A0A3Q0KPW1_SCHMA Loading...

Putative leucine-rich repeat-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KPW1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 566 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	39.9	Very low	32.9	Very low	235 Å²	235	163.6 Å²	163.6	100%	1.158	83%	0.834	S	S	*	*				0	93.3	0	-96.7	179.7	-179.2	0	0	105.6	I3	M1-I3 PolarHBondContact O-N 2.92Å
2	D	37.3	Very low	32.6	Very low	161 Å²	161	165.4 Å²	165.4	86%	0.861	83%	0.825	S	S	*	*			trans	-64	124.3	169.5	-54.5	-54.2	0	0	0	107.9
3	I	35.7	Very low	32.4	Very low	144 Å²	144	167.3 Å²	167.3	74%	0.738	83%	0.83	S	S	*	*			trans	-133.5	97.6	157.3	-59.4	-176.3	0	0	0	105.8	M1 V5	M1-I3 PolarHBondContact O-N 2.92Å; I3-V5 HydrophobicContact CG2-CG2 3.9Å; I3-V5 PolarHBondContact O-N 3.03Å
4	E	32	Very low	32.2	Very low	188 Å²	188	164.4 Å²	164.4	88%	0.879	83%	0.832	S	S	*	*			trans	-51	122.7	156.5	-65.9	173.1	141.8	0	0	109
5	V	38.8	Very low	32.2	Very low	126 Å²	126	157.2 Å²	157.2	76%	0.764	82%	0.815	S	S	*	*			trans	-125.9	94	160.5	-177.3	0	0	0	0	107.4	I3	I3-V5 HydrophobicContact CG2-CG2 3.9Å; I3-V5 PolarHBondContact O-N 3.03Å
6	L	32.2	Very low	32.6	Very low	155 Å²	155	158.5 Å²	158.5	81%	0.812	82%	0.816	S	S	*	*			trans	15.4	120.2	148.5	-62.9	169.4	0	0	0	117.8	S8	L6-S8 PolarHBondContact O-N 2.88Å
7	Q	27.5	Very low	33.5	Very low	190 Å²	190	153.5 Å²	153.5	89%	0.888	79%	0.794	S	S	*	*			trans	-49.1	118.2	148.4	-67.7	168.9	-38.3	0	0	110.1
8	S	31.7	Very low	34.7	Very low	95 Å²	95	154.6 Å²	154.6	66%	0.664	80%	0.795	S	S	*	*			trans	-126.5	105.1	149.9	54.2	0	0	0	0	106.9	L6 E10	L6-S8 PolarHBondContact O-N 2.88Å; S8-E10 PolarHBondContact O-N 2.87Å
9	D	27.1	Very low	35.9	Very low	161 Å²	161	151.4 Å²	151.4	86%	0.861	78%	0.776	S	S	*	*			trans	-62	75	166.2	-73.3	-42.4	0	0	0	109.5
10	E	30.7	Very low	37.2	Very low	143 Å²	143	150 Å²	150	67%	0.668	77%	0.766	S	S	*	*			trans	-97.7	92.8	159.2	-73	-170.8	175	0	0	106.7	S8 Y12	S8-E10 PolarHBondContact O-N 2.87Å; E10-Y12 WeakPolarHBondContact O-CD2 3.2Å; E10-Y12 PolarHBondContact O-N 3.39Å
11	K	29.3	Very low	38.8	Very low	202 Å²	202	146.8 Å²	146.8	88%	0.878	76%	0.757	S	S	*	*			trans	-50.6	92.7	156.5	-74.5	175.5	177.2	174	0	107.1	E13	K11-E13 PolarHBondContact O-N 3.44Å
12	Y	29.1	Very low	40.5	Very low	185 Å²	185	140.6 Å²	140.6	73%	0.725	72%	0.724	S	S	*	*			trans	-53.6	110.3	155.9	-71.2	-82.8	0	0	0	105.5	E10 C14	E10-Y12 WeakPolarHBondContact O-CD2 3.2Å; E10-Y12 PolarHBondContact O-N 3.39Å; Y12-C14 PolarHBondContact O-N 3.44Å
13	E	30	Very low	42.5	Very low	190 Å²	190	133.1 Å²	133.1	89%	0.888	68%	0.684	S	S	*	*			trans	-58.6	80.5	155.4	-84.1	-178.4	144	0	0	106.5	K11 G15	K11-E13 PolarHBondContact O-N 3.44Å; E13-G15 PolarHBondContact O-N 2.98Å
14	C	29.4	Very low	44.6	Very low	127 Å²	127	128.1 Å²	128.1	86%	0.858	66%	0.664	S	S	*	*			trans	-68.4	83.6	167.2	-79.3	0	0	0	0	107.1	Y12	Y12-C14 PolarHBondContact O-N 3.44Å
15	G	32.3	Very low	46.9	Very low	56 Å²	56	120.5 Å²	120.5	58%	0.577	64%	0.637	S	S	*	*			trans	-159.7	20.7	179.3	0	0	0	0	0	113.1	E13 T17	E13-G15 PolarHBondContact O-N 2.98Å; G15-T17 PolarHBondContact O-N 3.27Å
16	E	39	Very low	48.9	Very low	178 Å²	178	116.2 Å²	116.2	83%	0.832	61%	0.61	S	S	*	*			trans	-65.8	93.1	159	-75.5	-172.7	177.1	0	0	106.9	E18	E16-E18 PolarHBondContact O-N 2.93Å
17	T	48.2	Very low	51.3	Low	73 Å²	73	108.9 Å²	108.9	45%	0.448	57%	0.572	S	S	.	*			trans	-51.1	137	-176.2	57	0	0	0	0	110.5	G15 E19 E20	G15-T17 PolarHBondContact O-N 3.27Å; T17-E19 PolarHBondContact O-N 2.84Å; T17-E20 PolarHBondContact O-N 2.72Å
18	E	54.4	Low	54	Low	173 Å²	173	101.7 Å²	101.7	81%	0.808	54%	0.543	S	S	*	.	H	α-helix	trans	-48.1	-26.6	177.4	-64.7	-179.8	162.4	0	0	112.5	E16 S21 F22	E16-E18 PolarHBondContact O-N 2.93Å; E18-S21 PolarHBondContact O-OG 3.49Å; E18-F22 PolarHBondContact O-N 3.27Å; E18-F22 VanDerWaalsContact O-N 3.09Å
19	E	57	Low	56.5	Low	94 Å²	94	102.3 Å²	102.3	44%	0.439	54%	0.539	S	S	.	.	H	α-helix	trans	-66.2	-42.7	176.5	-61.3	-171.1	167.9	0	0	114.3	T17 S21 F22 V23	T17-E19 PolarHBondContact O-N 2.84Å; E19-S21 VanDerWaalsContact C-N 3.34Å; E19-F22 PolarHBondContact O-N 3.42Å; E19-V23 WeakPolarHBondContact O-CG2 3.4Å; E19-V23 PolarHBondContact O-N 3.49Å
20	E	62.6	Low	59	Low	124 Å²	124	95 Å²	95	58%	0.579	50%	0.501	S	S	*	.	H	α-helix	trans	-66.3	-39.5	178.1	-76	-174.9	174.7	0	0	111	T17 F22 V23 A24	T17-E20 PolarHBondContact O-N 2.72Å; E20-F22 VanDerWaalsContact C-N 3.33Å; E20-F22 PolarHBondContact O-N 3.32Å; E20-V23 PolarHBondContact O-N 2.73Å; E20-A24 WeakPolarHBondContact O-CB 3.02Å; E20-A24 PolarHBondContact O-N 3.26Å
21	S	71	Confident	61.5	Low	82 Å²	82	90.8 Å²	90.8	57%	0.573	49%	0.485	S	S	*	.	H	α-helix	trans	-63.7	-38.8	174.4	84.9	0	0	0	0	111.9	E18 E19 A24 G25	E18-S21 PolarHBondContact O-OG 3.49Å; E19-S21 VanDerWaalsContact C-N 3.34Å; S21-A24 PolarHBondContact O-N 3.37Å; S21-G25 PolarHBondContact O-N 3.2Å
22	F	75.5	Confident	63.8	Low	105 Å²	105	87.4 Å²	87.4	46%	0.461	48%	0.475	S	S	.	.	H	α-helix	trans	-66.3	-41	176.8	-173.2	-81.2	0	0	0	111.6	E18 E19 E20 G25 T26 R43	E18-F22 PolarHBondContact O-N 3.27Å; E18-F22 VanDerWaalsContact O-N 3.09Å; E19-F22 PolarHBondContact O-N 3.42Å; E20-F22 VanDerWaalsContact C-N 3.33Å; E20-F22 PolarHBondContact O-N 3.32Å; F22-G25 PolarHBondContact O-N 3.46Å; F22-T26 WeakPolarHBondContact CD1-OG1 3.43Å; F22-T26 WeakPolarHBondContact CE1-OG1 3.48Å; F22-T26 WeakPolarHBondContact O-CB 3.44Å; F22-T26 PolarHBondContact O-N 3.23Å; F22-T26 PolarHBondContact O-OG1 3.22Å; F22-R43 VanDerWaalsContact CD1-CZ 3.46Å
23	V	78.8	Confident	66.3	Low	5 Å²	5	82.1 Å²	82.1	3%	0.03	47%	0.47	C	S	.	.	H	α-helix	trans	-66.5	-45.8	176.9	172.2	0	0	0	0	110.5	E19 E20 G25 T26 I27 L40 R43 L45 P49	E19-V23 WeakPolarHBondContact O-CG2 3.4Å; E19-V23 PolarHBondContact O-N 3.49Å; E20-V23 PolarHBondContact O-N 2.73Å; V23-G25 VanDerWaalsContact C-N 3.29Å; V23-G25 PolarHBondContact O-N 2.83Å; V23-T26 PolarHBondContact O-N 3Å; V23-I27 HydrophobicContact CG1-CD1 3.7Å; V23-I27 HydrophobicContact CG1-CG1 4.41Å; V23-I27 VanDerWaalsContact O-CG1 3.26Å; V23-I27 WeakPolarHBondContact O-CG1 3.47Å; V23-I27 PolarHBondContact O-N 3.45Å; V23-L40 HydrophobicContact CG1-CD1 4.28Å; V23-L40 HydrophobicContact CG1-CD2 4.12Å; V23-L40 HydrophobicContact CG2-CD2 4.45Å; V23-R43 HydrophobicContact CG2-CB 4.02Å; V23-R43 HydrophobicContact CG2-CG 4.04Å; V23-L45 HydrophobicContact CG1-CD2 4.15Å; V23-L45 HydrophobicContact CG2-CD2 4.12Å; V23-P49 HydrophobicContact CG1-CG 3.99Å
24	A	79.7	Confident	68.7	Low	38 Å²	38	82.3 Å²	82.3	31%	0.314	46%	0.462	S	S	.	.	H	α-helix	trans	-60.4	-39.3	175.4	0	0	0	0	0	111.8	E20 S21 S28	E20-A24 WeakPolarHBondContact O-CB 3.02Å; E20-A24 PolarHBondContact O-N 3.26Å; S21-A24 PolarHBondContact O-N 3.37Å; A24-S28 WeakPolarHBondContact O-CB 3.32Å; A24-S28 PolarHBondContact O-N 3.14Å; A24-S28 PolarHBondContact O-OG 3.29Å
25	G	80.5	Confident	71.1	Confident	29 Å²	29	78 Å²	78	30%	0.299	43%	0.433	S	S	.	.	H	α-helix	trans	-63.8	-49	173.4	0	0	0	0	0	112.6	S21 F22 V23 I27 S28 D29	S21-G25 PolarHBondContact O-N 3.2Å; F22-G25 PolarHBondContact O-N 3.46Å; V23-G25 VanDerWaalsContact C-N 3.29Å; V23-G25 PolarHBondContact O-N 2.83Å; G25-I27 VanDerWaalsContact C-N 3.31Å; G25-I27 PolarHBondContact O-N 3.24Å; G25-S28 PolarHBondContact O-N 3.46Å; G25-S28 VanDerWaalsContact O-N 3.13Å; G25-D29 WeakPolarHBondContact O-CB 3.19Å; G25-D29 PolarHBondContact O-N 2.82Å
26	T	81.5	Confident	73.6	Confident	35 Å²	35	78.3 Å²	78.3	22%	0.215	43%	0.426	C	S	.	.	H	α-helix	trans	-60.3	-40.4	177.8	-56.3	0	0	0	0	111.9	F22 V23 A30 L38 L40	F22-T26 WeakPolarHBondContact CD1-OG1 3.43Å; F22-T26 WeakPolarHBondContact CE1-OG1 3.48Å; F22-T26 WeakPolarHBondContact O-CB 3.44Å; F22-T26 PolarHBondContact O-N 3.23Å; F22-T26 PolarHBondContact O-OG1 3.22Å; V23-T26 PolarHBondContact O-N 3Å; T26-A30 VanDerWaalsContact O-CB 3.26Å; T26-A30 WeakPolarHBondContact O-CB 3.29Å; T26-A30 PolarHBondContact O-N 3.47Å; T26-L38 HydrophobicContact CG2-CD1 4.11Å; T26-L40 HydrophobicContact CG2-CD2 4.03Å
27	I	81.9	Confident	75.9	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.01	40%	0.403	C	S	.	.	H	α-helix	trans	-68.2	-43.3	176	-65.5	165	0	0	0	110.2	V23 G25 D29 A30 V31 L38 L40 P49 R51 I52	V23-I27 HydrophobicContact CG1-CD1 3.7Å; V23-I27 HydrophobicContact CG1-CG1 4.41Å; V23-I27 VanDerWaalsContact O-CG1 3.26Å; V23-I27 WeakPolarHBondContact O-CG1 3.47Å; V23-I27 PolarHBondContact O-N 3.45Å; G25-I27 VanDerWaalsContact C-N 3.31Å; G25-I27 PolarHBondContact O-N 3.24Å; I27-D29 PolarHBondContact O-N 3.22Å; I27-A30 CarbonylContact O-C 3.56Å; I27-A30 WeakPolarHBondContact O-CB 3.47Å; I27-A30 PolarHBondContact O-N 3.38Å; I27-A30 VanDerWaalsContact O-N 3.16Å; I27-V31 HydrophobicContact CG2-CG2 4.32Å; I27-V31 VanDerWaalsContact O-CG2 3.27Å; I27-V31 WeakPolarHBondContact O-CG2 3.47Å; I27-V31 PolarHBondContact O-N 3.09Å; I27-L38 HydrophobicContact CG1-CD2 4.33Å; I27-L40 HydrophobicContact CD1-CD1 4.15Å; I27-L40 HydrophobicContact CG1-CD1 4.12Å; I27-P49 HydrophobicContact CD1-CB 3.71Å; I27-P49 HydrophobicContact CD1-CG 3.74Å; I27-R51 HydrophobicContact CG2-CB 3.81Å; I27-I52 HydrophobicContact CD1-CD1 4.09Å; I27-I52 HydrophobicContact CD1-CG1 3.85Å; I27-I52 HydrophobicContact CG1-CG1 4.16Å; I27-I52 HydrophobicContact CG2-CG1 4.32Å
28	S	84.3	Confident	77.8	Confident	39 Å²	39	69 Å²	69	27%	0.273	38%	0.383	S	S	.	.	H	α-helix	trans	-62.8	-42.4	178.1	-57.5	0	0	0	0	111.6	A24 G25 A30 V31 I32	A24-S28 WeakPolarHBondContact O-CB 3.32Å; A24-S28 PolarHBondContact O-N 3.14Å; A24-S28 PolarHBondContact O-OG 3.29Å; G25-S28 PolarHBondContact O-N 3.46Å; G25-S28 VanDerWaalsContact O-N 3.13Å; S28-A30 VanDerWaalsContact C-N 3.34Å; S28-A30 PolarHBondContact O-N 2.93Å; S28-V31 PolarHBondContact O-N 3.28Å; S28-I32 VanDerWaalsContact O-CG1 3.27Å; S28-I32 WeakPolarHBondContact O-CG1 3.44Å; S28-I32 PolarHBondContact O-N 3.08Å
29	D	83.1	Confident	79.4	Confident	107 Å²	107	64.7 Å²	64.7	57%	0.572	37%	0.366	S	S	*	.	H	α-helix	trans	-62.4	-41.4	172.9	-72.5	-16.3	0	0	0	111.3	G25 I27 V31 I32 A33	G25-D29 WeakPolarHBondContact O-CB 3.19Å; G25-D29 PolarHBondContact O-N 2.82Å; I27-D29 PolarHBondContact O-N 3.22Å; D29-V31 VanDerWaalsContact C-N 3.33Å; D29-V31 PolarHBondContact O-N 3.39Å; D29-I32 PolarHBondContact O-N 3.32Å; D29-A33 WeakPolarHBondContact O-CB 3.4Å; D29-A33 PolarHBondContact O-N 2.96Å
30	A	81.3	Confident	80.8	Confident	9 Å²	9	60.2 Å²	60.2	7%	0.074	35%	0.345	C	S	.	.	H	α-helix	trans	-65.7	-35.3	175.7	0	0	0	0	0	112.4	T26 I27 S28 R34 S35 L38 L55	T26-A30 VanDerWaalsContact O-CB 3.26Å; T26-A30 WeakPolarHBondContact O-CB 3.29Å; T26-A30 PolarHBondContact O-N 3.47Å; I27-A30 CarbonylContact O-C 3.56Å; I27-A30 WeakPolarHBondContact O-CB 3.47Å; I27-A30 PolarHBondContact O-N 3.38Å; I27-A30 VanDerWaalsContact O-N 3.16Å; S28-A30 VanDerWaalsContact C-N 3.34Å; S28-A30 PolarHBondContact O-N 2.93Å; A30-R34 WeakPolarHBondContact O-CA 3.07Å; A30-R34 PolarHBondContact O-N 3.44Å; A30-S35 PolarHBondContact O-N 2.97Å; A30-L38 HydrophobicContact CB-CD1 3.95Å; A30-L55 HydrophobicContact CB-CD1 4.25Å; A30-L55 HydrophobicContact CB-CD2 4.46Å; A30-L55 WeakPolarHBondContact O-CD2 3.36Å
31	V	81.5	Confident	81.9	Confident	53 Å²	53	57.5 Å²	57.5	32%	0.321	33%	0.331	S	S	.	.	H	α-helix	trans	-68.3	-47.5	175.5	169.7	0	0	0	0	110.3	I27 S28 D29 A33 R34 D54 L55	I27-V31 HydrophobicContact CG2-CG2 4.32Å; I27-V31 VanDerWaalsContact O-CG2 3.27Å; I27-V31 WeakPolarHBondContact O-CG2 3.47Å; I27-V31 PolarHBondContact O-N 3.09Å; S28-V31 PolarHBondContact O-N 3.28Å; D29-V31 VanDerWaalsContact C-N 3.33Å; D29-V31 PolarHBondContact O-N 3.39Å; V31-A33 VanDerWaalsContact C-N 3.33Å; V31-A33 PolarHBondContact O-N 3.42Å; V31-R34 PolarHBondContact O-N 3.49Å; V31-R34 VanDerWaalsContact O-N 3.13Å; V31-D54 HydrophobicContact CG2-CB 4.16Å; V31-L55 HydrophobicContact CB-CD2 4.22Å; V31-L55 HydrophobicContact CG2-CD1 4.48Å; V31-L55 HydrophobicContact CG2-CD2 3.66Å; V31-L55 HydrophobicContact CG2-CG 3.88Å
32	I	78.6	Confident	82.6	Confident	132 Å²	132	58.7 Å²	58.7	68%	0.677	33%	0.331	S	S	*	.	H	α-helix	trans	-59.4	-45.9	175.3	-67.1	164.8	0	0	0	110.4	S28 D29 R34	S28-I32 VanDerWaalsContact O-CG1 3.27Å; S28-I32 WeakPolarHBondContact O-CG1 3.44Å; S28-I32 PolarHBondContact O-N 3.08Å; D29-I32 PolarHBondContact O-N 3.32Å; I32-R34 PolarHBondContact O-N 3.15Å
33	A	82	Confident	83	Confident	74 Å²	74	57.4 Å²	57.4	61%	0.612	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-8.8	-179.8	0	0	0	0	0	113.9	D29 V31 S35	D29-A33 WeakPolarHBondContact O-CB 3.4Å; D29-A33 PolarHBondContact O-N 2.96Å; V31-A33 VanDerWaalsContact C-N 3.33Å; V31-A33 PolarHBondContact O-N 3.42Å; A33-S35 PolarHBondContact O-N 3.11Å
34	R	79.5	Confident	83.1	Confident	193 Å²	193	62.1 Å²	62.1	73%	0.728	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	47.6	-168.9	-65.3	-178.3	164.8	90.8	-0.9	111.5	A30 V31 I32	A30-R34 WeakPolarHBondContact O-CA 3.07Å; A30-R34 PolarHBondContact O-N 3.44Å; V31-R34 PolarHBondContact O-N 3.49Å; V31-R34 VanDerWaalsContact O-N 3.13Å; I32-R34 PolarHBondContact O-N 3.15Å
35	S	80.4	Confident	83.2	Confident	37 Å²	37	61.1 Å²	61.1	26%	0.259	34%	0.337	S	S	.	.			trans	-63.2	139.1	-171.5	-169.8	0	0	0	0	111.9	A30 A33 S37 L58	A30-S35 PolarHBondContact O-N 2.97Å; A33-S35 PolarHBondContact O-N 3.11Å; S35-S37 VanDerWaalsContact C-N 3.31Å; S35-S37 PolarHBondContact OG-N 3.38Å; S35-S37 PolarHBondContact OG-O 3.47Å; S35-L58 WeakPolarHBondContact O-CD1 3.49Å
36	C	85.5	Confident	83.4	Confident	62 Å²	62	67.1 Å²	67.1	42%	0.419	36%	0.355	S	S	.	.	S	Bend	trans	-84.8	-7.4	172.1	-58.8	0	0	0	0	112.6	Q59 K60	C36-Q59 HydrophobicContact CB-CG 4.41Å; C36-Q59 WeakPolarHBondContact O-CA 3.47Å; C36-Q59 PolarHBondContact O-N 2.87Å; C36-K60 PolarHBondContact O-N 2.92Å
37	S	87.3	Confident	83.5	Confident	51 Å²	51	72.1 Å²	72.1	36%	0.357	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	129.7	-178.3	-172.4	0	0	0	0	110.1	S35 K60	S35-S37 VanDerWaalsContact C-N 3.31Å; S35-S37 PolarHBondContact OG-N 3.38Å; S35-S37 PolarHBondContact OG-O 3.47Å; S37-K60 CarbonylContact C-O 3.55Å; S37-K60 VanDerWaalsContact CA-O 3.29Å; S37-K60 WeakPolarHBondContact CA-O 3.44Å
38	L	88.1	Confident	83.5	Confident	4 Å²	4	72.5 Å²	72.5	2%	0.021	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	122.3	177	179.9	61.8	0	0	0	108.8	T26 I27 A30 L40 I52 L55 L58 K60 L61 Y62	T26-L38 HydrophobicContact CG2-CD1 4.11Å; I27-L38 HydrophobicContact CG1-CD2 4.33Å; A30-L38 HydrophobicContact CB-CD1 3.95Å; L38-L40 HydrophobicContact CD1-CD1 4.39Å; L38-L40 HydrophobicContact CD1-CD2 4.4Å; L38-L40 HydrophobicContact CD1-CG 4.13Å; L38-L40 HydrophobicContact CD2-CD1 3.86Å; L38-L40 HydrophobicContact CD2-CG 4.37Å; L38-L40 HydrophobicContact CG-CD1 4.05Å; L38-L40 HydrophobicContact CG-CG 3.99Å; L38-I52 HydrophobicContact CD2-CD1 4Å; L38-I52 HydrophobicContact CD2-CG1 3.98Å; L38-I52 HydrophobicContact CD2-CG2 4.46Å; L38-L55 HydrophobicContact CD2-CD1 3.96Å; L38-L58 HydrophobicContact CB-CD1 3.77Å; L38-L58 HydrophobicContact CB-CD2 4.14Å; L38-K60 PolarHBondContact N-O 3.27Å; L38-L61 HydrophobicContact CB-CD1 4.02Å; L38-L61 HydrophobicContact CD2-CD1 3.94Å; L38-L61 HydrophobicContact CG-CD1 4.16Å; L38-Y62 PolarHBondContact O-N 2.66Å
39	D	87	Confident	83.3	Confident	83 Å²	83	72.3 Å²	72.3	44%	0.444	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	110	179.2	-165	-21.9	0	0	0	109.3	K41 Y62	D39-K41 WeakPolarHBondContact OD1-CB 3.41Å; D39-K41 WeakPolarHBondContact OD1-CD 3.38Å; D39-K41 WeakPolarHBondContact OD1-CG 3.48Å; D39-K41 PolarHBondContact OD1-N 3.12Å; D39-K41 IonicContact OD2-NZ 3.3Å; D39-Y62 HydrophobicContact CB-CD2 4.22Å
40	L	85.8	Confident	83.1	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	38%	0.377	C	S	.	.			trans	-125.7	36.4	178.3	-66.2	176	0	0	0	110.3	V23 T26 I27 L38 R43 L45 I52 Y62 F63 N66	V23-L40 HydrophobicContact CG1-CD1 4.28Å; V23-L40 HydrophobicContact CG1-CD2 4.12Å; V23-L40 HydrophobicContact CG2-CD2 4.45Å; T26-L40 HydrophobicContact CG2-CD2 4.03Å; I27-L40 HydrophobicContact CD1-CD1 4.15Å; I27-L40 HydrophobicContact CG1-CD1 4.12Å; L38-L40 HydrophobicContact CD1-CD1 4.39Å; L38-L40 HydrophobicContact CD1-CD2 4.4Å; L38-L40 HydrophobicContact CD1-CG 4.13Å; L38-L40 HydrophobicContact CD2-CD1 3.86Å; L38-L40 HydrophobicContact CD2-CG 4.37Å; L38-L40 HydrophobicContact CG-CD1 4.05Å; L38-L40 HydrophobicContact CG-CG 3.99Å; L40-R43 HydrophobicContact CB-CG 4.49Å; L40-L45 HydrophobicContact CB-CD1 4.22Å; L40-L45 HydrophobicContact CD1-CD1 4.49Å; L40-I52 HydrophobicContact CD1-CD1 3.95Å; L40-Y62 CarbonylContact C-O 3.58Å; L40-Y62 WeakPolarHBondContact CA-O 3.43Å; L40-Y62 PolarHBondContact N-O 3.44Å; L40-F63 HydrophobicContact CB-CD1 3.83Å; L40-F63 HydrophobicContact CB-CE1 3.63Å; L40-F63 HydrophobicContact CD1-CE1 3.52Å; L40-F63 HydrophobicContact CD1-CZ 3.95Å; L40-F63 HydrophobicContact CG-CE1 4.2Å; L40-N66 PolarHBondContact O-ND2 3.25Å
41	K	86.2	Confident	83.1	Confident	67 Å²	67	79 Å²	79	29%	0.291	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	150.8	174.8	-62.9	173	-172.3	169.3	0	112	D39 R43 S64	D39-K41 WeakPolarHBondContact OD1-CB 3.41Å; D39-K41 WeakPolarHBondContact OD1-CD 3.38Å; D39-K41 WeakPolarHBondContact OD1-CG 3.48Å; D39-K41 PolarHBondContact OD1-N 3.12Å; D39-K41 IonicContact OD2-NZ 3.3Å; K41-R43 WeakPolarHBondContact O-CG 3.44Å; K41-R43 PolarHBondContact O-N 2.92Å; K41-S64 VanDerWaalsContact CA-O 3.26Å; K41-S64 WeakPolarHBondContact CA-O 3.45Å; K41-S64 VanDerWaalsContact CD-OG 3.32Å; K41-S64 WeakPolarHBondContact CD-OG 3.37Å; K41-S64 WeakPolarHBondContact CG-OG 3.35Å
42	N	85.6	Confident	83.1	Confident	107 Å²	107	76.5 Å²	76.5	57%	0.572	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	45	175.8	-63.3	-17	0	0	0	113.1	S64 N65	N42-S64 PolarHBondContact N-O 3.1Å; N42-N65 VanDerWaalsContact CA-O 3.27Å; N42-N65 WeakPolarHBondContact CA-O 3.34Å; N42-N65 PolarHBondContact N-O 2.66Å; N42-N65 WeakPolarHBondContact OD1-CB 3.37Å; N42-N65 PolarHBondContact OD1-ND2 3.37Å
43	R	84.1	Confident	83.1	Confident	78 Å²	78	72.4 Å²	72.4	29%	0.294	37%	0.367	S	S	.	.	S	Bend	trans	-113.5	12.6	-178.5	-64.1	-58.9	177.7	168	-0.9	113.5	F22 V23 L40 K41 L45 N66	F22-R43 VanDerWaalsContact CD1-CZ 3.46Å; V23-R43 HydrophobicContact CG2-CB 4.02Å; V23-R43 HydrophobicContact CG2-CG 4.04Å; L40-R43 HydrophobicContact CB-CG 4.49Å; K41-R43 WeakPolarHBondContact O-CG 3.44Å; K41-R43 PolarHBondContact O-N 2.92Å; R43-L45 HydrophobicContact CB-CD1 4.01Å; R43-L45 HydrophobicContact CB-CD2 4.47Å; R43-L45 HydrophobicContact CB-CG 3.76Å; R43-L45 PolarHBondContact O-N 3.46Å; R43-N66 VanDerWaalsContact C-OD1 3.28Å; R43-N66 WeakPolarHBondContact CA-OD1 3.37Å; R43-N66 PolarHBondContact N-OD1 2.99Å
44	N	81.1	Confident	83.2	Confident	104 Å²	104	73.5 Å²	73.5	56%	0.556	36%	0.363	S	S	*	.			trans	47.9	26.9	-177.3	-72	-28.4	0	0	0	114.2	K46 N66	N44-K46 PolarHBondContact O-N 3.25Å; N44-N66 PolarHBondContact N-OD1 3.23Å; N44-N66 VanDerWaalsContact N-OD1 3.11Å
45	L	82.3	Confident	83.4	Confident	16 Å²	16	64.5 Å²	64.5	8%	0.084	33%	0.329	C	S	.	.			trans	-65.7	125.8	-174.6	-68.7	170.9	0	0	0	110	V23 L40 R43 F63 N66 S67 L68	V23-L45 HydrophobicContact CG1-CD2 4.15Å; V23-L45 HydrophobicContact CG2-CD2 4.12Å; L40-L45 HydrophobicContact CB-CD1 4.22Å; L40-L45 HydrophobicContact CD1-CD1 4.49Å; R43-L45 HydrophobicContact CB-CD1 4.01Å; R43-L45 HydrophobicContact CB-CD2 4.47Å; R43-L45 HydrophobicContact CB-CG 3.76Å; R43-L45 PolarHBondContact O-N 3.46Å; L45-F63 HydrophobicContact CD1-CD1 4.04Å; L45-F63 HydrophobicContact CD1-CE1 3.65Å; L45-N66 HydrophobicContact CB-CB 4.14Å; L45-N66 PolarHBondContact N-OD1 2.94Å; L45-N66 VanDerWaalsContact N-OD1 3.11Å; L45-S67 CarbonylContact O-C 3.5Å; L45-S67 VanDerWaalsContact O-CA 3.25Å; L45-S67 WeakPolarHBondContact O-CA 3.4Å; L45-S67 PolarHBondContact O-N 3.33Å; L45-L68 HydrophobicContact CB-CD2 4.02Å; L45-L68 PolarHBondContact O-N 3.39Å; L45-L68 VanDerWaalsContact O-N 3.13Å
46	K	84.2	Confident	83.5	Confident	155 Å²	155	66 Å²	66	67%	0.674	34%	0.338	S	S	*	.	S	Bend	trans	-81.5	-31.5	174.2	-67.3	176.2	-176.5	166.5	0	112	N44 L68 K69	N44-K46 PolarHBondContact O-N 3.25Å; K46-L68 WeakPolarHBondContact O-CA 3.37Å; K46-K69 PolarHBondContact O-N 3.12Å
47	E	82.9	Confident	83.4	Confident	141 Å²	141	67.3 Å²	67.3	66%	0.659	34%	0.341	S	S	*	.	S	Bend	trans	-140.8	158.4	-178.9	-64.8	-177.5	-177.6	0	0	110	P49	E47-P49 WeakPolarHBondContact O-CD 3.43Å
48	I	83.4	Confident	83.5	Confident	10 Å²	10	64.9 Å²	64.9	5%	0.051	32%	0.324	C	S	.	.			trans	-81.1	123.8	176.8	-60.6	178.9	0	0	0	107.5	D50 I52 F63 L68 I71 I75	I48-D50 PolarHBondContact O-N 3.3Å; I48-I52 HydrophobicContact CG2-CD1 3.83Å; I48-F63 HydrophobicContact CB-CE2 4.37Å; I48-F63 HydrophobicContact CB-CZ 4.38Å; I48-F63 HydrophobicContact CD1-CD2 4.21Å; I48-F63 HydrophobicContact CD1-CE2 3.9Å; I48-F63 HydrophobicContact CG1-CD2 4.36Å; I48-F63 HydrophobicContact CG1-CE2 3.89Å; I48-F63 HydrophobicContact CG1-CZ 4.2Å; I48-F63 HydrophobicContact CG2-CE2 3.66Å; I48-F63 HydrophobicContact CG2-CZ 3.66Å; I48-L68 HydrophobicContact CD1-CD1 4.33Å; I48-L68 HydrophobicContact CG1-CD1 3.9Å; I48-L68 HydrophobicContact CG1-CD2 3.84Å; I48-I71 HydrophobicContact CD1-CG1 4.36Å; I48-I71 HydrophobicContact CD1-CG2 4.1Å; I48-I75 HydrophobicContact CB-CD1 3.72Å; I48-I75 HydrophobicContact CG2-CD1 3.42Å; I48-I75 VanDerWaalsContact CG2-CD1 3.42Å; I48-I75 HydrophobicContact CG2-CG2 4.25Å
49	P	80.4	Confident	83.7	Confident	35 Å²	35	67.8 Å²	67.8	23%	0.227	34%	0.338	C	S	.	.			trans	-62.5	131.8	179.8	-22.7	33.1	0	0	0	112.2	V23 I27 E47 R51 I52	V23-P49 HydrophobicContact CG1-CG 3.99Å; I27-P49 HydrophobicContact CD1-CB 3.71Å; I27-P49 HydrophobicContact CD1-CG 3.74Å; E47-P49 WeakPolarHBondContact O-CD 3.43Å; P49-R51 PolarHBondContact O-N 3.15Å; P49-R51 VanDerWaalsContact O-N 3.15Å; P49-I52 WeakPolarHBondContact O-CG1 3.42Å; P49-I52 PolarHBondContact O-N 3.35Å; P49-I52 VanDerWaalsContact O-N 3.15Å
50	D	79.2	Confident	84	Confident	111 Å²	111	68.3 Å²	68.3	59%	0.594	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-57.8	-32.5	-177.4	-72.7	-28.7	0	0	0	112.9	I48 I52 S53	I48-D50 PolarHBondContact O-N 3.3Å; D50-I52 PolarHBondContact O-N 3.43Å; D50-S53 WeakPolarHBondContact O-CB 3.49Å; D50-S53 PolarHBondContact O-N 2.87Å; D50-S53 PolarHBondContact O-OG 3.43Å
51	R	79.3	Confident	84.2	Confident	146 Å²	146	68.5 Å²	68.5	55%	0.551	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-55.5	-15.7	178.4	-69.6	-170.1	-179.9	-171.9	3	114.8	I27 P49 S53 D54	I27-R51 HydrophobicContact CG2-CB 3.81Å; P49-R51 PolarHBondContact O-N 3.15Å; P49-R51 VanDerWaalsContact O-N 3.15Å; R51-S53 PolarHBondContact O-N 2.97Å; R51-D54 WeakPolarHBondContact O-CB 3.32Å; R51-D54 PolarHBondContact O-N 2.91Å
52	I	81.5	Confident	84.5	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-67.3	-21.1	173.8	-64.3	173.9	0	0	0	111.3	I27 L38 L40 I48 P49 D50 D54 L55 L58 F63 I75 L79	I27-I52 HydrophobicContact CD1-CD1 4.09Å; I27-I52 HydrophobicContact CD1-CG1 3.85Å; I27-I52 HydrophobicContact CG1-CG1 4.16Å; I27-I52 HydrophobicContact CG2-CG1 4.32Å; L38-I52 HydrophobicContact CD2-CD1 4Å; L38-I52 HydrophobicContact CD2-CG1 3.98Å; L38-I52 HydrophobicContact CD2-CG2 4.46Å; L40-I52 HydrophobicContact CD1-CD1 3.95Å; I48-I52 HydrophobicContact CG2-CD1 3.83Å; P49-I52 WeakPolarHBondContact O-CG1 3.42Å; P49-I52 PolarHBondContact O-N 3.35Å; P49-I52 VanDerWaalsContact O-N 3.15Å; D50-I52 PolarHBondContact O-N 3.43Å; I52-D54 PolarHBondContact O-N 3.23Å; I52-D54 VanDerWaalsContact O-N 3.16Å; I52-L55 WeakPolarHBondContact O-CB 3.48Å; I52-L55 PolarHBondContact O-N 3.26Å; I52-L58 HydrophobicContact CG2-CD2 4.41Å; I52-F63 HydrophobicContact CD1-CE1 4.34Å; I52-F63 HydrophobicContact CD1-CE2 4.19Å; I52-F63 HydrophobicContact CD1-CZ 3.42Å; I52-F63 VanDerWaalsContact CD1-CZ 3.42Å; I52-I75 HydrophobicContact CG2-CG2 4.36Å; I52-L79 HydrophobicContact CG2-CD1 4.03Å; I52-L79 HydrophobicContact CG2-CD2 4.25Å
53	S	80.4	Confident	84.8	Confident	45 Å²	45	62 Å²	62	32%	0.315	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-58.1	-24.5	171.4	62.4	0	0	0	0	113.3	D50 R51 L55	D50-S53 WeakPolarHBondContact O-CB 3.49Å; D50-S53 PolarHBondContact O-N 2.87Å; D50-S53 PolarHBondContact O-OG 3.43Å; R51-S53 PolarHBondContact O-N 2.97Å; S53-L55 PolarHBondContact O-N 2.97Å
54	D	82.4	Confident	85	Confident	97 Å²	97	58.8 Å²	58.8	52%	0.519	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-79.5	5.2	-177.9	-58.1	-20.8	0	0	0	112.8	V31 R51 I52 P56	V31-D54 HydrophobicContact CG2-CB 4.16Å; R51-D54 WeakPolarHBondContact O-CB 3.32Å; R51-D54 PolarHBondContact O-N 2.91Å; I52-D54 PolarHBondContact O-N 3.23Å; I52-D54 VanDerWaalsContact O-N 3.16Å; D54-P56 WeakPolarHBondContact O-CD 3.41Å
55	L	84.3	Confident	85.5	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.026	28%	0.283	C	S	.	.			trans	-111	67.3	179.1	-63.2	170.7	0	0	0	111.9	A30 V31 L38 I52 S53 N57 L58 L79	A30-L55 HydrophobicContact CB-CD1 4.25Å; A30-L55 HydrophobicContact CB-CD2 4.46Å; A30-L55 WeakPolarHBondContact O-CD2 3.36Å; V31-L55 HydrophobicContact CB-CD2 4.22Å; V31-L55 HydrophobicContact CG2-CD1 4.48Å; V31-L55 HydrophobicContact CG2-CD2 3.66Å; V31-L55 HydrophobicContact CG2-CG 3.88Å; L38-L55 HydrophobicContact CD2-CD1 3.96Å; I52-L55 WeakPolarHBondContact O-CB 3.48Å; I52-L55 PolarHBondContact O-N 3.26Å; S53-L55 PolarHBondContact O-N 2.97Å; L55-N57 PolarHBondContact O-N 3.24Å; L55-N57 VanDerWaalsContact O-N 3.08Å; L55-L58 HydrophobicContact CB-CB 4.16Å; L55-L58 HydrophobicContact CD1-CD1 4.39Å; L55-L58 WeakPolarHBondContact O-CB 3.31Å; L55-L58 PolarHBondContact O-N 3.41Å; L55-L58 VanDerWaalsContact O-N 3.11Å; L55-L79 WeakPolarHBondContact O-CD2 3.42Å
56	P	81.8	Confident	85.9	Confident	69 Å²	69	56.8 Å²	56.8	45%	0.448	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.3	-173.9	26.8	-36.2	0	0	0	113.9	D54	D54-P56 WeakPolarHBondContact O-CD 3.41Å
57	N	84.7	Confident	86	Confident	89 Å²	89	51.9 Å²	51.9	48%	0.476	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	8.4	-178.8	-64.9	-44.5	0	0	0	113.5	L55 Q59	L55-N57 PolarHBondContact O-N 3.24Å; L55-N57 VanDerWaalsContact O-N 3.08Å; N57-Q59 PolarHBondContact O-N 3.42Å
58	L	89.6	Confident	86.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.			trans	-65.4	124.9	-177.8	-161.5	71.6	0	0	0	110.3	S35 L38 I52 L55 L61 L79 Q81 L82	S35-L58 WeakPolarHBondContact O-CD1 3.49Å; L38-L58 HydrophobicContact CB-CD1 3.77Å; L38-L58 HydrophobicContact CB-CD2 4.14Å; I52-L58 HydrophobicContact CG2-CD2 4.41Å; L55-L58 HydrophobicContact CB-CB 4.16Å; L55-L58 HydrophobicContact CD1-CD1 4.39Å; L55-L58 WeakPolarHBondContact O-CB 3.31Å; L55-L58 PolarHBondContact O-N 3.41Å; L55-L58 VanDerWaalsContact O-N 3.11Å; L58-L61 HydrophobicContact CD2-CB 3.98Å; L58-L61 HydrophobicContact CD2-CD1 3.81Å; L58-L61 HydrophobicContact CD2-CD2 4.38Å; L58-L61 HydrophobicContact CD2-CG 4.28Å; L58-L79 HydrophobicContact CB-CD2 4.03Å; L58-L79 HydrophobicContact CD2-CD2 4.25Å; L58-Q81 CarbonylContact O-C 3.41Å; L58-Q81 VanDerWaalsContact O-C 3.32Å; L58-L82 HydrophobicContact CB-CD1 4.45Å; L58-L82 HydrophobicContact CD2-CD1 4.23Å; L58-L82 HydrophobicContact CG-CD1 4.22Å; L58-L82 VanDerWaalsContact O-CA 3.29Å; L58-L82 WeakPolarHBondContact O-CA 3.49Å; L58-L82 PolarHBondContact O-N 3.24Å
59	Q	91.5	Very high	86.6	Confident	65 Å²	65	51.4 Å²	51.4	30%	0.304	26%	0.262	S	S	.	.			trans	-105.9	-28.1	-179.3	-64.9	-177.8	1.9	0	0	112.5	C36 N57 R83 W84	C36-Q59 HydrophobicContact CB-CG 4.41Å; C36-Q59 WeakPolarHBondContact O-CA 3.47Å; C36-Q59 PolarHBondContact O-N 2.87Å; N57-Q59 PolarHBondContact O-N 3.42Å; Q59-R83 WeakPolarHBondContact O-CA 3.44Å; Q59-R83 PolarHBondContact O-N 2.99Å; Q59-W84 PolarHBondContact O-N 3Å
60	K	92.5	Very high	86.9	Confident	94 Å²	94	52.3 Å²	52.3	41%	0.409	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.7	-178.8	-54.7	-172.1	-179.4	-178.5	0	110.1	C36 S37 L38 Y62 W84	C36-K60 PolarHBondContact O-N 2.92Å; S37-K60 CarbonylContact C-O 3.55Å; S37-K60 VanDerWaalsContact CA-O 3.29Å; S37-K60 WeakPolarHBondContact CA-O 3.44Å; L38-K60 PolarHBondContact N-O 3.27Å; K60-Y62 HydrophobicContact CB-CE2 3.97Å; K60-W84 WeakPolarHBondContact CA-O 3.5Å; K60-W84 HydrophobicContact CB-CB 4.2Å; K60-W84 HydrophobicContact CG-CB 3.97Å
61	L	91.5	Very high	87.2	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.2	178.3	-176.7	61	0	0	0	108.8	L38 L58 F63 L79 L82 W84 L85 D86	L38-L61 HydrophobicContact CB-CD1 4.02Å; L38-L61 HydrophobicContact CD2-CD1 3.94Å; L38-L61 HydrophobicContact CG-CD1 4.16Å; L58-L61 HydrophobicContact CD2-CB 3.98Å; L58-L61 HydrophobicContact CD2-CD1 3.81Å; L58-L61 HydrophobicContact CD2-CD2 4.38Å; L58-L61 HydrophobicContact CD2-CG 4.28Å; L61-F63 HydrophobicContact CD1-CD2 4.14Å; L61-F63 HydrophobicContact CD1-CE2 3.74Å; L61-F63 HydrophobicContact CD1-CZ 4.09Å; L61-F63 HydrophobicContact CD2-CD2 3.9Å; L61-F63 HydrophobicContact CD2-CE2 3.58Å; L61-F63 HydrophobicContact CG-CD2 3.79Å; L61-F63 HydrophobicContact CG-CE2 3.74Å; L61-L79 HydrophobicContact CD2-CD1 3.99Å; L61-L82 HydrophobicContact CB-CD1 3.74Å; L61-L82 HydrophobicContact CB-CD2 4.38Å; L61-W84 PolarHBondContact N-O 2.91Å; L61-L85 HydrophobicContact CB-CD1 4.17Å; L61-L85 HydrophobicContact CD2-CD1 3.91Å; L61-L85 HydrophobicContact CG-CD1 4.2Å; L61-D86 PolarHBondContact O-N 3.45Å
62	Y	92.4	Very high	87.5	Confident	39 Å²	39	42.5 Å²	42.5	15%	0.153	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117	178	-50.8	-89.8	0	0	0	111.6	L38 D39 L40 K60 W84 D86	L38-Y62 PolarHBondContact O-N 2.66Å; D39-Y62 HydrophobicContact CB-CD2 4.22Å; L40-Y62 CarbonylContact C-O 3.58Å; L40-Y62 WeakPolarHBondContact CA-O 3.43Å; L40-Y62 PolarHBondContact N-O 3.44Å; K60-Y62 HydrophobicContact CB-CE2 3.97Å; Y62-W84 AromaticContact CD1-NE1 3.93Å; Y62-W84 AromaticContact CE1-CD1 3.7Å; Y62-W84 AromaticContact CE1-NE1 3.43Å; Y62-D86 HydrophobicContact CD1-CB 3.83Å
63	F	91.1	Very high	87.5	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.25	C	S	.	.			trans	-124.8	17.7	178.3	-84.2	-49.5	0	0	0	112.6	L40 L45 I48 I52 L61 N66 L68 D86 L87 N90	L40-F63 HydrophobicContact CB-CD1 3.83Å; L40-F63 HydrophobicContact CB-CE1 3.63Å; L40-F63 HydrophobicContact CD1-CE1 3.52Å; L40-F63 HydrophobicContact CD1-CZ 3.95Å; L40-F63 HydrophobicContact CG-CE1 4.2Å; L45-F63 HydrophobicContact CD1-CD1 4.04Å; L45-F63 HydrophobicContact CD1-CE1 3.65Å; I48-F63 HydrophobicContact CB-CE2 4.37Å; I48-F63 HydrophobicContact CB-CZ 4.38Å; I48-F63 HydrophobicContact CD1-CD2 4.21Å; I48-F63 HydrophobicContact CD1-CE2 3.9Å; I48-F63 HydrophobicContact CG1-CD2 4.36Å; I48-F63 HydrophobicContact CG1-CE2 3.89Å; I48-F63 HydrophobicContact CG1-CZ 4.2Å; I48-F63 HydrophobicContact CG2-CE2 3.66Å; I48-F63 HydrophobicContact CG2-CZ 3.66Å; I52-F63 HydrophobicContact CD1-CE1 4.34Å; I52-F63 HydrophobicContact CD1-CE2 4.19Å; I52-F63 HydrophobicContact CD1-CZ 3.42Å; I52-F63 VanDerWaalsContact CD1-CZ 3.42Å; L61-F63 HydrophobicContact CD1-CD2 4.14Å; L61-F63 HydrophobicContact CD1-CE2 3.74Å; L61-F63 HydrophobicContact CD1-CZ 4.09Å; L61-F63 HydrophobicContact CD2-CD2 3.9Å; L61-F63 HydrophobicContact CD2-CE2 3.58Å; L61-F63 HydrophobicContact CG-CD2 3.79Å; L61-F63 HydrophobicContact CG-CE2 3.74Å; F63-N66 PolarHBondContact O-ND2 3.5Å; F63-L68 HydrophobicContact CB-CD1 3.9Å; F63-L68 HydrophobicContact CD1-CD1 4.37Å; F63-L68 HydrophobicContact CD2-CD1 4.34Å; F63-L68 HydrophobicContact CG-CD1 4Å; F63-D86 CarbonylContact C-O 3.32Å; F63-D86 WeakPolarHBondContact CA-O 3.35Å; F63-D86 WeakPolarHBondContact CB-O 3.38Å; F63-D86 PolarHBondContact N-O 2.71Å; F63-L87 HydrophobicContact CB-CD2 3.81Å; F63-L87 HydrophobicContact CD2-CD2 4.06Å; F63-L87 HydrophobicContact CG-CD2 4.39Å; F63-N90 PolarHBondContact O-ND2 2.88Å
64	S	89.1	Confident	87.5	Confident	10 Å²	10	48.6 Å²	48.6	7%	0.07	27%	0.266	C	S	.	.			trans	-61.1	148.1	-178.8	67.3	0	0	0	0	111.9	K41 N42 D86 R88	K41-S64 VanDerWaalsContact CA-O 3.26Å; K41-S64 WeakPolarHBondContact CA-O 3.45Å; K41-S64 VanDerWaalsContact CD-OG 3.32Å; K41-S64 WeakPolarHBondContact CD-OG 3.37Å; K41-S64 WeakPolarHBondContact CG-OG 3.35Å; N42-S64 PolarHBondContact N-O 3.1Å; S64-D86 PolarHBondContact N-O 3.3Å; S64-R88 CarbonylContact C-O 3.01Å; S64-R88 WeakPolarHBondContact CA-O 3.36Å
65	N	90.5	Very high	87.5	Confident	69 Å²	69	44.2 Å²	44.2	37%	0.369	24%	0.242	S	C	.	.	S	Bend	trans	57	57.8	-178.9	-64.3	-17.4	0	0	0	112.5	N42 R88 D89	N42-N65 VanDerWaalsContact CA-O 3.27Å; N42-N65 WeakPolarHBondContact CA-O 3.34Å; N42-N65 PolarHBondContact N-O 2.66Å; N42-N65 WeakPolarHBondContact OD1-CB 3.37Å; N42-N65 PolarHBondContact OD1-ND2 3.37Å; N65-R88 PolarHBondContact N-O 3.47Å; N65-D89 VanDerWaalsContact CA-O 3.23Å; N65-D89 WeakPolarHBondContact CA-O 3.46Å; N65-D89 HydrophobicContact CB-CB 4.49Å; N65-D89 PolarHBondContact N-O 3.17Å; N65-D89 WeakPolarHBondContact OD1-CB 3.4Å; N65-D89 VanDerWaalsContact OD1-CG 3.24Å; N65-D89 PolarHBondContact OD1-OD2 3.07Å
66	N	90.5	Very high	87.4	Confident	9 Å²	9	44.2 Å²	44.2	5%	0.048	24%	0.242	C	C	.	.	S	Bend	trans	-125.4	-179	169.6	-76.5	-65.3	0	0	0	109.2	L40 R43 N44 L45 F63 L68 D89 N90	L40-N66 PolarHBondContact O-ND2 3.25Å; R43-N66 VanDerWaalsContact C-OD1 3.28Å; R43-N66 WeakPolarHBondContact CA-OD1 3.37Å; R43-N66 PolarHBondContact N-OD1 2.99Å; N44-N66 PolarHBondContact N-OD1 3.23Å; N44-N66 VanDerWaalsContact N-OD1 3.11Å; L45-N66 HydrophobicContact CB-CB 4.14Å; L45-N66 PolarHBondContact N-OD1 2.94Å; L45-N66 VanDerWaalsContact N-OD1 3.11Å; F63-N66 PolarHBondContact O-ND2 3.5Å; N66-L68 HydrophobicContact CB-CG 4.05Å; N66-D89 PolarHBondContact N-O 3.28Å; N66-D89 VanDerWaalsContact O-O 3.12Å; N66-N90 VanDerWaalsContact CA-OD1 3.31Å; N66-N90 WeakPolarHBondContact CA-OD1 3.46Å; N66-N90 WeakPolarHBondContact CB-OD1 3.31Å; N66-N90 PolarHBondContact N-OD1 3.4Å; N66-N90 WeakPolarHBondContact O-CA 3.33Å; N66-N90 PolarHBondContact O-OD1 3.35Å; N66-N90 VanDerWaalsContact O-OD1 3.05Å
67	S	87.9	Confident	87.4	Confident	52 Å²	52	43.1 Å²	43.1	36%	0.364	24%	0.235	S	C	.	.			trans	-103.6	30.8	177.4	-69.4	0	0	0	0	112.2	L45 K69	L45-S67 CarbonylContact O-C 3.5Å; L45-S67 VanDerWaalsContact O-CA 3.25Å; L45-S67 WeakPolarHBondContact O-CA 3.4Å; L45-S67 PolarHBondContact O-N 3.33Å; S67-K69 PolarHBondContact O-N 3.01Å
68	L	89.5	Confident	87.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.223	C	C	.	.			trans	-64.1	123.7	-173.4	-61.9	175.2	0	0	0	110.8	L45 K46 I48 F63 N66 L87 N90 S91 L92	L45-L68 HydrophobicContact CB-CD2 4.02Å; L45-L68 PolarHBondContact O-N 3.39Å; L45-L68 VanDerWaalsContact O-N 3.13Å; K46-L68 WeakPolarHBondContact O-CA 3.37Å; I48-L68 HydrophobicContact CD1-CD1 4.33Å; I48-L68 HydrophobicContact CG1-CD1 3.9Å; I48-L68 HydrophobicContact CG1-CD2 3.84Å; F63-L68 HydrophobicContact CB-CD1 3.9Å; F63-L68 HydrophobicContact CD1-CD1 4.37Å; F63-L68 HydrophobicContact CD2-CD1 4.34Å; F63-L68 HydrophobicContact CG-CD1 4Å; N66-L68 HydrophobicContact CB-CG 4.05Å; L68-L87 HydrophobicContact CD1-CD2 3.97Å; L68-N90 HydrophobicContact CB-CB 4.21Å; L68-N90 VanDerWaalsContact CB-OD1 3.23Å; L68-N90 WeakPolarHBondContact CB-OD1 3.4Å; L68-N90 VanDerWaalsContact CG-OD1 3.23Å; L68-N90 WeakPolarHBondContact CG-OD1 3.28Å; L68-N90 PolarHBondContact N-OD1 2.74Å; L68-S91 CarbonylContact O-C 3.5Å; L68-S91 VanDerWaalsContact O-CA 3.24Å; L68-S91 WeakPolarHBondContact O-CA 3.35Å; L68-S91 PolarHBondContact O-N 2.87Å; L68-L92 HydrophobicContact CB-CD2 3.99Å; L68-L92 PolarHBondContact O-N 3.19Å; L68-L92 VanDerWaalsContact O-N 3.09Å
69	K	88.2	Confident	87.3	Confident	141 Å²	141	40.3 Å²	40.3	61%	0.613	22%	0.223	S	C	*	.			trans	-92.4	-34.8	178.6	-67.8	-178	-179.2	175.9	0	113.5	K46 S67 T93	K46-K69 PolarHBondContact O-N 3.12Å; S67-K69 PolarHBondContact O-N 3.01Å; K69-T93 PolarHBondContact O-N 2.91Å
70	A	86.3	Confident	87	Confident	54 Å²	54	39.7 Å²	39.7	45%	0.446	23%	0.226	S	C	.	.			trans	-146.8	160.7	-178.4	0	0	0	0	0	110.4
71	I	86.5	Confident	86.8	Confident	12 Å²	12	38.6 Å²	38.6	6%	0.062	22%	0.222	C	C	.	.			trans	-106.7	120.8	172.1	-57.8	170	0	0	0	106.9	I48 P73 L76 L87 L92 P96	I48-I71 HydrophobicContact CD1-CG1 4.36Å; I48-I71 HydrophobicContact CD1-CG2 4.1Å; I71-P73 WeakPolarHBondContact O-CD 3.47Å; I71-L76 HydrophobicContact CG2-CD1 3.93Å; I71-L76 HydrophobicContact CG2-CD2 3.82Å; I71-L76 HydrophobicContact CG2-CG 3.75Å; I71-L87 HydrophobicContact CD1-CD1 3.61Å; I71-L92 HydrophobicContact CD1-CD1 4.11Å; I71-L92 HydrophobicContact CG1-CD1 4.28Å; I71-L92 HydrophobicContact CG1-CD2 3.86Å; I71-P96 HydrophobicContact CB-CG 4.13Å; I71-P96 HydrophobicContact CG2-CG 4.29Å
72	S	85	Confident	86.9	Confident	38 Å²	38	38.4 Å²	38.4	27%	0.266	22%	0.221	S	C	.	.			trans	-63.8	124.9	175.5	-57.2	0	0	0	0	110.2	N74 I75	S72-N74 VanDerWaalsContact C-N 3.29Å; S72-N74 PolarHBondContact O-N 3.04Å; S72-I75 PolarHBondContact O-N 2.9Å
73	P	82.3	Confident	87	Confident	54 Å²	54	41 Å²	41	35%	0.351	23%	0.231	S	C	.	.	H	α-helix	trans	-52.9	-44.5	-178.1	-30.8	36.7	0	0	0	113.4	I71 I75 L76 T77 P96 E98	I71-P73 WeakPolarHBondContact O-CD 3.47Å; P73-I75 PolarHBondContact O-N 3.42Å; P73-I75 VanDerWaalsContact O-N 3.12Å; P73-L76 PolarHBondContact O-N 3.4Å; P73-T77 WeakPolarHBondContact O-CG2 3.44Å; P73-T77 PolarHBondContact O-N 3.47Å; P73-P96 HydrophobicContact CG-CB 4.41Å; P73-E98 HydrophobicContact CB-CB 4.43Å; P73-E98 HydrophobicContact CB-CG 3.89Å
74	N	80.5	Confident	87.2	Confident	120 Å²	120	45 Å²	45	64%	0.642	25%	0.246	S	C	*	.	H	α-helix	trans	-54.8	-34.9	-177	-69	-6.2	0	0	0	112.9	S72 T77 A78	S72-N74 VanDerWaalsContact C-N 3.29Å; S72-N74 PolarHBondContact O-N 3.04Å; N74-T77 PolarHBondContact O-N 3.44Å; N74-T77 PolarHBondContact O-OG1 2.92Å; N74-A78 PolarHBondContact O-N 2.93Å
75	I	81.3	Confident	87.5	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-69.9	-41.1	-178	-56.8	177.9	0	0	0	110.6	I48 I52 S72 P73 T77 A78 L79	I48-I75 HydrophobicContact CB-CD1 3.72Å; I48-I75 HydrophobicContact CG2-CD1 3.42Å; I48-I75 VanDerWaalsContact CG2-CD1 3.42Å; I48-I75 HydrophobicContact CG2-CG2 4.25Å; I52-I75 HydrophobicContact CG2-CG2 4.36Å; S72-I75 PolarHBondContact O-N 2.9Å; P73-I75 PolarHBondContact O-N 3.42Å; P73-I75 VanDerWaalsContact O-N 3.12Å; I75-T77 PolarHBondContact O-N 3.03Å; I75-A78 PolarHBondContact O-N 3.46Å; I75-L79 HydrophobicContact CG2-CD1 3.8Å; I75-L79 HydrophobicContact CG2-CG 4.39Å; I75-L79 VanDerWaalsContact O-CG 3.31Å; I75-L79 WeakPolarHBondContact O-CG 3.45Å; I75-L79 PolarHBondContact O-N 2.82Å
76	L	82.9	Confident	87.7	Confident	6 Å²	6	41.6 Å²	41.6	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-65.4	-28.8	174.8	-59.1	-175.1	0	0	0	111.9	I71 P73 P96 E98 I99 L102	I71-L76 HydrophobicContact CG2-CD1 3.93Å; I71-L76 HydrophobicContact CG2-CD2 3.82Å; I71-L76 HydrophobicContact CG2-CG 3.75Å; P73-L76 PolarHBondContact O-N 3.4Å; L76-P96 HydrophobicContact CD1-CG 3.47Å; L76-P96 VanDerWaalsContact CD1-CG 3.47Å; L76-E98 HydrophobicContact CB-CB 4.47Å; L76-I99 HydrophobicContact CD1-CB 4.19Å; L76-L102 HydrophobicContact CD2-CD1 3.97Å; L76-L102 VanDerWaalsContact O-CD2 3.25Å; L76-L102 WeakPolarHBondContact O-CD2 3.39Å
77	T	81.8	Confident	87.8	Confident	46 Å²	46	41.2 Å²	41.2	28%	0.282	23%	0.225	S	C	.	.	H	α-helix	trans	-71.2	-32.2	176.9	76.1	0	0	0	0	113.3	P73 N74 I75 E98 R101	P73-T77 WeakPolarHBondContact O-CG2 3.44Å; P73-T77 PolarHBondContact O-N 3.47Å; N74-T77 PolarHBondContact O-N 3.44Å; N74-T77 PolarHBondContact O-OG1 2.92Å; I75-T77 PolarHBondContact O-N 3.03Å; T77-E98 HydrophobicContact CG2-CB 4.29Å; T77-E98 HydrophobicContact CG2-CG 4.21Å; T77-R101 VanDerWaalsContact CB-NH1 3.28Å; T77-R101 VanDerWaalsContact CG2-CZ 3.43Å
78	A	83.4	Confident	88.1	Confident	28 Å²	28	42.6 Å²	42.6	23%	0.231	22%	0.222	C	C	.	.	H	α-helix	trans	-79.3	-34.8	-179.1	0	0	0	0	0	112.6	N74 I75 S80	N74-A78 PolarHBondContact O-N 2.93Å; I75-A78 PolarHBondContact O-N 3.46Å; A78-S80 VanDerWaalsContact C-N 3.28Å; A78-S80 PolarHBondContact O-N 3.1Å
79	L	88	Confident	88.3	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.238	C	C	.	.			trans	-86	45.2	-171.3	-59.7	177.3	0	0	0	114.2	I52 L55 L58 L61 I75 Q81 L82 L102	I52-L79 HydrophobicContact CG2-CD1 4.03Å; I52-L79 HydrophobicContact CG2-CD2 4.25Å; L55-L79 WeakPolarHBondContact O-CD2 3.42Å; L58-L79 HydrophobicContact CB-CD2 4.03Å; L58-L79 HydrophobicContact CD2-CD2 4.25Å; L61-L79 HydrophobicContact CD2-CD1 3.99Å; I75-L79 HydrophobicContact CG2-CD1 3.8Å; I75-L79 HydrophobicContact CG2-CG 4.39Å; I75-L79 VanDerWaalsContact O-CG 3.31Å; I75-L79 WeakPolarHBondContact O-CG 3.45Å; I75-L79 PolarHBondContact O-N 2.82Å; L79-Q81 PolarHBondContact O-N 3.23Å; L79-L82 HydrophobicContact CB-CB 4.29Å; L79-L82 VanDerWaalsContact O-CB 3.26Å; L79-L82 WeakPolarHBondContact O-CB 3.3Å; L79-L82 PolarHBondContact O-N 2.9Å; L79-L102 HydrophobicContact CB-CD2 4.2Å; L79-L102 WeakPolarHBondContact O-CD2 3.36Å
80	S	85.1	Confident	88.6	Confident	52 Å²	52	39.2 Å²	39.2	36%	0.364	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-25.5	-175.5	60.2	0	0	0	0	115.8	A78	A78-S80 VanDerWaalsContact C-N 3.28Å; A78-S80 PolarHBondContact O-N 3.1Å
81	Q	89.8	Confident	88.8	Confident	71 Å²	71	38.5 Å²	38.5	33%	0.332	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	5.1	-179.1	-64.8	-61.2	-47.8	0	0	114.4	L58 L79 R83	L58-Q81 CarbonylContact O-C 3.41Å; L58-Q81 VanDerWaalsContact O-C 3.32Å; L79-Q81 PolarHBondContact O-N 3.23Å; Q81-R83 PolarHBondContact O-N 3.03Å
82	L	93.1	Very high	89.1	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.			trans	-69	125.7	-175	-161.5	72.8	0	0	0	111.4	L58 L61 L79 L85 L102 E104 L105	L58-L82 HydrophobicContact CB-CD1 4.45Å; L58-L82 HydrophobicContact CD2-CD1 4.23Å; L58-L82 HydrophobicContact CG-CD1 4.22Å; L58-L82 VanDerWaalsContact O-CA 3.29Å; L58-L82 WeakPolarHBondContact O-CA 3.49Å; L58-L82 PolarHBondContact O-N 3.24Å; L61-L82 HydrophobicContact CB-CD1 3.74Å; L61-L82 HydrophobicContact CB-CD2 4.38Å; L79-L82 HydrophobicContact CB-CB 4.29Å; L79-L82 VanDerWaalsContact O-CB 3.26Å; L79-L82 WeakPolarHBondContact O-CB 3.3Å; L79-L82 PolarHBondContact O-N 2.9Å; L82-L85 HydrophobicContact CD2-CB 3.9Å; L82-L85 HydrophobicContact CD2-CD1 4.1Å; L82-L85 HydrophobicContact CD2-CD2 4.19Å; L82-L85 HydrophobicContact CD2-CG 4.29Å; L82-L102 HydrophobicContact CB-CD2 4.24Å; L82-L102 HydrophobicContact CD2-CD1 4.2Å; L82-E104 CarbonylContact O-C 3.07Å; L82-E104 VanDerWaalsContact O-C 3.24Å; L82-L105 HydrophobicContact CD2-CD1 4.39Å; L82-L105 HydrophobicContact CG-CD1 4.4Å; L82-L105 WeakPolarHBondContact O-CA 3.47Å; L82-L105 PolarHBondContact O-N 3.3Å; L82-L105 VanDerWaalsContact O-N 3.11Å
83	R	94.6	Very high	89.4	Confident	93 Å²	93	39.8 Å²	39.8	35%	0.351	21%	0.209	S	C	.	.			trans	-108.3	-30.4	-179.7	-62.2	-176.1	176.7	178.2	-0	112.9	Q59 Q81 E104 Q106 T107	Q59-R83 WeakPolarHBondContact O-CA 3.44Å; Q59-R83 PolarHBondContact O-N 2.99Å; Q81-R83 PolarHBondContact O-N 3.03Å; R83-E104 HydrophobicContact CG-CB 4.27Å; R83-Q106 PolarHBondContact O-N 2.98Å; R83-T107 PolarHBondContact O-N 2.82Å
84	W	95.6	Very high	89.8	Confident	86 Å²	86	40.2 Å²	40.2	33%	0.326	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	118.2	-177	-172	-70.5	0	0	0	109.6	Q59 K60 L61 Y62 T107 L109	Q59-W84 PolarHBondContact O-N 3Å; K60-W84 WeakPolarHBondContact CA-O 3.5Å; K60-W84 HydrophobicContact CB-CB 4.2Å; K60-W84 HydrophobicContact CG-CB 3.97Å; L61-W84 PolarHBondContact N-O 2.91Å; Y62-W84 AromaticContact CD1-NE1 3.93Å; Y62-W84 AromaticContact CE1-CD1 3.7Å; Y62-W84 AromaticContact CE1-NE1 3.43Å; W84-T107 HydrophobicContact CD2-CG2 4.09Å; W84-T107 HydrophobicContact CE3-CG2 3.9Å; W84-T107 HydrophobicContact CH2-CG2 4.05Å; W84-T107 HydrophobicContact CZ2-CG2 4.22Å; W84-T107 HydrophobicContact CZ3-CG2 3.88Å; W84-L109 HydrophobicContact CZ2-CD1 3.78Å
85	L	94.4	Very high	90.3	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.026	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	113.7	176	-179.9	53.3	0	0	0	109.1	L61 L82 L87 L102 L105 T107 L108 L109	L61-L85 HydrophobicContact CB-CD1 4.17Å; L61-L85 HydrophobicContact CD2-CD1 3.91Å; L61-L85 HydrophobicContact CG-CD1 4.2Å; L82-L85 HydrophobicContact CD2-CB 3.9Å; L82-L85 HydrophobicContact CD2-CD1 4.1Å; L82-L85 HydrophobicContact CD2-CD2 4.19Å; L82-L85 HydrophobicContact CD2-CG 4.29Å; L85-L87 HydrophobicContact CD1-CD1 4.07Å; L85-L87 HydrophobicContact CD1-CD2 4.25Å; L85-L87 HydrophobicContact CD1-CG 3.89Å; L85-L87 HydrophobicContact CD2-CD1 3.82Å; L85-L87 HydrophobicContact CG-CD1 3.76Å; L85-L87 HydrophobicContact CG-CG 3.96Å; L85-L102 HydrophobicContact CD2-CD1 4.41Å; L85-L105 HydrophobicContact CB-CD1 3.89Å; L85-T107 PolarHBondContact N-O 3.47Å; L85-L108 HydrophobicContact CB-CD1 3.99Å; L85-L108 HydrophobicContact CD2-CD1 3.8Å; L85-L108 HydrophobicContact CG-CD1 3.89Å; L85-L109 PolarHBondContact O-N 2.99Å
86	D	94.3	Very high	90.7	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	109.8	178.4	-172.3	1.9	0	0	0	110.4	L61 Y62 F63 S64 R88 L109	L61-D86 PolarHBondContact O-N 3.45Å; Y62-D86 HydrophobicContact CD1-CB 3.83Å; F63-D86 CarbonylContact C-O 3.32Å; F63-D86 WeakPolarHBondContact CA-O 3.35Å; F63-D86 WeakPolarHBondContact CB-O 3.38Å; F63-D86 PolarHBondContact N-O 2.71Å; S64-D86 PolarHBondContact N-O 3.3Å; D86-R88 WeakPolarHBondContact OD1-CG 3.36Å; D86-R88 IonicContact OD1-CZ 3.4Å; D86-R88 PolarHBondContact OD1-N 3.45Å; D86-R88 IonicContact OD1-NE 3.83Å; D86-R88 PolarHBondContact OD1-NE 3.15Å; D86-R88 IonicContact OD1-NH2 2.74Å; D86-R88 IonicContact OD2-CZ 2.85Å; D86-R88 IonicContact OD2-NE 3.45Å; D86-R88 PolarHBondContact OD2-NE 3.28Å; D86-R88 IonicContact OD2-NH2 3.23Å; D86-R88 PolarHBondContact OD2-NH2 3.14Å; D86-L109 HydrophobicContact CB-CD1 4.21Å
87	L	93.8	Very high	90.9	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	20%	0.203	C	C	.	.			trans	-122.5	20.1	-178.2	-67.4	164.8	0	0	0	111.2	F63 L68 I71 L85 N90 L92 L108 L109 I110 N113	F63-L87 HydrophobicContact CB-CD2 3.81Å; F63-L87 HydrophobicContact CD2-CD2 4.06Å; F63-L87 HydrophobicContact CG-CD2 4.39Å; L68-L87 HydrophobicContact CD1-CD2 3.97Å; I71-L87 HydrophobicContact CD1-CD1 3.61Å; L85-L87 HydrophobicContact CD1-CD1 4.07Å; L85-L87 HydrophobicContact CD1-CD2 4.25Å; L85-L87 HydrophobicContact CD1-CG 3.89Å; L85-L87 HydrophobicContact CD2-CD1 3.82Å; L85-L87 HydrophobicContact CG-CD1 3.76Å; L85-L87 HydrophobicContact CG-CG 3.96Å; L87-N90 PolarHBondContact O-ND2 3.34Å; L87-L92 HydrophobicContact CB-CD1 3.92Å; L87-L92 HydrophobicContact CD1-CD1 3.96Å; L87-L92 HydrophobicContact CD2-CD1 4.32Å; L87-L92 HydrophobicContact CG-CD1 4.31Å; L87-L108 HydrophobicContact CD1-CD1 4.48Å; L87-L109 CarbonylContact C-O 3.24Å; L87-L109 WeakPolarHBondContact CA-O 3.4Å; L87-L109 PolarHBondContact N-O 3.44Å; L87-I110 HydrophobicContact CB-CG2 4.25Å; L87-I110 HydrophobicContact CD1-CG2 4.3Å; L87-N113 PolarHBondContact O-ND2 3.27Å
88	R	94.8	Very high	91.3	Very high	81 Å²	81	37.8 Å²	37.8	31%	0.306	20%	0.201	S	C	.	.			trans	-60.7	152.5	-178.7	-66.3	176.8	-72.2	164.8	4.1	111.7	S64 N65 D86 N90 L109 D111	S64-R88 CarbonylContact C-O 3.01Å; S64-R88 WeakPolarHBondContact CA-O 3.36Å; N65-R88 PolarHBondContact N-O 3.47Å; D86-R88 WeakPolarHBondContact OD1-CG 3.36Å; D86-R88 IonicContact OD1-CZ 3.4Å; D86-R88 PolarHBondContact OD1-N 3.45Å; D86-R88 IonicContact OD1-NE 3.83Å; D86-R88 PolarHBondContact OD1-NE 3.15Å; D86-R88 IonicContact OD1-NH2 2.74Å; D86-R88 IonicContact OD2-CZ 2.85Å; D86-R88 IonicContact OD2-NE 3.45Å; D86-R88 PolarHBondContact OD2-NE 3.28Å; D86-R88 IonicContact OD2-NH2 3.23Å; D86-R88 PolarHBondContact OD2-NH2 3.14Å; R88-N90 PolarHBondContact O-N 3.13Å; R88-N90 PolarHBondContact O-ND2 3.19Å; R88-L109 HydrophobicContact CG-CB 3.66Å; R88-L109 PolarHBondContact N-O 2.87Å; R88-D111 CarbonylContact C-O 3.55Å; R88-D111 WeakPolarHBondContact CA-O 3.41Å; R88-D111 HydrophobicContact CG-CB 3.88Å
89	D	93.6	Very high	91.7	Very high	60 Å²	60	36.6 Å²	36.6	32%	0.321	19%	0.191	S	C	.	.	S	Bend	trans	57.1	55.6	174	-55.2	-68	0	0	0	111.7	N65 N66 D111 N112	N65-D89 VanDerWaalsContact CA-O 3.23Å; N65-D89 WeakPolarHBondContact CA-O 3.46Å; N65-D89 HydrophobicContact CB-CB 4.49Å; N65-D89 PolarHBondContact N-O 3.17Å; N65-D89 WeakPolarHBondContact OD1-CB 3.4Å; N65-D89 VanDerWaalsContact OD1-CG 3.24Å; N65-D89 PolarHBondContact OD1-OD2 3.07Å; N66-D89 PolarHBondContact N-O 3.28Å; N66-D89 VanDerWaalsContact O-O 3.12Å; D89-D111 PolarHBondContact N-O 3.42Å; D89-N112 WeakPolarHBondContact CA-O 3.48Å; D89-N112 PolarHBondContact N-O 3.48Å; D89-N112 WeakPolarHBondContact OD1-CB 3.35Å; D89-N112 PolarHBondContact OD1-ND2 3.33Å
90	N	93.7	Very high	91.7	Very high	9 Å²	9	40.7 Å²	40.7	5%	0.048	21%	0.208	C	C	.	.	S	Bend	trans	-129.7	-178.3	176.4	-83.8	-80.2	0	0	0	109.9	F63 N66 L68 L87 R88 L92 N112 N113	F63-N90 PolarHBondContact O-ND2 2.88Å; N66-N90 VanDerWaalsContact CA-OD1 3.31Å; N66-N90 WeakPolarHBondContact CA-OD1 3.46Å; N66-N90 WeakPolarHBondContact CB-OD1 3.31Å; N66-N90 PolarHBondContact N-OD1 3.4Å; N66-N90 WeakPolarHBondContact O-CA 3.33Å; N66-N90 PolarHBondContact O-OD1 3.35Å; N66-N90 VanDerWaalsContact O-OD1 3.05Å; L68-N90 HydrophobicContact CB-CB 4.21Å; L68-N90 VanDerWaalsContact CB-OD1 3.23Å; L68-N90 WeakPolarHBondContact CB-OD1 3.4Å; L68-N90 VanDerWaalsContact CG-OD1 3.23Å; L68-N90 WeakPolarHBondContact CG-OD1 3.28Å; L68-N90 PolarHBondContact N-OD1 2.74Å; L87-N90 PolarHBondContact O-ND2 3.34Å; R88-N90 PolarHBondContact O-N 3.13Å; R88-N90 PolarHBondContact O-ND2 3.19Å; N90-L92 HydrophobicContact CB-CG 4.19Å; N90-N112 PolarHBondContact N-O 3.03Å; N90-N112 VanDerWaalsContact O-O 3.14Å; N90-N113 WeakPolarHBondContact CA-OD1 3.33Å; N90-N113 WeakPolarHBondContact CB-OD1 3.33Å; N90-N113 PolarHBondContact O-OD1 3.31Å
91	S	91.1	Very high	91.9	Very high	40 Å²	40	44.3 Å²	44.3	28%	0.28	21%	0.214	S	C	.	.			trans	-106.8	28.5	177.3	-72.1	0	0	0	0	112.8	L68 T93	L68-S91 CarbonylContact O-C 3.5Å; L68-S91 VanDerWaalsContact O-CA 3.24Å; L68-S91 WeakPolarHBondContact O-CA 3.35Å; L68-S91 PolarHBondContact O-N 2.87Å; S91-T93 PolarHBondContact O-N 3Å
92	L	92.8	Very high	92	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.198	C	C	.	.			trans	-64.9	130.5	-175.1	-63.8	173.8	0	0	0	110.9	L68 I71 L87 N90 N113 K114 I115	L68-L92 HydrophobicContact CB-CD2 3.99Å; L68-L92 PolarHBondContact O-N 3.19Å; L68-L92 VanDerWaalsContact O-N 3.09Å; I71-L92 HydrophobicContact CD1-CD1 4.11Å; I71-L92 HydrophobicContact CG1-CD1 4.28Å; I71-L92 HydrophobicContact CG1-CD2 3.86Å; L87-L92 HydrophobicContact CB-CD1 3.92Å; L87-L92 HydrophobicContact CD1-CD1 3.96Å; L87-L92 HydrophobicContact CD2-CD1 4.32Å; L87-L92 HydrophobicContact CG-CD1 4.31Å; N90-L92 HydrophobicContact CB-CG 4.19Å; L92-N113 HydrophobicContact CB-CB 4.25Å; L92-N113 VanDerWaalsContact CB-OD1 3.23Å; L92-N113 WeakPolarHBondContact CB-OD1 3.44Å; L92-N113 WeakPolarHBondContact CG-OD1 3.34Å; L92-N113 PolarHBondContact N-OD1 2.86Å; L92-K114 CarbonylContact O-C 3.13Å; L92-K114 WeakPolarHBondContact O-CA 3.47Å; L92-K114 WeakPolarHBondContact O-CB 3.34Å; L92-K114 PolarHBondContact O-N 3.33Å; L92-I115 HydrophobicContact CB-CD1 4.4Å; L92-I115 HydrophobicContact CB-CG1 4.16Å; L92-I115 WeakPolarHBondContact O-CG1 3.35Å; L92-I115 PolarHBondContact O-N 3.5Å; L92-I115 VanDerWaalsContact O-N 3.12Å
93	T	90.8	Very high	91.8	Very high	76 Å²	76	47.5 Å²	47.5	47%	0.466	23%	0.229	S	C	.	.			trans	-97.1	-28	179.8	50.5	0	0	0	0	113.1	K69 S91 K114 I115 K116	K69-T93 PolarHBondContact O-N 2.91Å; S91-T93 PolarHBondContact O-N 3Å; T93-K114 HydrophobicContact CG2-CB 4.47Å; T93-I115 WeakPolarHBondContact O-CA 3.42Å; T93-K116 PolarHBondContact O-N 2.9Å
94	S	89.7	Confident	91.6	Very high	63 Å²	63	44.8 Å²	44.8	44%	0.441	22%	0.221	S	C	.	.			trans	-153.2	156.1	178.9	56	0	0	0	0	110.8
95	I	91.6	Very high	91.6	Very high	9 Å²	9	40.7 Å²	40.7	5%	0.046	21%	0.205	C	C	.	.			trans	-101.4	130.2	166.7	-61.1	165	0	0	0	107.4	I99 L108 I110 I115 L118 P119 L122	I95-I99 HydrophobicContact CG2-CB 4.13Å; I95-I99 HydrophobicContact CG2-CD1 3.6Å; I95-I99 HydrophobicContact CG2-CG1 4.4Å; I95-I99 HydrophobicContact CG2-CG2 4.27Å; I95-L108 HydrophobicContact CD1-CD2 4.38Å; I95-I110 HydrophobicContact CD1-CD1 3.77Å; I95-I110 HydrophobicContact CD1-CG2 4.3Å; I95-I115 HydrophobicContact CD1-CD1 4.12Å; I95-I115 HydrophobicContact CG1-CD1 4.05Å; I95-L118 HydrophobicContact CD1-CD2 4.07Å; I95-P119 HydrophobicContact CB-CG 3.96Å; I95-P119 HydrophobicContact CG2-CG 3.94Å; I95-L122 HydrophobicContact CD1-CD1 4.26Å
96	P	89.6	Confident	91.6	Very high	15 Å²	15	44.2 Å²	44.2	10%	0.097	22%	0.221	C	C	.	.			trans	-72.6	151	-178.6	32.8	-38.7	0	0	0	112	I71 P73 L76 E98 I99	I71-P96 HydrophobicContact CB-CG 4.13Å; I71-P96 HydrophobicContact CG2-CG 4.29Å; P73-P96 HydrophobicContact CG-CB 4.41Å; L76-P96 HydrophobicContact CD1-CG 3.47Å; L76-P96 VanDerWaalsContact CD1-CG 3.47Å; P96-E98 WeakPolarHBondContact CB-OE2 3.4Å; P96-E98 PolarHBondContact O-N 3.12Å; P96-I99 PolarHBondContact O-N 3.47Å
97	P	87.9	Confident	91.7	Very high	51 Å²	51	44.6 Å²	44.6	33%	0.331	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-65.2	-20.4	-176.9	27.4	-35.2	0	0	0	113.4	I99 K100 E121	P97-I99 PolarHBondContact O-N 3.32Å; P97-K100 WeakPolarHBondContact O-CG 3.42Å; P97-K100 PolarHBondContact O-N 3.04Å; P97-E121 HydrophobicContact CB-CG 3.84Å; P97-E121 WeakPolarHBondContact CB-OE1 3.3Å; P97-E121 WeakPolarHBondContact O-CB 3.21Å; P97-E121 WeakPolarHBondContact O-CG 3.46Å
98	E	89.7	Confident	91.8	Very high	51 Å²	51	44.5 Å²	44.5	24%	0.238	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-61.3	-10.7	175.3	-68.6	71.8	-157.1	0	0	113.3	P73 L76 T77 P96 K100 R101	P73-E98 HydrophobicContact CB-CB 4.43Å; P73-E98 HydrophobicContact CB-CG 3.89Å; L76-E98 HydrophobicContact CB-CB 4.47Å; T77-E98 HydrophobicContact CG2-CB 4.29Å; T77-E98 HydrophobicContact CG2-CG 4.21Å; P96-E98 WeakPolarHBondContact CB-OE2 3.4Å; P96-E98 PolarHBondContact O-N 3.12Å; E98-K100 PolarHBondContact O-N 3.23Å; E98-R101 WeakPolarHBondContact O-CB 3.36Å; E98-R101 PolarHBondContact O-N 3.25Å
99	I	91.1	Very high	91.8	Very high	2 Å²	2	41 Å²	41	1%	0.01	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-53.4	-26.1	172	-159.5	169.7	0	0	0	112.8	L76 I95 P96 P97 R101 L102 L105 L108 P119 E121 L125	L76-I99 HydrophobicContact CD1-CB 4.19Å; I95-I99 HydrophobicContact CG2-CB 4.13Å; I95-I99 HydrophobicContact CG2-CD1 3.6Å; I95-I99 HydrophobicContact CG2-CG1 4.4Å; I95-I99 HydrophobicContact CG2-CG2 4.27Å; P96-I99 PolarHBondContact O-N 3.47Å; P97-I99 PolarHBondContact O-N 3.32Å; I99-R101 PolarHBondContact O-N 2.86Å; I99-L102 HydrophobicContact CG1-CD1 4.2Å; I99-L102 WeakPolarHBondContact O-CB 3.3Å; I99-L102 PolarHBondContact O-N 3.01Å; I99-L105 HydrophobicContact CD1-CD2 4.42Å; I99-L108 HydrophobicContact CD1-CD2 3.74Å; I99-P119 HydrophobicContact CG2-CG 4.09Å; I99-E121 HydrophobicContact CG2-CB 4.44Å; I99-L125 HydrophobicContact CG1-CD1 4.18Å; I99-L125 WeakPolarHBondContact O-CD2 3.01Å
100	K	87.7	Confident	91.9	Very high	87 Å²	87	38.2 Å²	38.2	38%	0.378	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-53.8	-24.5	173	64.1	-174.4	176.9	-168.7	0	114.5	P97 E98 L102 E121 L124	P97-K100 WeakPolarHBondContact O-CG 3.42Å; P97-K100 PolarHBondContact O-N 3.04Å; E98-K100 PolarHBondContact O-N 3.23Å; K100-L102 VanDerWaalsContact C-N 3.26Å; K100-L102 PolarHBondContact O-N 3.06Å; K100-E121 HydrophobicContact CB-CB 4.08Å; K100-E121 HydrophobicContact CB-CG 4.47Å; K100-E121 HydrophobicContact CD-CG 4.03Å; K100-L124 HydrophobicContact CB-CD1 4.03Å; K100-L124 HydrophobicContact CD-CD1 4.14Å
101	R	89.3	Confident	91.8	Very high	128 Å²	128	38.6 Å²	38.6	48%	0.483	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-75.7	-15.2	-179.5	-60.3	-170.4	-168.6	-172.5	5.8	113	T77 E98 I99 E103	T77-R101 VanDerWaalsContact CB-NH1 3.28Å; T77-R101 VanDerWaalsContact CG2-CZ 3.43Å; E98-R101 WeakPolarHBondContact O-CB 3.36Å; E98-R101 PolarHBondContact O-N 3.25Å; I99-R101 PolarHBondContact O-N 2.86Å; R101-E103 PolarHBondContact O-N 3.49Å
102	L	91.7	Very high	92	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.2	C	C	.	.			trans	-82.2	61.1	176.1	-57.5	-174.1	0	0	0	111.2	L76 L79 L82 L85 I99 K100 E104 L105 L125	L76-L102 HydrophobicContact CD2-CD1 3.97Å; L76-L102 VanDerWaalsContact O-CD2 3.25Å; L76-L102 WeakPolarHBondContact O-CD2 3.39Å; L79-L102 HydrophobicContact CB-CD2 4.2Å; L79-L102 WeakPolarHBondContact O-CD2 3.36Å; L82-L102 HydrophobicContact CB-CD2 4.24Å; L82-L102 HydrophobicContact CD2-CD1 4.2Å; L85-L102 HydrophobicContact CD2-CD1 4.41Å; I99-L102 HydrophobicContact CG1-CD1 4.2Å; I99-L102 WeakPolarHBondContact O-CB 3.3Å; I99-L102 PolarHBondContact O-N 3.01Å; K100-L102 VanDerWaalsContact C-N 3.26Å; K100-L102 PolarHBondContact O-N 3.06Å; L102-E104 PolarHBondContact O-N 3.12Å; L102-E104 VanDerWaalsContact O-N 3.09Å; L102-L105 HydrophobicContact CB-CB 3.94Å; L102-L105 HydrophobicContact CB-CD2 4.43Å; L102-L105 HydrophobicContact CD1-CD1 4.42Å; L102-L105 HydrophobicContact CD1-CD2 4.1Å; L102-L105 WeakPolarHBondContact O-CB 3.37Å; L102-L105 PolarHBondContact O-N 3.33Å; L102-L125 WeakPolarHBondContact O-CD2 3.25Å
103	E	89	Confident	92.1	Very high	139 Å²	139	40 Å²	40	65%	0.65	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.5	-173.5	-62.9	-177.1	-176.3	0	0	113.7	R101 K127	R101-E103 PolarHBondContact O-N 3.49Å; E103-K127 WeakPolarHBondContact O-CD 3.05Å
104	E	92.3	Very high	92.1	Very high	36 Å²	36	42.3 Å²	42.3	17%	0.168	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.5	178.7	-65.3	-60.1	140.6	0	0	114.3	L82 R83 L102 Q106 K127	L82-E104 CarbonylContact O-C 3.07Å; L82-E104 VanDerWaalsContact O-C 3.24Å; R83-E104 HydrophobicContact CG-CB 4.27Å; L102-E104 PolarHBondContact O-N 3.12Å; L102-E104 VanDerWaalsContact O-N 3.09Å; E104-Q106 PolarHBondContact O-N 2.8Å; E104-K127 IonicContact OE1-NZ 3.1Å; E104-K127 PolarHBondContact OE1-NZ 2.77Å; E104-K127 WeakPolarHBondContact OE2-CD 3.24Å; E104-K127 IonicContact OE2-NZ 3.44Å; E104-K127 PolarHBondContact OE2-NZ 3.35Å
105	L	95	Very high	92.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.184	C	C	.	.			trans	-66.1	123.1	-174.5	-165.4	69.4	0	0	0	111	L82 L85 I99 L102 L108 L125 K127 L128	L82-L105 HydrophobicContact CD2-CD1 4.39Å; L82-L105 HydrophobicContact CG-CD1 4.4Å; L82-L105 WeakPolarHBondContact O-CA 3.47Å; L82-L105 PolarHBondContact O-N 3.3Å; L82-L105 VanDerWaalsContact O-N 3.11Å; L85-L105 HydrophobicContact CB-CD1 3.89Å; I99-L105 HydrophobicContact CD1-CD2 4.42Å; L102-L105 HydrophobicContact CB-CB 3.94Å; L102-L105 HydrophobicContact CB-CD2 4.43Å; L102-L105 HydrophobicContact CD1-CD1 4.42Å; L102-L105 HydrophobicContact CD1-CD2 4.1Å; L102-L105 WeakPolarHBondContact O-CB 3.37Å; L102-L105 PolarHBondContact O-N 3.33Å; L105-L108 HydrophobicContact CD2-CB 4.19Å; L105-L125 HydrophobicContact CD2-CD1 4.17Å; L105-K127 CarbonylContact O-C 3.53Å; L105-L128 HydrophobicContact CB-CD1 4.37Å; L105-L128 HydrophobicContact CD2-CD1 3.96Å; L105-L128 HydrophobicContact CG-CD1 3.85Å; L105-L128 WeakPolarHBondContact O-CA 3.37Å; L105-L128 PolarHBondContact O-N 3.23Å
106	Q	95	Very high	92.2	Very high	79 Å²	79	44.2 Å²	44.2	37%	0.369	21%	0.206	S	C	.	.			trans	-108.9	-35.5	-177.9	-67.6	175	15.7	0	0	112.4	R83 E104 K127 S129 N130	R83-Q106 PolarHBondContact O-N 2.98Å; E104-Q106 PolarHBondContact O-N 2.8Å; Q106-K127 WeakPolarHBondContact CA-O 3.39Å; Q106-K127 HydrophobicContact CG-CB 4.49Å; Q106-S129 PolarHBondContact O-N 3.34Å; Q106-S129 PolarHBondContact O-OG 2.91Å; Q106-S129 VanDerWaalsContact O-OG 3.05Å; Q106-N130 PolarHBondContact O-N 3.2Å; Q106-N130 VanDerWaalsContact O-N 3.12Å
107	T	95.7	Very high	92.3	Very high	8 Å²	8	50.8 Å²	50.8	5%	0.049	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	122.5	-177.1	-60	0	0	0	0	110.2	R83 W84 L85 L109 N130	R83-T107 PolarHBondContact O-N 2.82Å; W84-T107 HydrophobicContact CD2-CG2 4.09Å; W84-T107 HydrophobicContact CE3-CG2 3.9Å; W84-T107 HydrophobicContact CH2-CG2 4.05Å; W84-T107 HydrophobicContact CZ2-CG2 4.22Å; W84-T107 HydrophobicContact CZ3-CG2 3.88Å; L85-T107 PolarHBondContact N-O 3.47Å; T107-L109 HydrophobicContact CG2-CD2 3.68Å; T107-L109 HydrophobicContact CG2-CG 3.94Å; T107-N130 WeakPolarHBondContact CA-O 3.37Å; T107-N130 HydrophobicContact CG2-CB 3.99Å; T107-N130 PolarHBondContact OG1-ND2 3.04Å
108	L	95.6	Very high	92.4	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	116.6	174.2	179	59.4	0	0	0	108.8	L85 L87 I95 I99 L105 I110 L122 L128 N130 L131 H132	L85-L108 HydrophobicContact CB-CD1 3.99Å; L85-L108 HydrophobicContact CD2-CD1 3.8Å; L85-L108 HydrophobicContact CG-CD1 3.89Å; L87-L108 HydrophobicContact CD1-CD1 4.48Å; I95-L108 HydrophobicContact CD1-CD2 4.38Å; I99-L108 HydrophobicContact CD1-CD2 3.74Å; L105-L108 HydrophobicContact CD2-CB 4.19Å; L108-I110 HydrophobicContact CD1-CG2 3.89Å; L108-I110 HydrophobicContact CD2-CG2 4.49Å; L108-I110 HydrophobicContact CG-CG2 3.99Å; L108-L122 HydrophobicContact CD2-CD1 4.16Å; L108-L128 HydrophobicContact CB-CD1 3.98Å; L108-N130 PolarHBondContact N-O 3.31Å; L108-L131 HydrophobicContact CB-CD1 4.04Å; L108-L131 HydrophobicContact CD2-CD1 3.77Å; L108-L131 HydrophobicContact CG-CD1 3.96Å; L108-L131 WeakPolarHBondContact O-CA 3.42Å; L108-H132 PolarHBondContact O-N 3.39Å
109	L	95.3	Very high	92.5	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.042	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	112.3	178	-47.5	176.3	0	0	0	109.1	W84 L85 D86 L87 R88 T107 H132	W84-L109 HydrophobicContact CZ2-CD1 3.78Å; L85-L109 PolarHBondContact O-N 2.99Å; D86-L109 HydrophobicContact CB-CD1 4.21Å; L87-L109 CarbonylContact C-O 3.24Å; L87-L109 WeakPolarHBondContact CA-O 3.4Å; L87-L109 PolarHBondContact N-O 3.44Å; R88-L109 HydrophobicContact CG-CB 3.66Å; R88-L109 PolarHBondContact N-O 2.87Å; T107-L109 HydrophobicContact CG2-CD2 3.68Å; T107-L109 HydrophobicContact CG2-CG 3.94Å; L109-H132 HydrophobicContact CD2-CB 3.64Å; L109-H132 WeakPolarHBondContact CD2-CD2 3.32Å; L109-H132 VanDerWaalsContact CD2-CG 3.43Å
110	I	94.3	Very high	92.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.215	C	C	.	.			trans	-127.6	20.2	-178.7	54.5	161	0	0	0	111.4	L87 I95 L108 N113 I115 L118 L131 H132 H133 N136	L87-I110 HydrophobicContact CB-CG2 4.25Å; L87-I110 HydrophobicContact CD1-CG2 4.3Å; I95-I110 HydrophobicContact CD1-CD1 3.77Å; I95-I110 HydrophobicContact CD1-CG2 4.3Å; L108-I110 HydrophobicContact CD1-CG2 3.89Å; L108-I110 HydrophobicContact CD2-CG2 4.49Å; L108-I110 HydrophobicContact CG-CG2 3.99Å; I110-N113 PolarHBondContact O-ND2 3.46Å; I110-I115 HydrophobicContact CB-CD1 3.81Å; I110-I115 HydrophobicContact CD1-CD1 3.61Å; I110-I115 HydrophobicContact CG1-CD1 4.22Å; I110-I115 HydrophobicContact CG2-CD1 4.22Å; I110-L118 HydrophobicContact CD1-CD2 3.86Å; I110-L131 HydrophobicContact CD1-CD1 4.26Å; I110-L131 HydrophobicContact CG1-CD1 4.34Å; I110-H132 WeakPolarHBondContact CG1-O 3.33Å; I110-H132 PolarHBondContact N-O 2.89Å; I110-H133 HydrophobicContact CD1-CB 3.97Å; I110-H133 HydrophobicContact CG1-CB 4.13Å; I110-N136 PolarHBondContact O-ND2 3.48Å
111	D	93.6	Very high	92.5	Very high	18 Å²	18	45.9 Å²	45.9	10%	0.096	21%	0.205	C	C	.	.			trans	-55.4	151.8	177.1	-56.1	-47.7	0	0	0	111.7	R88 D89 N113 H132 H133 R134	R88-D111 CarbonylContact C-O 3.55Å; R88-D111 WeakPolarHBondContact CA-O 3.41Å; R88-D111 HydrophobicContact CG-CB 3.88Å; D89-D111 PolarHBondContact N-O 3.42Å; D111-N113 PolarHBondContact O-ND2 2.85Å; D111-N113 VanDerWaalsContact O-ND2 3.12Å; D111-H132 PolarHBondContact N-O 3.21Å; D111-H132 WeakPolarHBondContact OD1-CB 3.32Å; D111-H132 WeakPolarHBondContact OD2-CB 3.4Å; D111-H132 IonicContact OD2-ND1 3.92Å; D111-H133 PolarHBondContact OD1-N 3.29Å; D111-H133 VanDerWaalsContact OD1-N 3.11Å; D111-R134 CarbonylContact C-O 3.4Å; D111-R134 VanDerWaalsContact CA-O 3.24Å; D111-R134 WeakPolarHBondContact CA-O 3.24Å; D111-R134 HydrophobicContact CB-CB 4.48Å; D111-R134 WeakPolarHBondContact OD1-CB 3.47Å; D111-R134 PolarHBondContact OD1-N 3.19Å
112	N	93.6	Very high	92.6	Very high	60 Å²	60	39.8 Å²	39.8	32%	0.321	18%	0.182	S	C	.	.	S	Bend	trans	54.6	55.8	177.2	-58.7	-32.5	0	0	0	112.7	D89 N90 R134 N135	D89-N112 WeakPolarHBondContact CA-O 3.48Å; D89-N112 PolarHBondContact N-O 3.48Å; D89-N112 WeakPolarHBondContact OD1-CB 3.35Å; D89-N112 PolarHBondContact OD1-ND2 3.33Å; N90-N112 PolarHBondContact N-O 3.03Å; N90-N112 VanDerWaalsContact O-O 3.14Å; N112-R134 PolarHBondContact N-O 2.88Å; N112-N135 WeakPolarHBondContact OD1-CB 3.42Å; N112-N135 PolarHBondContact OD1-ND2 3.28Å
113	N	94.7	Very high	92.4	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.043	19%	0.186	C	C	.	.	S	Bend	trans	-128.2	-177.1	173.2	-83.7	-84.9	0	0	0	109.8	L87 N90 L92 I110 D111 I115 N136	L87-N113 PolarHBondContact O-ND2 3.27Å; N90-N113 WeakPolarHBondContact CA-OD1 3.33Å; N90-N113 WeakPolarHBondContact CB-OD1 3.33Å; N90-N113 PolarHBondContact O-OD1 3.31Å; L92-N113 HydrophobicContact CB-CB 4.25Å; L92-N113 VanDerWaalsContact CB-OD1 3.23Å; L92-N113 WeakPolarHBondContact CB-OD1 3.44Å; L92-N113 WeakPolarHBondContact CG-OD1 3.34Å; L92-N113 PolarHBondContact N-OD1 2.86Å; I110-N113 PolarHBondContact O-ND2 3.46Å; D111-N113 PolarHBondContact O-ND2 2.85Å; D111-N113 VanDerWaalsContact O-ND2 3.12Å; N113-I115 HydrophobicContact CB-CD1 4.03Å; N113-I115 HydrophobicContact CB-CG1 4.02Å; N113-N136 VanDerWaalsContact CA-OD1 3.25Å; N113-N136 WeakPolarHBondContact CA-OD1 3.35Å; N113-N136 WeakPolarHBondContact CB-OD1 3.36Å; N113-N136 PolarHBondContact N-OD1 3.23Å; N113-N136 PolarHBondContact O-OD1 3.23Å; N113-N136 VanDerWaalsContact O-OD1 3.05Å
114	K	91.8	Very high	92.4	Very high	125 Å²	125	36.3 Å²	36.3	54%	0.543	17%	0.17	S	C	.	.			trans	-106.1	28.2	178	-61.5	-177.3	-179	176.7	0	112	L92 T93 K116	L92-K114 CarbonylContact O-C 3.13Å; L92-K114 WeakPolarHBondContact O-CA 3.47Å; L92-K114 WeakPolarHBondContact O-CB 3.34Å; L92-K114 PolarHBondContact O-N 3.33Å; T93-K114 HydrophobicContact CG2-CB 4.47Å; K114-K116 PolarHBondContact O-N 2.88Å
115	I	93.2	Very high	92.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.163	C	C	.	.			trans	-71.5	119.9	-173.1	-60.8	164.8	0	0	0	109.7	L92 T93 I95 I110 N113 R117 L118 N136 P137 I138	L92-I115 HydrophobicContact CB-CD1 4.4Å; L92-I115 HydrophobicContact CB-CG1 4.16Å; L92-I115 WeakPolarHBondContact O-CG1 3.35Å; L92-I115 PolarHBondContact O-N 3.5Å; L92-I115 VanDerWaalsContact O-N 3.12Å; T93-I115 WeakPolarHBondContact O-CA 3.42Å; I95-I115 HydrophobicContact CD1-CD1 4.12Å; I95-I115 HydrophobicContact CG1-CD1 4.05Å; I110-I115 HydrophobicContact CB-CD1 3.81Å; I110-I115 HydrophobicContact CD1-CD1 3.61Å; I110-I115 HydrophobicContact CG1-CD1 4.22Å; I110-I115 HydrophobicContact CG2-CD1 4.22Å; N113-I115 HydrophobicContact CB-CD1 4.03Å; N113-I115 HydrophobicContact CB-CG1 4.02Å; I115-R117 WeakPolarHBondContact CG2-O 3.41Å; I115-L118 HydrophobicContact CG2-CD2 4.25Å; I115-N136 HydrophobicContact CB-CB 4.42Å; I115-N136 VanDerWaalsContact CB-OD1 3.3Å; I115-N136 WeakPolarHBondContact CB-OD1 3.43Å; I115-N136 WeakPolarHBondContact CG1-OD1 3.25Å; I115-N136 PolarHBondContact N-OD1 3.38Å; I115-P137 CarbonylContact O-C 3.04Å; I115-I138 WeakPolarHBondContact O-CG1 3.38Å; I115-I138 PolarHBondContact O-N 3.24Å
116	K	90.6	Very high	91.9	Very high	113 Å²	113	44.9 Å²	44.9	49%	0.491	21%	0.206	S	C	.	.			trans	-90.3	-33.2	176.9	-67	-172.6	173.5	-161.1	0	113.6	T93 K114 P137 I138 E139 F140	T93-K116 PolarHBondContact O-N 2.9Å; K114-K116 PolarHBondContact O-N 2.88Å; K116-P137 WeakPolarHBondContact CA-O 3.5Å; K116-P137 HydrophobicContact CG-CG 4.39Å; K116-I138 CarbonylContact O-C 3.53Å; K116-I138 WeakPolarHBondContact O-CA 3.29Å; K116-E139 IonicContact NZ-OE1 2.66Å; K116-E139 PolarHBondContact O-N 2.89Å; K116-F140 PolarHBondContact O-N 3.48Å
117	R	90.2	Very high	91.7	Very high	152 Å²	152	45.7 Å²	45.7	57%	0.574	21%	0.209	S	C	*	.	B	Isolated β-bridge	trans	-137.4	134.8	-175.6	-59.7	-170.8	178.7	127.3	11.7	110.5	I115 E139 F140	I115-R117 WeakPolarHBondContact CG2-O 3.41Å; R117-E139 IonicContact CZ-OE2 2.74Å; R117-E139 IonicContact NE-OE2 3.39Å; R117-E139 IonicContact NH2-OE2 3.49Å; R117-E139 PolarHBondContact NH2-OE2 3.38Å; R117-F140 WeakPolarHBondContact CA-O 3.45Å; R117-F140 HydrophobicContact CB-CB 4.45Å; R117-F140 HydrophobicContact CG-CB 4.07Å
118	L	91.4	Very high	91.6	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	21%	0.21	C	C	.	.			trans	-85.7	134.4	166.8	-60.8	-179.5	0	0	0	109	I95 I110 I115 L122 L131 F140 P141 L146 I153 L157	I95-L118 HydrophobicContact CD1-CD2 4.07Å; I110-L118 HydrophobicContact CD1-CD2 3.86Å; I115-L118 HydrophobicContact CG2-CD2 4.25Å; L118-L122 HydrophobicContact CD2-CD1 4.42Å; L118-L131 HydrophobicContact CD1-CD2 4.15Å; L118-F140 PolarHBondContact N-O 3.15Å; L118-P141 HydrophobicContact CD1-CG 4.29Å; L118-L146 HydrophobicContact CD1-CD2 4.39Å; L118-I153 HydrophobicContact CD1-CG2 4.06Å; L118-L157 HydrophobicContact CB-CD1 4.17Å
119	P	90.5	Very high	91.3	Very high	16 Å²	16	48.5 Å²	48.5	10%	0.104	23%	0.228	C	C	.	.			trans	-67.4	146	177.6	26.4	-32.2	0	0	0	110.7	I95 I99 E121 L122	I95-P119 HydrophobicContact CB-CG 3.96Å; I95-P119 HydrophobicContact CG2-CG 3.94Å; I99-P119 HydrophobicContact CG2-CG 4.09Å; P119-E121 WeakPolarHBondContact CB-OE2 3.42Å; P119-E121 PolarHBondContact O-N 2.9Å; P119-L122 HydrophobicContact CG-CB 4.29Å; P119-L122 HydrophobicContact CG-CD1 4.38Å; P119-L122 WeakPolarHBondContact O-CB 3.47Å; P119-L122 PolarHBondContact O-N 2.96Å; P119-L122 VanDerWaalsContact O-N 3.17Å
120	L	89.8	Confident	91.2	Very high	32 Å²	32	51.6 Å²	51.6	17%	0.168	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-63	-33.8	178.9	-67.4	162.7	0	0	0	111.2	L122 G123 F140 L157 H160 Y161 L164	L120-L122 PolarHBondContact O-N 3.36Å; L120-L122 VanDerWaalsContact O-N 3.11Å; L120-G123 PolarHBondContact O-N 2.71Å; L120-F140 HydrophobicContact CD2-CE1 3.93Å; L120-F140 HydrophobicContact CD2-CZ 4.16Å; L120-L157 HydrophobicContact CD2-CD2 4.33Å; L120-H160 HydrophobicContact CD2-CB 3.66Å; L120-H160 WeakPolarHBondContact CD2-ND1 3.18Å; L120-Y161 HydrophobicContact CB-CD2 3.82Å; L120-Y161 HydrophobicContact CB-CG 4.45Å; L120-L164 HydrophobicContact CD1-CD1 3.44Å; L120-L164 VanDerWaalsContact CD1-CD1 3.44Å
121	E	90.2	Very high	91.1	Very high	36 Å²	36	52 Å²	52	17%	0.168	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-57.2	-23.1	176.1	-71.1	82.6	-177.9	0	0	113.7	P97 I99 K100 P119 G123 L124 Y161	P97-E121 HydrophobicContact CB-CG 3.84Å; P97-E121 WeakPolarHBondContact CB-OE1 3.3Å; P97-E121 WeakPolarHBondContact O-CB 3.21Å; P97-E121 WeakPolarHBondContact O-CG 3.46Å; I99-E121 HydrophobicContact CG2-CB 4.44Å; K100-E121 HydrophobicContact CB-CB 4.08Å; K100-E121 HydrophobicContact CB-CG 4.47Å; K100-E121 HydrophobicContact CD-CG 4.03Å; P119-E121 WeakPolarHBondContact CB-OE2 3.42Å; P119-E121 PolarHBondContact O-N 2.9Å; E121-G123 PolarHBondContact O-N 2.87Å; E121-L124 WeakPolarHBondContact O-CB 3.37Å; E121-L124 PolarHBondContact O-N 3.3Å; E121-Y161 HydrophobicContact CG-CE2 4.09Å
122	L	90.9	Very high	91	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-62	-29.4	175.3	-151.2	155.3	0	0	0	110.7	I95 L108 L118 P119 L120 L124 L125 L128 L131 L154 L157	I95-L122 HydrophobicContact CD1-CD1 4.26Å; L108-L122 HydrophobicContact CD2-CD1 4.16Å; L118-L122 HydrophobicContact CD2-CD1 4.42Å; P119-L122 HydrophobicContact CG-CB 4.29Å; P119-L122 HydrophobicContact CG-CD1 4.38Å; P119-L122 WeakPolarHBondContact O-CB 3.47Å; P119-L122 PolarHBondContact O-N 2.96Å; P119-L122 VanDerWaalsContact O-N 3.17Å; L120-L122 PolarHBondContact O-N 3.36Å; L120-L122 VanDerWaalsContact O-N 3.11Å; L122-L124 VanDerWaalsContact C-N 3.26Å; L122-L124 PolarHBondContact O-N 3.14Å; L122-L125 WeakPolarHBondContact O-CB 3.19Å; L122-L125 PolarHBondContact O-N 3.01Å; L122-L128 HydrophobicContact CD2-CD2 3.45Å; L122-L128 VanDerWaalsContact CD2-CD2 3.45Å; L122-L128 HydrophobicContact CG-CD2 4.43Å; L122-L131 HydrophobicContact CD2-CD2 4.11Å; L122-L154 HydrophobicContact CD2-CD2 3.17Å; L122-L154 WeakPolarHBondContact O-CD2 3.47Å; L122-L157 HydrophobicContact CB-CD1 4.07Å
123	G	86.9	Confident	90.8	Very high	10 Å²	10	53.7 Å²	53.7	10%	0.103	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-67.4	-18	173.7	0	0	0	0	0	114.8	L120 E121 L125 L154	L120-G123 PolarHBondContact O-N 2.71Å; E121-G123 PolarHBondContact O-N 2.87Å; G123-L125 VanDerWaalsContact C-N 3.28Å; G123-L125 PolarHBondContact O-N 2.92Å; G123-L154 WeakPolarHBondContact CA-O 3.47Å
124	L	89.2	Confident	90.6	Very high	57 Å²	57	61.9 Å²	61.9	30%	0.298	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-77.8	-15.1	177.5	-62.7	169.8	0	0	0	112.8	K100 E121 L122 K126 L158 Y161	K100-L124 HydrophobicContact CB-CD1 4.03Å; K100-L124 HydrophobicContact CD-CD1 4.14Å; E121-L124 WeakPolarHBondContact O-CB 3.37Å; E121-L124 PolarHBondContact O-N 3.3Å; L122-L124 VanDerWaalsContact C-N 3.26Å; L122-L124 PolarHBondContact O-N 3.14Å; L124-K126 PolarHBondContact O-N 3.33Å; L124-L158 HydrophobicContact CD2-CD1 3.88Å; L124-Y161 HydrophobicContact CD1-CE1 4.04Å; L124-Y161 HydrophobicContact CD1-CE2 4.25Å; L124-Y161 HydrophobicContact CD2-CD1 4.11Å; L124-Y161 HydrophobicContact CD2-CE1 4.05Å; L124-Y161 HydrophobicContact CG-CE1 4.45Å
125	L	91.3	Very high	90.5	Very high	5 Å²	5	62 Å²	62	3%	0.026	29%	0.289	C	S	.	.			trans	-76.3	86.7	-175.8	-62.6	179.1	0	0	0	111.8	I99 L102 L105 L122 G123 K127 L128	I99-L125 HydrophobicContact CG1-CD1 4.18Å; I99-L125 WeakPolarHBondContact O-CD2 3.01Å; L102-L125 WeakPolarHBondContact O-CD2 3.25Å; L105-L125 HydrophobicContact CD2-CD1 4.17Å; L122-L125 WeakPolarHBondContact O-CB 3.19Å; L122-L125 PolarHBondContact O-N 3.01Å; G123-L125 VanDerWaalsContact C-N 3.28Å; G123-L125 PolarHBondContact O-N 2.92Å; L125-K127 PolarHBondContact O-N 3.35Å; L125-K127 VanDerWaalsContact O-N 3.13Å; L125-L128 HydrophobicContact CB-CB 3.83Å; L125-L128 HydrophobicContact CD1-CD2 4.26Å; L125-L128 WeakPolarHBondContact O-CB 3.32Å; L125-L128 PolarHBondContact O-N 2.74Å; L125-L128 VanDerWaalsContact O-N 3.1Å
126	K	86.4	Confident	90.3	Very high	210 Å²	210	63 Å²	63	91%	0.913	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.6	-176.3	-61.5	-179.5	-177.4	176	0	114.5	L124	L124-K126 PolarHBondContact O-N 3.33Å
127	K	90.8	Very high	90.1	Very high	97 Å²	97	61.1 Å²	61.1	42%	0.422	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.7	-177.6	-71.7	179.4	173.8	175.1	0	113.5	E103 E104 L105 Q106 L125 S129	E103-K127 WeakPolarHBondContact O-CD 3.05Å; E104-K127 IonicContact OE1-NZ 3.1Å; E104-K127 PolarHBondContact OE1-NZ 2.77Å; E104-K127 WeakPolarHBondContact OE2-CD 3.24Å; E104-K127 IonicContact OE2-NZ 3.44Å; E104-K127 PolarHBondContact OE2-NZ 3.35Å; L105-K127 CarbonylContact O-C 3.53Å; Q106-K127 WeakPolarHBondContact CA-O 3.39Å; Q106-K127 HydrophobicContact CG-CB 4.49Å; L125-K127 PolarHBondContact O-N 3.35Å; L125-K127 VanDerWaalsContact O-N 3.13Å; K127-S129 PolarHBondContact O-N 2.91Å
128	L	93.1	Very high	90	Very high	12 Å²	12	54.7 Å²	54.7	6%	0.063	27%	0.27	C	S	.	.			trans	-72.2	119.5	-178	-166	73.5	0	0	0	109.6	L105 L108 L122 L125 L154	L105-L128 HydrophobicContact CB-CD1 4.37Å; L105-L128 HydrophobicContact CD2-CD1 3.96Å; L105-L128 HydrophobicContact CG-CD1 3.85Å; L105-L128 WeakPolarHBondContact O-CA 3.37Å; L105-L128 PolarHBondContact O-N 3.23Å; L108-L128 HydrophobicContact CB-CD1 3.98Å; L122-L128 HydrophobicContact CD2-CD2 3.45Å; L122-L128 VanDerWaalsContact CD2-CD2 3.45Å; L122-L128 HydrophobicContact CG-CD2 4.43Å; L125-L128 HydrophobicContact CB-CB 3.83Å; L125-L128 HydrophobicContact CD1-CD2 4.26Å; L125-L128 WeakPolarHBondContact O-CB 3.32Å; L125-L128 PolarHBondContact O-N 2.74Å; L125-L128 VanDerWaalsContact O-N 3.1Å; L128-L154 HydrophobicContact CB-CD1 4.13Å; L128-L154 HydrophobicContact CD2-CD1 4.29Å; L128-L154 HydrophobicContact CD2-CD2 3.94Å; L128-L154 HydrophobicContact CG-CD1 4.45Å; L128-L154 WeakPolarHBondContact O-CD1 3.34Å
129	S	89.4	Confident	89.8	Confident	56 Å²	56	59.4 Å²	59.4	39%	0.392	29%	0.292	S	S	.	.			trans	-115	-37	-176.9	56.9	0	0	0	0	112	Q106 K127 T150	Q106-S129 PolarHBondContact O-N 3.34Å; Q106-S129 PolarHBondContact O-OG 2.91Å; Q106-S129 VanDerWaalsContact O-OG 3.05Å; K127-S129 PolarHBondContact O-N 2.91Å; S129-T150 PolarHBondContact O-OG1 2.92Å
130	N	92.3	Very high	89.6	Confident	73 Å²	73	61.2 Å²	61.2	39%	0.39	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	113.6	-176.2	-57.7	-36.5	0	0	0	109.5	Q106 T107 L108	Q106-N130 PolarHBondContact O-N 3.2Å; Q106-N130 VanDerWaalsContact O-N 3.12Å; T107-N130 WeakPolarHBondContact CA-O 3.37Å; T107-N130 HydrophobicContact CG2-CB 3.99Å; T107-N130 PolarHBondContact OG1-ND2 3.04Å; L108-N130 PolarHBondContact N-O 3.31Å
131	L	93	Very high	89.4	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.6	172.1	174.5	65.2	0	0	0	107.5	L108 I110 L118 L122 T150 I153	L108-L131 HydrophobicContact CB-CD1 4.04Å; L108-L131 HydrophobicContact CD2-CD1 3.77Å; L108-L131 HydrophobicContact CG-CD1 3.96Å; L108-L131 WeakPolarHBondContact O-CA 3.42Å; I110-L131 HydrophobicContact CD1-CD1 4.26Å; I110-L131 HydrophobicContact CG1-CD1 4.34Å; L118-L131 HydrophobicContact CD1-CD2 4.15Å; L122-L131 HydrophobicContact CD2-CD2 4.11Å; L131-T150 HydrophobicContact CB-CG2 3.9Å; L131-T150 WeakPolarHBondContact O-CG2 3.34Å; L131-I153 HydrophobicContact CD2-CG2 4.16Å
132	H	91.8	Very high	89.1	Confident	79 Å²	79	60.7 Å²	60.7	37%	0.366	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118	176.1	-71.9	-122.7	0	0	0	108.7	L108 L109 I110 D111	L108-H132 PolarHBondContact O-N 3.39Å; L109-H132 HydrophobicContact CD2-CB 3.64Å; L109-H132 WeakPolarHBondContact CD2-CD2 3.32Å; L109-H132 VanDerWaalsContact CD2-CG 3.43Å; I110-H132 WeakPolarHBondContact CG1-O 3.33Å; I110-H132 PolarHBondContact N-O 2.89Å; D111-H132 PolarHBondContact N-O 3.21Å; D111-H132 WeakPolarHBondContact OD1-CB 3.32Å; D111-H132 WeakPolarHBondContact OD2-CB 3.4Å; D111-H132 IonicContact OD2-ND1 3.92Å
133	H	89.9	Confident	88.6	Confident	34 Å²	34	64.8 Å²	64.8	16%	0.157	33%	0.325	C	S	.	.			trans	-133.3	21.3	-172	65.6	48.2	0	0	0	113.1	I110 D111 I138 I153	I110-H133 HydrophobicContact CD1-CB 3.97Å; I110-H133 HydrophobicContact CG1-CB 4.13Å; D111-H133 PolarHBondContact OD1-N 3.29Å; D111-H133 VanDerWaalsContact OD1-N 3.11Å; H133-I138 HydrophobicContact CB-CD1 3.8Å; H133-I153 VanDerWaalsContact NE2-CD1 3.33Å; H133-I153 WeakPolarHBondContact NE2-CD1 3.49Å
134	R	89	Confident	88.4	Confident	181 Å²	181	69 Å²	69	68%	0.683	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	152.8	-176.9	-62.9	-177.3	175.3	-179.3	-1.8	110.1	D111 N112 N136	D111-R134 CarbonylContact C-O 3.4Å; D111-R134 VanDerWaalsContact CA-O 3.24Å; D111-R134 WeakPolarHBondContact CA-O 3.24Å; D111-R134 HydrophobicContact CB-CB 4.48Å; D111-R134 WeakPolarHBondContact OD1-CB 3.47Å; D111-R134 PolarHBondContact OD1-N 3.19Å; N112-R134 PolarHBondContact N-O 2.88Å; R134-N136 VanDerWaalsContact C-N 3.29Å; R134-N136 PolarHBondContact O-N 3.45Å; R134-N136 PolarHBondContact O-ND2 2.84Å; R134-N136 VanDerWaalsContact O-ND2 3.12Å
135	N	89.7	Confident	88.2	Confident	127 Å²	127	66.9 Å²	66.9	68%	0.679	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	44.8	178.2	-59.8	-13.1	0	0	0	113.5	N112	N112-N135 WeakPolarHBondContact OD1-CB 3.42Å; N112-N135 PolarHBondContact OD1-ND2 3.28Å
136	N	89.3	Confident	87.9	Confident	22 Å²	22	67.8 Å²	67.8	12%	0.118	34%	0.336	C	S	.	.			trans	-122.4	142.3	167.5	-80.8	-93	0	0	0	109	I110 N113 I115 R134 I138	I110-N136 PolarHBondContact O-ND2 3.48Å; N113-N136 VanDerWaalsContact CA-OD1 3.25Å; N113-N136 WeakPolarHBondContact CA-OD1 3.35Å; N113-N136 WeakPolarHBondContact CB-OD1 3.36Å; N113-N136 PolarHBondContact N-OD1 3.23Å; N113-N136 PolarHBondContact O-OD1 3.23Å; N113-N136 VanDerWaalsContact O-OD1 3.05Å; I115-N136 HydrophobicContact CB-CB 4.42Å; I115-N136 VanDerWaalsContact CB-OD1 3.3Å; I115-N136 WeakPolarHBondContact CB-OD1 3.43Å; I115-N136 WeakPolarHBondContact CG1-OD1 3.25Å; I115-N136 PolarHBondContact N-OD1 3.38Å; R134-N136 VanDerWaalsContact C-N 3.29Å; R134-N136 PolarHBondContact O-N 3.45Å; R134-N136 PolarHBondContact O-ND2 2.84Å; R134-N136 VanDerWaalsContact O-ND2 3.12Å; N136-I138 HydrophobicContact CB-CD1 3.97Å; N136-I138 HydrophobicContact CB-CG1 3.66Å; N136-I138 PolarHBondContact O-N 2.97Å
137	P	87.9	Confident	87.8	Confident	72 Å²	72	67.1 Å²	67.1	47%	0.468	33%	0.328	S	S	.	.			trans	-77.8	57.9	177.2	34.9	-36.8	0	0	0	111.6	I115 K116 E139	I115-P137 CarbonylContact O-C 3.04Å; K116-P137 WeakPolarHBondContact CA-O 3.5Å; K116-P137 HydrophobicContact CG-CG 4.39Å; P137-E139 PolarHBondContact O-N 3.44Å
138	I	87.3	Confident	87.5	Confident	17 Å²	17	69.8 Å²	69.8	9%	0.087	34%	0.335	C	S	.	.			trans	-73	113.3	-174.1	-56.7	172.7	0	0	0	110.2	I115 K116 H133 N136 F140 L146	I115-I138 WeakPolarHBondContact O-CG1 3.38Å; I115-I138 PolarHBondContact O-N 3.24Å; K116-I138 CarbonylContact O-C 3.53Å; K116-I138 WeakPolarHBondContact O-CA 3.29Å; H133-I138 HydrophobicContact CB-CD1 3.8Å; N136-I138 HydrophobicContact CB-CD1 3.97Å; N136-I138 HydrophobicContact CB-CG1 3.66Å; N136-I138 PolarHBondContact O-N 2.97Å; I138-F140 VanDerWaalsContact CG2-O 3.3Å; I138-F140 WeakPolarHBondContact CG2-O 3.49Å; I138-L146 HydrophobicContact CB-CD1 3.85Å; I138-L146 HydrophobicContact CD1-CD1 4.28Å; I138-L146 HydrophobicContact CD1-CD2 4.47Å; I138-L146 HydrophobicContact CG2-CD1 3.8Å; I138-L146 HydrophobicContact CG2-CD2 4.45Å
139	E	87.3	Confident	87.2	Confident	104 Å²	104	70.7 Å²	70.7	49%	0.486	35%	0.347	S	S	.	.			trans	-84	-35.9	171.6	-64	171.1	-165.8	0	0	111.4	K116 R117 P137	K116-E139 IonicContact NZ-OE1 2.66Å; K116-E139 PolarHBondContact O-N 2.89Å; R117-E139 IonicContact CZ-OE2 2.74Å; R117-E139 IonicContact NE-OE2 3.39Å; R117-E139 IonicContact NH2-OE2 3.49Å; R117-E139 PolarHBondContact NH2-OE2 3.38Å; P137-E139 PolarHBondContact O-N 3.44Å
140	F	86.1	Confident	87.2	Confident	54 Å²	54	69.8 Å²	69.8	24%	0.237	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-137.4	126.6	-178.4	-174.4	-94.9	0	0	0	111.3	K116 R117 L118 L120 I138 F156 L157	K116-F140 PolarHBondContact O-N 3.48Å; R117-F140 WeakPolarHBondContact CA-O 3.45Å; R117-F140 HydrophobicContact CB-CB 4.45Å; R117-F140 HydrophobicContact CG-CB 4.07Å; L118-F140 PolarHBondContact N-O 3.15Å; L120-F140 HydrophobicContact CD2-CE1 3.93Å; L120-F140 HydrophobicContact CD2-CZ 4.16Å; I138-F140 VanDerWaalsContact CG2-O 3.3Å; I138-F140 WeakPolarHBondContact CG2-O 3.49Å; F140-F156 AromaticContact CE2-CE1 3.94Å; F140-F156 HydrophobicContact CE2-CE1 3.94Å; F140-F156 HydrophobicContact CE2-CZ 4.28Å; F140-F156 AromaticContact CZ-CE1 3.86Å; F140-F156 HydrophobicContact CZ-CE1 3.86Å; F140-L157 HydrophobicContact CE1-CD2 3.98Å
141	P	84.8	Confident	87	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	36%	0.358	C	S	.	.	S	Bend	cis	-72	162.5	4.6	30	-35	0	0	0	113.4	L118 V145 L146 I153 F156 L157	L118-P141 HydrophobicContact CD1-CG 4.29Å; P141-V145 HydrophobicContact CB-CB 4.39Å; P141-V145 HydrophobicContact CB-CG1 4.33Å; P141-L146 HydrophobicContact CG-CD2 3.73Å; P141-L146 HydrophobicContact CG-CG 4.36Å; P141-I153 HydrophobicContact CG-CG2 4.1Å; P141-F156 HydrophobicContact CB-CD1 3.55Å; P141-F156 HydrophobicContact CB-CE1 3.56Å; P141-L157 HydrophobicContact CG-CD2 4.44Å
142	P	84.4	Confident	86.7	Confident	57 Å²	57	77.8 Å²	77.8	37%	0.37	37%	0.372	S	S	.	.			trans	-58.9	148.6	-176.4	22.1	-32.7	0	0	0	112.2	E144 V145 L146 F156	P142-E144 PolarHBondContact O-N 2.98Å; P142-V145 HydrophobicContact CG-CB 4.45Å; P142-V145 HydrophobicContact CG-CG2 3.9Å; P142-V145 WeakPolarHBondContact O-CB 3.23Å; P142-V145 PolarHBondContact O-N 3.47Å; P142-L146 PolarHBondContact O-N 3.22Å; P142-F156 HydrophobicContact CG-CZ 4.25Å
143	T	81.3	Confident	86.7	Confident	85 Å²	85	74 Å²	74	52%	0.521	35%	0.354	S	S	.	.	H	α-helix	trans	-55.1	-29.7	-174.7	-43.8	0	0	0	0	113.5	V145 L146 R147	T143-V145 VanDerWaalsContact C-N 3.35Å; T143-V145 PolarHBondContact O-N 2.98Å; T143-L146 PolarHBondContact O-N 3.14Å; T143-R147 WeakPolarHBondContact O-CG 3.41Å; T143-R147 PolarHBondContact O-N 3.16Å; T143-R147 VanDerWaalsContact O-N 3.12Å
144	E	82.6	Confident	86.7	Confident	98 Å²	98	73.3 Å²	73.3	46%	0.458	35%	0.352	S	S	.	.	H	α-helix	trans	-61.7	-39.9	174.8	179.3	55.5	-157.8	0	0	112.6	P142 R148	P142-E144 PolarHBondContact O-N 2.98Å; E144-R148 WeakPolarHBondContact O-CG 3.36Å; E144-R148 IonicContact OE1-CZ 3.47Å; E144-R148 IonicContact OE1-NE 2.59Å; E144-R148 PolarHBondContact OE1-NE 2.93Å; E144-R148 IonicContact OE1-NH2 3.51Å; E144-R148 PolarHBondContact OE1-NH2 3.5Å
145	V	84.2	Confident	86.7	Confident	14 Å²	14	70.3 Å²	70.3	9%	0.085	34%	0.343	C	S	.	.	H	α-helix	trans	-72.7	-38	176.5	175.7	0	0	0	0	110.4	P141 P142 T143 R147 R148 I153 F156	P141-V145 HydrophobicContact CB-CB 4.39Å; P141-V145 HydrophobicContact CB-CG1 4.33Å; P142-V145 HydrophobicContact CG-CB 4.45Å; P142-V145 HydrophobicContact CG-CG2 3.9Å; P142-V145 WeakPolarHBondContact O-CB 3.23Å; P142-V145 PolarHBondContact O-N 3.47Å; T143-V145 VanDerWaalsContact C-N 3.35Å; T143-V145 PolarHBondContact O-N 2.98Å; V145-R147 VanDerWaalsContact C-N 3.27Å; V145-R147 PolarHBondContact O-N 3.29Å; V145-R148 PolarHBondContact O-N 3.29Å; V145-R148 VanDerWaalsContact O-N 3.15Å; V145-I153 HydrophobicContact CG1-CB 4.48Å; V145-I153 HydrophobicContact CG1-CG1 4.1Å; V145-I153 WeakPolarHBondContact O-CG1 3.5Å; V145-F156 HydrophobicContact CG1-CB 3.72Å; V145-F156 HydrophobicContact CG1-CD1 4.36Å; V145-F156 HydrophobicContact CG1-CG 3.97Å; V145-F156 HydrophobicContact CG2-CD2 3.89Å; V145-F156 HydrophobicContact CG2-CE2 4.26Å; V145-F156 HydrophobicContact CG2-CG 4.09Å
146	L	85	Confident	86.7	Confident	24 Å²	24	66.8 Å²	66.8	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-36	177.6	-63.5	177.2	0	0	0	112.4	L118 I138 P141 P142 T143 R148 I153	L118-L146 HydrophobicContact CD1-CD2 4.39Å; I138-L146 HydrophobicContact CB-CD1 3.85Å; I138-L146 HydrophobicContact CD1-CD1 4.28Å; I138-L146 HydrophobicContact CD1-CD2 4.47Å; I138-L146 HydrophobicContact CG2-CD1 3.8Å; I138-L146 HydrophobicContact CG2-CD2 4.45Å; P141-L146 HydrophobicContact CG-CD2 3.73Å; P141-L146 HydrophobicContact CG-CG 4.36Å; P142-L146 PolarHBondContact O-N 3.22Å; T143-L146 PolarHBondContact O-N 3.14Å; L146-R148 VanDerWaalsContact C-N 3.32Å; L146-R148 PolarHBondContact O-N 3.18Å; L146-I153 HydrophobicContact CD2-CD1 3.87Å; L146-I153 HydrophobicContact CD2-CG1 4.16Å
147	R	84.6	Confident	86.8	Confident	196 Å²	196	65.8 Å²	65.8	74%	0.74	32%	0.317	S	S	*	.	H	α-helix	trans	-69.5	-26.4	177.5	-73.8	179.1	-178.3	160	-0	113.9	T143 V145 G149	T143-R147 WeakPolarHBondContact O-CG 3.41Å; T143-R147 PolarHBondContact O-N 3.16Å; T143-R147 VanDerWaalsContact O-N 3.12Å; V145-R147 VanDerWaalsContact C-N 3.27Å; V145-R147 PolarHBondContact O-N 3.29Å; R147-G149 PolarHBondContact O-N 3.32Å
148	R	84.7	Confident	86.9	Confident	153 Å²	153	65 Å²	65	58%	0.577	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-7.5	-177.7	-67	176.3	-174.3	-154.9	0.4	113.6	E144 V145 L146 Q152	E144-R148 WeakPolarHBondContact O-CG 3.36Å; E144-R148 IonicContact OE1-CZ 3.47Å; E144-R148 IonicContact OE1-NE 2.59Å; E144-R148 PolarHBondContact OE1-NE 2.93Å; E144-R148 IonicContact OE1-NH2 3.51Å; E144-R148 PolarHBondContact OE1-NH2 3.5Å; V145-R148 PolarHBondContact O-N 3.29Å; V145-R148 VanDerWaalsContact O-N 3.15Å; L146-R148 VanDerWaalsContact C-N 3.32Å; L146-R148 PolarHBondContact O-N 3.18Å; R148-Q152 HydrophobicContact CB-CB 3.7Å; R148-Q152 HydrophobicContact CB-CG 3.68Å; R148-Q152 HydrophobicContact CG-CG 4.38Å
149	G	87.6	Confident	87	Confident	30 Å²	30	68.3 Å²	68.3	31%	0.309	33%	0.326	S	S	.	.			trans	93.2	174.5	175.3	0	0	0	0	0	114	R147 K151 Q152 I153	R147-G149 PolarHBondContact O-N 3.32Å; G149-K151 PolarHBondContact O-N 2.95Å; G149-Q152 PolarHBondContact O-N 3.18Å; G149-I153 WeakPolarHBondContact O-CG1 3.34Å; G149-I153 PolarHBondContact O-N 3.5Å; G149-I153 VanDerWaalsContact O-N 3.14Å
150	T	87.7	Confident	86.9	Confident	38 Å²	38	67 Å²	67	23%	0.233	32%	0.32	C	S	.	.	H	α-helix	trans	-56.6	-48.1	-165.9	60.9	0	0	0	0	113	S129 L131 Q152 I153 L154	S129-T150 PolarHBondContact O-OG1 2.92Å; L131-T150 HydrophobicContact CB-CG2 3.9Å; L131-T150 WeakPolarHBondContact O-CG2 3.34Å; T150-Q152 VanDerWaalsContact C-N 3.32Å; T150-Q152 PolarHBondContact O-N 3.5Å; T150-I153 WeakPolarHBondContact O-CB 3.01Å; T150-I153 PolarHBondContact O-N 2.89Å; T150-L154 VanDerWaalsContact O-CG 3.32Å; T150-L154 WeakPolarHBondContact O-CG 3.35Å; T150-L154 PolarHBondContact O-N 3.12Å
151	K	89	Confident	87	Confident	179 Å²	179	66.1 Å²	66.1	78%	0.778	32%	0.315	S	S	*	.	H	α-helix	trans	-58.8	-41.5	-179.1	-66.3	-173.8	178	-174.1	0	112.9	G149 L154 K155	G149-K151 PolarHBondContact O-N 2.95Å; K151-L154 PolarHBondContact O-N 3Å; K151-K155 WeakPolarHBondContact O-CB 3.2Å; K151-K155 PolarHBondContact O-N 3.01Å
152	Q	87.3	Confident	87	Confident	70 Å²	70	70 Å²	70	33%	0.327	34%	0.335	S	S	.	.	H	α-helix	trans	-73.7	-34.3	-178.6	-172.3	59	65	0	0	111.7	R148 G149 T150 K155 F156	R148-Q152 HydrophobicContact CB-CB 3.7Å; R148-Q152 HydrophobicContact CB-CG 3.68Å; R148-Q152 HydrophobicContact CG-CG 4.38Å; G149-Q152 PolarHBondContact O-N 3.18Å; T150-Q152 VanDerWaalsContact C-N 3.32Å; T150-Q152 PolarHBondContact O-N 3.5Å; Q152-K155 PolarHBondContact O-N 3.21Å; Q152-F156 WeakPolarHBondContact O-CB 3.21Å; Q152-F156 PolarHBondContact O-N 3.37Å
153	I	90.3	Very high	86.9	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.5	-50.9	171.3	-64.7	165.1	0	0	0	110	L118 L131 H133 P141 V145 L146 G149 T150 K155 F156 L157	L118-I153 HydrophobicContact CD1-CG2 4.06Å; L131-I153 HydrophobicContact CD2-CG2 4.16Å; H133-I153 VanDerWaalsContact NE2-CD1 3.33Å; H133-I153 WeakPolarHBondContact NE2-CD1 3.49Å; P141-I153 HydrophobicContact CG-CG2 4.1Å; V145-I153 HydrophobicContact CG1-CB 4.48Å; V145-I153 HydrophobicContact CG1-CG1 4.1Å; V145-I153 WeakPolarHBondContact O-CG1 3.5Å; L146-I153 HydrophobicContact CD2-CD1 3.87Å; L146-I153 HydrophobicContact CD2-CG1 4.16Å; G149-I153 WeakPolarHBondContact O-CG1 3.34Å; G149-I153 PolarHBondContact O-N 3.5Å; G149-I153 VanDerWaalsContact O-N 3.14Å; T150-I153 WeakPolarHBondContact O-CB 3.01Å; T150-I153 PolarHBondContact O-N 2.89Å; I153-K155 VanDerWaalsContact C-N 3.35Å; I153-K155 PolarHBondContact O-N 3.03Å; I153-F156 PolarHBondContact O-N 3.06Å; I153-L157 HydrophobicContact CG2-CD1 3.96Å; I153-L157 VanDerWaalsContact O-CG 3.32Å; I153-L157 WeakPolarHBondContact O-CG 3.39Å; I153-L157 PolarHBondContact O-N 3.35Å
154	L	90.7	Very high	86.8	Confident	19 Å²	19	68.7 Å²	68.7	10%	0.099	33%	0.331	C	S	.	.	H	α-helix	trans	-62.5	-42.4	179.9	-62.7	179	0	0	0	112.2	L122 G123 L128 T150 K151 L157 L158	L122-L154 HydrophobicContact CD2-CD2 3.17Å; L122-L154 WeakPolarHBondContact O-CD2 3.47Å; G123-L154 WeakPolarHBondContact CA-O 3.47Å; L128-L154 HydrophobicContact CB-CD1 4.13Å; L128-L154 HydrophobicContact CD2-CD1 4.29Å; L128-L154 HydrophobicContact CD2-CD2 3.94Å; L128-L154 HydrophobicContact CG-CD1 4.45Å; L128-L154 WeakPolarHBondContact O-CD1 3.34Å; T150-L154 VanDerWaalsContact O-CG 3.32Å; T150-L154 WeakPolarHBondContact O-CG 3.35Å; T150-L154 PolarHBondContact O-N 3.12Å; K151-L154 PolarHBondContact O-N 3Å; L154-L157 PolarHBondContact O-N 3.21Å; L154-L158 WeakPolarHBondContact O-CB 3.45Å; L154-L158 PolarHBondContact O-N 3.28Å
155	K	89.5	Confident	86.1	Confident	117 Å²	117	67.9 Å²	67.9	51%	0.509	33%	0.328	S	S	.	.	H	α-helix	trans	-60.6	-47.4	175.4	-177.1	173.7	179.5	175.3	0	111.7	K151 Q152 I153 L157 L158 D159	K151-K155 WeakPolarHBondContact O-CB 3.2Å; K151-K155 PolarHBondContact O-N 3.01Å; Q152-K155 PolarHBondContact O-N 3.21Å; I153-K155 VanDerWaalsContact C-N 3.35Å; I153-K155 PolarHBondContact O-N 3.03Å; K155-L157 VanDerWaalsContact C-N 3.34Å; K155-L157 PolarHBondContact O-N 3.22Å; K155-L158 PolarHBondContact O-N 3.36Å; K155-D159 WeakPolarHBondContact O-CB 3.43Å; K155-D159 PolarHBondContact O-N 3.46Å
156	F	89.7	Confident	85	Confident	54 Å²	54	72.4 Å²	72.4	24%	0.237	35%	0.352	C	S	.	.	H	α-helix	trans	-60.1	-43.9	177.9	177	-90.9	0	0	0	112.2	F140 P141 P142 V145 Q152 I153 L158 D159 H160	F140-F156 AromaticContact CE2-CE1 3.94Å; F140-F156 HydrophobicContact CE2-CE1 3.94Å; F140-F156 HydrophobicContact CE2-CZ 4.28Å; F140-F156 AromaticContact CZ-CE1 3.86Å; F140-F156 HydrophobicContact CZ-CE1 3.86Å; P141-F156 HydrophobicContact CB-CD1 3.55Å; P141-F156 HydrophobicContact CB-CE1 3.56Å; P142-F156 HydrophobicContact CG-CZ 4.25Å; V145-F156 HydrophobicContact CG1-CB 3.72Å; V145-F156 HydrophobicContact CG1-CD1 4.36Å; V145-F156 HydrophobicContact CG1-CG 3.97Å; V145-F156 HydrophobicContact CG2-CD2 3.89Å; V145-F156 HydrophobicContact CG2-CE2 4.26Å; V145-F156 HydrophobicContact CG2-CG 4.09Å; Q152-F156 WeakPolarHBondContact O-CB 3.21Å; Q152-F156 PolarHBondContact O-N 3.37Å; I153-F156 PolarHBondContact O-N 3.06Å; F156-L158 VanDerWaalsContact C-N 3.35Å; F156-D159 PolarHBondContact O-N 2.98Å; F156-H160 WeakPolarHBondContact O-CB 3.48Å; F156-H160 PolarHBondContact O-N 3.17Å
157	L	91.2	Very high	83.4	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-64.6	-40	177.1	-68	172.7	0	0	0	111.6	L118 L120 L122 F140 P141 I153 L154 K155 Y161	L118-L157 HydrophobicContact CB-CD1 4.17Å; L120-L157 HydrophobicContact CD2-CD2 4.33Å; L122-L157 HydrophobicContact CB-CD1 4.07Å; F140-L157 HydrophobicContact CE1-CD2 3.98Å; P141-L157 HydrophobicContact CG-CD2 4.44Å; I153-L157 HydrophobicContact CG2-CD1 3.96Å; I153-L157 VanDerWaalsContact O-CG 3.32Å; I153-L157 WeakPolarHBondContact O-CG 3.39Å; I153-L157 PolarHBondContact O-N 3.35Å; L154-L157 PolarHBondContact O-N 3.21Å; K155-L157 VanDerWaalsContact C-N 3.34Å; K155-L157 PolarHBondContact O-N 3.22Å; L157-Y161 WeakPolarHBondContact O-CB 3.21Å; L157-Y161 PolarHBondContact O-N 3.11Å
158	L	90.2	Very high	81.5	Confident	57 Å²	57	73.3 Å²	73.3	30%	0.298	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-46.9	176	-178.6	64.2	0	0	0	112	L124 L154 K155 F156 H160 Y161 L162	L124-L158 HydrophobicContact CD2-CD1 3.88Å; L154-L158 WeakPolarHBondContact O-CB 3.45Å; L154-L158 PolarHBondContact O-N 3.28Å; K155-L158 PolarHBondContact O-N 3.36Å; F156-L158 VanDerWaalsContact C-N 3.35Å; L158-H160 VanDerWaalsContact C-N 3.28Å; L158-H160 PolarHBondContact O-N 3.35Å; L158-Y161 WeakPolarHBondContact O-CB 3.38Å; L158-Y161 PolarHBondContact O-N 2.97Å; L158-L162 HydrophobicContact CD1-CD1 4.34Å; L158-L162 HydrophobicContact CD1-CG 4.36Å; L158-L162 HydrophobicContact CG-CD1 4.13Å; L158-L162 WeakPolarHBondContact O-CG 3.32Å; L158-L162 PolarHBondContact O-N 3.07Å
159	D	88.4	Confident	79.5	Confident	85 Å²	85	71.4 Å²	71.4	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-60.7	-40.7	179.1	-68.8	-17.3	0	0	0	110.6	K155 F156 L162 G163	K155-D159 WeakPolarHBondContact O-CB 3.43Å; K155-D159 PolarHBondContact O-N 3.46Å; F156-D159 PolarHBondContact O-N 2.98Å; D159-L162 PolarHBondContact O-N 3.12Å; D159-G163 PolarHBondContact O-N 3.29Å
160	H	86.6	Confident	77.2	Confident	78 Å²	78	76.9 Å²	76.9	36%	0.361	40%	0.397	S	S	.	.	H	α-helix	trans	-72.6	-34.3	177	-164.2	-69.1	0	0	0	112.7	L120 F156 L158 L164	L120-H160 HydrophobicContact CD2-CB 3.66Å; L120-H160 WeakPolarHBondContact CD2-ND1 3.18Å; F156-H160 WeakPolarHBondContact O-CB 3.48Å; F156-H160 PolarHBondContact O-N 3.17Å; L158-H160 VanDerWaalsContact C-N 3.28Å; L158-H160 PolarHBondContact O-N 3.35Å; H160-L164 WeakPolarHBondContact O-CG 3.35Å; H160-L164 PolarHBondContact O-N 3.05Å
161	Y	87.4	Confident	74.5	Confident	35 Å²	35	83.5 Å²	83.5	14%	0.137	43%	0.426	C	S	.	.	H	α-helix	trans	-63	-45.2	171.6	-174	-93	0	0	0	111.1	L120 E121 L124 L157 L158 L164 M165	L120-Y161 HydrophobicContact CB-CD2 3.82Å; L120-Y161 HydrophobicContact CB-CG 4.45Å; E121-Y161 HydrophobicContact CG-CE2 4.09Å; L124-Y161 HydrophobicContact CD1-CE1 4.04Å; L124-Y161 HydrophobicContact CD1-CE2 4.25Å; L124-Y161 HydrophobicContact CD2-CD1 4.11Å; L124-Y161 HydrophobicContact CD2-CE1 4.05Å; L124-Y161 HydrophobicContact CG-CE1 4.45Å; L157-Y161 WeakPolarHBondContact O-CB 3.21Å; L157-Y161 PolarHBondContact O-N 3.11Å; L158-Y161 WeakPolarHBondContact O-CB 3.38Å; L158-Y161 PolarHBondContact O-N 2.97Å; Y161-L164 PolarHBondContact O-N 3.45Å; Y161-M165 HydrophobicContact CD1-CG 4.27Å; Y161-M165 HydrophobicContact CE1-CE 3.82Å; Y161-M165 HydrophobicContact CE1-CG 4.02Å; Y161-M165 HydrophobicContact CE2-CE 4.06Å; Y161-M165 VanDerWaalsContact CZ-CE 3.42Å; Y161-M165 WeakPolarHBondContact O-CG 3.45Å; Y161-M165 PolarHBondContact O-N 3.35Å; Y161-M165 VanDerWaalsContact O-N 3.14Å; Y161-M165 WeakPolarHBondContact OH-CE 3.41Å
162	L	85.8	Confident	71.7	Confident	81 Å²	81	78.5 Å²	78.5	42%	0.424	42%	0.424	S	S	.	.	H	α-helix	trans	-67.6	-38.9	177.6	-68.8	173.5	0	0	0	112.1	L158 D159 L164 M165 N166	L158-L162 HydrophobicContact CD1-CD1 4.34Å; L158-L162 HydrophobicContact CD1-CG 4.36Å; L158-L162 HydrophobicContact CG-CD1 4.13Å; L158-L162 WeakPolarHBondContact O-CG 3.32Å; L158-L162 PolarHBondContact O-N 3.07Å; D159-L162 PolarHBondContact O-N 3.12Å; L162-L164 VanDerWaalsContact C-N 3.33Å; L162-L164 PolarHBondContact O-N 2.77Å; L162-M165 PolarHBondContact O-N 3.03Å; L162-N166 PolarHBondContact O-N 3.49Å; L162-N166 PolarHBondContact O-ND2 3.28Å
163	G	81.2	Confident	68.9	Low	38 Å²	38	80.4 Å²	80.4	39%	0.392	45%	0.446	S	S	.	.	H	α-helix	trans	-58.6	-42.9	175.7	0	0	0	0	0	112.6	D159	D159-G163 PolarHBondContact O-N 3.29Å
164	L	79.7	Confident	65.7	Low	77 Å²	77	85.8 Å²	85.8	40%	0.403	48%	0.483	S	S	.	.	H	α-helix	trans	-66.5	-44.4	175.4	-73.7	163.7	0	0	0	112.1	L120 H160 Y161 L162 N166 T167 E168	L120-L164 HydrophobicContact CD1-CD1 3.44Å; L120-L164 VanDerWaalsContact CD1-CD1 3.44Å; H160-L164 WeakPolarHBondContact O-CG 3.35Å; H160-L164 PolarHBondContact O-N 3.05Å; Y161-L164 PolarHBondContact O-N 3.45Å; L162-L164 VanDerWaalsContact C-N 3.33Å; L162-L164 PolarHBondContact O-N 2.77Å; L164-N166 VanDerWaalsContact C-N 3.29Å; L164-N166 PolarHBondContact O-N 3.12Å; L164-T167 PolarHBondContact O-N 2.76Å; L164-T167 VanDerWaalsContact O-N 3.14Å; L164-T167 PolarHBondContact O-OG1 2.73Å; L164-E168 PolarHBondContact O-N 3.11Å
165	M	67.3	Low	62.5	Low	81 Å²	81	89.9 Å²	89.9	40%	0.399	51%	0.513	S	S	.	.	H	α-helix	trans	-64.2	-31.5	179.6	-71.1	-67.3	-173	0	0	113.3	Y161 L162 T167	Y161-M165 HydrophobicContact CD1-CG 4.27Å; Y161-M165 HydrophobicContact CE1-CE 3.82Å; Y161-M165 HydrophobicContact CE1-CG 4.02Å; Y161-M165 HydrophobicContact CE2-CE 4.06Å; Y161-M165 VanDerWaalsContact CZ-CE 3.42Å; Y161-M165 WeakPolarHBondContact O-CG 3.45Å; Y161-M165 PolarHBondContact O-N 3.35Å; Y161-M165 VanDerWaalsContact O-N 3.14Å; Y161-M165 WeakPolarHBondContact OH-CE 3.41Å; L162-M165 PolarHBondContact O-N 3.03Å; M165-T167 VanDerWaalsContact C-N 3.31Å
166	N	60.9	Low	59.3	Low	109 Å²	109	89.1 Å²	89.1	58%	0.583	52%	0.523	S	S	*	.	H	α-helix	trans	-76.2	-17.5	177.6	-67.3	-19.1	0	0	0	113.3	L162 L164 T169	L162-N166 PolarHBondContact O-N 3.49Å; L162-N166 PolarHBondContact O-ND2 3.28Å; L164-N166 VanDerWaalsContact C-N 3.29Å; L164-N166 PolarHBondContact O-N 3.12Å; N166-T169 PolarHBondContact O-OG1 3.32Å
167	T	52.5	Low	56.3	Low	86 Å²	86	94.9 Å²	94.9	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-84	-31.2	176.3	52.3	0	0	0	0	112.7	L164 M165 T169 N170	L164-T167 PolarHBondContact O-N 2.76Å; L164-T167 VanDerWaalsContact O-N 3.14Å; L164-T167 PolarHBondContact O-OG1 2.73Å; M165-T167 VanDerWaalsContact C-N 3.31Å; T167-T169 PolarHBondContact O-N 2.95Å; T167-N170 PolarHBondContact O-N 2.8Å
168	E	44.6	Very low	52.9	Low	153 Å²	153	105.6 Å²	105.6	72%	0.715	59%	0.593	S	S	*	*	H	α-helix	trans	-68.5	-19.8	178.6	-67.9	-175.6	177.5	0	0	113.1	L164	L164-E168 PolarHBondContact O-N 3.11Å
169	T	42.8	Very low	49.7	Very low	112 Å²	112	109.4 Å²	109.4	69%	0.687	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-10.7	178.2	52.7	0	0	0	0	114.3	N166 T167	N166-T169 PolarHBondContact O-OG1 3.32Å; T167-T169 PolarHBondContact O-N 2.95Å
170	N	39.6	Very low	46.6	Very low	145 Å²	145	111.5 Å²	111.5	78%	0.775	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-3.6	-176.5	-91.9	-9.8	0	0	0	115.6	T167	T167-N170 PolarHBondContact O-N 2.8Å
171	E	30.7	Very low	43.6	Very low	178 Å²	178	116.7 Å²	116.7	83%	0.832	65%	0.651	S	S	*	*			trans	-118	65.2	176.1	-63	-140.8	167.5	0	0	112.2
172	G	29.1	Very low	40.4	Very low	73 Å²	73	121 Å²	121	75%	0.753	69%	0.686	S	S	*	*			trans	-102.4	60.1	160.3	0	0	0	0	0	111
173	S	28.4	Very low	37.4	Very low	110 Å²	110	123.5 Å²	123.5	77%	0.769	71%	0.705	S	S	*	*	S	Bend	trans	-161.7	111	163	-77.5	0	0	0	0	110.9
174	S	23.9	Very low	34.6	Very low	114 Å²	114	130 Å²	130	80%	0.797	73%	0.725	S	S	*	*			trans	72	97.7	163	-69.4	0	0	0	0	121.3
175	S	22.7	Very low	31.6	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	75%	0.746	S	S	*	*				49.8	119.9	124.2	59.7	0	0	0	0	122.8
176	S	23.5	Very low	29.7	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	77%	0.765	S	S	*	*			trans	49.6	123	142.1	75.3	0	0	0	0	120.8
177	E	25	Very low	28	Very low	174 Å²	174	139.8 Å²	139.8	81%	0.813	78%	0.777	S	S	*	*				178.8	135.6	106	-97	174.8	-176.1	0	0	111.6
178	Y	20.8	Very low	26.7	Very low	225 Å²	225	143.3 Å²	143.3	88%	0.882	79%	0.792	S	S	*	*			trans	-68.4	127.8	166.4	-73.3	-93.6	0	0	0	109.4
179	N	23.4	Very low	25.9	Very low	137 Å²	137	141 Å²	141	73%	0.733	79%	0.785	S	S	*	*			trans	-139.1	97.4	156.5	-102.6	-44.5	0	0	0	110.9
180	T	22.2	Very low	25.3	Very low	130 Å²	130	142.1 Å²	142.1	80%	0.798	79%	0.787	S	S	*	*			trans	-73.7	113.7	153.7	39.4	0	0	0	0	108.4
181	K	23.7	Very low	24.8	Very low	186 Å²	186	141.7 Å²	141.7	81%	0.809	79%	0.785	S	S	*	*			trans	-156.2	118.7	155.1	-110.3	165.1	-169.7	177.9	0	110.4	T183	K181-T183 PolarHBondContact O-N 2.89Å
182	S	19.8	Very low	24.7	Very low	125 Å²	125	136.4 Å²	136.4	87%	0.874	76%	0.761	S	S	*	*			trans	-51.1	123.9	165.5	-45	0	0	0	0	110.2
183	T	24.2	Very low	24.7	Very low	134 Å²	134	137.5 Å²	137.5	82%	0.822	75%	0.75	S	S	*	*			trans	-145	136.8	151.5	-57.1	0	0	0	0	107.8	K181	K181-T183 PolarHBondContact O-N 2.89Å
184	E	22.1	Very low	25	Very low	176 Å²	176	136.8 Å²	136.8	82%	0.822	74%	0.741	S	S	*	*			trans	-52.9	145.2	-165.5	-71.9	153.9	152.5	0	0	115.5	P186	E184-P186 WeakPolarHBondContact O-CD 3.49Å
185	M	17.5	Very low	25.1	Very low	171 Å²	171	136.3 Å²	136.3	84%	0.842	73%	0.729	S	S	*	*			trans	-25.9	114.1	157.8	-58.7	-73.5	-76.5	0	0	114
186	P	25.4	Very low	25.5	Very low	121 Å²	121	136.7 Å²	136.7	79%	0.786	72%	0.717	S	S	*	*			trans	-82.3	129.9	149.6	32	-25.7	0	0	0	108.3	E184 N188	E184-P186 WeakPolarHBondContact O-CD 3.49Å; P186-N188 PolarHBondContact O-N 3.31Å
187	E	25.8	Very low	25.8	Very low	179 Å²	179	136.4 Å²	136.4	84%	0.836	71%	0.711	S	S	*	*			trans	-55.9	129.5	179.9	-61.3	-179.9	141.7	0	0	112.4	N189	E187-N189 PolarHBondContact O-N 3Å; E187-N189 VanDerWaalsContact O-N 3.14Å
188	N	26.5	Very low	26	Very low	160 Å²	160	135.2 Å²	135.2	86%	0.856	70%	0.703	S	S	*	*			trans	27.7	77.3	132.4	-161.7	23.9	0	0	0	116.7	P186	P186-N188 PolarHBondContact O-N 3.31Å
189	N	26	Very low	26.6	Very low	106 Å²	106	130.3 Å²	130.3	57%	0.567	69%	0.689	S	S	*	*			trans	-146.8	46.6	160.5	-134.6	-7.8	0	0	0	113.5	E187 N191 I192	E187-N189 PolarHBondContact O-N 3Å; E187-N189 VanDerWaalsContact O-N 3.14Å; N189-N191 VanDerWaalsContact C-N 3.29Å; N189-N191 PolarHBondContact O-N 3.42Å; N189-I192 WeakPolarHBondContact ND2-CD1 3.4Å
190	N	30.5	Very low	26.7	Very low	134 Å²	134	129.3 Å²	129.3	72%	0.717	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	11.9	176.1	-80.8	-20.7	0	0	0	114.6	I192	N190-I192 VanDerWaalsContact C-N 3.35Å
191	N	29	Very low	27.3	Very low	136 Å²	136	128.1 Å²	128.1	73%	0.727	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-0.2	162.2	-89.9	-12.8	0	0	0	113.8	N189	N189-N191 VanDerWaalsContact C-N 3.29Å; N189-N191 PolarHBondContact O-N 3.42Å
192	I	29.4	Very low	27.6	Very low	67 Å²	67	124.8 Å²	124.8	34%	0.344	66%	0.664	S	S	.	*	H	α-helix	trans	-91.1	-16.7	178.1	-65.8	-177.5	0	0	0	113.3	N189 N190 K196	N189-I192 WeakPolarHBondContact ND2-CD1 3.4Å; N190-I192 VanDerWaalsContact C-N 3.35Å; I192-K196 HydrophobicContact CG2-CD 3.85Å; I192-K196 HydrophobicContact CG2-CG 3.97Å; I192-K196 VanDerWaalsContact O-CB 3.29Å; I192-K196 WeakPolarHBondContact O-CB 3.5Å; I192-K196 WeakPolarHBondContact O-CG 3.24Å; I192-K196 PolarHBondContact O-N 3.03Å
193	N	29.2	Very low	28.3	Very low	96 Å²	96	125.2 Å²	125.2	51%	0.513	66%	0.656	S	S	.	*	H	α-helix	trans	-88	-20.4	-177.9	-70.8	-19.6	0	0	0	114.9	T197	N193-T197 PolarHBondContact O-OG1 3.38Å; N193-T197 VanDerWaalsContact O-OG1 3.08Å
194	V	33.6	Very low	28.6	Very low	95 Å²	95	121.8 Å²	121.8	58%	0.576	65%	0.648	S	S	*	*	H	α-helix	trans	-84.1	-25.2	169.5	-177.7	0	0	0	0	111.4	T197 K198	V194-T197 PolarHBondContact O-OG1 3Å; V194-K198 PolarHBondContact O-N 3.19Å
195	L	26.7	Very low	29	Very low	105 Å²	105	117.3 Å²	117.3	55%	0.55	63%	0.628	S	S	.	*	H	α-helix	trans	-84.7	-30.3	171.9	-70.4	172.6	0	0	0	112.4	T197 K198 Q199	L195-T197 VanDerWaalsContact C-N 3.32Å; L195-T197 PolarHBondContact O-N 3.36Å; L195-K198 CarbonylContact O-C 3.57Å; L195-K198 PolarHBondContact O-N 2.99Å; L195-Q199 WeakPolarHBondContact O-CA 3.39Å; L195-Q199 WeakPolarHBondContact O-CB 3.4Å; L195-Q199 PolarHBondContact O-N 3.01Å
196	K	30.8	Very low	30	Very low	111 Å²	111	116.2 Å²	116.2	48%	0.483	63%	0.626	S	S	.	*	H	α-helix	trans	-65.3	-33.9	171.4	-84.4	179.9	177.8	179.1	0	112.7	I192 L200	I192-K196 HydrophobicContact CG2-CD 3.85Å; I192-K196 HydrophobicContact CG2-CG 3.97Å; I192-K196 VanDerWaalsContact O-CB 3.29Å; I192-K196 WeakPolarHBondContact O-CB 3.5Å; I192-K196 WeakPolarHBondContact O-CG 3.24Å; I192-K196 PolarHBondContact O-N 3.03Å; K196-L200 HydrophobicContact CB-CD1 4.18Å; K196-L200 HydrophobicContact CD-CD1 4.5Å; K196-L200 HydrophobicContact CG-CD1 4.12Å; K196-L200 WeakPolarHBondContact O-CB 3.47Å; K196-L200 PolarHBondContact O-N 3.35Å
197	T	30	Very low	30.5	Very low	96 Å²	96	118.1 Å²	118.1	59%	0.589	62%	0.624	S	S	*	*	H	α-helix	trans	-78.5	-23.7	175.1	48	0	0	0	0	113.3	N193 V194 L195 V201	N193-T197 PolarHBondContact O-OG1 3.38Å; N193-T197 VanDerWaalsContact O-OG1 3.08Å; V194-T197 PolarHBondContact O-OG1 3Å; L195-T197 VanDerWaalsContact C-N 3.32Å; L195-T197 PolarHBondContact O-N 3.36Å; T197-V201 WeakPolarHBondContact O-CG2 3.24Å
198	K	30.5	Very low	31.4	Very low	149 Å²	149	116.5 Å²	116.5	65%	0.648	62%	0.621	S	S	*	*	H	α-helix	trans	-86.1	-23.8	170.2	-81.9	-175.7	171.9	-176	0	114.4	V194 L195 M202	V194-K198 PolarHBondContact O-N 3.19Å; L195-K198 CarbonylContact O-C 3.57Å; L195-K198 PolarHBondContact O-N 2.99Å; K198-M202 WeakPolarHBondContact O-CG 3.35Å
199	Q	32.2	Very low	32.2	Very low	123 Å²	123	114.1 Å²	114.1	58%	0.575	61%	0.608	S	S	*	*	H	α-helix	trans	-100.3	-37.1	-175.4	-157.4	70.5	32.9	0	0	112.2	L195 V201 M202	L195-Q199 WeakPolarHBondContact O-CA 3.39Å; L195-Q199 WeakPolarHBondContact O-CB 3.4Å; L195-Q199 PolarHBondContact O-N 3.01Å; Q199-V201 VanDerWaalsContact C-N 3.34Å; Q199-V201 PolarHBondContact O-N 3.12Å; Q199-M202 PolarHBondContact O-N 2.83Å
200	L	26.5	Very low	33.2	Very low	116 Å²	116	113.9 Å²	113.9	61%	0.607	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-1.7	178.9	-69.3	165.8	0	0	0	114.4	K196	K196-L200 HydrophobicContact CB-CD1 4.18Å; K196-L200 HydrophobicContact CD-CD1 4.5Å; K196-L200 HydrophobicContact CG-CD1 4.12Å; K196-L200 WeakPolarHBondContact O-CB 3.47Å; K196-L200 PolarHBondContact O-N 3.35Å
201	V	34.8	Very low	34	Very low	104 Å²	104	115.1 Å²	115.1	63%	0.63	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	-7.1	169.2	-174.9	0	0	0	0	111.6	T197 Q199	T197-V201 WeakPolarHBondContact O-CG2 3.24Å; Q199-V201 VanDerWaalsContact C-N 3.34Å; Q199-V201 PolarHBondContact O-N 3.12Å
202	M	29.3	Very low	34.7	Very low	116 Å²	116	114.6 Å²	114.6	57%	0.571	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-28.9	169.3	-71.9	-67.8	-71.2	0	0	112.3	K198 Q199 G204 I205	K198-M202 WeakPolarHBondContact O-CG 3.35Å; Q199-M202 PolarHBondContact O-N 2.83Å; M202-G204 VanDerWaalsContact C-N 3.28Å; M202-G204 PolarHBondContact O-N 2.85Å; M202-I205 HydrophobicContact CE-CD1 4.31Å; M202-I205 HydrophobicContact SD-CD1 3.81Å
203	D	34.2	Very low	35.7	Very low	135 Å²	135	115.1 Å²	115.1	72%	0.722	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-2.7	-178.9	-65.1	-15.7	0	0	0	113.7
204	G	30.7	Very low	37	Very low	62 Å²	62	115.2 Å²	115.2	64%	0.639	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	3	174	0	0	0	0	0	114.3	M202 N206	M202-G204 VanDerWaalsContact C-N 3.28Å; M202-G204 PolarHBondContact O-N 2.85Å; G204-N206 VanDerWaalsContact C-N 3.29Å; G204-N206 PolarHBondContact O-N 2.99Å
205	I	30.2	Very low	37.9	Very low	81 Å²	81	115.8 Å²	115.8	42%	0.415	61%	0.61	S	S	.	*			trans	-76.5	86.6	179	-57.1	174.6	0	0	0	107.8	M202 H207	M202-I205 HydrophobicContact CE-CD1 4.31Å; M202-I205 HydrophobicContact SD-CD1 3.81Å; I205-H207 PolarHBondContact O-N 3.09Å
206	N	38.6	Very low	39.2	Very low	148 Å²	148	114.8 Å²	114.8	79%	0.791	61%	0.605	S	S	*	*			trans	-55.6	110.7	153	-81.7	-21.2	0	0	0	106.7	G204 D208	G204-N206 VanDerWaalsContact C-N 3.29Å; G204-N206 PolarHBondContact O-N 2.99Å; N206-D208 PolarHBondContact O-N 3.39Å
207	H	36.9	Very low	40.3	Very low	162 Å²	162	114.1 Å²	114.1	75%	0.75	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	18.8	-168.9	-102.1	-67.1	0	0	0	115.5	I205	I205-H207 PolarHBondContact O-N 3.09Å
208	D	44.1	Very low	41.6	Very low	144 Å²	144	113.1 Å²	113.1	77%	0.77	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	12.6	-166.8	-71.5	-11.2	0	0	0	115.9	N206	N206-D208 PolarHBondContact O-N 3.39Å
209	N	43.3	Very low	42.2	Very low	111 Å²	111	111.1 Å²	111.1	59%	0.594	60%	0.599	S	S	*	*			trans	-121.2	71.1	172.7	-71.4	-26.4	0	0	0	112.2	E211 F212 T213	N209-E211 PolarHBondContact O-N 3.23Å; N209-F212 HydrophobicContact CB-CB 3.81Å; N209-F212 WeakPolarHBondContact O-CB 3.42Å; N209-F212 PolarHBondContact O-N 3.25Å; N209-T213 PolarHBondContact O-N 3Å
210	T	47.5	Very low	43.1	Very low	101 Å²	101	111.2 Å²	111.2	62%	0.62	60%	0.603	S	S	*	*	H	α-helix	trans	-52.4	-34.7	167.7	46.7	0	0	0	0	112.2	F212 T213 D214	T210-F212 VanDerWaalsContact C-N 3.27Å; T210-F212 PolarHBondContact O-N 3.42Å; T210-T213 PolarHBondContact O-OG1 2.95Å; T210-D214 PolarHBondContact O-N 3.23Å
211	E	47	Very low	44.1	Very low	160 Å²	160	110.3 Å²	110.3	75%	0.748	61%	0.607	S	S	*	*	H	α-helix	trans	-64.1	-28.5	175.2	-66.1	-172.6	162.8	0	0	113.5	N209 L215	N209-E211 PolarHBondContact O-N 3.23Å; E211-L215 PolarHBondContact O-N 3.43Å
212	F	43	Very low	44.2	Very low	124 Å²	124	109.5 Å²	109.5	54%	0.544	60%	0.602	S	S	.	*	H	α-helix	trans	-83.4	-35.4	-175.8	-143.1	-87.6	0	0	0	112	N209 T210 D214 L215 I216	N209-F212 HydrophobicContact CB-CB 3.81Å; N209-F212 WeakPolarHBondContact O-CB 3.42Å; N209-F212 PolarHBondContact O-N 3.25Å; T210-F212 VanDerWaalsContact C-N 3.27Å; T210-F212 PolarHBondContact O-N 3.42Å; F212-D214 VanDerWaalsContact C-N 3.32Å; F212-L215 PolarHBondContact O-N 3.07Å; F212-I216 HydrophobicContact CD1-CD1 4.03Å; F212-I216 HydrophobicContact CE1-CD1 4.28Å; F212-I216 WeakPolarHBondContact O-CG1 3.04Å; F212-I216 PolarHBondContact O-N 2.84Å
213	T	50.8	Low	44.6	Very low	78 Å²	78	109.3 Å²	109.3	48%	0.479	60%	0.603	S	S	.	*	H	α-helix	trans	-66.5	-36.7	172	46.4	0	0	0	0	111.6	N209 T210 I216 N217	N209-T213 PolarHBondContact O-N 3Å; T210-T213 PolarHBondContact O-OG1 2.95Å; T213-I216 PolarHBondContact O-N 3.12Å; T213-N217 WeakPolarHBondContact O-CB 3.34Å; T213-N217 VanDerWaalsContact O-CG 3.28Å; T213-N217 PolarHBondContact O-N 3.34Å; T213-N217 PolarHBondContact O-ND2 3.1Å
214	D	55.5	Low	44.8	Very low	99 Å²	99	109 Å²	109	53%	0.529	60%	0.601	S	S	.	*	H	α-helix	trans	-69.9	-35.8	178.2	-71.9	-12.5	0	0	0	112.1	T210 F212 S218	T210-D214 PolarHBondContact O-N 3.23Å; F212-D214 VanDerWaalsContact C-N 3.32Å; D214-S218 WeakPolarHBondContact O-CB 3.48Å; D214-S218 PolarHBondContact O-N 2.7Å; D214-S218 PolarHBondContact O-OG 2.97Å
215	L	53.4	Low	45.2	Very low	106 Å²	106	114.4 Å²	114.4	56%	0.555	61%	0.607	S	S	*	*	H	α-helix	trans	-66.3	-41.6	174.3	-111.1	163.8	0	0	0	112.5	E211 F212 S218 L219	E211-L215 PolarHBondContact O-N 3.43Å; F212-L215 PolarHBondContact O-N 3.07Å; L215-S218 PolarHBondContact O-N 2.84Å; L215-L219 HydrophobicContact CD2-CD1 4.46Å; L215-L219 WeakPolarHBondContact O-CB 3.23Å; L215-L219 WeakPolarHBondContact O-CG 3.41Å; L215-L219 PolarHBondContact O-N 3.13Å
216	I	54	Low	45.4	Very low	85 Å²	85	117.6 Å²	117.6	44%	0.436	63%	0.625	S	S	.	*	H	α-helix	trans	-68	-41.1	177.3	-67.6	174.4	0	0	0	110.9	F212 T213 L219 N220	F212-I216 HydrophobicContact CD1-CD1 4.03Å; F212-I216 HydrophobicContact CE1-CD1 4.28Å; F212-I216 WeakPolarHBondContact O-CG1 3.04Å; F212-I216 PolarHBondContact O-N 2.84Å; T213-I216 PolarHBondContact O-N 3.12Å; I216-L219 PolarHBondContact O-N 2.96Å; I216-N220 WeakPolarHBondContact O-CB 3.47Å; I216-N220 PolarHBondContact O-N 3.12Å; I216-N220 PolarHBondContact O-ND2 3.05Å
217	N	53.2	Low	45	Very low	96 Å²	96	120.3 Å²	120.3	51%	0.513	62%	0.624	S	S	.	*	H	α-helix	trans	-68.8	-35.6	176	-71.9	-25.4	0	0	0	112.4	T213 S221	T213-N217 WeakPolarHBondContact O-CB 3.34Å; T213-N217 VanDerWaalsContact O-CG 3.28Å; T213-N217 PolarHBondContact O-N 3.34Å; T213-N217 PolarHBondContact O-ND2 3.1Å; N217-S221 WeakPolarHBondContact O-CB 2.96Å; N217-S221 PolarHBondContact O-N 3.27Å; N217-S221 VanDerWaalsContact O-N 3.09Å; N217-S221 PolarHBondContact O-OG 2.87Å
218	S	58.6	Low	44.5	Very low	75 Å²	75	120.4 Å²	120.4	52%	0.524	62%	0.624	S	S	.	*	H	α-helix	trans	-64.4	-42.6	172.6	-65.1	0	0	0	0	111.5	D214 L215 S221 V222	D214-S218 WeakPolarHBondContact O-CB 3.48Å; D214-S218 PolarHBondContact O-N 2.7Å; D214-S218 PolarHBondContact O-OG 2.97Å; L215-S218 PolarHBondContact O-N 2.84Å; S218-S221 PolarHBondContact O-N 2.96Å; S218-V222 WeakPolarHBondContact O-CG2 3.21Å; S218-V222 PolarHBondContact O-N 3.06Å
219	L	43.6	Very low	43.8	Very low	107 Å²	107	119.1 Å²	119.1	56%	0.56	62%	0.624	S	S	*	*	H	α-helix	trans	-68.3	-38.2	177.1	-81.9	162.5	0	0	0	112.9	L215 I216 S221 V222	L215-L219 HydrophobicContact CD2-CD1 4.46Å; L215-L219 WeakPolarHBondContact O-CB 3.23Å; L215-L219 WeakPolarHBondContact O-CG 3.41Å; L215-L219 PolarHBondContact O-N 3.13Å; I216-L219 PolarHBondContact O-N 2.96Å; L219-S221 PolarHBondContact O-N 2.8Å; L219-V222 PolarHBondContact O-N 3.33Å
220	N	50.5	Low	43	Very low	125 Å²	125	120.6 Å²	120.6	67%	0.668	63%	0.631	S	S	*	*	H	α-helix	trans	-69.4	-22.8	175	-73.9	-28.1	0	0	0	112.8	I216	I216-N220 WeakPolarHBondContact O-CB 3.47Å; I216-N220 PolarHBondContact O-N 3.12Å; I216-N220 PolarHBondContact O-ND2 3.05Å
221	S	47.2	Very low	42	Very low	97 Å²	97	123.5 Å²	123.5	68%	0.678	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-11.5	174.4	-63.8	0	0	0	0	113.6	N217 S218 L219 N223	N217-S221 WeakPolarHBondContact O-CB 2.96Å; N217-S221 PolarHBondContact O-N 3.27Å; N217-S221 VanDerWaalsContact O-N 3.09Å; N217-S221 PolarHBondContact O-OG 2.87Å; S218-S221 PolarHBondContact O-N 2.96Å; L219-S221 PolarHBondContact O-N 2.8Å; S221-N223 PolarHBondContact O-N 2.95Å
222	V	37.3	Very low	41.1	Very low	87 Å²	87	121.4 Å²	121.4	53%	0.527	64%	0.64	S	S	.	*			trans	-77.5	77.1	172.8	-166.6	0	0	0	0	109.6	S218 L219 L224	S218-V222 WeakPolarHBondContact O-CG2 3.21Å; S218-V222 PolarHBondContact O-N 3.06Å; L219-V222 PolarHBondContact O-N 3.33Å; V222-L224 HydrophobicContact CG1-CD2 3.87Å; V222-L224 HydrophobicContact CG1-CG 3.99Å; V222-L224 PolarHBondContact O-N 3.3Å
223	N	37.1	Very low	40.3	Very low	113 Å²	113	122 Å²	122	60%	0.604	65%	0.654	S	S	*	*			trans	-71	93.5	166.1	-166.5	-1	0	0	0	108.2	S221 K225	S221-N223 PolarHBondContact O-N 2.95Å; N223-K225 PolarHBondContact O-N 3.39Å; N223-K225 WeakPolarHBondContact OD1-CG 3.14Å
224	L	38.8	Very low	39.1	Very low	127 Å²	127	129.6 Å²	129.6	67%	0.665	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	19.3	179.7	-72.7	168.2	0	0	0	114.4	V222 D226	V222-L224 HydrophobicContact CG1-CD2 3.87Å; V222-L224 HydrophobicContact CG1-CG 3.99Å; V222-L224 PolarHBondContact O-N 3.3Å; L224-D226 VanDerWaalsContact C-N 3.31Å
225	K	39.7	Very low	37.6	Very low	176 Å²	176	127.9 Å²	127.9	77%	0.765	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-13.8	177.5	-74.6	-174.6	177.1	-179.3	0	113.9	N223	N223-K225 PolarHBondContact O-N 3.39Å; N223-K225 WeakPolarHBondContact OD1-CG 3.14Å
226	D	33.4	Very low	36.3	Very low	149 Å²	149	131.9 Å²	131.9	80%	0.797	70%	0.698	S	S	*	*			trans	-105.5	65.1	176.9	-66.4	-31.5	0	0	0	112.2	L224	L224-D226 VanDerWaalsContact C-N 3.31Å
227	R	29.6	Very low	35	Very low	204 Å²	204	136.7 Å²	136.7	77%	0.77	72%	0.719	S	S	*	*			trans	-116.2	94.1	149.8	-75.8	-153	-178.9	-145.1	3.1	109.2
228	Q	27.6	Very low	33.6	Very low	164 Å²	164	139.8 Å²	139.8	77%	0.766	74%	0.735	S	S	*	*			trans	-44.4	133.4	160.2	-71.6	-72.9	-19.8	0	0	109.4	L230	Q228-L230 PolarHBondContact O-N 2.92Å
229	P	29.2	Very low	32	Very low	118 Å²	118	141.9 Å²	141.9	77%	0.766	75%	0.749	S	S	*	*			trans	-65.3	108.9	-173.1	23.8	-30.5	0	0	0	110.5	H231	P229-H231 PolarHBondContact O-N 3.49Å
230	L	25.7	Very low	31	Very low	142 Å²	142	144.9 Å²	144.9	74%	0.743	76%	0.763	S	S	*	*			trans	-63.1	116.2	171.9	-76.3	163.3	0	0	0	109.8	Q228	Q228-L230 PolarHBondContact O-N 2.92Å
231	H	27.9	Very low	29.9	Very low	161 Å²	161	146.8 Å²	146.8	75%	0.745	77%	0.773	S	S	*	*			trans	57.3	95.9	157.3	-79.9	-80.6	0	0	0	118.8	P229 V233	P229-H231 PolarHBondContact O-N 3.49Å; H231-V233 PolarHBondContact O-N 2.93Å
232	S	26.2	Very low	28.8	Very low	116 Å²	116	149.3 Å²	149.3	81%	0.811	78%	0.778	S	S	*	*			trans	-61.9	104.6	141.7	176.6	0	0	0	0	108.9	R234	S232-R234 PolarHBondContact O-N 3.36Å
233	V	27.4	Very low	28.3	Very low	138 Å²	138	151.5 Å²	151.5	84%	0.836	79%	0.787	S	S	*	*			trans	-63.7	99	173.1	178.7	0	0	0	0	108.9	H231	H231-V233 PolarHBondContact O-N 2.93Å
234	R	25.7	Very low	27.6	Very low	236 Å²	236	154.2 Å²	154.2	89%	0.891	80%	0.796	S	S	*	*			trans	-118.1	105.2	163.6	-164.5	176.8	-170.1	-156.5	0.6	108.6	S232	S232-R234 PolarHBondContact O-N 3.36Å
235	G	24.7	Very low	26.9	Very low	64 Å²	64	152.5 Å²	152.5	66%	0.66	79%	0.794	S	S	*	*			trans	37.4	94.4	153.5	0	0	0	0	0	118.1	H237	G235-H237 PolarHBondContact O-N 3.02Å
236	M	25	Very low	26	Very low	189 Å²	189	151.4 Å²	151.4	93%	0.931	80%	0.797	S	S	*	*			trans	-78.7	97.9	156.4	-63.8	-171.1	77.6	0	0	108.4
237	H	26.4	Very low	25.8	Very low	187 Å²	187	152.7 Å²	152.7	87%	0.866	80%	0.803	S	S	*	*			trans	-87.1	130.7	153.6	-91	-85	0	0	0	108	G235	G235-H237 PolarHBondContact O-N 3.02Å
238	N	24.3	Very low	25.4	Very low	161 Å²	161	150.5 Å²	150.5	86%	0.861	81%	0.806	S	S	*	*			trans	-56.5	136.2	177.8	-58.1	-40.2	0	0	0	112.5
239	S	25.2	Very low	25.1	Very low	118 Å²	118	148.9 Å²	148.9	83%	0.825	81%	0.811	S	S	*	*				-172.3	138.6	123.6	-170.2	0	0	0	0	109.9
240	M	22.3	Very low	25	Very low	170 Å²	170	148.7 Å²	148.7	84%	0.837	81%	0.81	S	S	*	*			trans	-56.4	140.2	169.7	-68.1	162.5	178.3	0	0	111.4
241	D	27.4	Very low	24.8	Very low	165 Å²	165	152.3 Å²	152.3	88%	0.882	81%	0.814	S	S	*	*				-164.3	146	125.3	-99.3	-26.2	0	0	0	111.4
242	L	25.1	Very low	24.5	Very low	150 Å²	150	153.3 Å²	153.3	79%	0.785	82%	0.824	S	S	*	*			trans	-88.8	162.3	-171.9	-73.7	156.3	0	0	0	112.3
243	N	25.8	Very low	24.3	Very low	133 Å²	133	155.5 Å²	155.5	71%	0.711	82%	0.821	S	S	*	*			trans	89.3	111.5	148.1	-61.7	-29.3	0	0	0	120.8
244	H	22.4	Very low	24	Very low	171 Å²	171	158.5 Å²	158.5	79%	0.792	82%	0.818	S	S	*	*				59.2	120.7	123.1	-84.6	-72.2	0	0	0	122.5
245	S	23.1	Very low	23.8	Very low	91 Å²	91	152.8 Å²	152.8	64%	0.636	81%	0.814	S	S	*	*			trans	60.8	126.5	136.1	55.1	0	0	0	0	121.1
246	D	22.7	Very low	23.7	Very low	153 Å²	153	158.1 Å²	158.1	82%	0.818	82%	0.815	S	S	*	*			trans	64.2	110.1	149.6	-58.1	-24.2	0	0	0	118.5
247	L	28.3	Very low	23.5	Very low	176 Å²	176	154.8 Å²	154.8	92%	0.921	81%	0.81	S	S	*	*				-170.7	120.2	125.1	-94.6	170.2	0	0	0	110.4
248	N	22.3	Very low	23.4	Very low	158 Å²	158	150 Å²	150	85%	0.845	80%	0.803	S	S	*	*			trans	-55.3	134.1	157.8	-84.4	-47.5	0	0	0	110.8
249	C	21.2	Very low	23.3	Very low	129 Å²	129	150 Å²	150	87%	0.872	80%	0.803	S	S	*	*				-176	147.8	129.2	-102.7	0	0	0	0	112.6
250	P	26.9	Very low	23.2	Very low	115 Å²	115	148.5 Å²	148.5	75%	0.747	80%	0.798	S	S	*	*			trans	-110.9	157.7	-158.9	37.2	-24.3	0	0	0	115.8
251	R	20.1	Very low	23.3	Very low	218 Å²	218	145.8 Å²	145.8	82%	0.823	80%	0.796	S	S	*	*			trans	45.2	113.8	139.7	-159.8	176	-174.3	146	0.7	119.9
252	L	23.3	Very low	23	Very low	181 Å²	181	147.5 Å²	147.5	95%	0.948	80%	0.796	S	S	*	*			trans	-136.1	95.5	145.9	-78.2	175.8	0	0	0	110.2
253	E	21.1	Very low	22.9	Very low	163 Å²	163	145.5 Å²	145.5	76%	0.762	79%	0.794	S	S	*	*			trans	-94.1	120.5	162.7	-92.4	-83.9	162.1	0	0	107.2
254	R	21.5	Very low	22.6	Very low	201 Å²	201	142.4 Å²	142.4	76%	0.758	79%	0.794	S	S	*	*			trans	-114.5	102.6	-176.5	-146.9	178.7	-156.4	-159.6	8.2	107.9	Y256	R254-Y256 HydrophobicContact CG-CD2 4.24Å; R254-Y256 HydrophobicContact CG-CE2 3.67Å; R254-Y256 PolarHBondContact NE-OH 3Å; R254-Y256 PolarHBondContact NH1-OH 2.81Å; R254-Y256 PolarHBondContact NH2-OH 3.48Å
255	S	21.9	Very low	22.5	Very low	116 Å²	116	141.6 Å²	141.6	81%	0.811	79%	0.794	S	S	*	*			trans	-121.4	124.2	163.2	52.9	0	0	0	0	108.9
256	Y	21.2	Very low	22.5	Very low	175 Å²	175	143.7 Å²	143.7	69%	0.686	80%	0.797	S	S	*	*			trans	-94.8	129.4	-179.2	-79.5	-89.3	0	0	0	109.6	R254	R254-Y256 HydrophobicContact CG-CD2 4.24Å; R254-Y256 HydrophobicContact CG-CE2 3.67Å; R254-Y256 PolarHBondContact NE-OH 3Å; R254-Y256 PolarHBondContact NH1-OH 2.81Å; R254-Y256 PolarHBondContact NH2-OH 3.48Å
257	S	22.3	Very low	22.3	Very low	119 Å²	119	144 Å²	144	83%	0.832	79%	0.794	S	S	*	*			trans	-147.2	127.8	153.3	-89.9	0	0	0	0	110.2
258	A	23.6	Very low	21.9	Very low	87 Å²	87	143 Å²	143	72%	0.719	79%	0.79	S	S	*	*			trans	41.5	111.5	147.1	0	0	0	0	0	119.6
259	D	22.2	Very low	21.9	Very low	160 Å²	160	144.2 Å²	144.2	86%	0.856	79%	0.79	S	S	*	*				-176.3	148.2	99.2	-92.1	-22.3	0	0	0	114.1
260	A	23.4	Very low	21.8	Very low	87 Å²	87	145.2 Å²	145.2	72%	0.719	79%	0.787	S	S	*	*			trans	46.8	111.8	147.9	0	0	0	0	0	122.6
261	S	24.5	Very low	21.7	Very low	113 Å²	113	146.3 Å²	146.3	79%	0.79	79%	0.792	S	S	*	*			trans	57.9	109.5	136.9	42.5	0	0	0	0	122.5
262	F	21.2	Very low	21.7	Very low	201 Å²	201	143.5 Å²	143.5	88%	0.882	79%	0.793	S	S	*	*			trans	48.4	102.5	136.2	-108.1	-96.1	0	0	0	120.4
263	S	21.8	Very low	21.7	Very low	108 Å²	108	142.5 Å²	142.5	76%	0.755	79%	0.789	S	S	*	*			trans	44.5	120	141.3	68.2	0	0	0	0	120.8
264	G	20.6	Very low	21.7	Very low	69 Å²	69	141.3 Å²	141.3	71%	0.711	79%	0.787	S	S	*	*			trans	143.9	76	144.9	0	0	0	0	0	117.4
265	I	20.3	Very low	21.8	Very low	154 Å²	154	136.6 Å²	136.6	79%	0.79	79%	0.786	S	S	*	*				54.1	106.2	120.7	-65	-179.5	0	0	0	118.4
266	L	21.4	Very low	21.8	Very low	134 Å²	134	138 Å²	138	70%	0.702	78%	0.784	S	S	*	*			trans	122	122	133.4	-75.8	163.7	0	0	0	118.9
267	Q	20.1	Very low	21.9	Very low	159 Å²	159	137.5 Å²	137.5	74%	0.743	79%	0.788	S	S	*	*			trans	68.2	107.7	138.7	-71.9	171.7	-1.5	0	0	117.4
268	N	19.4	Very low	21.9	Very low	157 Å²	157	136.4 Å²	136.4	84%	0.84	78%	0.78	S	S	*	*				66.9	109.7	89.6	-96.3	8.8	0	0	0	112.3
269	E	22.4	Very low	21.9	Very low	183 Å²	183	141.7 Å²	141.7	86%	0.855	79%	0.787	S	S	*	*				-175.3	112.4	123.9	-71.6	-137.8	148.8	0	0	105.7
270	N	19.7	Very low	22	Very low	149 Å²	149	142.9 Å²	142.9	80%	0.797	79%	0.785	S	S	*	*				57.1	116.1	88.5	-82.8	-10	0	0	0	115.7
271	T	24.7	Very low	21.9	Very low	138 Å²	138	145.8 Å²	145.8	85%	0.847	79%	0.793	S	S	*	*			trans	166	96.4	147.6	36.4	0	0	0	0	106
272	N	18.7	Very low	21.9	Very low	160 Å²	160	148 Å²	148	86%	0.856	79%	0.788	S	S	*	*				34.5	107.6	83.4	-76.7	-4	0	0	0	113.8
273	D	23.6	Very low	22	Very low	159 Å²	159	144.1 Å²	144.1	85%	0.85	78%	0.781	S	S	*	*				-160	159.5	127.9	-129.8	-19.9	0	0	0	113.4
274	D	21.4	Very low	22	Very low	138 Å²	138	148.2 Å²	148.2	74%	0.738	79%	0.786	S	S	*	*			trans	-87	171.6	-154.2	-79.8	-53.5	0	0	0	117.3
275	S	23.6	Very low	22.3	Very low	103 Å²	103	151.7 Å²	151.7	72%	0.72	79%	0.788	S	S	*	*			trans	84.5	119.3	137	64.6	0	0	0	0	122
276	D	22.9	Very low	22.8	Very low	145 Å²	145	153.5 Å²	153.5	78%	0.775	79%	0.793	S	S	*	*				88.7	125.6	125.3	-72.8	-22.2	0	0	0	124.9
277	E	22.7	Very low	23.2	Very low	165 Å²	165	152.6 Å²	152.6	77%	0.771	79%	0.793	S	S	*	*			trans	63.9	107.1	135.8	-75.6	-170.8	138.1	0	0	122.3
278	S	22.3	Very low	23.9	Very low	96 Å²	96	151.3 Å²	151.3	67%	0.671	79%	0.791	S	S	*	*				82.3	129.5	116.2	86.1	0	0	0	0	119.7
279	K	24.4	Very low	24.8	Very low	198 Å²	198	146.5 Å²	146.5	86%	0.861	78%	0.778	S	S	*	*			trans	51.9	87.8	149.9	-62.5	178.6	-177.7	172.8	0	117.2
280	K	23.4	Very low	25.4	Very low	185 Å²	185	145.4 Å²	145.4	80%	0.804	77%	0.774	S	S	*	*			trans	-144.2	98.3	140.4	-111.3	169.2	-172.5	171.9	0	110.1	K282	K280-K282 VanDerWaalsContact C-N 3.28Å; K280-K282 PolarHBondContact O-N 3.48Å
281	V	22.1	Very low	26.3	Very low	147 Å²	147	141.7 Å²	141.7	89%	0.891	76%	0.759	S	S	*	*			trans	-56.2	95.2	158.7	176.2	0	0	0	0	106.5
282	K	24.3	Very low	27.3	Very low	160 Å²	160	142.8 Å²	142.8	70%	0.696	75%	0.752	S	S	*	*			trans	-91.2	105.5	169.3	-74.6	-175.8	-179.9	178.5	0	107.2	K280 F284	K280-K282 VanDerWaalsContact C-N 3.28Å; K280-K282 PolarHBondContact O-N 3.48Å; K282-F284 PolarHBondContact O-N 2.91Å
283	T	21.6	Very low	28.3	Very low	120 Å²	120	140.5 Å²	140.5	74%	0.736	74%	0.739	S	S	*	*			trans	-40.3	103.9	155.5	44.6	0	0	0	0	109.1	D285	T283-D285 PolarHBondContact O-N 2.83Å
284	F	23.3	Very low	28.8	Very low	193 Å²	193	138.8 Å²	138.8	85%	0.846	73%	0.729	S	S	*	*			trans	-81.1	107.3	170.8	-113.2	-89.9	0	0	0	107.3	K282 Q286	K282-F284 PolarHBondContact O-N 2.91Å; F284-Q286 PolarHBondContact O-N 3.48Å
285	D	27	Very low	29.5	Very low	143 Å²	143	135.9 Å²	135.9	77%	0.765	72%	0.72	S	S	*	*			trans	-53.9	94.6	172.3	-72.4	-44.6	0	0	0	110.9	T283 V287	T283-D285 PolarHBondContact O-N 2.83Å; D285-V287 PolarHBondContact O-N 3.43Å
286	Q	29.1	Very low	30.5	Very low	192 Å²	192	134.8 Å²	134.8	90%	0.897	71%	0.709	S	S	*	*			trans	-84.2	57.8	161.5	-83.4	-173.7	-9	0	0	109.7	F284	F284-Q286 PolarHBondContact O-N 3.48Å
287	V	31.8	Very low	31	Very low	115 Å²	115	131.9 Å²	131.9	70%	0.697	69%	0.692	S	S	*	*			trans	-126.7	64.8	171.6	-165.5	0	0	0	0	108.8	D285	D285-V287 PolarHBondContact O-N 3.43Å
288	N	34.3	Very low	31.4	Very low	132 Å²	132	125.4 Å²	125.4	71%	0.706	67%	0.67	S	S	*	*	S	Bend	trans	-155.9	10	162.1	-98.8	-25.3	0	0	0	114.9
289	G	37.1	Very low	32	Very low	55 Å²	55	124.6 Å²	124.6	57%	0.567	67%	0.665	S	S	*	*	H	α-helix	trans	-82.7	-33.9	174	0	0	0	0	0	113.8	L293	G289-L293 WeakPolarHBondContact O-CB 3.35Å; G289-L293 PolarHBondContact O-N 2.98Å; G289-L293 VanDerWaalsContact O-N 3.12Å
290	Q	34.9	Very low	32.7	Very low	161 Å²	161	120.4 Å²	120.4	75%	0.752	65%	0.651	S	S	*	*	H	α-helix	trans	-74.4	-35.5	-176	-74.4	-179.9	-13.2	0	0	112.8	L293 L294	Q290-L293 PolarHBondContact O-N 3.42Å; Q290-L294 WeakPolarHBondContact O-CB 3.18Å; Q290-L294 PolarHBondContact O-N 3.22Å
291	S	39.9	Very low	33.2	Very low	70 Å²	70	117.7 Å²	117.7	49%	0.49	64%	0.643	S	S	.	*	H	α-helix	trans	-66.2	-40.1	177.2	56.5	0	0	0	0	112	L294 S295	S291-L294 PolarHBondContact O-N 3.04Å; S291-S295 WeakPolarHBondContact O-CB 3.48Å; S291-S295 PolarHBondContact O-N 3.16Å
292	K	46.1	Very low	33.7	Very low	162 Å²	162	117 Å²	117	70%	0.704	64%	0.635	S	S	*	*	H	α-helix	trans	-69.3	-36.9	175.9	-134.8	167.8	-171.2	171.3	0	111.9	S295 V296	K292-S295 PolarHBondContact O-N 2.88Å; K292-V296 WeakPolarHBondContact O-CB 3.45Å; K292-V296 VanDerWaalsContact O-CG2 3.24Å; K292-V296 WeakPolarHBondContact O-CG2 3.45Å; K292-V296 PolarHBondContact O-N 2.92Å
293	L	38.2	Very low	34	Very low	111 Å²	111	112.5 Å²	112.5	58%	0.581	63%	0.627	S	S	*	*	H	α-helix	trans	-71.3	-37.8	176.2	-164.3	145.3	0	0	0	111.8	G289 Q290 V296 L297	G289-L293 WeakPolarHBondContact O-CB 3.35Å; G289-L293 PolarHBondContact O-N 2.98Å; G289-L293 VanDerWaalsContact O-N 3.12Å; Q290-L293 PolarHBondContact O-N 3.42Å; L293-V296 PolarHBondContact O-N 3.28Å; L293-L297 HydrophobicContact CD2-CD1 3.42Å; L293-L297 VanDerWaalsContact CD2-CD1 3.42Å; L293-L297 HydrophobicContact CD2-CG 3.99Å; L293-L297 VanDerWaalsContact O-CB 3.32Å; L293-L297 WeakPolarHBondContact O-CB 3.44Å; L293-L297 VanDerWaalsContact O-CG 3.24Å; L293-L297 WeakPolarHBondContact O-CG 3.31Å; L293-L297 PolarHBondContact O-N 2.96Å
294	L	35.5	Very low	34.4	Very low	124 Å²	124	114.2 Å²	114.2	65%	0.649	63%	0.632	S	S	*	*	H	α-helix	trans	-66.5	-38	171.9	-101.4	142.8	0	0	0	112.4	Q290 S291 L297 G298	Q290-L294 WeakPolarHBondContact O-CB 3.18Å; Q290-L294 PolarHBondContact O-N 3.22Å; S291-L294 PolarHBondContact O-N 3.04Å; L294-L297 PolarHBondContact O-N 3.46Å; L294-G298 PolarHBondContact O-N 3.05Å
295	S	35.9	Very low	34.5	Very low	76 Å²	76	111.9 Å²	111.9	53%	0.531	63%	0.628	S	S	.	*	H	α-helix	trans	-64.7	-44.1	173.4	172.6	0	0	0	0	111.5	S291 K292 G298 S299	S291-S295 WeakPolarHBondContact O-CB 3.48Å; S291-S295 PolarHBondContact O-N 3.16Å; K292-S295 PolarHBondContact O-N 2.88Å; S295-G298 PolarHBondContact O-N 3.36Å; S295-S299 PolarHBondContact O-N 2.96Å; S295-S299 PolarHBondContact O-OG 3.05Å; S295-S299 VanDerWaalsContact O-OG 3.08Å
296	V	44	Very low	34.6	Very low	81 Å²	81	112.2 Å²	112.2	49%	0.491	63%	0.63	S	S	.	*	H	α-helix	trans	-66.7	-40.1	176.2	171.9	0	0	0	0	111.7	K292 L293 S299 I300	K292-V296 WeakPolarHBondContact O-CB 3.45Å; K292-V296 VanDerWaalsContact O-CG2 3.24Å; K292-V296 WeakPolarHBondContact O-CG2 3.45Å; K292-V296 PolarHBondContact O-N 2.92Å; L293-V296 PolarHBondContact O-N 3.28Å; V296-S299 PolarHBondContact O-N 3.09Å; V296-I300 HydrophobicContact CG1-CD1 3.88Å; V296-I300 WeakPolarHBondContact O-CD1 3.4Å; V296-I300 VanDerWaalsContact O-CG1 3.24Å; V296-I300 WeakPolarHBondContact O-CG1 3.33Å; V296-I300 PolarHBondContact O-N 3.03Å
297	L	33	Very low	34.4	Very low	83 Å²	83	107.9 Å²	107.9	44%	0.435	62%	0.621	S	S	.	*	H	α-helix	trans	-67.2	-38.3	175.2	-74.9	177.3	0	0	0	111.8	L293 L294 I300 I301	L293-L297 HydrophobicContact CD2-CD1 3.42Å; L293-L297 VanDerWaalsContact CD2-CD1 3.42Å; L293-L297 HydrophobicContact CD2-CG 3.99Å; L293-L297 VanDerWaalsContact O-CB 3.32Å; L293-L297 WeakPolarHBondContact O-CB 3.44Å; L293-L297 VanDerWaalsContact O-CG 3.24Å; L293-L297 WeakPolarHBondContact O-CG 3.31Å; L293-L297 PolarHBondContact O-N 2.96Å; L294-L297 PolarHBondContact O-N 3.46Å; L297-I300 PolarHBondContact O-N 3.49Å; L297-I301 VanDerWaalsContact O-CG1 3.31Å; L297-I301 WeakPolarHBondContact O-CG1 3.38Å; L297-I301 PolarHBondContact O-N 3.23Å
298	G	31	Very low	34.3	Very low	29 Å²	29	108.4 Å²	108.4	30%	0.299	62%	0.624	S	S	.	*	H	α-helix	trans	-64.1	-40	175	0	0	0	0	0	112.6	L294 S295 I300 N302	L294-G298 PolarHBondContact O-N 3.05Å; S295-G298 PolarHBondContact O-N 3.36Å; G298-I300 VanDerWaalsContact C-N 3.28Å; G298-I300 PolarHBondContact O-N 2.99Å; G298-N302 WeakPolarHBondContact O-CB 3.24Å; G298-N302 PolarHBondContact O-N 3.01Å; G298-N302 VanDerWaalsContact O-N 3.1Å
299	S	35.5	Very low	33.7	Very low	80 Å²	80	109.4 Å²	109.4	56%	0.559	62%	0.624	S	S	*	*	H	α-helix	trans	-68.4	-24.5	174.3	-57.2	0	0	0	0	113.7	S295 V296 A303	S295-S299 PolarHBondContact O-N 2.96Å; S295-S299 PolarHBondContact O-OG 3.05Å; S295-S299 VanDerWaalsContact O-OG 3.08Å; V296-S299 PolarHBondContact O-N 3.09Å; S299-A303 WeakPolarHBondContact O-CB 3.32Å
300	I	38.3	Very low	33	Very low	110 Å²	110	117.9 Å²	117.9	56%	0.564	64%	0.641	S	S	*	*	H	α-helix	trans	-86.8	-34.3	178.9	-66.9	165.1	0	0	0	111.1	V296 L297 G298	V296-I300 HydrophobicContact CG1-CD1 3.88Å; V296-I300 WeakPolarHBondContact O-CD1 3.4Å; V296-I300 VanDerWaalsContact O-CG1 3.24Å; V296-I300 WeakPolarHBondContact O-CG1 3.33Å; V296-I300 PolarHBondContact O-N 3.03Å; L297-I300 PolarHBondContact O-N 3.49Å; G298-I300 VanDerWaalsContact C-N 3.28Å; G298-I300 PolarHBondContact O-N 2.99Å
301	I	34.8	Very low	32.6	Very low	128 Å²	128	118.4 Å²	118.4	66%	0.656	64%	0.643	S	S	*	*	H	α-helix	trans	-75.7	-28.6	178.4	-67.1	167.3	0	0	0	111.2	L297	L297-I301 VanDerWaalsContact O-CG1 3.31Å; L297-I301 WeakPolarHBondContact O-CG1 3.38Å; L297-I301 PolarHBondContact O-N 3.23Å
302	N	31.7	Very low	31.7	Very low	133 Å²	133	118.3 Å²	118.3	71%	0.711	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	13.2	-179.1	-65.1	-19.5	0	0	0	114.6	G298	G298-N302 WeakPolarHBondContact O-CB 3.24Å; G298-N302 PolarHBondContact O-N 3.01Å; G298-N302 VanDerWaalsContact O-N 3.1Å
303	A	31.3	Very low	30.7	Very low	65 Å²	65	119 Å²	119	54%	0.537	66%	0.659	S	S	.	*	S	Bend	trans	-94.7	4.6	-179.9	0	0	0	0	0	114.8	S299	S299-A303 WeakPolarHBondContact O-CB 3.32Å
304	D	30.5	Very low	30.2	Very low	156 Å²	156	122.2 Å²	122.2	83%	0.834	67%	0.668	S	S	*	*	S	Bend	trans	-103.6	17	-179.3	-82	-19.4	0	0	0	114
305	D	25.4	Very low	29.7	Very low	143 Å²	143	124.3 Å²	124.3	77%	0.765	68%	0.678	S	S	*	*			trans	-130	45	178	-138.2	6.6	0	0	0	112.9	S307	D305-S307 PolarHBondContact O-N 3.28Å
306	D	28.5	Very low	29.2	Very low	150 Å²	150	127.7 Å²	127.7	80%	0.802	69%	0.69	S	S	*	*			trans	-83	90.9	158.3	-88.8	-21.2	0	0	0	108.2	V308	D306-V308 VanDerWaalsContact C-N 3.28Å; D306-V308 PolarHBondContact O-N 3.43Å
307	S	25.4	Very low	28.2	Very low	101 Å²	101	127.3 Å²	127.3	71%	0.706	70%	0.702	S	S	*	*			trans	-52.5	87.6	163.7	56.8	0	0	0	0	110.6	D305 Q309	D305-S307 PolarHBondContact O-N 3.28Å; S307-Q309 PolarHBondContact O-N 2.99Å
308	V	28.2	Very low	27.9	Very low	126 Å²	126	128.6 Å²	128.6	76%	0.764	72%	0.719	S	S	*	*			trans	-75.5	98	168.8	178.7	0	0	0	0	107.7	D306 Y310	D306-V308 VanDerWaalsContact C-N 3.28Å; D306-V308 PolarHBondContact O-N 3.43Å; V308-Y310 PolarHBondContact O-N 3.31Å
309	Q	22	Very low	27.7	Very low	153 Å²	153	132.4 Å²	132.4	72%	0.715	74%	0.74	S	S	*	*			trans	-49.5	116.5	172.2	-67	-178.6	-16.9	0	0	110.9	S307 H311	S307-Q309 PolarHBondContact O-N 2.99Å; Q309-H311 PolarHBondContact O-N 2.79Å
310	Y	23.6	Very low	27.2	Very low	234 Å²	234	135.4 Å²	135.4	92%	0.918	76%	0.76	S	S	*	*			trans	-66.2	99.8	159.7	-85.2	-90.5	0	0	0	108.3	V308 G312	V308-Y310 PolarHBondContact O-N 3.31Å; Y310-G312 PolarHBondContact O-N 2.8Å
311	H	25.7	Very low	27	Very low	172 Å²	172	135 Å²	135	80%	0.796	77%	0.767	S	S	*	*			trans	-68	88.4	160.3	-103.8	50.7	0	0	0	108.6	Q309	Q309-H311 PolarHBondContact O-N 2.79Å
312	G	21.5	Very low	27.1	Very low	67 Å²	67	140.7 Å²	140.7	69%	0.691	78%	0.78	S	S	*	*			trans	-80.7	103.8	161.4	0	0	0	0	0	109.6	Y310	Y310-G312 PolarHBondContact O-N 2.8Å
313	Q	24.9	Very low	27.5	Very low	177 Å²	177	140.4 Å²	140.4	83%	0.827	78%	0.783	S	S	*	*			trans	179	123.9	157.8	-101.8	169.7	17.9	0	0	105
314	K	26.5	Very low	28.7	Very low	178 Å²	178	140.3 Å²	140.3	77%	0.774	78%	0.778	S	S	*	*			cis	-145.9	134.1	41.9	-72.9	173.5	174.3	172.4	0	111.1	N316	K314-N316 PolarHBondContact O-N 2.91Å
315	I	25.4	Very low	29.9	Very low	169 Å²	169	139 Å²	139	87%	0.867	78%	0.782	S	S	*	*			trans	-68	108.2	155.4	-61.7	165.8	0	0	0	106.1
316	N	26.7	Very low	31.6	Very low	147 Å²	147	136.5 Å²	136.5	79%	0.786	76%	0.764	S	S	*	*			trans	-120.6	103.9	156.7	-90.2	-3.2	0	0	0	106.7	K314	K314-N316 PolarHBondContact O-N 2.91Å
317	G	21.5	Very low	33.8	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	75%	0.752	S	S	*	*			trans	-62.6	142.4	170.8	0	0	0	0	0	110.7
318	S	26.4	Very low	36.2	Very low	111 Å²	111	137 Å²	137	78%	0.776	76%	0.756	S	S	*	*			trans	-158.7	127.3	133.7	54	0	0	0	0	109.2
319	S	27.3	Very low	38.1	Very low	108 Å²	108	136.6 Å²	136.6	76%	0.755	74%	0.744	S	S	*	*			trans	70.5	80.3	150.8	-43	0	0	0	0	117.1	S321	S319-S321 VanDerWaalsContact C-N 3.29Å; S319-S321 PolarHBondContact O-N 2.9Å
320	C	24.5	Very low	40.5	Very low	144 Å²	144	135 Å²	135	97%	0.973	73%	0.732	S	S	*	*			trans	-57.7	90	156.9	-73.7	0	0	0	0	110.4	R322	C320-R322 PolarHBondContact O-N 3Å
321	S	34.2	Very low	43	Very low	101 Å²	101	127.2 Å²	127.2	71%	0.706	70%	0.703	S	S	*	*			trans	-81.5	101.5	168.2	56.3	0	0	0	0	109.4	S319 V323	S319-S321 VanDerWaalsContact C-N 3.29Å; S319-S321 PolarHBondContact O-N 2.9Å; S321-V323 PolarHBondContact O-N 3.28Å
322	R	38.1	Very low	45.4	Very low	247 Å²	247	124 Å²	124	93%	0.932	68%	0.684	S	S	*	*			trans	5.6	84.1	158.5	-159.3	168.6	169.9	167.7	-3.3	114.8	C320 S324	C320-R322 PolarHBondContact O-N 3Å; R322-S324 PolarHBondContact O-N 2.85Å
323	V	38.8	Very low	47.8	Very low	128 Å²	128	124.6 Å²	124.6	78%	0.776	67%	0.671	S	S	*	*			trans	-70	103.6	-178.9	-175.1	0	0	0	0	109.1	S321 S325	S321-V323 PolarHBondContact O-N 3.28Å; V323-S325 PolarHBondContact O-N 3.11Å
324	S	58.3	Low	50.3	Low	63 Å²	63	119.9 Å²	119.9	44%	0.441	65%	0.649	S	S	.	*			trans	-56.5	121.7	172.8	167.8	0	0	0	0	110.9	R322 K326 K331	R322-S324 PolarHBondContact O-N 2.85Å; S324-K326 PolarHBondContact O-N 2.99Å; S324-K331 WeakPolarHBondContact O-CE 3.39Å; S324-K331 PolarHBondContact O-NZ 2.71Å
325	S	54.6	Low	52.7	Low	129 Å²	129	117.5 Å²	117.5	90%	0.902	64%	0.635	S	S	*	*			trans	-65.7	8.4	-175.3	-32.3	0	0	0	0	115.7	V323 S327	V323-S325 PolarHBondContact O-N 3.11Å; S325-S327 PolarHBondContact O-N 2.59Å
326	K	61.1	Low	54.7	Low	89 Å²	89	112.8 Å²	112.8	39%	0.387	61%	0.611	S	S	.	*			trans	-77.2	126	177.9	-68.4	175.5	171.9	-163.4	0	109.7	S324 Y330 K331	S324-K326 PolarHBondContact O-N 2.99Å; K326-Y330 HydrophobicContact CB-CD1 4Å; K326-Y330 HydrophobicContact CB-CG 4.47Å; K326-Y330 HydrophobicContact CD-CD1 3.61Å; K326-Y330 HydrophobicContact CD-CE1 3.55Å; K326-Y330 HydrophobicContact CG-CD1 4.01Å; K326-Y330 HydrophobicContact CG-CE1 4.31Å; K326-K331 HydrophobicContact CB-CG 4.06Å; K326-K331 WeakPolarHBondContact O-CE 3.24Å; K326-K331 PolarHBondContact O-NZ 3.36Å
327	S	75.9	Confident	56.7	Low	79 Å²	79	111 Å²	111	55%	0.552	60%	0.595	S	S	*	*			trans	-47.3	144.4	171.9	166.7	0	0	0	0	111.2	S325 F329 Y330 K331	S325-S327 PolarHBondContact O-N 2.59Å; S327-F329 PolarHBondContact O-N 3Å; S327-F329 VanDerWaalsContact O-N 3.11Å; S327-F329 PolarHBondContact OG-N 3.37Å; S327-Y330 WeakPolarHBondContact O-CB 3.41Å; S327-Y330 PolarHBondContact O-N 3.33Å; S327-K331 PolarHBondContact O-N 3.32Å
328	K	74.7	Confident	59.1	Low	184 Å²	184	111.3 Å²	111.3	80%	0.8	58%	0.578	S	S	*	*	H	α-helix	trans	-52.4	-34.4	176.9	-72.2	-177.3	179.2	175.7	0	111.8	K331 R332	K328-K331 PolarHBondContact O-N 3.09Å; K328-R332 PolarHBondContact O-N 3.21Å; K328-R332 VanDerWaalsContact O-N 3.07Å
329	F	67.8	Low	61.1	Low	116 Å²	116	112.2 Å²	112.2	51%	0.509	57%	0.569	S	S	.	*	H	α-helix	trans	-60.6	-50.5	174.1	-179.7	-107.9	0	0	0	112.1	S327 K331 R332 I333	S327-F329 PolarHBondContact O-N 3Å; S327-F329 VanDerWaalsContact O-N 3.11Å; S327-F329 PolarHBondContact OG-N 3.37Å; F329-K331 PolarHBondContact O-N 3.48Å; F329-R332 WeakPolarHBondContact O-CB 3.33Å; F329-R332 PolarHBondContact O-N 3.38Å; F329-R332 VanDerWaalsContact O-N 3.11Å; F329-I333 HydrophobicContact CD1-CD1 3.88Å; F329-I333 HydrophobicContact CE1-CD1 3.38Å; F329-I333 HydrophobicContact CE2-CD1 4.25Å; F329-I333 HydrophobicContact CZ-CD1 3.6Å; F329-I333 HydrophobicContact CZ-CG1 4.48Å; F329-I333 PolarHBondContact O-N 2.94Å
330	Y	72.8	Confident	62.8	Low	119 Å²	119	109.2 Å²	109.2	47%	0.467	55%	0.548	S	S	.	.	H	α-helix	trans	-62.8	-42.8	177.5	-173.5	-77.6	0	0	0	111.7	K326 S327 R332 I333 Q334	K326-Y330 HydrophobicContact CB-CD1 4Å; K326-Y330 HydrophobicContact CB-CG 4.47Å; K326-Y330 HydrophobicContact CD-CD1 3.61Å; K326-Y330 HydrophobicContact CD-CE1 3.55Å; K326-Y330 HydrophobicContact CG-CD1 4.01Å; K326-Y330 HydrophobicContact CG-CE1 4.31Å; S327-Y330 WeakPolarHBondContact O-CB 3.41Å; S327-Y330 PolarHBondContact O-N 3.33Å; Y330-R332 PolarHBondContact O-N 3.2Å; Y330-I333 PolarHBondContact O-N 3.48Å; Y330-Q334 HydrophobicContact CD1-CB 4.5Å; Y330-Q334 HydrophobicContact CE1-CB 4.35Å; Y330-Q334 VanDerWaalsContact O-CB 3.32Å; Y330-Q334 WeakPolarHBondContact O-CB 3.25Å; Y330-Q334 PolarHBondContact O-N 3.31Å
331	K	77.2	Confident	64.3	Low	71 Å²	71	108.7 Å²	108.7	31%	0.309	53%	0.529	S	S	.	.	H	α-helix	trans	-60.4	-30.9	176.2	-70.8	177.2	179.7	164.3	0	112	S324 K326 S327 K328 F329 R335	S324-K331 WeakPolarHBondContact O-CE 3.39Å; S324-K331 PolarHBondContact O-NZ 2.71Å; K326-K331 HydrophobicContact CB-CG 4.06Å; K326-K331 WeakPolarHBondContact O-CE 3.24Å; K326-K331 PolarHBondContact O-NZ 3.36Å; S327-K331 PolarHBondContact O-N 3.32Å; K328-K331 PolarHBondContact O-N 3.09Å; F329-K331 PolarHBondContact O-N 3.48Å; K331-R335 WeakPolarHBondContact O-CB 3.23Å; K331-R335 PolarHBondContact O-N 2.97Å; K331-R335 VanDerWaalsContact O-N 3.15Å
332	R	75.9	Confident	65.3	Low	106 Å²	106	111.6 Å²	111.6	40%	0.4	53%	0.531	S	S	.	.	H	α-helix	trans	-73.6	-50.3	176.5	-171.8	172.2	-64	-172.2	-6.3	111.8	K328 F329 Y330 Q334 R335 D336 E368	K328-R332 PolarHBondContact O-N 3.21Å; K328-R332 VanDerWaalsContact O-N 3.07Å; F329-R332 WeakPolarHBondContact O-CB 3.33Å; F329-R332 PolarHBondContact O-N 3.38Å; F329-R332 VanDerWaalsContact O-N 3.11Å; Y330-R332 PolarHBondContact O-N 3.2Å; R332-Q334 VanDerWaalsContact C-N 3.27Å; R332-Q334 PolarHBondContact O-N 3.29Å; R332-R335 WeakPolarHBondContact O-CB 3.23Å; R332-R335 PolarHBondContact O-N 3.46Å; R332-D336 PolarHBondContact O-N 2.99Å; R332-E368 IonicContact CZ-OE1 3.63Å; R332-E368 IonicContact NH1-OE1 2.8Å; R332-E368 PolarHBondContact NH1-OE1 2.95Å; R332-E368 IonicContact NH2-OE1 3.61Å; R332-E368 PolarHBondContact NH2-OE1 3.22Å
333	I	70.6	Confident	65.9	Low	79 Å²	79	109.5 Å²	109.5	41%	0.405	52%	0.524	S	S	.	.	H	α-helix	trans	-54.4	-46.4	173.7	-66.8	173	0	0	0	110.6	F329 Y330 R335 D336 Y337	F329-I333 HydrophobicContact CD1-CD1 3.88Å; F329-I333 HydrophobicContact CE1-CD1 3.38Å; F329-I333 HydrophobicContact CE2-CD1 4.25Å; F329-I333 HydrophobicContact CZ-CD1 3.6Å; F329-I333 HydrophobicContact CZ-CG1 4.48Å; F329-I333 PolarHBondContact O-N 2.94Å; Y330-I333 PolarHBondContact O-N 3.48Å; I333-R335 VanDerWaalsContact C-N 3.31Å; I333-R335 PolarHBondContact O-N 3.4Å; I333-D336 PolarHBondContact O-N 3.35Å; I333-Y337 VanDerWaalsContact O-CB 3.26Å; I333-Y337 WeakPolarHBondContact O-CB 3.31Å; I333-Y337 PolarHBondContact O-N 3.19Å
334	Q	77.5	Confident	66.1	Low	78 Å²	78	107.6 Å²	107.6	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-61	-41	178.9	-174.3	-179.4	-12.2	0	0	111.7	Y330 R332 L338	Y330-Q334 HydrophobicContact CD1-CB 4.5Å; Y330-Q334 HydrophobicContact CE1-CB 4.35Å; Y330-Q334 VanDerWaalsContact O-CB 3.32Å; Y330-Q334 WeakPolarHBondContact O-CB 3.25Å; Y330-Q334 PolarHBondContact O-N 3.31Å; R332-Q334 VanDerWaalsContact C-N 3.27Å; R332-Q334 PolarHBondContact O-N 3.29Å; Q334-L338 HydrophobicContact CG-CD1 4.14Å; Q334-L338 WeakPolarHBondContact O-CB 3.25Å; Q334-L338 VanDerWaalsContact O-CG 3.23Å; Q334-L338 WeakPolarHBondContact O-CG 3.27Å; Q334-L338 PolarHBondContact O-N 3.21Å
335	R	76.4	Confident	65.5	Low	127 Å²	127	109.7 Å²	109.7	48%	0.479	53%	0.527	S	S	.	.	H	α-helix	trans	-65.4	-45	177.9	-125.5	-175.7	-70.3	98.8	-4.3	112	K331 R332 I333 L338 K339	K331-R335 WeakPolarHBondContact O-CB 3.23Å; K331-R335 PolarHBondContact O-N 2.97Å; K331-R335 VanDerWaalsContact O-N 3.15Å; R332-R335 WeakPolarHBondContact O-CB 3.23Å; R332-R335 PolarHBondContact O-N 3.46Å; I333-R335 VanDerWaalsContact C-N 3.31Å; I333-R335 PolarHBondContact O-N 3.4Å; R335-L338 PolarHBondContact O-N 3.35Å; R335-K339 WeakPolarHBondContact O-CB 3.13Å; R335-K339 WeakPolarHBondContact O-CG 3.31Å; R335-K339 PolarHBondContact O-N 3.19Å
336	D	68.2	Low	65.1	Low	70 Å²	70	112.9 Å²	112.9	37%	0.374	53%	0.525	S	S	.	.	H	α-helix	trans	-70.7	-37.1	-177.3	-64.6	-21.6	0	0	0	111.2	R332 I333 K339 S340	R332-D336 PolarHBondContact O-N 2.99Å; I333-D336 PolarHBondContact O-N 3.35Å; D336-K339 PolarHBondContact O-N 3.08Å; D336-S340 PolarHBondContact O-N 3.18Å
337	Y	69.3	Low	64.5	Low	111 Å²	111	113.6 Å²	113.6	44%	0.435	54%	0.541	S	S	.	.	H	α-helix	trans	-60.1	-45.2	169.7	177.2	-99	0	0	0	112.5	I333 S340 K341 P356	I333-Y337 VanDerWaalsContact O-CB 3.26Å; I333-Y337 WeakPolarHBondContact O-CB 3.31Å; I333-Y337 PolarHBondContact O-N 3.19Å; Y337-S340 PolarHBondContact O-N 3.44Å; Y337-S340 PolarHBondContact O-OG 3.25Å; Y337-S340 VanDerWaalsContact O-OG 3.04Å; Y337-K341 PolarHBondContact O-N 3.12Å; Y337-P356 HydrophobicContact CD2-CG 4.32Å
338	L	70.5	Confident	62.9	Low	77 Å²	77	116.1 Å²	116.1	40%	0.403	55%	0.549	S	S	.	.	H	α-helix	trans	-68.6	-39.5	177.7	-71.6	171.3	0	0	0	111.9	Q334 R335 K341 H342	Q334-L338 HydrophobicContact CG-CD1 4.14Å; Q334-L338 WeakPolarHBondContact O-CB 3.25Å; Q334-L338 VanDerWaalsContact O-CG 3.23Å; Q334-L338 WeakPolarHBondContact O-CG 3.27Å; Q334-L338 PolarHBondContact O-N 3.21Å; R335-L338 PolarHBondContact O-N 3.35Å; L338-K341 WeakPolarHBondContact O-CB 3.45Å; L338-K341 PolarHBondContact O-N 3.19Å; L338-H342 PolarHBondContact O-CD2 3.13Å; L338-H342 PolarHBondContact O-N 2.65Å
339	K	68.6	Low	61.6	Low	131 Å²	131	116.2 Å²	116.2	57%	0.57	56%	0.558	S	S	*	*	H	α-helix	trans	-61.6	-42.2	174.1	-80.3	-176.4	176.4	-174.2	0	112	R335 D336 K341 H342	R335-K339 WeakPolarHBondContact O-CB 3.13Å; R335-K339 WeakPolarHBondContact O-CG 3.31Å; R335-K339 PolarHBondContact O-N 3.19Å; D336-K339 PolarHBondContact O-N 3.08Å; K339-K341 VanDerWaalsContact C-N 3.25Å; K339-K341 PolarHBondContact O-N 3.21Å; K339-H342 PolarHBondContact O-N 3.23Å
340	S	63.1	Low	60.7	Low	45 Å²	45	113.6 Å²	113.6	32%	0.315	55%	0.554	S	S	.	*	H	α-helix	trans	-64.2	-34	177.6	80.2	0	0	0	0	111.7	D336 Y337 H342 Y343	D336-S340 PolarHBondContact O-N 3.18Å; Y337-S340 PolarHBondContact O-N 3.44Å; Y337-S340 PolarHBondContact O-OG 3.25Å; Y337-S340 VanDerWaalsContact O-OG 3.04Å; S340-H342 VanDerWaalsContact C-N 3.31Å; S340-H342 PolarHBondContact O-N 3.07Å; S340-Y343 PolarHBondContact O-N 3.07Å
341	K	56.1	Low	59.8	Low	132 Å²	132	114.6 Å²	114.6	57%	0.574	57%	0.567	S	S	*	*	H	α-helix	trans	-66.7	-29.4	176	-158.7	179.5	-178.8	-179.4	0	113.3	Y337 L338 K339 Y343 T344	Y337-K341 PolarHBondContact O-N 3.12Å; L338-K341 WeakPolarHBondContact O-CB 3.45Å; L338-K341 PolarHBondContact O-N 3.19Å; K339-K341 VanDerWaalsContact C-N 3.25Å; K339-K341 PolarHBondContact O-N 3.21Å; K341-Y343 VanDerWaalsContact C-N 3.3Å; K341-T344 PolarHBondContact O-OG1 2.83Å
342	H	56.3	Low	58.5	Low	163 Å²	163	117.4 Å²	117.4	76%	0.755	58%	0.584	S	S	*	*	H	α-helix	trans	-75.2	-17.4	175.3	-72.4	-61.3	0	0	0	113.7	L338 K339 S340	L338-H342 PolarHBondContact O-CD2 3.13Å; L338-H342 PolarHBondContact O-N 2.65Å; K339-H342 PolarHBondContact O-N 3.23Å; S340-H342 VanDerWaalsContact C-N 3.31Å; S340-H342 PolarHBondContact O-N 3.07Å
343	Y	49.3	Very low	57.3	Low	203 Å²	203	116.4 Å²	116.4	80%	0.796	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-1.8	177	-84.1	-80.1	0	0	0	114.5	S340 K341 S345	S340-Y343 PolarHBondContact O-N 3.07Å; K341-Y343 VanDerWaalsContact C-N 3.3Å; Y343-S345 VanDerWaalsContact C-N 3.28Å; Y343-S345 PolarHBondContact O-N 3.29Å
344	T	44.9	Very low	56.7	Low	88 Å²	88	119.9 Å²	119.9	54%	0.54	61%	0.605	S	S	.	*			trans	-84.2	79.9	170.2	61.4	0	0	0	0	109.1	K341	K341-T344 PolarHBondContact O-OG1 2.83Å
345	S	44.6	Very low	55.8	Low	106 Å²	106	121.6 Å²	121.6	74%	0.741	62%	0.616	S	S	*	*			trans	-56.8	133.1	157.4	56.8	0	0	0	0	108.8	Y343	Y343-S345 VanDerWaalsContact C-N 3.28Å; Y343-S345 PolarHBondContact O-N 3.29Å
346	K	46.6	Very low	55	Low	196 Å²	196	117.7 Å²	117.7	85%	0.852	61%	0.607	S	S	*	*	S	Bend	trans	3.9	136.8	158.5	-61.6	174.4	179.3	178.4	0	117.1
347	S	47.3	Very low	55.1	Low	104 Å²	104	117.5 Å²	117.5	73%	0.727	61%	0.612	S	S	*	*			trans	73	89.6	170.3	71.9	0	0	0	0	116.9
348	D	43	Very low	55	Low	133 Å²	133	119.1 Å²	119.1	71%	0.711	62%	0.623	S	S	*	*				179	127.5	108.4	-86.8	-18.5	0	0	0	110.6	S350	D348-S350 PolarHBondContact O-N 3.32Å
349	N	48.4	Very low	55.2	Low	186 Å²	186	120 Å²	120	100%	0.995	63%	0.631	S	S	*	*			trans	-76	51.1	-171.9	-82.9	-23.7	0	0	0	113.2
350	S	48.1	Very low	55	Low	61 Å²	61	116.2 Å²	116.2	43%	0.427	62%	0.622	S	S	.	*			trans	-103.1	128.3	168.4	179.9	0	0	0	0	110.5	D348 L352 C353	D348-S350 PolarHBondContact O-N 3.32Å; S350-L352 PolarHBondContact O-N 3.3Å; S350-C353 PolarHBondContact O-N 3.05Å; S350-C353 VanDerWaalsContact O-N 3.11Å
351	L	54.2	Low	55.2	Low	139 Å²	139	121.3 Å²	121.3	73%	0.728	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-54.8	-20.5	179.7	-72	168.4	0	0	0	113.2	C353 K354	L351-C353 VanDerWaalsContact C-N 3.33Å; L351-C353 PolarHBondContact O-N 3.25Å; L351-K354 PolarHBondContact O-N 3.24Å
352	L	48.5	Very low	55.9	Low	130 Å²	130	120.6 Å²	120.6	68%	0.681	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-69.8	-23.7	179.3	-74.2	167.1	0	0	0	114	S350 K354 L355	S350-L352 PolarHBondContact O-N 3.3Å; L352-K354 PolarHBondContact O-N 3.43Å; L352-K354 VanDerWaalsContact O-N 3.15Å; L352-L355 PolarHBondContact O-N 2.89Å
353	C	50.7	Low	56.4	Low	86 Å²	86	122.1 Å²	122.1	58%	0.581	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-70.3	-7.9	177	-63.4	0	0	0	0	113.5	S350 L351	S350-C353 PolarHBondContact O-N 3.05Å; S350-C353 VanDerWaalsContact O-N 3.11Å; L351-C353 VanDerWaalsContact C-N 3.33Å; L351-C353 PolarHBondContact O-N 3.25Å
354	K	58.4	Low	57.2	Low	151 Å²	151	114.1 Å²	114.1	66%	0.657	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-86.8	-9.8	178.8	-64.8	-179.6	-178.5	175.5	0	113.8	L351 L352	L351-K354 PolarHBondContact O-N 3.24Å; L352-K354 PolarHBondContact O-N 3.43Å; L352-K354 VanDerWaalsContact O-N 3.15Å
355	L	59.4	Low	58.3	Low	115 Å²	115	117.5 Å²	117.5	60%	0.602	62%	0.615	S	S	*	*	S	Bend	trans	-96.6	131.4	179.4	-70.3	165.5	0	0	0	110.6	L352 S357	L352-L355 PolarHBondContact O-N 2.89Å; L355-S357 PolarHBondContact O-N 2.86Å
356	P	59.7	Low	59.1	Low	44 Å²	44	118.1 Å²	118.1	29%	0.286	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-55.5	137.4	172.3	-21.6	30.9	0	0	0	110.9	Y337 R361	Y337-P356 HydrophobicContact CD2-CG 4.32Å; P356-R361 HydrophobicContact CB-CG 4.5Å
357	S	69.7	Low	59.6	Low	67 Å²	67	116.7 Å²	116.7	47%	0.469	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-54.8	148.1	178.6	67.9	0	0	0	0	111.7	L355 T359 S360 R361	L355-S357 PolarHBondContact O-N 2.86Å; S357-T359 PolarHBondContact O-N 3.01Å; S357-T359 VanDerWaalsContact O-N 3.16Å; S357-S360 WeakPolarHBondContact O-CA 3.36Å; S357-S360 WeakPolarHBondContact O-CB 3.09Å; S357-S360 PolarHBondContact O-N 3.03Å; S357-S360 PolarHBondContact OG-OG 2.84Å; S357-R361 PolarHBondContact O-N 3.23Å; S357-R361 VanDerWaalsContact O-N 3.1Å
358	Q	68.2	Low	60.3	Low	145 Å²	145	117.8 Å²	117.8	68%	0.678	60%	0.604	S	S	*	*	H	α-helix	trans	-53.9	-36.8	-179.1	-176.1	171.6	0.7	0	0	112.5	S360 R361 H362	Q358-S360 VanDerWaalsContact C-N 3.33Å; Q358-S360 PolarHBondContact O-N 3.27Å; Q358-R361 WeakPolarHBondContact O-CB 3.26Å; Q358-R361 PolarHBondContact O-N 2.73Å; Q358-H362 PolarHBondContact O-N 3.49Å
359	T	73.4	Confident	61.2	Low	94 Å²	94	118.4 Å²	118.4	58%	0.577	61%	0.607	S	S	*	*	H	α-helix	trans	-61.5	-37.9	174.2	-44.3	0	0	0	0	112.8	S357 H362 R363	S357-T359 PolarHBondContact O-N 3.01Å; S357-T359 VanDerWaalsContact O-N 3.16Å; T359-H362 PolarHBondContact O-N 3.44Å; T359-R363 PolarHBondContact O-N 2.96Å
360	S	65.2	Low	62.1	Low	52 Å²	52	114.9 Å²	114.9	36%	0.364	59%	0.594	S	S	.	*	H	α-helix	trans	-69.7	-38.6	176.2	-53.6	0	0	0	0	111.2	S357 Q358 A364	S357-S360 WeakPolarHBondContact O-CA 3.36Å; S357-S360 WeakPolarHBondContact O-CB 3.09Å; S357-S360 PolarHBondContact O-N 3.03Å; S357-S360 PolarHBondContact OG-OG 2.84Å; Q358-S360 VanDerWaalsContact C-N 3.33Å; Q358-S360 PolarHBondContact O-N 3.27Å; S360-A364 PolarHBondContact O-N 2.89Å
361	R	68.2	Low	63.3	Low	153 Å²	153	117.4 Å²	117.4	58%	0.577	61%	0.609	S	S	*	*	H	α-helix	trans	-62.9	-45.4	172	-61.1	179.3	84.9	171	3.5	110.6	P356 S357 Q358 A364 F365	P356-R361 HydrophobicContact CB-CG 4.5Å; S357-R361 PolarHBondContact O-N 3.23Å; S357-R361 VanDerWaalsContact O-N 3.1Å; Q358-R361 WeakPolarHBondContact O-CB 3.26Å; Q358-R361 PolarHBondContact O-N 2.73Å; R361-A364 WeakPolarHBondContact O-CB 2.88Å; R361-A364 PolarHBondContact O-N 2.97Å; R361-F365 WeakPolarHBondContact O-CD2 3.32Å; R361-F365 PolarHBondContact O-N 3.03Å
362	H	70.8	Confident	64.2	Low	117 Å²	117	119.8 Å²	119.8	54%	0.542	62%	0.617	S	S	.	*	H	α-helix	trans	-61.6	-44.6	177.5	-99.9	-74	0	0	0	113	Q358 T359 A364 F365 L366	Q358-H362 PolarHBondContact O-N 3.49Å; T359-H362 PolarHBondContact O-N 3.44Å; H362-A364 VanDerWaalsContact C-N 3.26Å; H362-A364 PolarHBondContact O-N 2.76Å; H362-F365 PolarHBondContact O-N 2.81Å; H362-F365 VanDerWaalsContact O-N 3.09Å; H362-L366 PolarHBondContact O-N 3.19Å; H362-L366 VanDerWaalsContact O-N 3.16Å
363	R	66.6	Low	65.7	Low	194 Å²	194	116.8 Å²	116.8	73%	0.732	61%	0.605	S	S	*	*	H	α-helix	trans	-62.3	-31.2	176.1	-81.7	-172.2	174.4	167.5	-0.5	113.2	T359 F365	T359-R363 PolarHBondContact O-N 2.96Å; R363-F365 VanDerWaalsContact C-N 3.28Å; R363-F365 PolarHBondContact O-N 3.37Å
364	A	65.2	Low	67.4	Low	35 Å²	35	116.9 Å²	116.9	29%	0.289	60%	0.603	S	S	.	*	H	α-helix	trans	-70	-24.7	175.6	0	0	0	0	0	113.2	S360 R361 H362	S360-A364 PolarHBondContact O-N 2.89Å; R361-A364 WeakPolarHBondContact O-CB 2.88Å; R361-A364 PolarHBondContact O-N 2.97Å; H362-A364 VanDerWaalsContact C-N 3.26Å; H362-A364 PolarHBondContact O-N 2.76Å
365	F	68.4	Low	68.9	Low	159 Å²	159	114.6 Å²	114.6	70%	0.697	60%	0.597	S	S	*	*	H	α-helix	trans	-88.7	-21.7	176.9	-72.5	-66.1	0	0	0	113.8	R361 H362 R363 L367	R361-F365 WeakPolarHBondContact O-CD2 3.32Å; R361-F365 PolarHBondContact O-N 3.03Å; H362-F365 PolarHBondContact O-N 2.81Å; H362-F365 VanDerWaalsContact O-N 3.09Å; R363-F365 VanDerWaalsContact C-N 3.28Å; R363-F365 PolarHBondContact O-N 3.37Å; F365-L367 PolarHBondContact O-N 3.43Å; F365-L367 VanDerWaalsContact O-N 3.14Å
366	L	62	Low	70.4	Confident	120 Å²	120	114.6 Å²	114.6	63%	0.628	59%	0.594	S	S	*	*	S	Bend	trans	-69.5	110.5	171.4	-67.3	172.3	0	0	0	108.4	H362 E368	H362-L366 PolarHBondContact O-N 3.19Å; H362-L366 VanDerWaalsContact O-N 3.16Å; L366-E368 PolarHBondContact O-N 3.33Å
367	L	57.3	Low	71.9	Confident	165 Å²	165	118.7 Å²	118.7	86%	0.864	61%	0.608	S	S	*	*			trans	-49.7	130.3	163.9	-71.5	163.8	0	0	0	106.9	F365 D369	F365-L367 PolarHBondContact O-N 3.43Å; F365-L367 VanDerWaalsContact O-N 3.14Å; L367-D369 PolarHBondContact O-N 2.91Å
368	E	61.1	Low	72.9	Confident	127 Å²	127	119.5 Å²	119.5	59%	0.593	61%	0.606	S	S	*	*			trans	-37.9	128.3	-178	-75	178.8	177.9	0	0	110.8	R332 L366	R332-E368 IonicContact CZ-OE1 3.63Å; R332-E368 IonicContact NH1-OE1 2.8Å; R332-E368 PolarHBondContact NH1-OE1 2.95Å; R332-E368 IonicContact NH2-OE1 3.61Å; R332-E368 PolarHBondContact NH2-OE1 3.22Å; L366-E368 PolarHBondContact O-N 3.33Å
369	D	62.4	Low	74.1	Confident	147 Å²	147	119 Å²	119	79%	0.786	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-48.1	121.6	169.2	-70.5	-39.5	0	0	0	106.6	L367	L367-D369 PolarHBondContact O-N 2.91Å
370	P	66.1	Low	75.2	Confident	111 Å²	111	120 Å²	120	72%	0.721	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-54.4	136.1	-171.4	20	-31.7	0	0	0	108.5	Q372	P370-Q372 PolarHBondContact O-N 2.97Å; P370-Q372 VanDerWaalsContact O-N 3.13Å
371	P	73.1	Confident	76.5	Confident	115 Å²	115	122.2 Å²	122.2	75%	0.747	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-54.2	127.9	-177.5	21.8	-32.7	0	0	0	108.8	P373	P371-P373 VanDerWaalsContact O-N 3.17Å
372	Q	73.5	Confident	77.9	Confident	188 Å²	188	121.5 Å²	121.5	88%	0.879	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-52.9	125	-177.5	-151.8	172.6	16.5	0	0	108.4	P370 T374	P370-Q372 PolarHBondContact O-N 2.97Å; P370-Q372 VanDerWaalsContact O-N 3.13Å; Q372-T374 PolarHBondContact O-N 3.41Å
373	P	79.5	Confident	79.1	Confident	67 Å²	67	122.8 Å²	122.8	44%	0.435	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-62.9	131.5	-173.6	23	-31.8	0	0	0	109.8	P371 K377 I378	P371-P373 VanDerWaalsContact O-N 3.17Å; P373-K377 HydrophobicContact CB-CB 4.34Å; P373-I378 HydrophobicContact CB-CG1 4.01Å; P373-I378 HydrophobicContact CG-CD1 4.12Å; P373-I378 HydrophobicContact CG-CG1 3.91Å
374	T	86.7	Confident	80.5	Confident	89 Å²	89	122.7 Å²	122.7	55%	0.546	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-55.6	145.8	173.4	-40.6	0	0	0	0	110.2	Q372 E376 K377 I378	Q372-T374 PolarHBondContact O-N 3.41Å; T374-E376 PolarHBondContact O-N 3.36Å; T374-K377 WeakPolarHBondContact O-CA 3.2Å; T374-K377 WeakPolarHBondContact O-CB 3.26Å; T374-K377 PolarHBondContact O-N 2.98Å; T374-I378 PolarHBondContact O-N 2.97Å
375	L	90.7	Very high	82	Confident	102 Å²	102	127 Å²	127	53%	0.534	62%	0.622	S	S	.	*	H	α-helix	trans	-48.7	-38.7	-178.9	-177.2	62.5	0	0	0	113.3	I378 R379	L375-I378 PolarHBondContact O-N 3.4Å; L375-R379 WeakPolarHBondContact O-CG 3.29Å; L375-R379 PolarHBondContact O-N 2.91Å
376	E	91.5	Very high	83.4	Confident	115 Å²	115	123.5 Å²	123.5	54%	0.537	61%	0.608	S	S	.	*	H	α-helix	trans	-64	-39.1	176.1	-69.9	-54.9	130.2	0	0	113.3	T374 I378 R379 L380	T374-E376 PolarHBondContact O-N 3.36Å; E376-I378 VanDerWaalsContact C-N 3.34Å; E376-R379 PolarHBondContact O-N 3.11Å; E376-R379 IonicContact OE1-CZ 3.29Å; E376-R379 IonicContact OE1-NH1 2.68Å; E376-R379 PolarHBondContact OE1-NH1 3.41Å; E376-L380 WeakPolarHBondContact O-CB 3.41Å; E376-L380 PolarHBondContact O-N 3.15Å
377	K	90.5	Very high	85	Confident	130 Å²	130	124.4 Å²	124.4	57%	0.565	61%	0.607	S	S	*	*	H	α-helix	trans	-64.6	-40.8	174.4	-69.7	-176.7	179.3	176.8	0	110.9	P373 T374 L380 I381	P373-K377 HydrophobicContact CB-CB 4.34Å; T374-K377 WeakPolarHBondContact O-CA 3.2Å; T374-K377 WeakPolarHBondContact O-CB 3.26Å; T374-K377 PolarHBondContact O-N 2.98Å; K377-L380 PolarHBondContact O-N 2.88Å; K377-I381 WeakPolarHBondContact O-CB 3.39Å; K377-I381 WeakPolarHBondContact O-CD1 3.38Å; K377-I381 VanDerWaalsContact O-CG1 3.26Å; K377-I381 WeakPolarHBondContact O-CG1 3.49Å; K377-I381 PolarHBondContact O-N 3.1Å
378	I	90.1	Very high	86.9	Confident	85 Å²	85	125.9 Å²	125.9	44%	0.436	60%	0.601	S	S	.	*	H	α-helix	trans	-62.5	-47.7	176.8	-59.2	174.7	0	0	0	110.3	P373 T374 L375 E376 L380 I381 Y382	P373-I378 HydrophobicContact CB-CG1 4.01Å; P373-I378 HydrophobicContact CG-CD1 4.12Å; P373-I378 HydrophobicContact CG-CG1 3.91Å; T374-I378 PolarHBondContact O-N 2.97Å; L375-I378 PolarHBondContact O-N 3.4Å; E376-I378 VanDerWaalsContact C-N 3.34Å; I378-L380 VanDerWaalsContact C-N 3.32Å; I378-L380 PolarHBondContact O-N 3.35Å; I378-I381 PolarHBondContact O-N 3.04Å; I378-Y382 WeakPolarHBondContact O-CB 3.45Å; I378-Y382 PolarHBondContact O-N 3.42Å
379	R	94.7	Very high	88.5	Confident	133 Å²	133	126.3 Å²	126.3	50%	0.502	60%	0.601	S	S	.	*	H	α-helix	trans	-59.2	-41.8	176.5	-73.5	172.7	173	177.8	-5.4	112.2	L375 E376 Y382 K383	L375-R379 WeakPolarHBondContact O-CG 3.29Å; L375-R379 PolarHBondContact O-N 2.91Å; E376-R379 PolarHBondContact O-N 3.11Å; E376-R379 IonicContact OE1-CZ 3.29Å; E376-R379 IonicContact OE1-NH1 2.68Å; E376-R379 PolarHBondContact OE1-NH1 3.41Å; R379-Y382 PolarHBondContact O-N 3.11Å; R379-K383 WeakPolarHBondContact O-CG 3.46Å; R379-K383 PolarHBondContact O-N 3.2Å
380	L	95.2	Very high	90.1	Very high	115 Å²	115	122 Å²	122	60%	0.602	59%	0.586	S	S	*	*	H	α-helix	trans	-67.6	-43	178.1	-174.7	129.3	0	0	0	112.1	E376 K377 I378 Y382 K383 R384	E376-L380 WeakPolarHBondContact O-CB 3.41Å; E376-L380 PolarHBondContact O-N 3.15Å; K377-L380 PolarHBondContact O-N 2.88Å; I378-L380 VanDerWaalsContact C-N 3.32Å; I378-L380 PolarHBondContact O-N 3.35Å; L380-Y382 VanDerWaalsContact C-N 3.35Å; L380-K383 PolarHBondContact O-N 2.88Å; L380-R384 WeakPolarHBondContact O-CB 3.35Å; L380-R384 PolarHBondContact O-N 2.96Å
381	I	93.4	Very high	91.6	Very high	99 Å²	99	125.5 Å²	125.5	51%	0.508	58%	0.584	S	S	.	*	H	α-helix	trans	-58.4	-48.3	173.3	-72.1	161.1	0	0	0	110	K377 I378 K383 R384 E385	K377-I381 WeakPolarHBondContact O-CB 3.39Å; K377-I381 WeakPolarHBondContact O-CD1 3.38Å; K377-I381 VanDerWaalsContact O-CG1 3.26Å; K377-I381 WeakPolarHBondContact O-CG1 3.49Å; K377-I381 PolarHBondContact O-N 3.1Å; I378-I381 PolarHBondContact O-N 3.04Å; I381-K383 PolarHBondContact O-N 3.11Å; I381-R384 WeakPolarHBondContact O-CB 3.33Å; I381-R384 PolarHBondContact O-N 2.91Å; I381-R384 VanDerWaalsContact O-N 3.15Å; I381-E385 WeakPolarHBondContact O-CB 3.5Å; I381-E385 PolarHBondContact O-N 3.03Å
382	Y	96	Very high	92.6	Very high	139 Å²	139	127.5 Å²	127.5	55%	0.545	58%	0.581	S	S	.	*	H	α-helix	trans	-59.8	-46.8	178.1	-179.4	-99.5	0	0	0	112.4	I378 R379 L380 R384 E385 Q386	I378-Y382 WeakPolarHBondContact O-CB 3.45Å; I378-Y382 PolarHBondContact O-N 3.42Å; R379-Y382 PolarHBondContact O-N 3.11Å; L380-Y382 VanDerWaalsContact C-N 3.35Å; Y382-R384 VanDerWaalsContact C-N 3.31Å; Y382-R384 PolarHBondContact O-N 2.93Å; Y382-E385 PolarHBondContact O-N 2.83Å; Y382-Q386 HydrophobicContact CD1-CG 4.29Å; Y382-Q386 HydrophobicContact CE1-CG 3.88Å; Y382-Q386 HydrophobicContact CE2-CG 4.44Å; Y382-Q386 WeakPolarHBondContact O-CG 3.48Å; Y382-Q386 PolarHBondContact O-N 3.28Å; Y382-Q386 PolarHBondContact OH-NE2 3.17Å; Y382-Q386 VanDerWaalsContact OH-NE2 3.11Å
383	K	96.4	Very high	93.7	Very high	144 Å²	144	125 Å²	125	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-60	-40.2	174.9	-77.2	-179.3	179	179.2	0	111.9	R379 L380 I381 K387	R379-K383 WeakPolarHBondContact O-CG 3.46Å; R379-K383 PolarHBondContact O-N 3.2Å; L380-K383 PolarHBondContact O-N 2.88Å; I381-K383 PolarHBondContact O-N 3.11Å; K383-K387 WeakPolarHBondContact O-CG 3.32Å; K383-K387 PolarHBondContact O-N 3.4Å
384	R	97.2	Very high	94.5	Very high	191 Å²	191	126.1 Å²	126.1	72%	0.721	57%	0.572	S	S	*	*	H	α-helix	trans	-65.9	-40.1	176.9	-172.4	176.9	-176.9	166.5	1.3	111.4	L380 I381 Y382 K387 R388	L380-R384 WeakPolarHBondContact O-CB 3.35Å; L380-R384 PolarHBondContact O-N 2.96Å; I381-R384 WeakPolarHBondContact O-CB 3.33Å; I381-R384 PolarHBondContact O-N 2.91Å; I381-R384 VanDerWaalsContact O-N 3.15Å; Y382-R384 VanDerWaalsContact C-N 3.31Å; Y382-R384 PolarHBondContact O-N 2.93Å; R384-K387 PolarHBondContact O-N 2.96Å; R384-R388 WeakPolarHBondContact O-CB 3.5Å; R384-R388 PolarHBondContact O-N 3.4Å
385	E	96.4	Very high	95	Very high	127 Å²	127	128.7 Å²	128.7	59%	0.593	58%	0.579	S	S	*	*	H	α-helix	trans	-66.2	-43.3	177.1	-168.4	174.2	-176.1	0	0	111.7	I381 Y382 R388 K389	I381-E385 WeakPolarHBondContact O-CB 3.5Å; I381-E385 PolarHBondContact O-N 3.03Å; Y382-E385 PolarHBondContact O-N 2.83Å; E385-R388 WeakPolarHBondContact O-CB 3.48Å; E385-R388 PolarHBondContact O-N 3.47Å; E385-K389 WeakPolarHBondContact O-CB 3.33Å; E385-K389 PolarHBondContact O-N 3.4Å
386	Q	96.8	Very high	95.1	Very high	84 Å²	84	129.6 Å²	129.6	39%	0.393	58%	0.584	S	S	.	*	H	α-helix	trans	-60.2	-47	173	-72.9	-65	-11.2	0	0	112	Y382 R388 K389 A390	Y382-Q386 HydrophobicContact CD1-CG 4.29Å; Y382-Q386 HydrophobicContact CE1-CG 3.88Å; Y382-Q386 HydrophobicContact CE2-CG 4.44Å; Y382-Q386 WeakPolarHBondContact O-CG 3.48Å; Y382-Q386 PolarHBondContact O-N 3.28Å; Y382-Q386 PolarHBondContact OH-NE2 3.17Å; Y382-Q386 VanDerWaalsContact OH-NE2 3.11Å; Q386-R388 VanDerWaalsContact C-N 3.3Å; Q386-R388 PolarHBondContact O-N 2.93Å; Q386-K389 PolarHBondContact O-N 2.97Å; Q386-A390 WeakPolarHBondContact O-CB 3.35Å; Q386-A390 PolarHBondContact O-N 3Å
387	K	96.5	Very high	95.3	Very high	140 Å²	140	131.4 Å²	131.4	61%	0.609	59%	0.59	S	S	*	*	H	α-helix	trans	-59	-40.6	174.3	-75.1	-177.7	179.3	-175.1	0	111.8	K383 R384 R391	K383-K387 WeakPolarHBondContact O-CG 3.32Å; K383-K387 PolarHBondContact O-N 3.4Å; R384-K387 PolarHBondContact O-N 2.96Å; K387-R391 WeakPolarHBondContact O-CB 3.36Å; K387-R391 VanDerWaalsContact O-CG 3.23Å; K387-R391 WeakPolarHBondContact O-CG 3.09Å; K387-R391 PolarHBondContact O-N 3.16Å
388	R	96.7	Very high	95.5	Very high	196 Å²	196	133.1 Å²	133.1	74%	0.74	59%	0.593	S	S	*	*	H	α-helix	trans	-65.3	-43.1	176.6	176.7	177.8	153	130.8	-5	111.6	R384 E385 Q386 R391 K392	R384-R388 WeakPolarHBondContact O-CB 3.5Å; R384-R388 PolarHBondContact O-N 3.4Å; E385-R388 WeakPolarHBondContact O-CB 3.48Å; E385-R388 PolarHBondContact O-N 3.47Å; Q386-R388 VanDerWaalsContact C-N 3.3Å; Q386-R388 PolarHBondContact O-N 2.93Å; R388-R391 PolarHBondContact O-N 2.93Å; R388-K392 WeakPolarHBondContact O-CB 3.47Å; R388-K392 PolarHBondContact O-N 3.43Å
389	K	96.1	Very high	95.6	Very high	135 Å²	135	131.9 Å²	131.9	59%	0.587	60%	0.595	S	S	*	*	H	α-helix	trans	-62.3	-48.5	176.5	-171.8	179.6	177.8	-176.4	0	111.2	E385 Q386 R391 K392 E393	E385-K389 WeakPolarHBondContact O-CB 3.33Å; E385-K389 PolarHBondContact O-N 3.4Å; Q386-K389 PolarHBondContact O-N 2.97Å; K389-R391 PolarHBondContact O-N 3.17Å; K389-K392 WeakPolarHBondContact O-CB 3.29Å; K389-K392 PolarHBondContact O-N 3Å; K389-K392 VanDerWaalsContact O-N 3.16Å; K389-E393 PolarHBondContact O-N 2.88Å
390	A	96	Very high	95.6	Very high	57 Å²	57	128 Å²	128	47%	0.471	59%	0.588	S	S	.	*	H	α-helix	trans	-60.6	-42	177.3	0	0	0	0	0	112.6	Q386 E393 L394	Q386-A390 WeakPolarHBondContact O-CB 3.35Å; Q386-A390 PolarHBondContact O-N 3Å; A390-E393 PolarHBondContact O-N 3.15Å; A390-L394 WeakPolarHBondContact O-CB 3.38Å; A390-L394 PolarHBondContact O-N 2.89Å
391	R	97.3	Very high	95.6	Very high	185 Å²	185	127.3 Å²	127.3	70%	0.698	58%	0.582	S	S	*	*	H	α-helix	trans	-61.7	-43.1	174.1	-74.7	171.6	-177.4	-176.2	-0.6	112.1	K387 R388 K389 L394 M395	K387-R391 WeakPolarHBondContact O-CB 3.36Å; K387-R391 VanDerWaalsContact O-CG 3.23Å; K387-R391 WeakPolarHBondContact O-CG 3.09Å; K387-R391 PolarHBondContact O-N 3.16Å; R388-R391 PolarHBondContact O-N 2.93Å; K389-R391 PolarHBondContact O-N 3.17Å; R391-L394 PolarHBondContact O-N 2.87Å; R391-M395 WeakPolarHBondContact O-CB 3.44Å; R391-M395 PolarHBondContact O-N 2.86Å
392	K	94.3	Very high	95.5	Very high	157 Å²	157	127.2 Å²	127.2	68%	0.683	58%	0.581	S	S	*	*	H	α-helix	trans	-63.6	-43.1	178.1	-172.8	-179.8	178.8	-176.1	0	111.3	R388 K389 M395 L396	R388-K392 WeakPolarHBondContact O-CB 3.47Å; R388-K392 PolarHBondContact O-N 3.43Å; K389-K392 WeakPolarHBondContact O-CB 3.29Å; K389-K392 PolarHBondContact O-N 3Å; K389-K392 VanDerWaalsContact O-N 3.16Å; K392-M395 PolarHBondContact O-N 2.96Å; K392-L396 WeakPolarHBondContact O-CB 3.47Å; K392-L396 PolarHBondContact O-N 3.24Å
393	E	95	Very high	95.3	Very high	135 Å²	135	125.3 Å²	125.3	63%	0.631	58%	0.578	S	S	*	*	H	α-helix	trans	-65.3	-45	177.3	-172.6	178.1	168	0	0	112	K389 A390 M395 L396 K397	K389-E393 PolarHBondContact O-N 2.88Å; A390-E393 PolarHBondContact O-N 3.15Å; E393-M395 VanDerWaalsContact C-N 3.31Å; E393-M395 PolarHBondContact O-N 3.25Å; E393-L396 PolarHBondContact O-N 3.28Å; E393-K397 WeakPolarHBondContact O-CB 3.23Å; E393-K397 PolarHBondContact O-N 3.2Å
394	L	97.3	Very high	95.1	Very high	91 Å²	91	126.7 Å²	126.7	48%	0.476	58%	0.579	S	S	.	*	H	α-helix	trans	-59.3	-42.8	174.8	-177.1	68.3	0	0	0	111.7	A390 R391 K397 R398	A390-L394 WeakPolarHBondContact O-CB 3.38Å; A390-L394 PolarHBondContact O-N 2.89Å; R391-L394 PolarHBondContact O-N 2.87Å; L394-K397 PolarHBondContact O-N 2.85Å; L394-R398 WeakPolarHBondContact O-CG 3.45Å; L394-R398 PolarHBondContact O-N 2.94Å
395	M	96.6	Very high	94.9	Very high	142 Å²	142	123.5 Å²	123.5	70%	0.7	57%	0.574	S	S	*	*	H	α-helix	trans	-62.1	-43.4	175.8	-174	-175.8	178.8	0	0	111.4	R391 K392 E393 R398 A399	R391-M395 WeakPolarHBondContact O-CB 3.44Å; R391-M395 PolarHBondContact O-N 2.86Å; K392-M395 PolarHBondContact O-N 2.96Å; E393-M395 VanDerWaalsContact C-N 3.31Å; E393-M395 PolarHBondContact O-N 3.25Å; M395-R398 PolarHBondContact O-N 3.4Å; M395-A399 WeakPolarHBondContact O-CB 3.45Å; M395-A399 PolarHBondContact O-N 2.91Å
396	L	93.6	Very high	94.7	Very high	122 Å²	122	123.6 Å²	123.6	64%	0.639	57%	0.572	S	S	*	*	H	α-helix	trans	-65.4	-39.4	178.3	-166.7	129.7	0	0	0	112	K392 E393 A399 S400	K392-L396 WeakPolarHBondContact O-CB 3.47Å; K392-L396 PolarHBondContact O-N 3.24Å; E393-L396 PolarHBondContact O-N 3.28Å; L396-A399 PolarHBondContact O-N 3.16Å; L396-S400 PolarHBondContact O-N 3.45Å; L396-S400 PolarHBondContact O-OG 3.2Å
397	K	94.9	Very high	94.5	Very high	153 Å²	153	123.6 Å²	123.6	67%	0.665	58%	0.575	S	S	*	*	H	α-helix	trans	-65.1	-40.4	174.2	-167.7	176.5	-179	176.4	0	112.3	E393 L394 S400 Q401	E393-K397 WeakPolarHBondContact O-CB 3.23Å; E393-K397 PolarHBondContact O-N 3.2Å; L394-K397 PolarHBondContact O-N 2.85Å; K397-S400 PolarHBondContact O-OG 3.17Å; K397-Q401 WeakPolarHBondContact O-CB 3.33Å; K397-Q401 PolarHBondContact O-N 3.08Å; K397-Q401 VanDerWaalsContact O-N 3.09Å
398	R	95.9	Very high	94.3	Very high	166 Å²	166	119.7 Å²	119.7	63%	0.626	57%	0.568	S	S	*	*	H	α-helix	trans	-65.3	-44.3	174.1	-74.6	177.7	178.6	-177.5	-0.9	111.7	L394 M395 Q401 I402	L394-R398 WeakPolarHBondContact O-CG 3.45Å; L394-R398 PolarHBondContact O-N 2.94Å; M395-R398 PolarHBondContact O-N 3.4Å; R398-Q401 PolarHBondContact O-N 2.95Å; R398-I402 WeakPolarHBondContact O-CG1 3.26Å; R398-I402 PolarHBondContact O-N 2.72Å
399	A	91.7	Very high	94.1	Very high	58 Å²	58	113.3 Å²	113.3	48%	0.479	55%	0.554	S	S	.	*	H	α-helix	trans	-62.4	-44	178.7	0	0	0	0	0	111.9	M395 L396 Q401 I402 Q403	M395-A399 WeakPolarHBondContact O-CB 3.45Å; M395-A399 PolarHBondContact O-N 2.91Å; L396-A399 PolarHBondContact O-N 3.16Å; A399-Q401 VanDerWaalsContact C-N 3.34Å; A399-Q401 PolarHBondContact O-N 2.98Å; A399-I402 PolarHBondContact O-N 3.25Å; A399-Q403 PolarHBondContact O-N 2.93Å
400	S	93.7	Very high	93.9	Very high	52 Å²	52	110.8 Å²	110.8	36%	0.364	55%	0.552	S	S	.	*	H	α-helix	trans	-65.2	-37.6	176.7	68.1	0	0	0	0	112.2	L396 K397 Q403 R404	L396-S400 PolarHBondContact O-N 3.45Å; L396-S400 PolarHBondContact O-OG 3.2Å; K397-S400 PolarHBondContact O-OG 3.17Å; S400-Q403 PolarHBondContact O-N 3.1Å; S400-R404 WeakPolarHBondContact O-CG 3.45Å; S400-R404 PolarHBondContact O-N 3.29Å
401	Q	96.1	Very high	93.6	Very high	101 Å²	101	112.1 Å²	112.1	47%	0.472	55%	0.551	S	S	.	*	H	α-helix	trans	-64.8	-45.6	174.9	-172.3	63.8	16.3	0	0	112.1	K397 R398 A399 Q403 R404 M405	K397-Q401 WeakPolarHBondContact O-CB 3.33Å; K397-Q401 PolarHBondContact O-N 3.08Å; K397-Q401 VanDerWaalsContact O-N 3.09Å; R398-Q401 PolarHBondContact O-N 2.95Å; A399-Q401 VanDerWaalsContact C-N 3.34Å; A399-Q401 PolarHBondContact O-N 2.98Å; Q401-Q403 VanDerWaalsContact C-N 3.26Å; Q401-Q403 PolarHBondContact O-N 3.37Å; Q401-R404 PolarHBondContact O-N 3.24Å; Q401-M405 WeakPolarHBondContact O-CG 3.1Å; Q401-M405 PolarHBondContact O-N 3.2Å
402	I	91.8	Very high	93.3	Very high	96 Å²	96	106 Å²	106	49%	0.492	54%	0.536	S	S	.	.	H	α-helix	trans	-58.5	-41.3	175.1	-69.1	165.6	0	0	0	110.3	R398 A399 M405 K406	R398-I402 WeakPolarHBondContact O-CG1 3.26Å; R398-I402 PolarHBondContact O-N 2.72Å; A399-I402 PolarHBondContact O-N 3.25Å; I402-M405 PolarHBondContact O-N 3.21Å; I402-K406 HydrophobicContact CG2-CD 4.33Å; I402-K406 WeakPolarHBondContact O-CG 3.47Å; I402-K406 PolarHBondContact O-N 3.13Å
403	Q	91.1	Very high	93.2	Very high	100 Å²	100	102.6 Å²	102.6	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-64.3	-41.6	177.6	-169.6	63.2	22	0	0	112.3	A399 S400 Q401 M405 K406 N407	A399-Q403 PolarHBondContact O-N 2.93Å; S400-Q403 PolarHBondContact O-N 3.1Å; Q401-Q403 VanDerWaalsContact C-N 3.26Å; Q401-Q403 PolarHBondContact O-N 3.37Å; Q403-M405 VanDerWaalsContact C-N 3.34Å; Q403-M405 PolarHBondContact O-N 3.14Å; Q403-K406 PolarHBondContact O-N 3.35Å; Q403-N407 PolarHBondContact NE2-OD1 3.18Å; Q403-N407 VanDerWaalsContact O-CG 3.28Å; Q403-N407 PolarHBondContact O-N 2.87Å; Q403-N407 PolarHBondContact O-OD1 2.91Å
404	R	93.2	Very high	93	Very high	173 Å²	173	104.4 Å²	104.4	65%	0.653	53%	0.527	S	S	*	.	H	α-helix	trans	-59.9	-44.2	174.4	-72.1	175.7	-178	-164.8	-1	111.7	S400 Q401 N407 A408	S400-R404 WeakPolarHBondContact O-CG 3.45Å; S400-R404 PolarHBondContact O-N 3.29Å; Q401-R404 PolarHBondContact O-N 3.24Å; R404-N407 PolarHBondContact O-N 3.46Å; R404-A408 WeakPolarHBondContact O-CB 3.44Å; R404-A408 PolarHBondContact O-N 3.37Å
405	M	92.7	Very high	92.7	Very high	123 Å²	123	107.7 Å²	107.7	61%	0.606	53%	0.533	S	S	*	.	H	α-helix	trans	-62.4	-42.3	176.7	-66.7	-61.5	-66	0	0	112	Q401 I402 Q403 A408 S409	Q401-M405 WeakPolarHBondContact O-CG 3.1Å; Q401-M405 PolarHBondContact O-N 3.2Å; I402-M405 PolarHBondContact O-N 3.21Å; Q403-M405 VanDerWaalsContact C-N 3.34Å; Q403-M405 PolarHBondContact O-N 3.14Å; M405-A408 PolarHBondContact O-N 3.29Å; M405-S409 PolarHBondContact O-N 3.01Å
406	K	91.7	Very high	92.6	Very high	130 Å²	130	105.7 Å²	105.7	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-62.1	-45.9	175.2	-74.3	-179.4	177.1	-173.3	0	112.3	I402 Q403 A408 S409 C410	I402-K406 HydrophobicContact CG2-CD 4.33Å; I402-K406 WeakPolarHBondContact O-CG 3.47Å; I402-K406 PolarHBondContact O-N 3.13Å; Q403-K406 PolarHBondContact O-N 3.35Å; K406-A408 VanDerWaalsContact C-N 3.34Å; K406-A408 PolarHBondContact O-N 3.45Å; K406-S409 PolarHBondContact O-N 2.9Å; K406-C410 WeakPolarHBondContact O-CB 3.47Å; K406-C410 PolarHBondContact O-N 2.83Å
407	N	91.5	Very high	92.6	Very high	84 Å²	84	104.9 Å²	104.9	45%	0.449	52%	0.521	S	S	.	.	H	α-helix	trans	-62.9	-41.9	177.6	-68.7	-1.3	0	0	0	111.2	Q403 R404 C410 I411	Q403-N407 PolarHBondContact NE2-OD1 3.18Å; Q403-N407 VanDerWaalsContact O-CG 3.28Å; Q403-N407 PolarHBondContact O-N 2.87Å; Q403-N407 PolarHBondContact O-OD1 2.91Å; R404-N407 PolarHBondContact O-N 3.46Å; N407-C410 PolarHBondContact O-N 2.81Å; N407-I411 WeakPolarHBondContact O-CD1 3.44Å; N407-I411 VanDerWaalsContact O-CG1 3.24Å; N407-I411 WeakPolarHBondContact O-CG1 3.43Å; N407-I411 PolarHBondContact O-N 3.06Å
408	A	92.8	Very high	92.6	Very high	57 Å²	57	103.6 Å²	103.6	47%	0.471	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-42.7	176.9	0	0	0	0	0	112.3	R404 M405 K406 I411 S412	R404-A408 WeakPolarHBondContact O-CB 3.44Å; R404-A408 PolarHBondContact O-N 3.37Å; M405-A408 PolarHBondContact O-N 3.29Å; K406-A408 VanDerWaalsContact C-N 3.34Å; K406-A408 PolarHBondContact O-N 3.45Å; A408-I411 PolarHBondContact O-N 2.98Å; A408-S412 PolarHBondContact O-N 2.86Å
409	S	92.8	Very high	92.5	Very high	63 Å²	63	98.3 Å²	98.3	44%	0.441	50%	0.499	S	S	.	.	H	α-helix	trans	-60.8	-49.5	174.4	-169.4	0	0	0	0	111.4	M405 K406 I411 S412 D413	M405-S409 PolarHBondContact O-N 3.01Å; K406-S409 PolarHBondContact O-N 2.9Å; S409-I411 VanDerWaalsContact C-N 3.29Å; S409-I411 PolarHBondContact O-N 2.72Å; S409-S412 WeakPolarHBondContact O-CA 3.27Å; S409-S412 WeakPolarHBondContact O-CB 3.38Å; S409-S412 PolarHBondContact O-N 3.22Å; S409-D413 VanDerWaalsContact O-CG 3.24Å; S409-D413 PolarHBondContact O-N 3.31Å
410	C	92.9	Very high	92.7	Very high	82 Å²	82	100.5 Å²	100.5	55%	0.554	50%	0.503	S	S	*	.	H	α-helix	trans	-57.9	-40.6	179.1	-175.7	0	0	0	0	112.4	K406 N407 S412 D413 W414	K406-C410 WeakPolarHBondContact O-CB 3.47Å; K406-C410 PolarHBondContact O-N 2.83Å; N407-C410 PolarHBondContact O-N 2.81Å; C410-S412 VanDerWaalsContact C-N 3.35Å; C410-D413 PolarHBondContact O-N 3.46Å; C410-W414 WeakPolarHBondContact O-CB 3.5Å; C410-W414 PolarHBondContact O-N 2.88Å
411	I	89.1	Confident	92.8	Very high	85 Å²	85	103.7 Å²	103.7	44%	0.436	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-37.1	175.9	-67.8	165.7	0	0	0	111.3	N407 A408 S409 R415	N407-I411 WeakPolarHBondContact O-CD1 3.44Å; N407-I411 VanDerWaalsContact O-CG1 3.24Å; N407-I411 WeakPolarHBondContact O-CG1 3.43Å; N407-I411 PolarHBondContact O-N 3.06Å; A408-I411 PolarHBondContact O-N 2.98Å; S409-I411 VanDerWaalsContact C-N 3.29Å; S409-I411 PolarHBondContact O-N 2.72Å; I411-R415 VanDerWaalsContact O-CG 3.29Å; I411-R415 WeakPolarHBondContact O-CG 3.01Å; I411-R415 PolarHBondContact O-N 2.7Å; I411-R415 VanDerWaalsContact O-N 3.12Å
412	S	91.2	Very high	92.7	Very high	56 Å²	56	103 Å²	103	39%	0.392	50%	0.504	S	S	.	.	H	α-helix	trans	-64.3	-50.3	175.2	-165.1	0	0	0	0	111	A408 S409 C410 W414 R415 D416	A408-S412 PolarHBondContact O-N 2.86Å; S409-S412 WeakPolarHBondContact O-CA 3.27Å; S409-S412 WeakPolarHBondContact O-CB 3.38Å; S409-S412 PolarHBondContact O-N 3.22Å; C410-S412 VanDerWaalsContact C-N 3.35Å; S412-W414 VanDerWaalsContact C-N 3.29Å; S412-W414 PolarHBondContact O-N 3.46Å; S412-R415 WeakPolarHBondContact O-CB 3.37Å; S412-R415 PolarHBondContact O-N 2.85Å; S412-D416 PolarHBondContact O-N 3.09Å
413	D	91.9	Very high	92.8	Very high	85 Å²	85	105.1 Å²	105.1	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-58.2	-43.9	179.7	-59.4	-28.8	0	0	0	110.5	S409 C410 R415 D416 D417	S409-D413 VanDerWaalsContact O-CG 3.24Å; S409-D413 PolarHBondContact O-N 3.31Å; C410-D413 PolarHBondContact O-N 3.46Å; D413-R415 VanDerWaalsContact C-N 3.33Å; D413-R415 PolarHBondContact O-N 2.85Å; D413-D416 PolarHBondContact O-N 3.46Å; D413-D417 PolarHBondContact O-N 2.93Å
414	W	91	Very high	93	Very high	173 Å²	173	103.3 Å²	103.3	66%	0.655	51%	0.506	S	S	*	.	H	α-helix	trans	-62.7	-35.5	176.2	-178.7	61.4	0	0	0	113.7	C410 S412 Y418	C410-W414 WeakPolarHBondContact O-CB 3.5Å; C410-W414 PolarHBondContact O-N 2.88Å; S412-W414 VanDerWaalsContact C-N 3.29Å; S412-W414 PolarHBondContact O-N 3.46Å; W414-Y418 VanDerWaalsContact O-CB 3.25Å; W414-Y418 WeakPolarHBondContact O-CB 3.34Å; W414-Y418 PolarHBondContact O-N 3.13Å
415	R	91.3	Very high	92.9	Very high	160 Å²	160	99.2 Å²	99.2	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-67.9	-40.7	175.4	-75.9	170.3	173.3	176.8	-2.5	111.5	I411 S412 D413 Y418 T419	I411-R415 VanDerWaalsContact O-CG 3.29Å; I411-R415 WeakPolarHBondContact O-CG 3.01Å; I411-R415 PolarHBondContact O-N 2.7Å; I411-R415 VanDerWaalsContact O-N 3.12Å; S412-R415 WeakPolarHBondContact O-CB 3.37Å; S412-R415 PolarHBondContact O-N 2.85Å; D413-R415 VanDerWaalsContact C-N 3.33Å; D413-R415 PolarHBondContact O-N 2.85Å; R415-Y418 PolarHBondContact O-N 2.77Å; R415-T419 WeakPolarHBondContact O-CB 3.14Å; R415-T419 PolarHBondContact O-N 2.8Å; R415-T419 PolarHBondContact O-OG1 2.92Å
416	D	93.3	Very high	92.9	Very high	101 Å²	101	97.9 Å²	97.9	54%	0.54	49%	0.488	S	S	.	.	H	α-helix	trans	-66.8	-45.1	178.7	-67.3	-23.7	0	0	0	110.6	S412 D413 Y418 T419 L420	S412-D416 PolarHBondContact O-N 3.09Å; D413-D416 PolarHBondContact O-N 3.46Å; D416-Y418 PolarHBondContact O-N 3.4Å; D416-T419 PolarHBondContact O-N 2.84Å; D416-L420 WeakPolarHBondContact O-CB 3.43Å; D416-L420 PolarHBondContact O-N 2.81Å
417	D	94.5	Very high	93	Very high	104 Å²	104	98.4 Å²	98.4	56%	0.556	49%	0.487	S	S	*	.	H	α-helix	trans	-61.4	-43.6	175.4	-73.3	-18.2	0	0	0	112	D413 L420 Y421	D413-D417 PolarHBondContact O-N 2.93Å; D417-L420 PolarHBondContact O-N 3.49Å; D417-Y421 WeakPolarHBondContact O-CB 3.46Å; D417-Y421 PolarHBondContact O-N 3.16Å
418	Y	93.6	Very high	93	Very high	126 Å²	126	98.7 Å²	98.7	49%	0.494	49%	0.485	S	S	.	.	H	α-helix	trans	-65.8	-39.6	176.5	-174.9	-104.9	0	0	0	111.9	W414 R415 D416 L420 Y421 Q422	W414-Y418 VanDerWaalsContact O-CB 3.25Å; W414-Y418 WeakPolarHBondContact O-CB 3.34Å; W414-Y418 PolarHBondContact O-N 3.13Å; R415-Y418 PolarHBondContact O-N 2.77Å; D416-Y418 PolarHBondContact O-N 3.4Å; Y418-L420 VanDerWaalsContact C-N 3.33Å; Y418-L420 PolarHBondContact O-N 3.22Å; Y418-Y421 WeakPolarHBondContact O-CB 3.46Å; Y418-Y421 PolarHBondContact O-N 2.85Å; Y418-Q422 HydrophobicContact CD1-CG 4.18Å; Y418-Q422 HydrophobicContact CE1-CG 3.85Å; Y418-Q422 HydrophobicContact CE2-CG 4.48Å; Y418-Q422 VanDerWaalsContact O-CG 3.31Å; Y418-Q422 WeakPolarHBondContact O-CG 3.48Å; Y418-Q422 PolarHBondContact O-N 3.45Å; Y418-Q422 PolarHBondContact OH-NE2 3.48Å
419	T	95.2	Very high	92.8	Very high	55 Å²	55	102 Å²	102	34%	0.337	49%	0.486	S	S	.	.	H	α-helix	trans	-63.5	-41.9	175.6	-57.4	0	0	0	0	110.8	R415 D416 Q422 K423	R415-T419 WeakPolarHBondContact O-CB 3.14Å; R415-T419 PolarHBondContact O-N 2.8Å; R415-T419 PolarHBondContact O-OG1 2.92Å; D416-T419 PolarHBondContact O-N 2.84Å; T419-Q422 PolarHBondContact O-N 3.35Å; T419-K423 WeakPolarHBondContact O-CG 3.48Å; T419-K423 PolarHBondContact O-N 2.9Å
420	L	95.9	Very high	92.7	Very high	105 Å²	105	104.7 Å²	104.7	55%	0.55	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-42.6	174.9	-176.6	63.1	0	0	0	111.7	D416 D417 Y418 Q422 K423 T424	D416-L420 WeakPolarHBondContact O-CB 3.43Å; D416-L420 PolarHBondContact O-N 2.81Å; D417-L420 PolarHBondContact O-N 3.49Å; Y418-L420 VanDerWaalsContact C-N 3.33Å; Y418-L420 PolarHBondContact O-N 3.22Å; L420-Q422 PolarHBondContact O-N 2.81Å; L420-K423 PolarHBondContact O-N 3.49Å; L420-T424 WeakPolarHBondContact O-CG2 3.41Å; L420-T424 PolarHBondContact O-N 3.44Å; L420-T424 PolarHBondContact O-OG1 2.91Å
421	Y	95.1	Very high	92.6	Very high	119 Å²	119	107.1 Å²	107.1	47%	0.467	50%	0.497	S	S	.	.	H	α-helix	trans	-59.5	-43.6	174.1	174.6	-99.3	0	0	0	112.2	D417 Y418 T424 K425	D417-Y421 WeakPolarHBondContact O-CB 3.46Å; D417-Y421 PolarHBondContact O-N 3.16Å; Y418-Y421 WeakPolarHBondContact O-CB 3.46Å; Y418-Y421 PolarHBondContact O-N 2.85Å; Y421-T424 VanDerWaalsContact CA-OG1 3.3Å; Y421-T424 WeakPolarHBondContact CA-OG1 3.37Å; Y421-T424 PolarHBondContact O-N 3.13Å; Y421-T424 PolarHBondContact O-OG1 2.98Å; Y421-K425 HydrophobicContact CD1-CG 4.44Å; Y421-K425 HydrophobicContact CD2-CG 4.42Å; Y421-K425 HydrophobicContact CE1-CG 3.94Å; Y421-K425 HydrophobicContact CE2-CD 4.44Å; Y421-K425 HydrophobicContact CE2-CG 3.91Å; Y421-K425 WeakPolarHBondContact O-CB 3.33Å; Y421-K425 WeakPolarHBondContact O-CG 3.27Å; Y421-K425 PolarHBondContact O-N 3.31Å; Y421-K425 WeakPolarHBondContact OH-CE 3.34Å
422	Q	93.8	Very high	92.6	Very high	85 Å²	85	106 Å²	106	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-65.6	-41.9	177	-70.2	-63	-16.8	0	0	112.1	Y418 T419 L420 K425 L426	Y418-Q422 HydrophobicContact CD1-CG 4.18Å; Y418-Q422 HydrophobicContact CE1-CG 3.85Å; Y418-Q422 HydrophobicContact CE2-CG 4.48Å; Y418-Q422 VanDerWaalsContact O-CG 3.31Å; Y418-Q422 WeakPolarHBondContact O-CG 3.48Å; Y418-Q422 PolarHBondContact O-N 3.45Å; Y418-Q422 PolarHBondContact OH-NE2 3.48Å; T419-Q422 PolarHBondContact O-N 3.35Å; L420-Q422 PolarHBondContact O-N 2.81Å; Q422-K425 PolarHBondContact O-N 2.89Å; Q422-L426 WeakPolarHBondContact O-CB 3.14Å; Q422-L426 PolarHBondContact O-N 3.42Å
423	K	94.4	Very high	92.6	Very high	141 Å²	141	106.8 Å²	106.8	61%	0.613	49%	0.491	S	S	*	.	H	α-helix	trans	-61.7	-43.7	175.2	-74.8	179.5	178.4	-174.6	0	112.2	T419 L420 L426 Y427	T419-K423 WeakPolarHBondContact O-CG 3.48Å; T419-K423 PolarHBondContact O-N 2.9Å; L420-K423 PolarHBondContact O-N 3.49Å; K423-L426 PolarHBondContact O-N 3.46Å; K423-Y427 WeakPolarHBondContact O-CB 3.41Å; K423-Y427 PolarHBondContact O-N 3.47Å
424	T	94.9	Very high	92.5	Very high	63 Å²	63	111.4 Å²	111.4	39%	0.387	50%	0.503	S	S	.	.	H	α-helix	trans	-65.4	-44	178	49.1	0	0	0	0	111.4	L420 Y421 L426 Y427 E428	L420-T424 WeakPolarHBondContact O-CG2 3.41Å; L420-T424 PolarHBondContact O-N 3.44Å; L420-T424 PolarHBondContact O-OG1 2.91Å; Y421-T424 VanDerWaalsContact CA-OG1 3.3Å; Y421-T424 WeakPolarHBondContact CA-OG1 3.37Å; Y421-T424 PolarHBondContact O-N 3.13Å; Y421-T424 PolarHBondContact O-OG1 2.98Å; T424-L426 PolarHBondContact O-N 2.98Å; T424-Y427 PolarHBondContact O-N 3.25Å; T424-E428 WeakPolarHBondContact O-CG 3.26Å; T424-E428 PolarHBondContact O-N 2.86Å
425	K	92.1	Very high	92.4	Very high	86 Å²	86	110 Å²	110	37%	0.374	50%	0.504	S	S	.	.	H	α-helix	trans	-61.6	-41.3	174.6	-78.1	-72.7	160.9	-151.2	0	113.3	Y421 Q422 E428 Y429	Y421-K425 HydrophobicContact CD1-CG 4.44Å; Y421-K425 HydrophobicContact CD2-CG 4.42Å; Y421-K425 HydrophobicContact CE1-CG 3.94Å; Y421-K425 HydrophobicContact CE2-CD 4.44Å; Y421-K425 HydrophobicContact CE2-CG 3.91Å; Y421-K425 WeakPolarHBondContact O-CB 3.33Å; Y421-K425 WeakPolarHBondContact O-CG 3.27Å; Y421-K425 PolarHBondContact O-N 3.31Å; Y421-K425 WeakPolarHBondContact OH-CE 3.34Å; Q422-K425 PolarHBondContact O-N 2.89Å; K425-E428 IonicContact NZ-OE2 3.84Å; K425-E428 PolarHBondContact NZ-OE2 3.42Å; K425-E428 PolarHBondContact O-N 3.22Å; K425-Y429 PolarHBondContact O-N 3.5Å
426	L	92.8	Very high	92.3	Very high	96 Å²	96	106.6 Å²	106.6	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-43.2	175.7	-179.4	61.8	0	0	0	111.4	Q422 K423 T424 Y429 L430	Q422-L426 WeakPolarHBondContact O-CB 3.14Å; Q422-L426 PolarHBondContact O-N 3.42Å; K423-L426 PolarHBondContact O-N 3.46Å; T424-L426 PolarHBondContact O-N 2.98Å; L426-Y429 PolarHBondContact O-N 3.31Å; L426-L430 HydrophobicContact CD1-CD1 4.44Å; L426-L430 HydrophobicContact CD1-CG 4.44Å; L426-L430 HydrophobicContact CG-CD1 4.15Å; L426-L430 WeakPolarHBondContact O-CG 3.46Å; L426-L430 PolarHBondContact O-N 2.59Å
427	Y	93.5	Very high	92	Very high	141 Å²	141	103.5 Å²	103.5	55%	0.553	48%	0.478	S	S	*	.	H	α-helix	trans	-65.8	-39.6	177.2	-177.1	-109.2	0	0	0	112.7	K423 T424 Y429 L430 K431	K423-Y427 WeakPolarHBondContact O-CB 3.41Å; K423-Y427 PolarHBondContact O-N 3.47Å; T424-Y427 PolarHBondContact O-N 3.25Å; Y427-Y429 VanDerWaalsContact C-N 3.33Å; Y427-L430 PolarHBondContact O-N 3.45Å; Y427-K431 HydrophobicContact CD1-CD 4.29Å; Y427-K431 HydrophobicContact CE1-CD 3.88Å; Y427-K431 WeakPolarHBondContact O-CG 3.46Å; Y427-K431 PolarHBondContact O-N 3.47Å; Y427-K431 VanDerWaalsContact O-N 3.12Å; Y427-K431 WeakPolarHBondContact OH-CE 3.44Å; Y427-K431 PolarHBondContact OH-NZ 3.47Å
428	E	91.3	Very high	91.7	Very high	89 Å²	89	104.3 Å²	104.3	42%	0.416	48%	0.477	S	S	.	.	H	α-helix	trans	-57.5	-46.8	170.1	-76.4	-179.5	174.6	0	0	110.9	T424 K425 K431 K432	T424-E428 WeakPolarHBondContact O-CG 3.26Å; T424-E428 PolarHBondContact O-N 2.86Å; K425-E428 IonicContact NZ-OE2 3.84Å; K425-E428 PolarHBondContact NZ-OE2 3.42Å; K425-E428 PolarHBondContact O-N 3.22Å; E428-K431 PolarHBondContact O-N 3.43Å; E428-K432 WeakPolarHBondContact O-CG 3.16Å; E428-K432 PolarHBondContact O-N 3.08Å
429	Y	88.5	Confident	91.4	Very high	126 Å²	126	104.2 Å²	104.2	49%	0.494	48%	0.481	S	S	.	.	H	α-helix	trans	-63.3	-43.4	179.6	-171.1	-91.8	0	0	0	112.5	K425 L426 Y427 K431 K432 I437	K425-Y429 PolarHBondContact O-N 3.5Å; L426-Y429 PolarHBondContact O-N 3.31Å; Y427-Y429 VanDerWaalsContact C-N 3.33Å; Y429-K431 PolarHBondContact O-N 2.81Å; Y429-K432 PolarHBondContact O-N 2.91Å; Y429-K432 VanDerWaalsContact O-N 3.15Å; Y429-I437 HydrophobicContact CE1-CD1 4.14Å; Y429-I437 HydrophobicContact CE2-CD1 3.93Å; Y429-I437 HydrophobicContact CE2-CG1 4.04Å; Y429-I437 HydrophobicContact CE2-CG2 4.03Å
430	L	90.2	Very high	91.1	Very high	120 Å²	120	104.2 Å²	104.2	63%	0.628	48%	0.477	S	S	*	.	H	α-helix	trans	-66.2	-22.5	178	-72.2	171.4	0	0	0	113.4	L426 Y427	L426-L430 HydrophobicContact CD1-CD1 4.44Å; L426-L430 HydrophobicContact CD1-CG 4.44Å; L426-L430 HydrophobicContact CG-CD1 4.15Å; L426-L430 WeakPolarHBondContact O-CG 3.46Å; L426-L430 PolarHBondContact O-N 2.59Å; Y427-L430 PolarHBondContact O-N 3.45Å
431	K	91.8	Very high	90.5	Very high	134 Å²	134	101.2 Å²	101.2	58%	0.583	47%	0.467	S	S	*	.	H	α-helix	trans	-79.2	-25.5	173.5	-82.3	-177	166	177	0	113.7	Y427 E428 Y429	Y427-K431 HydrophobicContact CD1-CD 4.29Å; Y427-K431 HydrophobicContact CE1-CD 3.88Å; Y427-K431 WeakPolarHBondContact O-CG 3.46Å; Y427-K431 PolarHBondContact O-N 3.47Å; Y427-K431 VanDerWaalsContact O-N 3.12Å; Y427-K431 WeakPolarHBondContact OH-CE 3.44Å; Y427-K431 PolarHBondContact OH-NZ 3.47Å; E428-K431 PolarHBondContact O-N 3.43Å; Y429-K431 PolarHBondContact O-N 2.81Å
432	K	89.5	Confident	89.9	Confident	61 Å²	61	99.4 Å²	99.4	27%	0.265	47%	0.465	S	S	.	.	S	Bend	trans	-74.3	142.3	-174.9	-70.1	-178.1	-173	-161.3	0	111.2	E428 Y429 E436 I437 E440	E428-K432 WeakPolarHBondContact O-CG 3.16Å; E428-K432 PolarHBondContact O-N 3.08Å; Y429-K432 PolarHBondContact O-N 2.91Å; Y429-K432 VanDerWaalsContact O-N 3.15Å; K432-E436 WeakPolarHBondContact CA-OE2 3.49Å; K432-E436 HydrophobicContact CB-CB 4.28Å; K432-I437 HydrophobicContact CB-CD1 4.28Å; K432-I437 HydrophobicContact CB-CG1 3.85Å; K432-I437 HydrophobicContact CD-CG1 4.41Å; K432-E440 IonicContact NZ-OE1 2.73Å; K432-E440 PolarHBondContact NZ-OE1 2.74Å; K432-E440 VanDerWaalsContact NZ-OE1 3.1Å; K432-E440 IonicContact NZ-OE2 2.71Å; K432-E440 PolarHBondContact NZ-OE2 2.9Å
433	T	90.5	Very high	89.4	Confident	72 Å²	72	101.2 Å²	101.2	44%	0.442	47%	0.474	S	S	.	.			trans	-74	159.8	169	62.7	0	0	0	0	110.9	Q435 E436 I437	T433-Q435 PolarHBondContact O-N 3.43Å; T433-E436 PolarHBondContact N-OE2 3.14Å; T433-E436 PolarHBondContact O-N 3.4Å; T433-E436 VanDerWaalsContact OG1-CD 3.24Å; T433-E436 WeakPolarHBondContact OG1-CG 3.47Å; T433-E436 PolarHBondContact OG1-OE1 2.91Å; T433-I437 WeakPolarHBondContact O-CG1 3.27Å; T433-I437 PolarHBondContact O-N 3.48Å; T433-I437 VanDerWaalsContact O-N 3.12Å
434	Y	89.8	Confident	88.7	Confident	182 Å²	182	101.5 Å²	101.5	71%	0.714	47%	0.471	S	S	*	.	H	α-helix	trans	-57.6	-34.9	177.5	178.3	-96.8	0	0	0	112.8	I437 K438	Y434-I437 PolarHBondContact O-N 2.92Å; Y434-K438 PolarHBondContact O-N 3.15Å; Y434-K438 VanDerWaalsContact O-N 3.11Å
435	Q	89.3	Confident	87.8	Confident	144 Å²	144	102 Å²	102	67%	0.673	47%	0.471	S	S	*	.	H	α-helix	trans	-66.1	-46.5	178.1	-71.2	177.9	-15.8	0	0	111.5	T433 I437 K438 E439	T433-Q435 PolarHBondContact O-N 3.43Å; Q435-I437 VanDerWaalsContact C-N 3.31Å; Q435-I437 PolarHBondContact O-N 3.25Å; Q435-K438 WeakPolarHBondContact O-CB 3.44Å; Q435-K438 PolarHBondContact O-N 3.37Å; Q435-K438 VanDerWaalsContact O-N 3.15Å; Q435-E439 WeakPolarHBondContact O-CG 3.45Å; Q435-E439 PolarHBondContact O-N 3.08Å
436	E	89.2	Confident	86.9	Confident	89 Å²	89	103 Å²	103	42%	0.416	48%	0.479	S	S	.	.	H	α-helix	trans	-60.3	-39.5	175.7	-72.4	159.9	-135	0	0	112.6	K432 T433 K438 E439 E440	K432-E436 WeakPolarHBondContact CA-OE2 3.49Å; K432-E436 HydrophobicContact CB-CB 4.28Å; T433-E436 PolarHBondContact N-OE2 3.14Å; T433-E436 PolarHBondContact O-N 3.4Å; T433-E436 VanDerWaalsContact OG1-CD 3.24Å; T433-E436 WeakPolarHBondContact OG1-CG 3.47Å; T433-E436 PolarHBondContact OG1-OE1 2.91Å; E436-K438 VanDerWaalsContact C-N 3.32Å; E436-K438 PolarHBondContact O-N 3.01Å; E436-E439 PolarHBondContact O-N 3.09Å; E436-E440 WeakPolarHBondContact O-CB 3.28Å; E436-E440 PolarHBondContact O-N 3.12Å
437	I	86.7	Confident	86.2	Confident	35 Å²	35	102.9 Å²	102.9	18%	0.179	49%	0.487	C	S	.	.	H	α-helix	trans	-62.9	-42.4	177.1	-66.5	164.8	0	0	0	110.4	Y429 K432 T433 Y434 Q435 A441	Y429-I437 HydrophobicContact CE1-CD1 4.14Å; Y429-I437 HydrophobicContact CE2-CD1 3.93Å; Y429-I437 HydrophobicContact CE2-CG1 4.04Å; Y429-I437 HydrophobicContact CE2-CG2 4.03Å; K432-I437 HydrophobicContact CB-CD1 4.28Å; K432-I437 HydrophobicContact CB-CG1 3.85Å; K432-I437 HydrophobicContact CD-CG1 4.41Å; T433-I437 WeakPolarHBondContact O-CG1 3.27Å; T433-I437 PolarHBondContact O-N 3.48Å; T433-I437 VanDerWaalsContact O-N 3.12Å; Y434-I437 PolarHBondContact O-N 2.92Å; Q435-I437 VanDerWaalsContact C-N 3.31Å; Q435-I437 PolarHBondContact O-N 3.25Å; I437-A441 WeakPolarHBondContact O-CB 3.16Å; I437-A441 PolarHBondContact O-N 2.86Å
438	K	87	Confident	85.3	Confident	122 Å²	122	97.5 Å²	97.5	53%	0.53	47%	0.474	S	S	.	.	H	α-helix	trans	-65.9	-46.1	178.3	-172.6	179.2	177.9	-177.6	0	111.5	Y434 Q435 E436 E440 A441 D442	Y434-K438 PolarHBondContact O-N 3.15Å; Y434-K438 VanDerWaalsContact O-N 3.11Å; Q435-K438 WeakPolarHBondContact O-CB 3.44Å; Q435-K438 PolarHBondContact O-N 3.37Å; Q435-K438 VanDerWaalsContact O-N 3.15Å; E436-K438 VanDerWaalsContact C-N 3.32Å; E436-K438 PolarHBondContact O-N 3.01Å; K438-E440 PolarHBondContact O-N 3.39Å; K438-A441 WeakPolarHBondContact O-CB 3.47Å; K438-A441 PolarHBondContact O-N 3.14Å; K438-D442 PolarHBondContact O-N 2.85Å
439	E	88.7	Confident	84.4	Confident	123 Å²	123	100 Å²	100	58%	0.575	50%	0.498	S	S	*	.	H	α-helix	trans	-62.4	-42.4	177.2	-71.3	176	-177.9	0	0	112	Q435 E436 A441 D442 Q443	Q435-E439 WeakPolarHBondContact O-CG 3.45Å; Q435-E439 PolarHBondContact O-N 3.08Å; E436-E439 PolarHBondContact O-N 3.09Å; E439-A441 VanDerWaalsContact C-N 3.3Å; E439-A441 PolarHBondContact O-N 3.33Å; E439-D442 PolarHBondContact O-N 2.68Å; E439-Q443 VanDerWaalsContact O-CG 3.31Å; E439-Q443 WeakPolarHBondContact O-CG 3.3Å; E439-Q443 PolarHBondContact O-N 2.74Å
440	E	87.7	Confident	83.1	Confident	56 Å²	56	100.2 Å²	100.2	26%	0.262	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-36.8	176.4	-168.5	-171.9	-168.5	0	0	112	K432 E436 K438 R444	K432-E440 IonicContact NZ-OE1 2.73Å; K432-E440 PolarHBondContact NZ-OE1 2.74Å; K432-E440 VanDerWaalsContact NZ-OE1 3.1Å; K432-E440 IonicContact NZ-OE2 2.71Å; K432-E440 PolarHBondContact NZ-OE2 2.9Å; E436-E440 WeakPolarHBondContact O-CB 3.28Å; E436-E440 PolarHBondContact O-N 3.12Å; K438-E440 PolarHBondContact O-N 3.39Å; E440-R444 VanDerWaalsContact CD-NH2 3.31Å; E440-R444 WeakPolarHBondContact O-CG 3.48Å; E440-R444 PolarHBondContact O-N 3.4Å; E440-R444 IonicContact OE1-CZ 3.49Å; E440-R444 VanDerWaalsContact OE1-CZ 3.3Å; E440-R444 IonicContact OE1-NH1 3.4Å; E440-R444 PolarHBondContact OE1-NH1 3.41Å; E440-R444 IonicContact OE1-NH2 3.83Å; E440-R444 PolarHBondContact OE1-NH2 3.02Å; E440-R444 IonicContact OE2-NH1 3.52Å; E440-R444 PolarHBondContact OE2-NH1 3.31Å; E440-R444 IonicContact OE2-NH2 2.59Å
441	A	83.5	Confident	81.9	Confident	41 Å²	41	101.9 Å²	101.9	34%	0.339	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-46.6	174.2	0	0	0	0	0	111.4	I437 K438 E439 Q443 R444 I445	I437-A441 WeakPolarHBondContact O-CB 3.16Å; I437-A441 PolarHBondContact O-N 2.86Å; K438-A441 WeakPolarHBondContact O-CB 3.47Å; K438-A441 PolarHBondContact O-N 3.14Å; E439-A441 VanDerWaalsContact C-N 3.3Å; E439-A441 PolarHBondContact O-N 3.33Å; A441-Q443 VanDerWaalsContact C-N 3.31Å; A441-Q443 PolarHBondContact O-N 3.21Å; A441-R444 PolarHBondContact O-N 3.34Å; A441-I445 VanDerWaalsContact O-CG1 3.28Å; A441-I445 WeakPolarHBondContact O-CG1 3.44Å; A441-I445 PolarHBondContact O-N 2.93Å; A441-I445 VanDerWaalsContact O-N 3.12Å
442	D	83.8	Confident	80.4	Confident	81 Å²	81	97.8 Å²	97.8	43%	0.433	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-41.1	177.3	-71	-16.4	0	0	0	111.4	K438 E439 I445 I446	K438-D442 PolarHBondContact O-N 2.85Å; E439-D442 PolarHBondContact O-N 2.68Å; D442-I445 PolarHBondContact O-N 3.29Å; D442-I446 WeakPolarHBondContact O-CG1 3.43Å; D442-I446 PolarHBondContact O-N 3.42Å; D442-I446 VanDerWaalsContact O-N 3.13Å
443	Q	82.4	Confident	79.1	Confident	124 Å²	124	99.6 Å²	99.6	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-64	-43.1	175.4	-69.9	-62.2	-23.8	0	0	112.8	E439 A441 I445 I446 S447	E439-Q443 VanDerWaalsContact O-CG 3.31Å; E439-Q443 WeakPolarHBondContact O-CG 3.3Å; E439-Q443 PolarHBondContact O-N 2.74Å; A441-Q443 VanDerWaalsContact C-N 3.31Å; A441-Q443 PolarHBondContact O-N 3.21Å; Q443-I445 PolarHBondContact O-N 3.37Å; Q443-I446 PolarHBondContact O-N 3.32Å; Q443-S447 WeakPolarHBondContact O-CB 3.49Å; Q443-S447 PolarHBondContact O-N 2.84Å; Q443-S447 PolarHBondContact O-OG 2.9Å
444	R	80.6	Confident	77.9	Confident	146 Å²	146	104.8 Å²	104.8	55%	0.551	53%	0.531	S	S	*	.	H	α-helix	trans	-60.4	-36.1	176.8	-79.2	-178	178.9	108.7	6.2	112.7	E440 A441 S447 G448	E440-R444 VanDerWaalsContact CD-NH2 3.31Å; E440-R444 WeakPolarHBondContact O-CG 3.48Å; E440-R444 PolarHBondContact O-N 3.4Å; E440-R444 IonicContact OE1-CZ 3.49Å; E440-R444 VanDerWaalsContact OE1-CZ 3.3Å; E440-R444 IonicContact OE1-NH1 3.4Å; E440-R444 PolarHBondContact OE1-NH1 3.41Å; E440-R444 IonicContact OE1-NH2 3.83Å; E440-R444 PolarHBondContact OE1-NH2 3.02Å; E440-R444 IonicContact OE2-NH1 3.52Å; E440-R444 PolarHBondContact OE2-NH1 3.31Å; E440-R444 IonicContact OE2-NH2 2.59Å; A441-R444 PolarHBondContact O-N 3.34Å; R444-S447 WeakPolarHBondContact CA-OG 3.4Å; R444-S447 PolarHBondContact O-OG 3.08Å; R444-G448 PolarHBondContact O-N 2.76Å
445	I	74.1	Confident	76.7	Confident	73 Å²	73	102.3 Å²	102.3	37%	0.374	53%	0.53	S	S	.	.	H	α-helix	trans	-68.5	-46	179.2	-67.4	165.7	0	0	0	110	A441 D442 Q443 S447 G448 L457	A441-I445 VanDerWaalsContact O-CG1 3.28Å; A441-I445 WeakPolarHBondContact O-CG1 3.44Å; A441-I445 PolarHBondContact O-N 2.93Å; A441-I445 VanDerWaalsContact O-N 3.12Å; D442-I445 PolarHBondContact O-N 3.29Å; Q443-I445 PolarHBondContact O-N 3.37Å; I445-S447 VanDerWaalsContact C-N 3.34Å; I445-G448 PolarHBondContact O-N 3.02Å; I445-L457 HydrophobicContact CG2-CD1 3.44Å; I445-L457 VanDerWaalsContact CG2-CD1 3.44Å; I445-L457 HydrophobicContact CG2-CD2 3.3Å; I445-L457 HydrophobicContact CG2-CG 3.99Å
446	I	74.8	Confident	75.5	Confident	107 Å²	107	102 Å²	102	55%	0.549	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-39.2	176.7	-63.4	164.3	0	0	0	111	D442 Q443 G448	D442-I446 WeakPolarHBondContact O-CG1 3.43Å; D442-I446 PolarHBondContact O-N 3.42Å; D442-I446 VanDerWaalsContact O-N 3.13Å; Q443-I446 PolarHBondContact O-N 3.32Å; I446-G448 PolarHBondContact O-N 2.63Å
447	S	78	Confident	74	Confident	95 Å²	95	101.1 Å²	101.1	66%	0.664	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	1.9	179.6	73.3	0	0	0	0	114.5	Q443 R444 I445	Q443-S447 WeakPolarHBondContact O-CB 3.49Å; Q443-S447 PolarHBondContact O-N 2.84Å; Q443-S447 PolarHBondContact O-OG 2.9Å; R444-S447 WeakPolarHBondContact CA-OG 3.4Å; R444-S447 PolarHBondContact O-OG 3.08Å; I445-S447 VanDerWaalsContact C-N 3.34Å
448	G	74.1	Confident	73.1	Confident	27 Å²	27	107.2 Å²	107.2	28%	0.278	55%	0.552	S	S	.	*	S	Bend	trans	-60.2	158.5	-179.7	0	0	0	0	0	112.2	R444 I445 I446 L450	R444-G448 PolarHBondContact O-N 2.76Å; I445-G448 PolarHBondContact O-N 3.02Å; I446-G448 PolarHBondContact O-N 2.63Å; G448-L450 PolarHBondContact O-N 2.84Å
449	P	71.3	Confident	72.2	Confident	142 Å²	142	110 Å²	110	92%	0.922	57%	0.569	S	S	*	*	S	Bend	trans	-68.4	-5.8	-180	28.7	-35.6	0	0	0	114
450	L	62.2	Low	71.6	Confident	130 Å²	130	108.1 Å²	108.1	68%	0.681	56%	0.562	S	S	*	*	S	Bend	trans	-106.6	129.9	175.3	-62.7	170.9	0	0	0	106.6	G448 V452	G448-L450 PolarHBondContact O-N 2.84Å; L450-V452 HydrophobicContact CB-CG2 3.76Å; L450-V452 WeakPolarHBondContact O-CG2 3.42Å; L450-V452 PolarHBondContact O-N 3.22Å
451	D	64.9	Low	71.2	Confident	156 Å²	156	110.7 Å²	110.7	83%	0.834	58%	0.577	S	S	*	*			trans	-70.6	74.4	179.1	-150	10.7	0	0	0	109.1	N453	D451-N453 PolarHBondContact O-N 2.9Å
452	V	60.7	Low	71	Confident	48 Å²	48	113.4 Å²	113.4	29%	0.291	59%	0.594	S	S	.	*			trans	-91.5	93.9	-173.7	-171.8	0	0	0	0	108.7	L450 H456 L457	L450-V452 HydrophobicContact CB-CG2 3.76Å; L450-V452 WeakPolarHBondContact O-CG2 3.42Å; L450-V452 PolarHBondContact O-N 3.22Å; V452-H456 HydrophobicContact CG1-CB 3.6Å; V452-L457 HydrophobicContact CG1-CD2 3.56Å; V452-L457 HydrophobicContact CG1-CG 3.93Å
453	N	62.1	Low	70.9	Confident	98 Å²	98	113 Å²	113	52%	0.524	60%	0.597	S	S	.	*			trans	-54.1	148.7	169.1	-73.4	-24.5	0	0	0	111.7	D451 D455 H456	D451-N453 PolarHBondContact O-N 2.9Å; N453-D455 PolarHBondContact O-N 3.02Å; N453-H456 WeakPolarHBondContact O-CB 3.37Å; N453-H456 PolarHBondContact O-N 2.92Å
454	K	65.6	Low	70.8	Confident	181 Å²	181	112.2 Å²	112.2	79%	0.787	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-53.4	-28	-177.7	-152.1	175.1	-173.9	177.2	0	113.6	H456 L457	K454-H456 VanDerWaalsContact C-N 3.35Å; K454-L457 WeakPolarHBondContact O-CB 3.4Å; K454-L457 PolarHBondContact O-N 3.2Å
455	D	63.9	Low	70.7	Confident	130 Å²	130	108.4 Å²	108.4	70%	0.695	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-74.1	-23.2	178.2	-56.9	-32.2	0	0	0	113.7	N453	N453-D455 PolarHBondContact O-N 3.02Å
456	H	63.4	Low	71.1	Confident	137 Å²	137	109 Å²	109	63%	0.634	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-77	-10.8	171.2	-60.2	141.9	0	0	0	112.2	V452 N453 K454	V452-H456 HydrophobicContact CG1-CB 3.6Å; N453-H456 WeakPolarHBondContact O-CB 3.37Å; N453-H456 PolarHBondContact O-N 2.92Å; K454-H456 VanDerWaalsContact C-N 3.35Å
457	L	59.3	Low	71.5	Confident	71 Å²	71	107.3 Å²	107.3	37%	0.372	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-95.2	28.4	-179.4	-58.1	173.7	0	0	0	113.2	I445 V452 K454 M459	I445-L457 HydrophobicContact CG2-CD1 3.44Å; I445-L457 VanDerWaalsContact CG2-CD1 3.44Å; I445-L457 HydrophobicContact CG2-CD2 3.3Å; I445-L457 HydrophobicContact CG2-CG 3.99Å; V452-L457 HydrophobicContact CG1-CD2 3.56Å; V452-L457 HydrophobicContact CG1-CG 3.93Å; K454-L457 WeakPolarHBondContact O-CB 3.4Å; K454-L457 PolarHBondContact O-N 3.2Å; L457-M459 PolarHBondContact O-N 3.39Å
458	K	67.3	Low	71.5	Confident	164 Å²	164	107.9 Å²	107.9	71%	0.713	58%	0.58	S	S	*	*			trans	-67.6	125.5	169.1	-71.7	-175.8	-178.5	-179.4	0	108.8	I460	K458-I460 PolarHBondContact O-N 3.39Å
459	M	67.9	Low	71.7	Confident	179 Å²	179	115.4 Å²	115.4	88%	0.882	60%	0.601	S	S	*	*			trans	-60.5	114	164.7	-74.8	-134.1	-57.4	0	0	107.7	L457 D461	L457-M459 PolarHBondContact O-N 3.39Å; M459-D461 PolarHBondContact O-N 2.94Å
460	I	76.4	Confident	72.1	Confident	85 Å²	85	117.2 Å²	117.2	44%	0.436	59%	0.594	S	S	.	*			trans	-67.7	122.9	177.3	-60.7	176.2	0	0	0	107.4	K458 E464 L465 L468	K458-I460 PolarHBondContact O-N 3.39Å; I460-E464 HydrophobicContact CG2-CB 3.39Å; I460-L465 HydrophobicContact CG2-CB 3.88Å; I460-L465 VanDerWaalsContact CG2-N 3.34Å; I460-L468 HydrophobicContact CD1-CD1 3.95Å; I460-L468 HydrophobicContact CG2-CD1 4.33Å
461	D	78.9	Confident	72.6	Confident	110 Å²	110	117.5 Å²	117.5	59%	0.588	59%	0.592	S	S	*	*			trans	-64	154.7	175.3	-79.8	-27.6	0	0	0	110.7	M459 S463 E464 L465	M459-D461 PolarHBondContact O-N 2.94Å; D461-S463 PolarHBondContact O-N 3.11Å; D461-E464 PolarHBondContact O-N 3.31Å; D461-L465 PolarHBondContact O-N 2.77Å
462	S	79.2	Confident	72.5	Confident	97 Å²	97	114.9 Å²	114.9	68%	0.678	58%	0.583	S	S	*	*	H	α-helix	trans	-55.9	-28.7	-179.7	61.8	0	0	0	0	113.2	N466	S462-N466 WeakPolarHBondContact O-CB 3.39Å; S462-N466 VanDerWaalsContact O-CG 3.31Å; S462-N466 PolarHBondContact O-N 2.83Å; S462-N466 VanDerWaalsContact O-N 3.1Å; S462-N466 PolarHBondContact O-ND2 3.32Å
463	S	80.9	Confident	72.6	Confident	72 Å²	72	120 Å²	120	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-70.2	-45.9	174.2	53.7	0	0	0	0	112.9	D461 N466 S467	D461-S463 PolarHBondContact O-N 3.11Å; S463-N466 PolarHBondContact O-N 2.98Å; S463-S467 PolarHBondContact O-N 3.08Å; S463-S467 PolarHBondContact O-OG 3.46Å
464	E	80.8	Confident	72.3	Confident	109 Å²	109	123.4 Å²	123.4	51%	0.509	62%	0.618	S	S	.	*	H	α-helix	trans	-66.4	-41.6	175.5	-79.4	-171.6	146.9	0	0	111.2	I460 D461 N466 S467 L468	I460-E464 HydrophobicContact CG2-CB 3.39Å; D461-E464 PolarHBondContact O-N 3.31Å; E464-N466 VanDerWaalsContact C-N 3.32Å; E464-N466 PolarHBondContact O-N 2.9Å; E464-S467 CarbonylContact O-C 3.6Å; E464-S467 WeakPolarHBondContact O-CA 3.37Å; E464-S467 WeakPolarHBondContact O-CB 3.38Å; E464-S467 PolarHBondContact O-N 3.43Å; E464-L468 PolarHBondContact O-N 3.43Å
465	L	79.3	Confident	72	Confident	66 Å²	66	124.1 Å²	124.1	35%	0.346	62%	0.621	S	S	.	*	H	α-helix	trans	-62.3	-41.4	177.5	-172.2	124.9	0	0	0	111.3	I460 D461 S467 L468 R469	I460-L465 HydrophobicContact CG2-CB 3.88Å; I460-L465 VanDerWaalsContact CG2-N 3.34Å; D461-L465 PolarHBondContact O-N 2.77Å; L465-S467 VanDerWaalsContact C-N 3.3Å; L465-S467 PolarHBondContact O-N 2.88Å; L465-L468 PolarHBondContact O-N 3.19Å; L465-R469 WeakPolarHBondContact O-CG 3.45Å; L465-R469 PolarHBondContact O-N 3.33Å
466	N	82.5	Confident	71.4	Confident	84 Å²	84	125.5 Å²	125.5	45%	0.449	62%	0.623	S	S	.	*	H	α-helix	trans	-66.3	-31.7	173.1	-82.1	-26.8	0	0	0	112.7	S462 S463 E464 K470	S462-N466 WeakPolarHBondContact O-CB 3.39Å; S462-N466 VanDerWaalsContact O-CG 3.31Å; S462-N466 PolarHBondContact O-N 2.83Å; S462-N466 VanDerWaalsContact O-N 3.1Å; S462-N466 PolarHBondContact O-ND2 3.32Å; S463-N466 PolarHBondContact O-N 2.98Å; E464-N466 VanDerWaalsContact C-N 3.32Å; E464-N466 PolarHBondContact O-N 2.9Å; N466-K470 WeakPolarHBondContact O-CG 3.47Å; N466-K470 PolarHBondContact O-N 3.22Å
467	S	83.8	Confident	71.2	Confident	73 Å²	73	130 Å²	130	51%	0.51	63%	0.634	S	S	.	*	H	α-helix	trans	-70.6	-41.4	175.7	-57.4	0	0	0	0	111.6	S463 E464 L465 K470 Q471	S463-S467 PolarHBondContact O-N 3.08Å; S463-S467 PolarHBondContact O-OG 3.46Å; E464-S467 CarbonylContact O-C 3.6Å; E464-S467 WeakPolarHBondContact O-CA 3.37Å; E464-S467 WeakPolarHBondContact O-CB 3.38Å; E464-S467 PolarHBondContact O-N 3.43Å; L465-S467 VanDerWaalsContact C-N 3.3Å; L465-S467 PolarHBondContact O-N 2.88Å; S467-K470 PolarHBondContact O-N 2.99Å; S467-Q471 PolarHBondContact O-N 3.22Å
468	L	77.6	Confident	71.4	Confident	106 Å²	106	132.2 Å²	132.2	56%	0.555	65%	0.653	S	S	*	*	H	α-helix	trans	-62.8	-41.9	172.8	-81.6	161.6	0	0	0	112.3	I460 E464 L465 K470 Q471	I460-L468 HydrophobicContact CD1-CD1 3.95Å; I460-L468 HydrophobicContact CG2-CD1 4.33Å; E464-L468 PolarHBondContact O-N 3.43Å; L465-L468 PolarHBondContact O-N 3.19Å; L468-K470 PolarHBondContact O-N 3.1Å; L468-Q471 WeakPolarHBondContact O-CB 3.45Å; L468-Q471 PolarHBondContact O-N 3.43Å; L468-Q471 VanDerWaalsContact O-N 3.16Å
469	R	78.4	Confident	71.5	Confident	186 Å²	186	128.7 Å²	128.7	70%	0.702	66%	0.655	S	S	*	*	H	α-helix	trans	-63.1	-27	175.9	-76.4	176.5	175.9	-176	-0.4	113.3	L465	L465-R469 WeakPolarHBondContact O-CG 3.45Å; L465-R469 PolarHBondContact O-N 3.33Å
470	K	79.5	Confident	71.9	Confident	180 Å²	180	127.9 Å²	127.9	78%	0.783	65%	0.654	S	S	*	*	H	α-helix	trans	-84.7	-12.1	177.7	-72.8	176.6	-178.2	-178.2	0	113.4	N466 S467 L468 P472	N466-K470 WeakPolarHBondContact O-CG 3.47Å; N466-K470 PolarHBondContact O-N 3.22Å; S467-K470 PolarHBondContact O-N 2.99Å; L468-K470 PolarHBondContact O-N 3.1Å; K470-P472 WeakPolarHBondContact O-CD 3.38Å
471	Q	71.7	Confident	72	Confident	135 Å²	135	129.2 Å²	129.2	63%	0.631	66%	0.661	S	S	*	*	S	Bend	trans	-67	121.6	172.7	-69.7	-83.5	-9.5	0	0	108.7	S467 L468 I473	S467-Q471 PolarHBondContact O-N 3.22Å; L468-Q471 WeakPolarHBondContact O-CB 3.45Å; L468-Q471 PolarHBondContact O-N 3.43Å; L468-Q471 VanDerWaalsContact O-N 3.16Å; Q471-I473 PolarHBondContact O-N 2.86Å
472	P	63	Low	72.2	Confident	102 Å²	102	128.8 Å²	128.8	66%	0.662	66%	0.659	S	S	*	*			trans	-64.6	121.7	174.2	25.5	-31.1	0	0	0	108.7	K470 K474	K470-P472 WeakPolarHBondContact O-CD 3.38Å; P472-K474 VanDerWaalsContact C-N 3.27Å; P472-K474 PolarHBondContact O-N 2.88Å
473	I	63.8	Low	72.5	Confident	156 Å²	156	128.9 Å²	128.9	80%	0.8	66%	0.66	S	S	*	*			trans	-63.7	93.6	170.6	-56.2	170.3	0	0	0	106.6	Q471 K475	Q471-I473 PolarHBondContact O-N 2.86Å; I473-K475 VanDerWaalsContact C-N 3.29Å; I473-K475 PolarHBondContact O-N 3.38Å
474	K	55.9	Low	72.8	Confident	169 Å²	169	129.3 Å²	129.3	74%	0.735	66%	0.656	S	S	*	*			trans	-63.1	99.3	165.4	-73.7	-175.8	179.8	178.5	0	105.8	P472 E476	P472-K474 VanDerWaalsContact C-N 3.27Å; P472-K474 PolarHBondContact O-N 2.88Å; K474-E476 HydrophobicContact CB-CG 4.3Å; K474-E476 PolarHBondContact O-N 3.17Å
475	K	57.8	Low	73	Confident	195 Å²	195	126.6 Å²	126.6	85%	0.848	65%	0.647	S	S	*	*			trans	-64.7	83.7	160.4	-70	-176.6	-178.7	179.9	0	105.6	I473 R477	I473-K475 VanDerWaalsContact C-N 3.29Å; I473-K475 PolarHBondContact O-N 3.38Å; K475-R477 PolarHBondContact O-N 3.04Å
476	E	52	Low	73.2	Confident	159 Å²	159	126.2 Å²	126.2	74%	0.743	65%	0.647	S	S	*	*			trans	-59.2	112.6	170.3	-67.5	-171.8	172	0	0	105.8	K474	K474-E476 HydrophobicContact CB-CG 4.3Å; K474-E476 PolarHBondContact O-N 3.17Å
477	R	59.6	Low	73.4	Confident	232 Å²	232	126.4 Å²	126.4	88%	0.875	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-54.6	131.1	162.6	-89.3	-177.7	173.1	171.4	-2	105.2	K475 A479	K475-R477 PolarHBondContact O-N 3.04Å; R477-A479 PolarHBondContact O-N 3.37Å
478	P	63	Low	73.6	Confident	118 Å²	118	128.4 Å²	128.4	77%	0.766	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-51.2	132.5	173.6	21.3	-30.9	0	0	0	107.7	N480	P478-N480 PolarHBondContact O-N 3.49Å
479	A	69.5	Low	73.9	Confident	90 Å²	90	127.7 Å²	127.7	74%	0.744	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-51.4	140.7	178.2	0	0	0	0	0	108.9	R477 L481	R477-A479 PolarHBondContact O-N 3.37Å; A479-L481 PolarHBondContact O-N 2.95Å
480	N	76.8	Confident	74.2	Confident	161 Å²	161	123.1 Å²	123.1	86%	0.861	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-53.8	128.3	172.1	-73.5	-22.6	0	0	0	107.9	P478	P478-N480 PolarHBondContact O-N 3.49Å
481	L	78.1	Confident	74.5	Confident	113 Å²	113	119.7 Å²	119.7	59%	0.592	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-55.5	143	173.9	-73.8	160.7	0	0	0	108.9	A479 T485 V486 L489	A479-L481 PolarHBondContact O-N 2.95Å; L481-T485 HydrophobicContact CD2-CG2 4.3Å; L481-V486 HydrophobicContact CB-CG2 3.66Å; L481-L489 HydrophobicContact CD1-CD1 4.28Å
482	D	83.8	Confident	75.3	Confident	101 Å²	101	115 Å²	115	54%	0.54	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-57.6	144.4	176.3	174.5	47.4	0	0	0	111	D484 T485 V486	D482-D484 PolarHBondContact O-N 3.13Å; D482-D484 WeakPolarHBondContact OD2-CB 3.42Å; D482-D484 PolarHBondContact OD2-N 3.43Å; D482-T485 WeakPolarHBondContact O-CA 3.36Å; D482-T485 WeakPolarHBondContact O-CB 3.41Å; D482-T485 PolarHBondContact O-N 2.99Å; D482-V486 WeakPolarHBondContact O-CG2 3.45Å; D482-V486 PolarHBondContact O-N 3.23Å
483	S	84.7	Confident	76.4	Confident	100 Å²	100	110.7 Å²	110.7	70%	0.699	58%	0.578	S	S	*	*	H	α-helix	trans	-57.5	-38.5	-174.5	-176	0	0	0	0	111.7	V486 L487	S483-V486 PolarHBondContact O-N 3.03Å; S483-L487 PolarHBondContact O-N 3.34Å; S483-L487 VanDerWaalsContact O-N 3.08Å
484	D	87.9	Confident	77.5	Confident	81 Å²	81	107.8 Å²	107.8	43%	0.433	56%	0.564	S	S	.	*	H	α-helix	trans	-68	-40	176.4	-171.4	61.1	0	0	0	111.4	D482 V486 L487 Q488	D482-D484 PolarHBondContact O-N 3.13Å; D482-D484 WeakPolarHBondContact OD2-CB 3.42Å; D482-D484 PolarHBondContact OD2-N 3.43Å; D484-V486 VanDerWaalsContact C-N 3.34Å; D484-V486 PolarHBondContact O-N 3.45Å; D484-L487 WeakPolarHBondContact O-CB 3.39Å; D484-L487 PolarHBondContact O-N 2.93Å; D484-Q488 WeakPolarHBondContact O-CG 3.37Å; D484-Q488 PolarHBondContact O-N 3.4Å; D484-Q488 PolarHBondContact OD2-NE2 2.9Å
485	T	85.2	Confident	79	Confident	52 Å²	52	102.5 Å²	102.5	32%	0.319	55%	0.552	S	S	.	*	H	α-helix	trans	-63.6	-40.6	177.5	-51.5	0	0	0	0	111.4	L481 D482 Q488 L489	L481-T485 HydrophobicContact CD2-CG2 4.3Å; D482-T485 WeakPolarHBondContact O-CA 3.36Å; D482-T485 WeakPolarHBondContact O-CB 3.41Å; D482-T485 PolarHBondContact O-N 2.99Å; T485-Q488 PolarHBondContact O-N 2.88Å; T485-L489 HydrophobicContact CG2-CD1 4.35Å; T485-L489 WeakPolarHBondContact O-CB 3.42Å; T485-L489 VanDerWaalsContact O-CG 3.27Å; T485-L489 WeakPolarHBondContact O-CG 3.43Å; T485-L489 PolarHBondContact O-N 3.46Å
486	V	83.1	Confident	80.4	Confident	57 Å²	57	99.9 Å²	99.9	35%	0.345	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-46	174.8	176.9	0	0	0	0	110.6	L481 D482 S483 D484 Q488 L489 E490	L481-V486 HydrophobicContact CB-CG2 3.66Å; D482-V486 WeakPolarHBondContact O-CG2 3.45Å; D482-V486 PolarHBondContact O-N 3.23Å; S483-V486 PolarHBondContact O-N 3.03Å; D484-V486 VanDerWaalsContact C-N 3.34Å; D484-V486 PolarHBondContact O-N 3.45Å; V486-Q488 PolarHBondContact O-N 3.45Å; V486-L489 PolarHBondContact O-N 3.38Å; V486-E490 WeakPolarHBondContact O-CG 3.47Å; V486-E490 PolarHBondContact O-N 3.47Å
487	L	86.7	Confident	82.1	Confident	89 Å²	89	94.2 Å²	94.2	47%	0.466	51%	0.512	S	S	.	.	H	α-helix	trans	-59.8	-44.9	176.7	179.5	63.5	0	0	0	111.9	S483 D484 L489 E490 L491	S483-L487 PolarHBondContact O-N 3.34Å; S483-L487 VanDerWaalsContact O-N 3.08Å; D484-L487 WeakPolarHBondContact O-CB 3.39Å; D484-L487 PolarHBondContact O-N 2.93Å; L487-L489 PolarHBondContact O-N 3.15Å; L487-E490 PolarHBondContact O-N 3.04Å; L487-L491 HydrophobicContact CD1-CD1 4.49Å; L487-L491 HydrophobicContact CD1-CG 4.45Å; L487-L491 HydrophobicContact CG-CD1 4.28Å; L487-L491 WeakPolarHBondContact O-CG 3.44Å; L487-L491 PolarHBondContact O-N 2.91Å
488	Q	88.2	Confident	83.5	Confident	114 Å²	114	85.8 Å²	85.8	53%	0.533	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-43.4	176.1	-71.9	-178	20.1	0	0	112	D484 T485 V486 E490 L491 A492	D484-Q488 WeakPolarHBondContact O-CG 3.37Å; D484-Q488 PolarHBondContact O-N 3.4Å; D484-Q488 PolarHBondContact OD2-NE2 2.9Å; T485-Q488 PolarHBondContact O-N 2.88Å; V486-Q488 PolarHBondContact O-N 3.45Å; Q488-E490 VanDerWaalsContact C-N 3.3Å; Q488-E490 PolarHBondContact O-N 3.39Å; Q488-L491 PolarHBondContact O-N 3.46Å; Q488-A492 VanDerWaalsContact O-CB 3.28Å; Q488-A492 WeakPolarHBondContact O-CB 3.42Å; Q488-A492 PolarHBondContact O-N 3.02Å
489	L	84.1	Confident	84.9	Confident	91 Å²	91	83.3 Å²	83.3	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-63.7	-37.7	176.3	-73.4	171.5	0	0	0	111.6	L481 T485 V486 L487 S493	L481-L489 HydrophobicContact CD1-CD1 4.28Å; T485-L489 HydrophobicContact CG2-CD1 4.35Å; T485-L489 WeakPolarHBondContact O-CB 3.42Å; T485-L489 VanDerWaalsContact O-CG 3.27Å; T485-L489 WeakPolarHBondContact O-CG 3.43Å; T485-L489 PolarHBondContact O-N 3.46Å; V486-L489 PolarHBondContact O-N 3.38Å; L487-L489 PolarHBondContact O-N 3.15Å; L489-S493 WeakPolarHBondContact O-CB 3.38Å; L489-S493 PolarHBondContact O-N 3.4Å
490	E	84.2	Confident	85.9	Confident	90 Å²	90	80.3 Å²	80.3	42%	0.421	45%	0.448	S	S	.	.	H	α-helix	trans	-65.7	-48.4	175	-76.9	-171	162.7	0	0	112.3	V486 L487 Q488 A492 S493 L494	V486-E490 WeakPolarHBondContact O-CG 3.47Å; V486-E490 PolarHBondContact O-N 3.47Å; L487-E490 PolarHBondContact O-N 3.04Å; Q488-E490 VanDerWaalsContact C-N 3.3Å; Q488-E490 PolarHBondContact O-N 3.39Å; E490-A492 VanDerWaalsContact C-N 3.34Å; E490-A492 PolarHBondContact O-N 2.92Å; E490-S493 VanDerWaalsContact O-CB 3.3Å; E490-S493 WeakPolarHBondContact O-CB 3.39Å; E490-S493 PolarHBondContact O-N 2.94Å; E490-S493 VanDerWaalsContact O-N 3.14Å; E490-L494 PolarHBondContact O-N 2.85Å
491	L	86.1	Confident	86.6	Confident	108 Å²	108	77.3 Å²	77.3	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-60.5	-43.2	175.9	-71.3	173.8	0	0	0	111.5	L487 Q488 S493 L494 A495	L487-L491 HydrophobicContact CD1-CD1 4.49Å; L487-L491 HydrophobicContact CD1-CG 4.45Å; L487-L491 HydrophobicContact CG-CD1 4.28Å; L487-L491 WeakPolarHBondContact O-CG 3.44Å; L487-L491 PolarHBondContact O-N 2.91Å; Q488-L491 PolarHBondContact O-N 3.46Å; L491-S493 VanDerWaalsContact C-N 3.3Å; L491-S493 PolarHBondContact O-N 2.9Å; L491-L494 PolarHBondContact O-N 3.37Å; L491-A495 WeakPolarHBondContact O-CB 3.31Å; L491-A495 PolarHBondContact O-N 3.46Å
492	A	87.6	Confident	87.4	Confident	38 Å²	38	78.3 Å²	78.3	31%	0.314	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-35.8	175.7	0	0	0	0	0	112.1	Q488 E490 R496	Q488-A492 VanDerWaalsContact O-CB 3.28Å; Q488-A492 WeakPolarHBondContact O-CB 3.42Å; Q488-A492 PolarHBondContact O-N 3.02Å; E490-A492 VanDerWaalsContact C-N 3.34Å; E490-A492 PolarHBondContact O-N 2.92Å; A492-R496 WeakPolarHBondContact O-CG 3.48Å; A492-R496 PolarHBondContact O-N 3.3Å; A492-R496 VanDerWaalsContact O-N 3.08Å; A492-R496 PolarHBondContact O-NH1 3.47Å
493	S	86	Confident	87.8	Confident	10 Å²	10	79.3 Å²	79.3	7%	0.07	43%	0.431	C	S	.	.	H	α-helix	trans	-65.5	-45	175.2	-163.1	0	0	0	0	111.1	L489 E490 L491 R496 D497 R550 R562	L489-S493 WeakPolarHBondContact O-CB 3.38Å; L489-S493 PolarHBondContact O-N 3.4Å; E490-S493 VanDerWaalsContact O-CB 3.3Å; E490-S493 WeakPolarHBondContact O-CB 3.39Å; E490-S493 PolarHBondContact O-N 2.94Å; E490-S493 VanDerWaalsContact O-N 3.14Å; L491-S493 VanDerWaalsContact C-N 3.3Å; L491-S493 PolarHBondContact O-N 2.9Å; S493-R496 VanDerWaalsContact CA-NH2 3.34Å; S493-R496 PolarHBondContact O-N 2.9Å; S493-D497 PolarHBondContact O-N 3.23Å; S493-D497 VanDerWaalsContact O-N 3.1Å; S493-R550 PolarHBondContact OG-NH2 2.97Å; S493-R562 PolarHBondContact OG-NH2 3.4Å
494	L	86.4	Confident	88.2	Confident	95 Å²	95	76.9 Å²	76.9	50%	0.497	41%	0.412	S	S	.	.	H	α-helix	trans	-64.1	-41.6	175.6	-166.6	155.5	0	0	0	111.6	E490 L491 R496 D497 A498	E490-L494 PolarHBondContact O-N 2.85Å; L491-L494 PolarHBondContact O-N 3.37Å; L494-R496 VanDerWaalsContact C-N 3.34Å; L494-R496 PolarHBondContact O-N 3.43Å; L494-D497 PolarHBondContact O-N 3.25Å; L494-A498 WeakPolarHBondContact O-CB 3.47Å; L494-A498 PolarHBondContact O-N 3.31Å
495	A	89.1	Confident	88.5	Confident	58 Å²	58	77.7 Å²	77.7	48%	0.479	41%	0.413	S	S	.	.	H	α-helix	trans	-61.8	-39.9	176	0	0	0	0	0	112.5	L491 C499	L491-A495 WeakPolarHBondContact O-CB 3.31Å; L491-A495 PolarHBondContact O-N 3.46Å; A495-C499 WeakPolarHBondContact O-CB 3.26Å; A495-C499 PolarHBondContact O-N 3.23Å
496	R	86.8	Confident	89	Confident	141 Å²	141	79 Å²	79	53%	0.532	42%	0.416	S	S	.	.	H	α-helix	trans	-63.3	-41.6	173.8	-74.6	-174.1	-61.9	-91	6.3	111.8	A492 S493 L494 C499 L500	A492-R496 WeakPolarHBondContact O-CG 3.48Å; A492-R496 PolarHBondContact O-N 3.3Å; A492-R496 VanDerWaalsContact O-N 3.08Å; A492-R496 PolarHBondContact O-NH1 3.47Å; S493-R496 VanDerWaalsContact CA-NH2 3.34Å; S493-R496 PolarHBondContact O-N 2.9Å; L494-R496 VanDerWaalsContact C-N 3.34Å; L494-R496 PolarHBondContact O-N 3.43Å; R496-C499 PolarHBondContact O-N 3.18Å; R496-L500 PolarHBondContact O-N 2.95Å
497	D	87.9	Confident	89.5	Confident	40 Å²	40	77.3 Å²	77.3	21%	0.214	40%	0.404	C	S	.	.	H	α-helix	trans	-66.8	-44.6	178.7	-66.8	-23.6	0	0	0	111.1	S493 L494 C499 L500 T501 R550	S493-D497 PolarHBondContact O-N 3.23Å; S493-D497 VanDerWaalsContact O-N 3.1Å; L494-D497 PolarHBondContact O-N 3.25Å; D497-C499 VanDerWaalsContact C-N 3.34Å; D497-C499 PolarHBondContact O-N 2.87Å; D497-L500 PolarHBondContact O-N 3.41Å; D497-T501 PolarHBondContact O-N 3.46Å; D497-T501 PolarHBondContact O-OG1 3.39Å; D497-R550 IonicContact OD1-CZ 2.9Å; D497-R550 IonicContact OD1-NE 3.78Å; D497-R550 PolarHBondContact OD1-NE 3.43Å; D497-R550 IonicContact OD1-NH2 2.92Å; D497-R550 PolarHBondContact OD1-NH2 3Å; D497-R550 IonicContact OD2-CZ 3.53Å; D497-R550 IonicContact OD2-NE 3.72Å; D497-R550 PolarHBondContact OD2-NE 2.88Å; D497-R550 IonicContact OD2-NH2 3.87Å; D497-R550 PolarHBondContact OD2-NH2 3.31Å
498	A	89.3	Confident	89.7	Confident	55 Å²	55	76.3 Å²	76.3	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-59.8	-42	174.5	0	0	0	0	0	112.4	L494 T501 K502	L494-A498 WeakPolarHBondContact O-CB 3.47Å; L494-A498 PolarHBondContact O-N 3.31Å; A498-T501 PolarHBondContact O-N 3.36Å; A498-K502 WeakPolarHBondContact O-CB 3.42Å; A498-K502 PolarHBondContact O-N 3.13Å
499	C	92.4	Very high	90	Very high	66 Å²	66	76.5 Å²	76.5	45%	0.446	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-43.3	175.8	-177.6	0	0	0	0	112	A495 R496 D497 K502 R503	A495-C499 WeakPolarHBondContact O-CB 3.26Å; A495-C499 PolarHBondContact O-N 3.23Å; R496-C499 PolarHBondContact O-N 3.18Å; D497-C499 VanDerWaalsContact C-N 3.34Å; D497-C499 PolarHBondContact O-N 2.87Å; C499-K502 PolarHBondContact O-N 2.97Å; C499-R503 WeakPolarHBondContact O-CB 3.4Å; C499-R503 PolarHBondContact O-N 3.35Å
500	L	90.2	Very high	90.3	Very high	27 Å²	27	77.1 Å²	77.1	14%	0.141	40%	0.401	C	S	.	.	H	α-helix	trans	-62.5	-46.3	176.9	-177.8	60	0	0	0	111.1	R496 D497 K502 R503 V504 L543 R546 V547	R496-L500 PolarHBondContact O-N 2.95Å; D497-L500 PolarHBondContact O-N 3.41Å; L500-K502 PolarHBondContact O-N 2.92Å; L500-R503 PolarHBondContact O-N 3Å; L500-V504 WeakPolarHBondContact O-CG2 3.48Å; L500-V504 PolarHBondContact O-N 3.01Å; L500-L543 HydrophobicContact CD1-CD2 4.14Å; L500-R546 HydrophobicContact CD1-CB 4.45Å; L500-R546 HydrophobicContact CD1-CG 4.33Å; L500-R546 HydrophobicContact CD2-CG 4.5Å; L500-V547 HydrophobicContact CD1-CG2 4.45Å; L500-V547 HydrophobicContact CD2-CG2 3.86Å; L500-V547 HydrophobicContact CG-CG2 4.19Å
501	T	91.2	Very high	90.5	Very high	98 Å²	98	75.4 Å²	75.4	60%	0.601	39%	0.394	S	S	*	.	H	α-helix	trans	-59.7	-45.5	176.8	-59.2	0	0	0	0	111.7	D497 A498 R503 V504 H505	D497-T501 PolarHBondContact O-N 3.46Å; D497-T501 PolarHBondContact O-OG1 3.39Å; A498-T501 PolarHBondContact O-N 3.36Å; T501-R503 PolarHBondContact O-N 3.3Å; T501-V504 PolarHBondContact O-N 3.48Å; T501-H505 WeakPolarHBondContact O-CB 3.35Å; T501-H505 PolarHBondContact O-N 3.23Å
502	K	93.6	Very high	90.7	Very high	134 Å²	134	75.2 Å²	75.2	58%	0.583	39%	0.393	S	S	*	.	H	α-helix	trans	-59.5	-46.5	177.1	-167.1	-171.3	-174.2	-156.5	0	111.6	A498 C499 L500 V504 H505 E506	A498-K502 WeakPolarHBondContact O-CB 3.42Å; A498-K502 PolarHBondContact O-N 3.13Å; C499-K502 PolarHBondContact O-N 2.97Å; L500-K502 PolarHBondContact O-N 2.92Å; K502-V504 PolarHBondContact O-N 3.41Å; K502-H505 WeakPolarHBondContact O-CB 3.47Å; K502-H505 PolarHBondContact O-N 3.48Å; K502-H505 VanDerWaalsContact O-N 3.17Å; K502-E506 WeakPolarHBondContact CE-OE1 3.42Å; K502-E506 HydrophobicContact CG-CG 4.47Å; K502-E506 IonicContact NZ-OE1 3.15Å; K502-E506 PolarHBondContact NZ-OE1 3.33Å; K502-E506 WeakPolarHBondContact O-CG 3.36Å; K502-E506 PolarHBondContact O-N 3.41Å
503	R	93.7	Very high	90.8	Very high	121 Å²	121	78.2 Å²	78.2	46%	0.457	40%	0.4	S	S	.	.	H	α-helix	trans	-64.3	-40	179.4	-176.5	169.1	-73.2	152.7	-2.1	112.6	C499 L500 T501 H505 H507 L543	C499-R503 WeakPolarHBondContact O-CB 3.4Å; C499-R503 PolarHBondContact O-N 3.35Å; L500-R503 PolarHBondContact O-N 3Å; T501-R503 PolarHBondContact O-N 3.3Å; R503-H505 VanDerWaalsContact C-N 3.33Å; R503-H507 WeakPolarHBondContact O-CB 3.32Å; R503-H507 PolarHBondContact O-N 3.46Å; R503-L543 HydrophobicContact CG-CD1 4.44Å; R503-L543 HydrophobicContact CG-CD2 3.99Å
504	V	93.4	Very high	90.7	Very high	50 Å²	50	81.8 Å²	81.8	30%	0.303	41%	0.412	S	S	.	.	H	α-helix	trans	-61.5	-45.5	173.2	171.4	0	0	0	0	110	L500 T501 K502 H507 T508 L543 V547	L500-V504 WeakPolarHBondContact O-CG2 3.48Å; L500-V504 PolarHBondContact O-N 3.01Å; T501-V504 PolarHBondContact O-N 3.48Å; K502-V504 PolarHBondContact O-N 3.41Å; V504-H507 PolarHBondContact O-N 3.08Å; V504-T508 HydrophobicContact CG1-CG2 4.46Å; V504-T508 VanDerWaalsContact O-CG2 3.3Å; V504-T508 WeakPolarHBondContact O-CG2 3.39Å; V504-T508 PolarHBondContact O-N 2.93Å; V504-T508 PolarHBondContact O-OG1 3.43Å; V504-L543 HydrophobicContact CG2-CB 4.34Å; V504-L543 HydrophobicContact CG2-CD1 4.31Å; V504-L543 HydrophobicContact CG2-CD2 4.47Å; V504-V547 HydrophobicContact CG2-CG2 4.46Å
505	H	94.2	Very high	90.5	Very high	97 Å²	97	85.6 Å²	85.6	45%	0.449	43%	0.425	S	S	.	.	H	α-helix	trans	-64.3	-45	179.8	-171.9	66.5	0	0	0	112.9	T501 K502 R503 T508 K509	T501-H505 WeakPolarHBondContact O-CB 3.35Å; T501-H505 PolarHBondContact O-N 3.23Å; K502-H505 WeakPolarHBondContact O-CB 3.47Å; K502-H505 PolarHBondContact O-N 3.48Å; K502-H505 VanDerWaalsContact O-N 3.17Å; R503-H505 VanDerWaalsContact C-N 3.33Å; H505-T508 WeakPolarHBondContact CA-OG1 3.32Å; H505-T508 PolarHBondContact O-N 3.02Å; H505-T508 PolarHBondContact O-OG1 2.88Å; H505-K509 PolarHBondContact CD2-NZ 2.93Å; H505-K509 WeakPolarHBondContact NE2-CE 3.48Å; H505-K509 PolarHBondContact NE2-NZ 2.85Å; H505-K509 WeakPolarHBondContact O-CG 3.39Å; H505-K509 PolarHBondContact O-N 3.4Å
506	E	94.4	Very high	90.4	Very high	81 Å²	81	89 Å²	89	38%	0.379	43%	0.429	S	S	.	.	H	α-helix	trans	-57	-49.4	173.6	-73.5	167.5	175.9	0	0	111.1	K502 T508 K509 E510	K502-E506 WeakPolarHBondContact CE-OE1 3.42Å; K502-E506 HydrophobicContact CG-CG 4.47Å; K502-E506 IonicContact NZ-OE1 3.15Å; K502-E506 PolarHBondContact NZ-OE1 3.33Å; K502-E506 WeakPolarHBondContact O-CG 3.36Å; K502-E506 PolarHBondContact O-N 3.41Å; E506-T508 VanDerWaalsContact C-N 3.34Å; E506-T508 PolarHBondContact O-N 3.03Å; E506-K509 WeakPolarHBondContact O-CB 3.5Å; E506-K509 PolarHBondContact O-N 3.1Å; E506-K509 VanDerWaalsContact O-N 3.15Å; E506-E510 WeakPolarHBondContact O-CG 3.19Å; E506-E510 PolarHBondContact O-N 3.25Å
507	H	93.5	Very high	90.1	Very high	21 Å²	21	88 Å²	88	10%	0.097	43%	0.434	C	S	.	.	H	α-helix	trans	-60.3	-42.5	177.5	-171.4	47.6	0	0	0	112.4	R503 V504 K509 E510 I511 S536 L543	R503-H507 WeakPolarHBondContact O-CB 3.32Å; R503-H507 PolarHBondContact O-N 3.46Å; V504-H507 PolarHBondContact O-N 3.08Å; H507-K509 VanDerWaalsContact C-N 3.34Å; H507-K509 PolarHBondContact O-N 2.93Å; H507-E510 PolarHBondContact O-N 3.01Å; H507-I511 WeakPolarHBondContact O-CG1 3.44Å; H507-I511 PolarHBondContact O-N 2.93Å; H507-S536 PolarHBondContact CE1-O 2.94Å; H507-S536 PolarHBondContact CE1-OG 2.88Å; H507-S536 PolarHBondContact NE2-O 3.49Å; H507-L543 HydrophobicContact CB-CD1 4.1Å
508	T	91.6	Very high	89.6	Confident	68 Å²	68	91.7 Å²	91.7	42%	0.417	46%	0.46	S	S	.	.	H	α-helix	trans	-64.3	-38	176.4	56.8	0	0	0	0	112.6	V504 H505 E506 I511 L512	V504-T508 HydrophobicContact CG1-CG2 4.46Å; V504-T508 VanDerWaalsContact O-CG2 3.3Å; V504-T508 WeakPolarHBondContact O-CG2 3.39Å; V504-T508 PolarHBondContact O-N 2.93Å; V504-T508 PolarHBondContact O-OG1 3.43Å; H505-T508 WeakPolarHBondContact CA-OG1 3.32Å; H505-T508 PolarHBondContact O-N 3.02Å; H505-T508 PolarHBondContact O-OG1 2.88Å; E506-T508 VanDerWaalsContact C-N 3.34Å; E506-T508 PolarHBondContact O-N 3.03Å; T508-I511 PolarHBondContact O-N 2.94Å; T508-L512 WeakPolarHBondContact O-CB 3.45Å; T508-L512 PolarHBondContact O-N 3.35Å
509	K	93.2	Very high	89	Confident	118 Å²	118	94.5 Å²	94.5	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-64.8	-45.4	174.6	-80.7	176.1	161.7	164	0	111.3	H505 E506 H507 I511 L512 E513	H505-K509 PolarHBondContact CD2-NZ 2.93Å; H505-K509 WeakPolarHBondContact NE2-CE 3.48Å; H505-K509 PolarHBondContact NE2-NZ 2.85Å; H505-K509 WeakPolarHBondContact O-CG 3.39Å; H505-K509 PolarHBondContact O-N 3.4Å; E506-K509 WeakPolarHBondContact O-CB 3.5Å; E506-K509 PolarHBondContact O-N 3.1Å; E506-K509 VanDerWaalsContact O-N 3.15Å; H507-K509 VanDerWaalsContact C-N 3.34Å; H507-K509 PolarHBondContact O-N 2.93Å; K509-I511 VanDerWaalsContact C-N 3.3Å; K509-I511 PolarHBondContact O-N 3.44Å; K509-L512 PolarHBondContact O-N 3.2Å; K509-L512 VanDerWaalsContact O-N 3.11Å; K509-E513 WeakPolarHBondContact O-CG 3.3Å; K509-E513 PolarHBondContact O-N 3.28Å
510	E	91	Very high	88.4	Confident	104 Å²	104	96.5 Å²	96.5	49%	0.486	48%	0.476	S	S	.	.	H	α-helix	trans	-57.6	-43.7	176.7	-74.4	-178.5	-161.7	0	0	111.9	E506 H507 L512 R514	E506-E510 WeakPolarHBondContact O-CG 3.19Å; E506-E510 PolarHBondContact O-N 3.25Å; H507-E510 PolarHBondContact O-N 3.01Å; E510-L512 VanDerWaalsContact C-N 3.34Å; E510-L512 PolarHBondContact O-N 3.12Å; E510-R514 VanDerWaalsContact O-CG 3.32Å; E510-R514 WeakPolarHBondContact O-CG 3.46Å; E510-R514 PolarHBondContact O-N 3.25Å
511	I	89.3	Confident	87.8	Confident	53 Å²	53	101 Å²	101	27%	0.272	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-44.1	175.6	-68.9	167.9	0	0	0	110.8	H507 T508 K509 R514 F515 S536	H507-I511 WeakPolarHBondContact O-CG1 3.44Å; H507-I511 PolarHBondContact O-N 2.93Å; T508-I511 PolarHBondContact O-N 2.94Å; K509-I511 VanDerWaalsContact C-N 3.3Å; K509-I511 PolarHBondContact O-N 3.44Å; I511-R514 PolarHBondContact O-N 2.84Å; I511-F515 HydrophobicContact CG2-CD2 3.93Å; I511-F515 HydrophobicContact CG2-CE2 3.54Å; I511-F515 WeakPolarHBondContact O-CD2 3.44Å; I511-F515 PolarHBondContact O-N 3.05Å; I511-S536 WeakPolarHBondContact CG1-OG 3.46Å
512	L	89.9	Confident	87.6	Confident	105 Å²	105	100.1 Å²	100.1	55%	0.55	50%	0.502	S	S	.	.	H	α-helix	trans	-67.7	-40.2	-177.8	-146.6	155.1	0	0	0	112	T508 K509 E510 F515	T508-L512 WeakPolarHBondContact O-CB 3.45Å; T508-L512 PolarHBondContact O-N 3.35Å; K509-L512 PolarHBondContact O-N 3.2Å; K509-L512 VanDerWaalsContact O-N 3.11Å; E510-L512 VanDerWaalsContact C-N 3.34Å; E510-L512 PolarHBondContact O-N 3.12Å; L512-F515 PolarHBondContact O-N 2.86Å
513	E	89	Confident	87.1	Confident	100 Å²	100	99.2 Å²	99.2	47%	0.467	50%	0.5	S	S	.	.	H	α-helix	trans	-65	-37.4	172.9	-68.4	-51.8	136.2	0	0	112.1	K509 F515 K516	K509-E513 WeakPolarHBondContact O-CG 3.3Å; K509-E513 PolarHBondContact O-N 3.28Å; E513-F515 VanDerWaalsContact C-N 3.31Å; E513-F515 PolarHBondContact O-N 2.9Å; E513-K516 WeakPolarHBondContact O-CB 3.45Å; E513-K516 PolarHBondContact O-N 3.34Å; E513-K516 IonicContact OE1-NZ 2.86Å; E513-K516 PolarHBondContact OE1-NZ 3.42Å; E513-K516 WeakPolarHBondContact OE2-CD 3.43Å; E513-K516 IonicContact OE2-NZ 2.64Å; E513-K516 PolarHBondContact OE2-NZ 3.45Å
514	R	85.1	Confident	86.8	Confident	86 Å²	86	98.8 Å²	98.8	33%	0.325	51%	0.506	S	S	.	.	H	α-helix	trans	-61.4	-38.3	174.6	-75	-177.8	-165	-173.1	8.8	112.7	E510 I511 K516 L517 T532	E510-R514 VanDerWaalsContact O-CG 3.32Å; E510-R514 WeakPolarHBondContact O-CG 3.46Å; E510-R514 PolarHBondContact O-N 3.25Å; I511-R514 PolarHBondContact O-N 2.84Å; R514-K516 PolarHBondContact O-N 3.38Å; R514-L517 PolarHBondContact O-N 3.1Å; R514-L517 VanDerWaalsContact O-N 3.16Å; R514-T532 PolarHBondContact NH1-O 3.17Å; R514-T532 VanDerWaalsContact NH1-O 3.13Å
515	F	81.2	Confident	86.4	Confident	175 Å²	175	97.7 Å²	97.7	77%	0.768	50%	0.503	S	S	*	.	H	α-helix	trans	-64.8	-18.8	175.4	-79.1	-66.5	0	0	0	113.8	I511 L512 E513	I511-F515 HydrophobicContact CG2-CD2 3.93Å; I511-F515 HydrophobicContact CG2-CE2 3.54Å; I511-F515 WeakPolarHBondContact O-CD2 3.44Å; I511-F515 PolarHBondContact O-N 3.05Å; L512-F515 PolarHBondContact O-N 2.86Å; E513-F515 VanDerWaalsContact C-N 3.31Å; E513-F515 PolarHBondContact O-N 2.9Å
516	K	87.8	Confident	86	Confident	128 Å²	128	96.4 Å²	96.4	56%	0.557	50%	0.498	S	S	*	.	H	α-helix	trans	-83.7	-18.3	175.8	-61.6	176.9	-171	167.7	0	113.2	E513 R514	E513-K516 WeakPolarHBondContact O-CB 3.45Å; E513-K516 PolarHBondContact O-N 3.34Å; E513-K516 IonicContact OE1-NZ 2.86Å; E513-K516 PolarHBondContact OE1-NZ 3.42Å; E513-K516 WeakPolarHBondContact OE2-CD 3.43Å; E513-K516 IonicContact OE2-NZ 2.64Å; E513-K516 PolarHBondContact OE2-NZ 3.45Å; R514-K516 PolarHBondContact O-N 3.38Å
517	L	79.2	Confident	85.7	Confident	122 Å²	122	99.5 Å²	99.5	64%	0.639	51%	0.506	S	S	*	.	S	Bend	trans	-76	134.3	-178.2	-65.9	178.2	0	0	0	111.1	R514 V519	R514-L517 PolarHBondContact O-N 3.1Å; R514-L517 VanDerWaalsContact O-N 3.16Å; L517-V519 PolarHBondContact O-N 3.15Å
518	P	78.5	Confident	85.4	Confident	116 Å²	116	101.8 Å²	101.8	75%	0.753	52%	0.524	S	S	*	.			trans	-67.9	130.3	175.3	26.8	-32.2	0	0	0	110.6	I520	P518-I520 PolarHBondContact O-N 3.38Å
519	V	77.3	Confident	85.2	Confident	115 Å²	115	102.6 Å²	102.6	70%	0.697	52%	0.524	S	S	*	.			trans	-72.5	114.4	177.3	-177.5	0	0	0	0	109.5	L517 I526	L517-V519 PolarHBondContact O-N 3.15Å; V519-I526 HydrophobicContact CG1-CG1 4.49Å
520	I	80	Confident	84.9	Confident	108 Å²	108	102.6 Å²	102.6	55%	0.554	53%	0.528	S	S	*	.			trans	-71.3	125.9	175.7	-57.3	167.5	0	0	0	108.5	P518 T522 A525	P518-I520 PolarHBondContact O-N 3.38Å; I520-T522 HydrophobicContact CG2-CG2 4.13Å; I520-T522 PolarHBondContact O-N 2.84Å; I520-A525 HydrophobicContact CB-CB 4.13Å; I520-A525 HydrophobicContact CG2-CB 4.42Å
521	P	76.1	Confident	84.9	Confident	122 Å²	122	102.3 Å²	102.3	79%	0.792	53%	0.53	S	S	*	.			trans	-79.3	23.1	-172	32.7	-36.7	0	0	0	114.2
522	T	87.2	Confident	84.9	Confident	79 Å²	79	102.2 Å²	102.2	49%	0.485	53%	0.532	S	S	.	.			trans	-84.8	136	172.7	56.4	0	0	0	0	109.6	I520 D524 A525 I526	I520-T522 HydrophobicContact CG2-CG2 4.13Å; I520-T522 PolarHBondContact O-N 2.84Å; T522-D524 PolarHBondContact O-N 3.03Å; T522-D524 VanDerWaalsContact O-N 3.17Å; T522-A525 PolarHBondContact O-N 3.47Å; T522-A525 VanDerWaalsContact O-N 3.1Å; T522-A525 WeakPolarHBondContact OG1-CB 3.46Å; T522-I526 WeakPolarHBondContact O-CG1 3.39Å; T522-I526 PolarHBondContact O-N 3.47Å
523	H	82.9	Confident	84.8	Confident	115 Å²	115	99.4 Å²	99.4	53%	0.532	52%	0.524	S	S	.	.	H	α-helix	trans	-57.6	-35.4	-174.7	-168.5	-65.1	0	0	0	112.4	R527	H523-R527 PolarHBondContact CE1-NE 2.94Å; H523-R527 PolarHBondContact CE1-NH2 3.07Å; H523-R527 PolarHBondContact ND1-NE 3.46Å; H523-R527 WeakPolarHBondContact O-CG 3.35Å; H523-R527 PolarHBondContact O-N 3.17Å; H523-R527 VanDerWaalsContact O-N 3.08Å
524	D	87.6	Confident	85	Confident	112 Å²	112	100.9 Å²	100.9	60%	0.599	53%	0.529	S	S	*	.	H	α-helix	trans	-74.5	-37.3	178.7	-65.2	-32	0	0	0	112.7	T522 I526 R527 S528	T522-D524 PolarHBondContact O-N 3.03Å; T522-D524 VanDerWaalsContact O-N 3.17Å; D524-I526 VanDerWaalsContact C-N 3.32Å; D524-I526 PolarHBondContact O-N 3.18Å; D524-R527 PolarHBondContact O-N 3.29Å; D524-R527 IonicContact OD1-NH1 3.88Å; D524-R527 PolarHBondContact OD1-NH1 2.71Å; D524-S528 PolarHBondContact O-N 3.3Å; D524-S528 PolarHBondContact O-OG 3.39Å
525	A	84.6	Confident	85.3	Confident	27 Å²	27	103.3 Å²	103.3	22%	0.223	54%	0.542	C	S	.	.	H	α-helix	trans	-63.4	-40	173.3	0	0	0	0	0	111.5	I520 T522 S528 E529	I520-A525 HydrophobicContact CB-CB 4.13Å; I520-A525 HydrophobicContact CG2-CB 4.42Å; T522-A525 PolarHBondContact O-N 3.47Å; T522-A525 VanDerWaalsContact O-N 3.1Å; T522-A525 WeakPolarHBondContact OG1-CB 3.46Å; A525-S528 WeakPolarHBondContact CA-OG 3.32Å; A525-S528 PolarHBondContact O-N 3.31Å; A525-S528 PolarHBondContact O-OG 2.87Å; A525-E529 VanDerWaalsContact O-CB 3.32Å; A525-E529 WeakPolarHBondContact O-CB 3.04Å; A525-E529 PolarHBondContact O-N 2.99Å
526	I	86.6	Confident	85.8	Confident	70 Å²	70	95.8 Å²	95.8	36%	0.359	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-44.4	174.6	-64	167.2	0	0	0	110.5	V519 T522 D524 E529 L530	V519-I526 HydrophobicContact CG1-CG1 4.49Å; T522-I526 WeakPolarHBondContact O-CG1 3.39Å; T522-I526 PolarHBondContact O-N 3.47Å; D524-I526 VanDerWaalsContact C-N 3.32Å; D524-I526 PolarHBondContact O-N 3.18Å; I526-E529 PolarHBondContact O-N 3.26Å; I526-L530 HydrophobicContact CG2-CD1 4.13Å; I526-L530 HydrophobicContact CG2-CG 4.46Å; I526-L530 WeakPolarHBondContact O-CB 3.32Å; I526-L530 VanDerWaalsContact O-CG 3.32Å; I526-L530 WeakPolarHBondContact O-CG 3.47Å; I526-L530 PolarHBondContact O-N 3.04Å
527	R	87.2	Confident	86.1	Confident	146 Å²	146	95.6 Å²	95.6	55%	0.551	51%	0.513	S	S	*	.	H	α-helix	trans	-63.8	-45.3	177.7	-79	179.7	178.1	143	1.7	112.2	H523 D524 E529 L530 L531	H523-R527 PolarHBondContact CE1-NE 2.94Å; H523-R527 PolarHBondContact CE1-NH2 3.07Å; H523-R527 PolarHBondContact ND1-NE 3.46Å; H523-R527 WeakPolarHBondContact O-CG 3.35Å; H523-R527 PolarHBondContact O-N 3.17Å; H523-R527 VanDerWaalsContact O-N 3.08Å; D524-R527 PolarHBondContact O-N 3.29Å; D524-R527 IonicContact OD1-NH1 3.88Å; D524-R527 PolarHBondContact OD1-NH1 2.71Å; R527-E529 VanDerWaalsContact C-N 3.27Å; R527-E529 PolarHBondContact O-N 3.44Å; R527-L530 PolarHBondContact O-N 3.49Å; R527-L531 PolarHBondContact O-N 3.02Å
528	S	87.8	Confident	86.7	Confident	68 Å²	68	93.6 Å²	93.6	48%	0.476	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-40.1	177.1	53.5	0	0	0	0	111	D524 A525 L531 T532	D524-S528 PolarHBondContact O-N 3.3Å; D524-S528 PolarHBondContact O-OG 3.39Å; A525-S528 WeakPolarHBondContact CA-OG 3.32Å; A525-S528 PolarHBondContact O-N 3.31Å; A525-S528 PolarHBondContact O-OG 2.87Å; S528-L531 PolarHBondContact O-N 3.3Å; S528-T532 WeakPolarHBondContact O-CG2 3.35Å; S528-T532 PolarHBondContact O-N 2.87Å; S528-T532 PolarHBondContact O-OG1 3.13Å
529	E	86.9	Confident	87.4	Confident	86 Å²	86	90.9 Å²	90.9	40%	0.402	48%	0.48	S	S	.	.	H	α-helix	trans	-68.4	-38.4	178	-169.2	54.6	-146.9	0	0	112.4	A525 I526 R527 L531 T532 A533	A525-E529 VanDerWaalsContact O-CB 3.32Å; A525-E529 WeakPolarHBondContact O-CB 3.04Å; A525-E529 PolarHBondContact O-N 2.99Å; I526-E529 PolarHBondContact O-N 3.26Å; R527-E529 VanDerWaalsContact C-N 3.27Å; R527-E529 PolarHBondContact O-N 3.44Å; E529-L531 VanDerWaalsContact C-N 3.29Å; E529-L531 PolarHBondContact O-N 3.39Å; E529-T532 VanDerWaalsContact CA-OG1 3.32Å; E529-T532 WeakPolarHBondContact CA-OG1 3.49Å; E529-T532 PolarHBondContact O-N 3.11Å; E529-T532 PolarHBondContact O-OG1 3.46Å; E529-T532 PolarHBondContact OE2-OG1 3.29Å; E529-A533 WeakPolarHBondContact O-CB 3.08Å; E529-A533 PolarHBondContact O-N 3.23Å
530	L	88.3	Confident	88.2	Confident	117 Å²	117	87.3 Å²	87.3	61%	0.613	46%	0.463	S	S	*	.	H	α-helix	trans	-62.3	-37.9	172.3	-75.4	172.5	0	0	0	111.9	I526 R527 K534	I526-L530 HydrophobicContact CG2-CD1 4.13Å; I526-L530 HydrophobicContact CG2-CG 4.46Å; I526-L530 WeakPolarHBondContact O-CB 3.32Å; I526-L530 VanDerWaalsContact O-CG 3.32Å; I526-L530 WeakPolarHBondContact O-CG 3.47Å; I526-L530 PolarHBondContact O-N 3.04Å; R527-L530 PolarHBondContact O-N 3.49Å; L530-K534 WeakPolarHBondContact O-CB 3.34Å; L530-K534 PolarHBondContact O-N 3.05Å
531	L	91.5	Very high	88.8	Confident	99 Å²	99	85.3 Å²	85.3	52%	0.518	45%	0.453	S	S	.	.	H	α-helix	trans	-70.3	-42.3	178.5	-169.3	71	0	0	0	111.7	R527 S528 E529 A533 K534 K535	R527-L531 PolarHBondContact O-N 3.02Å; S528-L531 PolarHBondContact O-N 3.3Å; E529-L531 VanDerWaalsContact C-N 3.29Å; E529-L531 PolarHBondContact O-N 3.39Å; L531-A533 VanDerWaalsContact C-N 3.35Å; L531-K534 PolarHBondContact O-N 3.34Å; L531-K535 WeakPolarHBondContact O-CG 3.35Å; L531-K535 PolarHBondContact O-N 3.16Å
532	T	88.2	Confident	89.6	Confident	50 Å²	50	86.4 Å²	86.4	31%	0.307	44%	0.441	S	S	.	.	H	α-helix	trans	-67.3	-36.1	175.6	56.1	0	0	0	0	111.5	R514 S528 E529 K535 S536	R514-T532 PolarHBondContact NH1-O 3.17Å; R514-T532 VanDerWaalsContact NH1-O 3.13Å; S528-T532 WeakPolarHBondContact O-CG2 3.35Å; S528-T532 PolarHBondContact O-N 2.87Å; S528-T532 PolarHBondContact O-OG1 3.13Å; E529-T532 VanDerWaalsContact CA-OG1 3.32Å; E529-T532 WeakPolarHBondContact CA-OG1 3.49Å; E529-T532 PolarHBondContact O-N 3.11Å; E529-T532 PolarHBondContact O-OG1 3.46Å; E529-T532 PolarHBondContact OE2-OG1 3.29Å; T532-K535 PolarHBondContact O-N 3.31Å; T532-S536 WeakPolarHBondContact O-CB 3.44Å; T532-S536 PolarHBondContact O-N 2.84Å
533	A	88.5	Confident	89.9	Confident	47 Å²	47	83.2 Å²	83.2	39%	0.388	42%	0.421	S	S	.	.	H	α-helix	trans	-64.3	-43.2	172.4	0	0	0	0	0	111.8	E529 L531 S536 M537	E529-A533 WeakPolarHBondContact O-CB 3.08Å; E529-A533 PolarHBondContact O-N 3.23Å; L531-A533 VanDerWaalsContact C-N 3.35Å; A533-S536 WeakPolarHBondContact O-CB 3.41Å; A533-S536 PolarHBondContact O-N 3.24Å; A533-M537 PolarHBondContact O-N 3.01Å
534	K	92.2	Very high	90.3	Very high	131 Å²	131	82.8 Å²	82.8	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-59.8	-48	174.4	-176.8	-176	174.8	-173.4	0	111.8	L530 L531 S536 M537 D538	L530-K534 WeakPolarHBondContact O-CB 3.34Å; L530-K534 PolarHBondContact O-N 3.05Å; L531-K534 PolarHBondContact O-N 3.34Å; K534-S536 VanDerWaalsContact C-N 3.27Å; K534-S536 PolarHBondContact O-N 2.68Å; K534-M537 WeakPolarHBondContact O-CB 3.17Å; K534-M537 PolarHBondContact O-N 3.14Å; K534-M537 VanDerWaalsContact O-N 3.13Å; K534-D538 PolarHBondContact O-N 3.24Å
535	K	91.8	Very high	90.6	Very high	137 Å²	137	85 Å²	85	60%	0.596	42%	0.419	S	S	*	.	H	α-helix	trans	-58.4	-41.5	176.6	-72.1	178.1	-179.7	-177.9	0	111.6	L531 T532 M537 D538 E539	L531-K535 WeakPolarHBondContact O-CG 3.35Å; L531-K535 PolarHBondContact O-N 3.16Å; T532-K535 PolarHBondContact O-N 3.31Å; K535-M537 VanDerWaalsContact C-N 3.34Å; K535-D538 PolarHBondContact O-N 3.11Å; K535-E539 PolarHBondContact O-N 3.11Å
536	S	91.8	Very high	90.9	Very high	16 Å²	16	90.8 Å²	90.8	11%	0.112	44%	0.435	C	S	.	.	H	α-helix	trans	-62.5	-40	175.9	175.7	0	0	0	0	112.4	H507 I511 T532 A533 K534 E539 A540	H507-S536 PolarHBondContact CE1-O 2.94Å; H507-S536 PolarHBondContact CE1-OG 2.88Å; H507-S536 PolarHBondContact NE2-O 3.49Å; I511-S536 WeakPolarHBondContact CG1-OG 3.46Å; T532-S536 WeakPolarHBondContact O-CB 3.44Å; T532-S536 PolarHBondContact O-N 2.84Å; A533-S536 WeakPolarHBondContact O-CB 3.41Å; A533-S536 PolarHBondContact O-N 3.24Å; K534-S536 VanDerWaalsContact C-N 3.27Å; K534-S536 PolarHBondContact O-N 2.68Å; S536-E539 PolarHBondContact O-N 3.04Å; S536-A540 PolarHBondContact O-N 3.38Å
537	M	93.1	Very high	91.1	Very high	125 Å²	125	89.9 Å²	89.9	62%	0.616	43%	0.432	S	S	*	.	H	α-helix	trans	-65	-43.1	174.7	-170.1	177.9	-174.7	0	0	112.2	A533 K534 K535 E539 A540 I541	A533-M537 PolarHBondContact O-N 3.01Å; K534-M537 WeakPolarHBondContact O-CB 3.17Å; K534-M537 PolarHBondContact O-N 3.14Å; K534-M537 VanDerWaalsContact O-N 3.13Å; K535-M537 VanDerWaalsContact C-N 3.34Å; M537-E539 VanDerWaalsContact C-N 3.32Å; M537-E539 PolarHBondContact O-N 3.34Å; M537-A540 WeakPolarHBondContact O-CB 3.49Å; M537-A540 PolarHBondContact O-N 3.47Å; M537-I541 HydrophobicContact CG-CD1 4.44Å; M537-I541 WeakPolarHBondContact O-CG1 3.49Å; M537-I541 PolarHBondContact O-N 2.96Å
538	D	93.8	Very high	91.3	Very high	80 Å²	80	87 Å²	87	43%	0.428	43%	0.425	S	S	.	.	H	α-helix	trans	-62.1	-40	176.7	-71	-30.4	0	0	0	111.6	K534 K535 I541 R542	K534-D538 PolarHBondContact O-N 3.24Å; K535-D538 PolarHBondContact O-N 3.11Å; D538-I541 PolarHBondContact O-N 3.43Å; D538-R542 PolarHBondContact O-N 3.45Å; D538-R542 VanDerWaalsContact O-N 3.08Å
539	E	92.9	Very high	91.3	Very high	58 Å²	58	89.5 Å²	89.5	27%	0.271	43%	0.43	S	S	.	.	H	α-helix	trans	-64.3	-42.9	174.2	-166.9	60.9	-145.1	0	0	111.8	K535 S536 M537 I541 R542 L543	K535-E539 PolarHBondContact O-N 3.11Å; S536-E539 PolarHBondContact O-N 3.04Å; M537-E539 VanDerWaalsContact C-N 3.32Å; M537-E539 PolarHBondContact O-N 3.34Å; E539-I541 VanDerWaalsContact C-N 3.32Å; E539-I541 PolarHBondContact O-N 3.16Å; E539-R542 WeakPolarHBondContact O-CB 3Å; E539-R542 PolarHBondContact O-N 2.99Å; E539-R542 VanDerWaalsContact O-N 3.12Å; E539-R542 IonicContact OE1-NH1 3.24Å; E539-R542 PolarHBondContact OE1-NH1 2.64Å; E539-R542 IonicContact OE2-CZ 2.66Å; E539-R542 IonicContact OE2-NH1 2.74Å; E539-R542 PolarHBondContact OE2-NH1 2.86Å; E539-R542 IonicContact OE2-NH2 3.37Å; E539-L543 HydrophobicContact CG-CD1 4.32Å; E539-L543 WeakPolarHBondContact O-CG 3.43Å; E539-L543 PolarHBondContact O-N 3.48Å
540	A	92.7	Very high	91.1	Very high	40 Å²	40	87.6 Å²	87.6	33%	0.331	42%	0.419	S	S	.	.	H	α-helix	trans	-59.8	-42.1	176.9	0	0	0	0	0	111.9	S536 M537 R542 L543 H544	S536-A540 PolarHBondContact O-N 3.38Å; M537-A540 WeakPolarHBondContact O-CB 3.49Å; M537-A540 PolarHBondContact O-N 3.47Å; A540-R542 VanDerWaalsContact C-N 3.34Å; A540-R542 PolarHBondContact O-N 3.04Å; A540-L543 PolarHBondContact O-N 2.9Å; A540-H544 VanDerWaalsContact O-CB 3.31Å; A540-H544 WeakPolarHBondContact O-CB 3.44Å; A540-H544 PolarHBondContact O-N 3.35Å
541	I	92.5	Very high	90.9	Very high	67 Å²	67	84.9 Å²	84.9	34%	0.344	41%	0.405	S	S	.	.	H	α-helix	trans	-62.6	-42.3	175.3	-67.2	166.1	0	0	0	110.7	M537 D538 E539 H544 R545	M537-I541 HydrophobicContact CG-CD1 4.44Å; M537-I541 WeakPolarHBondContact O-CG1 3.49Å; M537-I541 PolarHBondContact O-N 2.96Å; D538-I541 PolarHBondContact O-N 3.43Å; E539-I541 VanDerWaalsContact C-N 3.32Å; E539-I541 PolarHBondContact O-N 3.16Å; I541-H544 PolarHBondContact O-N 3.09Å; I541-R545 WeakPolarHBondContact O-CG 3.49Å; I541-R545 PolarHBondContact O-N 3.33Å
542	R	94	Very high	90.5	Very high	145 Å²	145	85.2 Å²	85.2	55%	0.547	40%	0.403	S	S	.	.	H	α-helix	trans	-64.5	-46.4	178.9	-167.3	-173.7	-58.8	136	10.2	111.7	D538 E539 A540 H544 R545 R546	D538-R542 PolarHBondContact O-N 3.45Å; D538-R542 VanDerWaalsContact O-N 3.08Å; E539-R542 WeakPolarHBondContact O-CB 3Å; E539-R542 PolarHBondContact O-N 2.99Å; E539-R542 VanDerWaalsContact O-N 3.12Å; E539-R542 IonicContact OE1-NH1 3.24Å; E539-R542 PolarHBondContact OE1-NH1 2.64Å; E539-R542 IonicContact OE2-CZ 2.66Å; E539-R542 IonicContact OE2-NH1 2.74Å; E539-R542 PolarHBondContact OE2-NH1 2.86Å; E539-R542 IonicContact OE2-NH2 3.37Å; A540-R542 VanDerWaalsContact C-N 3.34Å; A540-R542 PolarHBondContact O-N 3.04Å; R542-H544 VanDerWaalsContact C-N 3.34Å; R542-R545 PolarHBondContact O-N 3.28Å; R542-R546 PolarHBondContact O-N 3.07Å; R542-R546 VanDerWaalsContact O-N 3.09Å
543	L	92.2	Very high	90.1	Very high	12 Å²	12	85.5 Å²	85.5	6%	0.063	41%	0.405	C	S	.	.	H	α-helix	trans	-61.2	-43.5	175.8	-71.4	174.5	0	0	0	111.1	L500 R503 V504 H507 E539 A540 R545 R546 V547	L500-L543 HydrophobicContact CD1-CD2 4.14Å; R503-L543 HydrophobicContact CG-CD1 4.44Å; R503-L543 HydrophobicContact CG-CD2 3.99Å; V504-L543 HydrophobicContact CG2-CB 4.34Å; V504-L543 HydrophobicContact CG2-CD1 4.31Å; V504-L543 HydrophobicContact CG2-CD2 4.47Å; H507-L543 HydrophobicContact CB-CD1 4.1Å; E539-L543 HydrophobicContact CG-CD1 4.32Å; E539-L543 WeakPolarHBondContact O-CG 3.43Å; E539-L543 PolarHBondContact O-N 3.48Å; A540-L543 PolarHBondContact O-N 2.9Å; L543-R545 PolarHBondContact O-N 3.26Å; L543-R546 WeakPolarHBondContact O-CB 3.15Å; L543-R546 PolarHBondContact O-N 3.1Å; L543-R546 VanDerWaalsContact O-N 3.15Å; L543-V547 WeakPolarHBondContact O-CG2 3.08Å; L543-V547 PolarHBondContact O-N 3.15Å
544	H	92.4	Very high	89.4	Confident	105 Å²	105	85 Å²	85	49%	0.486	40%	0.396	S	S	.	.	H	α-helix	trans	-58.7	-47.4	177.1	-176.7	73.2	0	0	0	112.4	A540 I541 R542 R546 V547 Q548	A540-H544 VanDerWaalsContact O-CB 3.31Å; A540-H544 WeakPolarHBondContact O-CB 3.44Å; A540-H544 PolarHBondContact O-N 3.35Å; I541-H544 PolarHBondContact O-N 3.09Å; R542-H544 VanDerWaalsContact C-N 3.34Å; H544-R546 VanDerWaalsContact C-N 3.28Å; H544-R546 PolarHBondContact O-N 2.85Å; H544-V547 PolarHBondContact O-N 3.4Å; H544-Q548 VanDerWaalsContact NE2-CD 3.32Å; H544-Q548 PolarHBondContact NE2-NE2 3.32Å; H544-Q548 WeakPolarHBondContact O-CG 3.48Å; H544-Q548 PolarHBondContact O-N 3.23Å
545	R	93.5	Very high	88.4	Confident	158 Å²	158	86.1 Å²	86.1	60%	0.596	40%	0.397	S	S	*	.	H	α-helix	trans	-60	-39.6	175.7	-72.2	178.9	-171.3	167.6	4.1	112.1	I541 R542 L543 Q548 Q549	I541-R545 WeakPolarHBondContact O-CG 3.49Å; I541-R545 PolarHBondContact O-N 3.33Å; R542-R545 PolarHBondContact O-N 3.28Å; L543-R545 PolarHBondContact O-N 3.26Å; R545-Q548 PolarHBondContact O-N 3.18Å; R545-Q549 WeakPolarHBondContact O-CG 3.48Å; R545-Q549 PolarHBondContact O-N 3.22Å
546	R	92	Very high	87.3	Confident	150 Å²	150	89.4 Å²	89.4	57%	0.566	41%	0.406	S	S	*	.	H	α-helix	trans	-65.9	-40.9	178.5	-160.9	167.1	-150.7	158.9	5.9	111.8	L500 R542 L543 H544 R550	L500-R546 HydrophobicContact CD1-CB 4.45Å; L500-R546 HydrophobicContact CD1-CG 4.33Å; L500-R546 HydrophobicContact CD2-CG 4.5Å; R542-R546 PolarHBondContact O-N 3.07Å; R542-R546 VanDerWaalsContact O-N 3.09Å; L543-R546 WeakPolarHBondContact O-CB 3.15Å; L543-R546 PolarHBondContact O-N 3.1Å; L543-R546 VanDerWaalsContact O-N 3.15Å; H544-R546 VanDerWaalsContact C-N 3.28Å; H544-R546 PolarHBondContact O-N 2.85Å; R546-R550 WeakPolarHBondContact O-CB 3.5Å; R546-R550 PolarHBondContact O-N 3.41Å
547	V	90.2	Very high	85.9	Confident	50 Å²	50	94.7 Å²	94.7	30%	0.303	43%	0.428	S	S	.	.	H	α-helix	trans	-63.8	-43.5	172.8	173	0	0	0	0	110.8	L500 V504 L543 H544 R550 L551	L500-V547 HydrophobicContact CD1-CG2 4.45Å; L500-V547 HydrophobicContact CD2-CG2 3.86Å; L500-V547 HydrophobicContact CG-CG2 4.19Å; V504-V547 HydrophobicContact CG2-CG2 4.46Å; L543-V547 WeakPolarHBondContact O-CG2 3.08Å; L543-V547 PolarHBondContact O-N 3.15Å; H544-V547 PolarHBondContact O-N 3.4Å; V547-R550 WeakPolarHBondContact O-CB 3.47Å; V547-R550 PolarHBondContact O-N 2.93Å; V547-L551 HydrophobicContact CG1-CD1 4.05Å; V547-L551 HydrophobicContact CG1-CG 4.39Å; V547-L551 WeakPolarHBondContact O-CG 3.41Å; V547-L551 PolarHBondContact O-N 2.91Å
548	Q	90.4	Very high	83.8	Confident	86 Å²	86	94.1 Å²	94.1	40%	0.402	42%	0.423	S	S	.	.	H	α-helix	trans	-60.7	-50.2	176.6	-76.5	-177.2	-35.1	0	0	112.5	H544 R545 R550 L551 E552	H544-Q548 VanDerWaalsContact NE2-CD 3.32Å; H544-Q548 PolarHBondContact NE2-NE2 3.32Å; H544-Q548 WeakPolarHBondContact O-CG 3.48Å; H544-Q548 PolarHBondContact O-N 3.23Å; R545-Q548 PolarHBondContact O-N 3.18Å; Q548-R550 PolarHBondContact O-N 3.16Å; Q548-L551 PolarHBondContact O-N 2.93Å; Q548-L551 VanDerWaalsContact O-N 3.14Å; Q548-E552 WeakPolarHBondContact O-CG 3.32Å; Q548-E552 PolarHBondContact O-N 3.05Å
549	Q	88.4	Confident	81.7	Confident	121 Å²	121	94.3 Å²	94.3	57%	0.565	44%	0.444	S	S	*	.	H	α-helix	trans	-56.2	-40.9	175	-74.2	174.2	-14	0	0	111	R545 E552 T553	R545-Q549 WeakPolarHBondContact O-CG 3.48Å; R545-Q549 PolarHBondContact O-N 3.22Å; Q549-E552 PolarHBondContact O-N 2.97Å; Q549-T553 WeakPolarHBondContact O-CG2 3.44Å; Q549-T553 PolarHBondContact O-N 3.45Å
550	R	83.7	Confident	79.6	Confident	46 Å²	46	95.3 Å²	95.3	17%	0.174	46%	0.457	C	S	.	.	H	α-helix	trans	-64.4	-46.7	177.2	-174.7	52.6	173.9	154.6	-2.1	111.7	S493 D497 R546 V547 Q548 E552 T553 L554	S493-R550 PolarHBondContact OG-NH2 2.97Å; D497-R550 IonicContact OD1-CZ 2.9Å; D497-R550 IonicContact OD1-NE 3.78Å; D497-R550 PolarHBondContact OD1-NE 3.43Å; D497-R550 IonicContact OD1-NH2 2.92Å; D497-R550 PolarHBondContact OD1-NH2 3Å; D497-R550 IonicContact OD2-CZ 3.53Å; D497-R550 IonicContact OD2-NE 3.72Å; D497-R550 PolarHBondContact OD2-NE 2.88Å; D497-R550 IonicContact OD2-NH2 3.87Å; D497-R550 PolarHBondContact OD2-NH2 3.31Å; R546-R550 WeakPolarHBondContact O-CB 3.5Å; R546-R550 PolarHBondContact O-N 3.41Å; V547-R550 WeakPolarHBondContact O-CB 3.47Å; V547-R550 PolarHBondContact O-N 2.93Å; Q548-R550 PolarHBondContact O-N 3.16Å; R550-E552 VanDerWaalsContact C-N 3.31Å; R550-E552 PolarHBondContact O-N 3.42Å; R550-T553 PolarHBondContact NH1-OG1 3.24Å; R550-T553 PolarHBondContact O-N 3.37Å; R550-T553 PolarHBondContact O-OG1 3.37Å; R550-L554 HydrophobicContact CG-CD1 4.33Å; R550-L554 WeakPolarHBondContact O-CG 3.23Å; R550-L554 PolarHBondContact O-N 3.04Å
551	L	83.4	Confident	77.5	Confident	60 Å²	60	101.2 Å²	101.2	31%	0.314	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-40.4	175.4	-71.4	171.8	0	0	0	111.9	V547 Q548 L554 R555 W566	V547-L551 HydrophobicContact CG1-CD1 4.05Å; V547-L551 HydrophobicContact CG1-CG 4.39Å; V547-L551 WeakPolarHBondContact O-CG 3.41Å; V547-L551 PolarHBondContact O-N 2.91Å; Q548-L551 PolarHBondContact O-N 2.93Å; Q548-L551 VanDerWaalsContact O-N 3.14Å; L551-L554 PolarHBondContact O-N 3.46Å; L551-R555 WeakPolarHBondContact O-CG 3.45Å; L551-R555 PolarHBondContact O-N 3.12Å; L551-W566 HydrophobicContact CD2-CH2 4.28Å; L551-W566 HydrophobicContact CD2-CZ2 4.14Å
552	E	82.2	Confident	75.6	Confident	105 Å²	105	101 Å²	101	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-60.5	-48.4	173.7	-74	171	-176.7	0	0	111.2	Q548 Q549 R550 L554 R555 Y556	Q548-E552 WeakPolarHBondContact O-CG 3.32Å; Q548-E552 PolarHBondContact O-N 3.05Å; Q549-E552 PolarHBondContact O-N 2.97Å; R550-E552 VanDerWaalsContact C-N 3.31Å; R550-E552 PolarHBondContact O-N 3.42Å; E552-L554 VanDerWaalsContact C-N 3.32Å; E552-L554 PolarHBondContact O-N 3.34Å; E552-R555 WeakPolarHBondContact O-CB 3.33Å; E552-R555 PolarHBondContact O-N 2.89Å; E552-R555 VanDerWaalsContact O-N 3.1Å; E552-Y556 WeakPolarHBondContact O-CD2 3.26Å; E552-Y556 PolarHBondContact O-N 2.86Å; E552-Y556 VanDerWaalsContact O-N 3.14Å
553	T	79.4	Confident	73.3	Confident	57 Å²	57	104 Å²	104	35%	0.35	49%	0.49	S	S	.	.	H	α-helix	trans	-58.1	-45.5	175.9	62.3	0	0	0	0	111.3	Q549 R550 R555 Y556 F557	Q549-T553 WeakPolarHBondContact O-CG2 3.44Å; Q549-T553 PolarHBondContact O-N 3.45Å; R550-T553 PolarHBondContact NH1-OG1 3.24Å; R550-T553 PolarHBondContact O-N 3.37Å; R550-T553 PolarHBondContact O-OG1 3.37Å; T553-R555 VanDerWaalsContact C-N 3.28Å; T553-R555 PolarHBondContact O-N 3.2Å; T553-Y556 PolarHBondContact O-N 3.44Å; T553-Y556 VanDerWaalsContact O-N 3.13Å; T553-F557 WeakPolarHBondContact O-CD2 3.44Å; T553-F557 PolarHBondContact O-N 3.18Å
554	L	74.1	Confident	71	Confident	37 Å²	37	110.7 Å²	110.7	19%	0.194	53%	0.525	C	S	.	.	H	α-helix	trans	-63.2	-33.1	178.2	-69.3	173.8	0	0	0	112.3	R550 L551 E552 F557	R550-L554 HydrophobicContact CG-CD1 4.33Å; R550-L554 WeakPolarHBondContact O-CG 3.23Å; R550-L554 PolarHBondContact O-N 3.04Å; L551-L554 PolarHBondContact O-N 3.46Å; E552-L554 VanDerWaalsContact C-N 3.32Å; E552-L554 PolarHBondContact O-N 3.34Å; L554-F557 PolarHBondContact O-N 3.22Å
555	R	71.1	Confident	68.7	Low	154 Å²	154	111.8 Å²	111.8	58%	0.581	53%	0.534	S	S	*	.	H	α-helix	trans	-63.6	-40.8	173.1	-73.4	-174.3	-143.6	-169.1	5.8	112.6	L551 E552 T553 F557 H558	L551-R555 WeakPolarHBondContact O-CG 3.45Å; L551-R555 PolarHBondContact O-N 3.12Å; E552-R555 WeakPolarHBondContact O-CB 3.33Å; E552-R555 PolarHBondContact O-N 2.89Å; E552-R555 VanDerWaalsContact O-N 3.1Å; T553-R555 VanDerWaalsContact C-N 3.28Å; T553-R555 PolarHBondContact O-N 3.2Å; R555-F557 PolarHBondContact O-N 3.38Å; R555-H558 VanDerWaalsContact CA-CD2 3.45Å; R555-H558 WeakPolarHBondContact CA-CD2 3.46Å; R555-H558 WeakPolarHBondContact CA-NE2 3.43Å; R555-H558 WeakPolarHBondContact O-CB 3.43Å; R555-H558 PolarHBondContact O-CD2 3.22Å; R555-H558 PolarHBondContact O-N 3.15Å
556	Y	68.7	Low	65.9	Low	205 Å²	205	114.4 Å²	114.4	80%	0.804	54%	0.544	S	S	*	.	H	α-helix	trans	-65.2	-25.2	176.2	-74.3	-72.8	0	0	0	112.6	E552 T553	E552-Y556 WeakPolarHBondContact O-CD2 3.26Å; E552-Y556 PolarHBondContact O-N 2.86Å; E552-Y556 VanDerWaalsContact O-N 3.14Å; T553-Y556 PolarHBondContact O-N 3.44Å; T553-Y556 VanDerWaalsContact O-N 3.13Å
557	F	63.6	Low	64.6	Low	127 Å²	127	112.6 Å²	112.6	56%	0.557	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	13.5	178.6	-69.7	-69.8	0	0	0	114.9	T553 L554 R555 G559 S560	T553-F557 WeakPolarHBondContact O-CD2 3.44Å; T553-F557 PolarHBondContact O-N 3.18Å; L554-F557 PolarHBondContact O-N 3.22Å; R555-F557 PolarHBondContact O-N 3.38Å; F557-G559 PolarHBondContact O-N 3.45Å; F557-S560 PolarHBondContact O-N 3.11Å; F557-S560 VanDerWaalsContact O-N 3.08Å
558	H	48.9	Very low	63.2	Low	114 Å²	114	115.9 Å²	115.9	53%	0.528	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.2	0.3	-178	-79.7	-43.4	0	0	0	116.6	R555	R555-H558 VanDerWaalsContact CA-CD2 3.45Å; R555-H558 WeakPolarHBondContact CA-CD2 3.46Å; R555-H558 WeakPolarHBondContact CA-NE2 3.43Å; R555-H558 WeakPolarHBondContact O-CB 3.43Å; R555-H558 PolarHBondContact O-CD2 3.22Å; R555-H558 PolarHBondContact O-N 3.15Å
559	G	49.1	Very low	61.7	Low	83 Å²	83	117.6 Å²	117.6	86%	0.856	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-11.3	172.6	0	0	0	0	0	116.5	F557	F557-G559 PolarHBondContact O-N 3.45Å
560	S	49.4	Very low	60.1	Low	79 Å²	79	117.4 Å²	117.4	55%	0.552	56%	0.564	S	S	*	*	S	Bend	trans	-122.4	97.1	-170.9	-149.3	0	0	0	0	111.5	F557 R562	F557-S560 PolarHBondContact O-N 3.11Å; F557-S560 VanDerWaalsContact O-N 3.08Å; S560-R562 PolarHBondContact O-N 2.97Å
561	N	49.3	Very low	58.7	Low	164 Å²	164	121.8 Å²	121.8	88%	0.877	59%	0.588	S	S	*	*	S	Bend	trans	37.7	7.5	165	-91.2	0.6	0	0	0	121.3	R563	N561-R563 PolarHBondContact O-N 3.02Å
562	R	51.4	Low	57	Low	63 Å²	63	125.9 Å²	125.9	24%	0.238	61%	0.607	C	S	.	*	G	3₁₀ helix	trans	-94.2	16.1	-176.4	-74.1	-177.1	174.5	-136.5	-6.8	113.6	S493 S560 D564	S493-R562 PolarHBondContact OG-NH2 3.4Å; S560-R562 PolarHBondContact O-N 2.97Å; R562-D564 PolarHBondContact O-N 3.18Å
563	R	46.4	Very low	55.2	Low	209 Å²	209	127.4 Å²	127.4	79%	0.789	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-62.1	-30.8	173.2	-79.5	-172.4	-174.7	-176.6	2.3	111.8	N561 L565	N561-R563 PolarHBondContact O-N 3.02Å; R563-L565 VanDerWaalsContact C-N 3.34Å; R563-L565 PolarHBondContact O-N 2.87Å
564	D	42.4	Very low	53.3	Low	152 Å²	152	132.8 Å²	132.8	81%	0.813	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-82.4	-7.9	-174.1	-59.2	-17.6	0	0	0	114.3	R562	R562-D564 PolarHBondContact O-N 3.18Å
565	L	45	Very low	51.6	Low	127 Å²	127	140.8 Å²	140.8	67%	0.665	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-94.1	-9.2	178.5	-106.5	153.8	0	0	0	113.4	R563	R563-L565 VanDerWaalsContact C-N 3.34Å; R563-L565 PolarHBondContact O-N 2.87Å
566	W	34.1	Very low	49.8	Very low	213 Å²	213	139.6 Å²	139.6	81%	0.807	68%	0.68	S	S	*	*			trans	-76.3	0	167.3	-95.4	87.5	0	0	0	109.9	L551	L551-W566 HydrophobicContact CD2-CH2 4.28Å; L551-W566 HydrophobicContact CD2-CZ2 4.14Å

Retrieved 566 of 566 residues in 146.9 ms (Link to these results)

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