 Å²	70	37%	0.37	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	120	173.2	-75.3	-80.6	0	0	0	110.1	A153 H154	H140-A153 PolarHBondContact O-N 3.49Å; H140-H154 VanDerWaalsContact CB-CE1 3.43Å; H140-H154 WeakPolarHBondContact CB-CE1 3.5Å; H140-H154 AromaticContact CD2-CD2 3.62Å; H140-H154 AromaticContact CD2-NE2 3.31Å; H140-H154 PolarHBondContact CD2-NE2 2.88Å; H140-H154 VanDerWaalsContact CD2-NE2 3.31Å; H140-H154 AromaticContact CG-CE1 3.79Å; H140-H154 AromaticContact CG-NE2 3.49Å; H140-H154 PolarHBondContact N-O 3.09Å
141	E	85.1	Confident	81	Confident	107 Å²	107	72.6 Å²	72.6	50%	0.5	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	142	-179.3	-60.1	175.6	154.6	0	0	110.7	K150 I151	E141-K150 HydrophobicContact CB-CB 4.36Å; E141-K150 HydrophobicContact CB-CD 4.28Å; E141-K150 HydrophobicContact CG-CD 4.43Å; E141-K150 WeakPolarHBondContact OE2-CD 3.4Å; E141-K150 WeakPolarHBondContact OE2-CE 3.45Å; E141-K150 IonicContact OE2-NZ 2.77Å; E141-K150 PolarHBondContact OE2-NZ 3.23Å; E141-I151 CarbonylContact C-O 3.57Å; E141-I151 WeakPolarHBondContact CA-O 3.47Å
142	C	77.3	Confident	80.3	Confident	69 Å²	69	73.5 Å²	73.5	47%	0.466	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151.5	166	-69.4	0	0	0	0	109.4	I151 A153	C142-I151 PolarHBondContact N-O 3.48Å; C142-I151 PolarHBondContact O-N 3.44Å; C142-A153 HydrophobicContact CB-CB 4.15Å; C142-A153 WeakPolarHBondContact SG-CB 3.44Å
143	E	70.6	Confident	79.8	Confident	163 Å²	163	75.4 Å²	75.4	76%	0.762	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	134.1	173.1	-68	-176.1	167.4	0	0	109.8
144	N	64.2	Low	79.4	Confident	50 Å²	50	77.1 Å²	77.1	27%	0.267	43%	0.428	S	S	.	.			trans	-68.5	155.8	167.5	-82.7	-17.1	0	0	0	111.1	S146 G147 T149 I151	N144-S146 PolarHBondContact O-N 3.26Å; N144-G147 PolarHBondContact O-N 2.71Å; N144-T149 PolarHBondContact N-O 3.39Å; N144-T149 PolarHBondContact ND2-OG1 2.91Å; N144-I151 VanDerWaalsContact CG-CD1 3.48Å; N144-I151 WeakPolarHBondContact ND2-CD1 3.39Å; N144-I151 VanDerWaalsContact ND2-CG1 3.28Å; N144-I151 WeakPolarHBondContact ND2-CG1 3.49Å; N144-I151 WeakPolarHBondContact OD1-CD1 3.44Å; N144-I151 WeakPolarHBondContact OD1-CG1 3.29Å
145	D	63.8	Low	79.1	Confident	186 Å²	186	77.1 Å²	77.1	100%	0.995	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-19.1	173.4	-72.4	-21.6	0	0	0	113.7
146	S	64.4	Low	79	Confident	74 Å²	74	75.9 Å²	75.9	52%	0.517	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.6	176.7	59.3	0	0	0	0	115.3	N144 L148	N144-S146 PolarHBondContact O-N 3.26Å; S146-L148 WeakPolarHBondContact O-CD1 3.42Å; S146-L148 WeakPolarHBondContact O-CG 3.2Å; S146-L148 PolarHBondContact O-N 3.46Å
147	G	62.2	Low	79	Confident	58 Å²	58	73.2 Å²	73.2	60%	0.598	41%	0.408	S	S	*	.	S	Bend	trans	62.6	-3.3	177.2	0	0	0	0	0	116.6	N144	N144-G147 PolarHBondContact O-N 2.71Å
148	L	60.6	Low	79.1	Confident	154 Å²	154	71.3 Å²	71.3	81%	0.806	40%	0.398	S	S	*	.	S	Bend	trans	-97.7	-17.8	-169.3	-80.9	147.8	0	0	0	113.8	S146	S146-L148 WeakPolarHBondContact O-CD1 3.42Å; S146-L148 WeakPolarHBondContact O-CG 3.2Å; S146-L148 PolarHBondContact O-N 3.46Å
149	T	63.9	Low	79.3	Confident	78 Å²	78	68.5 Å²	68.5	48%	0.479	38%	0.381	S	S	.	.			trans	-138.4	133	-176.7	44.9	0	0	0	0	110.5	N144	N144-T149 PolarHBondContact N-O 3.39Å; N144-T149 PolarHBondContact ND2-OG1 2.91Å
150	K	71.9	Confident	79.5	Confident	143 Å²	143	70.7 Å²	70.7	62%	0.622	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	125.8	171.6	-61.3	-164.9	-179	179	0	108.8	E141	E141-K150 HydrophobicContact CB-CB 4.36Å; E141-K150 HydrophobicContact CB-CD 4.28Å; E141-K150 HydrophobicContact CG-CD 4.43Å; E141-K150 WeakPolarHBondContact OE2-CD 3.4Å; E141-K150 WeakPolarHBondContact OE2-CE 3.45Å; E141-K150 IonicContact OE2-NZ 2.77Å; E141-K150 PolarHBondContact OE2-NZ 3.23Å
151	I	77.6	Confident	79.8	Confident	85 Å²	85	67.2 Å²	67.2	44%	0.436	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136.4	171.6	-68.6	-166	0	0	0	108.5	E141 C142 N144 A153	E141-I151 CarbonylContact C-O 3.57Å; E141-I151 WeakPolarHBondContact CA-O 3.47Å; C142-I151 PolarHBondContact N-O 3.48Å; C142-I151 PolarHBondContact O-N 3.44Å; N144-I151 VanDerWaalsContact CG-CD1 3.48Å; N144-I151 WeakPolarHBondContact ND2-CD1 3.39Å; N144-I151 VanDerWaalsContact ND2-CG1 3.28Å; N144-I151 WeakPolarHBondContact ND2-CG1 3.49Å; N144-I151 WeakPolarHBondContact OD1-CD1 3.44Å; N144-I151 WeakPolarHBondContact OD1-CG1 3.29Å; I151-A153 PolarHBondContact O-N 3.13Å
152	I	80.1	Confident	80.2	Confident	40 Å²	40	66.3 Å²	66.3	21%	0.205	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	116.3	171.1	-62	174.4	0	0	0	107.3	P139 A172 Y175	P139-I152 HydrophobicContact CB-CD1 4.26Å; P139-I152 HydrophobicContact CB-CG2 4.26Å; I152-A172 WeakPolarHBondContact O-CB 3.37Å; I152-Y175 HydrophobicContact CD1-CD1 3.24Å; I152-Y175 HydrophobicContact CD1-CE1 3.03Å; I152-Y175 HydrophobicContact CD1-CE2 4.5Å; I152-Y175 HydrophobicContact CD1-CG 4.06Å
153	A	83.8	Confident	81	Confident	39 Å²	39	70.6 Å²	70.6	32%	0.322	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-38.3	177.5	0	0	0	0	0	111.7	H140 C142 I151	H140-A153 PolarHBondContact O-N 3.49Å; C142-A153 HydrophobicContact CB-CB 4.15Å; C142-A153 WeakPolarHBondContact SG-CB 3.44Å; I151-A153 PolarHBondContact O-N 3.13Å
154	H	88	Confident	82	Confident	37 Å²	37	64.6 Å²	64.6	17%	0.171	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	163.1	177.5	57	-77.9	0	0	0	110.2	H140 K169 L170	H140-H154 VanDerWaalsContact CB-CE1 3.43Å; H140-H154 WeakPolarHBondContact CB-CE1 3.5Å; H140-H154 AromaticContact CD2-CD2 3.62Å; H140-H154 AromaticContact CD2-NE2 3.31Å; H140-H154 PolarHBondContact CD2-NE2 2.88Å; H140-H154 VanDerWaalsContact CD2-NE2 3.31Å; H140-H154 AromaticContact CG-CE1 3.79Å; H140-H154 AromaticContact CG-NE2 3.49Å; H140-H154 PolarHBondContact N-O 3.09Å; H154-K169 HydrophobicContact CB-CG 4.17Å; H154-K169 WeakPolarHBondContact CD2-CE 3.45Å; H154-K169 PolarHBondContact CD2-NZ 3.41Å; H154-K169 PolarHBondContact CE1-NZ 2.91Å; H154-K169 VanDerWaalsContact CG-CE 3.41Å; H154-K169 WeakPolarHBondContact NE2-CE 3.36Å; H154-K169 PolarHBondContact NE2-NZ 2.93Å; H154-L170 WeakPolarHBondContact CA-O 3.39Å; H154-L170 VanDerWaalsContact CB-O 3.27Å; H154-L170 WeakPolarHBondContact CB-O 3.45Å
155	V	91.4	Very high	83.4	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.6	171.8	62.5	0	0	0	0	110.1	I137 V157 L170 Y175 I178	I137-V155 HydrophobicContact CG2-CG2 3.75Å; V155-V157 HydrophobicContact CG1-CG2 4.37Å; V155-V157 HydrophobicContact CG2-CG2 4.14Å; V155-L170 HydrophobicContact CG1-CB 3.72Å; V155-L170 HydrophobicContact CG1-CD1 4.39Å; V155-L170 PolarHBondContact N-O 3.38Å; V155-L170 PolarHBondContact O-N 3Å; V155-Y175 HydrophobicContact CB-CD2 4.01Å; V155-Y175 HydrophobicContact CG1-CD2 4.3Å; V155-Y175 HydrophobicContact CG2-CD2 3.9Å; V155-Y175 HydrophobicContact CG2-CE2 4.42Å; V155-I178 HydrophobicContact CG1-CD1 4.25Å
156	V	94	Very high	84.9	Confident	25 Å²	25	61.9 Å²	61.9	15%	0.152	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	122.1	171.6	177.8	0	0	0	0	108.5	I137 T138 Q167 L168	I137-V156 CarbonylContact C-O 3.58Å; I137-V156 WeakPolarHBondContact CA-O 3.48Å; T138-V156 PolarHBondContact N-O 3.48Å; T138-V156 PolarHBondContact O-N 3.16Å; V156-Q167 HydrophobicContact CG1-CB 4.48Å; V156-L168 CarbonylContact C-O 3.59Å; V156-L168 WeakPolarHBondContact CA-O 3.27Å
157	V	94.4	Very high	86.4	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.006	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.6	177.4	179.8	0	0	0	0	109.1	V134 E136 V155 L159 L168 L170 I178	V134-V157 HydrophobicContact CG1-CG1 4.33Å; E136-V157 WeakPolarHBondContact O-CA 3.49Å; V155-V157 HydrophobicContact CG1-CG2 4.37Å; V155-V157 HydrophobicContact CG2-CG2 4.14Å; V157-L159 HydrophobicContact CG1-CD2 4.13Å; V157-L159 HydrophobicContact CG1-CG 4.44Å; V157-L168 PolarHBondContact N-O 3.18Å; V157-L168 PolarHBondContact O-N 3.15Å; V157-L170 HydrophobicContact CB-CD1 4.07Å; V157-L170 HydrophobicContact CG2-CD1 3.6Å; V157-L170 HydrophobicContact CG2-CG 4.32Å; V157-I178 HydrophobicContact CG2-CD1 3.87Å
158	G	95.9	Very high	87.8	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	132.3	171.1	0	0	0	0	0	110.7	V134 T135 E136	V134-G158 CarbonylContact C-O 3.27Å; V134-G158 WeakPolarHBondContact CA-O 3.39Å; T135-G158 PolarHBondContact N-O 2.84Å; T135-G158 VanDerWaalsContact OG1-C 3.26Å; T135-G158 WeakPolarHBondContact OG1-CA 3.49Å; T135-G158 PolarHBondContact OG1-O 3.45Å; E136-G158 VanDerWaalsContact CG-N 3.35Å; E136-G158 PolarHBondContact O-N 3.5Å
159	L	96.8	Very high	89.3	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	142.7	175.5	-66.1	-177.5	0	0	0	111.1	F130 E133 V134 V157 S165 K166 L168 I189 M191 V226	F130-L159 HydrophobicContact CB-CD1 3.83Å; E133-L159 CarbonylContact O-C 3.52Å; E133-L159 VanDerWaalsContact O-CA 3.31Å; E133-L159 WeakPolarHBondContact O-CA 2.93Å; V134-L159 HydrophobicContact CG2-CD2 4.05Å; V157-L159 HydrophobicContact CG1-CD2 4.13Å; V157-L159 HydrophobicContact CG1-CG 4.44Å; L159-S165 CarbonylContact O-C 3.52Å; L159-S165 WeakPolarHBondContact O-CA 3.34Å; L159-S165 WeakPolarHBondContact O-CB 3.31Å; L159-K166 PolarHBondContact N-O 2.92Å; L159-K166 PolarHBondContact O-N 3.28Å; L159-L168 HydrophobicContact CD1-CD1 3.68Å; L159-L168 HydrophobicContact CG-CD1 4.32Å; L159-I189 HydrophobicContact CD2-CD1 3.94Å; L159-I189 HydrophobicContact CD2-CG1 3.78Å; L159-M191 HydrophobicContact CD1-CE 3.71Å; L159-M191 HydrophobicContact CG-CE 4.4Å; L159-V226 HydrophobicContact CB-CG1 3.55Å; L159-V226 HydrophobicContact CB-CG2 4.4Å; L159-V226 HydrophobicContact CD1-CG1 3.57Å; L159-V226 HydrophobicContact CG-CG1 4.24Å
160	R	95.4	Very high	90.6	Very high	94 Å²	94	59.7 Å²	59.7	36%	0.355	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.6	177.9	-179.9	173.8	65.8	-169.6	2.2	111.8	G132 E133 T135 L221	G132-R160 CarbonylContact C-O 3.55Å; G132-R160 VanDerWaalsContact CA-O 3.31Å; G132-R160 WeakPolarHBondContact CA-O 3.49Å; E133-R160 PolarHBondContact N-O 3.43Å; E133-R160 PolarHBondContact O-N 3.04Å; E133-R160 IonicContact OE1-CZ 3.77Å; E133-R160 IonicContact OE1-NH2 2.76Å; E133-R160 PolarHBondContact OE1-NH2 2.85Å; E133-R160 IonicContact OE2-CZ 3.54Å; E133-R160 IonicContact OE2-NE 3.39Å; E133-R160 PolarHBondContact OE2-NE 3.13Å; E133-R160 IonicContact OE2-NH2 2.83Å; E133-R160 PolarHBondContact OE2-NH2 2.95Å; T135-R160 HydrophobicContact CG2-CB 3.52Å; R160-L221 HydrophobicContact CG-CD2 4.39Å
161	T	95.4	Very high	91.3	Very high	7 Å²	7	57.4 Å²	57.4	4%	0.043	30%	0.3	C	S	.	.			trans	-123.1	178.1	168.2	67.1	0	0	0	0	110	E131 K163 G164 P222 G224 V226	E131-T161 WeakPolarHBondContact O-CG2 3.47Å; T161-K163 PolarHBondContact O-N 2.66Å; T161-K163 PolarHBondContact OG1-N 3.43Å; T161-G164 PolarHBondContact N-O 3.22Å; T161-G164 PolarHBondContact OG1-N 3.17Å; T161-G164 PolarHBondContact OG1-O 3.09Å; T161-P222 WeakPolarHBondContact CB-O 3.41Å; T161-P222 HydrophobicContact CG2-CB 4.07Å; T161-G224 VanDerWaalsContact CB-O 3.26Å; T161-G224 WeakPolarHBondContact CB-O 3.33Å; T161-G224 PolarHBondContact OG1-O 2.94Å; T161-V226 HydrophobicContact CG2-CB 4.35Å; T161-V226 HydrophobicContact CG2-CG2 3.84Å
162	T	93.1	Very high	91.7	Very high	89 Å²	89	54.8 Å²	54.8	55%	0.546	29%	0.291	S	S	.	.	S	Bend	trans	-62	-22.1	173	51.1	0	0	0	0	114.5	L221 P222 K223	T162-L221 HydrophobicContact CG2-CB 3.96Å; T162-P222 PolarHBondContact N-O 3.39Å; T162-P222 VanDerWaalsContact N-O 3.08Å; T162-P222 PolarHBondContact OG1-O 3.5Å; T162-K223 WeakPolarHBondContact OG1-CA 3.36Å
163	K	92.5	Very high	91.9	Very high	159 Å²	159	56.1 Å²	56.1	69%	0.691	30%	0.304	S	S	*	.	S	Bend	trans	-98.4	-22.5	-179.6	-67.6	-161.6	178.9	-175.3	0	114.2	T161 G224	T161-K163 PolarHBondContact O-N 2.66Å; T161-K163 PolarHBondContact OG1-N 3.43Å; K163-G224 WeakPolarHBondContact CB-O 3.47Å
164	G	92	Very high	92.1	Very high	36 Å²	36	55.6 Å²	55.6	37%	0.371	30%	0.296	S	S	.	.			trans	175.8	178.1	-177.4	0	0	0	0	0	113.4	T161	T161-G164 PolarHBondContact N-O 3.22Å; T161-G164 PolarHBondContact OG1-N 3.17Å; T161-G164 PolarHBondContact OG1-O 3.09Å
165	S	95	Very high	92	Very high	94 Å²	94	56.3 Å²	56.3	66%	0.657	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	157.8	175.9	57	0	0	0	0	111.1	L159	L159-S165 CarbonylContact O-C 3.52Å; L159-S165 WeakPolarHBondContact O-CA 3.34Å; L159-S165 WeakPolarHBondContact O-CB 3.31Å
166	K	94.9	Very high	91.7	Very high	85 Å²	85	60.7 Å²	60.7	37%	0.37	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	131.3	177.4	-170.8	169.3	-175	170.8	0	110.2	F130 L159 L168 V226	F130-K166 HydrophobicContact CE1-CD 4.38Å; L159-K166 PolarHBondContact N-O 2.92Å; L159-K166 PolarHBondContact O-N 3.28Å; K166-L168 HydrophobicContact CD-CD2 4.07Å; K166-L168 HydrophobicContact CG-CD2 4.1Å; K166-V226 HydrophobicContact CB-CB 4.08Å; K166-V226 HydrophobicContact CB-CG1 4.14Å; K166-V226 HydrophobicContact CB-CG2 4Å
167	Q	95.2	Very high	91.4	Very high	135 Å²	135	61.1 Å²	61.1	63%	0.631	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	135.5	168.5	-69.7	-180	-17.8	0	0	110	E136 V156	E136-Q167 VanDerWaalsContact OE1-CG 3.24Å; E136-Q167 WeakPolarHBondContact OE1-CG 3.46Å; E136-Q167 PolarHBondContact OE1-NE2 2.83Å; V156-Q167 HydrophobicContact CG1-CB 4.48Å
168	L	92.7	Very high	91.2	Very high	15 Å²	15	61.3 Å²	61.3	8%	0.079	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	132.4	179.5	-59.4	176	0	0	0	108.9	F130 V156 V157 L159 K166 L170 M191	F130-L168 HydrophobicContact CB-CD1 3.91Å; F130-L168 HydrophobicContact CD1-CD1 3.65Å; F130-L168 HydrophobicContact CD1-CD2 3.86Å; F130-L168 HydrophobicContact CD1-CG 4.38Å; F130-L168 HydrophobicContact CD2-CD1 4.2Å; F130-L168 HydrophobicContact CE1-CD1 4.17Å; F130-L168 HydrophobicContact CE1-CD2 3.54Å; F130-L168 HydrophobicContact CG-CD1 3.66Å; F130-L168 HydrophobicContact CZ-CD2 4Å; V156-L168 CarbonylContact C-O 3.59Å; V156-L168 WeakPolarHBondContact CA-O 3.27Å; V157-L168 PolarHBondContact N-O 3.18Å; V157-L168 PolarHBondContact O-N 3.15Å; L159-L168 HydrophobicContact CD1-CD1 3.68Å; L159-L168 HydrophobicContact CG-CD1 4.32Å; K166-L168 HydrophobicContact CD-CD2 4.07Å; K166-L168 HydrophobicContact CG-CD2 4.1Å; L168-L170 HydrophobicContact CB-CD2 4.05Å; L168-L170 HydrophobicContact CB-CG 4.43Å; L168-M191 HydrophobicContact CD1-CE 3.67Å
169	K	91.5	Very high	90.9	Very high	147 Å²	147	65.8 Å²	65.8	64%	0.639	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	109.4	170.1	178.9	163.6	167.2	151.6	0	107.9	H154	H154-K169 HydrophobicContact CB-CG 4.17Å; H154-K169 WeakPolarHBondContact CD2-CE 3.45Å; H154-K169 PolarHBondContact CD2-NZ 3.41Å; H154-K169 PolarHBondContact CE1-NZ 2.91Å; H154-K169 VanDerWaalsContact CG-CE 3.41Å; H154-K169 WeakPolarHBondContact NE2-CE 3.36Å; H154-K169 PolarHBondContact NE2-NZ 2.93Å
170	L	90.1	Very high	90.5	Very high	21 Å²	21	72.9 Å²	72.9	11%	0.11	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	150.3	-176.5	-55.8	-177.5	0	0	0	110.5	H154 V155 V157 L168 L174 I178 M191	H154-L170 WeakPolarHBondContact CA-O 3.39Å; H154-L170 VanDerWaalsContact CB-O 3.27Å; H154-L170 WeakPolarHBondContact CB-O 3.45Å; V155-L170 HydrophobicContact CG1-CB 3.72Å; V155-L170 HydrophobicContact CG1-CD1 4.39Å; V155-L170 PolarHBondContact N-O 3.38Å; V155-L170 PolarHBondContact O-N 3Å; V157-L170 HydrophobicContact CB-CD1 4.07Å; V157-L170 HydrophobicContact CG2-CD1 3.6Å; V157-L170 HydrophobicContact CG2-CG 4.32Å; L168-L170 HydrophobicContact CB-CD2 4.05Å; L168-L170 HydrophobicContact CB-CG 4.43Å; L170-L174 HydrophobicContact CB-CB 4.18Å; L170-L174 HydrophobicContact CB-CD1 3.85Å; L170-L174 HydrophobicContact CD1-CB 4.49Å; L170-L174 HydrophobicContact CD1-CD1 4.31Å; L170-L174 HydrophobicContact CD2-CD1 3.95Å; L170-L174 HydrophobicContact CG-CD1 4.25Å; L170-I178 HydrophobicContact CD1-CD1 4.43Å; L170-M191 HydrophobicContact CD1-CE 4.27Å; L170-M191 HydrophobicContact CD1-SD 3.82Å
171	D	86.9	Confident	90.2	Very high	96 Å²	96	72.5 Å²	72.5	51%	0.513	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	156.6	176.1	-175.3	-99.1	0	0	0	112.2	S173 L174	D171-S173 PolarHBondContact O-N 2.89Å; D171-S173 VanDerWaalsContact OD1-CB 3.32Å; D171-S173 WeakPolarHBondContact OD1-CB 3.39Å; D171-S173 PolarHBondContact OD1-N 3.34Å; D171-S173 PolarHBondContact OD1-OG 2.82Å; D171-L174 WeakPolarHBondContact O-CB 3.37Å; D171-L174 PolarHBondContact O-N 2.96Å; D171-L174 VanDerWaalsContact O-N 3.09Å
172	A	86.1	Confident	90	Very high	29 Å²	29	79.6 Å²	79.6	24%	0.24	41%	0.414	C	S	.	.	H	α-helix	trans	-55.4	-33.5	177.6	0	0	0	0	0	113.4	I152 L174 Y175	I152-A172 WeakPolarHBondContact O-CB 3.37Å; A172-L174 VanDerWaalsContact C-N 3.28Å; A172-L174 PolarHBondContact O-N 3.47Å; A172-Y175 VanDerWaalsContact O-CB 3.29Å; A172-Y175 WeakPolarHBondContact O-CB 3.29Å; A172-Y175 PolarHBondContact O-N 2.91Å; A172-Y175 VanDerWaalsContact O-N 3.16Å
173	S	85.1	Confident	90	Very high	68 Å²	68	76 Å²	76	48%	0.476	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-34.9	177.4	54.9	0	0	0	0	113.3	D171 Y175 N176	D171-S173 PolarHBondContact O-N 2.89Å; D171-S173 VanDerWaalsContact OD1-CB 3.32Å; D171-S173 WeakPolarHBondContact OD1-CB 3.39Å; D171-S173 PolarHBondContact OD1-N 3.34Å; D171-S173 PolarHBondContact OD1-OG 2.82Å; S173-Y175 VanDerWaalsContact C-N 3.29Å; S173-Y175 PolarHBondContact O-N 2.82Å; S173-N176 PolarHBondContact O-N 3.28Å
174	L	87.1	Confident	90	Very high	29 Å²	29	73.6 Å²	73.6	15%	0.152	38%	0.383	C	S	.	.	H	α-helix	trans	-72.7	-24.2	179.2	-67.8	-179.4	0	0	0	112.6	L170 D171 A172 N176 S177 I178 G196 I198	L170-L174 HydrophobicContact CB-CB 4.18Å; L170-L174 HydrophobicContact CB-CD1 3.85Å; L170-L174 HydrophobicContact CD1-CB 4.49Å; L170-L174 HydrophobicContact CD1-CD1 4.31Å; L170-L174 HydrophobicContact CD2-CD1 3.95Å; L170-L174 HydrophobicContact CG-CD1 4.25Å; D171-L174 WeakPolarHBondContact O-CB 3.37Å; D171-L174 PolarHBondContact O-N 2.96Å; D171-L174 VanDerWaalsContact O-N 3.09Å; A172-L174 VanDerWaalsContact C-N 3.28Å; A172-L174 PolarHBondContact O-N 3.47Å; L174-N176 VanDerWaalsContact C-N 3.29Å; L174-N176 PolarHBondContact O-N 3.34Å; L174-S177 PolarHBondContact O-N 2.92Å; L174-I178 WeakPolarHBondContact O-CG1 3.47Å; L174-I178 PolarHBondContact O-N 2.72Å; L174-I178 VanDerWaalsContact O-N 3.12Å; L174-G196 WeakPolarHBondContact CD2-O 3.44Å; L174-I198 HydrophobicContact CB-CD1 4.08Å; L174-I198 HydrophobicContact CD2-CD1 4.21Å; L174-I198 HydrophobicContact CD2-CG1 4.31Å
175	Y	86.6	Confident	90.2	Very high	51 Å²	51	74.9 Å²	74.9	20%	0.2	38%	0.383	C	S	.	.	H	α-helix	trans	-63.2	-36.6	175.3	-176.3	-107.1	0	0	0	112	P139 I152 V155 A172 S173 S177 I178 I179	P139-Y175 HydrophobicContact CB-CD2 4.44Å; P139-Y175 HydrophobicContact CB-CE2 3.95Å; P139-Y175 HydrophobicContact CG-CE2 4.21Å; I152-Y175 HydrophobicContact CD1-CD1 3.24Å; I152-Y175 HydrophobicContact CD1-CE1 3.03Å; I152-Y175 HydrophobicContact CD1-CE2 4.5Å; I152-Y175 HydrophobicContact CD1-CG 4.06Å; V155-Y175 HydrophobicContact CB-CD2 4.01Å; V155-Y175 HydrophobicContact CG1-CD2 4.3Å; V155-Y175 HydrophobicContact CG2-CD2 3.9Å; V155-Y175 HydrophobicContact CG2-CE2 4.42Å; A172-Y175 VanDerWaalsContact O-CB 3.29Å; A172-Y175 WeakPolarHBondContact O-CB 3.29Å; A172-Y175 PolarHBondContact O-N 2.91Å; A172-Y175 VanDerWaalsContact O-N 3.16Å; S173-Y175 VanDerWaalsContact C-N 3.29Å; S173-Y175 PolarHBondContact O-N 2.82Å; Y175-S177 VanDerWaalsContact C-N 3.34Å; Y175-S177 PolarHBondContact O-N 3.4Å; Y175-I178 WeakPolarHBondContact O-CB 3.27Å; Y175-I178 PolarHBondContact O-N 3.09Å; Y175-I179 HydrophobicContact CD1-CD1 3.72Å; Y175-I179 HydrophobicContact CD1-CG1 4.49Å; Y175-I179 HydrophobicContact CE1-CD1 3.22Å; Y175-I179 HydrophobicContact CE1-CG1 4.12Å; Y175-I179 PolarHBondContact O-N 3.39Å; Y175-I179 VanDerWaalsContact O-N 3.09Å
176	N	85.3	Confident	90	Very high	93 Å²	93	70.4 Å²	70.4	50%	0.497	35%	0.352	S	S	.	.	H	α-helix	trans	-62.1	-42.5	174.9	-66.7	-23.3	0	0	0	111.3	S173 L174 I178 I179 E180	S173-N176 PolarHBondContact O-N 3.28Å; L174-N176 VanDerWaalsContact C-N 3.29Å; L174-N176 PolarHBondContact O-N 3.34Å; N176-I178 VanDerWaalsContact C-N 3.29Å; N176-I178 PolarHBondContact O-N 3.4Å; N176-I179 PolarHBondContact O-N 2.76Å; N176-E180 WeakPolarHBondContact O-CB 3.44Å; N176-E180 WeakPolarHBondContact O-CG 3.39Å; N176-E180 PolarHBondContact O-N 2.93Å
177	S	88.2	Confident	90.1	Very high	33 Å²	33	66.4 Å²	66.4	23%	0.231	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-33	175.8	-59.3	0	0	0	0	113	L174 Y175 Q181	L174-S177 PolarHBondContact O-N 2.92Å; Y175-S177 VanDerWaalsContact C-N 3.34Å; Y175-S177 PolarHBondContact O-N 3.4Å; S177-Q181 VanDerWaalsContact O-CB 3.26Å; S177-Q181 WeakPolarHBondContact O-CB 3.28Å; S177-Q181 VanDerWaalsContact O-CG 3.27Å; S177-Q181 WeakPolarHBondContact O-CG 3.26Å; S177-Q181 PolarHBondContact O-N 2.91Å
178	I	90.1	Very high	90.1	Very high	6 Å²	6	60 Å²	60	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-44.5	174.2	-67.6	172.4	0	0	0	110.6	I137 V155 V157 L170 L174 Y175 N176 K182 I183 I198	I137-I178 HydrophobicContact CD1-CG2 4.02Å; I137-I178 HydrophobicContact CG2-CG2 4.42Å; V155-I178 HydrophobicContact CG1-CD1 4.25Å; V157-I178 HydrophobicContact CG2-CD1 3.87Å; L170-I178 HydrophobicContact CD1-CD1 4.43Å; L174-I178 WeakPolarHBondContact O-CG1 3.47Å; L174-I178 PolarHBondContact O-N 2.72Å; L174-I178 VanDerWaalsContact O-N 3.12Å; Y175-I178 WeakPolarHBondContact O-CB 3.27Å; Y175-I178 PolarHBondContact O-N 3.09Å; N176-I178 VanDerWaalsContact C-N 3.29Å; N176-I178 PolarHBondContact O-N 3.4Å; I178-K182 PolarHBondContact O-N 3.42Å; I178-K182 VanDerWaalsContact O-N 3.15Å; I178-I183 HydrophobicContact CG2-CB 3.99Å; I178-I183 HydrophobicContact CG2-CG2 4.44Å; I178-I183 PolarHBondContact O-N 2.95Å; I178-I198 HydrophobicContact CD1-CD1 4.31Å; I178-I198 HydrophobicContact CG1-CD1 3.79Å
179	I	89.3	Confident	90.2	Very high	94 Å²	94	59.4 Å²	59.4	48%	0.482	30%	0.301	S	S	.	.	H	α-helix	trans	-65.9	-48.4	177	-67.2	170.9	0	0	0	110.9	Y175 N176 Q181 K182	Y175-I179 HydrophobicContact CD1-CD1 3.72Å; Y175-I179 HydrophobicContact CD1-CG1 4.49Å; Y175-I179 HydrophobicContact CE1-CD1 3.22Å; Y175-I179 HydrophobicContact CE1-CG1 4.12Å; Y175-I179 PolarHBondContact O-N 3.39Å; Y175-I179 VanDerWaalsContact O-N 3.09Å; N176-I179 PolarHBondContact O-N 2.76Å; I179-Q181 VanDerWaalsContact C-N 3.3Å; I179-Q181 PolarHBondContact O-N 3.4Å; I179-K182 PolarHBondContact O-N 2.93Å
180	E	88.6	Confident	90.2	Very high	149 Å²	149	53.7 Å²	53.7	70%	0.696	28%	0.276	S	S	*	.	H	α-helix	trans	-60	-39.5	-179.4	-75.2	174.5	-177.5	0	0	112.1	N176 K182	N176-E180 WeakPolarHBondContact O-CB 3.44Å; N176-E180 WeakPolarHBondContact O-CG 3.39Å; N176-E180 PolarHBondContact O-N 2.93Å; E180-K182 VanDerWaalsContact C-N 3.28Å; E180-K182 PolarHBondContact O-N 3.26Å
181	Q	87.9	Confident	90.3	Very high	86 Å²	86	53 Å²	53	40%	0.402	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.4	177.3	-68.1	-76	-42.9	0	0	113.5	S177 I179 I183	S177-Q181 VanDerWaalsContact O-CB 3.26Å; S177-Q181 WeakPolarHBondContact O-CB 3.28Å; S177-Q181 VanDerWaalsContact O-CG 3.27Å; S177-Q181 WeakPolarHBondContact O-CG 3.26Å; S177-Q181 PolarHBondContact O-N 2.91Å; I179-Q181 VanDerWaalsContact C-N 3.3Å; I179-Q181 PolarHBondContact O-N 3.4Å; Q181-I183 VanDerWaalsContact C-N 3.31Å; Q181-I183 HydrophobicContact CB-CD1 3.76Å; Q181-I183 HydrophobicContact CB-CG1 3.72Å; Q181-I183 PolarHBondContact O-N 3.25Å
182	K	91.8	Very high	90.4	Very high	157 Å²	157	49.9 Å²	49.9	68%	0.683	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	51.3	-176	-59.6	-178.9	179	-179	0	112.3	I178 I179 E180	I178-K182 PolarHBondContact O-N 3.42Å; I178-K182 VanDerWaalsContact O-N 3.15Å; I179-K182 PolarHBondContact O-N 2.93Å; E180-K182 VanDerWaalsContact C-N 3.28Å; E180-K182 PolarHBondContact O-N 3.26Å
183	I	93.3	Very high	90.3	Very high	12 Å²	12	51.4 Å²	51.4	6%	0.062	26%	0.261	C	S	.	.			trans	-82.5	127.9	-178.4	-66.6	170.3	0	0	0	109.4	V134 I137 I178 Q181 I189 I198 R200	V134-I183 HydrophobicContact CG2-CG2 3.98Å; I137-I183 HydrophobicContact CD1-CG2 4.2Å; I137-I183 WeakPolarHBondContact CD1-O 3.48Å; I178-I183 HydrophobicContact CG2-CB 3.99Å; I178-I183 HydrophobicContact CG2-CG2 4.44Å; I178-I183 PolarHBondContact O-N 2.95Å; Q181-I183 VanDerWaalsContact C-N 3.31Å; Q181-I183 HydrophobicContact CB-CD1 3.76Å; Q181-I183 HydrophobicContact CB-CG1 3.72Å; Q181-I183 PolarHBondContact O-N 3.25Å; I183-I189 HydrophobicContact CD1-CG2 3.95Å; I183-I189 HydrophobicContact CG1-CG2 4.15Å; I183-I189 HydrophobicContact CG2-CG2 3.66Å; I183-I198 HydrophobicContact CD1-CB 4.47Å; I183-I198 HydrophobicContact CD1-CG2 3.31Å; I183-R200 HydrophobicContact CG1-CB 4.2Å
184	E	92.8	Very high	90.1	Very high	110 Å²	110	55.3 Å²	55.3	51%	0.514	28%	0.277	S	S	.	.			trans	-122.2	164.2	-179.3	-64.4	-176.8	178	0	0	112.2	G186 D187 R203	E184-G186 PolarHBondContact O-N 2.86Å; E184-D187 PolarHBondContact N-OD2 3.45Å; E184-D187 VanDerWaalsContact O-CB 3.32Å; E184-D187 WeakPolarHBondContact O-CB 3.48Å; E184-D187 PolarHBondContact O-N 3.38Å; E184-R203 IonicContact OE2-NH1 3.82Å; E184-R203 IonicContact OE2-NH2 3.94Å
185	V	94.7	Very high	89.7	Confident	63 Å²	63	56.7 Å²	56.7	38%	0.382	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	127.7	171	177.6	0	0	0	0	109.3	T135 R203	T135-V185 WeakPolarHBondContact O-CG1 3.43Å; V185-R203 PolarHBondContact O-NH1 2.97Å; V185-R203 VanDerWaalsContact O-NH1 3.09Å; V185-R203 PolarHBondContact O-NH2 3.41Å
186	G	92.7	Very high	89.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	100	-8.5	-172.5	0	0	0	0	0	114.3	V134 E184 S204	V134-G186 PolarHBondContact O-N 3.09Å; E184-G186 PolarHBondContact O-N 2.86Å; G186-S204 WeakPolarHBondContact O-CB 3.37Å; G186-S204 PolarHBondContact O-N 2.91Å
187	D	95.1	Very high	89.5	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	144.6	172.6	-68.7	-23.9	0	0	0	112	E133 V134 E184 I189 R200 R203	E133-D187 CarbonylContact C-O 3.44Å; E133-D187 VanDerWaalsContact CA-O 3.32Å; E133-D187 WeakPolarHBondContact CA-O 3.32Å; V134-D187 WeakPolarHBondContact CG2-O 3.49Å; V134-D187 PolarHBondContact N-O 3.18Å; E184-D187 PolarHBondContact N-OD2 3.45Å; E184-D187 VanDerWaalsContact O-CB 3.32Å; E184-D187 WeakPolarHBondContact O-CB 3.48Å; E184-D187 PolarHBondContact O-N 3.38Å; D187-I189 HydrophobicContact CB-CG2 4.34Å; D187-R200 HydrophobicContact CB-CG 4.39Å; D187-R200 IonicContact OD1-CZ 3.65Å; D187-R200 IonicContact OD1-NE 3.43Å; D187-R200 PolarHBondContact OD1-NE 2.68Å; D187-R200 IonicContact OD1-NH2 3.98Å; D187-R200 PolarHBondContact OD1-NH2 3.47Å; D187-R200 IonicContact OD2-CZ 3.48Å; D187-R200 IonicContact OD2-NE 3.59Å; D187-R200 PolarHBondContact OD2-NE 3.22Å; D187-R200 IonicContact OD2-NH2 3.06Å; D187-R203 WeakPolarHBondContact OD1-CD 3.48Å; D187-R203 IonicContact OD1-CZ 3.77Å; D187-R203 IonicContact OD1-NE 3.86Å; D187-R203 IonicContact OD1-NH1 2.87Å; D187-R203 PolarHBondContact OD1-NH1 3.23Å; D187-R203 IonicContact OD2-NH1 3.98Å
188	V	95.1	Very high	89.7	Confident	2 Å²	2	57 Å²	57	1%	0.012	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	123.1	168.3	-176.9	0	0	0	0	108.9	G132 E133 L201 G202 V219 P222	G132-V188 WeakPolarHBondContact O-CA 3.26Å; E133-V188 HydrophobicContact CB-CG2 4.32Å; V188-L201 HydrophobicContact CG1-CB 4.49Å; V188-L201 HydrophobicContact CG1-CD1 4.18Å; V188-L201 WeakPolarHBondContact O-CB 3.47Å; V188-L201 PolarHBondContact O-N 3.38Å; V188-G202 PolarHBondContact N-O 3.04Å; V188-V219 HydrophobicContact CB-CG2 3.57Å; V188-V219 HydrophobicContact CG1-CG2 4.31Å; V188-V219 HydrophobicContact CG2-CG2 3.63Å; V188-P222 HydrophobicContact CG1-CG 3.58Å
189	I	95.1	Very high	89.7	Confident	1 Å²	1	63 Å²	63	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	158.3	-178.1	70.2	170.3	0	0	0	111.6	E131 G132 V134 L159 I183 D187 M191 I198 K199	E131-I189 WeakPolarHBondContact CA-O 3.4Å; G132-I189 PolarHBondContact N-O 2.81Å; G132-I189 PolarHBondContact O-N 2.97Å; V134-I189 HydrophobicContact CG2-CB 4.37Å; V134-I189 HydrophobicContact CG2-CD1 3.62Å; V134-I189 HydrophobicContact CG2-CG1 3.72Å; V134-I189 HydrophobicContact CG2-CG2 3.79Å; L159-I189 HydrophobicContact CD2-CD1 3.94Å; L159-I189 HydrophobicContact CD2-CG1 3.78Å; I183-I189 HydrophobicContact CD1-CG2 3.95Å; I183-I189 HydrophobicContact CG1-CG2 4.15Å; I183-I189 HydrophobicContact CG2-CG2 3.66Å; D187-I189 HydrophobicContact CB-CG2 4.34Å; I189-M191 HydrophobicContact CD1-CE 3.95Å; I189-M191 HydrophobicContact CD1-CG 4.07Å; I189-M191 HydrophobicContact CD1-SD 3.97Å; I189-I198 HydrophobicContact CD1-CG2 4.22Å; I189-K199 WeakPolarHBondContact CA-O 3.49Å
190	Y	92	Very high	89.9	Confident	27 Å²	27	61.6 Å²	61.6	11%	0.106	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.8	173.3	166.1	-88	0	0	0	108.7	V129 F130 E192 I198 K199 K230	V129-Y190 HydrophobicContact CB-CD2 4.12Å; V129-Y190 HydrophobicContact CB-CE2 3.54Å; V129-Y190 HydrophobicContact CG1-CD2 4.41Å; V129-Y190 HydrophobicContact CG1-CE2 3.39Å; V129-Y190 VanDerWaalsContact CG1-OH 3.26Å; V129-Y190 WeakPolarHBondContact CG1-OH 3.37Å; V129-Y190 HydrophobicContact CG2-CD2 4.33Å; V129-Y190 HydrophobicContact CG2-CE2 3.84Å; F130-Y190 CarbonylContact O-C 3.53Å; F130-Y190 WeakPolarHBondContact O-CA 3.43Å; Y190-E192 HydrophobicContact CD1-CG 4.47Å; Y190-E192 HydrophobicContact CE1-CG 3.44Å; Y190-E192 VanDerWaalsContact CE1-CG 3.44Å; Y190-E192 WeakPolarHBondContact OH-CG 3.39Å; Y190-E192 PolarHBondContact OH-OE1 3.04Å; Y190-E192 VanDerWaalsContact OH-OE1 3.07Å; Y190-I198 WeakPolarHBondContact O-CA 3.21Å; Y190-K199 PolarHBondContact N-O 2.89Å; Y190-K199 PolarHBondContact O-N 3.29Å; Y190-K230 HydrophobicContact CE2-CD 4.07Å
191	M	92	Very high	90.1	Very high	8 Å²	8	57.8 Å²	57.8	4%	0.039	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.2	179.4	-60.4	-168.1	-79.2	0	0	110.9	V129 F130 L159 L168 L170 I189 K197 I198	V129-M191 CarbonylContact C-O 3.58Å; V129-M191 WeakPolarHBondContact CA-O 3.4Å; F130-M191 HydrophobicContact CB-CB 4.35Å; F130-M191 HydrophobicContact CB-CE 4.21Å; F130-M191 PolarHBondContact N-O 3.22Å; F130-M191 PolarHBondContact O-N 3.07Å; L159-M191 HydrophobicContact CD1-CE 3.71Å; L159-M191 HydrophobicContact CG-CE 4.4Å; L168-M191 HydrophobicContact CD1-CE 3.67Å; L170-M191 HydrophobicContact CD1-CE 4.27Å; L170-M191 HydrophobicContact CD1-SD 3.82Å; I189-M191 HydrophobicContact CD1-CE 3.95Å; I189-M191 HydrophobicContact CD1-CG 4.07Å; I189-M191 HydrophobicContact CD1-SD 3.97Å; M191-K197 WeakPolarHBondContact CA-O 3.49Å; M191-I198 HydrophobicContact CG-CB 4.17Å; M191-I198 HydrophobicContact CG-CD1 4.28Å; M191-I198 HydrophobicContact CG-CG1 3.78Å; M191-I198 HydrophobicContact CG-CG2 3.86Å; M191-I198 HydrophobicContact SD-CD1 3.66Å; M191-I198 HydrophobicContact SD-CG1 3.83Å; M191-I198 HydrophobicContact SD-CG2 4.3Å
192	E	89.5	Confident	90.3	Very high	29 Å²	29	54 Å²	54	14%	0.136	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	125.3	174.2	-63.7	-168.5	167.1	0	0	110.8	K127 Y190 N194 S195 G196 K197	K127-E192 HydrophobicContact CD-CG 4.39Å; K127-E192 WeakPolarHBondContact CD-OE1 3.37Å; K127-E192 IonicContact NZ-OE1 2.72Å; K127-E192 PolarHBondContact NZ-OE1 2.92Å; K127-E192 IonicContact NZ-OE2 2.88Å; K127-E192 PolarHBondContact NZ-OE2 3.09Å; Y190-E192 HydrophobicContact CD1-CG 4.47Å; Y190-E192 HydrophobicContact CE1-CG 3.44Å; Y190-E192 VanDerWaalsContact CE1-CG 3.44Å; Y190-E192 WeakPolarHBondContact OH-CG 3.39Å; Y190-E192 PolarHBondContact OH-OE1 3.04Å; Y190-E192 VanDerWaalsContact OH-OE1 3.07Å; E192-N194 VanDerWaalsContact C-N 3.31Å; E192-N194 PolarHBondContact O-N 2.84Å; E192-S195 WeakPolarHBondContact CB-OG 3.48Å; E192-S195 PolarHBondContact OE2-OG 3.33Å; E192-G196 PolarHBondContact O-N 3.22Å; E192-G196 VanDerWaalsContact O-N 3.11Å; E192-K197 PolarHBondContact N-O 3.17Å; E192-K197 VanDerWaalsContact N-O 3.09Å
193	T	84.8	Confident	90.2	Very high	62 Å²	62	47.8 Å²	47.8	38%	0.38	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-37.5	-175.9	-52.1	0	0	0	0	112.9	E128 F130	E128-T193 PolarHBondContact O-N 2.87Å; E128-T193 PolarHBondContact O-OG1 3.34Å; E128-T193 VanDerWaalsContact O-OG1 3.08Å; F130-T193 HydrophobicContact CE2-CG2 4.42Å; F130-T193 WeakPolarHBondContact CE2-OG1 3.47Å
194	N	80.1	Confident	90	Very high	150 Å²	150	47.2 Å²	47.2	80%	0.802	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-33.5	-171.7	-64.2	-10.9	0	0	0	113.5	E192	E192-N194 VanDerWaalsContact C-N 3.31Å; E192-N194 PolarHBondContact O-N 2.84Å
195	S	79	Confident	89.8	Confident	57 Å²	57	45.4 Å²	45.4	40%	0.399	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-13.3	-176.2	69.2	0	0	0	0	113.1	E192 K197	E192-S195 WeakPolarHBondContact CB-OG 3.48Å; E192-S195 PolarHBondContact OE2-OG 3.33Å; S195-K197 PolarHBondContact O-N 2.66Å; S195-K197 VanDerWaalsContact O-N 3.15Å; S195-K197 PolarHBondContact OG-N 3.38Å
196	G	80.9	Confident	89.2	Confident	24 Å²	24	46.3 Å²	46.3	25%	0.247	24%	0.241	C	C	.	.			trans	65.2	10.5	-174.1	0	0	0	0	0	113.7	L174 E192 I198	L174-G196 WeakPolarHBondContact CD2-O 3.44Å; E192-G196 PolarHBondContact O-N 3.22Å; E192-G196 VanDerWaalsContact O-N 3.11Å; G196-I198 PolarHBondContact O-N 3.15Å
197	K	86.8	Confident	88.6	Confident	149 Å²	149	48 Å²	48	65%	0.648	25%	0.247	S	C	*	.			trans	-75.8	123.2	-179.6	-69.8	-175.2	179.3	-177.1	0	110.2	M191 E192 S195	M191-K197 WeakPolarHBondContact CA-O 3.49Å; E192-K197 PolarHBondContact N-O 3.17Å; E192-K197 VanDerWaalsContact N-O 3.09Å; S195-K197 PolarHBondContact O-N 2.66Å; S195-K197 VanDerWaalsContact O-N 3.15Å; S195-K197 PolarHBondContact OG-N 3.38Å
198	I	91.5	Very high	87.6	Confident	12 Å²	12	49.9 Å²	49.9	6%	0.062	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.1	174.4	-51.4	-174.2	0	0	0	108.5	L174 I178 I183 I189 Y190 M191 G196	L174-I198 HydrophobicContact CB-CD1 4.08Å; L174-I198 HydrophobicContact CD2-CD1 4.21Å; L174-I198 HydrophobicContact CD2-CG1 4.31Å; I178-I198 HydrophobicContact CD1-CD1 4.31Å; I178-I198 HydrophobicContact CG1-CD1 3.79Å; I183-I198 HydrophobicContact CD1-CB 4.47Å; I183-I198 HydrophobicContact CD1-CG2 3.31Å; I189-I198 HydrophobicContact CD1-CG2 4.22Å; Y190-I198 WeakPolarHBondContact O-CA 3.21Å; M191-I198 HydrophobicContact CG-CB 4.17Å; M191-I198 HydrophobicContact CG-CD1 4.28Å; M191-I198 HydrophobicContact CG-CG1 3.78Å; M191-I198 HydrophobicContact CG-CG2 3.86Å; M191-I198 HydrophobicContact SD-CD1 3.66Å; M191-I198 HydrophobicContact SD-CG1 3.83Å; M191-I198 HydrophobicContact SD-CG2 4.3Å; G196-I198 PolarHBondContact O-N 3.15Å
199	K	91.5	Very high	86.5	Confident	131 Å²	131	56.1 Å²	56.1	57%	0.57	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.1	176.5	-170.6	176.6	-178	179	0	110.6	I189 Y190	I189-K199 WeakPolarHBondContact CA-O 3.49Å; Y190-K199 PolarHBondContact N-O 2.89Å; Y190-K199 PolarHBondContact O-N 3.29Å
200	R	93.4	Very high	85.3	Confident	65 Å²	65	62.2 Å²	62.2	25%	0.245	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	121.2	169.3	-170.4	177.7	177.9	-158.1	-3.2	109.1	I183 D187 E216	I183-R200 HydrophobicContact CG1-CB 4.2Å; D187-R200 HydrophobicContact CB-CG 4.39Å; D187-R200 IonicContact OD1-CZ 3.65Å; D187-R200 IonicContact OD1-NE 3.43Å; D187-R200 PolarHBondContact OD1-NE 2.68Å; D187-R200 IonicContact OD1-NH2 3.98Å; D187-R200 PolarHBondContact OD1-NH2 3.47Å; D187-R200 IonicContact OD2-CZ 3.48Å; D187-R200 IonicContact OD2-NE 3.59Å; D187-R200 PolarHBondContact OD2-NE 3.22Å; D187-R200 IonicContact OD2-NH2 3.06Å; R200-E216 IonicContact CZ-OE1 3.44Å; R200-E216 IonicContact NH1-OE1 3.46Å; R200-E216 PolarHBondContact NH1-OE1 3.43Å; R200-E216 IonicContact NH2-OE1 2.69Å; R200-E216 PolarHBondContact NH2-OE1 3.3Å; R200-E216 IonicContact NH2-OE2 3.15Å; R200-E216 PolarHBondContact NH2-OE2 3.38Å
201	L	91.7	Very high	84	Confident	69 Å²	69	67.8 Å²	67.8	36%	0.361	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-31.7	176.7	-62.4	-178.1	0	0	0	111.8	E131 V188	E131-L201 HydrophobicContact CG-CD1 4.31Å; V188-L201 HydrophobicContact CG1-CB 4.49Å; V188-L201 HydrophobicContact CG1-CD1 4.18Å; V188-L201 WeakPolarHBondContact O-CB 3.47Å; V188-L201 PolarHBondContact O-N 3.38Å
202	G	91.9	Very high	82.5	Confident	7 Å²	7	75.6 Å²	75.6	7%	0.072	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.8	-176.7	-179.9	0	0	0	0	0	111.6	V188 T217	V188-G202 PolarHBondContact N-O 3.04Å; G202-T217 CarbonylContact C-O 3.6Å; G202-T217 WeakPolarHBondContact CA-O 3.1Å
203	R	90.8	Very high	81.3	Confident	26 Å²	26	82.3 Å²	82.3	10%	0.098	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	142.7	174.8	-163.1	62.8	168	-175.7	-6.1	110.4	E184 V185 D187 E216 T217 Y218 V219	E184-R203 IonicContact OE2-NH1 3.82Å; E184-R203 IonicContact OE2-NH2 3.94Å; V185-R203 PolarHBondContact O-NH1 2.97Å; V185-R203 VanDerWaalsContact O-NH1 3.09Å; V185-R203 PolarHBondContact O-NH2 3.41Å; D187-R203 WeakPolarHBondContact OD1-CD 3.48Å; D187-R203 IonicContact OD1-CZ 3.77Å; D187-R203 IonicContact OD1-NE 3.86Å; D187-R203 IonicContact OD1-NH1 2.87Å; D187-R203 PolarHBondContact OD1-NH1 3.23Å; D187-R203 IonicContact OD2-NH1 3.98Å; R203-E216 HydrophobicContact CB-CB 4.21Å; R203-E216 VanDerWaalsContact CB-OE2 3.29Å; R203-E216 WeakPolarHBondContact CB-OE2 3.46Å; R203-E216 VanDerWaalsContact CD-OE2 3.29Å; R203-E216 WeakPolarHBondContact CD-OE2 3.26Å; R203-E216 VanDerWaalsContact CG-OE2 3.31Å; R203-E216 WeakPolarHBondContact CG-OE2 3.33Å; R203-E216 IonicContact NE-OE2 3.9Å; R203-T217 PolarHBondContact N-O 2.93Å; R203-Y218 HydrophobicContact CB-CD1 3.84Å; R203-Y218 HydrophobicContact CB-CE1 3.97Å; R203-Y218 HydrophobicContact CG-CD1 4.14Å; R203-Y218 HydrophobicContact CG-CE1 3.89Å; R203-Y218 CarbonylContact O-C 3.5Å; R203-Y218 VanDerWaalsContact O-CA 3.25Å; R203-Y218 WeakPolarHBondContact O-CA 3.42Å; R203-V219 PolarHBondContact O-N 2.84Å
204	S	89.6	Confident	80.4	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	136.8	175.7	176.1	0	0	0	0	111	E133 G186 V206 Y207	E133-S204 PolarHBondContact OE2-OG 3.38Å; G186-S204 WeakPolarHBondContact O-CB 3.37Å; G186-S204 PolarHBondContact O-N 2.91Å; S204-V206 PolarHBondContact O-N 3.22Å; S204-V206 VanDerWaalsContact O-N 3.13Å; S204-Y207 PolarHBondContact O-N 3.03Å
205	D	87.1	Confident	79.8	Confident	72 Å²	72	84.2 Å²	84.2	39%	0.385	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-55.8	-24.8	177.2	55.4	-9.2	0	0	0	113.7	Y207 A208 V219 P220	D205-Y207 PolarHBondContact O-N 2.67Å; D205-A208 VanDerWaalsContact O-CB 3.26Å; D205-A208 WeakPolarHBondContact O-CB 3.39Å; D205-A208 PolarHBondContact O-N 3.37Å; D205-A208 VanDerWaalsContact O-N 3.15Å; D205-V219 PolarHBondContact N-O 3.34Å; D205-V219 VanDerWaalsContact N-O 3.16Å; D205-P220 WeakPolarHBondContact OD2-CA 3.32Å
206	V	82	Confident	79.6	Confident	81 Å²	81	84.5 Å²	84.5	49%	0.491	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-61.1	-24.4	173.4	-177.5	0	0	0	0	112.9	S204 L221	S204-V206 PolarHBondContact O-N 3.22Å; S204-V206 VanDerWaalsContact O-N 3.13Å; V206-L221 HydrophobicContact CG2-CD1 3.51Å
207	Y	80.4	Confident	79.7	Confident	35 Å²	35	88.3 Å²	88.3	14%	0.137	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-96.8	-2.8	-179.4	-63.3	-104.6	0	0	0	112.8	E133 S204 D205 T209 K210	E133-Y207 WeakPolarHBondContact OE1-CE2 3.44Å; E133-Y207 PolarHBondContact OE1-OH 3.35Å; S204-Y207 PolarHBondContact O-N 3.03Å; D205-Y207 PolarHBondContact O-N 2.67Å; Y207-T209 PolarHBondContact O-N 2.81Å; Y207-K210 HydrophobicContact CD1-CD 3.73Å; Y207-K210 VanDerWaalsContact CD1-NZ 3.29Å; Y207-K210 HydrophobicContact CE1-CD 4.49Å; Y207-K210 PolarHBondContact O-N 3.02Å
208	A	75	Confident	79.7	Confident	40 Å²	40	84.8 Å²	84.8	33%	0.331	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.8	-175.8	0	0	0	0	0	114.2	D205 Y218	D205-A208 VanDerWaalsContact O-CB 3.26Å; D205-A208 WeakPolarHBondContact O-CB 3.39Å; D205-A208 PolarHBondContact O-N 3.37Å; D205-A208 VanDerWaalsContact O-N 3.15Å; A208-Y218 HydrophobicContact CB-CD1 3.75Å; A208-Y218 HydrophobicContact CB-CD2 4.47Å; A208-Y218 HydrophobicContact CB-CE1 3.74Å; A208-Y218 HydrophobicContact CB-CE2 4.41Å; A208-Y218 HydrophobicContact CB-CG 4.13Å
209	T	71.3	Confident	79.7	Confident	134 Å²	134	85.6 Å²	85.6	82%	0.822	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	5.9	180	60.3	0	0	0	0	113.8	Y207 Y211	Y207-T209 PolarHBondContact O-N 2.81Å; T209-Y211 VanDerWaalsContact C-N 3.35Å
210	K	69.4	Low	79.7	Confident	128 Å²	128	83.8 Å²	83.8	56%	0.557	44%	0.436	S	S	*	.	S	Bend	trans	-75.4	-24.5	-177.5	-76.1	-162.3	-178.1	-177.5	0	113.6	Y207	Y207-K210 HydrophobicContact CD1-CD 3.73Å; Y207-K210 VanDerWaalsContact CD1-NZ 3.29Å; Y207-K210 HydrophobicContact CE1-CD 4.49Å; Y207-K210 PolarHBondContact O-N 3.02Å
211	Y	65.1	Low	79.7	Confident	144 Å²	144	82.5 Å²	82.5	57%	0.565	43%	0.433	S	S	*	.			trans	-141.3	144	-174.1	-59.8	-83.8	0	0	0	110.5	T209 L213 E214	T209-Y211 VanDerWaalsContact C-N 3.35Å; Y211-L213 VanDerWaalsContact C-N 3.3Å; Y211-L213 PolarHBondContact O-N 2.73Å; Y211-E214 HydrophobicContact CD2-CG 4.37Å; Y211-E214 WeakPolarHBondContact CD2-OE1 3.36Å; Y211-E214 WeakPolarHBondContact CE2-OE1 3.48Å; Y211-E214 HydrophobicContact CG-CG 4.37Å
212	D	61.6	Low	79.7	Confident	173 Å²	173	79.6 Å²	79.6	93%	0.925	42%	0.419	S	S	*	.	S	Bend	trans	-74.7	-17.9	-174.6	-66.4	-41	0	0	0	113.7
213	L	63.3	Low	79.7	Confident	170 Å²	170	87.9 Å²	87.9	89%	0.89	45%	0.453	S	S	*	.			trans	-147.4	104.8	-179.4	-73.7	169.7	0	0	0	110.3	Y211	Y211-L213 VanDerWaalsContact C-N 3.3Å; Y211-L213 PolarHBondContact O-N 2.73Å
214	E	65.3	Low	79.7	Confident	67 Å²	67	87.5 Å²	87.5	31%	0.313	46%	0.457	S	S	.	.			trans	-132.3	140.6	170.9	-73.8	-172	151.1	0	0	110.6	Y211 E216 Y218	Y211-E214 HydrophobicContact CD2-CG 4.37Å; Y211-E214 WeakPolarHBondContact CD2-OE1 3.36Å; Y211-E214 WeakPolarHBondContact CE2-OE1 3.48Å; Y211-E214 HydrophobicContact CG-CG 4.37Å; E214-E216 VanDerWaalsContact C-N 3.32Å; E214-Y218 VanDerWaalsContact CB-OH 3.3Å; E214-Y218 WeakPolarHBondContact CB-OH 3.35Å; E214-Y218 PolarHBondContact OE2-OH 3.23Å
215	I	68.3	Low	79.9	Confident	185 Å²	185	94 Å²	94	95%	0.949	49%	0.487	S	S	*	.			trans	-102.3	37.3	175.6	-45.7	169.3	0	0	0	108.8
216	E	75.3	Confident	80.2	Confident	62 Å²	62	90.9 Å²	90.9	29%	0.29	47%	0.471	S	S	.	.			trans	-94.9	145.5	176.6	-63.5	-148.1	137.6	0	0	110.9	R200 R203 E214 Y218	R200-E216 IonicContact CZ-OE1 3.44Å; R200-E216 IonicContact NH1-OE1 3.46Å; R200-E216 PolarHBondContact NH1-OE1 3.43Å; R200-E216 IonicContact NH2-OE1 2.69Å; R200-E216 PolarHBondContact NH2-OE1 3.3Å; R200-E216 IonicContact NH2-OE2 3.15Å; R200-E216 PolarHBondContact NH2-OE2 3.38Å; R203-E216 HydrophobicContact CB-CB 4.21Å; R203-E216 VanDerWaalsContact CB-OE2 3.29Å; R203-E216 WeakPolarHBondContact CB-OE2 3.46Å; R203-E216 VanDerWaalsContact CD-OE2 3.29Å; R203-E216 WeakPolarHBondContact CD-OE2 3.26Å; R203-E216 VanDerWaalsContact CG-OE2 3.31Å; R203-E216 WeakPolarHBondContact CG-OE2 3.33Å; R203-E216 IonicContact NE-OE2 3.9Å; E214-E216 VanDerWaalsContact C-N 3.32Å; E216-Y218 WeakPolarHBondContact O-CD2 3.45Å; E216-Y218 PolarHBondContact O-N 2.7Å
217	T	82.9	Confident	80.8	Confident	104 Å²	104	92.6 Å²	92.6	64%	0.638	47%	0.469	S	S	*	.			trans	-78.9	111	172.1	-58.2	0	0	0	0	108.3	G202 R203 V219	G202-T217 CarbonylContact C-O 3.6Å; G202-T217 WeakPolarHBondContact CA-O 3.1Å; R203-T217 PolarHBondContact N-O 2.93Å; T217-V219 HydrophobicContact CG2-CG1 4.42Å
218	Y	86.6	Confident	81.3	Confident	75 Å²	75	93.6 Å²	93.6	29%	0.294	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	134.3	175.8	-62.1	-83.2	0	0	0	111.4	R203 A208 E214 E216	R203-Y218 HydrophobicContact CB-CD1 3.84Å; R203-Y218 HydrophobicContact CB-CE1 3.97Å; R203-Y218 HydrophobicContact CG-CD1 4.14Å; R203-Y218 HydrophobicContact CG-CE1 3.89Å; R203-Y218 CarbonylContact O-C 3.5Å; R203-Y218 VanDerWaalsContact O-CA 3.25Å; R203-Y218 WeakPolarHBondContact O-CA 3.42Å; A208-Y218 HydrophobicContact CB-CD1 3.75Å; A208-Y218 HydrophobicContact CB-CD2 4.47Å; A208-Y218 HydrophobicContact CB-CE1 3.74Å; A208-Y218 HydrophobicContact CB-CE2 4.41Å; A208-Y218 HydrophobicContact CB-CG 4.13Å; E214-Y218 VanDerWaalsContact CB-OH 3.3Å; E214-Y218 WeakPolarHBondContact CB-OH 3.35Å; E214-Y218 PolarHBondContact OE2-OH 3.23Å; E216-Y218 WeakPolarHBondContact O-CD2 3.45Å; E216-Y218 PolarHBondContact O-N 2.7Å
219	V	91	Very high	82.1	Confident	30 Å²	30	98.9 Å²	98.9	18%	0.182	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.8	179.4	-67.3	0	0	0	0	109.5	V188 R203 D205 T217	V188-V219 HydrophobicContact CB-CG2 3.57Å; V188-V219 HydrophobicContact CG1-CG2 4.31Å; V188-V219 HydrophobicContact CG2-CG2 3.63Å; R203-V219 PolarHBondContact O-N 2.84Å; D205-V219 PolarHBondContact N-O 3.34Å; D205-V219 VanDerWaalsContact N-O 3.16Å; T217-V219 HydrophobicContact CG2-CG1 4.42Å
220	P	92.7	Very high	82.8	Confident	93 Å²	93	96.8 Å²	96.8	60%	0.604	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-69.3	152.9	180	29.4	-35.1	0	0	0	111.5	D205	D205-P220 WeakPolarHBondContact OD2-CA 3.32Å
221	L	92.4	Very high	83.7	Confident	37 Å²	37	96.1 Å²	96.1	19%	0.194	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-50.2	128.2	170.3	-90.2	130.4	0	0	0	111.4	E133 R160 T162 V206 K223	E133-L221 HydrophobicContact CB-CD2 4.21Å; E133-L221 WeakPolarHBondContact OE2-CD2 3.34Å; R160-L221 HydrophobicContact CG-CD2 4.39Å; T162-L221 HydrophobicContact CG2-CB 3.96Å; V206-L221 HydrophobicContact CG2-CD1 3.51Å; L221-K223 PolarHBondContact O-N 3.08Å
222	P	92.1	Very high	84.7	Confident	9 Å²	9	91 Å²	91	6%	0.058	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-55.9	140.2	178.7	-29.7	37	0	0	0	113	E131 T161 T162 V188	E131-P222 HydrophobicContact CG-CB 4.26Å; E131-P222 HydrophobicContact CG-CG 3.97Å; E131-P222 WeakPolarHBondContact OE1-CB 3.46Å; T161-P222 WeakPolarHBondContact CB-O 3.41Å; T161-P222 HydrophobicContact CG2-CB 4.07Å; T162-P222 PolarHBondContact N-O 3.39Å; T162-P222 VanDerWaalsContact N-O 3.08Å; T162-P222 PolarHBondContact OG1-O 3.5Å; V188-P222 HydrophobicContact CG1-CG 3.58Å
223	K	91	Very high	86	Confident	181 Å²	181	85.3 Å²	85.3	79%	0.787	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-84.2	143.9	171.5	-64.2	-176.9	-177.1	179	0	110.5	T162 L221	T162-K223 WeakPolarHBondContact OG1-CA 3.36Å; L221-K223 PolarHBondContact O-N 3.08Å
224	G	91.2	Very high	87.3	Confident	18 Å²	18	81.8 Å²	81.8	19%	0.186	40%	0.4	C	S	.	.	S	Bend	trans	94.4	-168.2	177.6	0	0	0	0	0	113.6	T161 K163	T161-G224 VanDerWaalsContact CB-O 3.26Å; T161-G224 WeakPolarHBondContact CB-O 3.33Å; T161-G224 PolarHBondContact OG1-O 2.94Å; K163-G224 WeakPolarHBondContact CB-O 3.47Å
225	E	93.5	Very high	88.5	Confident	136 Å²	136	81.9 Å²	81.9	64%	0.636	40%	0.403	S	S	*	.			trans	-73.4	154.3	177.7	-64.8	178.7	-170.7	0	0	111.5
226	V	94.4	Very high	89.7	Confident	7 Å²	7	75.3 Å²	75.3	4%	0.042	37%	0.371	C	S	.	.	S	Bend	trans	-59.4	-47.4	175.8	178.9	0	0	0	0	110.7	F130 E131 L159 T161 K166	F130-V226 CarbonylContact C-O 3.56Å; F130-V226 VanDerWaalsContact CA-O 3.31Å; F130-V226 WeakPolarHBondContact CA-O 3.43Å; F130-V226 HydrophobicContact CD1-CG1 4.21Å; E131-V226 PolarHBondContact N-O 3.44Å; L159-V226 HydrophobicContact CB-CG1 3.55Å; L159-V226 HydrophobicContact CB-CG2 4.4Å; L159-V226 HydrophobicContact CD1-CG1 3.57Å; L159-V226 HydrophobicContact CG-CG1 4.24Å; T161-V226 HydrophobicContact CG2-CB 4.35Å; T161-V226 HydrophobicContact CG2-CG2 3.84Å; K166-V226 HydrophobicContact CB-CB 4.08Å; K166-V226 HydrophobicContact CB-CG1 4.14Å; K166-V226 HydrophobicContact CB-CG2 4Å
227	R	93.9	Very high	90.6	Very high	117 Å²	117	73.4 Å²	73.4	44%	0.442	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122	173.6	-173.4	-177.7	-178.2	179.1	4.3	108	E128 V129 F130	E128-R227 IonicContact OE1-NH2 3.17Å; E128-R227 IonicContact OE2-CZ 2.87Å; E128-R227 IonicContact OE2-NE 3.43Å; E128-R227 PolarHBondContact OE2-NE 3.22Å; E128-R227 IonicContact OE2-NH2 3.27Å; E128-R227 PolarHBondContact OE2-NH2 3.14Å; V129-R227 WeakPolarHBondContact O-CA 3.32Å; F130-R227 HydrophobicContact CD1-CB 3.88Å; F130-R227 HydrophobicContact CD1-CG 4.24Å; F130-R227 HydrophobicContact CE1-CB 3.62Å; F130-R227 HydrophobicContact CE1-CG 3.74Å; F130-R227 HydrophobicContact CZ-CB 4.44Å; F130-R227 HydrophobicContact CZ-CG 4.07Å
228	K	91.5	Very high	91	Very high	56 Å²	56	68.7 Å²	68.7	24%	0.243	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156.6	176.3	60.7	-169.8	177.1	-171	0	111.5	V129 E131	V129-K228 HydrophobicContact CG2-CG 3.72Å; V129-K228 WeakPolarHBondContact CG2-O 3.35Å; V129-K228 PolarHBondContact N-O 3.41Å; V129-K228 PolarHBondContact O-N 2.95Å; E131-K228 VanDerWaalsContact CD-CE 3.49Å; E131-K228 IonicContact OE1-NZ 3.54Å; E131-K228 PolarHBondContact OE1-NZ 3.46Å; E131-K228 WeakPolarHBondContact OE2-CE 3.46Å; E131-K228 IonicContact OE2-NZ 2.79Å; E131-K228 PolarHBondContact OE2-NZ 3.08Å
229	K	90.5	Very high	91.3	Very high	151 Å²	151	67.6 Å²	67.6	66%	0.657	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	120.7	168.2	-69.4	-174.5	176.1	-175.2	0	107.8	I126 K127 E128	I126-K229 HydrophobicContact CG2-CB 3.88Å; I126-K229 HydrophobicContact CG2-CD 4.27Å; I126-K229 HydrophobicContact CG2-CG 4.31Å; K127-K229 WeakPolarHBondContact O-CA 3.03Å; E128-K229 HydrophobicContact CG-CG 4.2Å; E128-K229 WeakPolarHBondContact OE1-CE 3.19Å; E128-K229 IonicContact OE1-NZ 3.34Å
230	K	87	Confident	91.3	Very high	90 Å²	90	69.7 Å²	69.7	39%	0.391	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.3	178.6	-166.4	171.8	-172.8	170.7	0	108.5	K127 V129 E131 Y190	K127-K230 PolarHBondContact N-O 3.35Å; K127-K230 PolarHBondContact O-N 3.43Å; V129-K230 HydrophobicContact CG1-CB 4.37Å; V129-K230 HydrophobicContact CG2-CB 3.92Å; V129-K230 HydrophobicContact CG2-CD 4.49Å; E131-K230 IonicContact OE2-NZ 2.82Å; Y190-K230 HydrophobicContact CE2-CD 4.07Å
231	E	87.5	Confident	91.3	Very high	114 Å²	114	67 Å²	67	53%	0.533	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.5	170.5	-171.4	179.7	-178.2	0	0	108.5	V233	E231-V233 HydrophobicContact CG-CG2 4.29Å
232	I	86	Confident	91.2	Very high	35 Å²	35	65.3 Å²	65.3	18%	0.179	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	118.5	176	-56.6	-174.4	0	0	0	106.8	E125 K127 Q234	E125-I232 PolarHBondContact N-O 2.86Å; E125-I232 PolarHBondContact O-N 2.91Å; K127-I232 HydrophobicContact CB-CD1 4.24Å; K127-I232 HydrophobicContact CD-CD1 3.56Å; K127-I232 HydrophobicContact CG-CD1 3.86Å; K127-I232 HydrophobicContact CG-CG1 4.45Å; I232-Q234 HydrophobicContact CG2-CG 4.06Å
233	V	89.4	Confident	90.9	Very high	54 Å²	54	66.5 Å²	66.5	33%	0.327	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120	175.4	-177.3	0	0	0	0	108.1	R122 V123 R124 E231	R122-V233 HydrophobicContact CG-CG1 3.6Å; V123-V233 WeakPolarHBondContact O-CA 3.32Å; R124-V233 HydrophobicContact CG-CG2 4.32Å; E231-V233 HydrophobicContact CG-CG2 4.29Å
234	Q	90.1	Very high	90.6	Very high	97 Å²	97	60.7 Å²	60.7	45%	0.453	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	125.5	175.4	-64.4	-177.4	-1.9	0	0	109	R122 V123 I232	R122-Q234 CarbonylContact C-O 3.54Å; R122-Q234 WeakPolarHBondContact CA-O 3.37Å; V123-Q234 PolarHBondContact N-O 2.8Å; V123-Q234 PolarHBondContact O-N 2.86Å; I232-Q234 HydrophobicContact CG2-CG 4.06Å
235	D	91.3	Very high	90.2	Very high	69 Å²	69	64.2 Å²	64.2	37%	0.369	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	114.5	176.1	-66.1	-66.2	0	0	0	107.3	K89 R122	K89-D235 WeakPolarHBondContact CD-OD2 3.26Å; K89-D235 WeakPolarHBondContact CE-OD2 3.4Å; K89-D235 IonicContact NZ-OD2 2.83Å; K89-D235 PolarHBondContact NZ-OD2 2.95Å; R122-D235 WeakPolarHBondContact CB-OD1 3.43Å; R122-D235 WeakPolarHBondContact CG-OD1 3.31Å; R122-D235 IonicContact CZ-OD1 3.79Å; R122-D235 IonicContact NE-OD1 2.77Å; R122-D235 PolarHBondContact NE-OD1 3.48Å; R122-D235 IonicContact NE-OD2 3.4Å; R122-D235 IonicContact NH2-OD1 2.92Å; R122-D235 PolarHBondContact NH2-OD1 3.04Å
236	V	92.8	Very high	89.5	Confident	46 Å²	46	59.5 Å²	59.5	28%	0.279	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.1	-177.2	-176.4	0	0	0	0	108.7	G120 L121 D240 I241	G120-V236 CarbonylContact C-O 3.6Å; L121-V236 PolarHBondContact N-O 3.42Å; L121-V236 PolarHBondContact O-N 3.23Å; V236-D240 HydrophobicContact CG1-CB 3.61Å; V236-I241 HydrophobicContact CG1-CG1 3.98Å
237	T	93.9	Very high	88.4	Confident	23 Å²	23	63 Å²	63	14%	0.141	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	157.2	175.3	70.7	0	0	0	0	111.7	P91 R117 I119 Y239 D240 I241	P91-T237 HydrophobicContact CB-CG2 4.49Å; R117-T237 WeakPolarHBondContact O-CG2 3.2Å; I119-T237 WeakPolarHBondContact O-CA 3.45Å; T237-Y239 PolarHBondContact O-N 3.39Å; T237-Y239 PolarHBondContact OG1-N 3.05Å; T237-D240 WeakPolarHBondContact CB-OD2 3.5Å; T237-D240 PolarHBondContact N-OD2 3.32Å; T237-D240 PolarHBondContact O-N 3.47Å; T237-D240 VanDerWaalsContact O-N 3.09Å; T237-D240 PolarHBondContact OG1-N 3.19Å; T237-D240 PolarHBondContact OG1-OD1 3.34Å; T237-D240 PolarHBondContact OG1-OD2 2.83Å; T237-I241 PolarHBondContact O-N 3.02Å
238	L	92.9	Very high	86.8	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-60	-29.9	172.7	-65.1	-174.2	0	0	0	111.7	R116 I119 I241 D242 V281 L292	R116-L238 HydrophobicContact CB-CB 4.3Å; R116-L238 PolarHBondContact O-N 3.41Å; I119-L238 HydrophobicContact CB-CD1 3.89Å; I119-L238 HydrophobicContact CB-CG 4.1Å; I119-L238 HydrophobicContact CD1-CD1 4.14Å; I119-L238 HydrophobicContact CG2-CD1 3.57Å; I119-L238 HydrophobicContact CG2-CG 3.85Å; I119-L238 PolarHBondContact O-N 3.26Å; L238-I241 HydrophobicContact CD2-CD1 4.37Å; L238-I241 PolarHBondContact O-N 3.05Å; L238-D242 WeakPolarHBondContact O-CB 3.48Å; L238-D242 PolarHBondContact O-N 3.21Å; L238-V281 HydrophobicContact CD2-CG1 4.23Å; L238-V281 HydrophobicContact CD2-CG2 3.94Å; L238-L292 HydrophobicContact CD2-CD2 4.34Å
239	Y	92.7	Very high	85.1	Confident	52 Å²	52	68.9 Å²	68.9	20%	0.204	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-41.7	174.4	176.3	-96.5	0	0	0	112.4	E113 R116 R117 T237 I241 D242 A243	E113-Y239 HydrophobicContact CB-CD2 4.12Å; E113-Y239 HydrophobicContact CB-CE2 4.01Å; E113-Y239 HydrophobicContact CG-CD2 4.24Å; E113-Y239 HydrophobicContact CG-CE2 3.89Å; R116-Y239 PolarHBondContact O-N 2.95Å; R117-Y239 VanDerWaalsContact CG-CB 3.47Å; R117-Y239 HydrophobicContact CG-CD1 3.7Å; R117-Y239 HydrophobicContact CG-CD2 4Å; R117-Y239 HydrophobicContact CG-CE1 4.45Å; R117-Y239 HydrophobicContact CG-CG 3.43Å; R117-Y239 VanDerWaalsContact CG-CG 3.43Å; R117-Y239 VanDerWaalsContact NH2-CZ 3.26Å; R117-Y239 PolarHBondContact NH2-OH 2.94Å; T237-Y239 PolarHBondContact O-N 3.39Å; T237-Y239 PolarHBondContact OG1-N 3.05Å; Y239-I241 VanDerWaalsContact C-N 3.26Å; Y239-I241 PolarHBondContact O-N 2.97Å; Y239-D242 PolarHBondContact O-N 3.49Å; Y239-A243 HydrophobicContact CE1-CB 4.48Å; Y239-A243 VanDerWaalsContact O-CB 3.27Å; Y239-A243 WeakPolarHBondContact O-CB 3.3Å; Y239-A243 PolarHBondContact O-N 3.34Å
240	D	91.4	Very high	83.2	Confident	75 Å²	75	65.1 Å²	65.1	40%	0.401	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-36.7	179	-56.3	-42.2	0	0	0	110.8	V236 T237 A244	V236-D240 HydrophobicContact CG1-CB 3.61Å; T237-D240 WeakPolarHBondContact CB-OD2 3.5Å; T237-D240 PolarHBondContact N-OD2 3.32Å; T237-D240 PolarHBondContact O-N 3.47Å; T237-D240 VanDerWaalsContact O-N 3.09Å; T237-D240 PolarHBondContact OG1-N 3.19Å; T237-D240 PolarHBondContact OG1-OD1 3.34Å; T237-D240 PolarHBondContact OG1-OD2 2.83Å; D240-A244 VanDerWaalsContact O-CB 3.26Å; D240-A244 WeakPolarHBondContact O-CB 3.33Å; D240-A244 PolarHBondContact O-N 3.49Å
241	I	90.7	Very high	81.2	Confident	36 Å²	36	62.7 Å²	62.7	19%	0.185	37%	0.369	C	S	.	.	H	α-helix	trans	-68.1	-47.3	174.8	-56.7	171.3	0	0	0	110.4	L121 V236 T237 L238 Y239 A243 A244 N245 V277 V281	L121-I241 HydrophobicContact CB-CD1 4.5Å; L121-I241 HydrophobicContact CD2-CD1 3.67Å; V236-I241 HydrophobicContact CG1-CG1 3.98Å; T237-I241 PolarHBondContact O-N 3.02Å; L238-I241 HydrophobicContact CD2-CD1 4.37Å; L238-I241 PolarHBondContact O-N 3.05Å; Y239-I241 VanDerWaalsContact C-N 3.26Å; Y239-I241 PolarHBondContact O-N 2.97Å; I241-A243 VanDerWaalsContact C-N 3.29Å; I241-A243 PolarHBondContact O-N 3.42Å; I241-A244 PolarHBondContact O-N 3.06Å; I241-N245 WeakPolarHBondContact CG2-ND2 3.47Å; I241-N245 PolarHBondContact O-N 2.89Å; I241-N245 VanDerWaalsContact O-N 3.09Å; I241-N245 PolarHBondContact O-ND2 3.04Å; I241-V277 HydrophobicContact CB-CG1 4.25Å; I241-V277 HydrophobicContact CG2-CG1 3.63Å; I241-V277 HydrophobicContact CG2-CG2 4.15Å; I241-V281 HydrophobicContact CD1-CG2 4.19Å
242	D	90.6	Very high	79.5	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.011	38%	0.384	C	S	.	.	H	α-helix	trans	-57	-45	176.3	-72.2	-13.3	0	0	0	110.8	R116 L238 Y239 A246 V269 V277	R116-D242 WeakPolarHBondContact CD-OD2 3.42Å; R116-D242 WeakPolarHBondContact CG-OD2 3.49Å; R116-D242 IonicContact CZ-OD1 2.71Å; R116-D242 IonicContact CZ-OD2 3.97Å; R116-D242 IonicContact NE-OD2 3.18Å; R116-D242 PolarHBondContact NE-OD2 2.83Å; R116-D242 IonicContact NH1-OD1 3.97Å; R116-D242 PolarHBondContact NH1-OD1 3.02Å; R116-D242 VanDerWaalsContact NH1-OD1 3.15Å; R116-D242 IonicContact NH1-OD2 3.91Å; R116-D242 PolarHBondContact NH1-OD2 3.47Å; L238-D242 WeakPolarHBondContact O-CB 3.48Å; L238-D242 PolarHBondContact O-N 3.21Å; Y239-D242 PolarHBondContact O-N 3.49Å; D242-A246 VanDerWaalsContact O-CB 3.26Å; D242-A246 WeakPolarHBondContact O-CB 3.28Å; D242-A246 PolarHBondContact O-N 3.48Å; D242-V269 HydrophobicContact CB-CG1 4.08Å; D242-V269 HydrophobicContact CB-CG2 4.28Å; D242-V277 WeakPolarHBondContact OD1-CG1 3.29Å
243	A	86.5	Confident	78	Confident	34 Å²	34	67.6 Å²	67.6	28%	0.281	40%	0.404	S	S	.	.	H	α-helix	trans	-67.1	-44.5	-179.4	0	0	0	0	0	112.5	Y239 I241 N245 A246 K247	Y239-A243 HydrophobicContact CE1-CB 4.48Å; Y239-A243 VanDerWaalsContact O-CB 3.27Å; Y239-A243 WeakPolarHBondContact O-CB 3.3Å; Y239-A243 PolarHBondContact O-N 3.34Å; I241-A243 VanDerWaalsContact C-N 3.29Å; I241-A243 PolarHBondContact O-N 3.42Å; A243-N245 VanDerWaalsContact C-N 3.3Å; A243-N245 PolarHBondContact O-N 3.25Å; A243-A246 PolarHBondContact O-N 2.91Å; A243-K247 PolarHBondContact O-N 3.38Å
244	A	84.3	Confident	76.3	Confident	59 Å²	59	70.1 Å²	70.1	49%	0.488	42%	0.419	S	S	.	.	H	α-helix	trans	-63.2	-35.4	178.3	0	0	0	0	0	112.5	D240 I241 K247	D240-A244 VanDerWaalsContact O-CB 3.26Å; D240-A244 WeakPolarHBondContact O-CB 3.33Å; D240-A244 PolarHBondContact O-N 3.49Å; I241-A244 PolarHBondContact O-N 3.06Å; A244-K247 CarbonylContact O-C 3.47Å; A244-K247 VanDerWaalsContact O-C 3.31Å
245	N	82.6	Confident	74.8	Confident	92 Å²	92	72.2 Å²	72.2	49%	0.492	43%	0.433	S	S	.	.	H	α-helix	trans	-80.1	-30.5	175.9	-69.1	-79.2	0	0	0	112.8	I241 A243 L273	I241-N245 WeakPolarHBondContact CG2-ND2 3.47Å; I241-N245 PolarHBondContact O-N 2.89Å; I241-N245 VanDerWaalsContact O-N 3.09Å; I241-N245 PolarHBondContact O-ND2 3.04Å; A243-N245 VanDerWaalsContact C-N 3.3Å; A243-N245 PolarHBondContact O-N 3.25Å; N245-L273 HydrophobicContact CB-CD1 3.85Å; N245-L273 HydrophobicContact CB-CD2 4.29Å; N245-L273 HydrophobicContact CB-CG 4.45Å
246	A	80	Confident	73.2	Confident	37 Å²	37	70.5 Å²	70.5	31%	0.306	43%	0.427	S	S	.	.	H	α-helix	trans	-72.8	-30.1	176.3	0	0	0	0	0	112.6	D242 A243 V269 L273	D242-A246 VanDerWaalsContact O-CB 3.26Å; D242-A246 WeakPolarHBondContact O-CB 3.28Å; D242-A246 PolarHBondContact O-N 3.48Å; A243-A246 PolarHBondContact O-N 2.91Å; A246-V269 HydrophobicContact CB-CG2 4.27Å; A246-L273 HydrophobicContact CB-CD2 3.76Å
247	K	69.7	Low	71.4	Confident	79 Å²	79	73.9 Å²	73.9	34%	0.343	44%	0.442	S	S	.	.	S	Bend	trans	-134.5	89.7	176.2	-67.1	-176.7	-176.3	178.8	0	109.3	A243 A244 E249 R265 T267	A243-K247 PolarHBondContact O-N 3.38Å; A244-K247 CarbonylContact O-C 3.47Å; A244-K247 VanDerWaalsContact O-C 3.31Å; K247-E249 PolarHBondContact O-N 3.43Å; K247-R265 PolarHBondContact NZ-O 2.72Å; K247-T267 VanDerWaalsContact CE-OG1 3.29Å; K247-T267 WeakPolarHBondContact CE-OG1 3.49Å
248	P	61.5	Low	69.6	Low	103 Å²	103	76.9 Å²	76.9	67%	0.669	46%	0.457	S	S	*	.			trans	-65.4	99	175	24.1	-31.5	0	0	0	110	G250	P248-G250 PolarHBondContact O-N 3.15Å
249	E	54.8	Low	67.7	Low	194 Å²	194	80.2 Å²	80.2	91%	0.907	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	109.7	168.4	-66.5	-173.5	171.6	0	0	108	K247	K247-E249 PolarHBondContact O-N 3.43Å
250	G	51.8	Low	66.1	Low	73 Å²	73	81 Å²	81	75%	0.753	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	139.2	7.6	175.7	0	0	0	0	0	117.6	P248	P248-G250 PolarHBondContact O-N 3.15Å
251	G	43.9	Very low	64.4	Low	39 Å²	39	84.9 Å²	84.9	40%	0.402	52%	0.524	S	S	.	.			trans	-67.3	136.3	165.7	0	0	0	0	0	110.6	D253 S256	G251-D253 PolarHBondContact O-N 3.46Å; G251-S256 WeakPolarHBondContact O-CB 3.47Å; G251-S256 PolarHBondContact O-OG 3.08Å
252	T	52	Low	62.8	Low	139 Å²	139	89.1 Å²	89.1	85%	0.853	54%	0.544	S	S	*	.			trans	-71.4	0.9	172.8	44.2	0	0	0	0	113.6
253	D	54	Low	61.2	Low	113 Å²	113	100.3 Å²	100.3	60%	0.604	59%	0.586	S	S	*	*	S	Bend	trans	-76.4	138.4	-175.3	-68	-22.2	0	0	0	111.5	G251 L255 S256	G251-D253 PolarHBondContact O-N 3.46Å; D253-L255 PolarHBondContact O-N 3.29Å; D253-S256 PolarHBondContact O-N 2.86Å; D253-S256 PolarHBondContact O-OG 3.21Å
254	V	55.4	Low	59.9	Low	107 Å²	107	103.9 Å²	103.9	65%	0.648	61%	0.607	S	S	*	*	H	α-helix	trans	-49	-27.9	177.9	-176.3	0	0	0	0	112.5	L257 I258	V254-L257 PolarHBondContact O-N 3.47Å; V254-I258 HydrophobicContact CG1-CD1 3.99Å; V254-I258 VanDerWaalsContact O-CG1 3.27Å; V254-I258 WeakPolarHBondContact O-CG1 3.27Å; V254-I258 PolarHBondContact O-N 2.91Å; V254-I258 VanDerWaalsContact O-N 3.08Å
255	L	57	Low	58.7	Low	140 Å²	140	110.8 Å²	110.8	73%	0.733	62%	0.62	S	S	*	*	H	α-helix	trans	-69	-33.8	177.9	-124.6	142.7	0	0	0	113.9	D253 S259	D253-L255 PolarHBondContact O-N 3.29Å; L255-S259 WeakPolarHBondContact O-CB 3.3Å; L255-S259 PolarHBondContact O-N 3.29Å; L255-S259 PolarHBondContact O-OG 3Å
256	S	58.5	Low	57.8	Low	34 Å²	34	113.5 Å²	113.5	24%	0.238	62%	0.624	C	S	.	*	H	α-helix	trans	-73.7	-33.8	175.9	72.4	0	0	0	0	111.6	G251 D253 S259 G260	G251-S256 WeakPolarHBondContact O-CB 3.47Å; G251-S256 PolarHBondContact O-OG 3.08Å; D253-S256 PolarHBondContact O-N 2.86Å; D253-S256 PolarHBondContact O-OG 3.21Å; S256-S259 WeakPolarHBondContact CA-OG 3.32Å; S256-S259 PolarHBondContact O-N 3.19Å; S256-S259 PolarHBondContact O-OG 2.91Å; S256-G260 PolarHBondContact O-N 3.31Å
257	L	54.2	Low	57.2	Low	117 Å²	117	115.2 Å²	115.2	61%	0.613	63%	0.63	S	S	*	*	H	α-helix	trans	-68.1	-40.3	174	-66.9	172.8	0	0	0	111	V254 L261	V254-L257 PolarHBondContact O-N 3.47Å; L257-L261 WeakPolarHBondContact O-CD1 3.41Å; L257-L261 PolarHBondContact O-N 3.43Å
258	I	56	Low	57.5	Low	86 Å²	86	115.2 Å²	115.2	44%	0.441	63%	0.631	S	S	.	*	H	α-helix	trans	-68.7	-41.2	175.1	-67.5	166.9	0	0	0	111	V254 G260 L261 M262	V254-I258 HydrophobicContact CG1-CD1 3.99Å; V254-I258 VanDerWaalsContact O-CG1 3.27Å; V254-I258 WeakPolarHBondContact O-CG1 3.27Å; V254-I258 PolarHBondContact O-N 2.91Å; V254-I258 VanDerWaalsContact O-N 3.08Å; I258-G260 VanDerWaalsContact C-N 3.31Å; I258-G260 PolarHBondContact O-N 2.93Å; I258-L261 PolarHBondContact O-N 2.89Å; I258-L261 VanDerWaalsContact O-N 3.13Å; I258-M262 HydrophobicContact CG2-CE 3.94Å; I258-M262 PolarHBondContact O-N 3.43Å
259	S	54.7	Low	58.5	Low	74 Å²	74	110.6 Å²	110.6	52%	0.517	60%	0.601	S	S	.	*	H	α-helix	trans	-68.2	-30.5	178.3	73	0	0	0	0	112.6	L255 S256 L261 M262	L255-S259 WeakPolarHBondContact O-CB 3.3Å; L255-S259 PolarHBondContact O-N 3.29Å; L255-S259 PolarHBondContact O-OG 3Å; S256-S259 WeakPolarHBondContact CA-OG 3.32Å; S256-S259 PolarHBondContact O-N 3.19Å; S256-S259 PolarHBondContact O-OG 2.91Å; S259-L261 VanDerWaalsContact C-N 3.34Å; S259-M262 PolarHBondContact O-N 3.2Å
260	G	58.1	Low	59.9	Low	67 Å²	67	105.5 Å²	105.5	69%	0.691	58%	0.584	S	S	*	*	H	α-helix	trans	-69.8	-26.1	169.9	0	0	0	0	0	114.1	S256 I258	S256-G260 PolarHBondContact O-N 3.31Å; I258-G260 VanDerWaalsContact C-N 3.31Å; I258-G260 PolarHBondContact O-N 2.93Å
261	L	56.3	Low	61.6	Low	157 Å²	157	106.6 Å²	106.6	82%	0.822	57%	0.572	S	S	*	*	H	α-helix	trans	-83.8	-24.8	173.7	-103.3	122.2	0	0	0	113.4	L257 I258 S259	L257-L261 WeakPolarHBondContact O-CD1 3.41Å; L257-L261 PolarHBondContact O-N 3.43Å; I258-L261 PolarHBondContact O-N 2.89Å; I258-L261 VanDerWaalsContact O-N 3.13Å; S259-L261 VanDerWaalsContact C-N 3.34Å
262	M	57.4	Low	63.7	Low	126 Å²	126	112.4 Å²	112.4	62%	0.621	59%	0.586	S	S	*	*	S	Bend	trans	-80.5	146.2	173.5	-69.2	-156.8	-171.9	0	0	110.9	I258 S259 P264	I258-M262 HydrophobicContact CG2-CE 3.94Å; I258-M262 PolarHBondContact O-N 3.43Å; S259-M262 PolarHBondContact O-N 3.2Å; M262-P264 VanDerWaalsContact O-N 3.16Å
263	R	56.8	Low	65.4	Low	237 Å²	237	107.2 Å²	107.2	89%	0.894	55%	0.553	S	S	*	*			trans	-54.3	125.9	173.8	-76.1	-173.2	179.8	-177.3	1	109.1	R265	R263-R265 PolarHBondContact O-N 2.82Å
264	P	58.5	Low	67.1	Low	109 Å²	109	102.3 Å²	102.3	71%	0.708	53%	0.526	S	S	*	.			trans	-65	108.9	-178.6	24.4	-32.4	0	0	0	109.2	M262	M262-P264 VanDerWaalsContact O-N 3.16Å
265	R	59.4	Low	68.8	Low	203 Å²	203	102.9 Å²	102.9	77%	0.766	52%	0.522	S	S	*	.			trans	-63.1	140	169	-71.1	-172	176.3	-171.8	-0.8	109.3	K247 R263 T267	K247-R265 PolarHBondContact NZ-O 2.72Å; R263-R265 PolarHBondContact O-N 2.82Å; R265-T267 PolarHBondContact O-N 3.48Å; R265-T267 VanDerWaalsContact O-N 3.16Å
266	R	64.1	Low	70.5	Confident	150 Å²	150	101.9 Å²	101.9	57%	0.566	51%	0.513	S	S	*	.			trans	-73.7	108.9	170.5	-64.5	-172.2	172.5	-175.3	1.2	108.1	E104 L105	E104-R266 WeakPolarHBondContact OE2-CB 3.49Å; E104-R266 PolarHBondContact OE2-N 3.14Å; L105-R266 HydrophobicContact CD1-CB 4.22Å; L105-R266 HydrophobicContact CG-CB 4.5Å
267	T	67.1	Low	72	Confident	72 Å²	72	100.5 Å²	100.5	44%	0.442	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-96	126.6	175.9	46.7	0	0	0	0	108.5	K247 R265 V269	K247-T267 VanDerWaalsContact CE-OG1 3.29Å; K247-T267 WeakPolarHBondContact CE-OG1 3.49Å; R265-T267 PolarHBondContact O-N 3.48Å; R265-T267 VanDerWaalsContact O-N 3.16Å; T267-V269 PolarHBondContact O-N 3.2Å
268	E	76.8	Confident	73.8	Confident	79 Å²	79	97.3 Å²	97.3	37%	0.369	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-59.5	126.2	174.3	-170.4	174.6	-176.1	0	0	109.7	L105 A109 T270	L105-E268 HydrophobicContact CD2-CB 3.66Å; L105-E268 HydrophobicContact CD2-CG 4.31Å; A109-E268 HydrophobicContact CB-CG 4.09Å; E268-T270 PolarHBondContact O-N 3.42Å
269	V	81.4	Confident	75.6	Confident	7 Å²	7	97.7 Å²	97.7	4%	0.042	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-71.6	118.8	171.9	-177	0	0	0	0	107.9	D242 A246 T267 L273 R274	D242-V269 HydrophobicContact CB-CG1 4.08Å; D242-V269 HydrophobicContact CB-CG2 4.28Å; A246-V269 HydrophobicContact CB-CG2 4.27Å; T267-V269 PolarHBondContact O-N 3.2Å; V269-L273 HydrophobicContact CG1-CB 4.27Å; V269-L273 HydrophobicContact CG1-CD2 3.88Å; V269-L273 HydrophobicContact CG1-CG 4.21Å; V269-R274 HydrophobicContact CG1-CG 3.78Å; V269-R274 VanDerWaalsContact O-CZ 3.32Å; V269-R274 PolarHBondContact O-NH1 3.26Å
270	T	85.4	Confident	77.4	Confident	87 Å²	87	97.3 Å²	97.3	53%	0.534	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-65.3	150.5	-179.6	68.5	0	0	0	0	111.8	E268 K272 L273 R274	E268-T270 PolarHBondContact O-N 3.42Å; T270-K272 VanDerWaalsContact C-N 3.26Å; T270-K272 PolarHBondContact O-N 3.46Å; T270-L273 PolarHBondContact O-N 3.36Å; T270-L273 VanDerWaalsContact O-N 3.17Å; T270-L273 PolarHBondContact OG1-N 3.17Å; T270-R274 PolarHBondContact O-N 3.15Å; T270-R274 VanDerWaalsContact O-N 3.14Å
271	D	86	Confident	79	Confident	95 Å²	95	94.5 Å²	94.5	51%	0.508	46%	0.456	S	S	.	.	H	α-helix	trans	-63.2	-32.9	178.8	-68	-32.3	0	0	0	112.6	L273 R274 E275	D271-L273 PolarHBondContact O-N 2.67Å; D271-R274 WeakPolarHBondContact O-CB 3.43Å; D271-R274 PolarHBondContact O-N 2.84Å; D271-R274 IonicContact OD1-NH1 3.73Å; D271-R274 PolarHBondContact OD1-NH1 3.03Å; D271-R274 VanDerWaalsContact OD1-NH1 3.13Å; D271-E275 WeakPolarHBondContact O-CG 3.35Å; D271-E275 PolarHBondContact O-N 3.48Å
272	K	88.5	Confident	80.7	Confident	162 Å²	162	90.7 Å²	90.7	70%	0.704	44%	0.436	S	S	*	.	H	α-helix	trans	-58.3	-47	172.9	-69.8	-173.1	177.6	-175.5	0	112	T270 R274 E275 E276	T270-K272 VanDerWaalsContact C-N 3.26Å; T270-K272 PolarHBondContact O-N 3.46Å; K272-R274 VanDerWaalsContact C-N 3.29Å; K272-R274 PolarHBondContact O-N 3.41Å; K272-E275 WeakPolarHBondContact O-CB 3.45Å; K272-E275 PolarHBondContact O-N 3.03Å; K272-E276 WeakPolarHBondContact O-CG 3.43Å; K272-E276 PolarHBondContact O-N 3.15Å
273	L	88.7	Confident	82.4	Confident	29 Å²	29	91.1 Å²	91.1	15%	0.152	43%	0.434	C	S	.	.	H	α-helix	trans	-63.4	-39.2	178.3	-178.8	60.1	0	0	0	111.2	N245 A246 V269 T270 D271 E275 E276 V277	N245-L273 HydrophobicContact CB-CD1 3.85Å; N245-L273 HydrophobicContact CB-CD2 4.29Å; N245-L273 HydrophobicContact CB-CG 4.45Å; A246-L273 HydrophobicContact CB-CD2 3.76Å; V269-L273 HydrophobicContact CG1-CB 4.27Å; V269-L273 HydrophobicContact CG1-CD2 3.88Å; V269-L273 HydrophobicContact CG1-CG 4.21Å; T270-L273 PolarHBondContact O-N 3.36Å; T270-L273 VanDerWaalsContact O-N 3.17Å; T270-L273 PolarHBondContact OG1-N 3.17Å; D271-L273 PolarHBondContact O-N 2.67Å; L273-E275 VanDerWaalsContact C-N 3.33Å; L273-E275 PolarHBondContact O-N 3.01Å; L273-E276 PolarHBondContact O-N 2.99Å; L273-V277 WeakPolarHBondContact O-CG2 3.42Å; L273-V277 PolarHBondContact O-N 3.49Å
274	R	89.9	Confident	84.1	Confident	10 Å²	10	83.1 Å²	83.1	4%	0.038	41%	0.409	C	S	.	.	H	α-helix	trans	-64.1	-37.4	175.5	-72.3	177.3	178.5	145.3	0.9	112.7	M112 V269 T270 D271 K272 N278	M112-R274 VanDerWaalsContact CG-CZ 3.45Å; V269-R274 HydrophobicContact CG1-CG 3.78Å; V269-R274 VanDerWaalsContact O-CZ 3.32Å; V269-R274 PolarHBondContact O-NH1 3.26Å; T270-R274 PolarHBondContact O-N 3.15Å; T270-R274 VanDerWaalsContact O-N 3.14Å; D271-R274 WeakPolarHBondContact O-CB 3.43Å; D271-R274 PolarHBondContact O-N 2.84Å; D271-R274 IonicContact OD1-NH1 3.73Å; D271-R274 PolarHBondContact OD1-NH1 3.03Å; D271-R274 VanDerWaalsContact OD1-NH1 3.13Å; K272-R274 VanDerWaalsContact C-N 3.29Å; K272-R274 PolarHBondContact O-N 3.41Å; R274-N278 WeakPolarHBondContact O-CB 3.47Å; R274-N278 PolarHBondContact O-N 3.49Å; R274-N278 PolarHBondContact O-ND2 3.12Å; R274-N278 PolarHBondContact O-OD1 2.75Å
275	E	90.6	Very high	85.7	Confident	120 Å²	120	80.6 Å²	80.6	56%	0.561	39%	0.389	S	S	*	.	H	α-helix	trans	-64.8	-44.8	174.3	-73.9	173.3	-177.1	0	0	111.2	D271 K272 L273 N278 I279	D271-E275 WeakPolarHBondContact O-CG 3.35Å; D271-E275 PolarHBondContact O-N 3.48Å; K272-E275 WeakPolarHBondContact O-CB 3.45Å; K272-E275 PolarHBondContact O-N 3.03Å; L273-E275 VanDerWaalsContact C-N 3.33Å; L273-E275 PolarHBondContact O-N 3.01Å; E275-N278 WeakPolarHBondContact O-CB 3.45Å; E275-N278 PolarHBondContact O-N 3.45Å; E275-I279 VanDerWaalsContact O-CG1 3.28Å; E275-I279 WeakPolarHBondContact O-CG1 3.44Å; E275-I279 PolarHBondContact O-N 3.16Å
276	E	91.3	Very high	87.3	Confident	119 Å²	119	78.7 Å²	78.7	56%	0.556	39%	0.389	S	S	*	.	H	α-helix	trans	-61.7	-43.5	175.7	-71.6	176.6	-179.1	0	0	112.4	K272 L273 I279 S280	K272-E276 WeakPolarHBondContact O-CG 3.43Å; K272-E276 PolarHBondContact O-N 3.15Å; L273-E276 PolarHBondContact O-N 2.99Å; E276-I279 PolarHBondContact O-N 2.97Å; E276-S280 PolarHBondContact O-N 3.33Å; E276-S280 PolarHBondContact O-OG 3.09Å
277	V	91.2	Very high	88.6	Confident	5 Å²	5	75.2 Å²	75.2	3%	0.03	39%	0.387	C	S	.	.	H	α-helix	trans	-61.1	-46.3	173.5	169.8	0	0	0	0	110.1	I241 D242 L273 I279 S280 V281	I241-V277 HydrophobicContact CB-CG1 4.25Å; I241-V277 HydrophobicContact CG2-CG1 3.63Å; I241-V277 HydrophobicContact CG2-CG2 4.15Å; D242-V277 WeakPolarHBondContact OD1-CG1 3.29Å; L273-V277 WeakPolarHBondContact O-CG2 3.42Å; L273-V277 PolarHBondContact O-N 3.49Å; V277-I279 VanDerWaalsContact C-N 3.35Å; V277-I279 PolarHBondContact O-N 3.29Å; V277-S280 PolarHBondContact O-N 2.91Å; V277-S280 VanDerWaalsContact O-N 3.15Å; V277-V281 HydrophobicContact CG1-CG2 4.1Å; V277-V281 WeakPolarHBondContact O-CB 3.35Å; V277-V281 VanDerWaalsContact O-CG2 3.29Å; V277-V281 WeakPolarHBondContact O-CG2 3.28Å; V277-V281 PolarHBondContact O-N 3.1Å
278	N	92.2	Very high	89.8	Confident	50 Å²	50	74.8 Å²	74.8	27%	0.267	40%	0.398	S	S	.	.	H	α-helix	trans	-60.4	-42.8	178.6	-72.6	-12.7	0	0	0	112.2	R116 R274 E275 S280 V281 N282	R116-N278 PolarHBondContact NH1-OD1 3.17Å; R116-N278 VanDerWaalsContact NH1-OD1 3.08Å; R116-N278 PolarHBondContact NH2-ND2 2.98Å; R116-N278 VanDerWaalsContact NH2-ND2 3.19Å; R116-N278 PolarHBondContact NH2-OD1 3.08Å; R274-N278 WeakPolarHBondContact O-CB 3.47Å; R274-N278 PolarHBondContact O-N 3.49Å; R274-N278 PolarHBondContact O-ND2 3.12Å; R274-N278 PolarHBondContact O-OD1 2.75Å; E275-N278 WeakPolarHBondContact O-CB 3.45Å; E275-N278 PolarHBondContact O-N 3.45Å; N278-S280 VanDerWaalsContact C-N 3.32Å; N278-S280 PolarHBondContact O-N 2.9Å; N278-V281 PolarHBondContact O-N 3.24Å; N278-N282 WeakPolarHBondContact O-CB 3.5Å; N278-N282 PolarHBondContact O-N 3.08Å; N278-N282 PolarHBondContact O-ND2 3.43Å
279	I	93.1	Very high	90.4	Very high	94 Å²	94	73.4 Å²	73.4	48%	0.482	40%	0.395	S	S	.	.	H	α-helix	trans	-60.2	-44.7	175.4	-68.6	164.2	0	0	0	110.2	E275 E276 V277 N282 K283	E275-I279 VanDerWaalsContact O-CG1 3.28Å; E275-I279 WeakPolarHBondContact O-CG1 3.44Å; E275-I279 PolarHBondContact O-N 3.16Å; E276-I279 PolarHBondContact O-N 2.97Å; V277-I279 VanDerWaalsContact C-N 3.35Å; V277-I279 PolarHBondContact O-N 3.29Å; I279-N282 PolarHBondContact O-N 3.2Å; I279-K283 WeakPolarHBondContact O-CG 3.39Å; I279-K283 PolarHBondContact O-N 3.24Å; I279-K283 VanDerWaalsContact O-N 3.13Å
280	S	91.8	Very high	91	Very high	66 Å²	66	73.5 Å²	73.5	46%	0.462	40%	0.396	S	S	.	.	H	α-helix	trans	-66.1	-43	179.9	-57.9	0	0	0	0	112.3	E276 V277 N278 K283 L284	E276-S280 PolarHBondContact O-N 3.33Å; E276-S280 PolarHBondContact O-OG 3.09Å; V277-S280 PolarHBondContact O-N 2.91Å; V277-S280 VanDerWaalsContact O-N 3.15Å; N278-S280 VanDerWaalsContact C-N 3.32Å; N278-S280 PolarHBondContact O-N 2.9Å; S280-K283 PolarHBondContact O-N 3.09Å; S280-L284 PolarHBondContact O-N 2.89Å
281	V	92.1	Very high	91.3	Very high	7 Å²	7	72.7 Å²	72.7	4%	0.042	39%	0.387	C	S	.	.	H	α-helix	trans	-63.3	-43.9	176.2	168.8	0	0	0	0	111.1	L121 L238 I241 V277 N278 K283 L284 I285 L292	L121-V281 HydrophobicContact CD1-CG1 3.82Å; L121-V281 HydrophobicContact CD2-CG1 4.42Å; L121-V281 HydrophobicContact CD2-CG2 4.16Å; L238-V281 HydrophobicContact CD2-CG1 4.23Å; L238-V281 HydrophobicContact CD2-CG2 3.94Å; I241-V281 HydrophobicContact CD1-CG2 4.19Å; V277-V281 HydrophobicContact CG1-CG2 4.1Å; V277-V281 WeakPolarHBondContact O-CB 3.35Å; V277-V281 VanDerWaalsContact O-CG2 3.29Å; V277-V281 WeakPolarHBondContact O-CG2 3.28Å; V277-V281 PolarHBondContact O-N 3.1Å; N278-V281 PolarHBondContact O-N 3.24Å; V281-K283 VanDerWaalsContact C-N 3.31Å; V281-K283 PolarHBondContact O-N 3.47Å; V281-L284 WeakPolarHBondContact O-CB 3.42Å; V281-L284 PolarHBondContact O-N 3.19Å; V281-L284 VanDerWaalsContact O-N 3.12Å; V281-I285 HydrophobicContact CG1-CD1 3.77Å; V281-I285 HydrophobicContact CG1-CG1 4.45Å; V281-I285 WeakPolarHBondContact O-CG1 3.35Å; V281-I285 PolarHBondContact O-N 2.89Å; V281-L292 HydrophobicContact CG1-CD2 4.22Å
282	N	92.5	Very high	91.5	Very high	78 Å²	78	70.6 Å²	70.6	42%	0.417	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-40.4	177.3	-74.1	-24.2	0	0	0	111.9	N278 I279 L284 I285 E286	N278-N282 WeakPolarHBondContact O-CB 3.5Å; N278-N282 PolarHBondContact O-N 3.08Å; N278-N282 PolarHBondContact O-ND2 3.43Å; I279-N282 PolarHBondContact O-N 3.2Å; N282-L284 VanDerWaalsContact C-N 3.31Å; N282-L284 PolarHBondContact O-N 3.45Å; N282-I285 PolarHBondContact O-N 2.76Å; N282-E286 WeakPolarHBondContact O-CB 3.44Å; N282-E286 VanDerWaalsContact O-CG 3.31Å; N282-E286 WeakPolarHBondContact O-CG 3.41Å; N282-E286 PolarHBondContact O-N 3.39Å
283	K	93.7	Very high	91.5	Very high	134 Å²	134	63.9 Å²	63.9	58%	0.583	35%	0.347	S	S	*	.	H	α-helix	trans	-60.1	-38.9	174.4	-71.8	172.9	-178.7	177.3	0	112.7	I279 S280 V281 S287	I279-K283 WeakPolarHBondContact O-CG 3.39Å; I279-K283 PolarHBondContact O-N 3.24Å; I279-K283 VanDerWaalsContact O-N 3.13Å; S280-K283 PolarHBondContact O-N 3.09Å; V281-K283 VanDerWaalsContact C-N 3.31Å; V281-K283 PolarHBondContact O-N 3.47Å; K283-S287 WeakPolarHBondContact O-CB 3.24Å; K283-S287 PolarHBondContact O-N 2.85Å; K283-S287 PolarHBondContact O-OG 2.88Å
284	L	92.1	Very high	91.5	Very high	69 Å²	69	65.9 Å²	65.9	36%	0.361	36%	0.362	S	S	.	.	H	α-helix	trans	-68.7	-34.8	177	-66.3	174.1	0	0	0	112.4	L121 S280 V281 N282 S287 G288 T289 A290	L121-L284 HydrophobicContact CD2-CD1 4.35Å; S280-L284 PolarHBondContact O-N 2.89Å; V281-L284 WeakPolarHBondContact O-CB 3.42Å; V281-L284 PolarHBondContact O-N 3.19Å; V281-L284 VanDerWaalsContact O-N 3.12Å; N282-L284 VanDerWaalsContact C-N 3.31Å; N282-L284 PolarHBondContact O-N 3.45Å; L284-S287 PolarHBondContact O-OG 3.22Å; L284-G288 PolarHBondContact O-N 3.31Å; L284-T289 WeakPolarHBondContact CA-OG1 3.33Å; L284-T289 WeakPolarHBondContact CD2-OG1 3.49Å; L284-T289 PolarHBondContact O-N 2.98Å; L284-T289 PolarHBondContact O-OG1 2.87Å; L284-A290 HydrophobicContact CB-CB 3.76Å; L284-A290 PolarHBondContact O-N 2.94Å
285	I	92	Very high	91.6	Very high	57 Å²	57	65.4 Å²	65.4	29%	0.292	36%	0.36	S	S	.	.	H	α-helix	trans	-71.2	-46.2	176.1	-62.3	162	0	0	0	110.5	L121 V281 N282 S287 G288 A290 L292	L121-I285 HydrophobicContact CD1-CG1 4.47Å; V281-I285 HydrophobicContact CG1-CD1 3.77Å; V281-I285 HydrophobicContact CG1-CG1 4.45Å; V281-I285 WeakPolarHBondContact O-CG1 3.35Å; V281-I285 PolarHBondContact O-N 2.89Å; N282-I285 PolarHBondContact O-N 2.76Å; I285-S287 VanDerWaalsContact C-N 3.27Å; I285-S287 PolarHBondContact O-N 3.48Å; I285-G288 PolarHBondContact O-N 3.01Å; I285-A290 WeakPolarHBondContact CA-O 3.33Å; I285-L292 HydrophobicContact CD1-CD1 3.59Å; I285-L292 HydrophobicContact CD1-CD2 4.38Å; I285-L292 HydrophobicContact CD1-CG 3.57Å
286	E	93.4	Very high	91.7	Very high	163 Å²	163	59.7 Å²	59.7	76%	0.762	33%	0.334	S	S	*	.	H	α-helix	trans	-61.8	-34.4	178.3	-74.6	172.6	-173.5	0	0	112.3	N282 G288	N282-E286 WeakPolarHBondContact O-CB 3.44Å; N282-E286 VanDerWaalsContact O-CG 3.31Å; N282-E286 WeakPolarHBondContact O-CG 3.41Å; N282-E286 PolarHBondContact O-N 3.39Å; E286-G288 PolarHBondContact O-N 3.24Å
287	S	91.9	Very high	91.9	Very high	76 Å²	76	54 Å²	54	53%	0.531	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-8.4	174.1	69.6	0	0	0	0	113.9	K283 L284 I285 T289	K283-S287 WeakPolarHBondContact O-CB 3.24Å; K283-S287 PolarHBondContact O-N 2.85Å; K283-S287 PolarHBondContact O-OG 2.88Å; L284-S287 PolarHBondContact O-OG 3.22Å; I285-S287 VanDerWaalsContact C-N 3.27Å; I285-S287 PolarHBondContact O-N 3.48Å; S287-T289 PolarHBondContact O-N 3.42Å; S287-T289 WeakPolarHBondContact OG-CG2 3.4Å; S287-T289 PolarHBondContact OG-OG1 3.42Å
288	G	90.4	Very high	92.1	Very high	64 Å²	64	54 Å²	54	66%	0.66	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	9.6	-176	0	0	0	0	0	114.4	L284 I285 E286	L284-G288 PolarHBondContact O-N 3.31Å; I285-G288 PolarHBondContact O-N 3.01Å; E286-G288 PolarHBondContact O-N 3.24Å
289	T	90.5	Very high	92.3	Very high	49 Å²	49	51.6 Å²	51.6	30%	0.301	29%	0.294	S	S	.	.	S	Bend	trans	-82.2	-20.6	178.7	58.8	0	0	0	0	112.9	V123 R124 L284 S287	V123-T289 WeakPolarHBondContact CA-O 3.14Å; R124-T289 PolarHBondContact N-O 2.92Å; L284-T289 WeakPolarHBondContact CA-OG1 3.33Å; L284-T289 WeakPolarHBondContact CD2-OG1 3.49Å; L284-T289 PolarHBondContact O-N 2.98Å; L284-T289 PolarHBondContact O-OG1 2.87Å; S287-T289 PolarHBondContact O-N 3.42Å; S287-T289 WeakPolarHBondContact OG-CG2 3.4Å; S287-T289 PolarHBondContact OG-OG1 3.42Å
290	A	93.1	Very high	92.5	Very high	10 Å²	10	49.1 Å²	49.1	8%	0.083	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	153.1	178.6	0	0	0	0	0	113.2	L121 R122 V123 L284 I285	L121-A290 HydrophobicContact CD1-CB 3.71Å; L121-A290 HydrophobicContact CD2-CB 4.47Å; L121-A290 HydrophobicContact CG-CB 4.06Å; R122-A290 CarbonylContact O-C 3.57Å; R122-A290 WeakPolarHBondContact O-CA 3.32Å; V123-A290 HydrophobicContact CG2-CB 4.1Å; L284-A290 HydrophobicContact CB-CB 3.76Å; L284-A290 PolarHBondContact O-N 2.94Å; I285-A290 WeakPolarHBondContact CA-O 3.33Å
291	E	91.9	Very high	92.6	Very high	70 Å²	70	49.4 Å²	49.4	33%	0.327	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.7	171.5	64.3	-178.5	179.5	0	0	110.4	R122 R124 V293	R122-E291 HydrophobicContact CB-CG 3.77Å; R122-E291 VanDerWaalsContact CD-OE1 3.29Å; R122-E291 WeakPolarHBondContact CD-OE1 3.25Å; R122-E291 HydrophobicContact CG-CG 4.37Å; R122-E291 IonicContact CZ-OE1 2.86Å; R122-E291 PolarHBondContact N-O 3.1Å; R122-E291 IonicContact NE-OE1 3.75Å; R122-E291 IonicContact NH1-OE1 3.66Å; R122-E291 PolarHBondContact NH1-OE1 3.27Å; R122-E291 PolarHBondContact O-N 2.92Å; R124-E291 IonicContact CZ-OE1 3.49Å; R124-E291 IonicContact NE-OE1 2.87Å; R124-E291 IonicContact NH2-OE1 3.86Å; R124-E291 PolarHBondContact NH2-OE1 3.05Å; R124-E291 IonicContact NH2-OE2 3.78Å; R124-E291 PolarHBondContact NH2-OE2 3.08Å; E291-V293 HydrophobicContact CG-CG2 4.38Å
292	L	90.3	Very high	92.8	Very high	51 Å²	51	49.1 Å²	49.1	27%	0.267	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	131.5	170.6	-74.8	169.9	0	0	0	109.9	I119 G120 L121 L238 V281 I285 I321	I119-L292 HydrophobicContact CG2-CD2 3.9Å; G120-L292 WeakPolarHBondContact O-CA 3.34Å; L121-L292 HydrophobicContact CD1-CD2 3.97Å; L121-L292 HydrophobicContact CD1-CG 4.46Å; L238-L292 HydrophobicContact CD2-CD2 4.34Å; V281-L292 HydrophobicContact CG1-CD2 4.22Å; I285-L292 HydrophobicContact CD1-CD1 3.59Å; I285-L292 HydrophobicContact CD1-CD2 4.38Å; I285-L292 HydrophobicContact CD1-CG 3.57Å; L292-I321 HydrophobicContact CD1-CG2 3.91Å
293	V	88.4	Confident	93	Very high	20 Å²	20	46 Å²	46	12%	0.121	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	100.9	176.6	-176.8	0	0	0	0	107.7	G120 R122 E291 G295	G120-V293 PolarHBondContact N-O 3.45Å; G120-V293 PolarHBondContact O-N 2.95Å; R122-V293 HydrophobicContact CB-CG2 4.1Å; E291-V293 HydrophobicContact CG-CG2 4.38Å; V293-G295 PolarHBondContact O-N 3.23Å
294	P	88	Confident	93	Very high	71 Å²	71	41.5 Å²	41.5	46%	0.461	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	122.7	174.8	27.4	-32.4	0	0	0	109.2
295	G	92.1	Very high	93.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.221	C	C	.	.			trans	-95.5	-155.1	175.7	0	0	0	0	0	112.8	P91 A118 V293 P323 I324	P91-G295 CarbonylContact O-C 3.56Å; P91-G295 WeakPolarHBondContact O-CA 3.49Å; A118-G295 CarbonylContact O-C 3.56Å; A118-G295 WeakPolarHBondContact O-CA 3.45Å; A118-G295 PolarHBondContact O-N 2.92Å; V293-G295 PolarHBondContact O-N 3.23Å; G295-P323 WeakPolarHBondContact O-CB 3.39Å; G295-I324 PolarHBondContact O-N 3.21Å
296	I	93	Very high	93.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.3	179	-57.7	-175.1	0	0	0	109.4	I82 L86 P91 F92 A93 I324 I326	I82-I296 HydrophobicContact CB-CD1 4.25Å; I82-I296 HydrophobicContact CG2-CD1 3.7Å; L86-I296 HydrophobicContact CD1-CD1 3.88Å; L86-I296 HydrophobicContact CD1-CG1 4.09Å; P91-I296 PolarHBondContact O-N 3.23Å; F92-I296 HydrophobicContact CD2-CB 3.88Å; F92-I296 HydrophobicContact CD2-CD1 4.47Å; F92-I296 HydrophobicContact CD2-CG2 3.96Å; F92-I296 HydrophobicContact CE2-CB 4.39Å; F92-I296 HydrophobicContact CE2-CG2 3.95Å; A93-I296 PolarHBondContact N-O 3.15Å; I296-I324 CarbonylContact C-O 3.6Å; I296-I324 WeakPolarHBondContact CA-O 3.2Å; I296-I324 HydrophobicContact CG1-CB 4.38Å; I296-I324 HydrophobicContact CG1-CD1 4.23Å; I296-I326 HydrophobicContact CD1-CD1 4.28Å; I296-I326 HydrophobicContact CG2-CD1 3.69Å; I296-I326 HydrophobicContact CG2-CG1 3.94Å
297	L	95.4	Very high	93.4	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	109.6	164	174.8	57.6	0	0	0	108.3	A93 M95 N114 F115 A118 I299 P323 I324 V325 I326	A93-L297 HydrophobicContact CB-CD1 4.23Å; M95-L297 HydrophobicContact CG-CD1 4.1Å; M95-L297 HydrophobicContact SD-CD1 4.01Å; N114-L297 HydrophobicContact CB-CD1 3.73Å; F115-L297 HydrophobicContact CD1-CD2 4.32Å; F115-L297 HydrophobicContact CD2-CD2 3.72Å; F115-L297 HydrophobicContact CE1-CD2 4.17Å; F115-L297 HydrophobicContact CE2-CD2 3.56Å; F115-L297 HydrophobicContact CG-CD2 4.09Å; F115-L297 HydrophobicContact CZ-CD2 3.79Å; A118-L297 HydrophobicContact CB-CB 3.96Å; L297-I299 HydrophobicContact CD1-CG1 4.36Å; L297-I299 HydrophobicContact CD2-CD1 4.23Å; L297-I299 HydrophobicContact CD2-CG1 4.46Å; L297-I299 HydrophobicContact CG-CD1 4.35Å; L297-I299 HydrophobicContact CG-CG1 4.04Å; L297-P323 HydrophobicContact CB-CG 4.22Å; L297-I324 PolarHBondContact N-O 3.45Å; L297-V325 HydrophobicContact CB-CG2 4.4Å; L297-V325 HydrophobicContact CD2-CG2 4.33Å; L297-V325 WeakPolarHBondContact O-CA 3.48Å; L297-I326 PolarHBondContact O-N 3.23Å
298	F	96.7	Very high	93.4	Very high	4 Å²	4	33 Å²	33	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	118.8	176.1	175.7	-108.7	0	0	0	110	L67 T76 A79 F92 A93 P94 M95 D300 I326 A328	L67-F298 HydrophobicContact CD1-CE2 4.39Å; T76-F298 HydrophobicContact CG2-CD1 4.48Å; T76-F298 HydrophobicContact CG2-CE1 3.73Å; T76-F298 HydrophobicContact CG2-CZ 4.17Å; A79-F298 HydrophobicContact CB-CD2 3.4Å; A79-F298 HydrophobicContact CB-CE2 3.64Å; A79-F298 HydrophobicContact CB-CG 4.01Å; A79-F298 HydrophobicContact CB-CZ 4.42Å; F92-F298 HydrophobicContact CE1-CB 4.38Å; F92-F298 HydrophobicContact CE2-CB 3.83Å; F92-F298 HydrophobicContact CZ-CB 3.56Å; F92-F298 HydrophobicContact CZ-CD1 4.21Å; F92-F298 AromaticContact CZ-CG 3.99Å; F92-F298 HydrophobicContact CZ-CG 3.99Å; A93-F298 PolarHBondContact O-N 3.01Å; P94-F298 CarbonylContact C-O 3.51Å; P94-F298 WeakPolarHBondContact CA-O 3.26Å; P94-F298 HydrophobicContact CB-CD1 4.37Å; M95-F298 PolarHBondContact N-O 2.62Å; F298-D300 HydrophobicContact CE1-CB 3.72Å; F298-D300 HydrophobicContact CZ-CB 4.02Å; F298-I326 CarbonylContact C-O 3.52Å; F298-I326 WeakPolarHBondContact CA-O 3.49Å; F298-I326 HydrophobicContact CD2-CB 4.12Å; F298-I326 HydrophobicContact CD2-CG2 3.92Å; F298-I326 WeakPolarHBondContact CD2-O 3.37Å; F298-I326 HydrophobicContact CE2-CG2 4.3Å; F298-A328 HydrophobicContact CE2-CB 3.68Å; F298-A328 HydrophobicContact CZ-CB 3.74Å
299	I	96.6	Very high	93.7	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	102.8	177.3	-48.1	-172.9	0	0	0	108.7	M95 L297 L305 L313 V325 I326 L327 A328	M95-I299 HydrophobicContact CE-CG2 4.4Å; M95-I299 HydrophobicContact CG-CB 4.17Å; M95-I299 HydrophobicContact CG-CG1 3.76Å; M95-I299 HydrophobicContact CG-CG2 4.16Å; M95-I299 CarbonylContact O-C 3.51Å; M95-I299 WeakPolarHBondContact O-CA 3.46Å; M95-I299 HydrophobicContact SD-CD1 3.96Å; M95-I299 HydrophobicContact SD-CG1 3.85Å; M95-I299 HydrophobicContact SD-CG2 4.47Å; L297-I299 HydrophobicContact CD1-CG1 4.36Å; L297-I299 HydrophobicContact CD2-CD1 4.23Å; L297-I299 HydrophobicContact CD2-CG1 4.46Å; L297-I299 HydrophobicContact CG-CD1 4.35Å; L297-I299 HydrophobicContact CG-CG1 4.04Å; I299-L305 HydrophobicContact CD1-CD1 4.38Å; I299-L305 HydrophobicContact CG2-CD1 4.15Å; I299-L313 HydrophobicContact CD1-CD1 4.36Å; I299-L313 HydrophobicContact CD1-CD2 4.17Å; I299-V325 HydrophobicContact CD1-CG1 4.42Å; I299-I326 PolarHBondContact N-O 3.44Å; I299-L327 HydrophobicContact CB-CD2 3.76Å; I299-L327 HydrophobicContact CD1-CD2 3.78Å; I299-L327 HydrophobicContact CG1-CD2 3.97Å; I299-L327 HydrophobicContact CG2-CD2 4.48Å; I299-L327 CarbonylContact O-C 3.57Å; I299-L327 WeakPolarHBondContact O-CA 3.39Å; I299-A328 PolarHBondContact O-N 3.33Å
300	D	95.4	Very high	93.9	Very high	42 Å²	42	27.7 Å²	27.7	23%	0.225	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	155.7	171.7	-148.8	-9.8	0	0	0	111	T76 M95 V96 G97 F298 A302	T76-D300 PolarHBondContact OG1-OD2 3.05Å; M95-D300 PolarHBondContact O-N 3.03Å; V96-D300 CarbonylContact C-O 3.51Å; G97-D300 PolarHBondContact N-O 3.17Å; F298-D300 HydrophobicContact CE1-CB 3.72Å; F298-D300 HydrophobicContact CZ-CB 4.02Å; D300-A302 VanDerWaalsContact C-N 3.27Å; D300-A302 PolarHBondContact O-N 3.3Å
301	E	95.3	Very high	93.8	Very high	73 Å²	73	31.6 Å²	31.6	34%	0.341	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	45.7	-178.3	-55.7	-166.9	160.5	0	0	113.7	V96 H303 M304 A328	V96-E301 HydrophobicContact CG1-CB 4.14Å; V96-E301 HydrophobicContact CG1-CG 4.29Å; E301-H303 PolarHBondContact O-N 2.98Å; E301-M304 HydrophobicContact CB-CG 4.07Å; E301-M304 VanDerWaalsContact O-CB 3.28Å; E301-M304 WeakPolarHBondContact O-CB 3.23Å; E301-M304 PolarHBondContact O-N 2.88Å; E301-A328 PolarHBondContact N-O 3.19Å; E301-A328 VanDerWaalsContact N-O 3.15Å
302	A	96.4	Very high	93.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-56.9	-22.6	-174.6	0	0	0	0	0	114.4	D300 M304 L305 F310 L327 A328	D300-A302 VanDerWaalsContact C-N 3.27Å; D300-A302 PolarHBondContact O-N 3.3Å; A302-M304 PolarHBondContact O-N 3.17Å; A302-L305 WeakPolarHBondContact O-CB 3.47Å; A302-L305 PolarHBondContact O-N 3.47Å; A302-L305 VanDerWaalsContact O-N 3.14Å; A302-F310 WeakPolarHBondContact O-CZ 3.42Å; A302-L327 HydrophobicContact CB-CB 3.89Å; A302-L327 HydrophobicContact CB-CD2 4.21Å; A302-L327 HydrophobicContact CB-CG 4.43Å; A302-A328 PolarHBondContact N-O 3.12Å
303	H	95.3	Very high	94	Very high	13 Å²	13	28.2 Å²	28.2	6%	0.06	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-64.8	-12.2	172.9	65.3	-87.2	0	0	0	114	E301 N330 R331 H345	E301-H303 PolarHBondContact O-N 2.98Å; H303-N330 PolarHBondContact CE1-OD1 3.41Å; H303-R331 HydrophobicContact CB-CB 4.32Å; H303-R331 HydrophobicContact CB-CG 4.09Å; H303-R331 WeakPolarHBondContact CD2-CG 3.37Å; H303-R331 VanDerWaalsContact CG-CG 3.48Å; H303-H345 VanDerWaalsContact CB-O 3.25Å; H303-H345 WeakPolarHBondContact CB-O 3.3Å
304	M	95.5	Very high	94.1	Very high	39 Å²	39	29.7 Å²	29.7	19%	0.192	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-83	-13.7	174.9	-66.3	-61.8	-69.7	0	0	112.9	Y101 E301 A302 R337	Y101-M304 WeakPolarHBondContact CE2-O 3.49Å; Y101-M304 PolarHBondContact OH-O 3.47Å; Y101-M304 VanDerWaalsContact OH-O 3.14Å; E301-M304 HydrophobicContact CB-CG 4.07Å; E301-M304 VanDerWaalsContact O-CB 3.28Å; E301-M304 WeakPolarHBondContact O-CB 3.23Å; E301-M304 PolarHBondContact O-N 2.88Å; A302-M304 PolarHBondContact O-N 3.17Å; M304-R337 VanDerWaalsContact CE-CZ 3.48Å; M304-R337 VanDerWaalsContact O-CD 3.25Å; M304-R337 WeakPolarHBondContact O-CD 3.45Å
305	L	95.7	Very high	94.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-72.7	147.4	172.6	-64.1	177.9	0	0	0	110.8	G97 V100 I299 A302 C309 F310 L313	G97-L305 WeakPolarHBondContact O-CD2 3.48Å; V100-L305 HydrophobicContact CB-CD2 4.41Å; V100-L305 HydrophobicContact CG1-CD2 3.57Å; V100-L305 HydrophobicContact CG2-CD2 3.95Å; I299-L305 HydrophobicContact CD1-CD1 4.38Å; I299-L305 HydrophobicContact CG2-CD1 4.15Å; A302-L305 WeakPolarHBondContact O-CB 3.47Å; A302-L305 PolarHBondContact O-N 3.47Å; A302-L305 VanDerWaalsContact O-N 3.14Å; L305-C309 HydrophobicContact CB-CB 3.98Å; L305-C309 HydrophobicContact CD2-CB 4Å; L305-C309 HydrophobicContact CG-CB 4.41Å; L305-F310 HydrophobicContact CB-CD1 4.47Å; L305-F310 HydrophobicContact CB-CE1 3.9Å; L305-F310 HydrophobicContact CB-CE2 4.25Å; L305-F310 HydrophobicContact CB-CZ 3.78Å; L305-F310 HydrophobicContact CD1-CD1 4.46Å; L305-F310 HydrophobicContact CD1-CE1 3.99Å; L305-F310 WeakPolarHBondContact O-CE2 3.43Å; L305-L313 HydrophobicContact CD1-CD1 3.7Å
306	D	94.4	Very high	94.1	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.043	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-95.6	173.8	175	57.1	30.8	0	0	0	113.2	Y101 K107 E308 C309 F310 R337	Y101-D306 PolarHBondContact OH-OD2 2.86Å; K107-D306 WeakPolarHBondContact CD-OD2 3.31Å; K107-D306 WeakPolarHBondContact CE-OD2 3.4Å; K107-D306 IonicContact NZ-OD2 2.67Å; K107-D306 PolarHBondContact NZ-OD2 3.32Å; D306-E308 PolarHBondContact O-N 2.9Å; D306-E308 PolarHBondContact OD1-N 3.12Å; D306-C309 WeakPolarHBondContact O-CB 3.45Å; D306-C309 PolarHBondContact O-N 2.89Å; D306-C309 VanDerWaalsContact O-N 3.11Å; D306-C309 WeakPolarHBondContact OD1-CB 3.49Å; D306-C309 PolarHBondContact OD1-N 3.4Å; D306-C309 PolarHBondContact OD1-SG 3.03Å; D306-F310 VanDerWaalsContact O-CD2 3.28Å; D306-F310 WeakPolarHBondContact O-CD2 3.4Å; D306-F310 PolarHBondContact O-N 3.23Å; D306-R337 CarbonylContact C-O 3.52Å; D306-R337 WeakPolarHBondContact CA-O 3.31Å; D306-R337 HydrophobicContact CB-CB 3.97Å; D306-R337 VanDerWaalsContact CB-O 3.26Å; D306-R337 WeakPolarHBondContact CB-O 3.47Å
307	I	94.2	Very high	93.9	Very high	62 Å²	62	36.6 Å²	36.6	32%	0.318	17%	0.174	S	C	.	.	H	α-helix	trans	-56.4	-34.2	179	-170.9	169	0	0	0	113.4	F310 T311 R337 T339 T348	I307-F310 PolarHBondContact O-N 3.41Å; I307-T311 WeakPolarHBondContact O-CB 3.34Å; I307-T311 PolarHBondContact O-N 2.81Å; I307-T311 PolarHBondContact O-OG1 3.07Å; I307-R337 PolarHBondContact N-O 3.38Å; I307-T339 HydrophobicContact CB-CG2 3.96Å; I307-T339 HydrophobicContact CD1-CG2 3.59Å; I307-T339 HydrophobicContact CG1-CG2 4.34Å; I307-T339 HydrophobicContact CG2-CG2 4.03Å; I307-T348 HydrophobicContact CG1-CG2 4.24Å
308	E	93.4	Very high	93.4	Very high	117 Å²	117	41.6 Å²	41.6	55%	0.547	20%	0.197	S	C	.	.	H	α-helix	trans	-65.4	-43.9	177.4	-60.8	179.2	149.9	0	0	110.7	K107 D306 T311 Y312	K107-E308 IonicContact NZ-OE2 2.92Å; K107-E308 PolarHBondContact NZ-OE2 3.04Å; D306-E308 PolarHBondContact O-N 2.9Å; D306-E308 PolarHBondContact OD1-N 3.12Å; E308-T311 PolarHBondContact O-N 3.39Å; E308-Y312 PolarHBondContact O-N 3.22Å
309	C	95.4	Very high	92.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-43.4	174.8	-67	0	0	0	0	111.7	L111 L305 D306 Y312 L313	L111-C309 HydrophobicContact CD1-CB 3.79Å; L305-C309 HydrophobicContact CB-CB 3.98Å; L305-C309 HydrophobicContact CD2-CB 4Å; L305-C309 HydrophobicContact CG-CB 4.41Å; D306-C309 WeakPolarHBondContact O-CB 3.45Å; D306-C309 PolarHBondContact O-N 2.89Å; D306-C309 VanDerWaalsContact O-N 3.11Å; D306-C309 WeakPolarHBondContact OD1-CB 3.49Å; D306-C309 PolarHBondContact OD1-N 3.4Å; D306-C309 PolarHBondContact OD1-SG 3.03Å; C309-Y312 PolarHBondContact O-N 3.34Å; C309-L313 WeakPolarHBondContact O-CB 3.44Å; C309-L313 WeakPolarHBondContact O-CG 3.47Å; C309-L313 PolarHBondContact O-N 2.88Å
310	F	94.3	Very high	91.8	Very high	1 Å²	1	56.2 Å²	56.2	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-37.7	177	-66.9	-49	0	0	0	112.8	A302 L305 D306 I307 Y312 L313 H314 I336 G346 I347 T348 L351	A302-F310 WeakPolarHBondContact O-CZ 3.42Å; L305-F310 HydrophobicContact CB-CD1 4.47Å; L305-F310 HydrophobicContact CB-CE1 3.9Å; L305-F310 HydrophobicContact CB-CE2 4.25Å; L305-F310 HydrophobicContact CB-CZ 3.78Å; L305-F310 HydrophobicContact CD1-CD1 4.46Å; L305-F310 HydrophobicContact CD1-CE1 3.99Å; L305-F310 WeakPolarHBondContact O-CE2 3.43Å; D306-F310 VanDerWaalsContact O-CD2 3.28Å; D306-F310 WeakPolarHBondContact O-CD2 3.4Å; D306-F310 PolarHBondContact O-N 3.23Å; I307-F310 PolarHBondContact O-N 3.41Å; F310-Y312 VanDerWaalsContact C-N 3.33Å; F310-Y312 PolarHBondContact O-N 2.85Å; F310-L313 HydrophobicContact CD1-CD1 4.05Å; F310-L313 PolarHBondContact O-N 2.85Å; F310-H314 WeakPolarHBondContact O-CB 3.46Å; F310-H314 PolarHBondContact O-N 3.05Å; F310-I336 HydrophobicContact CD2-CG2 4.46Å; F310-I336 HydrophobicContact CE2-CG2 4.4Å; F310-G346 VanDerWaalsContact CE2-O 3.26Å; F310-G346 WeakPolarHBondContact CE2-O 3.45Å; F310-I347 HydrophobicContact CE1-CG1 4.19Å; F310-I347 HydrophobicContact CE1-CG2 4.48Å; F310-I347 HydrophobicContact CZ-CB 4.43Å; F310-I347 HydrophobicContact CZ-CG1 3.93Å; F310-T348 HydrophobicContact CB-CG2 4.28Å; F310-T348 HydrophobicContact CD2-CG2 4.11Å; F310-L351 HydrophobicContact CB-CD2 4.24Å; F310-L351 HydrophobicContact CD1-CD2 3.35Å; F310-L351 HydrophobicContact CE1-CD2 4.01Å; F310-L351 HydrophobicContact CG-CD2 4.09Å
311	T	92.7	Very high	91	Very high	93 Å²	93	58 Å²	58	57%	0.571	27%	0.27	S	S	*	.	H	α-helix	trans	-61.7	-43.5	174.2	-56.8	0	0	0	0	110.8	I307 E308 R315	I307-T311 WeakPolarHBondContact O-CB 3.34Å; I307-T311 PolarHBondContact O-N 2.81Å; I307-T311 PolarHBondContact O-OG1 3.07Å; E308-T311 PolarHBondContact O-N 3.39Å; T311-R315 PolarHBondContact O-N 2.9Å
312	Y	92.8	Very high	90.6	Very high	46 Å²	46	55.7 Å²	55.7	18%	0.18	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-46.9	174.2	179	-89.9	0	0	0	112	T108 L111 M112 F115 E308 C309 F310 H314 R315 A316	T108-Y312 HydrophobicContact CG2-CD2 4.08Å; T108-Y312 HydrophobicContact CG2-CG 4.28Å; L111-Y312 HydrophobicContact CB-CD1 3.89Å; L111-Y312 HydrophobicContact CB-CE1 3.76Å; L111-Y312 HydrophobicContact CD1-CD1 3.81Å; L111-Y312 HydrophobicContact CD1-CG 4.41Å; M112-Y312 WeakPolarHBondContact CA-OH 3.5Å; M112-Y312 WeakPolarHBondContact CB-OH 3.36Å; M112-Y312 PolarHBondContact SD-OH 3Å; F115-Y312 HydrophobicContact CD2-CE1 4.15Å; F115-Y312 HydrophobicContact CE2-CE1 4.12Å; E308-Y312 PolarHBondContact O-N 3.22Å; C309-Y312 PolarHBondContact O-N 3.34Å; F310-Y312 VanDerWaalsContact C-N 3.33Å; F310-Y312 PolarHBondContact O-N 2.85Å; Y312-H314 VanDerWaalsContact C-N 3.33Å; Y312-H314 PolarHBondContact O-N 2.82Å; Y312-R315 PolarHBondContact O-N 2.93Å; Y312-A316 HydrophobicContact CE1-CB 4.2Å; Y312-A316 WeakPolarHBondContact O-CB 3.4Å; Y312-A316 PolarHBondContact O-N 3.22Å
313	L	93.1	Very high	90.4	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-43.9	178.4	-76.4	171.9	0	0	0	111.8	F115 I299 L305 C309 F310 R315 A316 L317	F115-L313 HydrophobicContact CE2-CD2 3.58Å; F115-L313 HydrophobicContact CZ-CD2 3.69Å; I299-L313 HydrophobicContact CD1-CD1 4.36Å; I299-L313 HydrophobicContact CD1-CD2 4.17Å; L305-L313 HydrophobicContact CD1-CD1 3.7Å; C309-L313 WeakPolarHBondContact O-CB 3.44Å; C309-L313 WeakPolarHBondContact O-CG 3.47Å; C309-L313 PolarHBondContact O-N 2.88Å; F310-L313 HydrophobicContact CD1-CD1 4.05Å; F310-L313 PolarHBondContact O-N 2.85Å; L313-R315 VanDerWaalsContact C-N 3.34Å; L313-R315 PolarHBondContact O-N 3.03Å; L313-A316 PolarHBondContact O-N 3.29Å; L313-L317 VanDerWaalsContact O-CG 3.28Å; L313-L317 WeakPolarHBondContact O-CG 3.47Å; L313-L317 PolarHBondContact O-N 2.92Å
314	H	90.6	Very high	90.3	Very high	52 Å²	52	55.9 Å²	55.9	24%	0.241	26%	0.263	C	S	.	.	H	α-helix	trans	-56.8	-47.4	177.9	-178	-80.3	0	0	0	111.8	F310 Y312 E318 R354	F310-H314 WeakPolarHBondContact O-CB 3.46Å; F310-H314 PolarHBondContact O-N 3.05Å; Y312-H314 VanDerWaalsContact C-N 3.33Å; Y312-H314 PolarHBondContact O-N 2.82Å; H314-E318 IonicContact CE1-OE1 3.25Å; H314-E318 PolarHBondContact CE1-OE1 3.31Å; H314-E318 VanDerWaalsContact CE1-OE1 3.25Å; H314-E318 IonicContact ND1-OE1 3.56Å; H314-R354 PolarHBondContact CE1-NH1 2.9Å; H314-R354 PolarHBondContact CE1-NH2 3.48Å; H314-R354 PolarHBondContact NE2-NE 2.81Å; H314-R354 VanDerWaalsContact NE2-NE 3.15Å; H314-R354 PolarHBondContact NE2-NH1 2.78Å; H314-R354 PolarHBondContact NE2-NH2 3.27Å; H314-R354 VanDerWaalsContact NE2-NH2 3.15Å; H314-R354 PolarHBondContact O-NH1 2.96Å
315	R	89.7	Confident	90.3	Very high	193 Å²	193	54.1 Å²	54.1	73%	0.728	25%	0.254	S	S	*	.	H	α-helix	trans	-66.6	-39.5	175.8	177.5	179.6	151.5	-176.8	-6.7	112.2	T311 Y312 L313 L317 E318	T311-R315 PolarHBondContact O-N 2.9Å; Y312-R315 PolarHBondContact O-N 2.93Å; L313-R315 VanDerWaalsContact C-N 3.34Å; L313-R315 PolarHBondContact O-N 3.03Å; R315-L317 VanDerWaalsContact C-N 3.32Å; R315-L317 PolarHBondContact O-N 3.45Å; R315-E318 PolarHBondContact O-N 3.29Å
316	A	89.4	Confident	90.3	Very high	16 Å²	16	54.1 Å²	54.1	13%	0.132	25%	0.254	C	S	.	.	H	α-helix	trans	-66.9	-32.5	-179.8	0	0	0	0	0	112.8	F115 Y312 L313 E318 S319 S322	F115-A316 HydrophobicContact CD1-CB 4.43Å; F115-A316 HydrophobicContact CE1-CB 3.82Å; F115-A316 HydrophobicContact CE2-CB 4.05Å; F115-A316 HydrophobicContact CZ-CB 3.6Å; Y312-A316 HydrophobicContact CE1-CB 4.2Å; Y312-A316 WeakPolarHBondContact O-CB 3.4Å; Y312-A316 PolarHBondContact O-N 3.22Å; L313-A316 PolarHBondContact O-N 3.29Å; A316-E318 VanDerWaalsContact C-N 3.26Å; A316-E318 PolarHBondContact O-N 3.23Å; A316-S319 WeakPolarHBondContact O-CB 3.28Å; A316-S319 PolarHBondContact O-N 3.41Å; A316-S322 WeakPolarHBondContact O-CB 3.02Å; A316-S322 PolarHBondContact O-OG 3.02Å
317	L	89.8	Confident	90.5	Very high	6 Å²	6	53.8 Å²	53.8	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-68.4	-21.7	176.1	-73.1	171.8	0	0	0	113.5	G62 A64 L313 R315 S319 V325 L351	G62-L317 WeakPolarHBondContact CA-O 3.47Å; G62-L317 PolarHBondContact N-O 2.87Å; A64-L317 HydrophobicContact CB-CD1 3.9Å; A64-L317 HydrophobicContact CB-CD2 3.99Å; L313-L317 VanDerWaalsContact O-CG 3.28Å; L313-L317 WeakPolarHBondContact O-CG 3.47Å; L313-L317 PolarHBondContact O-N 2.92Å; R315-L317 VanDerWaalsContact C-N 3.32Å; R315-L317 PolarHBondContact O-N 3.45Å; L317-S319 PolarHBondContact O-N 3.04Å; L317-V325 HydrophobicContact CD2-CB 3.97Å; L317-V325 HydrophobicContact CD2-CG2 3.59Å; L317-L351 HydrophobicContact CD1-CD1 3.86Å
318	E	85.2	Confident	90.6	Very high	106 Å²	106	50.9 Å²	50.9	50%	0.495	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-14.4	176.7	-66.7	174.9	175.3	0	0	112.7	H314 R315 A316 R354	H314-E318 IonicContact CE1-OE1 3.25Å; H314-E318 PolarHBondContact CE1-OE1 3.31Å; H314-E318 VanDerWaalsContact CE1-OE1 3.25Å; H314-E318 IonicContact ND1-OE1 3.56Å; R315-E318 PolarHBondContact O-N 3.29Å; A316-E318 VanDerWaalsContact C-N 3.26Å; A316-E318 PolarHBondContact O-N 3.23Å; E318-R354 VanDerWaalsContact CG-NH1 3.29Å; E318-R354 IonicContact OE1-CZ 3.89Å; E318-R354 IonicContact OE1-NH1 3.91Å; E318-R354 PolarHBondContact OE1-NH1 3.14Å; E318-R354 IonicContact OE1-NH2 3.98Å; E318-R354 PolarHBondContact OE1-NH2 3.4Å
319	S	83	Confident	90.8	Very high	56 Å²	56	45.3 Å²	45.3	39%	0.392	21%	0.212	S	C	.	.	S	Bend	trans	-68.3	135	176.9	-175.2	0	0	0	0	111.4	A316 L317 I321 S322	A316-S319 WeakPolarHBondContact O-CB 3.28Å; A316-S319 PolarHBondContact O-N 3.41Å; L317-S319 PolarHBondContact O-N 3.04Å; S319-I321 PolarHBondContact O-N 3.31Å; S319-I321 VanDerWaalsContact OG-CG1 3.3Å; S319-I321 WeakPolarHBondContact OG-CG1 3.41Å; S319-S322 VanDerWaalsContact O-CB 3.25Å; S319-S322 WeakPolarHBondContact O-CB 3.35Å; S319-S322 PolarHBondContact O-N 3.09Å; S319-S322 VanDerWaalsContact O-N 3.15Å
320	R	75.4	Confident	90.8	Very high	254 Å²	254	48.1 Å²	48.1	96%	0.958	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-24.6	177.2	-66.4	-176.4	-178.8	-178.6	0.7	113.5
321	I	79.3	Confident	90.7	Very high	80 Å²	80	54.7 Å²	54.7	41%	0.41	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	11.9	-179.6	60.2	167.5	0	0	0	112.3	I119 L292 S319	I119-I321 WeakPolarHBondContact CD1-O 3.42Å; L292-I321 HydrophobicContact CD1-CG2 3.91Å; S319-I321 PolarHBondContact O-N 3.31Å; S319-I321 VanDerWaalsContact OG-CG1 3.3Å; S319-I321 WeakPolarHBondContact OG-CG1 3.41Å
322	S	86.8	Confident	90.8	Very high	24 Å²	24	52.5 Å²	52.5	17%	0.168	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-65.1	133.9	-179	-152.3	0	0	0	0	110.7	A316 S319	A316-S322 WeakPolarHBondContact O-CB 3.02Å; A316-S322 PolarHBondContact O-OG 3.02Å; S319-S322 VanDerWaalsContact O-CB 3.25Å; S319-S322 WeakPolarHBondContact O-CB 3.35Å; S319-S322 PolarHBondContact O-N 3.09Å; S319-S322 VanDerWaalsContact O-N 3.15Å
323	P	92	Very high	90.9	Very high	4 Å²	4	57 Å²	57	3%	0.026	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-65.9	167.1	170.8	33.1	-36.3	0	0	0	110.1	F115 A118 I119 G295 L297 V325	F115-P323 VanDerWaalsContact CD1-CD 3.49Å; F115-P323 HydrophobicContact CD1-CG 3.63Å; F115-P323 HydrophobicContact CE1-CG 4Å; A118-P323 HydrophobicContact CB-CB 3.59Å; A118-P323 HydrophobicContact CB-CG 3.74Å; I119-P323 HydrophobicContact CG1-CB 4.38Å; I119-P323 HydrophobicContact CG1-CG 4.37Å; G295-P323 WeakPolarHBondContact O-CB 3.39Å; L297-P323 HydrophobicContact CB-CG 4.22Å; P323-V325 PolarHBondContact O-N 2.85Å
324	I	93.1	Very high	90.9	Very high	13 Å²	13	58 Å²	58	7%	0.067	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	116.5	174.4	-57.9	143.6	0	0	0	107.8	V55 L86 G295 I296 L297 I326	V55-I324 HydrophobicContact CB-CD1 4.08Å; V55-I324 HydrophobicContact CG1-CD1 3.39Å; V55-I324 HydrophobicContact CG1-CG1 4.31Å; V55-I324 HydrophobicContact CG2-CD1 3.46Å; V55-I324 VanDerWaalsContact CG2-CD1 3.46Å; V55-I324 HydrophobicContact CG2-CG1 3.83Å; V55-I324 HydrophobicContact CG2-CG2 4.47Å; L86-I324 HydrophobicContact CD1-CD1 3.66Å; G295-I324 PolarHBondContact O-N 3.21Å; I296-I324 CarbonylContact C-O 3.6Å; I296-I324 WeakPolarHBondContact CA-O 3.2Å; I296-I324 HydrophobicContact CG1-CB 4.38Å; I296-I324 HydrophobicContact CG1-CD1 4.23Å; L297-I324 PolarHBondContact N-O 3.45Å; I324-I326 HydrophobicContact CG2-CG1 4.15Å
325	V	95.6	Very high	91.2	Very high	2 Å²	2	60.7 Å²	60.7	1%	0.012	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.8	177.5	-176.4	0	0	0	0	109.4	A64 V65 F115 L297 I299 L317 P323 L327	A64-V325 WeakPolarHBondContact CA-O 3.3Å; A64-V325 HydrophobicContact CB-CB 3.96Å; A64-V325 HydrophobicContact CB-CG1 4.42Å; A64-V325 WeakPolarHBondContact CB-O 3.39Å; V65-V325 PolarHBondContact N-O 2.9Å; F115-V325 HydrophobicContact CE1-CG2 3.93Å; F115-V325 HydrophobicContact CZ-CG2 3.91Å; L297-V325 HydrophobicContact CB-CG2 4.4Å; L297-V325 HydrophobicContact CD2-CG2 4.33Å; L297-V325 WeakPolarHBondContact O-CA 3.48Å; I299-V325 HydrophobicContact CD1-CG1 4.42Å; L317-V325 HydrophobicContact CD2-CB 3.97Å; L317-V325 HydrophobicContact CD2-CG2 3.59Å; P323-V325 PolarHBondContact O-N 2.85Å; V325-L327 HydrophobicContact CG1-CD2 3.77Å; V325-L327 HydrophobicContact CG1-CG 4.25Å
326	I	96.8	Very high	91.5	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	110.6	174	-55.4	-177.9	0	0	0	107.9	V65 L67 A79 I82 I296 L297 F298 I299 I324	V65-I326 HydrophobicContact CB-CG1 4.23Å; V65-I326 HydrophobicContact CB-CG2 4.39Å; V65-I326 HydrophobicContact CG1-CG2 4.39Å; V65-I326 CarbonylContact O-C 3.44Å; V65-I326 WeakPolarHBondContact O-CA 3.05Å; L67-I326 HydrophobicContact CD1-CG2 3.63Å; L67-I326 HydrophobicContact CG-CG2 3.94Å; A79-I326 HydrophobicContact CB-CD1 4.39Å; A79-I326 HydrophobicContact CB-CG2 4.25Å; I82-I326 HydrophobicContact CB-CD1 4.48Å; I82-I326 HydrophobicContact CD1-CD1 3.86Å; I82-I326 HydrophobicContact CG2-CD1 4.29Å; I296-I326 HydrophobicContact CD1-CD1 4.28Å; I296-I326 HydrophobicContact CG2-CD1 3.69Å; I296-I326 HydrophobicContact CG2-CG1 3.94Å; L297-I326 PolarHBondContact O-N 3.23Å; F298-I326 CarbonylContact C-O 3.52Å; F298-I326 WeakPolarHBondContact CA-O 3.49Å; F298-I326 HydrophobicContact CD2-CB 4.12Å; F298-I326 HydrophobicContact CD2-CG2 3.92Å; F298-I326 WeakPolarHBondContact CD2-O 3.37Å; F298-I326 HydrophobicContact CE2-CG2 4.3Å; I299-I326 PolarHBondContact N-O 3.44Å; I324-I326 HydrophobicContact CG2-CG1 4.15Å
327	L	97.6	Very high	91.7	Very high	2 Å²	2	56 Å²	56	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	143.6	174.1	-55.6	-178.8	0	0	0	109.4	V65 L66 L67 I299 A302 V325 I347 L351 L355	V65-L327 PolarHBondContact O-N 3.09Å; L66-L327 CarbonylContact C-O 3.6Å; L66-L327 WeakPolarHBondContact CA-O 3.29Å; L66-L327 HydrophobicContact CD1-CB 3.67Å; L67-L327 PolarHBondContact N-O 3.13Å; I299-L327 HydrophobicContact CB-CD2 3.76Å; I299-L327 HydrophobicContact CD1-CD2 3.78Å; I299-L327 HydrophobicContact CG1-CD2 3.97Å; I299-L327 HydrophobicContact CG2-CD2 4.48Å; I299-L327 CarbonylContact O-C 3.57Å; I299-L327 WeakPolarHBondContact O-CA 3.39Å; A302-L327 HydrophobicContact CB-CB 3.89Å; A302-L327 HydrophobicContact CB-CD2 4.21Å; A302-L327 HydrophobicContact CB-CG 4.43Å; V325-L327 HydrophobicContact CG1-CD2 3.77Å; V325-L327 HydrophobicContact CG1-CG 4.25Å; L327-I347 HydrophobicContact CD1-CD1 4.32Å; L327-L351 HydrophobicContact CD1-CD2 4.39Å; L327-L355 HydrophobicContact CD1-CD1 4.02Å; L327-L355 HydrophobicContact CD1-CD2 3.9Å
328	A	97.4	Very high	91.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.9	169.5	0	0	0	0	0	111.4	L67 K75 F298 I299 E301 A302	L67-A328 HydrophobicContact CB-CB 4.31Å; L67-A328 WeakPolarHBondContact O-CA 3.22Å; K75-A328 HydrophobicContact CB-CB 4.17Å; K75-A328 HydrophobicContact CD-CB 4.08Å; F298-A328 HydrophobicContact CE2-CB 3.68Å; F298-A328 HydrophobicContact CZ-CB 3.74Å; I299-A328 PolarHBondContact O-N 3.33Å; E301-A328 PolarHBondContact N-O 3.19Å; E301-A328 VanDerWaalsContact N-O 3.15Å; A302-A328 PolarHBondContact N-O 3.12Å
329	T	97.2	Very high	92.2	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	142.7	177.4	-171.3	0	0	0	0	111.4	L66 L67 A68 G69 K75 R331 H345	L66-T329 HydrophobicContact CD1-CG2 3.87Å; L66-T329 HydrophobicContact CD2-CG2 4.47Å; L66-T329 HydrophobicContact CG-CG2 4.37Å; L67-T329 PolarHBondContact O-N 2.7Å; A68-T329 HydrophobicContact CB-CG2 4.06Å; G69-T329 PolarHBondContact N-O 3.47Å; G69-T329 VanDerWaalsContact N-O 3.16Å; K75-T329 WeakPolarHBondContact CE-O 3.49Å; T329-R331 PolarHBondContact OG1-N 3.22Å; T329-H345 HydrophobicContact CG2-CB 3.8Å
330	N	94.2	Very high	92.7	Very high	59 Å²	59	60.4 Å²	60.4	32%	0.316	31%	0.312	S	S	.	.			trans	-109.6	2.7	170.8	61.2	-18.2	0	0	0	112.7	G69 H303	G69-N330 VanDerWaalsContact O-CA 3.27Å; G69-N330 WeakPolarHBondContact O-CA 3.31Å; H303-N330 PolarHBondContact CE1-OD1 3.41Å
331	R	93.9	Very high	93.5	Very high	139 Å²	139	54 Å²	54	53%	0.525	29%	0.294	S	S	.	.			trans	-93.5	140.3	176.6	-65	-70.8	-175.4	165.4	-1.3	110.7	H303 T329 C334 H345	H303-R331 HydrophobicContact CB-CB 4.32Å; H303-R331 HydrophobicContact CB-CG 4.09Å; H303-R331 WeakPolarHBondContact CD2-CG 3.37Å; H303-R331 VanDerWaalsContact CG-CG 3.48Å; T329-R331 PolarHBondContact OG1-N 3.22Å; R331-C334 HydrophobicContact CB-CB 4.44Å; R331-H345 PolarHBondContact O-ND1 3.5Å
332	G	93.2	Very high	94.2	Very high	47 Å²	47	54.8 Å²	54.8	49%	0.485	30%	0.302	S	S	.	.	S	Bend	trans	-80.3	-116.5	165.5	0	0	0	0	0	109.5	H345	G332-H345 WeakPolarHBondContact O-CA 3.28Å; G332-H345 PolarHBondContact O-N 3.47Å
333	I	94.7	Very high	94.5	Very high	140 Å²	140	54 Å²	54	72%	0.718	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	124.7	174.1	-62.2	174.6	0	0	0	109	V342	I333-V342 HydrophobicContact CG2-CG1 3.22Å
334	C	94.8	Very high	94.6	Very high	24 Å²	24	56.2 Å²	56.2	16%	0.162	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	167	174.1	65.9	0	0	0	0	111.7	R331 G343 G346	R331-C334 HydrophobicContact CB-CB 4.44Å; C334-G343 PolarHBondContact N-O 3.32Å; C334-G343 PolarHBondContact O-N 3.49Å; C334-G346 WeakPolarHBondContact SG-CA 3.45Å; C334-G346 PolarHBondContact SG-N 3.08Å
335	E	95.8	Very high	94.8	Very high	109 Å²	109	57.3 Å²	57.3	51%	0.509	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	138.5	175.6	-169.1	-171.9	138.1	0	0	111.2	R337 T339	E335-R337 PolarHBondContact O-N 3.42Å; E335-T339 WeakPolarHBondContact CG-O 3.49Å
336	I	95.4	Very high	94.7	Very high	11 Å²	11	57.2 Å²	57.2	6%	0.056	32%	0.317	C	S	.	.			trans	-82.6	110.5	168.6	-59.3	165.6	0	0	0	106.6	F310 G338 T339 M341 T348	F310-I336 HydrophobicContact CD2-CG2 4.46Å; F310-I336 HydrophobicContact CE2-CG2 4.4Å; I336-G338 PolarHBondContact O-N 2.9Å; I336-T339 HydrophobicContact CG2-CG2 4.46Å; I336-T339 PolarHBondContact O-N 2.61Å; I336-T339 VanDerWaalsContact O-O 3.14Å; I336-T339 PolarHBondContact O-OG1 3.46Å; I336-M341 HydrophobicContact CD1-CB 4.43Å; I336-M341 PolarHBondContact N-O 2.87Å; I336-T348 HydrophobicContact CG2-CG2 4.07Å
337	R	94.4	Very high	94.7	Very high	99 Å²	99	57.2 Å²	57.2	37%	0.374	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-55.3	136.5	-175.5	-75.5	-178.7	157.4	-129.8	-9.3	111.9	M304 D306 I307 E335	M304-R337 VanDerWaalsContact CE-CZ 3.48Å; M304-R337 VanDerWaalsContact O-CD 3.25Å; M304-R337 WeakPolarHBondContact O-CD 3.45Å; D306-R337 CarbonylContact C-O 3.52Å; D306-R337 WeakPolarHBondContact CA-O 3.31Å; D306-R337 HydrophobicContact CB-CB 3.97Å; D306-R337 VanDerWaalsContact CB-O 3.26Å; D306-R337 WeakPolarHBondContact CB-O 3.47Å; I307-R337 PolarHBondContact N-O 3.38Å; E335-R337 PolarHBondContact O-N 3.42Å
338	G	92.9	Very high	94.5	Very high	67 Å²	67	58.2 Å²	58.2	69%	0.691	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	8.4	-174.9	0	0	0	0	0	114.1	I336	I336-G338 PolarHBondContact O-N 2.9Å
339	T	93.8	Very high	94.2	Very high	27 Å²	27	67.1 Å²	67.1	17%	0.166	36%	0.357	C	S	.	.	S	Bend	trans	-143.6	160.3	174.4	74.6	0	0	0	0	110.3	I307 E335 I336 M341	I307-T339 HydrophobicContact CB-CG2 3.96Å; I307-T339 HydrophobicContact CD1-CG2 3.59Å; I307-T339 HydrophobicContact CG1-CG2 4.34Å; I307-T339 HydrophobicContact CG2-CG2 4.03Å; E335-T339 WeakPolarHBondContact CG-O 3.49Å; I336-T339 HydrophobicContact CG2-CG2 4.46Å; I336-T339 PolarHBondContact O-N 2.61Å; I336-T339 VanDerWaalsContact O-O 3.14Å; I336-T339 PolarHBondContact O-OG1 3.46Å; T339-M341 PolarHBondContact O-N 2.91Å; T339-M341 PolarHBondContact OG1-N 3.39Å
340	D	92.9	Very high	93.8	Very high	167 Å²	167	72.3 Å²	72.3	89%	0.893	38%	0.384	S	S	*	.	S	Bend	trans	-84.2	10.2	171.1	-55.4	-45.2	0	0	0	112.7
341	M	92.8	Very high	93.7	Very high	118 Å²	118	69.5 Å²	69.5	58%	0.581	37%	0.369	S	S	*	.			trans	-91.6	135.7	-174.9	-63.3	-178.3	70.1	0	0	111	I336 T339	I336-M341 HydrophobicContact CD1-CB 4.43Å; I336-M341 PolarHBondContact N-O 2.87Å; T339-M341 PolarHBondContact O-N 2.91Å; T339-M341 PolarHBondContact OG1-N 3.39Å
342	V	93.6	Very high	93.7	Very high	97 Å²	97	64.8 Å²	64.8	59%	0.588	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.8	172.1	179.8	0	0	0	0	109.3	I333	I333-V342 HydrophobicContact CG2-CG1 3.22Å
343	G	92.2	Very high	93.6	Very high	8 Å²	8	70.6 Å²	70.6	8%	0.082	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	162.7	-177.7	0	0	0	0	0	113.1	C334 H345 G346	C334-G343 PolarHBondContact N-O 3.32Å; C334-G343 PolarHBondContact O-N 3.49Å; G343-H345 PolarHBondContact O-N 3.19Å; G343-G346 PolarHBondContact O-N 3.34Å
344	P	95.3	Very high	93.4	Very high	50 Å²	50	67.2 Å²	67.2	33%	0.325	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	130.8	169.9	29.1	-35.4	0	0	0	109.5	G346 I347 L352	P344-G346 PolarHBondContact O-N 3.49Å; P344-I347 PolarHBondContact O-N 3.47Å; P344-L352 HydrophobicContact CB-CD2 4.43Å; P344-L352 HydrophobicContact CG-CD2 3.5Å; P344-L352 VanDerWaalsContact CG-CD2 3.5Å
345	H	96.2	Very high	93.5	Very high	36 Å²	36	66.8 Å²	66.8	17%	0.167	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	61	8.3	179.2	-52	-53	0	0	0	115.9	L66 H303 T329 R331 G332 G343 I347	L66-H345 HydrophobicContact CD2-CB 4.4Å; H303-H345 VanDerWaalsContact CB-O 3.25Å; H303-H345 WeakPolarHBondContact CB-O 3.3Å; T329-H345 HydrophobicContact CG2-CB 3.8Å; R331-H345 PolarHBondContact O-ND1 3.5Å; G332-H345 WeakPolarHBondContact O-CA 3.28Å; G332-H345 PolarHBondContact O-N 3.47Å; G343-H345 PolarHBondContact O-N 3.19Å; H345-I347 HydrophobicContact CB-CD1 4.05Å; H345-I347 HydrophobicContact CB-CG1 4.18Å; H345-I347 PolarHBondContact O-N 2.93Å
346	G	94.4	Very high	93.4	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	23.3	-172.6	0	0	0	0	0	113.1	F310 C334 G343 P344	F310-G346 VanDerWaalsContact CE2-O 3.26Å; F310-G346 WeakPolarHBondContact CE2-O 3.45Å; C334-G346 WeakPolarHBondContact SG-CA 3.45Å; C334-G346 PolarHBondContact SG-N 3.08Å; G343-G346 PolarHBondContact O-N 3.34Å; P344-G346 PolarHBondContact O-N 3.49Å
347	I	95.3	Very high	93.5	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.005	35%	0.35	C	S	.	.			trans	-108.9	143.6	-177.9	-62.1	175.3	0	0	0	109.5	L66 F310 L327 P344 H345 L351 L355	L66-I347 HydrophobicContact CD1-CD1 3.81Å; L66-I347 HydrophobicContact CD2-CD1 3.98Å; F310-I347 HydrophobicContact CE1-CG1 4.19Å; F310-I347 HydrophobicContact CE1-CG2 4.48Å; F310-I347 HydrophobicContact CZ-CB 4.43Å; F310-I347 HydrophobicContact CZ-CG1 3.93Å; L327-I347 HydrophobicContact CD1-CD1 4.32Å; P344-I347 PolarHBondContact O-N 3.47Å; H345-I347 HydrophobicContact CB-CD1 4.05Å; H345-I347 HydrophobicContact CB-CG1 4.18Å; H345-I347 PolarHBondContact O-N 2.93Å; I347-L351 HydrophobicContact CG2-CB 3.92Å; I347-L351 HydrophobicContact CG2-CD2 3.98Å; I347-L351 HydrophobicContact CG2-CG 4.08Å; I347-L355 HydrophobicContact CD1-CD1 3.94Å; I347-L355 HydrophobicContact CG2-CD1 4.2Å
348	T	93.3	Very high	93.7	Very high	22 Å²	22	63.6 Å²	63.6	14%	0.135	34%	0.336	C	S	.	.			trans	-62.3	146.8	175	59.8	0	0	0	0	111.4	I307 F310 I336 D350 L351 L352	I307-T348 HydrophobicContact CG1-CG2 4.24Å; F310-T348 HydrophobicContact CB-CG2 4.28Å; F310-T348 HydrophobicContact CD2-CG2 4.11Å; I336-T348 HydrophobicContact CG2-CG2 4.07Å; T348-D350 VanDerWaalsContact C-N 3.28Å; T348-D350 PolarHBondContact O-N 3.06Å; T348-L351 PolarHBondContact O-N 3.3Å; T348-L351 WeakPolarHBondContact OG1-CB 3.37Å; T348-L352 WeakPolarHBondContact O-CB 3.45Å; T348-L352 PolarHBondContact O-N 3.48Å
349	R	91.4	Very high	93.8	Very high	188 Å²	188	68.6 Å²	68.6	71%	0.709	33%	0.334	S	S	*	.	H	α-helix	trans	-57.5	-42.8	-179.3	-67.8	-175.3	-179.1	-173.5	0.6	112	L351 L352 E353	R349-L351 VanDerWaalsContact C-N 3.33Å; R349-L351 PolarHBondContact O-N 3.29Å; R349-L352 WeakPolarHBondContact O-CB 3.49Å; R349-L352 PolarHBondContact O-N 3.49Å; R349-L352 VanDerWaalsContact O-N 3.13Å; R349-E353 PolarHBondContact O-N 3.12Å; R349-E353 VanDerWaalsContact O-N 3.09Å
350	D	90.2	Very high	94	Very high	109 Å²	109	67.3 Å²	67.3	58%	0.583	33%	0.326	S	S	*	.	H	α-helix	trans	-60.9	-40.7	-179.2	-48.4	-34.7	0	0	0	112.4	T348	T348-D350 VanDerWaalsContact C-N 3.28Å; T348-D350 PolarHBondContact O-N 3.06Å
351	L	92.1	Very high	94	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-72.4	-40.4	176	-175.9	59.8	0	0	0	110.6	F310 L317 L327 I347 T348 R349 E353 R354 L355	F310-L351 HydrophobicContact CB-CD2 4.24Å; F310-L351 HydrophobicContact CD1-CD2 3.35Å; F310-L351 HydrophobicContact CE1-CD2 4.01Å; F310-L351 HydrophobicContact CG-CD2 4.09Å; L317-L351 HydrophobicContact CD1-CD1 3.86Å; L327-L351 HydrophobicContact CD1-CD2 4.39Å; I347-L351 HydrophobicContact CG2-CB 3.92Å; I347-L351 HydrophobicContact CG2-CD2 3.98Å; I347-L351 HydrophobicContact CG2-CG 4.08Å; T348-L351 PolarHBondContact O-N 3.3Å; T348-L351 WeakPolarHBondContact OG1-CB 3.37Å; R349-L351 VanDerWaalsContact C-N 3.33Å; R349-L351 PolarHBondContact O-N 3.29Å; L351-E353 VanDerWaalsContact C-N 3.27Å; L351-E353 PolarHBondContact O-N 3.43Å; L351-R354 WeakPolarHBondContact O-CA 3.34Å; L351-R354 WeakPolarHBondContact O-CB 3.43Å; L351-R354 PolarHBondContact O-N 2.88Å; L351-L355 HydrophobicContact CG-CD1 4.38Å; L351-L355 WeakPolarHBondContact O-CG 3.29Å; L351-L355 PolarHBondContact O-N 3.28Å
352	L	92.6	Very high	94	Very high	39 Å²	39	63.2 Å²	63.2	20%	0.204	30%	0.304	C	S	.	.	H	α-helix	trans	-57.1	-38.6	-179.8	-167.9	72.4	0	0	0	112.7	L66 P344 T348 R349 R354 L355 I357	L66-L352 HydrophobicContact CD2-CD1 4.28Å; P344-L352 HydrophobicContact CB-CD2 4.43Å; P344-L352 HydrophobicContact CG-CD2 3.5Å; P344-L352 VanDerWaalsContact CG-CD2 3.5Å; T348-L352 WeakPolarHBondContact O-CB 3.45Å; T348-L352 PolarHBondContact O-N 3.48Å; R349-L352 WeakPolarHBondContact O-CB 3.49Å; R349-L352 PolarHBondContact O-N 3.49Å; R349-L352 VanDerWaalsContact O-N 3.13Å; L352-R354 PolarHBondContact O-N 2.8Å; L352-L355 HydrophobicContact CD1-CD1 4.31Å; L352-L355 PolarHBondContact O-N 3.31Å; L352-I357 HydrophobicContact CD1-CD1 3.78Å; L352-I357 HydrophobicContact CG-CD1 4.37Å
353	E	91.8	Very high	94	Very high	169 Å²	169	59.5 Å²	59.5	79%	0.79	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-21.2	176	-71	-179.1	-177.5	0	0	113.6	R349 L351	R349-E353 PolarHBondContact O-N 3.12Å; R349-E353 VanDerWaalsContact O-N 3.09Å; L351-E353 VanDerWaalsContact C-N 3.27Å; L351-E353 PolarHBondContact O-N 3.43Å
354	R	91.3	Very high	94.2	Very high	70 Å²	70	62.5 Å²	62.5	26%	0.264	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-2.5	175.9	-62.5	-174.8	172	-160.4	-1.5	113.5	R63 A64 H314 E318 L351 L352	R63-R354 WeakPolarHBondContact CA-O 3.32Å; A64-R354 PolarHBondContact N-O 3.2Å; A64-R354 VanDerWaalsContact N-O 3.14Å; H314-R354 PolarHBondContact CE1-NH1 2.9Å; H314-R354 PolarHBondContact CE1-NH2 3.48Å; H314-R354 PolarHBondContact NE2-NE 2.81Å; H314-R354 VanDerWaalsContact NE2-NE 3.15Å; H314-R354 PolarHBondContact NE2-NH1 2.78Å; H314-R354 PolarHBondContact NE2-NH2 3.27Å; H314-R354 VanDerWaalsContact NE2-NH2 3.15Å; H314-R354 PolarHBondContact O-NH1 2.96Å; E318-R354 VanDerWaalsContact CG-NH1 3.29Å; E318-R354 IonicContact OE1-CZ 3.89Å; E318-R354 IonicContact OE1-NH1 3.91Å; E318-R354 PolarHBondContact OE1-NH1 3.14Å; E318-R354 IonicContact OE1-NH2 3.98Å; E318-R354 PolarHBondContact OE1-NH2 3.4Å; L351-R354 WeakPolarHBondContact O-CA 3.34Å; L351-R354 WeakPolarHBondContact O-CB 3.43Å; L351-R354 PolarHBondContact O-N 2.88Å; L352-R354 PolarHBondContact O-N 2.8Å
355	L	95	Very high	94.1	Very high	15 Å²	15	62 Å²	62	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.9	-177	-62.2	174.1	0	0	0	112.1	A64 L66 L327 I347 L351 L352 I357	A64-L355 HydrophobicContact CB-CD2 3.45Å; A64-L355 VanDerWaalsContact CB-CD2 3.45Å; A64-L355 CarbonylContact O-C 3.12Å; A64-L355 WeakPolarHBondContact O-CA 3.45Å; L66-L355 HydrophobicContact CB-CB 4.12Å; L66-L355 HydrophobicContact CB-CD1 4.02Å; L66-L355 HydrophobicContact CB-CG 4.45Å; L66-L355 HydrophobicContact CD2-CD1 4.12Å; L66-L355 HydrophobicContact CG-CD1 4.49Å; L327-L355 HydrophobicContact CD1-CD1 4.02Å; L327-L355 HydrophobicContact CD1-CD2 3.9Å; I347-L355 HydrophobicContact CD1-CD1 3.94Å; I347-L355 HydrophobicContact CG2-CD1 4.2Å; L351-L355 HydrophobicContact CG-CD1 4.38Å; L351-L355 WeakPolarHBondContact O-CG 3.29Å; L351-L355 PolarHBondContact O-N 3.28Å; L352-L355 HydrophobicContact CD1-CD1 4.31Å; L352-L355 PolarHBondContact O-N 3.31Å; L355-I357 HydrophobicContact CB-CG1 4.33Å; L355-I357 PolarHBondContact O-N 3.24Å
356	L	95.7	Very high	94.1	Very high	53 Å²	53	64.8 Å²	64.8	28%	0.277	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	105.4	160.8	-63.1	178	0	0	0	108.3	L54 M60 A64 V65 L66	L54-L356 HydrophobicContact CD1-CD1 4.07Å; M60-L356 HydrophobicContact CE-CD1 4.34Å; M60-L356 HydrophobicContact SD-CD1 4.13Å; A64-L356 PolarHBondContact O-N 3.34Å; V65-L356 WeakPolarHBondContact CA-O 3.3Å; L66-L356 PolarHBondContact N-O 2.88Å
357	I	96.6	Very high	94.1	Very high	85 Å²	85	67.1 Å²	67.1	44%	0.436	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	116.6	-176	-51.1	178.6	0	0	0	109.9	L66 A68 L352 L355	L66-I357 HydrophobicContact CB-CG1 4.25Å; L66-I357 HydrophobicContact CD2-CD1 4.38Å; L66-I357 HydrophobicContact CD2-CG1 4.16Å; L66-I357 HydrophobicContact CD2-CG2 4.31Å; L66-I357 CarbonylContact O-C 3.56Å; L66-I357 WeakPolarHBondContact O-CA 3.36Å; A68-I357 HydrophobicContact CB-CG2 4.1Å; L352-I357 HydrophobicContact CD1-CD1 3.78Å; L352-I357 HydrophobicContact CG-CD1 4.37Å; L355-I357 HydrophobicContact CB-CG1 4.33Å; L355-I357 PolarHBondContact O-N 3.24Å
358	V	97.5	Very high	94.1	Very high	13 Å²	13	67.6 Å²	67.6	8%	0.079	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.5	174.2	176.9	0	0	0	0	108.6	A44 A47 I51 V65 L66 L67 A68	A44-V358 HydrophobicContact CB-CG1 3.93Å; A47-V358 HydrophobicContact CB-CG1 3.92Å; A47-V358 HydrophobicContact CB-CG2 3.9Å; I51-V358 HydrophobicContact CD1-CG2 3.81Å; V65-V358 HydrophobicContact CG1-CG2 4.39Å; L66-V358 PolarHBondContact O-N 3.35Å; L67-V358 WeakPolarHBondContact CA-O 3.32Å; L67-V358 HydrophobicContact CD2-CB 3.98Å; L67-V358 HydrophobicContact CD2-CG1 4.11Å; A68-V358 PolarHBondContact N-O 2.77Å
359	R	96.9	Very high	94.2	Very high	173 Å²	173	69.6 Å²	69.6	65%	0.653	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	137.5	-179.8	-173.3	177.2	177.6	-171.6	-3.5	110.8	A68 M361	A68-R359 CarbonylContact O-C 3.56Å; A68-R359 WeakPolarHBondContact O-CA 3.45Å; R359-M361 HydrophobicContact CG-SD 4.1Å; R359-M361 PolarHBondContact NE-SD 2.93Å
360	T	96.1	Very high	94.3	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.313	C	S	.	.			trans	-110.6	134.8	169	55.3	0	0	0	0	109.6	A44 A68 G69 T73 K75 I78	A44-T360 HydrophobicContact CB-CG2 4.17Å; A68-T360 PolarHBondContact O-N 2.86Å; A68-T360 PolarHBondContact O-OG1 3.02Å; G69-T360 WeakPolarHBondContact CA-OG1 3.43Å; T73-T360 WeakPolarHBondContact OG1-CB 3.48Å; T73-T360 PolarHBondContact OG1-OG1 3.13Å; K75-T360 HydrophobicContact CG-CG2 3.94Å; I78-T360 HydrophobicContact CD1-CG2 3.88Å
361	M	94	Very high	94.5	Very high	80 Å²	80	60.1 Å²	60.1	39%	0.394	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-101.1	161.2	-178	-63	-60.9	-79.1	0	0	112.2	Q41 T73 R359	Q41-M361 PolarHBondContact NE2-O 3.13Å; T73-M361 VanDerWaalsContact CG2-O 3.25Å; T73-M361 WeakPolarHBondContact CG2-O 3.35Å; R359-M361 HydrophobicContact CG-SD 4.1Å; R359-M361 PolarHBondContact NE-SD 2.93Å
362	L	93.2	Very high	94.6	Very high	118 Å²	118	60.1 Å²	60.1	62%	0.618	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-65.9	144.7	168.1	-67.5	173.8	0	0	0	109.7	P70 T73	P70-L362 HydrophobicContact CB-CD2 3.61Å; P70-L362 HydrophobicContact CB-CG 4.39Å; P70-L362 HydrophobicContact CG-CD2 3.79Å; P70-L362 HydrophobicContact CG-CG 4.02Å; T73-L362 HydrophobicContact CG2-CD2 4.3Å
363	Y	93.9	Very high	94.6	Very high	20 Å²	20	61.2 Å²	61.2	8%	0.078	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-72.9	145.8	174.6	-63.9	-70.9	0	0	0	111.2	V39 Q41 A72 T73 E367 M368 I371 L400	V39-Y363 WeakPolarHBondContact O-CE1 3.43Å; Q41-Y363 HydrophobicContact CG-CE1 3.75Å; A72-Y363 WeakPolarHBondContact O-CE2 3.46Å; T73-Y363 PolarHBondContact O-OH 3.46Å; Y363-E367 WeakPolarHBondContact CA-OE2 3.39Å; Y363-E367 HydrophobicContact CD1-CB 4.14Å; Y363-M368 WeakPolarHBondContact O-CE 3.32Å; Y363-I371 HydrophobicContact CD1-CD1 3.75Å; Y363-I371 HydrophobicContact CD2-CD1 3.96Å; Y363-I371 HydrophobicContact CE1-CD1 3.74Å; Y363-I371 HydrophobicContact CE2-CD1 3.95Å; Y363-I371 HydrophobicContact CG-CD1 3.86Å; Y363-L400 HydrophobicContact CD2-CD2 3.66Å; Y363-L400 HydrophobicContact CE2-CD2 3.67Å
364	T	94.5	Very high	94.6	Very high	71 Å²	71	55.5 Å²	55.5	44%	0.436	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-74.2	160.3	168.2	62	0	0	0	0	110.8	E367 M368	T364-E367 PolarHBondContact N-OE2 3.33Å; T364-E367 PolarHBondContact O-N 3.3Å; T364-E367 VanDerWaalsContact O-N 3.12Å; T364-E367 VanDerWaalsContact OG1-CD 3.25Å; T364-E367 VanDerWaalsContact OG1-CG 3.22Å; T364-E367 WeakPolarHBondContact OG1-CG 3.46Å; T364-E367 PolarHBondContact OG1-N 2.96Å; T364-E367 PolarHBondContact OG1-OE2 2.88Å; T364-M368 WeakPolarHBondContact O-CG 3.48Å; T364-M368 PolarHBondContact O-N 3.42Å
365	V	95	Very high	94.5	Very high	38 Å²	38	54 Å²	54	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-55	-44.3	177.8	-178.2	0	0	0	0	112.3	E367 M368 R369 A392 Y396	V365-E367 PolarHBondContact O-N 3.05Å; V365-M368 PolarHBondContact O-N 3.17Å; V365-R369 WeakPolarHBondContact O-CB 3.37Å; V365-R369 PolarHBondContact O-N 2.87Å; V365-A392 HydrophobicContact CG1-CB 4.16Å; V365-Y396 HydrophobicContact CG2-CD1 4.33Å; V365-Y396 HydrophobicContact CG2-CD2 3.8Å; V365-Y396 HydrophobicContact CG2-CE2 4.39Å; V365-Y396 HydrophobicContact CG2-CG 3.76Å
366	P	95.3	Very high	94.4	Very high	95 Å²	95	53.4 Å²	53.4	62%	0.617	26%	0.262	S	S	*	.	H	α-helix	trans	-61.9	-38.9	175.9	-24.4	35.9	0	0	0	113.6	K370	P366-K370 PolarHBondContact O-N 3.39Å; P366-K370 VanDerWaalsContact O-N 3.1Å
367	E	94.5	Very high	94.1	Very high	50 Å²	50	57.1 Å²	57.1	23%	0.234	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-44.5	176	-69.5	168.5	143.5	0	0	111.1	V39 G40 Y363 T364 V365 R369 K370 I371	V39-E367 HydrophobicContact CG1-CB 3.92Å; V39-E367 HydrophobicContact CG1-CG 4.06Å; G40-E367 WeakPolarHBondContact CA-OE1 3.42Å; Y363-E367 WeakPolarHBondContact CA-OE2 3.39Å; Y363-E367 HydrophobicContact CD1-CB 4.14Å; T364-E367 PolarHBondContact N-OE2 3.33Å; T364-E367 PolarHBondContact O-N 3.3Å; T364-E367 VanDerWaalsContact O-N 3.12Å; T364-E367 VanDerWaalsContact OG1-CD 3.25Å; T364-E367 VanDerWaalsContact OG1-CG 3.22Å; T364-E367 WeakPolarHBondContact OG1-CG 3.46Å; T364-E367 PolarHBondContact OG1-N 2.96Å; T364-E367 PolarHBondContact OG1-OE2 2.88Å; V365-E367 PolarHBondContact O-N 3.05Å; E367-R369 PolarHBondContact O-N 3.43Å; E367-K370 PolarHBondContact O-N 3.43Å; E367-K370 VanDerWaalsContact O-N 3.17Å; E367-I371 VanDerWaalsContact O-CG1 3.26Å; E367-I371 WeakPolarHBondContact O-CG1 3.22Å; E367-I371 PolarHBondContact O-N 3.05Å
368	M	94.4	Very high	93.7	Very high	10 Å²	10	55.1 Å²	55.1	5%	0.049	27%	0.274	C	S	.	.	H	α-helix	trans	-59.1	-47.1	175.8	-70.4	-167	-177.7	0	0	111.4	Y363 T364 V365 K370 I371 I372 Y396 L400	Y363-M368 WeakPolarHBondContact O-CE 3.32Å; T364-M368 WeakPolarHBondContact O-CG 3.48Å; T364-M368 PolarHBondContact O-N 3.42Å; V365-M368 PolarHBondContact O-N 3.17Å; M368-K370 PolarHBondContact O-N 2.83Å; M368-I371 PolarHBondContact O-N 3.31Å; M368-I371 VanDerWaalsContact O-N 3.17Å; M368-I372 WeakPolarHBondContact O-CB 3.32Å; M368-I372 WeakPolarHBondContact O-CD1 3.45Å; M368-I372 WeakPolarHBondContact O-CG1 3.43Å; M368-I372 PolarHBondContact O-N 3.17Å; M368-Y396 PolarHBondContact SD-N 3.46Å; M368-L400 HydrophobicContact CG-CD1 4.44Å
369	R	95.8	Very high	93.1	Very high	65 Å²	65	56.7 Å²	56.7	25%	0.245	28%	0.281	C	S	.	.	H	α-helix	trans	-52.2	-46.9	175	-172.9	-178.5	164.3	78.9	-6.4	110.7	V365 E367 I372 E373 K385 L388 D389 A392	V365-R369 WeakPolarHBondContact O-CB 3.37Å; V365-R369 PolarHBondContact O-N 2.87Å; E367-R369 PolarHBondContact O-N 3.43Å; R369-I372 PolarHBondContact O-N 2.94Å; R369-E373 WeakPolarHBondContact O-CB 3.35Å; R369-E373 PolarHBondContact O-N 2.92Å; R369-K385 PolarHBondContact NH1-O 3.14Å; R369-L388 HydrophobicContact CG-CD1 4.41Å; R369-L388 HydrophobicContact CG-CD2 3.98Å; R369-L388 HydrophobicContact CG-CG 3.82Å; R369-D389 WeakPolarHBondContact CD-OD1 3.38Å; R369-D389 IonicContact CZ-OD1 3.15Å; R369-D389 VanDerWaalsContact CZ-OD1 3.23Å; R369-D389 IonicContact CZ-OD2 2.7Å; R369-D389 IonicContact NE-OD1 2.66Å; R369-D389 VanDerWaalsContact NH1-N 3.14Å; R369-D389 IonicContact NH1-OD1 3.21Å; R369-D389 PolarHBondContact NH1-OD1 3.42Å; R369-D389 IonicContact NH1-OD2 2.95Å; R369-D389 PolarHBondContact NH1-OD2 2.78Å; R369-D389 IonicContact NH2-OD2 3.34Å; R369-A392 HydrophobicContact CB-CB 3.81Å; R369-A392 HydrophobicContact CG-CB 4.4Å
370	K	94.4	Very high	92.8	Very high	71 Å²	71	59.4 Å²	59.4	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-69.8	-37.6	-179.3	-169.8	56	174.3	-178.2	0	113.2	L34 V39 P366 E367 M368 E373 I374	L34-K370 HydrophobicContact CD2-CG 3.88Å; V39-K370 HydrophobicContact CG1-CB 3.99Å; V39-K370 HydrophobicContact CG1-CG 4.16Å; V39-K370 HydrophobicContact CG2-CB 4.29Å; V39-K370 HydrophobicContact CG2-CG 3.91Å; P366-K370 PolarHBondContact O-N 3.39Å; P366-K370 VanDerWaalsContact O-N 3.1Å; E367-K370 PolarHBondContact O-N 3.43Å; E367-K370 VanDerWaalsContact O-N 3.17Å; M368-K370 PolarHBondContact O-N 2.83Å; K370-E373 WeakPolarHBondContact CD-OE2 3.49Å; K370-E373 WeakPolarHBondContact CE-OE2 3.25Å; K370-E373 IonicContact NZ-OE1 3.81Å; K370-E373 IonicContact NZ-OE2 3.4Å; K370-E373 PolarHBondContact NZ-OE2 2.97Å; K370-E373 PolarHBondContact O-N 3.28Å; K370-I374 HydrophobicContact CG-CD1 4.37Å; K370-I374 WeakPolarHBondContact O-CG1 3.35Å; K370-I374 PolarHBondContact O-N 3.45Å; K370-I374 VanDerWaalsContact O-N 3.08Å
371	I	92.9	Very high	92.7	Very high	27 Å²	27	59.9 Å²	59.9	14%	0.138	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-45	175.4	-65.8	163.3	0	0	0	110.5	V39 Y363 E367 M368 E373 I374 R375 L400	V39-I371 HydrophobicContact CB-CD1 4.2Å; V39-I371 HydrophobicContact CB-CG1 3.6Å; V39-I371 HydrophobicContact CG1-CG1 4.18Å; V39-I371 HydrophobicContact CG2-CG1 3.71Å; Y363-I371 HydrophobicContact CD1-CD1 3.75Å; Y363-I371 HydrophobicContact CD2-CD1 3.96Å; Y363-I371 HydrophobicContact CE1-CD1 3.74Å; Y363-I371 HydrophobicContact CE2-CD1 3.95Å; Y363-I371 HydrophobicContact CG-CD1 3.86Å; E367-I371 VanDerWaalsContact O-CG1 3.26Å; E367-I371 WeakPolarHBondContact O-CG1 3.22Å; E367-I371 PolarHBondContact O-N 3.05Å; M368-I371 PolarHBondContact O-N 3.31Å; M368-I371 VanDerWaalsContact O-N 3.17Å; I371-E373 VanDerWaalsContact C-N 3.33Å; I371-E373 PolarHBondContact O-N 3.18Å; I371-I374 PolarHBondContact O-N 3.4Å; I371-R375 PolarHBondContact O-N 3.16Å; I371-L400 HydrophobicContact CB-CD1 4.44Å; I371-L400 HydrophobicContact CD1-CD2 3.92Å; I371-L400 HydrophobicContact CG2-CD1 4.15Å; I371-L400 HydrophobicContact CG2-CD2 4.07Å
372	I	94.1	Very high	92.7	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-42.5	178.2	-64.7	160.4	0	0	0	110.1	M368 R369 I374 R375 A376 L383 L388 L391 A392 L400 A403 L404 L407	M368-I372 WeakPolarHBondContact O-CB 3.32Å; M368-I372 WeakPolarHBondContact O-CD1 3.45Å; M368-I372 WeakPolarHBondContact O-CG1 3.43Å; M368-I372 PolarHBondContact O-N 3.17Å; R369-I372 PolarHBondContact O-N 2.94Å; I372-I374 PolarHBondContact O-N 3.11Å; I372-R375 PolarHBondContact O-N 3.31Å; I372-A376 VanDerWaalsContact O-CB 3.31Å; I372-A376 WeakPolarHBondContact O-CB 3.46Å; I372-A376 PolarHBondContact O-N 2.87Å; I372-L383 HydrophobicContact CG2-CD1 4.27Å; I372-L388 HydrophobicContact CB-CD1 3.86Å; I372-L388 HydrophobicContact CG2-CD1 3.53Å; I372-L391 HydrophobicContact CD1-CB 4.07Å; I372-L391 HydrophobicContact CG2-CB 4.16Å; I372-L391 HydrophobicContact CG2-CD1 4.01Å; I372-A392 HydrophobicContact CD1-CB 4.3Å; I372-L400 HydrophobicContact CG1-CD1 4.12Å; I372-A403 HydrophobicContact CD1-CB 4.15Å; I372-L404 HydrophobicContact CB-CD2 4.4Å; I372-L404 HydrophobicContact CG1-CD2 3.88Å; I372-L407 HydrophobicContact CG2-CD2 4.03Å
373	E	94.1	Very high	92.8	Very high	62 Å²	62	54.8 Å²	54.8	29%	0.29	27%	0.273	S	S	.	.	H	α-helix	trans	-57.7	-49.1	175.4	-172.6	-172.4	-167.5	0	0	112	R369 K370 I371 R375 A376 Q377 L388	R369-E373 WeakPolarHBondContact O-CB 3.35Å; R369-E373 PolarHBondContact O-N 2.92Å; K370-E373 WeakPolarHBondContact CD-OE2 3.49Å; K370-E373 WeakPolarHBondContact CE-OE2 3.25Å; K370-E373 IonicContact NZ-OE1 3.81Å; K370-E373 IonicContact NZ-OE2 3.4Å; K370-E373 PolarHBondContact NZ-OE2 2.97Å; K370-E373 PolarHBondContact O-N 3.28Å; I371-E373 VanDerWaalsContact C-N 3.33Å; I371-E373 PolarHBondContact O-N 3.18Å; E373-R375 VanDerWaalsContact C-N 3.31Å; E373-R375 PolarHBondContact O-N 3.1Å; E373-A376 PolarHBondContact O-N 2.86Å; E373-Q377 WeakPolarHBondContact O-CG 3.42Å; E373-Q377 PolarHBondContact O-N 2.91Å; E373-L388 HydrophobicContact CB-CD1 4.34Å; E373-L388 HydrophobicContact CB-CD2 4.06Å; E373-L388 HydrophobicContact CG-CD2 4.3Å
374	I	90.4	Very high	93	Very high	49 Å²	49	56.4 Å²	56.4	25%	0.251	28%	0.282	S	S	.	.	H	α-helix	trans	-61.4	-41.9	178.4	-67.7	165.3	0	0	0	110.6	V39 K370 I371 I372 Q377 A378	V39-I374 HydrophobicContact CG2-CD1 3.59Å; K370-I374 HydrophobicContact CG-CD1 4.37Å; K370-I374 WeakPolarHBondContact O-CG1 3.35Å; K370-I374 PolarHBondContact O-N 3.45Å; K370-I374 VanDerWaalsContact O-N 3.08Å; I371-I374 PolarHBondContact O-N 3.4Å; I372-I374 PolarHBondContact O-N 3.11Å; I374-Q377 PolarHBondContact O-N 3.5Å; I374-A378 PolarHBondContact O-N 3.1Å; I374-A378 VanDerWaalsContact O-N 3.09Å
375	R	89.7	Confident	93.1	Very high	39 Å²	39	60.6 Å²	60.6	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-67.6	-42.4	179.5	-171.1	68.4	-179	178.4	9.5	111.8	I371 I372 E373 Q377 A378 E379 L404 L407	I371-R375 PolarHBondContact O-N 3.16Å; I372-R375 PolarHBondContact O-N 3.31Å; E373-R375 VanDerWaalsContact C-N 3.31Å; E373-R375 PolarHBondContact O-N 3.1Å; R375-Q377 VanDerWaalsContact C-N 3.31Å; R375-Q377 PolarHBondContact O-N 3.47Å; R375-A378 PolarHBondContact O-N 3.44Å; R375-A378 VanDerWaalsContact O-N 3.16Å; R375-E379 IonicContact CZ-OE1 3.99Å; R375-E379 IonicContact NE-OE1 3.12Å; R375-E379 PolarHBondContact NE-OE1 3.32Å; R375-E379 IonicContact NH2-OE1 3.13Å; R375-E379 PolarHBondContact NH2-OE1 3.01Å; R375-E379 PolarHBondContact O-N 2.87Å; R375-L404 HydrophobicContact CB-CD2 3.79Å; R375-L404 HydrophobicContact CG-CD2 3.91Å; R375-L407 HydrophobicContact CB-CD1 4.12Å; R375-L407 HydrophobicContact CG-CD1 3.84Å
376	A	92.7	Very high	93.1	Very high	3 Å²	3	64.3 Å²	64.3	3%	0.025	31%	0.309	C	S	.	.	H	α-helix	trans	-59.6	-42.5	176.6	0	0	0	0	0	111.2	I372 E373 A378 E379 R380 V381 L383 L407	I372-A376 VanDerWaalsContact O-CB 3.31Å; I372-A376 WeakPolarHBondContact O-CB 3.46Å; I372-A376 PolarHBondContact O-N 2.87Å; E373-A376 PolarHBondContact O-N 2.86Å; A376-A378 PolarHBondContact O-N 2.94Å; A376-E379 CarbonylContact O-C 3.56Å; A376-E379 PolarHBondContact O-N 3.27Å; A376-R380 PolarHBondContact O-N 3.11Å; A376-V381 HydrophobicContact CB-CB 4.28Å; A376-V381 PolarHBondContact O-N 3.5Å; A376-L383 HydrophobicContact CB-CD1 3.51Å; A376-L383 HydrophobicContact CB-CG 3.98Å; A376-L407 HydrophobicContact CB-CD2 4.22Å
377	Q	90.5	Very high	93.2	Very high	130 Å²	130	59.8 Å²	59.8	61%	0.607	28%	0.279	S	S	*	.	H	α-helix	trans	-61.5	-43.5	174	-70.5	175.2	2.6	0	0	112.4	E373 I374 R375 E379 R380	E373-Q377 WeakPolarHBondContact O-CG 3.42Å; E373-Q377 PolarHBondContact O-N 2.91Å; I374-Q377 PolarHBondContact O-N 3.5Å; R375-Q377 VanDerWaalsContact C-N 3.31Å; R375-Q377 PolarHBondContact O-N 3.47Å; Q377-E379 PolarHBondContact O-N 3.06Å; Q377-R380 PolarHBondContact O-N 3.27Å
378	A	86.7	Confident	93.3	Very high	43 Å²	43	58 Å²	58	36%	0.355	27%	0.271	S	S	.	.	H	α-helix	trans	-64.3	-39.1	177.8	0	0	0	0	0	112.5	I14 I374 R375 A376 R380	I14-A378 VanDerWaalsContact CD1-O 3.28Å; I14-A378 WeakPolarHBondContact CD1-O 3.38Å; I374-A378 PolarHBondContact O-N 3.1Å; I374-A378 VanDerWaalsContact O-N 3.09Å; R375-A378 PolarHBondContact O-N 3.44Å; R375-A378 VanDerWaalsContact O-N 3.16Å; A376-A378 PolarHBondContact O-N 2.94Å; A378-R380 VanDerWaalsContact C-N 3.26Å; A378-R380 PolarHBondContact O-N 2.89Å
379	E	86.8	Confident	93.5	Very high	47 Å²	47	60.5 Å²	60.5	22%	0.22	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	1.8	176.7	-66.9	-175.6	-170.7	0	0	113.3	I14 R375 A376 Q377 V381 T408	I14-E379 HydrophobicContact CD1-CG 4.48Å; R375-E379 IonicContact CZ-OE1 3.99Å; R375-E379 IonicContact NE-OE1 3.12Å; R375-E379 PolarHBondContact NE-OE1 3.32Å; R375-E379 IonicContact NH2-OE1 3.13Å; R375-E379 PolarHBondContact NH2-OE1 3.01Å; R375-E379 PolarHBondContact O-N 2.87Å; A376-E379 CarbonylContact O-C 3.56Å; A376-E379 PolarHBondContact O-N 3.27Å; Q377-E379 PolarHBondContact O-N 3.06Å; E379-V381 HydrophobicContact CB-CG2 3.9Å; E379-V381 PolarHBondContact O-N 3.22Å; E379-T408 PolarHBondContact OE2-OG1 2.86Å
380	R	89.7	Confident	93.5	Very high	230 Å²	230	59.1 Å²	59.1	87%	0.868	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	35.4	-177	-54.3	179.2	-178.6	175.5	-0.5	113.2	A376 Q377 A378	A376-R380 PolarHBondContact O-N 3.11Å; Q377-R380 PolarHBondContact O-N 3.27Å; A378-R380 VanDerWaalsContact C-N 3.26Å; A378-R380 PolarHBondContact O-N 2.89Å
381	V	93	Very high	93.6	Very high	9 Å²	9	55.8 Å²	55.8	6%	0.055	27%	0.269	C	S	.	.			trans	-92	118.4	174.5	-175.8	0	0	0	0	108.7	A376 E379 L383 R411 V422	A376-V381 HydrophobicContact CB-CB 4.28Å; A376-V381 PolarHBondContact O-N 3.5Å; E379-V381 HydrophobicContact CB-CG2 3.9Å; E379-V381 PolarHBondContact O-N 3.22Å; V381-L383 HydrophobicContact CG1-CD2 3.74Å; V381-L383 HydrophobicContact CG1-CG 4.21Å; V381-R411 HydrophobicContact CG1-CB 4.12Å; V381-R411 HydrophobicContact CG2-CB 4.45Å; V381-V422 HydrophobicContact CG1-CG2 3.9Å
382	S	95.2	Very high	93.8	Very high	62 Å²	62	54.5 Å²	54.5	43%	0.434	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	120.1	172.3	-174.7	0	0	0	0	109.3	V422	S382-V422 PolarHBondContact O-N 3.28Å
383	L	96	Very high	93.9	Very high	29 Å²	29	59.5 Å²	59.5	15%	0.152	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.7	-178.2	-62.7	176.8	0	0	0	110.3	I372 A376 V381 L388 L391 L407 V422	I372-L383 HydrophobicContact CG2-CD1 4.27Å; A376-L383 HydrophobicContact CB-CD1 3.51Å; A376-L383 HydrophobicContact CB-CG 3.98Å; V381-L383 HydrophobicContact CG1-CD2 3.74Å; V381-L383 HydrophobicContact CG1-CG 4.21Å; L383-L388 HydrophobicContact CD1-CB 4.46Å; L383-L388 HydrophobicContact CD1-CD1 3.94Å; L383-L391 HydrophobicContact CD1-CD1 3.97Å; L383-L391 HydrophobicContact CD2-CD1 4.09Å; L383-L407 HydrophobicContact CD1-CD2 3.81Å; L383-L407 HydrophobicContact CD2-CD2 4.09Å; L383-L407 HydrophobicContact CG-CD2 4.45Å; L383-V422 HydrophobicContact CD2-CB 3.7Å; L383-V422 HydrophobicContact CD2-CG1 4.03Å; L383-V422 HydrophobicContact CD2-CG2 4.01Å
384	H	96.8	Very high	93.9	Very high	55 Å²	55	56.8 Å²	56.8	26%	0.255	27%	0.273	S	S	.	.			trans	-63.2	149.6	165.6	-171.2	-106	0	0	0	110.3	E386 A387 L388 E421 V422 M423	H384-E386 IonicContact CE1-OE2 3.19Å; H384-E386 PolarHBondContact ND1-N 3.36Å; H384-E386 IonicContact ND1-OE2 2.8Å; H384-E386 PolarHBondContact O-N 3.18Å; H384-A387 HydrophobicContact CB-CB 4.23Å; H384-A387 WeakPolarHBondContact O-CB 3.35Å; H384-A387 PolarHBondContact O-N 3.32Å; H384-L388 PolarHBondContact O-N 3.15Å; H384-E421 VanDerWaalsContact CA-OE1 3.3Å; H384-E421 WeakPolarHBondContact CA-OE1 3.48Å; H384-E421 HydrophobicContact CB-CG 4.17Å; H384-E421 IonicContact CD2-OE1 3.01Å; H384-E421 PolarHBondContact N-OE1 3.01Å; H384-V422 VanDerWaalsContact CB-O 3.27Å; H384-V422 WeakPolarHBondContact CB-O 3.25Å; H384-V422 PolarHBondContact N-O 2.77Å; H384-M423 HydrophobicContact CB-CE 4.27Å; H384-M423 HydrophobicContact CB-SD 3.74Å
385	K	96.1	Very high	94.1	Very high	159 Å²	159	54.5 Å²	54.5	69%	0.691	26%	0.262	S	S	*	.	H	α-helix	trans	-55.6	-39.4	-176.8	-72.1	-178.5	-179.2	175.2	0	112.9	R369 D389	R369-K385 PolarHBondContact NH1-O 3.14Å; K385-D389 PolarHBondContact O-N 3.13Å; K385-D389 VanDerWaalsContact O-OD2 3.12Å
386	E	96.4	Very high	94.2	Very high	116 Å²	116	59.7 Å²	59.7	54%	0.542	28%	0.282	S	S	.	.	H	α-helix	trans	-73.3	-38.1	178.4	-64.2	176.6	175.8	0	0	111.9	H384 L388 D389 T390 P424	H384-E386 IonicContact CE1-OE2 3.19Å; H384-E386 PolarHBondContact ND1-N 3.36Å; H384-E386 IonicContact ND1-OE2 2.8Å; H384-E386 PolarHBondContact O-N 3.18Å; E386-L388 PolarHBondContact O-N 3.33Å; E386-D389 WeakPolarHBondContact O-CB 3.44Å; E386-D389 PolarHBondContact O-N 3.41Å; E386-T390 PolarHBondContact O-N 2.96Å; E386-T390 PolarHBondContact O-OG1 3.18Å; E386-P424 HydrophobicContact CB-CG 4.21Å
387	A	97	Very high	94.2	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.7	-38.5	174.7	0	0	0	0	0	111.1	H384 T390 L391 V422 V427	H384-A387 HydrophobicContact CB-CB 4.23Å; H384-A387 WeakPolarHBondContact O-CB 3.35Å; H384-A387 PolarHBondContact O-N 3.32Å; A387-T390 PolarHBondContact O-N 2.95Å; A387-L391 WeakPolarHBondContact O-CG 3.46Å; A387-L391 PolarHBondContact O-N 2.78Å; A387-V422 HydrophobicContact CB-CG1 4.45Å; A387-V422 VanDerWaalsContact CB-O 3.32Å; A387-V422 WeakPolarHBondContact CB-O 3.26Å; A387-V427 HydrophobicContact CB-CG2 4.11Å
388	L	97.2	Very high	94.2	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.068	29%	0.29	C	S	.	.	H	α-helix	trans	-65	-37.8	174	-179.1	62.7	0	0	0	112.5	R369 I372 E373 L383 H384 E386 A392	R369-L388 HydrophobicContact CG-CD1 4.41Å; R369-L388 HydrophobicContact CG-CD2 3.98Å; R369-L388 HydrophobicContact CG-CG 3.82Å; I372-L388 HydrophobicContact CB-CD1 3.86Å; I372-L388 HydrophobicContact CG2-CD1 3.53Å; E373-L388 HydrophobicContact CB-CD1 4.34Å; E373-L388 HydrophobicContact CB-CD2 4.06Å; E373-L388 HydrophobicContact CG-CD2 4.3Å; L383-L388 HydrophobicContact CD1-CB 4.46Å; L383-L388 HydrophobicContact CD1-CD1 3.94Å; H384-L388 PolarHBondContact O-N 3.15Å; E386-L388 PolarHBondContact O-N 3.33Å; L388-A392 WeakPolarHBondContact O-CB 3.47Å; L388-A392 PolarHBondContact O-N 3.18Å
389	D	97	Very high	94.5	Very high	62 Å²	62	60.6 Å²	60.6	33%	0.332	29%	0.287	S	S	.	.	H	α-helix	trans	-66.6	-44.4	173.9	-75.9	-45.9	0	0	0	111.1	R369 K385 E386 L391 A392 H393	R369-D389 WeakPolarHBondContact CD-OD1 3.38Å; R369-D389 IonicContact CZ-OD1 3.15Å; R369-D389 VanDerWaalsContact CZ-OD1 3.23Å; R369-D389 IonicContact CZ-OD2 2.7Å; R369-D389 IonicContact NE-OD1 2.66Å; R369-D389 VanDerWaalsContact NH1-N 3.14Å; R369-D389 IonicContact NH1-OD1 3.21Å; R369-D389 PolarHBondContact NH1-OD1 3.42Å; R369-D389 IonicContact NH1-OD2 2.95Å; R369-D389 PolarHBondContact NH1-OD2 2.78Å; R369-D389 IonicContact NH2-OD2 3.34Å; K385-D389 PolarHBondContact O-N 3.13Å; K385-D389 VanDerWaalsContact O-OD2 3.12Å; E386-D389 WeakPolarHBondContact O-CB 3.44Å; E386-D389 PolarHBondContact O-N 3.41Å; D389-L391 PolarHBondContact O-N 2.87Å; D389-A392 PolarHBondContact O-N 3.46Å; D389-H393 PolarHBondContact O-CD2 2.84Å; D389-H393 PolarHBondContact O-N 3.15Å
390	T	96.4	Very high	94.7	Very high	36 Å²	36	59.1 Å²	59.1	22%	0.221	28%	0.28	C	S	.	.	H	α-helix	trans	-57.1	-47.6	175.2	-53.1	0	0	0	0	111.2	E386 A387 A392 H393 I394 V427 V428	E386-T390 PolarHBondContact O-N 2.96Å; E386-T390 PolarHBondContact O-OG1 3.18Å; A387-T390 PolarHBondContact O-N 2.95Å; T390-A392 VanDerWaalsContact C-N 3.34Å; T390-A392 PolarHBondContact O-N 3.45Å; T390-H393 PolarHBondContact O-N 2.8Å; T390-I394 HydrophobicContact CG2-CD1 3.96Å; T390-I394 VanDerWaalsContact O-CG1 3.29Å; T390-I394 WeakPolarHBondContact O-CG1 3.33Å; T390-I394 PolarHBondContact O-N 3.17Å; T390-V427 HydrophobicContact CG2-CB 4.33Å; T390-V427 HydrophobicContact CG2-CG1 3.85Å; T390-V428 HydrophobicContact CG2-CG2 4.22Å
391	L	97.2	Very high	94.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-39.5	176.8	-74.1	166.9	0	0	0	112.5	I372 L383 A387 D389 I394 G395 A403 L406 L407 V427	I372-L391 HydrophobicContact CD1-CB 4.07Å; I372-L391 HydrophobicContact CG2-CB 4.16Å; I372-L391 HydrophobicContact CG2-CD1 4.01Å; L383-L391 HydrophobicContact CD1-CD1 3.97Å; L383-L391 HydrophobicContact CD2-CD1 4.09Å; A387-L391 WeakPolarHBondContact O-CG 3.46Å; A387-L391 PolarHBondContact O-N 2.78Å; D389-L391 PolarHBondContact O-N 2.87Å; L391-I394 PolarHBondContact O-N 3.06Å; L391-G395 PolarHBondContact O-N 3.43Å; L391-A403 WeakPolarHBondContact O-CB 3.39Å; L391-L406 HydrophobicContact CD2-CB 3.92Å; L391-L406 HydrophobicContact CD2-CD1 4.31Å; L391-L407 HydrophobicContact CD1-CD2 3.7Å; L391-V427 HydrophobicContact CD1-CG2 4.28Å; L391-V427 HydrophobicContact CD2-CG1 3.57Å; L391-V427 HydrophobicContact CD2-CG2 4.23Å; L391-V427 HydrophobicContact CG-CG1 3.82Å; L391-V427 HydrophobicContact CG-CG2 4Å
392	A	96.6	Very high	94.8	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65	-42.1	177.3	0	0	0	0	0	111.9	V365 R369 I372 L388 D389 T390 G395 Y396	V365-A392 HydrophobicContact CG1-CB 4.16Å; R369-A392 HydrophobicContact CB-CB 3.81Å; R369-A392 HydrophobicContact CG-CB 4.4Å; I372-A392 HydrophobicContact CD1-CB 4.3Å; L388-A392 WeakPolarHBondContact O-CB 3.47Å; L388-A392 PolarHBondContact O-N 3.18Å; D389-A392 PolarHBondContact O-N 3.46Å; T390-A392 VanDerWaalsContact C-N 3.34Å; T390-A392 PolarHBondContact O-N 3.45Å; A392-G395 PolarHBondContact O-N 3.44Å; A392-Y396 PolarHBondContact O-N 2.95Å
393	H	95.8	Very high	94.8	Very high	105 Å²	105	52.8 Å²	52.8	49%	0.486	25%	0.246	S	C	.	.	H	α-helix	trans	-65.6	-43.1	175.2	-76.6	-65	0	0	0	112.4	D389 T390 G395 Y396 Q397	D389-H393 PolarHBondContact O-CD2 2.84Å; D389-H393 PolarHBondContact O-N 3.15Å; T390-H393 PolarHBondContact O-N 2.8Å; H393-G395 VanDerWaalsContact C-N 3.3Å; H393-G395 PolarHBondContact O-N 3.12Å; H393-Y396 PolarHBondContact O-N 3.15Å; H393-Q397 WeakPolarHBondContact O-CG 3.41Å; H393-Q397 PolarHBondContact O-N 3.25Å
394	I	94.7	Very high	94.6	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-43.5	173.2	-69.9	169.1	0	0	0	110.5	T390 L391 Y396 Q397 A398 Y402 L406 V427 Q431	T390-I394 HydrophobicContact CG2-CD1 3.96Å; T390-I394 VanDerWaalsContact O-CG1 3.29Å; T390-I394 WeakPolarHBondContact O-CG1 3.33Å; T390-I394 PolarHBondContact O-N 3.17Å; L391-I394 PolarHBondContact O-N 3.06Å; I394-Y396 VanDerWaalsContact C-N 3.28Å; I394-Y396 PolarHBondContact O-N 2.83Å; I394-Q397 PolarHBondContact O-N 2.78Å; I394-A398 WeakPolarHBondContact O-CB 3.19Å; I394-A398 PolarHBondContact O-N 2.78Å; I394-Y402 HydrophobicContact CG2-CD1 3.65Å; I394-Y402 HydrophobicContact CG2-CE1 3.52Å; I394-L406 HydrophobicContact CD1-CD1 4.19Å; I394-L406 HydrophobicContact CG2-CD1 3.9Å; I394-V427 HydrophobicContact CD1-CG1 3.61Å; I394-Q431 HydrophobicContact CD1-CB 4.37Å; I394-Q431 HydrophobicContact CD1-CG 4.37Å
395	G	93.8	Very high	94.5	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-60.5	-37.1	177.9	0	0	0	0	0	113.2	L391 A392 H393 S399 L400	L391-G395 PolarHBondContact O-N 3.43Å; A392-G395 PolarHBondContact O-N 3.44Å; H393-G395 VanDerWaalsContact C-N 3.3Å; H393-G395 PolarHBondContact O-N 3.12Å; G395-S399 WeakPolarHBondContact CA-O 3.27Å; G395-S399 CarbonylContact O-C 3.59Å; G395-S399 WeakPolarHBondContact O-CA 3.38Å; G395-S399 PolarHBondContact O-N 2.94Å; G395-L400 PolarHBondContact O-N 2.96Å
396	Y	93.3	Very high	94.4	Very high	149 Å²	149	49.2 Å²	49.2	58%	0.584	23%	0.232	S	C	*	.	H	α-helix	trans	-72	-40	177.7	-178.1	-100.5	0	0	0	112.5	V365 M368 A392 H393 I394	V365-Y396 HydrophobicContact CG2-CD1 4.33Å; V365-Y396 HydrophobicContact CG2-CD2 3.8Å; V365-Y396 HydrophobicContact CG2-CE2 4.39Å; V365-Y396 HydrophobicContact CG2-CG 3.76Å; M368-Y396 PolarHBondContact SD-N 3.46Å; A392-Y396 PolarHBondContact O-N 2.95Å; H393-Y396 PolarHBondContact O-N 3.15Å; I394-Y396 VanDerWaalsContact C-N 3.28Å; I394-Y396 PolarHBondContact O-N 2.83Å
397	Q	91.9	Very high	94.4	Very high	133 Å²	133	43.7 Å²	43.7	62%	0.621	21%	0.206	S	C	*	.	H	α-helix	trans	-74.2	-44.7	179.4	-70.1	177.8	-24	0	0	112.7	H393 I394 K438	H393-Q397 WeakPolarHBondContact O-CG 3.41Å; H393-Q397 PolarHBondContact O-N 3.25Å; I394-Q397 PolarHBondContact O-N 2.78Å; Q397-K438 PolarHBondContact O-NZ 3.16Å
398	A	91.4	Very high	94.2	Very high	20 Å²	20	46.4 Å²	46.4	17%	0.165	22%	0.223	C	C	.	.	S	Bend	trans	-97.4	-85	-177.6	0	0	0	0	0	111.5	I394 Y402 D436	I394-A398 WeakPolarHBondContact O-CB 3.19Å; I394-A398 PolarHBondContact O-N 2.78Å; A398-Y402 HydrophobicContact CB-CD1 3.63Å; A398-Y402 HydrophobicContact CB-CE1 4.21Å; A398-Y402 HydrophobicContact CB-CG 4.32Å; A398-D436 HydrophobicContact CB-CB 3.85Å
399	S	91.3	Very high	94.1	Very high	42 Å²	42	47.2 Å²	47.2	29%	0.294	23%	0.229	S	C	.	.			trans	-166.1	155.2	171.5	68.8	0	0	0	0	111	G395 R401 Y402 A403	G395-S399 WeakPolarHBondContact CA-O 3.27Å; G395-S399 CarbonylContact O-C 3.59Å; G395-S399 WeakPolarHBondContact O-CA 3.38Å; G395-S399 PolarHBondContact O-N 2.94Å; S399-R401 VanDerWaalsContact C-N 3.25Å; S399-R401 PolarHBondContact O-N 2.84Å; S399-Y402 PolarHBondContact O-N 2.89Å; S399-Y402 VanDerWaalsContact O-N 3.16Å; S399-Y402 WeakPolarHBondContact OG-CB 3.48Å; S399-Y402 PolarHBondContact OG-N 3.4Å; S399-Y402 VanDerWaalsContact OG-N 3.11Å; S399-A403 PolarHBondContact O-N 3.32Å
400	L	91.9	Very high	94.1	Very high	15 Å²	15	44.3 Å²	44.3	8%	0.079	21%	0.213	C	C	.	.	H	α-helix	trans	-57.2	-39.6	172.5	178.8	62.5	0	0	0	111.9	A72 Y363 M368 I371 I372 G395 Y402 A403 L404	A72-L400 HydrophobicContact CB-CB 4.38Å; Y363-L400 HydrophobicContact CD2-CD2 3.66Å; Y363-L400 HydrophobicContact CE2-CD2 3.67Å; M368-L400 HydrophobicContact CG-CD1 4.44Å; I371-L400 HydrophobicContact CB-CD1 4.44Å; I371-L400 HydrophobicContact CD1-CD2 3.92Å; I371-L400 HydrophobicContact CG2-CD1 4.15Å; I371-L400 HydrophobicContact CG2-CD2 4.07Å; I372-L400 HydrophobicContact CG1-CD1 4.12Å; G395-L400 PolarHBondContact O-N 2.96Å; L400-Y402 VanDerWaalsContact C-N 3.31Å; L400-Y402 PolarHBondContact O-N 3.41Å; L400-A403 PolarHBondContact O-N 3.04Å; L400-L404 HydrophobicContact CD1-CD1 4.44Å; L400-L404 HydrophobicContact CD1-CD2 4.41Å; L400-L404 HydrophobicContact CD1-CG 4.16Å; L400-L404 HydrophobicContact CG-CD1 4.27Å; L400-L404 HydrophobicContact CG-CG 4.38Å; L400-L404 VanDerWaalsContact O-CG 3.31Å; L400-L404 WeakPolarHBondContact O-CG 3.49Å; L400-L404 PolarHBondContact O-N 3.43Å
401	R	90.8	Very high	94.1	Very high	154 Å²	154	46.2 Å²	46.2	58%	0.581	22%	0.217	S	C	*	.	H	α-helix	trans	-58.2	-45.4	177.6	179.7	-179.7	-68.8	176.9	-3.5	111.4	A72 S399 L404 Q405	A72-R401 HydrophobicContact CB-CB 4Å; S399-R401 VanDerWaalsContact C-N 3.25Å; S399-R401 PolarHBondContact O-N 2.84Å; R401-L404 PolarHBondContact O-N 2.86Å; R401-Q405 WeakPolarHBondContact O-CG 3.42Å; R401-Q405 PolarHBondContact O-N 3.15Å; R401-Q405 VanDerWaalsContact O-N 3.09Å
402	Y	94	Very high	94	Very high	15 Å²	15	50.6 Å²	50.6	6%	0.059	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-48	178.3	176	-108.6	0	0	0	111.2	I394 A398 S399 L400 L404 Q405 L406 F434 D436	I394-Y402 HydrophobicContact CG2-CD1 3.65Å; I394-Y402 HydrophobicContact CG2-CE1 3.52Å; A398-Y402 HydrophobicContact CB-CD1 3.63Å; A398-Y402 HydrophobicContact CB-CE1 4.21Å; A398-Y402 HydrophobicContact CB-CG 4.32Å; S399-Y402 PolarHBondContact O-N 2.89Å; S399-Y402 VanDerWaalsContact O-N 3.16Å; S399-Y402 WeakPolarHBondContact OG-CB 3.48Å; S399-Y402 PolarHBondContact OG-N 3.4Å; S399-Y402 VanDerWaalsContact OG-N 3.11Å; L400-Y402 VanDerWaalsContact C-N 3.31Å; L400-Y402 PolarHBondContact O-N 3.41Å; Y402-L404 VanDerWaalsContact C-N 3.3Å; Y402-L404 PolarHBondContact O-N 3.3Å; Y402-Q405 WeakPolarHBondContact O-CB 3.47Å; Y402-Q405 PolarHBondContact O-N 2.86Å; Y402-L406 HydrophobicContact CD1-CD1 4.29Å; Y402-L406 HydrophobicContact CE1-CD1 3.79Å; Y402-L406 HydrophobicContact CE1-CG 4.38Å; Y402-L406 HydrophobicContact CE2-CD2 4.08Å; Y402-L406 WeakPolarHBondContact O-CG 3.18Å; Y402-L406 PolarHBondContact O-N 3.25Å; Y402-F434 VanDerWaalsContact CE2-O 3.28Å; Y402-F434 WeakPolarHBondContact CE2-O 3.17Å; Y402-F434 VanDerWaalsContact CZ-O 3.28Å; Y402-F434 PolarHBondContact OH-O 3.28Å; Y402-D436 HydrophobicContact CD1-CB 3.89Å; Y402-D436 HydrophobicContact CD2-CB 3.85Å; Y402-D436 HydrophobicContact CE1-CB 3.81Å; Y402-D436 HydrophobicContact CE2-CB 3.79Å; Y402-D436 HydrophobicContact CG-CB 3.9Å
403	A	94.8	Very high	94	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.5	-40.4	176.8	0	0	0	0	0	113.1	I372 L391 S399 L400 Q405 L406	I372-A403 HydrophobicContact CD1-CB 4.15Å; L391-A403 WeakPolarHBondContact O-CB 3.39Å; S399-A403 PolarHBondContact O-N 3.32Å; L400-A403 PolarHBondContact O-N 3.04Å; A403-Q405 VanDerWaalsContact C-N 3.35Å; A403-L406 PolarHBondContact O-N 3.21Å
404	L	93	Very high	94	Very high	42 Å²	42	48.2 Å²	48.2	22%	0.22	23%	0.23	C	C	.	.	H	α-helix	trans	-66.7	-34.7	175.5	-65.7	-177.9	0	0	0	112.7	I372 R375 L400 R401 Y402 L406 L407	I372-L404 HydrophobicContact CB-CD2 4.4Å; I372-L404 HydrophobicContact CG1-CD2 3.88Å; R375-L404 HydrophobicContact CB-CD2 3.79Å; R375-L404 HydrophobicContact CG-CD2 3.91Å; L400-L404 HydrophobicContact CD1-CD1 4.44Å; L400-L404 HydrophobicContact CD1-CD2 4.41Å; L400-L404 HydrophobicContact CD1-CG 4.16Å; L400-L404 HydrophobicContact CG-CD1 4.27Å; L400-L404 HydrophobicContact CG-CG 4.38Å; L400-L404 VanDerWaalsContact O-CG 3.31Å; L400-L404 WeakPolarHBondContact O-CG 3.49Å; L400-L404 PolarHBondContact O-N 3.43Å; R401-L404 PolarHBondContact O-N 2.86Å; Y402-L404 VanDerWaalsContact C-N 3.3Å; Y402-L404 PolarHBondContact O-N 3.3Å; L404-L406 VanDerWaalsContact C-N 3.25Å; L404-L406 PolarHBondContact O-N 3.36Å; L404-L407 HydrophobicContact CD2-CD1 4.04Å; L404-L407 WeakPolarHBondContact O-CB 3.43Å; L404-L407 WeakPolarHBondContact O-CG 3.39Å; L404-L407 PolarHBondContact O-N 3.21Å
405	Q	93	Very high	94.1	Very high	123 Å²	123	52.7 Å²	52.7	58%	0.575	25%	0.25	S	S	*	.	H	α-helix	trans	-67.6	-25.4	176.5	-75.5	173.1	-28.3	0	0	112.8	R401 Y402 A403 L407 P409	R401-Q405 WeakPolarHBondContact O-CG 3.42Å; R401-Q405 PolarHBondContact O-N 3.15Å; R401-Q405 VanDerWaalsContact O-N 3.09Å; Y402-Q405 WeakPolarHBondContact O-CB 3.47Å; Y402-Q405 PolarHBondContact O-N 2.86Å; A403-Q405 VanDerWaalsContact C-N 3.35Å; Q405-L407 VanDerWaalsContact C-N 3.3Å; Q405-L407 PolarHBondContact O-N 3.24Å; Q405-P409 WeakPolarHBondContact O-CD 3.32Å
406	L	96	Very high	94.1	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-72.8	-20.3	176.8	-60.2	178.2	0	0	0	113	L391 I394 Y402 A403 L404 T408 P409 S410 T430 F434	L391-L406 HydrophobicContact CD2-CB 3.92Å; L391-L406 HydrophobicContact CD2-CD1 4.31Å; I394-L406 HydrophobicContact CD1-CD1 4.19Å; I394-L406 HydrophobicContact CG2-CD1 3.9Å; Y402-L406 HydrophobicContact CD1-CD1 4.29Å; Y402-L406 HydrophobicContact CE1-CD1 3.79Å; Y402-L406 HydrophobicContact CE1-CG 4.38Å; Y402-L406 HydrophobicContact CE2-CD2 4.08Å; Y402-L406 WeakPolarHBondContact O-CG 3.18Å; Y402-L406 PolarHBondContact O-N 3.25Å; A403-L406 PolarHBondContact O-N 3.21Å; L404-L406 VanDerWaalsContact C-N 3.25Å; L404-L406 PolarHBondContact O-N 3.36Å; L406-T408 PolarHBondContact O-N 2.75Å; L406-P409 WeakPolarHBondContact O-CD 3.35Å; L406-S410 VanDerWaalsContact O-CB 3.28Å; L406-S410 WeakPolarHBondContact O-CB 3.28Å; L406-S410 PolarHBondContact O-N 2.86Å; L406-S410 PolarHBondContact O-OG 3.44Å; L406-T430 HydrophobicContact CB-CG2 4.32Å; L406-T430 HydrophobicContact CD2-CG2 3.58Å; L406-F434 HydrophobicContact CD2-CB 4.49Å
407	L	95.1	Very high	94.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-55.2	-51.6	-177.1	-72	173.3	0	0	0	113.3	I372 R375 A376 L383 L391 L404 Q405 R411	I372-L407 HydrophobicContact CG2-CD2 4.03Å; R375-L407 HydrophobicContact CB-CD1 4.12Å; R375-L407 HydrophobicContact CG-CD1 3.84Å; A376-L407 HydrophobicContact CB-CD2 4.22Å; L383-L407 HydrophobicContact CD1-CD2 3.81Å; L383-L407 HydrophobicContact CD2-CD2 4.09Å; L383-L407 HydrophobicContact CG-CD2 4.45Å; L391-L407 HydrophobicContact CD1-CD2 3.7Å; L404-L407 HydrophobicContact CD2-CD1 4.04Å; L404-L407 WeakPolarHBondContact O-CB 3.43Å; L404-L407 WeakPolarHBondContact O-CG 3.39Å; L404-L407 PolarHBondContact O-N 3.21Å; Q405-L407 VanDerWaalsContact C-N 3.3Å; Q405-L407 PolarHBondContact O-N 3.24Å; L407-R411 PolarHBondContact O-N 3.11Å
408	T	93.2	Very high	94.3	Very high	56 Å²	56	49.7 Å²	49.7	34%	0.344	29%	0.286	S	S	.	.	H	α-helix	trans	-69.2	-48.7	-176.4	-70.3	0	0	0	0	112.2	E379 L406 S410 R411 I412	E379-T408 PolarHBondContact OE2-OG1 2.86Å; L406-T408 PolarHBondContact O-N 2.75Å; T408-S410 PolarHBondContact O-N 3.29Å; T408-R411 WeakPolarHBondContact O-CB 3.34Å; T408-R411 PolarHBondContact O-N 3.22Å; T408-I412 HydrophobicContact CG2-CD1 4.17Å; T408-I412 WeakPolarHBondContact O-CG1 3.28Å; T408-I412 PolarHBondContact O-N 3.42Å; T408-I412 VanDerWaalsContact O-N 3.08Å
409	P	95.7	Very high	94.4	Very high	31 Å²	31	52.1 Å²	52.1	20%	0.201	29%	0.291	C	S	.	.	H	α-helix	trans	-59.1	-41.2	173.5	-26.8	36.6	0	0	0	113.5	Q405 L406 R411 I412 L413 T430 F434	Q405-P409 WeakPolarHBondContact O-CD 3.32Å; L406-P409 WeakPolarHBondContact O-CD 3.35Å; P409-R411 VanDerWaalsContact C-N 3.31Å; P409-R411 PolarHBondContact O-N 3.08Å; P409-I412 PolarHBondContact O-N 2.53Å; P409-I412 VanDerWaalsContact O-N 3.12Å; P409-L413 PolarHBondContact O-N 3.17Å; P409-T430 HydrophobicContact CB-CG2 3.53Å; P409-T430 HydrophobicContact CG-CG2 4.37Å; P409-F434 HydrophobicContact CB-CD2 4.46Å; P409-F434 HydrophobicContact CB-CE2 3.95Å; P409-F434 HydrophobicContact CG-CE2 4.34Å
410	S	96.9	Very high	94.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.9	-34.4	177.2	-58.7	0	0	0	0	112.5	L406 T408 L413 A414 T430	L406-S410 VanDerWaalsContact O-CB 3.28Å; L406-S410 WeakPolarHBondContact O-CB 3.28Å; L406-S410 PolarHBondContact O-N 2.86Å; L406-S410 PolarHBondContact O-OG 3.44Å; T408-S410 PolarHBondContact O-N 3.29Å; S410-L413 PolarHBondContact O-N 3.02Å; S410-A414 WeakPolarHBondContact O-CB 3.38Å; S410-A414 PolarHBondContact O-N 2.86Å; S410-T430 WeakPolarHBondContact CA-OG1 3.35Å; S410-T430 WeakPolarHBondContact OG-CB 3.39Å; S410-T430 PolarHBondContact OG-OG1 3.18Å
411	R	96.1	Very high	94.7	Very high	77 Å²	77	58.8 Å²	58.8	29%	0.291	33%	0.327	S	S	.	.	H	α-helix	trans	-61.2	-46.2	169.6	-177.4	-177.1	60.3	92.4	3.8	111.8	V381 L407 T408 P409 L413 A414 E415 V422	V381-R411 HydrophobicContact CG1-CB 4.12Å; V381-R411 HydrophobicContact CG2-CB 4.45Å; L407-R411 PolarHBondContact O-N 3.11Å; T408-R411 WeakPolarHBondContact O-CB 3.34Å; T408-R411 PolarHBondContact O-N 3.22Å; P409-R411 VanDerWaalsContact C-N 3.31Å; P409-R411 PolarHBondContact O-N 3.08Å; R411-L413 VanDerWaalsContact C-N 3.31Å; R411-L413 PolarHBondContact O-N 3.06Å; R411-A414 PolarHBondContact O-N 3.17Å; R411-E415 WeakPolarHBondContact CD-OE1 3.45Å; R411-E415 HydrophobicContact CG-CG 4.38Å; R411-E415 WeakPolarHBondContact CG-OE1 3.49Å; R411-E415 IonicContact CZ-OE1 3.65Å; R411-E415 IonicContact NE-OE1 2.79Å; R411-E415 VanDerWaalsContact NH1-CD 3.31Å; R411-E415 IonicContact NH1-OE1 2.67Å; R411-E415 PolarHBondContact NH1-OE1 3.13Å; R411-E415 IonicContact NH1-OE2 3.34Å; R411-E415 PolarHBondContact NH1-OE2 2.98Å; R411-E415 WeakPolarHBondContact O-CB 3.37Å; R411-E415 WeakPolarHBondContact O-CG 3.4Å; R411-E415 PolarHBondContact O-N 3.23Å; R411-V422 HydrophobicContact CB-CG2 4.3Å
412	I	95.5	Very high	95	Very high	91 Å²	91	51.6 Å²	51.6	47%	0.467	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-40.3	-179.6	-66.7	168	0	0	0	110.8	T408 P409 E415 A416	T408-I412 HydrophobicContact CG2-CD1 4.17Å; T408-I412 WeakPolarHBondContact O-CG1 3.28Å; T408-I412 PolarHBondContact O-N 3.42Å; T408-I412 VanDerWaalsContact O-N 3.08Å; P409-I412 PolarHBondContact O-N 2.53Å; P409-I412 VanDerWaalsContact O-N 3.12Å; I412-E415 PolarHBondContact O-N 2.95Å; I412-A416 WeakPolarHBondContact O-CB 3.47Å; I412-A416 PolarHBondContact O-N 3.38Å
413	L	95.7	Very high	95.2	Very high	54 Å²	54	53.2 Å²	53.2	28%	0.283	31%	0.308	S	S	.	.	H	α-helix	trans	-65.4	-42.6	175.2	-67.9	-175.4	0	0	0	112.3	P409 S410 R411 E415 A416 A417 D426 T430 L433	P409-L413 PolarHBondContact O-N 3.17Å; S410-L413 PolarHBondContact O-N 3.02Å; R411-L413 VanDerWaalsContact C-N 3.31Å; R411-L413 PolarHBondContact O-N 3.06Å; L413-E415 PolarHBondContact O-N 3.29Å; L413-A416 PolarHBondContact O-N 3.24Å; L413-A417 PolarHBondContact O-N 3.3Å; L413-D426 HydrophobicContact CB-CB 4.35Å; L413-T430 WeakPolarHBondContact CD1-OG1 3.41Å; L413-L433 HydrophobicContact CD1-CD1 4.5Å
414	A	96.1	Very high	95.3	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-45	175.3	0	0	0	0	0	111.6	S410 R411 A416 A417 G418 R419 V422	S410-A414 WeakPolarHBondContact O-CB 3.38Å; S410-A414 PolarHBondContact O-N 2.86Å; R411-A414 PolarHBondContact O-N 3.17Å; A414-A416 PolarHBondContact O-N 2.81Å; A414-A417 CarbonylContact O-C 3.57Å; A414-A417 PolarHBondContact O-N 3.49Å; A414-A417 VanDerWaalsContact O-N 3.15Å; A414-G418 PolarHBondContact O-N 2.96Å; A414-R419 CarbonylContact C-O 3.49Å; A414-R419 VanDerWaalsContact C-O 3.27Å; A414-R419 HydrophobicContact CB-CB 4.5Å; A414-R419 WeakPolarHBondContact O-CA 3.48Å; A414-R419 PolarHBondContact O-N 2.97Å; A414-R419 VanDerWaalsContact O-O 3.12Å; A414-V422 HydrophobicContact CB-CG2 4.1Å
415	E	96	Very high	95.4	Very high	99 Å²	99	59.4 Å²	59.4	46%	0.463	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-41.2	176.3	-74.8	172.8	-177.3	0	0	111.7	R411 I412 L413 A417 G418 R419	R411-E415 WeakPolarHBondContact CD-OE1 3.45Å; R411-E415 HydrophobicContact CG-CG 4.38Å; R411-E415 WeakPolarHBondContact CG-OE1 3.49Å; R411-E415 IonicContact CZ-OE1 3.65Å; R411-E415 IonicContact NE-OE1 2.79Å; R411-E415 VanDerWaalsContact NH1-CD 3.31Å; R411-E415 IonicContact NH1-OE1 2.67Å; R411-E415 PolarHBondContact NH1-OE1 3.13Å; R411-E415 IonicContact NH1-OE2 3.34Å; R411-E415 PolarHBondContact NH1-OE2 2.98Å; R411-E415 WeakPolarHBondContact O-CB 3.37Å; R411-E415 WeakPolarHBondContact O-CG 3.4Å; R411-E415 PolarHBondContact O-N 3.23Å; I412-E415 PolarHBondContact O-N 2.95Å; L413-E415 PolarHBondContact O-N 3.29Å; E415-A417 VanDerWaalsContact C-N 3.26Å; E415-A417 PolarHBondContact O-N 3.09Å; E415-G418 PolarHBondContact O-N 3.22Å; E415-R419 WeakPolarHBondContact CA-O 3.19Å; E415-R419 PolarHBondContact N-O 3.14Å
416	A	94.9	Very high	95.6	Very high	87 Å²	87	54 Å²	54	72%	0.719	31%	0.314	S	S	*	.	H	α-helix	trans	-64.4	-30.5	175.2	0	0	0	0	0	112.7	I412 L413 A414 G418	I412-A416 WeakPolarHBondContact O-CB 3.47Å; I412-A416 PolarHBondContact O-N 3.38Å; L413-A416 PolarHBondContact O-N 3.24Å; A414-A416 PolarHBondContact O-N 2.81Å; A416-G418 PolarHBondContact O-N 3Å
417	A	94.3	Very high	95.6	Very high	60 Å²	60	53.9 Å²	53.9	50%	0.496	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	3.6	171.9	0	0	0	0	0	113.6	L413 A414 E415	L413-A417 PolarHBondContact O-N 3.3Å; A414-A417 CarbonylContact O-C 3.57Å; A414-A417 PolarHBondContact O-N 3.49Å; A414-A417 VanDerWaalsContact O-N 3.15Å; E415-A417 VanDerWaalsContact C-N 3.26Å; E415-A417 PolarHBondContact O-N 3.09Å
418	G	94.1	Very high	95.6	Very high	73 Å²	73	56.7 Å²	56.7	75%	0.753	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	17.8	-179.3	0	0	0	0	0	114.5	A414 E415 A416	A414-G418 PolarHBondContact O-N 2.96Å; E415-G418 PolarHBondContact O-N 3.22Å; A416-G418 PolarHBondContact O-N 3Å
419	R	95.1	Very high	95.7	Very high	72 Å²	72	56.6 Å²	56.6	27%	0.272	33%	0.332	S	S	.	.			trans	-106.8	146.1	179.6	-67.4	-174.9	-79.8	105.3	-4.4	111.1	A414 E415 E421 D426	A414-R419 CarbonylContact C-O 3.49Å; A414-R419 VanDerWaalsContact C-O 3.27Å; A414-R419 HydrophobicContact CB-CB 4.5Å; A414-R419 WeakPolarHBondContact O-CA 3.48Å; A414-R419 PolarHBondContact O-N 2.97Å; A414-R419 VanDerWaalsContact O-O 3.12Å; E415-R419 WeakPolarHBondContact CA-O 3.19Å; E415-R419 PolarHBondContact N-O 3.14Å; R419-E421 PolarHBondContact NH1-O 3.2Å; R419-E421 VanDerWaalsContact NH1-O 3.15Å; R419-D426 IonicContact CZ-OD1 2.68Å; R419-D426 IonicContact CZ-OD2 3.65Å; R419-D426 IonicContact NH1-OD1 3.33Å; R419-D426 IonicContact NH1-OD2 3.36Å; R419-D426 PolarHBondContact NH1-OD2 2.95Å; R419-D426 VanDerWaalsContact NH2-CG 3.27Å; R419-D426 IonicContact NH2-OD1 2.7Å; R419-D426 PolarHBondContact NH2-OD1 3.11Å; R419-D426 IonicContact NH2-OD2 3.83Å; R419-D426 PolarHBondContact NH2-OD2 3.25Å; R419-D426 VanDerWaalsContact NH2-OD2 3.12Å
420	T	93.2	Very high	95.7	Very high	132 Å²	132	55.1 Å²	55.1	81%	0.81	32%	0.322	S	S	*	.	S	Bend	trans	-92.4	-18.8	173.8	53.8	0	0	0	0	113
421	E	96.1	Very high	95.6	Very high	65 Å²	65	58 Å²	58	30%	0.304	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.1	-179.7	-174.3	177.5	-146	0	0	110	H384 R419 M423	H384-E421 VanDerWaalsContact CA-OE1 3.3Å; H384-E421 WeakPolarHBondContact CA-OE1 3.48Å; H384-E421 HydrophobicContact CB-CG 4.17Å; H384-E421 IonicContact CD2-OE1 3.01Å; H384-E421 PolarHBondContact N-OE1 3.01Å; R419-E421 PolarHBondContact NH1-O 3.2Å; R419-E421 VanDerWaalsContact NH1-O 3.15Å; E421-M423 HydrophobicContact CB-CE 4.28Å; E421-M423 HydrophobicContact CG-CE 4.18Å; E421-M423 WeakPolarHBondContact OE2-CE 3.4Å
422	V	97	Very high	95.4	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.012	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.9	177.7	-179.8	0	0	0	0	109.6	V381 S382 L383 H384 A387 R411 A414 D426 V427	V381-V422 HydrophobicContact CG1-CG2 3.9Å; S382-V422 PolarHBondContact O-N 3.28Å; L383-V422 HydrophobicContact CD2-CB 3.7Å; L383-V422 HydrophobicContact CD2-CG1 4.03Å; L383-V422 HydrophobicContact CD2-CG2 4.01Å; H384-V422 VanDerWaalsContact CB-O 3.27Å; H384-V422 WeakPolarHBondContact CB-O 3.25Å; H384-V422 PolarHBondContact N-O 2.77Å; A387-V422 HydrophobicContact CB-CG1 4.45Å; A387-V422 VanDerWaalsContact CB-O 3.32Å; A387-V422 WeakPolarHBondContact CB-O 3.26Å; R411-V422 HydrophobicContact CB-CG2 4.3Å; A414-V422 HydrophobicContact CB-CG2 4.1Å; V422-D426 HydrophobicContact CG1-CB 4Å; V422-V427 HydrophobicContact CG1-CG2 3.91Å
423	M	97.1	Very high	95.4	Very high	50 Å²	50	62.7 Å²	62.7	25%	0.246	36%	0.362	C	S	.	.			trans	-98.7	160.1	178.5	-68	-64.3	162.3	0	0	110.2	H384 E421 E425 D426 V427	H384-M423 HydrophobicContact CB-CE 4.27Å; H384-M423 HydrophobicContact CB-SD 3.74Å; E421-M423 HydrophobicContact CB-CE 4.28Å; E421-M423 HydrophobicContact CG-CE 4.18Å; E421-M423 WeakPolarHBondContact OE2-CE 3.4Å; M423-E425 PolarHBondContact O-N 2.9Å; M423-D426 PolarHBondContact N-OD2 3.38Å; M423-D426 WeakPolarHBondContact O-CB 3.43Å; M423-D426 PolarHBondContact O-N 3.34Å; M423-D426 VanDerWaalsContact O-N 3.08Å; M423-V427 PolarHBondContact O-N 3.45Å
424	P	96.5	Very high	95.4	Very high	28 Å²	28	65.5 Å²	65.5	18%	0.182	37%	0.372	C	S	.	.	H	α-helix	trans	-57	-32.7	179.6	21	-33.7	0	0	0	113	E386 D426 V427 V428	E386-P424 HydrophobicContact CB-CG 4.21Å; P424-D426 VanDerWaalsContact C-N 3.33Å; P424-D426 PolarHBondContact O-N 2.82Å; P424-V427 PolarHBondContact O-N 2.67Å; P424-V428 WeakPolarHBondContact O-CG2 3.29Å; P424-V428 PolarHBondContact O-N 3.37Å
425	E	96.2	Very high	95.2	Very high	143 Å²	143	70.1 Å²	70.1	67%	0.668	40%	0.396	S	S	*	.	H	α-helix	trans	-58.9	-42	176	-63.1	174.2	-165.1	0	0	112.2	M423 V427 V428 S429	M423-E425 PolarHBondContact O-N 2.9Å; E425-V427 VanDerWaalsContact C-N 3.31Å; E425-V427 PolarHBondContact O-N 2.98Å; E425-V428 PolarHBondContact O-N 3.48Å; E425-S429 WeakPolarHBondContact O-CB 3.45Å; E425-S429 PolarHBondContact O-N 3.31Å; E425-S429 PolarHBondContact O-OG 3.38Å; E425-S429 VanDerWaalsContact O-OG 3.11Å
426	D	96.9	Very high	95.1	Very high	11 Å²	11	66.3 Å²	66.3	6%	0.059	38%	0.379	C	S	.	.	H	α-helix	trans	-63.6	-40.3	178.4	-55.5	-49.8	0	0	0	111.1	L413 R419 V422 M423 P424 T430	L413-D426 HydrophobicContact CB-CB 4.35Å; R419-D426 IonicContact CZ-OD1 2.68Å; R419-D426 IonicContact CZ-OD2 3.65Å; R419-D426 IonicContact NH1-OD1 3.33Å; R419-D426 IonicContact NH1-OD2 3.36Å; R419-D426 PolarHBondContact NH1-OD2 2.95Å; R419-D426 VanDerWaalsContact NH2-CG 3.27Å; R419-D426 IonicContact NH2-OD1 2.7Å; R419-D426 PolarHBondContact NH2-OD1 3.11Å; R419-D426 IonicContact NH2-OD2 3.83Å; R419-D426 PolarHBondContact NH2-OD2 3.25Å; R419-D426 VanDerWaalsContact NH2-OD2 3.12Å; V422-D426 HydrophobicContact CG1-CB 4Å; M423-D426 PolarHBondContact N-OD2 3.38Å; M423-D426 WeakPolarHBondContact O-CB 3.43Å; M423-D426 PolarHBondContact O-N 3.34Å; M423-D426 VanDerWaalsContact O-N 3.08Å; P424-D426 VanDerWaalsContact C-N 3.33Å; P424-D426 PolarHBondContact O-N 2.82Å; D426-T430 WeakPolarHBondContact O-CB 3.28Å; D426-T430 PolarHBondContact O-N 3.14Å; D426-T430 PolarHBondContact O-OG1 3.49Å
427	V	96.9	Very high	94.8	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-65	-46.1	178.8	177.7	0	0	0	0	110.2	A387 T390 L391 I394 V422 M423 P424 E425 T430 Q431	A387-V427 HydrophobicContact CB-CG2 4.11Å; T390-V427 HydrophobicContact CG2-CB 4.33Å; T390-V427 HydrophobicContact CG2-CG1 3.85Å; L391-V427 HydrophobicContact CD1-CG2 4.28Å; L391-V427 HydrophobicContact CD2-CG1 3.57Å; L391-V427 HydrophobicContact CD2-CG2 4.23Å; L391-V427 HydrophobicContact CG-CG1 3.82Å; L391-V427 HydrophobicContact CG-CG2 4Å; I394-V427 HydrophobicContact CD1-CG1 3.61Å; V422-V427 HydrophobicContact CG1-CG2 3.91Å; M423-V427 PolarHBondContact O-N 3.45Å; P424-V427 PolarHBondContact O-N 2.67Å; E425-V427 VanDerWaalsContact C-N 3.31Å; E425-V427 PolarHBondContact O-N 2.98Å; V427-T430 WeakPolarHBondContact O-CB 3.25Å; V427-T430 PolarHBondContact O-N 2.92Å; V427-Q431 WeakPolarHBondContact O-CB 3.39Å; V427-Q431 PolarHBondContact O-N 3.04Å
428	V	95.2	Very high	94.5	Very high	59 Å²	59	69.8 Å²	69.8	36%	0.358	38%	0.378	S	S	.	.	H	α-helix	trans	-64.6	-44.8	178.1	174.3	0	0	0	0	111	T390 P424 E425 T430 Q431 Q432	T390-V428 HydrophobicContact CG2-CG2 4.22Å; P424-V428 WeakPolarHBondContact O-CG2 3.29Å; P424-V428 PolarHBondContact O-N 3.37Å; E425-V428 PolarHBondContact O-N 3.48Å; V428-T430 VanDerWaalsContact C-N 3.3Å; V428-T430 PolarHBondContact O-N 2.87Å; V428-Q431 WeakPolarHBondContact O-CB 3.42Å; V428-Q431 PolarHBondContact O-N 3.38Å; V428-Q432 WeakPolarHBondContact O-CG 3.46Å; V428-Q432 PolarHBondContact O-N 2.58Å; V428-Q432 VanDerWaalsContact O-N 3.08Å
429	S	95.1	Very high	94.3	Very high	54 Å²	54	68.8 Å²	68.8	38%	0.378	36%	0.359	S	S	.	.	H	α-helix	trans	-60.7	-40.9	174.4	-65.3	0	0	0	0	111.6	E425 Q431 Q432 L433	E425-S429 WeakPolarHBondContact O-CB 3.45Å; E425-S429 PolarHBondContact O-N 3.31Å; E425-S429 PolarHBondContact O-OG 3.38Å; E425-S429 VanDerWaalsContact O-OG 3.11Å; S429-Q431 PolarHBondContact O-N 3.04Å; S429-Q432 PolarHBondContact O-N 3.27Å; S429-L433 WeakPolarHBondContact O-CG 3.26Å; S429-L433 PolarHBondContact O-N 3.09Å
430	T	95.5	Very high	94.1	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-44.2	175.5	-53.6	0	0	0	0	111.2	L406 P409 S410 L413 D426 V427 V428 Q432 L433 F434	L406-T430 HydrophobicContact CB-CG2 4.32Å; L406-T430 HydrophobicContact CD2-CG2 3.58Å; P409-T430 HydrophobicContact CB-CG2 3.53Å; P409-T430 HydrophobicContact CG-CG2 4.37Å; S410-T430 WeakPolarHBondContact CA-OG1 3.35Å; S410-T430 WeakPolarHBondContact OG-CB 3.39Å; S410-T430 PolarHBondContact OG-OG1 3.18Å; L413-T430 WeakPolarHBondContact CD1-OG1 3.41Å; D426-T430 WeakPolarHBondContact O-CB 3.28Å; D426-T430 PolarHBondContact O-N 3.14Å; D426-T430 PolarHBondContact O-OG1 3.49Å; V427-T430 WeakPolarHBondContact O-CB 3.25Å; V427-T430 PolarHBondContact O-N 2.92Å; V428-T430 VanDerWaalsContact C-N 3.3Å; V428-T430 PolarHBondContact O-N 2.87Å; T430-Q432 VanDerWaalsContact C-N 3.28Å; T430-Q432 PolarHBondContact O-N 3.32Å; T430-L433 PolarHBondContact O-N 2.69Å; T430-L433 VanDerWaalsContact O-N 3.15Å; T430-F434 HydrophobicContact CG2-CD2 3.69Å; T430-F434 HydrophobicContact CG2-CE2 4.15Å; T430-F434 WeakPolarHBondContact O-CD2 3.44Å; T430-F434 PolarHBondContact O-N 3.34Å
431	Q	94.1	Very high	94	Very high	60 Å²	60	65.9 Å²	65.9	28%	0.28	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-37.2	179	-173.1	-173.9	13.3	0	0	112.2	I394 V427 V428 S429 F434	I394-Q431 HydrophobicContact CD1-CB 4.37Å; I394-Q431 HydrophobicContact CD1-CG 4.37Å; V427-Q431 WeakPolarHBondContact O-CB 3.39Å; V427-Q431 PolarHBondContact O-N 3.04Å; V428-Q431 WeakPolarHBondContact O-CB 3.42Å; V428-Q431 PolarHBondContact O-N 3.38Å; S429-Q431 PolarHBondContact O-N 3.04Å; Q431-F434 CarbonylContact O-C 3.31Å
432	Q	92.7	Very high	93.7	Very high	146 Å²	146	66.2 Å²	66.2	68%	0.682	36%	0.362	S	S	*	.	H	α-helix	trans	-68.2	-35.5	175.9	-70.1	175.6	-6.3	0	0	112.6	V428 S429 T430	V428-Q432 WeakPolarHBondContact O-CG 3.46Å; V428-Q432 PolarHBondContact O-N 2.58Å; V428-Q432 VanDerWaalsContact O-N 3.08Å; S429-Q432 PolarHBondContact O-N 3.27Å; T430-Q432 VanDerWaalsContact C-N 3.28Å; T430-Q432 PolarHBondContact O-N 3.32Å
433	L	94.6	Very high	93.3	Very high	120 Å²	120	71.7 Å²	71.7	63%	0.628	40%	0.395	S	S	*	.	H	α-helix	trans	-76.4	-34.6	179.5	-68.2	173.2	0	0	0	112.7	L413 S429 T430	L413-L433 HydrophobicContact CD1-CD1 4.5Å; S429-L433 WeakPolarHBondContact O-CG 3.26Å; S429-L433 PolarHBondContact O-N 3.09Å; T430-L433 PolarHBondContact O-N 2.69Å; T430-L433 VanDerWaalsContact O-N 3.15Å
434	F	95.8	Very high	92.8	Very high	113 Å²	113	73 Å²	73	50%	0.496	42%	0.415	S	S	.	.	S	Bend	trans	-119.7	94.7	-174.6	-61	-76.9	0	0	0	110.5	Y402 L406 P409 T430 Q431	Y402-F434 VanDerWaalsContact CE2-O 3.28Å; Y402-F434 WeakPolarHBondContact CE2-O 3.17Å; Y402-F434 VanDerWaalsContact CZ-O 3.28Å; Y402-F434 PolarHBondContact OH-O 3.28Å; L406-F434 HydrophobicContact CD2-CB 4.49Å; P409-F434 HydrophobicContact CB-CD2 4.46Å; P409-F434 HydrophobicContact CB-CE2 3.95Å; P409-F434 HydrophobicContact CG-CE2 4.34Å; T430-F434 HydrophobicContact CG2-CD2 3.69Å; T430-F434 HydrophobicContact CG2-CE2 4.15Å; T430-F434 WeakPolarHBondContact O-CD2 3.44Å; T430-F434 PolarHBondContact O-N 3.34Å; Q431-F434 CarbonylContact O-C 3.31Å
435	L	92.7	Very high	91.9	Very high	99 Å²	99	78.2 Å²	78.2	52%	0.518	44%	0.436	S	S	.	.			trans	-62.9	141.8	179.3	-58.5	179.1	0	0	0	112
436	D	93.2	Very high	90.4	Very high	18 Å²	18	80.8 Å²	80.8	10%	0.096	47%	0.465	C	S	.	.			trans	-75.2	166.6	167.7	77.8	92.4	0	0	0	111.3	A398 Y402 K438 S439 S440	A398-D436 HydrophobicContact CB-CB 3.85Å; Y402-D436 HydrophobicContact CD1-CB 3.89Å; Y402-D436 HydrophobicContact CD2-CB 3.85Å; Y402-D436 HydrophobicContact CE1-CB 3.81Å; Y402-D436 HydrophobicContact CE2-CB 3.79Å; Y402-D436 HydrophobicContact CG-CB 3.9Å; D436-K438 VanDerWaalsContact C-N 3.31Å; D436-K438 PolarHBondContact O-N 3.05Å; D436-K438 WeakPolarHBondContact OD1-CA 3.2Å; D436-K438 VanDerWaalsContact OD1-CB 3.29Å; D436-K438 WeakPolarHBondContact OD1-CB 3.37Å; D436-K438 PolarHBondContact OD1-N 2.86Å; D436-S439 PolarHBondContact O-N 3.16Å; D436-S439 PolarHBondContact OD1-N 3.49Å; D436-S439 VanDerWaalsContact OD2-CB 3.25Å; D436-S439 WeakPolarHBondContact OD2-CB 3.35Å; D436-S439 PolarHBondContact OD2-OG 3.3Å; D436-S440 WeakPolarHBondContact O-CB 3.25Å; D436-S440 PolarHBondContact O-N 3.18Å
437	S	89.2	Confident	90.1	Very high	89 Å²	89	84.3 Å²	84.3	62%	0.622	49%	0.486	S	S	*	.	H	α-helix	trans	-59.4	-36.7	-176.6	-176.4	0	0	0	0	113.7	I441	S437-I441 WeakPolarHBondContact O-CD1 3.41Å; S437-I441 WeakPolarHBondContact O-CG1 3.39Å; S437-I441 PolarHBondContact O-N 3.4Å; S437-I441 VanDerWaalsContact O-N 3.09Å
438	K	88.2	Confident	89.7	Confident	131 Å²	131	88.7 Å²	88.7	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-71.2	-45.8	-179.2	-60.8	176.9	-175.1	168.7	0	110.1	Q397 D436 S440 I441 A442	Q397-K438 PolarHBondContact O-NZ 3.16Å; D436-K438 VanDerWaalsContact C-N 3.31Å; D436-K438 PolarHBondContact O-N 3.05Å; D436-K438 WeakPolarHBondContact OD1-CA 3.2Å; D436-K438 VanDerWaalsContact OD1-CB 3.29Å; D436-K438 WeakPolarHBondContact OD1-CB 3.37Å; D436-K438 PolarHBondContact OD1-N 2.86Å; K438-S440 VanDerWaalsContact C-N 3.34Å; K438-S440 PolarHBondContact O-N 3.47Å; K438-I441 PolarHBondContact O-N 2.97Å; K438-A442 PolarHBondContact O-N 2.84Å
439	S	88.7	Confident	89.4	Confident	52 Å²	52	90.3 Å²	90.3	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-62.7	-40.5	176.8	-59.4	0	0	0	0	111.8	D436 A442 V443	D436-S439 PolarHBondContact O-N 3.16Å; D436-S439 PolarHBondContact OD1-N 3.49Å; D436-S439 VanDerWaalsContact OD2-CB 3.25Å; D436-S439 WeakPolarHBondContact OD2-CB 3.35Å; D436-S439 PolarHBondContact OD2-OG 3.3Å; S439-A442 PolarHBondContact O-N 3.39Å; S439-V443 WeakPolarHBondContact O-CG2 3.31Å; S439-V443 PolarHBondContact O-N 3.01Å; S439-V443 VanDerWaalsContact O-N 3.16Å
440	S	91.3	Very high	89.1	Confident	61 Å²	61	92.5 Å²	92.5	43%	0.427	53%	0.528	S	S	.	.	H	α-helix	trans	-64.4	-39.5	176.2	-176.4	0	0	0	0	112.8	D436 K438 V443 A444	D436-S440 WeakPolarHBondContact O-CB 3.25Å; D436-S440 PolarHBondContact O-N 3.18Å; K438-S440 VanDerWaalsContact C-N 3.34Å; K438-S440 PolarHBondContact O-N 3.47Å; S440-V443 PolarHBondContact O-N 2.91Å; S440-A444 WeakPolarHBondContact O-CB 3.48Å; S440-A444 PolarHBondContact O-N 3.35Å
441	I	90.8	Very high	88.7	Confident	82 Å²	82	98.3 Å²	98.3	42%	0.421	56%	0.561	S	S	.	*	H	α-helix	trans	-65.9	-45.7	176.2	-70.4	164.5	0	0	0	109.9	S437 K438 V443 A444 E445	S437-I441 WeakPolarHBondContact O-CD1 3.41Å; S437-I441 WeakPolarHBondContact O-CG1 3.39Å; S437-I441 PolarHBondContact O-N 3.4Å; S437-I441 VanDerWaalsContact O-N 3.09Å; K438-I441 PolarHBondContact O-N 2.97Å; I441-V443 PolarHBondContact O-N 3.21Å; I441-A444 PolarHBondContact O-N 2.78Å; I441-E445 HydrophobicContact CG2-CG 3.93Å; I441-E445 VanDerWaalsContact CG2-OE1 3.31Å; I441-E445 WeakPolarHBondContact CG2-OE1 3.41Å; I441-E445 PolarHBondContact O-N 3.17Å
442	A	89.9	Confident	88.3	Confident	73 Å²	73	100.8 Å²	100.8	60%	0.603	58%	0.58	S	S	*	*	H	α-helix	trans	-61.4	-26.3	179.5	0	0	0	0	0	113.8	K438 S439	K438-A442 PolarHBondContact O-N 2.84Å; S439-A442 PolarHBondContact O-N 3.39Å
443	V	89.1	Confident	88	Confident	116 Å²	116	97.6 Å²	97.6	70%	0.703	57%	0.573	S	S	*	*	H	α-helix	trans	-82.8	-27.6	174	174.2	0	0	0	0	112.1	S439 S440 I441	S439-V443 WeakPolarHBondContact O-CG2 3.31Å; S439-V443 PolarHBondContact O-N 3.01Å; S439-V443 VanDerWaalsContact O-N 3.16Å; S440-V443 PolarHBondContact O-N 2.91Å; I441-V443 PolarHBondContact O-N 3.21Å
444	A	86.4	Confident	87.5	Confident	79 Å²	79	95.8 Å²	95.8	65%	0.653	57%	0.568	S	S	*	*	H	α-helix	trans	-89.5	-25.1	-177.8	0	0	0	0	0	113.5	S440 I441 P446	S440-A444 WeakPolarHBondContact O-CB 3.48Å; S440-A444 PolarHBondContact O-N 3.35Å; I441-A444 PolarHBondContact O-N 2.78Å; A444-P446 WeakPolarHBondContact O-CD 3.46Å
445	E	77.9	Confident	86.8	Confident	136 Å²	136	94.4 Å²	94.4	64%	0.636	57%	0.574	S	S	*	*			trans	-72.7	119.9	173.7	-74.3	-178.2	173.7	0	0	109.3	I441	I441-E445 HydrophobicContact CG2-CG 3.93Å; I441-E445 VanDerWaalsContact CG2-OE1 3.31Å; I441-E445 WeakPolarHBondContact CG2-OE1 3.41Å; I441-E445 PolarHBondContact O-N 3.17Å
446	P	64.6	Low	86.3	Confident	197 Å²	197	94 Å²	94	100%	1.279	58%	0.579	S	S	*	*			trans	-68.5	0	-177.9	28.3	-34.9	0	0	0	114.2	A444	A444-P446 WeakPolarHBondContact O-CD 3.46Å

Retrieved 446 of 446 residues in 697.5 ms (Link to these results)

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