A0A096LWF4_POEFO Loading...

Syntaxin binding protein 4

AlphaFold DB , UniProt , Accession A0A096LWF4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 704 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	33.1	Very low	32.4	Very low	224 Å²	224	173.5 Å²	173.5	100%	1.103	87%	0.871	S	S	*	*				0	112.3	0	-69.5	-59.6	-170.9	0	0	107.9
2	P	34.1	Very low	33.1	Very low	127 Å²	127	166.9 Å²	166.9	83%	0.825	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-77.6	138.5	172.6	31.5	-27.5	0	0	0	109.8
3	F	29	Very low	33.6	Very low	207 Å²	207	158.5 Å²	158.5	91%	0.908	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-61.8	129	179.5	-85.7	-106.1	0	0	0	111.6
4	L	25.5	Very low	34.2	Very low	166 Å²	166	156.6 Å²	156.6	87%	0.869	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-75.1	133	163.6	-83.8	156.1	0	0	0	109.1
5	P	32	Very low	34.8	Very low	120 Å²	120	150.5 Å²	150.5	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-75.3	142.3	170.6	-1.9	17.7	0	0	0	111.2
6	Q	29.5	Very low	35.6	Very low	195 Å²	195	145 Å²	145	91%	0.911	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-55.9	157.7	173.1	-115.1	163	-20.7	0	0	113.4
7	E	26.4	Very low	36.2	Very low	176 Å²	176	141.4 Å²	141.4	82%	0.822	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-46	154.3	-174.7	-60.3	-156.8	152.9	0	0	117	E9	E7-E9 PolarHBondContact O-N 3.18Å
8	P	33.9	Very low	36.3	Very low	124 Å²	124	141.6 Å²	141.6	81%	0.805	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-64	125	178.2	27.1	-34.4	0	0	0	110.8	R10	P8-R10 PolarHBondContact O-N 3.24Å
9	E	33.5	Very low	36.6	Very low	185 Å²	185	141.1 Å²	141.1	86%	0.864	72%	0.719	S	S	*	*			trans	-52.3	115.8	175.7	-67.5	-153.5	162.2	0	0	111	E7 L11	E7-E9 PolarHBondContact O-N 3.18Å; E9-L11 PolarHBondContact O-N 2.88Å
10	R	37	Very low	36.9	Very low	220 Å²	220	135.4 Å²	135.4	83%	0.83	69%	0.691	S	S	*	*			trans	-63.9	100.3	169.1	-169.7	177.8	-172.2	165.9	-0.7	106.9	P8 D12	P8-R10 PolarHBondContact O-N 3.24Å; R10-D12 VanDerWaalsContact C-N 3.33Å; R10-D12 PolarHBondContact O-N 3.37Å
11	L	42.6	Very low	37.1	Very low	165 Å²	165	134.7 Å²	134.7	86%	0.864	69%	0.688	S	S	*	*			trans	-56	98.7	167.3	-85.3	151.1	0	0	0	108.4	E9 G13	E9-L11 PolarHBondContact O-N 2.88Å; L11-G13 PolarHBondContact O-N 3Å
12	D	40.7	Very low	37.9	Very low	94 Å²	94	125.6 Å²	125.6	50%	0.503	64%	0.643	S	S	.	*			trans	-60.2	129.9	-179.8	-88.3	-21.2	0	0	0	109.8	R10 L14 S15 L16	R10-D12 VanDerWaalsContact C-N 3.33Å; R10-D12 PolarHBondContact O-N 3.37Å; D12-L14 HydrophobicContact CB-CB 4.49Å; D12-L14 PolarHBondContact O-N 2.96Å; D12-S15 WeakPolarHBondContact O-CA 3.32Å; D12-S15 WeakPolarHBondContact O-CB 3.43Å; D12-S15 PolarHBondContact O-N 3.4Å; D12-L16 PolarHBondContact O-N 3.17Å
13	G	39.9	Very low	38.2	Very low	57 Å²	57	121 Å²	121	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-56.9	-17.7	175	0	0	0	0	0	113.1	L11 L17	L11-G13 PolarHBondContact O-N 3Å; G13-L17 VanDerWaalsContact O-CB 3.27Å; G13-L17 WeakPolarHBondContact O-CB 3.28Å; G13-L17 PolarHBondContact O-N 3.3Å
14	L	41.7	Very low	39.1	Very low	133 Å²	133	115.1 Å²	115.1	70%	0.696	60%	0.601	S	S	*	*	H	α-helix	trans	-69.7	-39.1	170.1	-66.9	172.5	0	0	0	112.6	D12 L17 Y18	D12-L14 HydrophobicContact CB-CB 4.49Å; D12-L14 PolarHBondContact O-N 2.96Å; L14-L17 PolarHBondContact O-N 3Å; L14-Y18 WeakPolarHBondContact O-CB 3.45Å; L14-Y18 PolarHBondContact O-N 3.42Å
15	S	43.7	Very low	40.3	Very low	64 Å²	64	109 Å²	109	45%	0.448	57%	0.568	S	S	.	*	H	α-helix	trans	-66.7	-37.7	173.1	-83.6	0	0	0	0	111.5	D12 W19	D12-S15 WeakPolarHBondContact O-CA 3.32Å; D12-S15 WeakPolarHBondContact O-CB 3.43Å; D12-S15 PolarHBondContact O-N 3.4Å; S15-W19 VanDerWaalsContact O-CB 3.31Å; S15-W19 WeakPolarHBondContact O-CB 3.49Å; S15-W19 PolarHBondContact O-N 2.99Å
16	L	47.4	Very low	40.8	Very low	63 Å²	63	104.8 Å²	104.8	33%	0.33	55%	0.546	S	S	.	.	H	α-helix	trans	-71.3	-37.7	176.2	-163.9	69.9	0	0	0	111.9	D12 W19 T20	D12-L16 PolarHBondContact O-N 3.17Å; L16-W19 PolarHBondContact O-N 2.87Å; L16-T20 WeakPolarHBondContact O-CB 3.4Å; L16-T20 PolarHBondContact O-N 2.87Å; L16-T20 PolarHBondContact O-OG1 3.24Å
17	L	45.2	Very low	41.4	Very low	84 Å²	84	101 Å²	101	44%	0.44	53%	0.53	S	S	.	.	H	α-helix	trans	-69.8	-38.4	175.3	-165.7	72.4	0	0	0	111.6	G13 L14 T20 I21	G13-L17 VanDerWaalsContact O-CB 3.27Å; G13-L17 WeakPolarHBondContact O-CB 3.28Å; G13-L17 PolarHBondContact O-N 3.3Å; L14-L17 PolarHBondContact O-N 3Å; L17-T20 PolarHBondContact O-N 3.32Å; L17-I21 HydrophobicContact CD1-CD1 4.2Å; L17-I21 HydrophobicContact CD2-CD1 4.4Å; L17-I21 HydrophobicContact CG-CD1 3.82Å; L17-I21 HydrophobicContact CG-CG1 4.49Å; L17-I21 WeakPolarHBondContact O-CB 3.44Å; L17-I21 VanDerWaalsContact O-CG1 3.26Å; L17-I21 WeakPolarHBondContact O-CG1 3.44Å; L17-I21 PolarHBondContact O-N 3.5Å
18	Y	38	Very low	42.2	Very low	144 Å²	144	99 Å²	99	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-60.5	-53.8	169.1	-170.4	-103.4	0	0	0	109.6	L14 T20 I21 M22	L14-Y18 WeakPolarHBondContact O-CB 3.45Å; L14-Y18 PolarHBondContact O-N 3.42Å; Y18-T20 VanDerWaalsContact C-N 3.26Å; Y18-T20 PolarHBondContact O-N 2.88Å; Y18-T20 VanDerWaalsContact O-N 3.16Å; Y18-I21 PolarHBondContact O-N 2.94Å; Y18-M22 HydrophobicContact CD1-CG 4.42Å; Y18-M22 HydrophobicContact CD2-CE 4.08Å; Y18-M22 HydrophobicContact CD2-CG 4.04Å; Y18-M22 HydrophobicContact CD2-SD 4.02Å; Y18-M22 HydrophobicContact CE1-CE 4.2Å; Y18-M22 HydrophobicContact CE2-CE 3.4Å; Y18-M22 HydrophobicContact CE2-CG 4.28Å; Y18-M22 HydrophobicContact CE2-SD 3.91Å; Y18-M22 HydrophobicContact CG-CG 4.11Å; Y18-M22 VanDerWaalsContact CZ-CE 3.48Å; Y18-M22 WeakPolarHBondContact O-CB 3.49Å; Y18-M22 WeakPolarHBondContact O-CG 3.49Å; Y18-M22 PolarHBondContact O-N 3.35Å
19	W	42.4	Very low	43.2	Very low	133 Å²	133	96.2 Å²	96.2	50%	0.504	50%	0.499	S	S	.	.	H	α-helix	trans	-58.1	-33.6	175.6	-90	69.1	0	0	0	114.6	S15 L16 G23 P24 I208	S15-W19 VanDerWaalsContact O-CB 3.31Å; S15-W19 WeakPolarHBondContact O-CB 3.49Å; S15-W19 PolarHBondContact O-N 2.99Å; L16-W19 PolarHBondContact O-N 2.87Å; W19-G23 CarbonylContact O-C 3.59Å; W19-G23 WeakPolarHBondContact O-CA 3.3Å; W19-G23 PolarHBondContact O-N 3.42Å; W19-P24 HydrophobicContact CZ3-CB 4.01Å; W19-I208 HydrophobicContact CE3-CD1 4.16Å
20	T	43.3	Very low	44.7	Very low	26 Å²	26	90.4 Å²	90.4	16%	0.16	48%	0.483	C	S	.	.	H	α-helix	trans	-80.8	-36.4	-176.9	-57.4	0	0	0	0	113.2	L16 L17 Y18 M22 S265 I267	L16-T20 WeakPolarHBondContact O-CB 3.4Å; L16-T20 PolarHBondContact O-N 2.87Å; L16-T20 PolarHBondContact O-OG1 3.24Å; L17-T20 PolarHBondContact O-N 3.32Å; Y18-T20 VanDerWaalsContact C-N 3.26Å; Y18-T20 PolarHBondContact O-N 2.88Å; Y18-T20 VanDerWaalsContact O-N 3.16Å; T20-M22 VanDerWaalsContact C-N 3.33Å; T20-S265 WeakPolarHBondContact CG2-OG 3.44Å; T20-I267 HydrophobicContact CG2-CB 3.86Å; T20-I267 HydrophobicContact CG2-CG1 3.57Å; T20-I267 WeakPolarHBondContact OG1-CG1 3.47Å
21	I	40.7	Very low	46.6	Very low	122 Å²	122	82.3 Å²	82.3	63%	0.626	46%	0.458	S	S	*	.	H	α-helix	trans	-76.3	-27.3	175.6	-65	171.6	0	0	0	110.5	L17 Y18	L17-I21 HydrophobicContact CD1-CD1 4.2Å; L17-I21 HydrophobicContact CD2-CD1 4.4Å; L17-I21 HydrophobicContact CG-CD1 3.82Å; L17-I21 HydrophobicContact CG-CG1 4.49Å; L17-I21 WeakPolarHBondContact O-CB 3.44Å; L17-I21 VanDerWaalsContact O-CG1 3.26Å; L17-I21 WeakPolarHBondContact O-CG1 3.44Å; L17-I21 PolarHBondContact O-N 3.5Å; Y18-I21 PolarHBondContact O-N 2.94Å
22	M	49.9	Very low	48.6	Very low	33 Å²	33	78.2 Å²	78.2	16%	0.163	43%	0.434	C	S	.	.	H	α-helix	trans	-107.2	-6.4	-167.5	-39.7	-95.1	-64.4	0	0	113.9	Y18 T20 G26 I27	Y18-M22 HydrophobicContact CD1-CG 4.42Å; Y18-M22 HydrophobicContact CD2-CE 4.08Å; Y18-M22 HydrophobicContact CD2-CG 4.04Å; Y18-M22 HydrophobicContact CD2-SD 4.02Å; Y18-M22 HydrophobicContact CE1-CE 4.2Å; Y18-M22 HydrophobicContact CE2-CE 3.4Å; Y18-M22 HydrophobicContact CE2-CG 4.28Å; Y18-M22 HydrophobicContact CE2-SD 3.91Å; Y18-M22 HydrophobicContact CG-CG 4.11Å; Y18-M22 VanDerWaalsContact CZ-CE 3.48Å; Y18-M22 WeakPolarHBondContact O-CB 3.49Å; Y18-M22 WeakPolarHBondContact O-CG 3.49Å; Y18-M22 PolarHBondContact O-N 3.35Å; T20-M22 VanDerWaalsContact C-N 3.33Å; M22-G26 CarbonylContact O-C 3.46Å; M22-G26 WeakPolarHBondContact O-CA 3.47Å; M22-G26 PolarHBondContact O-N 3.49Å; M22-I27 HydrophobicContact CB-CG1 4.49Å; M22-I27 HydrophobicContact CE-CB 3.46Å; M22-I27 VanDerWaalsContact CE-CB 3.46Å; M22-I27 HydrophobicContact CE-CD1 3.57Å; M22-I27 HydrophobicContact CE-CG1 3.43Å; M22-I27 VanDerWaalsContact CE-CG1 3.43Å; M22-I27 HydrophobicContact CG-CG1 4.4Å; M22-I27 HydrophobicContact SD-CB 4.03Å; M22-I27 HydrophobicContact SD-CD1 3.04Å; M22-I27 WeakPolarHBondContact SD-CD1 3.34Å; M22-I27 HydrophobicContact SD-CG1 3.25Å; M22-I27 WeakPolarHBondContact SD-CG1 3.37Å
23	G	39.8	Very low	50.9	Low	31 Å²	31	79.1 Å²	79.1	32%	0.32	43%	0.431	S	S	.	.			trans	66	173.2	-171.3	0	0	0	0	0	112.9	W19 H25 G26	W19-G23 CarbonylContact O-C 3.59Å; W19-G23 WeakPolarHBondContact O-CA 3.3Å; W19-G23 PolarHBondContact O-N 3.42Å; G23-H25 PolarHBondContact O-N 2.95Å; G23-G26 PolarHBondContact O-N 3.15Å
24	P	48.2	Very low	53.3	Low	83 Å²	83	76.4 Å²	76.4	54%	0.539	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	1.4	177.8	26.3	-34	0	0	0	114.1	W19	W19-P24 HydrophobicContact CZ3-CB 4.01Å
25	H	50.2	Low	55.7	Low	38 Å²	38	75.2 Å²	75.2	18%	0.176	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	3.1	-173.1	-52.8	-39.5	0	0	0	114.7	G23 R29 V31 L116	G23-H25 PolarHBondContact O-N 2.95Å; H25-R29 HydrophobicContact CB-CB 4.15Å; H25-R29 WeakPolarHBondContact O-CB 3.41Å; H25-R29 VanDerWaalsContact O-CD 3.3Å; H25-R29 WeakPolarHBondContact O-CD 3.47Å; H25-R29 WeakPolarHBondContact O-CG 3.28Å; H25-V31 HydrophobicContact CB-CG2 3.86Å; H25-L116 WeakPolarHBondContact NE2-CD2 3.39Å
26	G	43.6	Very low	57.9	Low	30 Å²	30	72.4 Å²	72.4	31%	0.309	37%	0.373	S	S	.	.			trans	73.5	162.8	171.7	0	0	0	0	0	115.9	M22 G23 N28	M22-G26 CarbonylContact O-C 3.46Å; M22-G26 WeakPolarHBondContact O-CA 3.47Å; M22-G26 PolarHBondContact O-N 3.49Å; G23-G26 PolarHBondContact O-N 3.15Å; G26-N28 PolarHBondContact O-N 2.78Å; G26-N28 VanDerWaalsContact O-N 3.07Å
27	I	41.2	Very low	59.8	Low	115 Å²	115	73.3 Å²	73.3	59%	0.59	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-13.1	-171.2	-91	174.8	0	0	0	114.8	M22	M22-I27 HydrophobicContact CB-CG1 4.49Å; M22-I27 HydrophobicContact CE-CB 3.46Å; M22-I27 VanDerWaalsContact CE-CB 3.46Å; M22-I27 HydrophobicContact CE-CD1 3.57Å; M22-I27 HydrophobicContact CE-CG1 3.43Å; M22-I27 VanDerWaalsContact CE-CG1 3.43Å; M22-I27 HydrophobicContact CG-CG1 4.4Å; M22-I27 HydrophobicContact SD-CB 4.03Å; M22-I27 HydrophobicContact SD-CD1 3.04Å; M22-I27 WeakPolarHBondContact SD-CD1 3.34Å; M22-I27 HydrophobicContact SD-CG1 3.25Å; M22-I27 WeakPolarHBondContact SD-CG1 3.37Å
28	N	44	Very low	61.8	Low	136 Å²	136	74.6 Å²	74.6	73%	0.727	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126	4.3	-173.1	-79	-61.2	0	0	0	114.8	G26 A30 D120	G26-N28 PolarHBondContact O-N 2.78Å; G26-N28 VanDerWaalsContact O-N 3.07Å; N28-A30 PolarHBondContact O-N 2.84Å; N28-A30 VanDerWaalsContact O-N 3.12Å; N28-D120 WeakPolarHBondContact O-CB 3.47Å
29	R	54.8	Low	64	Low	64 Å²	64	67.8 Å²	67.8	24%	0.242	37%	0.365	C	S	.	.			trans	-78.6	104	172.7	-66.4	-161.4	167.2	-177.3	-2.1	109.1	H25 V31 A118 D120 E122	H25-R29 HydrophobicContact CB-CB 4.15Å; H25-R29 WeakPolarHBondContact O-CB 3.41Å; H25-R29 VanDerWaalsContact O-CD 3.3Å; H25-R29 WeakPolarHBondContact O-CD 3.47Å; H25-R29 WeakPolarHBondContact O-CG 3.28Å; R29-V31 HydrophobicContact CB-CG2 3.68Å; R29-V31 WeakPolarHBondContact O-CG2 3.48Å; R29-V31 PolarHBondContact O-N 2.98Å; R29-A118 HydrophobicContact CB-CB 4.34Å; R29-D120 HydrophobicContact CG-CB 4.12Å; R29-D120 VanDerWaalsContact CG-OD1 3.3Å; R29-D120 WeakPolarHBondContact CG-OD1 3.39Å; R29-D120 IonicContact NE-OD1 2.65Å; R29-D120 IonicContact NE-OD2 2.94Å; R29-E122 IonicContact CZ-OE2 3.55Å; R29-E122 IonicContact NE-OE2 3.12Å; R29-E122 IonicContact NH2-OE2 2.74Å; R29-E122 PolarHBondContact NH2-OE2 2.96Å
30	A	63.5	Low	65.8	Low	63 Å²	63	68.4 Å²	68.4	52%	0.521	37%	0.372	S	S	.	.			trans	-64.1	82.6	165.2	0	0	0	0	0	108.1	N28 R119	N28-A30 PolarHBondContact O-N 2.84Å; N28-A30 VanDerWaalsContact O-N 3.12Å; A30-R119 PolarHBondContact O-N 2.88Å; A30-R119 VanDerWaalsContact O-N 3.12Å
31	V	78.1	Confident	67.7	Low	51 Å²	51	77.4 Å²	77.4	31%	0.309	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	126.8	-178.8	-175	0	0	0	0	109.2	H25 R29 L85 L116 V117 A118	H25-V31 HydrophobicContact CB-CG2 3.86Å; R29-V31 HydrophobicContact CB-CG2 3.68Å; R29-V31 WeakPolarHBondContact O-CG2 3.48Å; R29-V31 PolarHBondContact O-N 2.98Å; V31-L85 HydrophobicContact CG1-CD1 4.01Å; V31-L85 HydrophobicContact CG2-CD1 3.98Å; V31-L116 HydrophobicContact CG1-CD1 3.34Å; V31-L116 HydrophobicContact CG1-CD2 4.1Å; V31-L116 HydrophobicContact CG1-CG 3.46Å; V31-L116 VanDerWaalsContact CG1-CG 3.46Å; V31-V117 CarbonylContact C-O 3.42Å; V31-V117 VanDerWaalsContact CA-O 3.22Å; V31-V117 WeakPolarHBondContact CA-O 3.31Å; V31-A118 HydrophobicContact CG2-CB 4.23Å
32	Q	84.1	Confident	69.8	Low	79 Å²	79	72.6 Å²	72.6	37%	0.369	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.7	179.7	-174.1	172.4	28.2	0	0	109.7	L34 V117 R119	Q32-L34 HydrophobicContact CG-CD2 3.89Å; Q32-L34 HydrophobicContact CG-CG 4.26Å; Q32-V117 PolarHBondContact N-O 3.3Å; Q32-V117 PolarHBondContact O-N 2.88Å; Q32-R119 VanDerWaalsContact OE1-NH1 3.16Å
33	R	88.8	Confident	71.8	Confident	113 Å²	113	71.5 Å²	71.5	43%	0.426	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.5	169.8	-163.1	171.9	-172.4	108.1	-0.2	109.6	N89 S114 L115 L116	R33-N89 PolarHBondContact NH2-OD1 3.47Å; R33-S114 PolarHBondContact NE-OG 3.17Å; R33-S114 PolarHBondContact NH2-OG 3.4Å; R33-L115 CarbonylContact C-O 3.57Å; R33-L115 VanDerWaalsContact CA-O 3.31Å; R33-L115 WeakPolarHBondContact CA-O 3.3Å; R33-L116 HydrophobicContact CB-CD1 4.25Å
34	L	90.9	Very high	74.3	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.5	-179.2	-62.3	175.5	0	0	0	109.7	Q32 F36 R77 L78 S114 L115 V117	Q32-L34 HydrophobicContact CG-CD2 3.89Å; Q32-L34 HydrophobicContact CG-CG 4.26Å; L34-F36 HydrophobicContact CB-CD2 4.49Å; L34-F36 HydrophobicContact CB-CE2 3.63Å; L34-F36 HydrophobicContact CB-CZ 4.13Å; L34-F36 HydrophobicContact CD1-CE2 4.5Å; L34-F36 HydrophobicContact CD1-CZ 4.43Å; L34-R77 HydrophobicContact CD1-CB 4.49Å; L34-R77 HydrophobicContact CD2-CB 3.88Å; L34-L78 HydrophobicContact CD1-CB 4.42Å; L34-L78 HydrophobicContact CD1-CD1 3.6Å; L34-S114 CarbonylContact O-C 3.57Å; L34-S114 WeakPolarHBondContact O-CA 3.16Å; L34-L115 PolarHBondContact N-O 2.86Å; L34-L115 PolarHBondContact O-N 2.92Å; L34-V117 HydrophobicContact CD1-CG2 4.29Å
35	E	92.1	Very high	76.5	Confident	108 Å²	108	68.4 Å²	68.4	51%	0.505	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	132.5	177	-67.4	-178.7	-175.3	0	0	110.5	R77 M113	E35-R77 PolarHBondContact O-NH2 2.89Å; E35-M113 CarbonylContact C-O 3.59Å; E35-M113 WeakPolarHBondContact CA-O 3.43Å
36	F	90.3	Very high	78.6	Confident	5 Å²	5	71.2 Å²	71.2	2%	0.022	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	137	178.1	-61.7	-86.8	0	0	0	109.4	L34 C39 L43 L71 D75 L78 H112 M113 L115	L34-F36 HydrophobicContact CB-CD2 4.49Å; L34-F36 HydrophobicContact CB-CE2 3.63Å; L34-F36 HydrophobicContact CB-CZ 4.13Å; L34-F36 HydrophobicContact CD1-CE2 4.5Å; L34-F36 HydrophobicContact CD1-CZ 4.43Å; F36-C39 VanDerWaalsContact CB-SG 3.6Å; F36-L43 HydrophobicContact CB-CD1 4.15Å; F36-L43 HydrophobicContact CD1-CD1 3.61Å; F36-L43 HydrophobicContact CD2-CD1 3.76Å; F36-L43 HydrophobicContact CE1-CD1 3.88Å; F36-L43 HydrophobicContact CE2-CD1 4.02Å; F36-L43 HydrophobicContact CG-CD1 3.54Å; F36-L43 HydrophobicContact CZ-CD1 4.08Å; F36-L71 HydrophobicContact CB-CD2 4.3Å; F36-D75 HydrophobicContact CD1-CB 4.42Å; F36-D75 HydrophobicContact CE1-CB 3.87Å; F36-L78 HydrophobicContact CZ-CB 4.3Å; F36-L78 HydrophobicContact CZ-CD2 4.43Å; F36-H112 WeakPolarHBondContact O-CA 3.42Å; F36-M113 PolarHBondContact N-O 3.09Å; F36-M113 PolarHBondContact O-N 2.8Å; F36-L115 HydrophobicContact CD2-CD1 4.27Å; F36-L115 HydrophobicContact CD2-CG 4.45Å; F36-L115 HydrophobicContact CE2-CD1 3.82Å; F36-L115 HydrophobicContact CE2-CG 4.31Å
37	S	87.8	Confident	81	Confident	82 Å²	82	71 Å²	71	57%	0.573	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.7	156.8	173.6	-60.1	0	0	0	0	109.4	N111	S37-N111 CarbonylContact C-O 3.55Å; S37-N111 WeakPolarHBondContact CA-O 3.42Å
38	D	85.8	Confident	83.5	Confident	111 Å²	111	66.4 Å²	66.4	59%	0.594	34%	0.341	S	S	*	.			trans	65.1	40	-174	-162.5	28.4	0	0	0	114.3	K40 N111	D38-K40 PolarHBondContact O-N 2.96Å; D38-N111 PolarHBondContact N-O 3.3Å
39	C	84.9	Confident	85.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-74.6	12.3	-179.5	-58.7	0	0	0	0	114.6	F36 K41 G42 S108 N111	F36-C39 VanDerWaalsContact CB-SG 3.6Å; C39-K41 PolarHBondContact O-N 2.97Å; C39-K41 VanDerWaalsContact O-N 3.1Å; C39-G42 WeakPolarHBondContact O-CA 3.36Å; C39-G42 PolarHBondContact O-N 2.94Å; C39-S108 WeakPolarHBondContact O-CB 3.42Å; C39-N111 PolarHBondContact N-O 3.3Å
40	K	80.7	Confident	87.6	Confident	147 Å²	147	57.9 Å²	57.9	64%	0.639	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-54.8	-34.3	-174.4	-72.2	-178.5	-178.8	175.7	0	114	D38 G42 N111	D38-K40 PolarHBondContact O-N 2.96Å; K40-G42 VanDerWaalsContact C-N 3.31Å; K40-N111 WeakPolarHBondContact CD-OD1 3.45Å; K40-N111 WeakPolarHBondContact CE-OD1 2.87Å; K40-N111 WeakPolarHBondContact CG-OD1 3.4Å
41	K	81.9	Confident	88.8	Confident	214 Å²	214	59.2 Å²	59.2	93%	0.93	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-92.7	8.8	179.8	-63	179.3	-178.9	174	0	112.6	C39	C39-K41 PolarHBondContact O-N 2.97Å; C39-K41 VanDerWaalsContact O-N 3.1Å
42	G	86.3	Confident	89.1	Confident	22 Å²	22	62 Å²	62	23%	0.227	30%	0.302	C	S	.	.			trans	80.4	168.9	-172.4	0	0	0	0	0	113.1	C39 K40	C39-G42 WeakPolarHBondContact O-CA 3.36Å; C39-G42 PolarHBondContact O-N 2.94Å; K40-G42 VanDerWaalsContact C-N 3.31Å
43	L	90.6	Very high	88.8	Confident	10 Å²	10	65.4 Å²	65.4	5%	0.052	32%	0.318	C	S	.	.			trans	-75.8	-23.1	-177.9	-170.8	68.7	0	0	0	113.1	F36 V45 L71 A72 L78 M113 L115	F36-L43 HydrophobicContact CB-CD1 4.15Å; F36-L43 HydrophobicContact CD1-CD1 3.61Å; F36-L43 HydrophobicContact CD2-CD1 3.76Å; F36-L43 HydrophobicContact CE1-CD1 3.88Å; F36-L43 HydrophobicContact CE2-CD1 4.02Å; F36-L43 HydrophobicContact CG-CD1 3.54Å; F36-L43 HydrophobicContact CZ-CD1 4.08Å; L43-V45 HydrophobicContact CB-CG2 4.36Å; L43-V45 HydrophobicContact CD2-CG1 3.83Å; L43-V45 HydrophobicContact CD2-CG2 3.9Å; L43-V45 HydrophobicContact CG-CG1 4.13Å; L43-V45 HydrophobicContact CG-CG2 4.46Å; L43-L71 HydrophobicContact CD1-CD2 4.5Å; L43-L71 PolarHBondContact O-N 3.41Å; L43-A72 HydrophobicContact CD1-CB 4.15Å; L43-A72 HydrophobicContact CD2-CB 4.46Å; L43-A72 HydrophobicContact CG-CB 3.87Å; L43-A72 VanDerWaalsContact O-CB 3.31Å; L43-A72 WeakPolarHBondContact O-CB 3.35Å; L43-A72 PolarHBondContact O-N 2.9Å; L43-L78 HydrophobicContact CD2-CD2 3.54Å; L43-L78 HydrophobicContact CG-CD2 4.36Å; L43-M113 HydrophobicContact CB-CE 3.72Å; L43-M113 HydrophobicContact CD1-CE 3.81Å; L43-M113 HydrophobicContact CD2-CE 3.54Å; L43-M113 HydrophobicContact CG-CE 3.86Å; L43-L115 HydrophobicContact CD2-CD1 3.64Å
44	G	92.3	Very high	88.1	Confident	19 Å²	19	67.8 Å²	67.8	20%	0.196	34%	0.338	C	S	.	.			trans	77.1	41.9	-176.3	0	0	0	0	0	113.4	I67	G44-I67 VanDerWaalsContact O-CB 3.27Å; G44-I67 WeakPolarHBondContact O-CB 3.36Å; G44-I67 WeakPolarHBondContact O-CG1 3.33Å; G44-I67 PolarHBondContact O-N 2.94Å
45	V	94.6	Very high	87.5	Confident	29 Å²	29	71.3 Å²	71.3	18%	0.176	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	152.7	174.9	-64.1	0	0	0	0	111.2	L43 I47 I63 A72 L78	L43-V45 HydrophobicContact CB-CG2 4.36Å; L43-V45 HydrophobicContact CD2-CG1 3.83Å; L43-V45 HydrophobicContact CD2-CG2 3.9Å; L43-V45 HydrophobicContact CG-CG1 4.13Å; L43-V45 HydrophobicContact CG-CG2 4.46Å; V45-I47 HydrophobicContact CG2-CG2 4.44Å; V45-I63 HydrophobicContact CB-CG2 4.43Å; V45-I63 HydrophobicContact CG1-CD1 4.4Å; V45-I63 HydrophobicContact CG1-CG2 4.44Å; V45-A72 HydrophobicContact CG1-CB 3.82Å; V45-L78 HydrophobicContact CG1-CD2 3.6Å
46	K	94	Very high	86.8	Confident	97 Å²	97	68.6 Å²	68.6	42%	0.422	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133	161.6	-67.5	-161.8	173.6	-171.4	0	108.7	I63 K64 R65 I67	K46-I63 CarbonylContact O-C 3.54Å; K46-K64 HydrophobicContact CB-CB 4.32Å; K46-K64 WeakPolarHBondContact O-CB 3.21Å; K46-K64 PolarHBondContact O-N 3.39Å; K46-R65 HydrophobicContact CB-CG 3.8Å; K46-R65 HydrophobicContact CD-CG 4.02Å; K46-R65 HydrophobicContact CG-CG 3.94Å; K46-R65 PolarHBondContact N-O 3.48Å; K46-R65 PolarHBondContact O-N 3.43Å; K46-I67 HydrophobicContact CG-CD1 4.37Å
47	I	95.1	Very high	86.4	Confident	26 Å²	26	70.7 Å²	70.7	13%	0.133	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	161.8	175.9	62.7	164.6	0	0	0	111.6	V45 I61 Y62 I84 A100 V101 L104	V45-I47 HydrophobicContact CG2-CG2 4.44Å; I47-I61 HydrophobicContact CB-CG2 4.12Å; I47-I61 HydrophobicContact CD1-CG2 3.81Å; I47-I61 HydrophobicContact CG2-CG2 4.26Å; I47-Y62 CarbonylContact C-O 3.53Å; I47-Y62 WeakPolarHBondContact CA-O 3.36Å; I47-Y62 WeakPolarHBondContact CB-O 3.3Å; I47-I84 HydrophobicContact CG2-CD1 4.08Å; I47-A100 HydrophobicContact CD1-CB 3.86Å; I47-V101 HydrophobicContact CD1-CG2 3.78Å; I47-V101 HydrophobicContact CG1-CG2 4.12Å; I47-L104 HydrophobicContact CD1-CD1 4Å; I47-L104 HydrophobicContact CG2-CD1 3.93Å
48	I	93.6	Very high	86.3	Confident	19 Å²	19	71.5 Å²	71.5	10%	0.097	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	158.9	173.9	-160	177.9	0	0	0	109.4	Y62 K64 F127 L130 M131	I48-Y62 PolarHBondContact N-O 3.43Å; I48-Y62 PolarHBondContact O-N 2.73Å; I48-K64 HydrophobicContact CB-CB 4.05Å; I48-K64 HydrophobicContact CB-CD 4.33Å; I48-K64 HydrophobicContact CD1-CD 4.17Å; I48-K64 HydrophobicContact CG2-CB 3.84Å; I48-K64 HydrophobicContact CG2-CG 4.49Å; I48-F127 HydrophobicContact CG2-CE2 4.25Å; I48-L130 HydrophobicContact CB-CD2 3.94Å; I48-L130 HydrophobicContact CD1-CD2 3.37Å; I48-L130 HydrophobicContact CG1-CD2 3.33Å; I48-L130 HydrophobicContact CG2-CD2 3.64Å; I48-M131 HydrophobicContact CB-CE 4.45Å; I48-M131 HydrophobicContact CD1-CE 3.26Å; I48-M131 HydrophobicContact CG1-CE 4.38Å; I48-M131 HydrophobicContact CG2-CE 3.85Å
49	G	93.3	Very high	86.4	Confident	14 Å²	14	67.3 Å²	67.3	14%	0.144	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	94.6	-157.3	-175.2	0	0	0	0	0	112.1	G60 N97	G49-G60 WeakPolarHBondContact CA-O 2.79Å; G49-N97 VanDerWaalsContact O-CB 3.26Å; G49-N97 WeakPolarHBondContact O-CB 3.36Å; G49-N97 PolarHBondContact O-ND2 3.31Å
50	G	91	Very high	86.6	Confident	7 Å²	7	68.2 Å²	68.2	7%	0.072	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	99.6	162.4	-171.1	0	0	0	0	0	112.7	F59 G60 I61 V95	G50-F59 CarbonylContact C-O 3.58Å; G50-F59 VanDerWaalsContact C-O 3.32Å; G50-F59 WeakPolarHBondContact CA-O 3.32Å; G50-F59 PolarHBondContact N-O 3.34Å; G50-G60 PolarHBondContact N-O 2.95Å; G50-I61 VanDerWaalsContact CA-CD1 3.41Å; G50-V95 CarbonylContact C-O 3.46Å; G50-V95 WeakPolarHBondContact CA-O 2.98Å
51	Y	88.4	Confident	87.3	Confident	90 Å²	90	61.3 Å²	61.3	35%	0.353	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	133.9	178.6	178.6	-110.1	0	0	0	111.6	E53 D58 G94 V95 T96	Y51-E53 HydrophobicContact CD1-CG 4.12Å; Y51-E53 HydrophobicContact CE1-CB 4.43Å; Y51-E53 HydrophobicContact CE1-CG 3.66Å; Y51-D58 HydrophobicContact CD2-CB 4.08Å; Y51-G94 WeakPolarHBondContact CB-O 3.41Å; Y51-V95 PolarHBondContact N-O 3.27Å; Y51-T96 HydrophobicContact CD1-CG2 4.31Å
52	R	84.8	Confident	88	Confident	111 Å²	111	51.1 Å²	51.1	42%	0.419	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	104.5	178.6	-173.6	177.3	-64.5	-85.6	0.2	110.9	L54 T55 G56 E57	R52-L54 PolarHBondContact O-N 3.31Å; R52-T55 WeakPolarHBondContact CD-OG1 3.4Å; R52-T55 HydrophobicContact CG-CG2 4.41Å; R52-T55 WeakPolarHBondContact CG-OG1 3.35Å; R52-T55 PolarHBondContact O-N 3.48Å; R52-G56 WeakPolarHBondContact O-CA 3.14Å; R52-G56 PolarHBondContact O-N 2.99Å; R52-E57 PolarHBondContact N-O 3.21Å
53	E	77.9	Confident	88.4	Confident	150 Å²	150	50 Å²	50	70%	0.701	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-35.3	-180	-68.5	174.2	-171	0	0	113.8	Y51	Y51-E53 HydrophobicContact CD1-CG 4.12Å; Y51-E53 HydrophobicContact CE1-CB 4.43Å; Y51-E53 HydrophobicContact CE1-CG 3.66Å
54	L	74.9	Confident	88.5	Confident	162 Å²	162	52.8 Å²	52.8	85%	0.848	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-26.1	-175.9	-65.5	172.6	0	0	0	114.1	R52	R52-L54 PolarHBondContact O-N 3.31Å
55	T	77.4	Confident	88.6	Confident	74 Å²	74	57.7 Å²	57.7	45%	0.454	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-11.5	-176.7	59.2	0	0	0	0	112.7	R52 E57	R52-T55 WeakPolarHBondContact CD-OG1 3.4Å; R52-T55 HydrophobicContact CG-CG2 4.41Å; R52-T55 WeakPolarHBondContact CG-OG1 3.35Å; R52-T55 PolarHBondContact O-N 3.48Å; T55-E57 PolarHBondContact O-N 3Å; T55-E57 WeakPolarHBondContact OG1-CB 3.44Å; T55-E57 WeakPolarHBondContact OG1-CG 3.49Å; T55-E57 PolarHBondContact OG1-N 3.14Å
56	G	77.2	Confident	88.6	Confident	51 Å²	51	58 Å²	58	53%	0.526	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	70	12.9	-173.7	0	0	0	0	0	113.7	R52	R52-G56 WeakPolarHBondContact O-CA 3.14Å; R52-G56 PolarHBondContact O-N 2.99Å
57	E	82.4	Confident	88.5	Confident	50 Å²	50	56.5 Å²	56.5	23%	0.234	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	124.6	-178.7	-66.2	174.2	-175.8	0	0	110	R52 T55 F59 K133 Y134	R52-E57 PolarHBondContact N-O 3.21Å; T55-E57 PolarHBondContact O-N 3Å; T55-E57 WeakPolarHBondContact OG1-CB 3.44Å; T55-E57 WeakPolarHBondContact OG1-CG 3.49Å; T55-E57 PolarHBondContact OG1-N 3.14Å; E57-F59 HydrophobicContact CB-CD2 4.11Å; E57-F59 HydrophobicContact CB-CE2 3.93Å; E57-F59 HydrophobicContact CG-CE2 4.45Å; E57-F59 WeakPolarHBondContact OE2-CE2 3.45Å; E57-K133 IonicContact OE1-NZ 3.62Å; E57-K133 PolarHBondContact OE1-NZ 3.13Å; E57-K133 IonicContact OE2-NZ 3.88Å; E57-K133 PolarHBondContact OE2-NZ 2.91Å; E57-Y134 PolarHBondContact OE2-OH 3.13Å
58	D	84.4	Confident	88.3	Confident	98 Å²	98	59.8 Å²	59.8	52%	0.524	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	93.3	178.5	-169.8	13.7	0	0	0	109.8	Y51	Y51-D58 HydrophobicContact CD2-CB 4.08Å
59	F	87.8	Confident	88	Confident	24 Å²	24	62 Å²	62	11%	0.105	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	143.5	172.1	-71.4	-76.1	0	0	0	110	G50 E57 L130 Y134	G50-F59 CarbonylContact C-O 3.58Å; G50-F59 VanDerWaalsContact C-O 3.32Å; G50-F59 WeakPolarHBondContact CA-O 3.32Å; G50-F59 PolarHBondContact N-O 3.34Å; E57-F59 HydrophobicContact CB-CD2 4.11Å; E57-F59 HydrophobicContact CB-CE2 3.93Å; E57-F59 HydrophobicContact CG-CE2 4.45Å; E57-F59 WeakPolarHBondContact OE2-CE2 3.45Å; F59-L130 HydrophobicContact CB-CD1 3.39Å; F59-L130 HydrophobicContact CD1-CD1 3.63Å; F59-L130 HydrophobicContact CD1-CG 4.37Å; F59-L130 HydrophobicContact CD2-CD1 4.14Å; F59-L130 HydrophobicContact CE1-CD1 4.4Å; F59-L130 HydrophobicContact CG-CD1 3.46Å; F59-L130 VanDerWaalsContact CG-CD1 3.46Å; F59-L130 HydrophobicContact CG-CG 4.34Å; F59-Y134 HydrophobicContact CE2-CE2 4.19Å
60	G	90.9	Very high	87.8	Confident	19 Å²	19	62 Å²	62	20%	0.196	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	167.5	169.9	0	0	0	0	0	113.9	G49 G50 Y62	G49-G60 WeakPolarHBondContact CA-O 2.79Å; G50-G60 PolarHBondContact N-O 2.95Å; G60-Y62 WeakPolarHBondContact O-CD2 3.49Å; G60-Y62 WeakPolarHBondContact O-CE2 3.31Å
61	I	95.3	Very high	87.8	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	105.4	175.4	-59.4	-64	0	0	0	110	I47 G50 I84 L92 A100	I47-I61 HydrophobicContact CB-CG2 4.12Å; I47-I61 HydrophobicContact CD1-CG2 3.81Å; I47-I61 HydrophobicContact CG2-CG2 4.26Å; G50-I61 VanDerWaalsContact CA-CD1 3.41Å; I61-I84 PolarHBondContact O-N 3.41Å; I61-L92 HydrophobicContact CB-CB 4.44Å; I61-L92 HydrophobicContact CB-CD1 4.23Å; I61-L92 HydrophobicContact CG1-CB 4.05Å; I61-L92 HydrophobicContact CG1-CD1 4.36Å; I61-L92 HydrophobicContact CG2-CD1 4.13Å; I61-A100 HydrophobicContact CD1-CB 3.53Å; I61-A100 HydrophobicContact CG1-CB 3.78Å; I61-A100 HydrophobicContact CG2-CB 4.14Å
62	Y	95.2	Very high	88	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	152	-177.2	-64.1	-90	0	0	0	113.2	I47 I48 G60 K64 D82 L83 S123 E126 F127 L130	I47-Y62 CarbonylContact C-O 3.53Å; I47-Y62 WeakPolarHBondContact CA-O 3.36Å; I47-Y62 WeakPolarHBondContact CB-O 3.3Å; I48-Y62 PolarHBondContact N-O 3.43Å; I48-Y62 PolarHBondContact O-N 2.73Å; G60-Y62 WeakPolarHBondContact O-CD2 3.49Å; G60-Y62 WeakPolarHBondContact O-CE2 3.31Å; Y62-K64 PolarHBondContact O-N 3.4Å; Y62-D82 CarbonylContact C-O 3.55Å; Y62-D82 WeakPolarHBondContact CA-O 3.49Å; Y62-L83 HydrophobicContact CD1-CB 3.97Å; Y62-L83 HydrophobicContact CD1-CD1 4.27Å; Y62-L83 HydrophobicContact CD2-CD1 4.47Å; Y62-L83 HydrophobicContact CE1-CB 3.69Å; Y62-L83 HydrophobicContact CE1-CD1 3.94Å; Y62-L83 HydrophobicContact CE1-CG 4.23Å; Y62-L83 HydrophobicContact CE2-CD1 4.13Å; Y62-S123 VanDerWaalsContact CE1-O 3.27Å; Y62-S123 WeakPolarHBondContact CE1-O 3.49Å; Y62-E126 HydrophobicContact CE2-CB 4.48Å; Y62-E126 WeakPolarHBondContact OH-CB 3.35Å; Y62-E126 PolarHBondContact OH-OE2 3.09Å; Y62-F127 HydrophobicContact CD1-CB 3.86Å; Y62-F127 HydrophobicContact CD1-CD2 4.06Å; Y62-F127 HydrophobicContact CD1-CG 4.35Å; Y62-F127 HydrophobicContact CE1-CB 4.1Å; Y62-F127 HydrophobicContact CG-CB 4.32Å; Y62-F127 AromaticContact CG-CD2 3.89Å; Y62-F127 HydrophobicContact CG-CD2 3.89Å; Y62-L130 HydrophobicContact CD2-CD1 4.13Å; Y62-L130 HydrophobicContact CE2-CD1 4.37Å
63	I	95	Very high	88.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	104.8	169.3	-59.8	-174.2	0	0	0	109.6	V45 K46 V66 L78 K79 S80 G81 D82 I84	V45-I63 HydrophobicContact CB-CG2 4.43Å; V45-I63 HydrophobicContact CG1-CD1 4.4Å; V45-I63 HydrophobicContact CG1-CG2 4.44Å; K46-I63 CarbonylContact O-C 3.54Å; I63-V66 HydrophobicContact CG2-CG2 4.16Å; I63-L78 HydrophobicContact CD1-CD1 3.43Å; I63-L78 VanDerWaalsContact CD1-CD1 3.43Å; I63-L78 HydrophobicContact CD1-CD2 3.42Å; I63-L78 VanDerWaalsContact CD1-CD2 3.42Å; I63-L78 HydrophobicContact CD1-CG 3.27Å; I63-K79 WeakPolarHBondContact CB-O 3.44Å; I63-S80 CarbonylContact O-C 3.53Å; I63-S80 WeakPolarHBondContact O-CA 3.43Å; I63-G81 PolarHBondContact O-N 2.95Å; I63-D82 HydrophobicContact CB-CB 4.36Å; I63-D82 HydrophobicContact CD1-CB 3.94Å; I63-D82 HydrophobicContact CG1-CB 4.2Å; I63-D82 PolarHBondContact N-O 3.38Å; I63-I84 HydrophobicContact CD1-CD1 4.17Å; I63-I84 HydrophobicContact CD1-CG1 4.27Å; I63-I84 HydrophobicContact CG1-CD1 3.87Å; I63-I84 HydrophobicContact CG1-CG1 4.01Å
64	K	94.1	Very high	89	Confident	68 Å²	68	55.5 Å²	55.5	30%	0.296	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	-47.8	172.7	-177.4	167.3	-169.4	166	0	111.7	K46 I48 Y62 M131 G135	K46-K64 HydrophobicContact CB-CB 4.32Å; K46-K64 WeakPolarHBondContact O-CB 3.21Å; K46-K64 PolarHBondContact O-N 3.39Å; I48-K64 HydrophobicContact CB-CB 4.05Å; I48-K64 HydrophobicContact CB-CD 4.33Å; I48-K64 HydrophobicContact CD1-CD 4.17Å; I48-K64 HydrophobicContact CG2-CB 3.84Å; I48-K64 HydrophobicContact CG2-CG 4.49Å; Y62-K64 PolarHBondContact O-N 3.4Å; K64-M131 HydrophobicContact CD-CE 3.93Å; K64-M131 HydrophobicContact CG-CE 3.89Å; K64-M131 HydrophobicContact CG-SD 4.18Å; K64-G135 PolarHBondContact NZ-O 3.45Å
65	R	93.3	Very high	89.7	Confident	121 Å²	121	50.7 Å²	50.7	46%	0.457	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	150.3	177	65.5	174.6	-149.1	-173	8.6	112.8	K46 S80	K46-R65 HydrophobicContact CB-CG 3.8Å; K46-R65 HydrophobicContact CD-CG 4.02Å; K46-R65 HydrophobicContact CG-CG 3.94Å; K46-R65 PolarHBondContact N-O 3.48Å; K46-R65 PolarHBondContact O-N 3.43Å; R65-S80 WeakPolarHBondContact CA-OG 3.39Å
66	V	94.5	Very high	90.3	Very high	36 Å²	36	49.2 Å²	49.2	22%	0.218	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.9	167	-171.2	0	0	0	0	109.1	I63 A72 A73	I63-V66 HydrophobicContact CG2-CG2 4.16Å; V66-A72 HydrophobicContact CG1-CB 3.82Å; V66-A73 HydrophobicContact CG1-CB 3.85Å
67	I	92.8	Very high	91	Very high	65 Å²	65	51.5 Å²	51.5	33%	0.333	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-84.8	123.7	-177.2	-57	174.4	0	0	0	108.9	G44 K46 G69 G70 A73	G44-I67 VanDerWaalsContact O-CB 3.27Å; G44-I67 WeakPolarHBondContact O-CB 3.36Å; G44-I67 WeakPolarHBondContact O-CG1 3.33Å; G44-I67 PolarHBondContact O-N 2.94Å; K46-I67 HydrophobicContact CG-CD1 4.37Å; I67-G69 PolarHBondContact O-N 3.23Å; I67-G70 PolarHBondContact O-N 3.23Å; I67-A73 VanDerWaalsContact O-CB 3.28Å; I67-A73 WeakPolarHBondContact O-CB 3.38Å
68	A	90.4	Very high	91.5	Very high	96 Å²	96	49.4 Å²	49.4	79%	0.793	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	133.7	176.9	0	0	0	0	0	111.5	G70	A68-G70 PolarHBondContact O-N 3.38Å
69	G	87.2	Confident	91.8	Very high	65 Å²	65	50.4 Å²	50.4	67%	0.67	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	-2.1	-175.4	0	0	0	0	0	115.2	I67	I67-G69 PolarHBondContact O-N 3.23Å
70	G	89.8	Confident	92.1	Very high	15 Å²	15	52.6 Å²	52.6	16%	0.155	31%	0.313	C	S	.	.	S	Bend	trans	-78.8	163.7	171.2	0	0	0	0	0	112.8	I67 A68 A72 A73 L74	I67-G70 PolarHBondContact O-N 3.23Å; A68-G70 PolarHBondContact O-N 3.38Å; G70-A72 VanDerWaalsContact C-N 3.33Å; G70-A72 PolarHBondContact O-N 3.35Å; G70-A73 WeakPolarHBondContact O-CA 3.44Å; G70-A73 WeakPolarHBondContact O-CB 3.41Å; G70-A73 PolarHBondContact O-N 3.06Å; G70-L74 WeakPolarHBondContact O-CG 3.49Å; G70-L74 PolarHBondContact O-N 3.06Å
71	L	91	Very high	92.1	Very high	45 Å²	45	52.2 Å²	52.2	24%	0.236	31%	0.31	C	S	.	.	H	α-helix	trans	-56.5	-43.4	-176.3	-172	65.7	0	0	0	112.8	F36 L43 A73 L74 D75	F36-L71 HydrophobicContact CB-CD2 4.3Å; L43-L71 HydrophobicContact CD1-CD2 4.5Å; L43-L71 PolarHBondContact O-N 3.41Å; L71-A73 VanDerWaalsContact C-N 3.31Å; L71-A73 PolarHBondContact O-N 3.33Å; L71-L74 PolarHBondContact O-N 3.28Å; L71-D75 WeakPolarHBondContact O-CB 3.5Å; L71-D75 PolarHBondContact O-N 3.24Å
72	A	92.5	Very high	92	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.8	-31.4	175.1	0	0	0	0	0	113.7	L43 V45 V66 G70 G76 L78	L43-A72 HydrophobicContact CD1-CB 4.15Å; L43-A72 HydrophobicContact CD2-CB 4.46Å; L43-A72 HydrophobicContact CG-CB 3.87Å; L43-A72 VanDerWaalsContact O-CB 3.31Å; L43-A72 WeakPolarHBondContact O-CB 3.35Å; L43-A72 PolarHBondContact O-N 2.9Å; V45-A72 HydrophobicContact CG1-CB 3.82Å; V66-A72 HydrophobicContact CG1-CB 3.82Å; G70-A72 VanDerWaalsContact C-N 3.33Å; G70-A72 PolarHBondContact O-N 3.35Å; A72-G76 PolarHBondContact O-N 2.94Å; A72-L78 HydrophobicContact CB-CB 4.2Å; A72-L78 HydrophobicContact CB-CD2 3.82Å
73	A	92.1	Very high	91.9	Very high	41 Å²	41	52.8 Å²	52.8	34%	0.339	31%	0.313	S	S	.	.	H	α-helix	trans	-73.4	-37.5	175.8	0	0	0	0	0	111.8	V66 I67 G70 L71	V66-A73 HydrophobicContact CG1-CB 3.85Å; I67-A73 VanDerWaalsContact O-CB 3.28Å; I67-A73 WeakPolarHBondContact O-CB 3.38Å; G70-A73 WeakPolarHBondContact O-CA 3.44Å; G70-A73 WeakPolarHBondContact O-CB 3.41Å; G70-A73 PolarHBondContact O-N 3.06Å; L71-A73 VanDerWaalsContact C-N 3.31Å; L71-A73 PolarHBondContact O-N 3.33Å
74	L	90.5	Very high	91.9	Very high	135 Å²	135	52.9 Å²	52.9	71%	0.707	31%	0.313	S	S	*	.	H	α-helix	trans	-67.7	-40.8	177	-66.9	173.8	0	0	0	111.8	G70 L71	G70-L74 WeakPolarHBondContact O-CG 3.49Å; G70-L74 PolarHBondContact O-N 3.06Å; L71-L74 PolarHBondContact O-N 3.28Å
75	D	91.1	Very high	91.8	Very high	60 Å²	60	49.8 Å²	49.8	32%	0.321	30%	0.3	S	S	.	.	H	α-helix	trans	-72.7	-34.7	176.5	179.9	-89.8	0	0	0	112.2	F36 L71 R77	F36-D75 HydrophobicContact CD1-CB 4.42Å; F36-D75 HydrophobicContact CE1-CB 3.87Å; L71-D75 WeakPolarHBondContact O-CB 3.5Å; L71-D75 PolarHBondContact O-N 3.24Å; D75-R77 PolarHBondContact O-N 2.97Å; D75-R77 WeakPolarHBondContact OD1-CB 3.26Å; D75-R77 VanDerWaalsContact OD1-CG 3.25Å; D75-R77 WeakPolarHBondContact OD1-CG 3.28Å; D75-R77 IonicContact OD1-CZ 2.61Å; D75-R77 PolarHBondContact OD1-N 3.36Å; D75-R77 IonicContact OD1-NE 2.81Å; D75-R77 PolarHBondContact OD1-NE 2.86Å; D75-R77 IonicContact OD1-NH2 3.53Å; D75-R77 PolarHBondContact OD1-NH2 3.01Å; D75-R77 IonicContact OD2-CZ 2.7Å; D75-R77 IonicContact OD2-NE 2.75Å; D75-R77 PolarHBondContact OD2-NE 3.39Å; D75-R77 VanDerWaalsContact OD2-NE 3.17Å; D75-R77 IonicContact OD2-NH2 3.39Å; D75-R77 PolarHBondContact OD2-NH2 3.06Å
76	G	89.6	Confident	91.7	Very high	43 Å²	43	45.6 Å²	45.6	44%	0.443	29%	0.287	S	S	.	.			trans	71.9	-6.6	171.5	0	0	0	0	0	115.6	A72	A72-G76 PolarHBondContact O-N 2.94Å
77	R	91.7	Very high	91.7	Very high	99 Å²	99	43.9 Å²	43.9	37%	0.374	28%	0.276	S	S	.	.			trans	-74.6	-27.4	178.2	-63.3	-179	-70.5	169.5	-3	112.8	L34 E35 D75 R119	L34-R77 HydrophobicContact CD1-CB 4.49Å; L34-R77 HydrophobicContact CD2-CB 3.88Å; E35-R77 PolarHBondContact O-NH2 2.89Å; D75-R77 PolarHBondContact O-N 2.97Å; D75-R77 WeakPolarHBondContact OD1-CB 3.26Å; D75-R77 VanDerWaalsContact OD1-CG 3.25Å; D75-R77 WeakPolarHBondContact OD1-CG 3.28Å; D75-R77 IonicContact OD1-CZ 2.61Å; D75-R77 PolarHBondContact OD1-N 3.36Å; D75-R77 IonicContact OD1-NE 2.81Å; D75-R77 PolarHBondContact OD1-NE 2.86Å; D75-R77 IonicContact OD1-NH2 3.53Å; D75-R77 PolarHBondContact OD1-NH2 3.01Å; D75-R77 IonicContact OD2-CZ 2.7Å; D75-R77 IonicContact OD2-NE 2.75Å; D75-R77 PolarHBondContact OD2-NE 3.39Å; D75-R77 VanDerWaalsContact OD2-NE 3.17Å; D75-R77 IonicContact OD2-NH2 3.39Å; D75-R77 PolarHBondContact OD2-NH2 3.06Å; R77-R119 PolarHBondContact O-NH2 2.88Å
78	L	92.7	Very high	91.5	Very high	6 Å²	6	42.9 Å²	42.9	3%	0.031	27%	0.271	C	S	.	.			trans	-92.8	135.9	-177.8	-162.2	68.9	0	0	0	111	L34 F36 L43 V45 I63 A72 L115 V117	L34-L78 HydrophobicContact CD1-CB 4.42Å; L34-L78 HydrophobicContact CD1-CD1 3.6Å; F36-L78 HydrophobicContact CZ-CB 4.3Å; F36-L78 HydrophobicContact CZ-CD2 4.43Å; L43-L78 HydrophobicContact CD2-CD2 3.54Å; L43-L78 HydrophobicContact CG-CD2 4.36Å; V45-L78 HydrophobicContact CG1-CD2 3.6Å; I63-L78 HydrophobicContact CD1-CD1 3.43Å; I63-L78 VanDerWaalsContact CD1-CD1 3.43Å; I63-L78 HydrophobicContact CD1-CD2 3.42Å; I63-L78 VanDerWaalsContact CD1-CD2 3.42Å; I63-L78 HydrophobicContact CD1-CG 3.27Å; A72-L78 HydrophobicContact CB-CB 4.2Å; A72-L78 HydrophobicContact CB-CD2 3.82Å; L78-L115 HydrophobicContact CD1-CD1 4.42Å; L78-L115 HydrophobicContact CD2-CD1 4.24Å; L78-V117 HydrophobicContact CD1-CG2 3.98Å
79	K	91.2	Very high	91.1	Very high	120 Å²	120	43.8 Å²	43.8	52%	0.522	26%	0.263	S	S	.	.			trans	-130.5	159.9	-171.6	-63.6	-178.2	-178.6	-179.9	0	112	I63 D82	I63-K79 WeakPolarHBondContact CB-O 3.44Å; K79-D82 PolarHBondContact N-OD2 2.82Å; K79-D82 VanDerWaalsContact O-CB 3.25Å; K79-D82 WeakPolarHBondContact O-CB 3.41Å; K79-D82 PolarHBondContact O-N 3.1Å
80	S	92.8	Very high	91.1	Very high	69 Å²	69	45 Å²	45	48%	0.483	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	141.3	169.2	-51.6	0	0	0	0	110.2	I63 R65 D82	I63-S80 CarbonylContact O-C 3.53Å; I63-S80 WeakPolarHBondContact O-CA 3.43Å; R65-S80 WeakPolarHBondContact CA-OG 3.39Å; S80-D82 VanDerWaalsContact C-N 3.31Å
81	G	91.4	Very high	91	Very high	12 Å²	12	46.9 Å²	46.9	12%	0.124	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-5.1	-175.5	0	0	0	0	0	114.7	I63 L83	I63-G81 PolarHBondContact O-N 2.95Å; G81-L83 PolarHBondContact O-N 3Å
82	D	93.5	Very high	90.9	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.032	25%	0.254	C	S	.	.			trans	-65.4	128.3	173.1	-79	0.2	0	0	0	110.7	Y62 I63 K79 S80 V117 R119	Y62-D82 CarbonylContact C-O 3.55Å; Y62-D82 WeakPolarHBondContact CA-O 3.49Å; I63-D82 HydrophobicContact CB-CB 4.36Å; I63-D82 HydrophobicContact CD1-CB 3.94Å; I63-D82 HydrophobicContact CG1-CB 4.2Å; I63-D82 PolarHBondContact N-O 3.38Å; K79-D82 PolarHBondContact N-OD2 2.82Å; K79-D82 VanDerWaalsContact O-CB 3.25Å; K79-D82 WeakPolarHBondContact O-CB 3.41Å; K79-D82 PolarHBondContact O-N 3.1Å; S80-D82 VanDerWaalsContact C-N 3.31Å; D82-V117 HydrophobicContact CB-CG1 3.49Å; D82-V117 VanDerWaalsContact CB-CG1 3.49Å; D82-R119 WeakPolarHBondContact OD1-CG 3.01Å; D82-R119 IonicContact OD1-CZ 2.72Å; D82-R119 IonicContact OD1-NE 2.85Å; D82-R119 PolarHBondContact OD1-NE 3.04Å; D82-R119 IonicContact OD1-NH2 3.49Å; D82-R119 PolarHBondContact OD1-NH2 3.49Å; D82-R119 IonicContact OD2-CZ 2.8Å; D82-R119 IonicContact OD2-NE 3.34Å; D82-R119 IonicContact OD2-NH2 3.4Å; D82-R119 PolarHBondContact OD2-NH2 3.32Å
83	L	93.7	Very high	90.6	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.037	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.5	173.2	172.3	59.3	0	0	0	109.6	Y62 G81 L85 V117 A118 S123	Y62-L83 HydrophobicContact CD1-CB 3.97Å; Y62-L83 HydrophobicContact CD1-CD1 4.27Å; Y62-L83 HydrophobicContact CD2-CD1 4.47Å; Y62-L83 HydrophobicContact CE1-CB 3.69Å; Y62-L83 HydrophobicContact CE1-CD1 3.94Å; Y62-L83 HydrophobicContact CE1-CG 4.23Å; Y62-L83 HydrophobicContact CE2-CD1 4.13Å; G81-L83 PolarHBondContact O-N 3Å; L83-L85 HydrophobicContact CD2-CD2 3.8Å; L83-L85 HydrophobicContact CG-CD2 3.99Å; L83-L85 HydrophobicContact CG-CG 4.49Å; L83-V117 CarbonylContact O-C 3.55Å; L83-V117 WeakPolarHBondContact O-CA 3.41Å; L83-A118 HydrophobicContact CB-CB 4.3Å; L83-A118 HydrophobicContact CD2-CB 4.37Å; L83-A118 PolarHBondContact N-O 2.73Å; L83-A118 PolarHBondContact O-N 2.84Å; L83-S123 WeakPolarHBondContact CD2-OG 3.48Å
84	I	94.3	Very high	90.2	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	113.6	175.1	-48.5	177	0	0	0	108.4	I47 I61 I63 V87 L92 L115	I47-I84 HydrophobicContact CG2-CD1 4.08Å; I61-I84 PolarHBondContact O-N 3.41Å; I63-I84 HydrophobicContact CD1-CD1 4.17Å; I63-I84 HydrophobicContact CD1-CG1 4.27Å; I63-I84 HydrophobicContact CG1-CD1 3.87Å; I63-I84 HydrophobicContact CG1-CG1 4.01Å; I84-V87 HydrophobicContact CG2-CG2 3.99Å; I84-L92 HydrophobicContact CB-CD1 4.07Å; I84-L92 HydrophobicContact CG2-CD1 3.66Å; I84-L115 HydrophobicContact CG2-CD2 4.32Å
85	L	91.7	Very high	90.1	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-52	177.3	-62	171.1	0	0	0	110.3	V31 L83 L92 L116 A118	V31-L85 HydrophobicContact CG1-CD1 4.01Å; V31-L85 HydrophobicContact CG2-CD1 3.98Å; L83-L85 HydrophobicContact CD2-CD2 3.8Å; L83-L85 HydrophobicContact CG-CD2 3.99Å; L83-L85 HydrophobicContact CG-CG 4.49Å; L85-L92 WeakPolarHBondContact O-CB 3.46Å; L85-L92 PolarHBondContact O-N 2.94Å; L85-L116 HydrophobicContact CB-CB 4.3Å; L85-L116 HydrophobicContact CB-CD2 4.21Å; L85-L116 HydrophobicContact CB-CG 4.32Å; L85-L116 HydrophobicContact CD1-CD2 4.27Å; L85-L116 HydrophobicContact CD1-CG 4.3Å; L85-L116 PolarHBondContact N-O 3.47Å; L85-A118 HydrophobicContact CD1-CB 3.92Å; L85-A118 HydrophobicContact CG-CB 4.32Å
86	D	92.3	Very high	90.1	Very high	33 Å²	33	42.9 Å²	42.9	18%	0.176	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	153.5	-176.5	-61.8	-8.2	0	0	0	112.4	I90 S91 L115 L116	D86-I90 CarbonylContact C-O 3.53Å; D86-I90 VanDerWaalsContact CA-O 3.28Å; D86-I90 WeakPolarHBondContact CA-O 3.4Å; D86-S91 WeakPolarHBondContact OD1-CA 3.36Å; D86-S91 VanDerWaalsContact OD1-CB 3.25Å; D86-S91 WeakPolarHBondContact OD1-CB 3.16Å; D86-S91 PolarHBondContact OD1-OG 3.33Å; D86-L115 WeakPolarHBondContact O-CA 3.29Å; D86-L116 HydrophobicContact CB-CB 3.99Å; D86-L116 PolarHBondContact N-O 3.3Å; D86-L116 PolarHBondContact O-N 2.96Å
87	V	93.1	Very high	90.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118	173.9	-176.4	0	0	0	0	109.1	I84 N89 I90 L92 I103 L104 A107 M113 L115	I84-V87 HydrophobicContact CG2-CG2 3.99Å; V87-N89 PolarHBondContact O-N 2.99Å; V87-N89 VanDerWaalsContact O-N 3.17Å; V87-I90 PolarHBondContact N-O 3.43Å; V87-I90 VanDerWaalsContact O-CB 3.29Å; V87-I90 WeakPolarHBondContact O-CB 3.3Å; V87-I90 PolarHBondContact O-N 3.35Å; V87-L92 HydrophobicContact CG2-CD1 3.64Å; V87-L92 HydrophobicContact CG2-CD2 4.42Å; V87-L92 HydrophobicContact CG2-CG 4.08Å; V87-I103 HydrophobicContact CB-CG2 3.85Å; V87-I103 HydrophobicContact CG1-CG2 4.23Å; V87-I103 HydrophobicContact CG2-CG2 4.28Å; V87-L104 HydrophobicContact CG1-CD2 4.09Å; V87-L104 HydrophobicContact CG2-CD2 3.6Å; V87-L104 HydrophobicContact CG2-CG 4.21Å; V87-A107 HydrophobicContact CG1-CB 3.49Å; V87-A107 VanDerWaalsContact CG1-CB 3.49Å; V87-M113 HydrophobicContact CG1-CG 3.8Å; V87-M113 HydrophobicContact CG1-SD 3.77Å; V87-L115 HydrophobicContact CB-CD2 4.13Å; V87-L115 HydrophobicContact CG1-CD2 3.92Å; V87-L115 HydrophobicContact CG2-CD2 3.66Å
88	N	88.8	Confident	90.3	Very high	43 Å²	43	44.5 Å²	44.5	23%	0.23	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	37.7	-177.6	-72.6	-5.9	0	0	0	113.2	I90 S110 H112 M113 S114	N88-I90 PolarHBondContact O-N 3Å; N88-S110 PolarHBondContact ND2-OG 3.17Å; N88-H112 PolarHBondContact ND2-O 3.02Å; N88-H112 VanDerWaalsContact ND2-O 3.11Å; N88-M113 VanDerWaalsContact OD1-CA 3.3Å; N88-M113 WeakPolarHBondContact OD1-CA 3.44Å; N88-S114 PolarHBondContact N-O 3.22Å; N88-S114 PolarHBondContact OD1-N 3.22Å
89	N	83.3	Confident	90.2	Very high	116 Å²	116	50.5 Å²	50.5	62%	0.62	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	16.1	-175.5	-40.2	-56.3	0	0	0	114.6	R33 V87	R33-N89 PolarHBondContact NH2-OD1 3.47Å; V87-N89 PolarHBondContact O-N 2.99Å; V87-N89 VanDerWaalsContact O-N 3.17Å
90	I	86.1	Confident	90.3	Very high	91 Å²	91	44.8 Å²	44.8	47%	0.467	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119.4	167.3	-55.5	173.2	0	0	0	107.1	D86 V87 N88 I103	D86-I90 CarbonylContact C-O 3.53Å; D86-I90 VanDerWaalsContact CA-O 3.28Å; D86-I90 WeakPolarHBondContact CA-O 3.4Å; V87-I90 PolarHBondContact N-O 3.43Å; V87-I90 VanDerWaalsContact O-CB 3.29Å; V87-I90 WeakPolarHBondContact O-CB 3.3Å; V87-I90 PolarHBondContact O-N 3.35Å; N88-I90 PolarHBondContact O-N 3Å; I90-I103 HydrophobicContact CB-CG2 4.2Å; I90-I103 HydrophobicContact CD1-CG2 4.29Å; I90-I103 HydrophobicContact CG2-CD1 3.87Å; I90-I103 HydrophobicContact CG2-CG1 4.3Å; I90-I103 HydrophobicContact CG2-CG2 4.14Å
91	S	87.3	Confident	90.4	Very high	54 Å²	54	43.7 Å²	43.7	38%	0.378	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	142.8	179.9	-160.6	0	0	0	0	112.5	D86	D86-S91 WeakPolarHBondContact OD1-CA 3.36Å; D86-S91 VanDerWaalsContact OD1-CB 3.25Å; D86-S91 WeakPolarHBondContact OD1-CB 3.16Å; D86-S91 PolarHBondContact OD1-OG 3.33Å
92	L	88.9	Confident	90.5	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.016	25%	0.249	C	C	.	.			trans	-106.6	4.7	176.6	-61.9	-169.9	0	0	0	112.9	I61 I84 L85 V87 V95 A100 I103	I61-L92 HydrophobicContact CB-CB 4.44Å; I61-L92 HydrophobicContact CB-CD1 4.23Å; I61-L92 HydrophobicContact CG1-CB 4.05Å; I61-L92 HydrophobicContact CG1-CD1 4.36Å; I61-L92 HydrophobicContact CG2-CD1 4.13Å; I84-L92 HydrophobicContact CB-CD1 4.07Å; I84-L92 HydrophobicContact CG2-CD1 3.66Å; L85-L92 WeakPolarHBondContact O-CB 3.46Å; L85-L92 PolarHBondContact O-N 2.94Å; V87-L92 HydrophobicContact CG2-CD1 3.64Å; V87-L92 HydrophobicContact CG2-CD2 4.42Å; V87-L92 HydrophobicContact CG2-CG 4.08Å; L92-V95 WeakPolarHBondContact O-CB 3.24Å; L92-V95 PolarHBondContact O-N 3.03Å; L92-A100 HydrophobicContact CD1-CB 4.45Å; L92-A100 HydrophobicContact CD2-CB 4.25Å; L92-I103 HydrophobicContact CD2-CB 4.13Å; L92-I103 HydrophobicContact CD2-CD1 3.52Å; L92-I103 HydrophobicContact CD2-CG1 4.44Å; L92-I103 HydrophobicContact CD2-CG2 3.97Å
93	I	86.8	Confident	90.4	Very high	104 Å²	104	47.3 Å²	47.3	53%	0.533	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	130.1	176	-59.1	173.2	0	0	0	109.4	V95	I93-V95 PolarHBondContact O-N 3.45Å
94	G	82.6	Confident	90.4	Very high	35 Å²	35	48 Å²	48	36%	0.361	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	12.1	-179	0	0	0	0	0	114.5	Y51	Y51-G94 WeakPolarHBondContact CB-O 3.41Å
95	V	89.1	Confident	90.2	Very high	24 Å²	24	55.1 Å²	55.1	15%	0.145	28%	0.281	C	S	.	.			trans	-89	141	-178.5	178.5	0	0	0	0	110.2	G50 Y51 L92 I93 R99 A100 I103	G50-V95 CarbonylContact C-O 3.46Å; G50-V95 WeakPolarHBondContact CA-O 2.98Å; Y51-V95 PolarHBondContact N-O 3.27Å; L92-V95 WeakPolarHBondContact O-CB 3.24Å; L92-V95 PolarHBondContact O-N 3.03Å; I93-V95 PolarHBondContact O-N 3.45Å; V95-R99 HydrophobicContact CG1-CB 3.49Å; V95-R99 VanDerWaalsContact CG1-CB 3.49Å; V95-R99 HydrophobicContact CG1-CG 3.44Å; V95-R99 VanDerWaalsContact CG1-CG 3.44Å; V95-A100 HydrophobicContact CG1-CB 4.35Å; V95-I103 HydrophobicContact CG1-CD1 4.29Å
96	T	91	Very high	90.1	Very high	31 Å²	31	58.6 Å²	58.6	19%	0.19	31%	0.305	C	S	.	.			trans	-65.3	156.6	174.7	66.3	0	0	0	0	111.7	Y51 E98 R99 A100	Y51-T96 HydrophobicContact CD1-CG2 4.31Å; T96-E98 VanDerWaalsContact C-N 3.27Å; T96-E98 PolarHBondContact O-N 3.13Å; T96-R99 PolarHBondContact O-N 2.99Å; T96-R99 VanDerWaalsContact OG1-CB 3.28Å; T96-R99 WeakPolarHBondContact OG1-CB 3.37Å; T96-R99 PolarHBondContact OG1-N 3.36Å; T96-A100 PolarHBondContact O-N 3.21Å
97	N	92.7	Very high	89.9	Confident	47 Å²	47	57.4 Å²	57.4	25%	0.251	30%	0.3	S	S	.	.	H	α-helix	trans	-57.3	-44.3	179.7	-167	-98.9	0	0	0	111.7	G49 R99 A100 V101	G49-N97 VanDerWaalsContact O-CB 3.26Å; G49-N97 WeakPolarHBondContact O-CB 3.36Å; G49-N97 PolarHBondContact O-ND2 3.31Å; N97-R99 VanDerWaalsContact C-N 3.34Å; N97-R99 PolarHBondContact O-N 2.98Å; N97-A100 PolarHBondContact O-N 3.42Å; N97-V101 WeakPolarHBondContact O-CG2 3.49Å; N97-V101 PolarHBondContact O-N 2.89Å
98	E	92.6	Very high	89.7	Confident	128 Å²	128	58 Å²	58	60%	0.598	30%	0.304	S	S	*	.	H	α-helix	trans	-60.9	-45.5	-178.6	-64.6	70.2	-153.1	0	0	110.5	T96 V101 E102	T96-E98 VanDerWaalsContact C-N 3.27Å; T96-E98 PolarHBondContact O-N 3.13Å; E98-V101 WeakPolarHBondContact O-CB 3.43Å; E98-V101 PolarHBondContact O-N 3.11Å; E98-E102 PolarHBondContact O-N 2.64Å; E98-E102 VanDerWaalsContact O-N 3.07Å
99	R	92.3	Very high	89.5	Confident	132 Å²	132	62.4 Å²	62.4	50%	0.498	33%	0.327	S	S	.	.	H	α-helix	trans	-68.3	-37.4	179.3	-177.9	58.4	177	178.2	-1.4	112.1	V95 T96 N97 V101 E102 I103	V95-R99 HydrophobicContact CG1-CB 3.49Å; V95-R99 VanDerWaalsContact CG1-CB 3.49Å; V95-R99 HydrophobicContact CG1-CG 3.44Å; V95-R99 VanDerWaalsContact CG1-CG 3.44Å; T96-R99 PolarHBondContact O-N 2.99Å; T96-R99 VanDerWaalsContact OG1-CB 3.28Å; T96-R99 WeakPolarHBondContact OG1-CB 3.37Å; T96-R99 PolarHBondContact OG1-N 3.36Å; N97-R99 VanDerWaalsContact C-N 3.34Å; N97-R99 PolarHBondContact O-N 2.98Å; R99-V101 VanDerWaalsContact C-N 3.33Å; R99-V101 PolarHBondContact O-N 3.37Å; R99-E102 WeakPolarHBondContact CD-OE2 3.48Å; R99-E102 IonicContact CZ-OE2 3.46Å; R99-E102 IonicContact NH1-OE2 3.41Å; R99-E102 PolarHBondContact NH1-OE2 3.08Å; R99-E102 WeakPolarHBondContact O-CB 3.5Å; R99-E102 PolarHBondContact O-N 3.46Å; R99-I103 HydrophobicContact CG-CD1 4.09Å; R99-I103 VanDerWaalsContact O-CG1 3.31Å; R99-I103 WeakPolarHBondContact O-CG1 3.25Å; R99-I103 PolarHBondContact O-N 3.28Å
100	A	92.9	Very high	89.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.8	-38.9	173.9	0	0	0	0	0	112.2	I47 I61 L92 V95 T96 N97 I103 L104	I47-A100 HydrophobicContact CD1-CB 3.86Å; I61-A100 HydrophobicContact CD1-CB 3.53Å; I61-A100 HydrophobicContact CG1-CB 3.78Å; I61-A100 HydrophobicContact CG2-CB 4.14Å; L92-A100 HydrophobicContact CD1-CB 4.45Å; L92-A100 HydrophobicContact CD2-CB 4.25Å; V95-A100 HydrophobicContact CG1-CB 4.35Å; T96-A100 PolarHBondContact O-N 3.21Å; N97-A100 PolarHBondContact O-N 3.42Å; A100-I103 PolarHBondContact O-N 2.79Å; A100-L104 WeakPolarHBondContact O-CG 3.31Å; A100-L104 PolarHBondContact O-N 2.86Å
101	V	94.2	Very high	89.5	Confident	47 Å²	47	58.6 Å²	58.6	29%	0.285	31%	0.312	S	S	.	.	H	α-helix	trans	-62.2	-42.8	173.2	174.2	0	0	0	0	111.3	I47 N97 E98 R99 L104 R105	I47-V101 HydrophobicContact CD1-CG2 3.78Å; I47-V101 HydrophobicContact CG1-CG2 4.12Å; N97-V101 WeakPolarHBondContact O-CG2 3.49Å; N97-V101 PolarHBondContact O-N 2.89Å; E98-V101 WeakPolarHBondContact O-CB 3.43Å; E98-V101 PolarHBondContact O-N 3.11Å; R99-V101 VanDerWaalsContact C-N 3.33Å; R99-V101 PolarHBondContact O-N 3.37Å; V101-L104 PolarHBondContact O-N 2.61Å; V101-R105 VanDerWaalsContact CG1-NH2 3.35Å; V101-R105 WeakPolarHBondContact O-CB 3.18Å; V101-R105 PolarHBondContact O-N 2.85Å
102	E	92.9	Very high	89.5	Confident	84 Å²	84	59.7 Å²	59.7	39%	0.393	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-42.2	176.4	-71.8	177.8	174.9	0	0	112.6	E98 R99 R105 S106	E98-E102 PolarHBondContact O-N 2.64Å; E98-E102 VanDerWaalsContact O-N 3.07Å; R99-E102 WeakPolarHBondContact CD-OE2 3.48Å; R99-E102 IonicContact CZ-OE2 3.46Å; R99-E102 IonicContact NH1-OE2 3.41Å; R99-E102 PolarHBondContact NH1-OE2 3.08Å; R99-E102 WeakPolarHBondContact O-CB 3.5Å; R99-E102 PolarHBondContact O-N 3.46Å; E102-R105 PolarHBondContact O-N 3.09Å; E102-S106 VanDerWaalsContact O-CB 3.29Å; E102-S106 WeakPolarHBondContact O-CB 3.27Å; E102-S106 PolarHBondContact O-N 3.42Å; E102-S106 PolarHBondContact O-OG 3.32Å
103	I	92.6	Very high	89.6	Confident	10 Å²	10	59.6 Å²	59.6	5%	0.051	31%	0.311	C	S	.	.	H	α-helix	trans	-63.3	-47.8	178.4	-69.1	164.3	0	0	0	110.1	V87 I90 L92 V95 R99 A100 R105 S106 A107	V87-I103 HydrophobicContact CB-CG2 3.85Å; V87-I103 HydrophobicContact CG1-CG2 4.23Å; V87-I103 HydrophobicContact CG2-CG2 4.28Å; I90-I103 HydrophobicContact CB-CG2 4.2Å; I90-I103 HydrophobicContact CD1-CG2 4.29Å; I90-I103 HydrophobicContact CG2-CD1 3.87Å; I90-I103 HydrophobicContact CG2-CG1 4.3Å; I90-I103 HydrophobicContact CG2-CG2 4.14Å; L92-I103 HydrophobicContact CD2-CB 4.13Å; L92-I103 HydrophobicContact CD2-CD1 3.52Å; L92-I103 HydrophobicContact CD2-CG1 4.44Å; L92-I103 HydrophobicContact CD2-CG2 3.97Å; V95-I103 HydrophobicContact CG1-CD1 4.29Å; R99-I103 HydrophobicContact CG-CD1 4.09Å; R99-I103 VanDerWaalsContact O-CG1 3.31Å; R99-I103 WeakPolarHBondContact O-CG1 3.25Å; R99-I103 PolarHBondContact O-N 3.28Å; A100-I103 PolarHBondContact O-N 2.79Å; I103-R105 VanDerWaalsContact C-N 3.33Å; I103-R105 PolarHBondContact O-N 3.27Å; I103-S106 PolarHBondContact O-N 2.8Å; I103-A107 VanDerWaalsContact O-CB 3.3Å; I103-A107 WeakPolarHBondContact O-CB 3.4Å; I103-A107 PolarHBondContact O-N 3.15Å
104	L	92.5	Very high	89.8	Confident	22 Å²	22	55 Å²	55	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-39.5	176.5	-74.1	167.2	0	0	0	112.2	I47 V87 A100 V101 S108 M113 L115	I47-L104 HydrophobicContact CD1-CD1 4Å; I47-L104 HydrophobicContact CG2-CD1 3.93Å; V87-L104 HydrophobicContact CG1-CD2 4.09Å; V87-L104 HydrophobicContact CG2-CD2 3.6Å; V87-L104 HydrophobicContact CG2-CG 4.21Å; A100-L104 WeakPolarHBondContact O-CG 3.31Å; A100-L104 PolarHBondContact O-N 2.86Å; V101-L104 PolarHBondContact O-N 2.61Å; L104-S108 WeakPolarHBondContact O-CB 3.16Å; L104-S108 PolarHBondContact O-N 2.6Å; L104-M113 HydrophobicContact CD2-CE 4.29Å; L104-M113 HydrophobicContact CD2-SD 4.02Å; L104-L115 HydrophobicContact CD2-CD2 4.08Å
105	R	90.6	Very high	90.3	Very high	151 Å²	151	53.3 Å²	53.3	57%	0.57	27%	0.27	S	S	*	.	H	α-helix	trans	-67.1	-44.2	176	-168.1	-174.4	-59.7	133.4	0.5	111.2	V101 E102 I103 S108 L109	V101-R105 VanDerWaalsContact CG1-NH2 3.35Å; V101-R105 WeakPolarHBondContact O-CB 3.18Å; V101-R105 PolarHBondContact O-N 2.85Å; E102-R105 PolarHBondContact O-N 3.09Å; I103-R105 VanDerWaalsContact C-N 3.33Å; I103-R105 PolarHBondContact O-N 3.27Å; R105-S108 WeakPolarHBondContact O-CB 3.28Å; R105-S108 PolarHBondContact O-N 3.26Å; R105-S108 PolarHBondContact O-OG 3.22Å; R105-L109 PolarHBondContact O-N 3.02Å
106	S	89.9	Confident	90.4	Very high	75 Å²	75	53.4 Å²	53.4	52%	0.524	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-42.3	178.2	-57.2	0	0	0	0	111.4	E102 I103 S108 L109	E102-S106 VanDerWaalsContact O-CB 3.29Å; E102-S106 WeakPolarHBondContact O-CB 3.27Å; E102-S106 PolarHBondContact O-N 3.42Å; E102-S106 PolarHBondContact O-OG 3.32Å; I103-S106 PolarHBondContact O-N 2.8Å; S106-S108 VanDerWaalsContact C-N 3.31Å; S106-S108 PolarHBondContact O-N 3.17Å; S106-L109 WeakPolarHBondContact O-CB 3.36Å; S106-L109 PolarHBondContact O-N 3.48Å
107	A	88.1	Confident	90.5	Very high	8 Å²	8	51.9 Å²	51.9	7%	0.066	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-38.3	174.6	0	0	0	0	0	112	V87 I103 L109 S110 M113	V87-A107 HydrophobicContact CG1-CB 3.49Å; V87-A107 VanDerWaalsContact CG1-CB 3.49Å; I103-A107 VanDerWaalsContact O-CB 3.3Å; I103-A107 WeakPolarHBondContact O-CB 3.4Å; I103-A107 PolarHBondContact O-N 3.15Å; A107-L109 VanDerWaalsContact C-N 3.26Å; A107-L109 PolarHBondContact O-N 3.35Å; A107-S110 WeakPolarHBondContact O-CB 3.32Å; A107-S110 PolarHBondContact O-N 2.87Å; A107-S110 VanDerWaalsContact O-N 3.08Å; A107-S110 PolarHBondContact O-OG 2.78Å; A107-M113 HydrophobicContact CB-CG 3.91Å; A107-M113 HydrophobicContact CB-SD 3.65Å
108	S	87.9	Confident	90.3	Very high	13 Å²	13	49.7 Å²	49.7	9%	0.091	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-29.8	176.6	76.1	0	0	0	0	114	C39 L104 R105 S106 S110 N111	C39-S108 WeakPolarHBondContact O-CB 3.42Å; L104-S108 WeakPolarHBondContact O-CB 3.16Å; L104-S108 PolarHBondContact O-N 2.6Å; R105-S108 WeakPolarHBondContact O-CB 3.28Å; R105-S108 PolarHBondContact O-N 3.26Å; R105-S108 PolarHBondContact O-OG 3.22Å; S106-S108 VanDerWaalsContact C-N 3.31Å; S106-S108 PolarHBondContact O-N 3.17Å; S108-S110 VanDerWaalsContact C-N 3.25Å; S108-S110 PolarHBondContact O-N 3.49Å; S108-N111 PolarHBondContact O-N 2.85Å
109	L	86.3	Confident	90	Very high	135 Å²	135	47.2 Å²	47.2	71%	0.707	23%	0.234	S	C	*	.	H	α-helix	trans	-67.2	-26.4	175.8	-63.6	173.6	0	0	0	112.7	R105 S106 A107 N111	R105-L109 PolarHBondContact O-N 3.02Å; S106-L109 WeakPolarHBondContact O-CB 3.36Å; S106-L109 PolarHBondContact O-N 3.48Å; A107-L109 VanDerWaalsContact C-N 3.26Å; A107-L109 PolarHBondContact O-N 3.35Å; L109-N111 PolarHBondContact O-N 2.81Å
110	S	83.6	Confident	89.5	Confident	64 Å²	64	41.5 Å²	41.5	45%	0.448	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	0	178.3	73.2	0	0	0	0	113.6	N88 A107 S108 H112	N88-S110 PolarHBondContact ND2-OG 3.17Å; A107-S110 WeakPolarHBondContact O-CB 3.32Å; A107-S110 PolarHBondContact O-N 2.87Å; A107-S110 VanDerWaalsContact O-N 3.08Å; A107-S110 PolarHBondContact O-OG 2.78Å; S108-S110 VanDerWaalsContact C-N 3.25Å; S108-S110 PolarHBondContact O-N 3.49Å; S110-H112 PolarHBondContact O-N 2.97Å; S110-H112 PolarHBondContact OG-O 3.43Å
111	N	84.2	Confident	88.8	Confident	64 Å²	64	46.3 Å²	46.3	34%	0.342	24%	0.239	S	C	.	.	S	Bend	trans	62.9	-11.7	-177.5	-56.6	-54.9	0	0	0	116	S37 D38 C39 K40 S108 L109	S37-N111 CarbonylContact C-O 3.55Å; S37-N111 WeakPolarHBondContact CA-O 3.42Å; D38-N111 PolarHBondContact N-O 3.3Å; C39-N111 PolarHBondContact N-O 3.3Å; K40-N111 WeakPolarHBondContact CD-OD1 3.45Å; K40-N111 WeakPolarHBondContact CE-OD1 2.87Å; K40-N111 WeakPolarHBondContact CG-OD1 3.4Å; S108-N111 PolarHBondContact O-N 2.85Å; L109-N111 PolarHBondContact O-N 2.81Å
112	H	86.9	Confident	88.3	Confident	77 Å²	77	48.2 Å²	48.2	36%	0.356	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	127.5	179.3	179.9	78.3	0	0	0	109.4	F36 N88 S110	F36-H112 WeakPolarHBondContact O-CA 3.42Å; N88-H112 PolarHBondContact ND2-O 3.02Å; N88-H112 VanDerWaalsContact ND2-O 3.11Å; S110-H112 PolarHBondContact O-N 2.97Å; S110-H112 PolarHBondContact OG-O 3.43Å
113	M	91.1	Very high	87.9	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.2	-179.6	-164.6	165.6	68.1	0	0	111.3	E35 F36 L43 V87 N88 L104 A107 L115	E35-M113 CarbonylContact C-O 3.59Å; E35-M113 WeakPolarHBondContact CA-O 3.43Å; F36-M113 PolarHBondContact N-O 3.09Å; F36-M113 PolarHBondContact O-N 2.8Å; L43-M113 HydrophobicContact CB-CE 3.72Å; L43-M113 HydrophobicContact CD1-CE 3.81Å; L43-M113 HydrophobicContact CD2-CE 3.54Å; L43-M113 HydrophobicContact CG-CE 3.86Å; V87-M113 HydrophobicContact CG1-CG 3.8Å; V87-M113 HydrophobicContact CG1-SD 3.77Å; N88-M113 VanDerWaalsContact OD1-CA 3.3Å; N88-M113 WeakPolarHBondContact OD1-CA 3.44Å; L104-M113 HydrophobicContact CD2-CE 4.29Å; L104-M113 HydrophobicContact CD2-SD 4.02Å; A107-M113 HydrophobicContact CB-CG 3.91Å; A107-M113 HydrophobicContact CB-SD 3.65Å; M113-L115 HydrophobicContact CE-CD1 4.18Å; M113-L115 HydrophobicContact CE-CD2 3.99Å; M113-L115 HydrophobicContact CE-CG 4.23Å; M113-L115 HydrophobicContact CG-CD2 3.99Å; M113-L115 HydrophobicContact CG-CG 4.42Å; M113-L115 HydrophobicContact SD-CD2 4.12Å
114	S	92.3	Very high	87.6	Confident	6 Å²	6	50.7 Å²	50.7	4%	0.042	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	110.3	177.2	169.7	0	0	0	0	108.9	R33 L34 N88	R33-S114 PolarHBondContact NE-OG 3.17Å; R33-S114 PolarHBondContact NH2-OG 3.4Å; L34-S114 CarbonylContact O-C 3.57Å; L34-S114 WeakPolarHBondContact O-CA 3.16Å; N88-S114 PolarHBondContact N-O 3.22Å; N88-S114 PolarHBondContact OD1-N 3.22Å
115	L	93.6	Very high	87.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.3	177.6	-57.7	-180	0	0	0	110.7	R33 L34 F36 L43 L78 I84 D86 V87 L104 M113 V117	R33-L115 CarbonylContact C-O 3.57Å; R33-L115 VanDerWaalsContact CA-O 3.31Å; R33-L115 WeakPolarHBondContact CA-O 3.3Å; L34-L115 PolarHBondContact N-O 2.86Å; L34-L115 PolarHBondContact O-N 2.92Å; F36-L115 HydrophobicContact CD2-CD1 4.27Å; F36-L115 HydrophobicContact CD2-CG 4.45Å; F36-L115 HydrophobicContact CE2-CD1 3.82Å; F36-L115 HydrophobicContact CE2-CG 4.31Å; L43-L115 HydrophobicContact CD2-CD1 3.64Å; L78-L115 HydrophobicContact CD1-CD1 4.42Å; L78-L115 HydrophobicContact CD2-CD1 4.24Å; I84-L115 HydrophobicContact CG2-CD2 4.32Å; D86-L115 WeakPolarHBondContact O-CA 3.29Å; V87-L115 HydrophobicContact CB-CD2 4.13Å; V87-L115 HydrophobicContact CG1-CD2 3.92Å; V87-L115 HydrophobicContact CG2-CD2 3.66Å; L104-L115 HydrophobicContact CD2-CD2 4.08Å; M113-L115 HydrophobicContact CE-CD1 4.18Å; M113-L115 HydrophobicContact CE-CD2 3.99Å; M113-L115 HydrophobicContact CE-CG 4.23Å; M113-L115 HydrophobicContact CG-CD2 3.99Å; M113-L115 HydrophobicContact CG-CG 4.42Å; M113-L115 HydrophobicContact SD-CD2 4.12Å; L115-V117 HydrophobicContact CB-CG2 4.11Å
116	L	91.3	Very high	87.3	Confident	26 Å²	26	53 Å²	53	14%	0.136	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.4	165.8	-167.2	69	0	0	0	108.2	H25 V31 R33 L85 D86	H25-L116 WeakPolarHBondContact NE2-CD2 3.39Å; V31-L116 HydrophobicContact CG1-CD1 3.34Å; V31-L116 HydrophobicContact CG1-CD2 4.1Å; V31-L116 HydrophobicContact CG1-CG 3.46Å; V31-L116 VanDerWaalsContact CG1-CG 3.46Å; R33-L116 HydrophobicContact CB-CD1 4.25Å; L85-L116 HydrophobicContact CB-CB 4.3Å; L85-L116 HydrophobicContact CB-CD2 4.21Å; L85-L116 HydrophobicContact CB-CG 4.32Å; L85-L116 HydrophobicContact CD1-CD2 4.27Å; L85-L116 HydrophobicContact CD1-CG 4.3Å; L85-L116 PolarHBondContact N-O 3.47Å; D86-L116 HydrophobicContact CB-CB 3.99Å; D86-L116 PolarHBondContact N-O 3.3Å; D86-L116 PolarHBondContact O-N 2.96Å
117	V	92.1	Very high	87.4	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	137.6	-171	175.3	0	0	0	0	111.1	V31 Q32 L34 L78 D82 L83 L115	V31-V117 CarbonylContact C-O 3.42Å; V31-V117 VanDerWaalsContact CA-O 3.22Å; V31-V117 WeakPolarHBondContact CA-O 3.31Å; Q32-V117 PolarHBondContact N-O 3.3Å; Q32-V117 PolarHBondContact O-N 2.88Å; L34-V117 HydrophobicContact CD1-CG2 4.29Å; L78-V117 HydrophobicContact CD1-CG2 3.98Å; D82-V117 HydrophobicContact CB-CG1 3.49Å; D82-V117 VanDerWaalsContact CB-CG1 3.49Å; L83-V117 CarbonylContact O-C 3.55Å; L83-V117 WeakPolarHBondContact O-CA 3.41Å; L115-V117 HydrophobicContact CB-CG2 4.11Å
118	A	89.1	Confident	87.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	144.7	173.8	0	0	0	0	0	112.8	R29 V31 L83 L85	R29-A118 HydrophobicContact CB-CB 4.34Å; V31-A118 HydrophobicContact CG2-CB 4.23Å; L83-A118 HydrophobicContact CB-CB 4.3Å; L83-A118 HydrophobicContact CD2-CB 4.37Å; L83-A118 PolarHBondContact N-O 2.73Å; L83-A118 PolarHBondContact O-N 2.84Å; L85-A118 HydrophobicContact CD1-CB 3.92Å; L85-A118 HydrophobicContact CG-CB 4.32Å
119	R	85.8	Confident	87.6	Confident	77 Å²	77	57.6 Å²	57.6	29%	0.291	28%	0.279	S	S	.	.			trans	-135.4	54.8	179.6	-67	-175.4	177	141.9	10.4	113.3	A30 Q32 R77 D82	A30-R119 PolarHBondContact O-N 2.88Å; A30-R119 VanDerWaalsContact O-N 3.12Å; Q32-R119 VanDerWaalsContact OE1-NH1 3.16Å; R77-R119 PolarHBondContact O-NH2 2.88Å; D82-R119 WeakPolarHBondContact OD1-CG 3.01Å; D82-R119 IonicContact OD1-CZ 2.72Å; D82-R119 IonicContact OD1-NE 2.85Å; D82-R119 PolarHBondContact OD1-NE 3.04Å; D82-R119 IonicContact OD1-NH2 3.49Å; D82-R119 PolarHBondContact OD1-NH2 3.49Å; D82-R119 IonicContact OD2-CZ 2.8Å; D82-R119 IonicContact OD2-NE 3.34Å; D82-R119 IonicContact OD2-NH2 3.4Å; D82-R119 PolarHBondContact OD2-NH2 3.32Å
120	D	81.9	Confident	87.8	Confident	11 Å²	11	51.2 Å²	51.2	6%	0.059	25%	0.246	C	C	.	.			trans	-95.6	169.7	176.5	55.2	-79.3	0	0	0	113.5	N28 R29 E122 S123 R124	N28-D120 WeakPolarHBondContact O-CB 3.47Å; R29-D120 HydrophobicContact CG-CB 4.12Å; R29-D120 VanDerWaalsContact CG-OD1 3.3Å; R29-D120 WeakPolarHBondContact CG-OD1 3.39Å; R29-D120 IonicContact NE-OD1 2.65Å; R29-D120 IonicContact NE-OD2 2.94Å; D120-E122 VanDerWaalsContact C-N 3.28Å; D120-E122 PolarHBondContact O-N 3.42Å; D120-E122 WeakPolarHBondContact OD2-CA 3.46Å; D120-E122 VanDerWaalsContact OD2-CB 3.26Å; D120-E122 WeakPolarHBondContact OD2-CB 3.45Å; D120-E122 PolarHBondContact OD2-N 3.41Å; D120-E122 VanDerWaalsContact OD2-N 3.11Å; D120-S123 VanDerWaalsContact CG-OG 3.28Å; D120-S123 WeakPolarHBondContact OD1-CB 3.36Å; D120-S123 PolarHBondContact OD1-OG 2.79Å; D120-S123 PolarHBondContact OD2-N 3.18Å; D120-S123 PolarHBondContact OD2-OG 2.94Å; D120-R124 WeakPolarHBondContact O-CG 3.32Å; D120-R124 PolarHBondContact O-N 2.93Å; D120-R124 VanDerWaalsContact O-N 3.14Å
121	D	78.9	Confident	88.1	Confident	101 Å²	101	50.6 Å²	50.6	54%	0.54	24%	0.236	S	C	.	.	H	α-helix	trans	-62.9	-31.3	176.5	-77.6	-69.8	0	0	0	113.2	R124 R125	D121-R124 IonicContact OD1-CZ 3.59Å; D121-R124 IonicContact OD1-NE 2.82Å; D121-R124 IonicContact OD1-NH1 3.51Å; D121-R124 IonicContact OD1-NH2 3.13Å; D121-R124 PolarHBondContact OD1-NH2 2.79Å; D121-R124 IonicContact OD2-NH2 2.9Å; D121-R124 PolarHBondContact OD2-NH2 2.6Å; D121-R125 WeakPolarHBondContact O-CG 3.33Å; D121-R125 PolarHBondContact O-N 2.85Å; D121-R125 VanDerWaalsContact O-N 3.15Å
122	E	81.9	Confident	88.4	Confident	87 Å²	87	55.6 Å²	55.6	41%	0.407	26%	0.257	S	S	.	.	H	α-helix	trans	-71.3	-49.7	177.9	171.5	-175	-106.3	0	0	110.8	R29 D120 R124 R125 E126	R29-E122 IonicContact CZ-OE2 3.55Å; R29-E122 IonicContact NE-OE2 3.12Å; R29-E122 IonicContact NH2-OE2 2.74Å; R29-E122 PolarHBondContact NH2-OE2 2.96Å; D120-E122 VanDerWaalsContact C-N 3.28Å; D120-E122 PolarHBondContact O-N 3.42Å; D120-E122 WeakPolarHBondContact OD2-CA 3.46Å; D120-E122 VanDerWaalsContact OD2-CB 3.26Å; D120-E122 WeakPolarHBondContact OD2-CB 3.45Å; D120-E122 PolarHBondContact OD2-N 3.41Å; D120-E122 VanDerWaalsContact OD2-N 3.11Å; E122-R124 PolarHBondContact O-N 2.72Å; E122-R125 PolarHBondContact O-N 2.77Å; E122-E126 WeakPolarHBondContact CG-OE1 3.15Å; E122-E126 PolarHBondContact O-N 2.94Å
123	S	84.9	Confident	88.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-52.8	-38.7	172	-68.4	0	0	0	0	112.6	Y62 L83 D120 F127	Y62-S123 VanDerWaalsContact CE1-O 3.27Å; Y62-S123 WeakPolarHBondContact CE1-O 3.49Å; L83-S123 WeakPolarHBondContact CD2-OG 3.48Å; D120-S123 VanDerWaalsContact CG-OG 3.28Å; D120-S123 WeakPolarHBondContact OD1-CB 3.36Å; D120-S123 PolarHBondContact OD1-OG 2.79Å; D120-S123 PolarHBondContact OD2-N 3.18Å; D120-S123 PolarHBondContact OD2-OG 2.94Å; S123-F127 VanDerWaalsContact O-CB 3.25Å; S123-F127 WeakPolarHBondContact O-CB 3.23Å; S123-F127 PolarHBondContact O-N 3.12Å
124	R	86.4	Confident	88	Confident	146 Å²	146	59.7 Å²	59.7	55%	0.551	27%	0.272	S	S	*	.	H	α-helix	trans	-68.4	-38.6	176.3	-78.6	-173.7	-75.7	160.9	-9.7	113.3	D120 D121 E122 A128	D120-R124 WeakPolarHBondContact O-CG 3.32Å; D120-R124 PolarHBondContact O-N 2.93Å; D120-R124 VanDerWaalsContact O-N 3.14Å; D121-R124 IonicContact OD1-CZ 3.59Å; D121-R124 IonicContact OD1-NE 2.82Å; D121-R124 IonicContact OD1-NH1 3.51Å; D121-R124 IonicContact OD1-NH2 3.13Å; D121-R124 PolarHBondContact OD1-NH2 2.79Å; D121-R124 IonicContact OD2-NH2 2.9Å; D121-R124 PolarHBondContact OD2-NH2 2.6Å; E122-R124 PolarHBondContact O-N 2.72Å; R124-A128 PolarHBondContact O-N 3.4Å; R124-A128 VanDerWaalsContact O-N 3.15Å
125	R	87.6	Confident	87.2	Confident	170 Å²	170	60.4 Å²	60.4	64%	0.642	28%	0.281	S	S	*	.	H	α-helix	trans	-68.2	-47.9	177.4	-74.1	-178.4	-63.5	-165.2	4.5	111.1	D121 E122 F127 A128 E129	D121-R125 WeakPolarHBondContact O-CG 3.33Å; D121-R125 PolarHBondContact O-N 2.85Å; D121-R125 VanDerWaalsContact O-N 3.15Å; E122-R125 PolarHBondContact O-N 2.77Å; R125-F127 VanDerWaalsContact C-N 3.34Å; R125-F127 PolarHBondContact O-N 3.02Å; R125-A128 WeakPolarHBondContact O-CB 3.45Å; R125-A128 PolarHBondContact O-N 2.85Å; R125-A128 VanDerWaalsContact O-N 3.15Å; R125-E129 PolarHBondContact O-N 3.32Å
126	E	89.1	Confident	85.9	Confident	52 Å²	52	65 Å²	65	24%	0.243	31%	0.314	C	S	.	.	H	α-helix	trans	-60.9	-43.1	177	-73.3	-178.9	-145.2	0	0	111.5	Y62 E122 A128 E129 L130	Y62-E126 HydrophobicContact CE2-CB 4.48Å; Y62-E126 WeakPolarHBondContact OH-CB 3.35Å; Y62-E126 PolarHBondContact OH-OE2 3.09Å; E122-E126 WeakPolarHBondContact CG-OE1 3.15Å; E122-E126 PolarHBondContact O-N 2.94Å; E126-A128 VanDerWaalsContact C-N 3.3Å; E126-A128 PolarHBondContact O-N 3.15Å; E126-E129 PolarHBondContact O-N 3.45Å; E126-L130 VanDerWaalsContact O-CB 3.24Å; E126-L130 WeakPolarHBondContact O-CB 3.43Å; E126-L130 PolarHBondContact O-N 3.48Å
127	F	91.7	Very high	83.8	Confident	34 Å²	34	71.5 Å²	71.5	15%	0.149	35%	0.348	C	S	.	.	H	α-helix	trans	-59.7	-39.8	175.1	177.7	-108.4	0	0	0	112.8	I48 Y62 S123 R125 L130 M131	I48-F127 HydrophobicContact CG2-CE2 4.25Å; Y62-F127 HydrophobicContact CD1-CB 3.86Å; Y62-F127 HydrophobicContact CD1-CD2 4.06Å; Y62-F127 HydrophobicContact CD1-CG 4.35Å; Y62-F127 HydrophobicContact CE1-CB 4.1Å; Y62-F127 HydrophobicContact CG-CB 4.32Å; Y62-F127 AromaticContact CG-CD2 3.89Å; Y62-F127 HydrophobicContact CG-CD2 3.89Å; S123-F127 VanDerWaalsContact O-CB 3.25Å; S123-F127 WeakPolarHBondContact O-CB 3.23Å; S123-F127 PolarHBondContact O-N 3.12Å; R125-F127 VanDerWaalsContact C-N 3.34Å; R125-F127 PolarHBondContact O-N 3.02Å; F127-L130 PolarHBondContact O-N 2.73Å; F127-M131 HydrophobicContact CD1-CG 4.34Å; F127-M131 HydrophobicContact CD2-CG 4.4Å; F127-M131 HydrophobicContact CE1-CG 3.87Å; F127-M131 HydrophobicContact CE2-CE 4.48Å; F127-M131 HydrophobicContact CE2-CG 3.95Å; F127-M131 HydrophobicContact CE2-SD 4.27Å; F127-M131 HydrophobicContact CZ-CG 3.66Å; F127-M131 HydrophobicContact CZ-SD 3.96Å; F127-M131 WeakPolarHBondContact O-CB 3.19Å; F127-M131 WeakPolarHBondContact O-CG 3.44Å; F127-M131 PolarHBondContact O-N 2.8Å
128	A	90.3	Very high	81.3	Confident	55 Å²	55	79 Å²	79	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-65.9	-45.7	178.3	0	0	0	0	0	111.8	R124 R125 E126 L130 M131 E132	R124-A128 PolarHBondContact O-N 3.4Å; R124-A128 VanDerWaalsContact O-N 3.15Å; R125-A128 WeakPolarHBondContact O-CB 3.45Å; R125-A128 PolarHBondContact O-N 2.85Å; R125-A128 VanDerWaalsContact O-N 3.15Å; E126-A128 VanDerWaalsContact C-N 3.3Å; E126-A128 PolarHBondContact O-N 3.15Å; A128-L130 VanDerWaalsContact C-N 3.29Å; A128-L130 PolarHBondContact O-N 2.85Å; A128-M131 PolarHBondContact O-N 2.74Å; A128-E132 PolarHBondContact O-N 3.33Å
129	E	90.9	Very high	78.6	Confident	104 Å²	104	85.8 Å²	85.8	49%	0.486	43%	0.43	S	S	.	.	H	α-helix	trans	-58.3	-43.7	174.1	-177.6	-179	172.8	0	0	111.1	R125 E126 M131 E132 K133	R125-E129 PolarHBondContact O-N 3.32Å; E126-E129 PolarHBondContact O-N 3.45Å; E129-M131 VanDerWaalsContact C-N 3.32Å; E129-M131 PolarHBondContact O-N 2.82Å; E129-E132 PolarHBondContact O-N 3.48Å; E129-K133 WeakPolarHBondContact O-CB 3.36Å; E129-K133 PolarHBondContact O-N 2.9Å
130	L	90.4	Very high	76	Confident	1 Å²	1	87.9 Å²	87.9	1%	0.005	45%	0.451	C	S	.	.	H	α-helix	trans	-67.3	-34.2	-179.4	-154.3	153.9	0	0	0	112.2	I48 F59 Y62 E126 F127 A128 Y134 G135	I48-L130 HydrophobicContact CB-CD2 3.94Å; I48-L130 HydrophobicContact CD1-CD2 3.37Å; I48-L130 HydrophobicContact CG1-CD2 3.33Å; I48-L130 HydrophobicContact CG2-CD2 3.64Å; F59-L130 HydrophobicContact CB-CD1 3.39Å; F59-L130 HydrophobicContact CD1-CD1 3.63Å; F59-L130 HydrophobicContact CD1-CG 4.37Å; F59-L130 HydrophobicContact CD2-CD1 4.14Å; F59-L130 HydrophobicContact CE1-CD1 4.4Å; F59-L130 HydrophobicContact CG-CD1 3.46Å; F59-L130 VanDerWaalsContact CG-CD1 3.46Å; F59-L130 HydrophobicContact CG-CG 4.34Å; Y62-L130 HydrophobicContact CD2-CD1 4.13Å; Y62-L130 HydrophobicContact CE2-CD1 4.37Å; E126-L130 VanDerWaalsContact O-CB 3.24Å; E126-L130 WeakPolarHBondContact O-CB 3.43Å; E126-L130 PolarHBondContact O-N 3.48Å; F127-L130 PolarHBondContact O-N 2.73Å; A128-L130 VanDerWaalsContact C-N 3.29Å; A128-L130 PolarHBondContact O-N 2.85Å; L130-Y134 HydrophobicContact CG-CD2 4.43Å; L130-Y134 PolarHBondContact O-N 3.28Å; L130-G135 PolarHBondContact O-N 2.79Å
131	M	90.4	Very high	73.9	Confident	50 Å²	50	92.9 Å²	92.9	25%	0.246	49%	0.487	C	S	.	.	H	α-helix	trans	-69.2	-38.3	171.3	-76	-71.4	84.7	0	0	113	I48 K64 F127 A128 E129 G135	I48-M131 HydrophobicContact CB-CE 4.45Å; I48-M131 HydrophobicContact CD1-CE 3.26Å; I48-M131 HydrophobicContact CG1-CE 4.38Å; I48-M131 HydrophobicContact CG2-CE 3.85Å; K64-M131 HydrophobicContact CD-CE 3.93Å; K64-M131 HydrophobicContact CG-CE 3.89Å; K64-M131 HydrophobicContact CG-SD 4.18Å; F127-M131 HydrophobicContact CD1-CG 4.34Å; F127-M131 HydrophobicContact CD2-CG 4.4Å; F127-M131 HydrophobicContact CE1-CG 3.87Å; F127-M131 HydrophobicContact CE2-CE 4.48Å; F127-M131 HydrophobicContact CE2-CG 3.95Å; F127-M131 HydrophobicContact CE2-SD 4.27Å; F127-M131 HydrophobicContact CZ-CG 3.66Å; F127-M131 HydrophobicContact CZ-SD 3.96Å; F127-M131 WeakPolarHBondContact O-CB 3.19Å; F127-M131 WeakPolarHBondContact O-CG 3.44Å; F127-M131 PolarHBondContact O-N 2.8Å; A128-M131 PolarHBondContact O-N 2.74Å; E129-M131 VanDerWaalsContact C-N 3.32Å; E129-M131 PolarHBondContact O-N 2.82Å; M131-G135 WeakPolarHBondContact O-CA 3.36Å; M131-G135 PolarHBondContact O-N 2.91Å
132	E	88.9	Confident	71.6	Confident	169 Å²	169	93 Å²	93	79%	0.79	50%	0.495	S	S	*	.	H	α-helix	trans	-66.1	-44.1	176.1	-174.4	171.1	-172.5	0	0	111.3	A128 E129	A128-E132 PolarHBondContact O-N 3.33Å; E129-E132 PolarHBondContact O-N 3.48Å
133	K	86.8	Confident	69.5	Low	91 Å²	91	92.1 Å²	92.1	40%	0.396	51%	0.51	S	S	.	.	H	α-helix	trans	-78.9	-40.6	-174.1	-165.2	174.2	-178.1	-165	0	114.1	E57 E129	E57-K133 IonicContact OE1-NZ 3.62Å; E57-K133 PolarHBondContact OE1-NZ 3.13Å; E57-K133 IonicContact OE2-NZ 3.88Å; E57-K133 PolarHBondContact OE2-NZ 2.91Å; E129-K133 WeakPolarHBondContact O-CB 3.36Å; E129-K133 PolarHBondContact O-N 2.9Å
134	Y	84.3	Confident	66.9	Low	73 Å²	73	103.8 Å²	103.8	29%	0.286	55%	0.554	S	S	.	*	H	α-helix	trans	-129	5	-171.7	-58.3	-66.1	0	0	0	113.8	E57 F59 L130 S136	E57-Y134 PolarHBondContact OE2-OH 3.13Å; F59-Y134 HydrophobicContact CE2-CE2 4.19Å; L130-Y134 HydrophobicContact CG-CD2 4.43Å; L130-Y134 PolarHBondContact O-N 3.28Å; Y134-S136 PolarHBondContact O-N 3.41Å
135	G	73.8	Confident	64.3	Low	22 Å²	22	104.3 Å²	104.3	23%	0.227	57%	0.566	C	S	.	*	S	Bend	trans	-68.7	-24.2	178.6	0	0	0	0	0	113.9	K64 L130 M131	K64-G135 PolarHBondContact NZ-O 3.45Å; L130-G135 PolarHBondContact O-N 2.79Å; M131-G135 WeakPolarHBondContact O-CA 3.36Å; M131-G135 PolarHBondContact O-N 2.91Å
136	S	66.4	Low	61.2	Low	97 Å²	97	101 Å²	101	68%	0.678	57%	0.569	S	S	*	*			trans	-97.8	123.8	-172.5	-64.1	0	0	0	0	112.7	Y134	Y134-S136 PolarHBondContact O-N 3.41Å
137	N	48.7	Very low	58.8	Low	161 Å²	161	103.8 Å²	103.8	86%	0.861	59%	0.591	S	S	*	*			trans	-134.2	119.5	151.6	-84.8	-23	0	0	0	108.6
138	N	38.1	Very low	55.8	Low	159 Å²	159	107.5 Å²	107.5	85%	0.85	62%	0.617	S	S	*	*			trans	66.6	91.6	167.3	-69.8	2.6	0	0	0	120
139	V	33.7	Very low	52.8	Low	142 Å²	142	112.7 Å²	112.7	86%	0.861	63%	0.632	S	S	*	*				-120.2	127.2	126.2	171.9	0	0	0	0	108
140	T	31.2	Very low	49.8	Very low	120 Å²	120	115.2 Å²	115.2	74%	0.736	65%	0.648	S	S	*	*			trans	-44.2	138.2	175.8	46.9	0	0	0	0	113.4	S142	T140-S142 PolarHBondContact O-N 2.96Å; T140-S142 VanDerWaalsContact O-N 3.14Å
141	S	37.2	Very low	46.8	Very low	117 Å²	117	120 Å²	120	82%	0.818	68%	0.681	S	S	*	*			trans	-3.2	104.3	135.9	155.9	0	0	0	0	114
142	S	31.1	Very low	43.8	Very low	102 Å²	102	124 Å²	124	71%	0.713	71%	0.709	S	S	*	*				-158.8	105	125.9	-163.4	0	0	0	0	108.2	T140 R144	T140-S142 PolarHBondContact O-N 2.96Å; T140-S142 VanDerWaalsContact O-N 3.14Å; S142-R144 PolarHBondContact O-N 3.02Å
143	G	37.6	Very low	40.9	Very low	69 Å²	69	119.5 Å²	119.5	71%	0.711	71%	0.708	S	S	*	*			trans	-56.3	131.4	152.8	0	0	0	0	0	108.3
144	R	29.9	Very low	38.2	Very low	245 Å²	245	124.6 Å²	124.6	93%	0.925	73%	0.73	S	S	*	*			trans	-164.2	118.7	140.1	-105.2	167.3	-166.4	-147.6	4	108.8	S142	S142-R144 PolarHBondContact O-N 3.02Å
145	I	31.3	Very low	35.6	Very low	157 Å²	157	128.1 Å²	128.1	81%	0.805	75%	0.753	S	S	*	*			trans	-80.8	136	174.8	-19.4	176.6	0	0	0	106.7
146	S	23.2	Very low	33.6	Very low	102 Å²	102	133 Å²	133	71%	0.713	78%	0.779	S	S	*	*			trans	77.5	165.2	151.8	-45.5	0	0	0	0	118.3
147	P	39.8	Very low	31.8	Very low	109 Å²	109	134.9 Å²	134.9	71%	0.708	78%	0.782	S	S	*	*			cis	-136.7	166.5	-14.1	12.6	14.2	0	0	0	115.5
148	T	27.6	Very low	30.9	Very low	112 Å²	112	133.4 Å²	133.4	69%	0.687	78%	0.778	S	S	*	*			trans	43.4	131.9	137.4	-29.9	0	0	0	0	121.2
149	Q	27.2	Very low	30.4	Very low	164 Å²	164	130 Å²	130	77%	0.766	77%	0.772	S	S	*	*				171.9	134.7	111.5	-84.7	-57.5	-19.2	0	0	112.7
150	L	29	Very low	30.3	Very low	157 Å²	157	128.5 Å²	128.5	82%	0.822	77%	0.768	S	S	*	*			trans	-59.2	142.4	165	-76.4	83.6	0	0	0	110.3
151	S	25.9	Very low	30.1	Very low	101 Å²	101	127.8 Å²	127.8	71%	0.706	77%	0.768	S	S	*	*				-175.3	123.4	129.4	-151.4	0	0	0	0	113.4
152	T	27.9	Very low	29.7	Very low	134 Å²	134	127.5 Å²	127.5	82%	0.822	77%	0.766	S	S	*	*			trans	48.2	129.6	135.2	61.1	0	0	0	0	122.6
153	G	28.9	Very low	29.7	Very low	76 Å²	76	128.4 Å²	128.4	78%	0.784	77%	0.772	S	S	*	*			trans	132.3	98.4	131.6	0	0	0	0	0	119.5
154	K	29.3	Very low	29.4	Very low	197 Å²	197	129.7 Å²	129.7	86%	0.857	77%	0.771	S	S	*	*			trans	68.4	115	130.7	-111.8	175.7	175.7	-177.5	0	122.9
155	L	29.7	Very low	29.3	Very low	147 Å²	147	122.4 Å²	122.4	77%	0.77	76%	0.757	S	S	*	*				27.5	123.3	129.5	-52.6	172.9	0	0	0	120.5
156	T	31.1	Very low	29.3	Very low	124 Å²	124	125.4 Å²	125.4	76%	0.761	76%	0.758	S	S	*	*				161.3	136.1	100.2	47.9	0	0	0	0	112.4
157	D	29.6	Very low	29.8	Very low	138 Å²	138	125.7 Å²	125.7	74%	0.738	76%	0.76	S	S	*	*			trans	62.2	118.8	138.3	-59	-23.1	0	0	0	124.7
158	T	30	Very low	29.2	Very low	129 Å²	129	129.2 Å²	129.2	79%	0.791	77%	0.767	S	S	*	*				63.7	129.4	127.9	62	0	0	0	0	123.3
159	A	27.5	Very low	29.2	Very low	87 Å²	87	129 Å²	129	72%	0.719	77%	0.771	S	S	*	*			trans	76.3	116.2	135.9	0	0	0	0	0	120.6
160	S	31	Very low	29.7	Very low	111 Å²	111	127.6 Å²	127.6	78%	0.776	78%	0.775	S	S	*	*				49.6	123.1	128.1	-50.8	0	0	0	0	120.7
161	S	28.1	Very low	29.7	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	77%	0.773	S	S	*	*				157.1	117.8	116.5	-68.7	0	0	0	0	109.4
162	S	27.8	Very low	30	Very low	110 Å²	110	130 Å²	130	77%	0.769	78%	0.775	S	S	*	*				64.5	98.2	88.4	-52.9	0	0	0	0	114.6
163	S	31.7	Very low	29.9	Very low	121 Å²	121	131.7 Å²	131.7	85%	0.846	78%	0.778	S	S	*	*			trans	65.3	137.8	131.8	-55.6	0	0	0	0	123.2
164	S	30.3	Very low	29.9	Very low	97 Å²	97	133.1 Å²	133.1	68%	0.678	78%	0.776	S	S	*	*			trans	90.9	120.8	140.3	-167.1	0	0	0	0	119.7
165	S	29	Very low	31	Very low	91 Å²	91	129.2 Å²	129.2	64%	0.636	77%	0.771	S	S	*	*				172.1	126.5	104.7	-72.7	0	0	0	0	110.5
166	R	30.6	Very low	30.9	Very low	221 Å²	221	130.1 Å²	130.1	83%	0.834	77%	0.768	S	S	*	*				63.3	110	106.2	-63.8	178.7	146.8	139.4	-4.7	113.5
167	S	33.6	Very low	30.7	Very low	107 Å²	107	131.9 Å²	131.9	75%	0.748	77%	0.768	S	S	*	*				117	155.5	98.5	59.7	0	0	0	0	107.4
168	E	27.8	Very low	30.5	Very low	183 Å²	183	128.8 Å²	128.8	86%	0.855	77%	0.769	S	S	*	*			cis	-155.2	165.8	24.9	-75.1	178.6	105.9	0	0	111
169	S	26.7	Very low	30.2	Very low	109 Å²	109	130.2 Å²	130.2	76%	0.762	77%	0.77	S	S	*	*			trans	-64.2	179.9	166.8	-49.6	0	0	0	0	113.7
170	P	38.6	Very low	30.3	Very low	133 Å²	133	132.6 Å²	132.6	86%	0.864	78%	0.776	S	S	*	*				-140.4	160.6	104.8	35.2	-20.8	0	0	0	115
171	Q	28.8	Very low	29.9	Very low	168 Å²	168	130.9 Å²	130.9	79%	0.785	77%	0.768	S	S	*	*			trans	-130	148	178.4	-121.9	-159.5	10.7	0	0	110.9
172	L	31.2	Very low	29.9	Very low	141 Å²	141	136.3 Å²	136.3	74%	0.738	77%	0.774	S	S	*	*			trans	81.3	131.6	152.8	-61.1	175.8	0	0	0	121.4
173	L	26.1	Very low	29.7	Very low	170 Å²	170	135.6 Å²	135.6	89%	0.89	77%	0.769	S	S	*	*				-163.5	140.4	121	-95.9	160.4	0	0	0	111.2
174	S	29.7	Very low	29.5	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	77%	0.769	S	S	*	*			trans	-136	179.2	160.3	-52.5	0	0	0	0	105.8
175	P	52	Low	29.6	Very low	115 Å²	115	138 Å²	138	75%	0.747	77%	0.771	S	S	*	*			cis	-134.2	166.6	-22.2	35	-16.5	0	0	0	114.2
176	K	28.3	Very low	29.9	Very low	166 Å²	166	138.2 Å²	138.2	72%	0.722	77%	0.77	S	S	*	*			trans	156.9	132.2	133.8	-93.9	-175	159.5	-147.6	0	117.3
177	E	26.5	Very low	29.6	Very low	162 Å²	162	134.8 Å²	134.8	76%	0.757	76%	0.763	S	S	*	*			trans	48	127.5	137.3	-66.8	151.4	-172.4	0	0	122.8
178	G	24.6	Very low	29.3	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	77%	0.767	S	S	*	*			trans	140.9	88.2	146.4	0	0	0	0	0	120.3
179	I	25.3	Very low	29.2	Very low	159 Å²	159	134.6 Å²	134.6	82%	0.815	76%	0.756	S	S	*	*			trans	33.1	114.3	135.3	-52.6	157.7	0	0	0	120.3
180	T	28.2	Very low	29.1	Very low	137 Å²	137	135.9 Å²	135.9	84%	0.84	76%	0.759	S	S	*	*				176.2	145.4	108.8	38.5	0	0	0	0	112.4
181	A	23.2	Very low	28.5	Very low	75 Å²	75	135.5 Å²	135.5	62%	0.62	75%	0.754	S	S	*	*			trans	-56.1	157.4	178	0	0	0	0	0	116.5
182	Y	27.5	Very low	28.7	Very low	219 Å²	219	132.8 Å²	132.8	86%	0.859	75%	0.751	S	S	*	*				-175	107.9	115.3	-81	-66.3	0	0	0	107.2
183	S	24.8	Very low	28.6	Very low	95 Å²	95	129.9 Å²	129.9	66%	0.664	75%	0.748	S	S	*	*				53.3	109.5	107.1	-53.1	0	0	0	0	112.9
184	H	27.7	Very low	28.5	Very low	184 Å²	184	132 Å²	132	85%	0.852	75%	0.745	S	S	*	*				-157.5	125.6	65.9	-88.5	-91.4	0	0	0	112.2
185	A	30.8	Very low	28.7	Very low	86 Å²	86	132.9 Å²	132.9	71%	0.711	75%	0.747	S	S	*	*			trans	-102.6	165	135.8	0	0	0	0	0	105.3
186	P	35.6	Very low	27.5	Very low	94 Å²	94	133.4 Å²	133.4	61%	0.61	75%	0.748	S	S	*	*				-162.5	-160.6	57.4	51	-29.9	0	0	0	114.5
187	H	25.2	Very low	27.5	Very low	150 Å²	150	134.2 Å²	134.2	69%	0.694	75%	0.754	S	S	*	*			cis	-152.6	137.7	-2.3	-99.3	-59.3	0	0	0	107.4
188	Y	27.3	Very low	27.4	Very low	210 Å²	210	132.3 Å²	132.3	82%	0.824	75%	0.753	S	S	*	*				44.6	152.2	128.2	-64.6	-106.1	0	0	0	121.3
189	A	26.3	Very low	27.5	Very low	76 Å²	76	134 Å²	134	63%	0.628	75%	0.751	S	S	*	*			cis	175.2	174.8	-11.8	0	0	0	0	0	105.7
190	T	23.7	Very low	27.5	Very low	136 Å²	136	131.1 Å²	131.1	83%	0.834	75%	0.751	S	S	*	*			trans	113.6	100.8	149.2	-40.9	0	0	0	0	115.5
191	T	26.3	Very low	27.4	Very low	124 Å²	124	132.6 Å²	132.6	76%	0.761	75%	0.748	S	S	*	*			trans	-50.7	156.4	153.8	-8.7	0	0	0	0	111.5
192	P	33.5	Very low	27.7	Very low	112 Å²	112	132.1 Å²	132.1	73%	0.727	74%	0.744	S	S	*	*				-146.9	170.4	80.9	32.4	-10.9	0	0	0	115.6
193	A	28	Very low	27.8	Very low	80 Å²	80	130.4 Å²	130.4	66%	0.661	74%	0.741	S	S	*	*			trans	-63.4	142.1	-178.4	0	0	0	0	0	114.4
194	Y	25.1	Very low	28.4	Very low	213 Å²	213	130.4 Å²	130.4	84%	0.835	74%	0.741	S	S	*	*			trans	-145.5	127.9	142.6	-73.5	-73.8	0	0	0	110.5
195	T	33.6	Very low	29	Very low	125 Å²	125	128.3 Å²	128.3	77%	0.767	74%	0.736	S	S	*	*			trans	-46.8	128	165.9	42.1	0	0	0	0	112.7
196	V	25.1	Very low	29.9	Very low	126 Å²	126	128.3 Å²	128.3	76%	0.764	73%	0.731	S	S	*	*			trans	-131.3	104.1	157.4	-179.7	0	0	0	0	107.9
197	H	28.8	Very low	31.6	Very low	183 Å²	183	128 Å²	128	85%	0.847	73%	0.727	S	S	*	*			trans	-66.4	129.7	160.8	-81.3	-79.9	0	0	0	108.9
198	T	24.1	Very low	34.2	Very low	121 Å²	121	123.7 Å²	123.7	74%	0.742	71%	0.709	S	S	*	*			trans	-141.5	134.2	157.5	-8.6	0	0	0	0	108.3
199	P	27.5	Very low	36.8	Very low	109 Å²	109	117.7 Å²	117.7	71%	0.708	69%	0.688	S	S	*	*			trans	-82.3	138.2	-152.3	32.7	-31.8	0	0	0	111.5	H201	P199-H201 PolarHBondContact O-N 3.37Å; P199-H201 VanDerWaalsContact O-N 3.16Å
200	A	25.1	Very low	39.6	Very low	99 Å²	99	118.8 Å²	118.8	82%	0.818	68%	0.683	S	S	*	*			trans	-60.5	115.8	167.3	0	0	0	0	0	109.2	A202	A200-A202 PolarHBondContact O-N 3.03Å; A200-A202 VanDerWaalsContact O-N 3.08Å
201	H	27.5	Very low	42.6	Very low	168 Å²	168	112.8 Å²	112.8	78%	0.778	65%	0.645	S	S	*	*			trans	-61.1	108.4	168	-95.6	-87.5	0	0	0	108.9	P199 F203	P199-H201 PolarHBondContact O-N 3.37Å; P199-H201 VanDerWaalsContact O-N 3.16Å; H201-F203 PolarHBondContact O-N 3.29Å
202	A	29	Very low	45.6	Very low	64 Å²	64	110.2 Å²	110.2	53%	0.529	63%	0.632	S	S	.	*			trans	-76.1	106.9	174.7	0	0	0	0	0	109.8	A200	A200-A202 PolarHBondContact O-N 3.03Å; A200-A202 VanDerWaalsContact O-N 3.08Å
203	F	28.4	Very low	48.2	Very low	184 Å²	184	104.9 Å²	104.9	81%	0.807	60%	0.597	S	S	*	*			trans	-86.6	136.1	155.5	-71.7	-82.1	0	0	0	108.7	H201 D205	H201-F203 PolarHBondContact O-N 3.29Å; F203-D205 PolarHBondContact O-N 3.29Å
204	S	38.4	Very low	50.9	Low	94 Å²	94	104.6 Å²	104.6	66%	0.657	59%	0.594	S	S	*	*			trans	-87.8	91.7	-167.9	46.8	0	0	0	0	111.9
205	D	39.3	Very low	53.6	Low	140 Å²	140	97.3 Å²	97.3	75%	0.749	57%	0.567	S	S	*	*			trans	-93	113.9	166.7	-75.1	-29.3	0	0	0	110.4	F203 V207	F203-D205 PolarHBondContact O-N 3.29Å; D205-V207 HydrophobicContact CB-CG2 3.59Å; D205-V207 PolarHBondContact O-N 2.79Å
206	S	51.4	Low	55.8	Low	87 Å²	87	94.3 Å²	94.3	61%	0.608	56%	0.562	S	S	*	*			trans	-78.2	68.2	168.5	-62.2	0	0	0	0	109.4
207	V	70.9	Confident	58.3	Low	87 Å²	87	93 Å²	93	53%	0.527	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-73.6	134.4	-179.3	-172.8	0	0	0	0	110.4	D205 Q209	D205-V207 HydrophobicContact CB-CG2 3.59Å; D205-V207 PolarHBondContact O-N 2.79Å; V207-Q209 PolarHBondContact O-N 3.42Å
208	I	79.3	Confident	60.9	Low	60 Å²	60	84.6 Å²	84.6	31%	0.308	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	121.9	170.4	-60.1	170.9	0	0	0	108.3	W19 A292 I294	W19-I208 HydrophobicContact CE3-CD1 4.16Å; I208-A292 HydrophobicContact CG2-CB 4.12Å; I208-I294 HydrophobicContact CB-CG1 4.4Å; I208-I294 HydrophobicContact CG1-CD1 3.95Å; I208-I294 HydrophobicContact CG1-CG1 3.7Å
209	Q	81.9	Confident	63.9	Low	83 Å²	83	79.2 Å²	79.2	39%	0.388	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	141	178	-65.2	176.2	36.2	0	0	109.9	V207 A292 F293	V207-Q209 PolarHBondContact O-N 3.42Å; Q209-A292 CarbonylContact O-C 3.32Å; Q209-A292 VanDerWaalsContact O-CA 3.29Å; Q209-A292 WeakPolarHBondContact O-CA 3.25Å; Q209-F293 HydrophobicContact CB-CD1 4.2Å; Q209-F293 HydrophobicContact CB-CE1 3.74Å; Q209-F293 HydrophobicContact CB-CE2 4.22Å; Q209-F293 HydrophobicContact CB-CZ 3.75Å; Q209-F293 HydrophobicContact CG-CZ 4.49Å; Q209-F293 PolarHBondContact N-O 3.28Å; Q209-F293 PolarHBondContact O-N 2.93Å
210	L	83.9	Confident	66.8	Low	99 Å²	99	74.6 Å²	74.6	52%	0.518	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.3	179	-169.5	65.7	0	0	0	110.2	E290 A292	L210-E290 HydrophobicContact CD1-CG 3.53Å; L210-E290 HydrophobicContact CD2-CG 4.34Å; L210-E290 WeakPolarHBondContact CD2-OE1 3.29Å; L210-E290 HydrophobicContact CG-CG 4.1Å; L210-A292 HydrophobicContact CD1-CB 3.9Å
211	I	86.6	Confident	70	Confident	10 Å²	10	70.8 Å²	70.8	5%	0.051	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	149	175.2	61.1	167.2	0	0	0	111	V213 R251 L252 E290 I291 F293	I211-V213 HydrophobicContact CD1-CG2 3.81Å; I211-V213 HydrophobicContact CG1-CG2 4.31Å; I211-R251 HydrophobicContact CD1-CB 4.39Å; I211-R251 HydrophobicContact CG2-CB 4.34Å; I211-L252 HydrophobicContact CD1-CD1 3.91Å; I211-L252 HydrophobicContact CD1-CD2 3.74Å; I211-L252 HydrophobicContact CD1-CG 3.5Å; I211-L252 VanDerWaalsContact CD1-CG 3.5Å; I211-E290 CarbonylContact O-C 3.55Å; I211-E290 WeakPolarHBondContact O-CA 3.39Å; I211-I291 HydrophobicContact CD1-CB 4.4Å; I211-I291 HydrophobicContact CG1-CB 3.9Å; I211-I291 WeakPolarHBondContact CG1-O 3.26Å; I211-I291 PolarHBondContact N-O 3.38Å; I211-I291 PolarHBondContact O-N 3.35Å; I211-F293 HydrophobicContact CD1-CE1 4.22Å; I211-F293 HydrophobicContact CG1-CD1 4.42Å; I211-F293 HydrophobicContact CG1-CE1 4.15Å; I211-F293 HydrophobicContact CG2-CE1 3.88Å
212	C	89.3	Confident	73	Confident	70 Å²	70	65 Å²	65	47%	0.473	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.7	169	-62.1	0	0	0	0	109.1	R251 V289	C212-R251 PolarHBondContact O-NH2 2.92Å; C212-V289 CarbonylContact C-O 3.48Å; C212-V289 WeakPolarHBondContact CA-O 3.36Å
213	V	88.9	Confident	76.1	Confident	1 Å²	1	62 Å²	62	1%	0.006	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.6	-179.5	-179.4	0	0	0	0	109	I211 K215 D245 D249 T288 V289 I291	I211-V213 HydrophobicContact CD1-CG2 3.81Å; I211-V213 HydrophobicContact CG1-CG2 4.31Å; V213-K215 PolarHBondContact O-N 2.85Å; V213-D245 HydrophobicContact CG1-CB 3.84Å; V213-D249 HydrophobicContact CG1-CB 4.11Å; V213-D249 HydrophobicContact CG2-CB 4.25Å; V213-T288 CarbonylContact O-C 3.55Å; V213-T288 WeakPolarHBondContact O-CA 3.13Å; V213-V289 PolarHBondContact N-O 3.02Å; V213-V289 PolarHBondContact O-N 3.48Å; V213-I291 HydrophobicContact CG2-CD1 4.08Å
214	A	84.1	Confident	79	Confident	73 Å²	73	57 Å²	57	60%	0.603	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	131.9	175.4	0	0	0	0	0	110.5
215	K	82.6	Confident	81.4	Confident	60 Å²	60	52.5 Å²	52.5	26%	0.261	32%	0.32	S	S	.	.			trans	-82.8	128.9	-177.1	-175.6	178.4	172.3	170.6	0	111	V213 T281 K282 R284 D286 P287 V289	V213-K215 PolarHBondContact O-N 2.85Å; K215-T281 PolarHBondContact NZ-O 3.07Å; K215-K282 VanDerWaalsContact CE-O 3.32Å; K215-K282 WeakPolarHBondContact CE-O 3.38Å; K215-K282 PolarHBondContact NZ-O 2.77Å; K215-R284 PolarHBondContact NZ-O 2.71Å; K215-D286 WeakPolarHBondContact CD-O 3.36Å; K215-P287 WeakPolarHBondContact CB-O 3.49Å; K215-P287 PolarHBondContact N-O 3.04Å; K215-V289 HydrophobicContact CB-CG2 4.44Å
216	G	80.7	Confident	83.5	Confident	63 Å²	63	45.9 Å²	45.9	65%	0.649	28%	0.284	S	S	*	.	S	Bend	trans	-140.3	-77.4	176.5	0	0	0	0	0	112.4	D245	G216-D245 PolarHBondContact N-OD1 3.06Å; G216-D245 PolarHBondContact N-OD2 3.28Å
217	T	77.3	Confident	84.9	Confident	99 Å²	99	44.5 Å²	44.5	61%	0.607	28%	0.278	S	S	*	.	S	Bend	trans	-100	-10.9	-174.5	37.5	0	0	0	0	113.2	G243 D245 K248	T217-G243 PolarHBondContact OG1-O 2.92Å; T217-D245 PolarHBondContact N-OD1 3.31Å; T217-D245 PolarHBondContact N-OD2 2.81Å; T217-D245 PolarHBondContact OG1-OD1 2.74Å; T217-K248 PolarHBondContact OG1-NZ 2.95Å
218	G	83.2	Confident	85.5	Confident	6 Å²	6	44 Å²	44	6%	0.062	27%	0.273	C	S	.	.			trans	114.8	151.7	-173.7	0	0	0	0	0	111	G220 D245	G218-G220 PolarHBondContact O-N 3.45Å; G218-D245 VanDerWaalsContact C-OD2 3.24Å; G218-D245 WeakPolarHBondContact CA-OD2 3.49Å; G218-D245 PolarHBondContact N-OD2 2.79Å; G218-D245 VanDerWaalsContact O-CG 3.26Å; G218-D245 PolarHBondContact O-N 3.07Å
219	L	87.2	Confident	85.6	Confident	7 Å²	7	47 Å²	47	4%	0.037	28%	0.28	C	S	.	.			trans	-54.6	-31.8	-173	-63.7	-179.4	0	0	0	114.4	L221 C246 I261 L278 T281 V289 I291	L219-L221 VanDerWaalsContact C-N 3.33Å; L219-L221 HydrophobicContact CB-CD1 4.46Å; L219-L221 HydrophobicContact CB-CG 4.25Å; L219-L221 PolarHBondContact O-N 2.84Å; L219-C246 WeakPolarHBondContact O-CB 3.5Å; L219-C246 PolarHBondContact O-N 3.08Å; L219-C246 VanDerWaalsContact O-N 3.13Å; L219-C246 PolarHBondContact O-SG 2.68Å; L219-I261 HydrophobicContact CD1-CD1 4.33Å; L219-I261 HydrophobicContact CD1-CG2 4.13Å; L219-L278 HydrophobicContact CD1-CD2 3.94Å; L219-T281 HydrophobicContact CD1-CG2 3.82Å; L219-T281 HydrophobicContact CG-CG2 4.26Å; L219-V289 HydrophobicContact CD1-CG1 4Å; L219-V289 HydrophobicContact CD2-CB 3.85Å; L219-V289 HydrophobicContact CD2-CG1 3.81Å; L219-V289 HydrophobicContact CD2-CG2 3.92Å; L219-V289 HydrophobicContact CG-CG1 4.43Å; L219-I291 HydrophobicContact CD1-CD1 4.38Å; L219-I291 HydrophobicContact CD2-CD1 4.13Å
220	G	88.5	Confident	85.1	Confident	13 Å²	13	48.8 Å²	48.8	13%	0.134	31%	0.309	C	S	.	.			trans	65.7	35.1	178.2	0	0	0	0	0	113	G218 I240 V241	G218-G220 PolarHBondContact O-N 3.45Å; G220-I240 CarbonylContact O-C 3.55Å; G220-I240 WeakPolarHBondContact O-CA 3.41Å; G220-V241 WeakPolarHBondContact O-CB 3.4Å; G220-V241 PolarHBondContact O-N 3.26Å
221	L	92.1	Very high	84.6	Confident	19 Å²	19	49.5 Å²	49.5	10%	0.099	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	130	176.9	-61.3	178.8	0	0	0	110.4	L219 I237 I240 C246 L252 L258 L278 I291	L219-L221 VanDerWaalsContact C-N 3.33Å; L219-L221 HydrophobicContact CB-CD1 4.46Å; L219-L221 HydrophobicContact CB-CG 4.25Å; L219-L221 PolarHBondContact O-N 2.84Å; L221-I237 HydrophobicContact CD2-CD1 4.07Å; L221-I237 HydrophobicContact CD2-CG2 4.32Å; L221-I240 HydrophobicContact CD2-CG1 4.14Å; L221-C246 HydrophobicContact CD2-CB 3.66Å; L221-C246 HydrophobicContact CG-CB 4.15Å; L221-L252 HydrophobicContact CD1-CD1 4.06Å; L221-L252 HydrophobicContact CD2-CD1 4.16Å; L221-L258 HydrophobicContact CD1-CD1 4.4Å; L221-L278 HydrophobicContact CB-CD2 4.16Å; L221-L278 HydrophobicContact CD1-CD2 4.16Å; L221-I291 HydrophobicContact CD1-CD1 4.37Å
222	V	90.6	Very high	83.9	Confident	45 Å²	45	50.1 Å²	50.1	27%	0.273	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.5	166.8	-175.1	0	0	0	0	107.5	Q238 E239 V241	V222-Q238 HydrophobicContact CG1-CB 4.33Å; V222-Q238 PolarHBondContact O-N 3.46Å; V222-E239 HydrophobicContact CB-CB 3.91Å; V222-E239 HydrophobicContact CG2-CB 4.06Å; V222-E239 PolarHBondContact N-O 3Å; V222-E239 PolarHBondContact O-N 3.05Å; V222-V241 HydrophobicContact CG2-CG2 3.81Å
223	V	93.3	Very high	83.4	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	146.3	-174.6	-63.6	0	0	0	0	113	V235 F236 L258 A274 R275 L278	V223-V235 HydrophobicContact CB-CG1 3.74Å; V223-V235 HydrophobicContact CG1-CG1 4.03Å; V223-V235 HydrophobicContact CG2-CG1 4.18Å; V223-F236 CarbonylContact C-O 3.43Å; V223-F236 VanDerWaalsContact CA-O 3.25Å; V223-F236 WeakPolarHBondContact CA-O 3.28Å; V223-L258 HydrophobicContact CG1-CD1 3.48Å; V223-L258 VanDerWaalsContact CG1-CD1 3.48Å; V223-A274 HydrophobicContact CG2-CB 4.31Å; V223-R275 HydrophobicContact CG2-CG 4.19Å; V223-L278 HydrophobicContact CB-CD1 4.29Å; V223-L278 HydrophobicContact CG1-CD1 3.6Å; V223-L278 HydrophobicContact CG2-CD1 3.66Å
224	K	89.9	Confident	83.1	Confident	77 Å²	77	53.1 Å²	53.1	34%	0.335	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	170	174.6	70.7	176.3	-177.9	173.1	0	110.9	E231 V235 F236 Q238	K224-E231 VanDerWaalsContact CB-OE2 3.28Å; K224-E231 WeakPolarHBondContact CB-OE2 3.29Å; K224-E231 WeakPolarHBondContact CG-OE2 3.43Å; K224-V235 WeakPolarHBondContact O-CA 3.28Å; K224-F236 HydrophobicContact CG-CB 4.11Å; K224-F236 PolarHBondContact N-O 3.13Å; K224-F236 PolarHBondContact O-N 2.76Å; K224-Q238 HydrophobicContact CB-CB 4.05Å; K224-Q238 HydrophobicContact CD-CB 4.06Å; K224-Q238 HydrophobicContact CD-CG 4.17Å; K224-Q238 HydrophobicContact CG-CB 3.99Å
225	G	87.9	Confident	83.4	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74	-171.8	-170.6	0	0	0	0	0	114.6	E231 M234 N271	G225-E231 PolarHBondContact N-OE2 3.47Å; G225-M234 CarbonylContact C-O 3.51Å; G225-M234 WeakPolarHBondContact CA-O 3.45Å; G225-N271 WeakPolarHBondContact O-CB 3.38Å; G225-N271 PolarHBondContact O-ND2 2.85Å
226	G	83.8	Confident	83.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	30%	0.298	C	S	.	.			trans	120.8	157.9	-173.1	0	0	0	0	0	112	N228 R229 G232 M234 V269	G226-N228 PolarHBondContact O-N 3.1Å; G226-R229 PolarHBondContact O-N 3.36Å; G226-G232 CarbonylContact C-O 3.57Å; G226-G232 PolarHBondContact N-O 2.82Å; G226-M234 PolarHBondContact N-O 3.4Å; G226-V269 CarbonylContact C-O 3.43Å; G226-V269 VanDerWaalsContact CA-O 3.26Å; G226-V269 WeakPolarHBondContact CA-O 3.46Å
227	A	81.2	Confident	84.5	Confident	59 Å²	59	45.2 Å²	45.2	49%	0.488	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-17.9	-168.4	0	0	0	0	0	115.4	G268 V269	A227-G268 WeakPolarHBondContact CB-O 3.33Å; A227-V269 PolarHBondContact N-O 2.87Å
228	N	83.3	Confident	85.2	Confident	77 Å²	77	45 Å²	45	41%	0.412	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	11.6	-179.8	67.2	-21.5	0	0	0	114.6	G226 T270 N271 E272	G226-N228 PolarHBondContact O-N 3.1Å; N228-T270 HydrophobicContact CB-CG2 4.19Å; N228-N271 PolarHBondContact OD1-N 2.89Å; N228-E272 PolarHBondContact ND2-OE2 3.08Å
229	R	80.9	Confident	85.6	Confident	123 Å²	123	49.5 Å²	49.5	46%	0.464	28%	0.279	S	S	.	.	S	Bend	trans	-115.8	149.2	178.7	-61.8	-67.3	175.9	176.2	-6.5	111.1	G226 E231 G232 N271 E272	G226-R229 PolarHBondContact O-N 3.36Å; R229-E231 PolarHBondContact O-N 3.29Å; R229-E231 VanDerWaalsContact O-N 3.09Å; R229-G232 PolarHBondContact O-N 3.42Å; R229-G232 VanDerWaalsContact O-N 3.17Å; R229-N271 HydrophobicContact CG-CB 3.89Å; R229-E272 IonicContact CZ-OE1 2.96Å; R229-E272 IonicContact NH2-OE1 3.06Å; R229-E272 PolarHBondContact NH2-OE1 3.29Å
230	A	71.6	Confident	85.9	Confident	119 Å²	119	50.5 Å²	50.5	98%	0.983	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.4	178.5	0	0	0	0	0	114	G232	A230-G232 PolarHBondContact O-N 3.07Å
231	E	72.9	Confident	86	Confident	114 Å²	114	52.7 Å²	52.7	53%	0.533	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-5	177.9	-60.5	176.5	-176.4	0	0	113.5	K224 G225 R229	K224-E231 VanDerWaalsContact CB-OE2 3.28Å; K224-E231 WeakPolarHBondContact CB-OE2 3.29Å; K224-E231 WeakPolarHBondContact CG-OE2 3.43Å; G225-E231 PolarHBondContact N-OE2 3.47Å; R229-E231 PolarHBondContact O-N 3.29Å; R229-E231 VanDerWaalsContact O-N 3.09Å
232	G	72.6	Confident	85.8	Confident	23 Å²	23	56.3 Å²	56.3	24%	0.237	32%	0.319	C	S	.	.			trans	99.7	169.8	176.6	0	0	0	0	0	114.3	G226 R229 A230 M234	G226-G232 CarbonylContact C-O 3.57Å; G226-G232 PolarHBondContact N-O 2.82Å; R229-G232 PolarHBondContact O-N 3.42Å; R229-G232 VanDerWaalsContact O-N 3.17Å; A230-G232 PolarHBondContact O-N 3.07Å; G232-M234 PolarHBondContact O-N 3.39Å
233	P	78.4	Confident	85.5	Confident	78 Å²	78	56.1 Å²	56.1	51%	0.506	33%	0.326	S	S	.	.	S	Bend	trans	-72.1	-2.2	-169.3	30.7	-37	0	0	0	114.7	G268	P233-G268 PolarHBondContact O-N 3.1Å
234	M	83.6	Confident	85.3	Confident	57 Å²	57	56.2 Å²	56.2	28%	0.281	33%	0.327	S	S	.	.			trans	-94.5	140	-174.9	-61.3	165.5	81.9	0	0	110	G225 G226 G232 F236 Q257	G225-M234 CarbonylContact C-O 3.51Å; G225-M234 WeakPolarHBondContact CA-O 3.45Å; G226-M234 PolarHBondContact N-O 3.4Å; G232-M234 PolarHBondContact O-N 3.39Å; M234-F236 HydrophobicContact CB-CD2 4.38Å; M234-F236 HydrophobicContact CB-CE1 4.38Å; M234-F236 HydrophobicContact CB-CE2 3.51Å; M234-F236 HydrophobicContact CB-CZ 3.49Å; M234-F236 VanDerWaalsContact CB-CZ 3.49Å; M234-F236 HydrophobicContact CE-CE1 4.46Å; M234-F236 HydrophobicContact CE-CZ 4.11Å; M234-F236 HydrophobicContact CG-CZ 4.38Å; M234-F236 WeakPolarHBondContact O-CD2 3.22Å; M234-F236 HydrophobicContact SD-CZ 4.09Å; M234-Q257 HydrophobicContact CE-CG 4.21Å
235	V	90.8	Very high	85.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.1	179	-178.9	0	0	0	0	109.4	V223 K224 L258 L266 V269 A274	V223-V235 HydrophobicContact CB-CG1 3.74Å; V223-V235 HydrophobicContact CG1-CG1 4.03Å; V223-V235 HydrophobicContact CG2-CG1 4.18Å; K224-V235 WeakPolarHBondContact O-CA 3.28Å; V235-L258 HydrophobicContact CG1-CD1 4.44Å; V235-L258 PolarHBondContact O-N 2.96Å; V235-L266 HydrophobicContact CB-CB 4.47Å; V235-L266 HydrophobicContact CG2-CB 4.48Å; V235-L266 WeakPolarHBondContact CG2-O 3.31Å; V235-V269 HydrophobicContact CG2-CG2 3.99Å; V235-A274 HydrophobicContact CG1-CB 4.1Å; V235-A274 HydrophobicContact CG2-CB 4.03Å
236	F	92.6	Very high	85.4	Confident	30 Å²	30	52.9 Å²	52.9	13%	0.132	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	149.1	-178.5	-57.8	-83.2	0	0	0	111.6	V223 K224 M234 Q238 D256 Q257	V223-F236 CarbonylContact C-O 3.43Å; V223-F236 VanDerWaalsContact CA-O 3.25Å; V223-F236 WeakPolarHBondContact CA-O 3.28Å; K224-F236 HydrophobicContact CG-CB 4.11Å; K224-F236 PolarHBondContact N-O 3.13Å; K224-F236 PolarHBondContact O-N 2.76Å; M234-F236 HydrophobicContact CB-CD2 4.38Å; M234-F236 HydrophobicContact CB-CE1 4.38Å; M234-F236 HydrophobicContact CB-CE2 3.51Å; M234-F236 HydrophobicContact CB-CZ 3.49Å; M234-F236 VanDerWaalsContact CB-CZ 3.49Å; M234-F236 HydrophobicContact CE-CE1 4.46Å; M234-F236 HydrophobicContact CE-CZ 4.11Å; M234-F236 HydrophobicContact CG-CZ 4.38Å; M234-F236 WeakPolarHBondContact O-CD2 3.22Å; M234-F236 HydrophobicContact SD-CZ 4.09Å; F236-Q238 PolarHBondContact O-N 3.22Å; F236-D256 CarbonylContact C-O 3.59Å; F236-D256 WeakPolarHBondContact CA-O 3.49Å; F236-Q257 HydrophobicContact CD1-CB 3.78Å; F236-Q257 HydrophobicContact CD1-CG 4.18Å; F236-Q257 HydrophobicContact CE1-CB 3.73Å; F236-Q257 HydrophobicContact CE1-CG 3.91Å
237	I	93.5	Very high	85.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	113.9	169.6	-55.9	-177	0	0	0	108.4	L221 I240 L252 G255 D256 L258	L221-I237 HydrophobicContact CD2-CD1 4.07Å; L221-I237 HydrophobicContact CD2-CG2 4.32Å; I237-I240 HydrophobicContact CG2-CD1 4.46Å; I237-I240 HydrophobicContact CG2-CG1 3.78Å; I237-L252 HydrophobicContact CD1-CB 4.04Å; I237-L252 HydrophobicContact CD1-CD1 4.17Å; I237-L252 HydrophobicContact CD1-CD2 4.19Å; I237-L252 HydrophobicContact CD1-CG 4.36Å; I237-G255 PolarHBondContact O-N 3.05Å; I237-D256 HydrophobicContact CD1-CB 3.9Å; I237-D256 HydrophobicContact CG1-CB 4.3Å; I237-D256 PolarHBondContact N-O 2.92Å; I237-L258 HydrophobicContact CD1-CD2 3.88Å; I237-L258 HydrophobicContact CD1-CG 4.39Å; I237-L258 HydrophobicContact CG1-CD1 4.06Å; I237-L258 HydrophobicContact CG1-CD2 3.89Å; I237-L258 HydrophobicContact CG1-CG 3.83Å
238	Q	90.6	Very high	86	Confident	93 Å²	93	61 Å²	61	44%	0.435	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-41.9	174.7	-178.1	165.7	31.8	0	0	111.7	V222 K224 F236 V254	V222-Q238 HydrophobicContact CG1-CB 4.33Å; V222-Q238 PolarHBondContact O-N 3.46Å; K224-Q238 HydrophobicContact CB-CB 4.05Å; K224-Q238 HydrophobicContact CD-CB 4.06Å; K224-Q238 HydrophobicContact CD-CG 4.17Å; K224-Q238 HydrophobicContact CG-CB 3.99Å; F236-Q238 PolarHBondContact O-N 3.22Å; Q238-V254 WeakPolarHBondContact O-CG1 3.17Å
239	E	91.9	Very high	86.2	Confident	102 Å²	102	59.7 Å²	59.7	48%	0.477	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	148.6	-177.8	-170.3	-175.1	160.3	0	0	109.6	V222	V222-E239 HydrophobicContact CB-CB 3.91Å; V222-E239 HydrophobicContact CG2-CB 4.06Å; V222-E239 PolarHBondContact N-O 3Å; V222-E239 PolarHBondContact O-N 3.05Å
240	I	93	Very high	86.5	Confident	27 Å²	27	56.2 Å²	56.2	14%	0.138	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	114.5	171.4	-56	177.4	0	0	0	107.5	G220 L221 I237 Q247 L252 V254	G220-I240 CarbonylContact O-C 3.55Å; G220-I240 WeakPolarHBondContact O-CA 3.41Å; L221-I240 HydrophobicContact CD2-CG1 4.14Å; I237-I240 HydrophobicContact CG2-CD1 4.46Å; I237-I240 HydrophobicContact CG2-CG1 3.78Å; I240-Q247 HydrophobicContact CG2-CB 3.62Å; I240-Q247 HydrophobicContact CG2-CG 3.95Å; I240-L252 HydrophobicContact CD1-CB 4.27Å; I240-L252 VanDerWaalsContact CD1-O 3.22Å; I240-L252 WeakPolarHBondContact CD1-O 3.2Å; I240-V254 HydrophobicContact CG1-CG2 4.25Å
241	V	92.3	Very high	87.2	Confident	59 Å²	59	55.9 Å²	55.9	36%	0.358	31%	0.307	S	S	.	.			trans	-64.9	129	-175.9	179.8	0	0	0	0	110.4	G220 V222 G243 G244	G220-V241 WeakPolarHBondContact O-CB 3.4Å; G220-V241 PolarHBondContact O-N 3.26Å; V222-V241 HydrophobicContact CG2-CG2 3.81Å; V241-G243 PolarHBondContact O-N 3.31Å; V241-G244 PolarHBondContact O-N 3.07Å; V241-G244 VanDerWaalsContact O-N 3.1Å
242	P	87.1	Confident	88	Confident	96 Å²	96	50.8 Å²	50.8	62%	0.623	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	130.6	175	-27.7	35.8	0	0	0	113.4	G244	P242-G244 VanDerWaalsContact C-N 3.31Å
243	G	84.5	Confident	88.8	Confident	40 Å²	40	54.5 Å²	54.5	41%	0.412	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-3.9	-177.6	0	0	0	0	0	115.2	T217 V241 K248	T217-G243 PolarHBondContact OG1-O 2.92Å; V241-G243 PolarHBondContact O-N 3.31Å; G243-K248 WeakPolarHBondContact O-CE 3.48Å; G243-K248 PolarHBondContact O-NZ 3.34Å; G243-K248 VanDerWaalsContact O-NZ 3.09Å
244	G	89.2	Confident	89.4	Confident	5 Å²	5	54.7 Å²	54.7	5%	0.052	30%	0.295	C	S	.	.			trans	-70.7	158.9	175.9	0	0	0	0	0	113.7	V241 P242 C246 Q247 K248	V241-G244 PolarHBondContact O-N 3.07Å; V241-G244 VanDerWaalsContact O-N 3.1Å; P242-G244 VanDerWaalsContact C-N 3.31Å; G244-C246 VanDerWaalsContact C-N 3.33Å; G244-C246 PolarHBondContact O-N 3.17Å; G244-Q247 WeakPolarHBondContact O-CB 3.39Å; G244-Q247 PolarHBondContact O-N 2.99Å; G244-Q247 VanDerWaalsContact O-N 3.1Å; G244-K248 PolarHBondContact O-N 3.42Å; G244-K248 VanDerWaalsContact O-N 3.07Å
245	D	89.4	Confident	89.6	Confident	8 Å²	8	53 Å²	53	4%	0.043	29%	0.292	C	S	.	.	H	α-helix	trans	-63.8	-38.9	-174.9	-58.2	-20	0	0	0	111.6	V213 G216 T217 G218 Q247 K248 D249	V213-D245 HydrophobicContact CG1-CB 3.84Å; G216-D245 PolarHBondContact N-OD1 3.06Å; G216-D245 PolarHBondContact N-OD2 3.28Å; T217-D245 PolarHBondContact N-OD1 3.31Å; T217-D245 PolarHBondContact N-OD2 2.81Å; T217-D245 PolarHBondContact OG1-OD1 2.74Å; G218-D245 VanDerWaalsContact C-OD2 3.24Å; G218-D245 WeakPolarHBondContact CA-OD2 3.49Å; G218-D245 PolarHBondContact N-OD2 2.79Å; G218-D245 VanDerWaalsContact O-CG 3.26Å; G218-D245 PolarHBondContact O-N 3.07Å; D245-Q247 VanDerWaalsContact C-N 3.3Å; D245-Q247 PolarHBondContact O-N 3.49Å; D245-K248 PolarHBondContact O-N 3.04Å; D245-D249 WeakPolarHBondContact O-CB 3.25Å; D245-D249 PolarHBondContact O-N 3.32Å
246	C	89.9	Confident	89.6	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.6	-28.1	175.9	-64.7	0	0	0	0	113.2	L219 L221 G244 G250 L252	L219-C246 WeakPolarHBondContact O-CB 3.5Å; L219-C246 PolarHBondContact O-N 3.08Å; L219-C246 VanDerWaalsContact O-N 3.13Å; L219-C246 PolarHBondContact O-SG 2.68Å; L221-C246 HydrophobicContact CD2-CB 3.66Å; L221-C246 HydrophobicContact CG-CB 4.15Å; G244-C246 VanDerWaalsContact C-N 3.33Å; G244-C246 PolarHBondContact O-N 3.17Å; C246-G250 PolarHBondContact O-N 2.86Å; C246-G250 VanDerWaalsContact O-N 3.07Å; C246-L252 HydrophobicContact CB-CD1 3.95Å
247	Q	90.4	Very high	89.5	Confident	92 Å²	92	52 Å²	52	43%	0.43	29%	0.287	S	S	.	.	H	α-helix	trans	-73.3	-41.3	175.4	-157.7	-158.4	21.9	0	0	111.3	I240 G244 D245 D249 G250	I240-Q247 HydrophobicContact CG2-CB 3.62Å; I240-Q247 HydrophobicContact CG2-CG 3.95Å; G244-Q247 WeakPolarHBondContact O-CB 3.39Å; G244-Q247 PolarHBondContact O-N 2.99Å; G244-Q247 VanDerWaalsContact O-N 3.1Å; D245-Q247 VanDerWaalsContact C-N 3.3Å; D245-Q247 PolarHBondContact O-N 3.49Å; Q247-D249 VanDerWaalsContact C-N 3.28Å; Q247-D249 PolarHBondContact O-N 3.11Å; Q247-G250 PolarHBondContact O-N 3.39Å
248	K	87.2	Confident	89.4	Confident	138 Å²	138	52 Å²	52	60%	0.6	29%	0.287	S	S	*	.	H	α-helix	trans	-63.3	-36.9	176.3	-69.3	170.5	-177.7	157.3	0	111.7	T217 G243 G244 D245	T217-K248 PolarHBondContact OG1-NZ 2.95Å; G243-K248 WeakPolarHBondContact O-CE 3.48Å; G243-K248 PolarHBondContact O-NZ 3.34Å; G243-K248 VanDerWaalsContact O-NZ 3.09Å; G244-K248 PolarHBondContact O-N 3.42Å; G244-K248 VanDerWaalsContact O-N 3.07Å; D245-K248 PolarHBondContact O-N 3.04Å
249	D	88.3	Confident	89.4	Confident	50 Å²	50	48 Å²	48	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-71.2	-35.5	175.8	-174.2	-93.8	0	0	0	112.7	V213 D245 Q247 R251	V213-D249 HydrophobicContact CG1-CB 4.11Å; V213-D249 HydrophobicContact CG2-CB 4.25Å; D245-D249 WeakPolarHBondContact O-CB 3.25Å; D245-D249 PolarHBondContact O-N 3.32Å; Q247-D249 VanDerWaalsContact C-N 3.28Å; Q247-D249 PolarHBondContact O-N 3.11Å; D249-R251 PolarHBondContact O-N 2.87Å; D249-R251 VanDerWaalsContact O-N 3.07Å; D249-R251 WeakPolarHBondContact OD1-CB 3.44Å; D249-R251 WeakPolarHBondContact OD1-CG 3.13Å; D249-R251 IonicContact OD1-CZ 3.17Å; D249-R251 IonicContact OD1-NE 3.58Å; D249-R251 PolarHBondContact OD1-NE 2.91Å; D249-R251 IonicContact OD1-NH2 2.9Å; D249-R251 PolarHBondContact OD1-NH2 3.44Å; D249-R251 IonicContact OD2-CZ 2.58Å; D249-R251 IonicContact OD2-NE 3.83Å; D249-R251 PolarHBondContact OD2-NE 3.14Å; D249-R251 IonicContact OD2-NH2 2.83Å; D249-R251 PolarHBondContact OD2-NH2 2.82Å
250	G	86.1	Confident	89.4	Confident	49 Å²	49	44.3 Å²	44.3	51%	0.505	26%	0.255	S	S	.	.			trans	72.1	-2.6	168.9	0	0	0	0	0	116.1	C246 Q247	C246-G250 PolarHBondContact O-N 2.86Å; C246-G250 VanDerWaalsContact O-N 3.07Å; Q247-G250 PolarHBondContact O-N 3.39Å
251	R	86.7	Confident	89.3	Confident	113 Å²	113	43 Å²	43	43%	0.426	25%	0.248	S	C	.	.			trans	-78.9	-30.2	179.7	-66.2	-178.5	-71.2	-178.2	-6.9	113.4	I211 C212 D249 R295	I211-R251 HydrophobicContact CD1-CB 4.39Å; I211-R251 HydrophobicContact CG2-CB 4.34Å; C212-R251 PolarHBondContact O-NH2 2.92Å; D249-R251 PolarHBondContact O-N 2.87Å; D249-R251 VanDerWaalsContact O-N 3.07Å; D249-R251 WeakPolarHBondContact OD1-CB 3.44Å; D249-R251 WeakPolarHBondContact OD1-CG 3.13Å; D249-R251 IonicContact OD1-CZ 3.17Å; D249-R251 IonicContact OD1-NE 3.58Å; D249-R251 PolarHBondContact OD1-NE 2.91Å; D249-R251 IonicContact OD1-NH2 2.9Å; D249-R251 PolarHBondContact OD1-NH2 3.44Å; D249-R251 IonicContact OD2-CZ 2.58Å; D249-R251 IonicContact OD2-NE 3.83Å; D249-R251 PolarHBondContact OD2-NE 3.14Å; D249-R251 IonicContact OD2-NH2 2.83Å; D249-R251 PolarHBondContact OD2-NH2 2.82Å; R251-R295 PolarHBondContact O-NH2 2.91Å
252	L	90.6	Very high	89	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.031	23%	0.234	C	C	.	.			trans	-81.7	144.1	175.8	-68.1	175.9	0	0	0	111.6	I211 L221 I237 I240 C246 I291 F293	I211-L252 HydrophobicContact CD1-CD1 3.91Å; I211-L252 HydrophobicContact CD1-CD2 3.74Å; I211-L252 HydrophobicContact CD1-CG 3.5Å; I211-L252 VanDerWaalsContact CD1-CG 3.5Å; L221-L252 HydrophobicContact CD1-CD1 4.06Å; L221-L252 HydrophobicContact CD2-CD1 4.16Å; I237-L252 HydrophobicContact CD1-CB 4.04Å; I237-L252 HydrophobicContact CD1-CD1 4.17Å; I237-L252 HydrophobicContact CD1-CD2 4.19Å; I237-L252 HydrophobicContact CD1-CG 4.36Å; I240-L252 HydrophobicContact CD1-CB 4.27Å; I240-L252 VanDerWaalsContact CD1-O 3.22Å; I240-L252 WeakPolarHBondContact CD1-O 3.2Å; C246-L252 HydrophobicContact CB-CD1 3.95Å; L252-I291 HydrophobicContact CD1-CD1 3.87Å; L252-I291 HydrophobicContact CD1-CG2 4.31Å; L252-F293 HydrophobicContact CD2-CB 4.22Å; L252-F293 HydrophobicContact CD2-CD1 3.4Å; L252-F293 HydrophobicContact CD2-CD2 4.04Å; L252-F293 HydrophobicContact CD2-CE1 3.63Å; L252-F293 HydrophobicContact CD2-CE2 4.24Å; L252-F293 HydrophobicContact CD2-CG 3.61Å; L252-F293 HydrophobicContact CD2-CZ 4.05Å
253	Q	88.9	Confident	88.5	Confident	101 Å²	101	44.3 Å²	44.3	47%	0.472	24%	0.24	S	C	.	.			trans	-126.7	154.7	178.6	-67.4	179.1	7.1	0	0	111.3	G255 D256 R295	Q253-G255 PolarHBondContact O-N 3.1Å; Q253-D256 PolarHBondContact N-OD2 3.46Å; Q253-D256 VanDerWaalsContact O-CB 3.3Å; Q253-D256 WeakPolarHBondContact O-CB 3.37Å; Q253-D256 VanDerWaalsContact O-CG 3.29Å; Q253-D256 PolarHBondContact O-N 3.4Å; Q253-D256 VanDerWaalsContact O-N 3.15Å; Q253-R295 VanDerWaalsContact CD-CZ 3.43Å; Q253-R295 VanDerWaalsContact OE1-NH1 3.11Å
254	V	91.9	Very high	88.5	Confident	83 Å²	83	43.9 Å²	43.9	50%	0.503	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	133.9	170.4	175.2	0	0	0	0	109	Q238 I240	Q238-V254 WeakPolarHBondContact O-CG1 3.17Å; I240-V254 HydrophobicContact CG1-CG2 4.25Å
255	G	87.1	Confident	88.3	Confident	22 Å²	22	45.8 Å²	45.8	23%	0.227	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	-8.6	-174.7	0	0	0	0	0	114.6	I237 Q253 Q257	I237-G255 PolarHBondContact O-N 3.05Å; Q253-G255 PolarHBondContact O-N 3.1Å; G255-Q257 PolarHBondContact O-N 3.02Å
256	D	90.6	Very high	88.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-63.4	136	172.7	-73.4	-15.9	0	0	0	110.5	F236 I237 Q253 F293 R295	F236-D256 CarbonylContact C-O 3.59Å; F236-D256 WeakPolarHBondContact CA-O 3.49Å; I237-D256 HydrophobicContact CD1-CB 3.9Å; I237-D256 HydrophobicContact CG1-CB 4.3Å; I237-D256 PolarHBondContact N-O 2.92Å; Q253-D256 PolarHBondContact N-OD2 3.46Å; Q253-D256 VanDerWaalsContact O-CB 3.3Å; Q253-D256 WeakPolarHBondContact O-CB 3.37Å; Q253-D256 VanDerWaalsContact O-CG 3.29Å; Q253-D256 PolarHBondContact O-N 3.4Å; Q253-D256 VanDerWaalsContact O-N 3.15Å; D256-F293 HydrophobicContact CB-CD2 3.89Å; D256-F293 WeakPolarHBondContact OD2-CE2 3.48Å; D256-R295 VanDerWaalsContact CG-NE 3.35Å; D256-R295 WeakPolarHBondContact OD1-CD 3.48Å; D256-R295 IonicContact OD1-CZ 2.75Å; D256-R295 IonicContact OD1-NE 2.88Å; D256-R295 PolarHBondContact OD1-NE 3.37Å; D256-R295 IonicContact OD1-NH2 3.79Å; D256-R295 IonicContact OD2-CZ 3.72Å; D256-R295 IonicContact OD2-NE 3.24Å; D256-R295 PolarHBondContact OD2-NE 2.97Å; D256-R295 IonicContact OD2-NH2 3.12Å; D256-R295 PolarHBondContact OD2-NH2 3.22Å
257	Q	90.7	Very high	87.7	Confident	7 Å²	7	46.7 Å²	46.7	3%	0.033	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.8	174.8	-178.5	-168.4	-18.5	0	0	108.9	M234 F236 G255 F293 I294	M234-Q257 HydrophobicContact CE-CG 4.21Å; F236-Q257 HydrophobicContact CD1-CB 3.78Å; F236-Q257 HydrophobicContact CD1-CG 4.18Å; F236-Q257 HydrophobicContact CE1-CB 3.73Å; F236-Q257 HydrophobicContact CE1-CG 3.91Å; G255-Q257 PolarHBondContact O-N 3.02Å; Q257-F293 CarbonylContact O-C 3.55Å; Q257-F293 WeakPolarHBondContact O-CA 3.48Å; Q257-F293 VanDerWaalsContact O-CB 3.25Å; Q257-F293 WeakPolarHBondContact O-CB 3.07Å; Q257-I294 HydrophobicContact CB-CB 4.26Å; Q257-I294 PolarHBondContact N-O 3.07Å; Q257-I294 PolarHBondContact O-N 3.47Å
258	L	91.8	Very high	87	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	130.2	174.8	-62.5	175.9	0	0	0	110.1	L221 V223 V235 I237 I261 L266 I291 F293	L221-L258 HydrophobicContact CD1-CD1 4.4Å; V223-L258 HydrophobicContact CG1-CD1 3.48Å; V223-L258 VanDerWaalsContact CG1-CD1 3.48Å; V235-L258 HydrophobicContact CG1-CD1 4.44Å; V235-L258 PolarHBondContact O-N 2.96Å; I237-L258 HydrophobicContact CD1-CD2 3.88Å; I237-L258 HydrophobicContact CD1-CG 4.39Å; I237-L258 HydrophobicContact CG1-CD1 4.06Å; I237-L258 HydrophobicContact CG1-CD2 3.89Å; I237-L258 HydrophobicContact CG1-CG 3.83Å; L258-I261 HydrophobicContact CD1-CD1 4.46Å; L258-L266 HydrophobicContact CB-CD1 3.55Å; L258-L266 HydrophobicContact CD1-CD1 4.08Å; L258-L266 HydrophobicContact CG-CD1 4.43Å; L258-I291 HydrophobicContact CD2-CG2 3.89Å; L258-F293 HydrophobicContact CD2-CB 4.34Å
259	V	90.6	Very high	86.8	Confident	9 Å²	9	38.9 Å²	38.9	6%	0.055	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-46.7	179.9	-179.3	0	0	0	0	110.4	L266 I267 A292 I294	V259-L266 PolarHBondContact O-N 3.28Å; V259-I267 HydrophobicContact CG1-CD1 4.3Å; V259-I267 HydrophobicContact CG1-CG1 4.26Å; V259-A292 HydrophobicContact CB-CB 4.17Å; V259-A292 PolarHBondContact N-O 3.41Å; V259-I294 HydrophobicContact CG2-CD1 3.76Å; V259-I294 HydrophobicContact CG2-CG1 3.77Å
260	S	90.4	Very high	86.8	Confident	25 Å²	25	38.3 Å²	38.3	18%	0.175	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	156.5	175.4	69.8	0	0	0	0	112.3	E264 A292	S260-E264 CarbonylContact C-O 3.58Å; S260-E264 WeakPolarHBondContact CA-O 3.22Å; S260-E264 VanDerWaalsContact CB-O 3.27Å; S260-E264 WeakPolarHBondContact CB-O 3.39Å; S260-A292 PolarHBondContact N-O 3.33Å; S260-A292 PolarHBondContact O-N 2.97Å; S260-A292 VanDerWaalsContact OG-CB 3.28Å; S260-A292 WeakPolarHBondContact OG-CB 3.35Å
261	I	91.1	Very high	87	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	124.8	172.7	-63.7	178.4	0	0	0	108	L219 L258 K263 E264 L266 I277 L278 T281 V289 E290 I291	L219-I261 HydrophobicContact CD1-CD1 4.33Å; L219-I261 HydrophobicContact CD1-CG2 4.13Å; L258-I261 HydrophobicContact CD1-CD1 4.46Å; I261-K263 PolarHBondContact O-N 2.76Å; I261-E264 PolarHBondContact N-O 3.46Å; I261-E264 WeakPolarHBondContact O-CA 3.49Å; I261-E264 VanDerWaalsContact O-CB 3.3Å; I261-E264 WeakPolarHBondContact O-CB 3.42Å; I261-E264 PolarHBondContact O-N 2.88Å; I261-L266 HydrophobicContact CD1-CD1 3.72Å; I261-L266 HydrophobicContact CG1-CD1 3.7Å; I261-I277 HydrophobicContact CB-CG2 4.24Å; I261-L278 HydrophobicContact CD1-CD2 3.24Å; I261-L278 HydrophobicContact CD1-CG 4.05Å; I261-T281 HydrophobicContact CG2-CG2 4.19Å; I261-V289 HydrophobicContact CG2-CG1 3.74Å; I261-E290 CarbonylContact C-O 3.55Å; I261-E290 WeakPolarHBondContact CA-O 3.27Å; I261-I291 HydrophobicContact CG1-CG1 4.38Å; I261-I291 HydrophobicContact CG1-CG2 4.27Å
262	N	85.9	Confident	87.2	Confident	9 Å²	9	35 Å²	35	5%	0.048	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	36.6	179	-80.8	-26.2	0	0	0	113.5	E264 T281 V289 E290	N262-E264 PolarHBondContact O-N 2.79Å; N262-T281 WeakPolarHBondContact ND2-CG2 3.48Å; N262-V289 WeakPolarHBondContact OD1-CA 3.45Å; N262-E290 PolarHBondContact N-O 2.89Å; N262-E290 PolarHBondContact OD1-N 2.91Å; N262-E290 VanDerWaalsContact OD1-N 3.08Å
263	K	78.1	Confident	87.1	Confident	173 Å²	173	39.5 Å²	39.5	75%	0.752	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.9	7.9	-174.9	-49.6	173.8	-179.2	178.2	0	114.6	I261	I261-K263 PolarHBondContact O-N 2.76Å
264	E	84	Confident	87.1	Confident	30 Å²	30	34.7 Å²	34.7	14%	0.14	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.3	170.5	-56.4	-174.5	170.3	0	0	109.1	S260 I261 N262 I277 R280 R284	S260-E264 CarbonylContact C-O 3.58Å; S260-E264 WeakPolarHBondContact CA-O 3.22Å; S260-E264 VanDerWaalsContact CB-O 3.27Å; S260-E264 WeakPolarHBondContact CB-O 3.39Å; I261-E264 PolarHBondContact N-O 3.46Å; I261-E264 WeakPolarHBondContact O-CA 3.49Å; I261-E264 VanDerWaalsContact O-CB 3.3Å; I261-E264 WeakPolarHBondContact O-CB 3.42Å; I261-E264 PolarHBondContact O-N 2.88Å; N262-E264 PolarHBondContact O-N 2.79Å; E264-I277 HydrophobicContact CB-CD1 4.5Å; E264-I277 HydrophobicContact CB-CG2 4.03Å; E264-I277 WeakPolarHBondContact OE2-CG2 3.34Å; E264-R280 IonicContact OE1-CZ 2.76Å; E264-R280 IonicContact OE1-NE 3.7Å; E264-R280 IonicContact OE1-NH1 3.84Å; E264-R280 PolarHBondContact OE1-NH1 3.48Å; E264-R280 IonicContact OE1-NH2 2.74Å; E264-R280 PolarHBondContact OE1-NH2 2.82Å; E264-R280 VanDerWaalsContact OE1-NH2 3.13Å; E264-R280 IonicContact OE2-CZ 3.45Å; E264-R280 IonicContact OE2-NE 3.28Å; E264-R280 IonicContact OE2-NH1 2.69Å; E264-R280 IonicContact OE2-NH2 3.46Å; E264-R280 PolarHBondContact OE2-NH2 3.45Å; E264-R284 IonicContact OE1-NH2 2.78Å
265	S	84.4	Confident	87	Confident	45 Å²	45	36.9 Å²	36.9	32%	0.315	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	139.6	-178.9	176.3	0	0	0	0	111.9	T20 I267 V269	T20-S265 WeakPolarHBondContact CG2-OG 3.44Å; S265-I267 PolarHBondContact OG-N 3.47Å; S265-V269 WeakPolarHBondContact O-CG1 3.47Å
266	L	84.9	Confident	87.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.208	C	C	.	.			trans	-110.4	10.5	171.7	-69.1	169.8	0	0	0	112.4	V235 L258 V259 I261 V269 A274 I277	V235-L266 HydrophobicContact CB-CB 4.47Å; V235-L266 HydrophobicContact CG2-CB 4.48Å; V235-L266 WeakPolarHBondContact CG2-O 3.31Å; L258-L266 HydrophobicContact CB-CD1 3.55Å; L258-L266 HydrophobicContact CD1-CD1 4.08Å; L258-L266 HydrophobicContact CG-CD1 4.43Å; V259-L266 PolarHBondContact O-N 3.28Å; I261-L266 HydrophobicContact CD1-CD1 3.72Å; I261-L266 HydrophobicContact CG1-CD1 3.7Å; L266-V269 HydrophobicContact CB-CG2 4.49Å; L266-V269 HydrophobicContact CD2-CG2 4.22Å; L266-V269 WeakPolarHBondContact O-CG2 3.3Å; L266-A274 HydrophobicContact CD2-CB 3.8Å; L266-I277 HydrophobicContact CD2-CB 4.23Å; L266-I277 HydrophobicContact CD2-CD1 3.75Å; L266-I277 HydrophobicContact CD2-CG2 4.16Å
267	I	82.6	Confident	87.1	Confident	28 Å²	28	39.7 Å²	39.7	14%	0.144	21%	0.211	C	C	.	.	S	Bend	trans	-89.5	127.7	177.9	-55	-57.1	0	0	0	109.9	T20 V259 S265 V269	T20-I267 HydrophobicContact CG2-CB 3.86Å; T20-I267 HydrophobicContact CG2-CG1 3.57Å; T20-I267 WeakPolarHBondContact OG1-CG1 3.47Å; V259-I267 HydrophobicContact CG1-CD1 4.3Å; V259-I267 HydrophobicContact CG1-CG1 4.26Å; S265-I267 PolarHBondContact OG-N 3.47Å; I267-V269 PolarHBondContact O-N 2.95Å
268	G	74.6	Confident	87.1	Confident	45 Å²	45	40 Å²	40	46%	0.464	21%	0.213	S	C	.	.	S	Bend	trans	70.7	6.1	177.5	0	0	0	0	0	114.3	A227 P233	A227-G268 WeakPolarHBondContact CB-O 3.33Å; P233-G268 PolarHBondContact O-N 3.1Å
269	V	84.4	Confident	86.9	Confident	21 Å²	21	43.8 Å²	43.8	13%	0.127	24%	0.236	C	C	.	.			trans	-77.4	153.6	173.4	-55.2	0	0	0	0	110.4	G226 A227 V235 S265 L266 I267 E273 A274	G226-V269 CarbonylContact C-O 3.43Å; G226-V269 VanDerWaalsContact CA-O 3.26Å; G226-V269 WeakPolarHBondContact CA-O 3.46Å; A227-V269 PolarHBondContact N-O 2.87Å; V235-V269 HydrophobicContact CG2-CG2 3.99Å; S265-V269 WeakPolarHBondContact O-CG1 3.47Å; L266-V269 HydrophobicContact CB-CG2 4.49Å; L266-V269 HydrophobicContact CD2-CG2 4.22Å; L266-V269 WeakPolarHBondContact O-CG2 3.3Å; I267-V269 PolarHBondContact O-N 2.95Å; V269-E273 HydrophobicContact CB-CB 4.04Å; V269-A274 HydrophobicContact CG2-CB 3.89Å
270	T	87.3	Confident	86.6	Confident	38 Å²	38	49.2 Å²	49.2	23%	0.233	26%	0.255	C	S	.	.			trans	-68.6	159.5	170	60.2	0	0	0	0	111.2	N228 E272 E273 A274	N228-T270 HydrophobicContact CB-CG2 4.19Å; T270-E272 PolarHBondContact O-N 2.9Å; T270-E273 WeakPolarHBondContact CB-OE2 3.37Å; T270-E273 PolarHBondContact N-OE2 3.07Å; T270-E273 PolarHBondContact O-N 3.36Å; T270-E273 VanDerWaalsContact OG1-CB 3.32Å; T270-E273 WeakPolarHBondContact OG1-CB 3.29Å; T270-E273 WeakPolarHBondContact OG1-CG 3.15Å; T270-E273 PolarHBondContact OG1-N 3.27Å; T270-E273 PolarHBondContact OG1-OE2 3.39Å; T270-A274 PolarHBondContact O-N 3.27Å
271	N	89.6	Confident	86.2	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-36.4	177.6	-171	-99.3	0	0	0	111.8	G225 N228 R229 R275	G225-N271 WeakPolarHBondContact O-CB 3.38Å; G225-N271 PolarHBondContact O-ND2 2.85Å; N228-N271 PolarHBondContact OD1-N 2.89Å; R229-N271 HydrophobicContact CG-CB 3.89Å; N271-R275 VanDerWaalsContact O-CG 3.28Å; N271-R275 WeakPolarHBondContact O-CG 3.38Å; N271-R275 PolarHBondContact O-N 3.45Å; N271-R275 VanDerWaalsContact O-N 3.09Å; N271-R275 PolarHBondContact OD1-NE 2.85Å
272	E	91.7	Very high	85.7	Confident	89 Å²	89	53.6 Å²	53.6	42%	0.416	27%	0.272	S	S	.	.	H	α-helix	trans	-67.8	-41.1	177.5	-62.1	74.2	-154.9	0	0	111.5	N228 R229 T270 R275 S276	N228-E272 PolarHBondContact ND2-OE2 3.08Å; R229-E272 IonicContact CZ-OE1 2.96Å; R229-E272 IonicContact NH2-OE1 3.06Å; R229-E272 PolarHBondContact NH2-OE1 3.29Å; T270-E272 PolarHBondContact O-N 2.9Å; E272-R275 PolarHBondContact O-N 2.88Å; E272-S276 WeakPolarHBondContact O-CB 3.43Å; E272-S276 PolarHBondContact O-N 3.26Å
273	E	87.8	Confident	85.3	Confident	99 Å²	99	60.2 Å²	60.2	46%	0.463	31%	0.306	S	S	.	.	H	α-helix	trans	-64.1	-43.7	174.5	-75.8	164	158.3	0	0	112	V269 T270 R275 S276 I277	V269-E273 HydrophobicContact CB-CB 4.04Å; T270-E273 WeakPolarHBondContact CB-OE2 3.37Å; T270-E273 PolarHBondContact N-OE2 3.07Å; T270-E273 PolarHBondContact O-N 3.36Å; T270-E273 VanDerWaalsContact OG1-CB 3.32Å; T270-E273 WeakPolarHBondContact OG1-CB 3.29Å; T270-E273 WeakPolarHBondContact OG1-CG 3.15Å; T270-E273 PolarHBondContact OG1-N 3.27Å; T270-E273 PolarHBondContact OG1-OE2 3.39Å; E273-R275 VanDerWaalsContact C-N 3.29Å; E273-R275 PolarHBondContact O-N 2.74Å; E273-S276 WeakPolarHBondContact O-CA 3.49Å; E273-S276 WeakPolarHBondContact O-CB 3.21Å; E273-S276 PolarHBondContact O-N 2.79Å; E273-S276 VanDerWaalsContact O-N 3.08Å; E273-I277 WeakPolarHBondContact O-CG1 3.25Å; E273-I277 PolarHBondContact O-N 2.82Å
274	A	90.1	Very high	85.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.7	-42.6	174.8	0	0	0	0	0	111.9	V223 V235 L266 V269 T270 I277 L278	V223-A274 HydrophobicContact CG2-CB 4.31Å; V235-A274 HydrophobicContact CG1-CB 4.1Å; V235-A274 HydrophobicContact CG2-CB 4.03Å; L266-A274 HydrophobicContact CD2-CB 3.8Å; V269-A274 HydrophobicContact CG2-CB 3.89Å; T270-A274 PolarHBondContact O-N 3.27Å; A274-I277 PolarHBondContact O-N 3.02Å; A274-L278 WeakPolarHBondContact O-CG 3.28Å; A274-L278 PolarHBondContact O-N 3.27Å; A274-L278 VanDerWaalsContact O-N 3.13Å
275	R	90.2	Very high	84.8	Confident	129 Å²	129	61.3 Å²	61.3	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-66.4	-36.4	174.9	-71.6	173.5	179.9	-153	-2.4	112.4	V223 N271 E272 E273 T279	V223-R275 HydrophobicContact CG2-CG 4.19Å; N271-R275 VanDerWaalsContact O-CG 3.28Å; N271-R275 WeakPolarHBondContact O-CG 3.38Å; N271-R275 PolarHBondContact O-N 3.45Å; N271-R275 VanDerWaalsContact O-N 3.09Å; N271-R275 PolarHBondContact OD1-NE 2.85Å; E272-R275 PolarHBondContact O-N 2.88Å; E273-R275 VanDerWaalsContact C-N 3.29Å; E273-R275 PolarHBondContact O-N 2.74Å; R275-T279 WeakPolarHBondContact O-CB 3.47Å; R275-T279 PolarHBondContact O-N 3.02Å; R275-T279 PolarHBondContact O-OG1 3.38Å
276	S	89.7	Confident	84.5	Confident	70 Å²	70	62.2 Å²	62.2	49%	0.49	32%	0.323	S	S	.	.	H	α-helix	trans	-64.3	-44.6	175.4	-172.6	0	0	0	0	111.6	E272 E273 L278 T279 R280	E272-S276 WeakPolarHBondContact O-CB 3.43Å; E272-S276 PolarHBondContact O-N 3.26Å; E273-S276 WeakPolarHBondContact O-CA 3.49Å; E273-S276 WeakPolarHBondContact O-CB 3.21Å; E273-S276 PolarHBondContact O-N 2.79Å; E273-S276 VanDerWaalsContact O-N 3.08Å; S276-L278 PolarHBondContact O-N 3.42Å; S276-T279 PolarHBondContact O-N 2.75Å; S276-T279 VanDerWaalsContact O-N 3.17Å; S276-R280 WeakPolarHBondContact O-CB 3.45Å; S276-R280 PolarHBondContact O-N 3.17Å
277	I	90	Very high	84.4	Confident	13 Å²	13	66.9 Å²	66.9	7%	0.067	35%	0.353	C	S	.	.	H	α-helix	trans	-58.9	-47.8	175.8	-69.3	164.8	0	0	0	111.1	I261 E264 L266 E273 A274 T279 R280 T281	I261-I277 HydrophobicContact CB-CG2 4.24Å; E264-I277 HydrophobicContact CB-CD1 4.5Å; E264-I277 HydrophobicContact CB-CG2 4.03Å; E264-I277 WeakPolarHBondContact OE2-CG2 3.34Å; L266-I277 HydrophobicContact CD2-CB 4.23Å; L266-I277 HydrophobicContact CD2-CD1 3.75Å; L266-I277 HydrophobicContact CD2-CG2 4.16Å; E273-I277 WeakPolarHBondContact O-CG1 3.25Å; E273-I277 PolarHBondContact O-N 2.82Å; A274-I277 PolarHBondContact O-N 3.02Å; I277-T279 VanDerWaalsContact C-N 3.31Å; I277-T279 PolarHBondContact O-N 2.77Å; I277-R280 PolarHBondContact O-N 3.13Å; I277-T281 PolarHBondContact O-N 2.83Å; I277-T281 PolarHBondContact O-OG1 2.77Å
278	L	89.4	Confident	84.5	Confident	14 Å²	14	68.6 Å²	68.6	7%	0.073	37%	0.365	C	S	.	.	H	α-helix	trans	-60.2	-39.1	175.4	-74.5	166.7	0	0	0	112.8	L219 L221 V223 I261 A274 S276	L219-L278 HydrophobicContact CD1-CD2 3.94Å; L221-L278 HydrophobicContact CB-CD2 4.16Å; L221-L278 HydrophobicContact CD1-CD2 4.16Å; V223-L278 HydrophobicContact CB-CD1 4.29Å; V223-L278 HydrophobicContact CG1-CD1 3.6Å; V223-L278 HydrophobicContact CG2-CD1 3.66Å; I261-L278 HydrophobicContact CD1-CD2 3.24Å; I261-L278 HydrophobicContact CD1-CG 4.05Å; A274-L278 WeakPolarHBondContact O-CG 3.28Å; A274-L278 PolarHBondContact O-N 3.27Å; A274-L278 VanDerWaalsContact O-N 3.13Å; S276-L278 PolarHBondContact O-N 3.42Å
279	T	87.4	Confident	85.1	Confident	79 Å²	79	66.6 Å²	66.6	49%	0.485	34%	0.343	S	S	.	.	H	α-helix	trans	-73.8	-43.7	-179.1	-56.7	0	0	0	0	111.5	R275 S276 I277 T281 K282	R275-T279 WeakPolarHBondContact O-CB 3.47Å; R275-T279 PolarHBondContact O-N 3.02Å; R275-T279 PolarHBondContact O-OG1 3.38Å; S276-T279 PolarHBondContact O-N 2.75Å; S276-T279 VanDerWaalsContact O-N 3.17Å; I277-T279 VanDerWaalsContact C-N 3.31Å; I277-T279 PolarHBondContact O-N 2.77Å; T279-T281 PolarHBondContact O-N 2.99Å; T279-K282 VanDerWaalsContact O-CB 3.23Å; T279-K282 WeakPolarHBondContact O-CB 3.38Å; T279-K282 PolarHBondContact O-N 2.65Å
280	R	84.6	Confident	85.3	Confident	122 Å²	122	68.4 Å²	68.4	46%	0.46	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-30.9	176.8	179.5	167.3	50.4	145.4	-17.7	112.4	E264 S276 I277 K282 L283 R284	E264-R280 IonicContact OE1-CZ 2.76Å; E264-R280 IonicContact OE1-NE 3.7Å; E264-R280 IonicContact OE1-NH1 3.84Å; E264-R280 PolarHBondContact OE1-NH1 3.48Å; E264-R280 IonicContact OE1-NH2 2.74Å; E264-R280 PolarHBondContact OE1-NH2 2.82Å; E264-R280 VanDerWaalsContact OE1-NH2 3.13Å; E264-R280 IonicContact OE2-CZ 3.45Å; E264-R280 IonicContact OE2-NE 3.28Å; E264-R280 IonicContact OE2-NH1 2.69Å; E264-R280 IonicContact OE2-NH2 3.46Å; E264-R280 PolarHBondContact OE2-NH2 3.45Å; S276-R280 WeakPolarHBondContact O-CB 3.45Å; S276-R280 PolarHBondContact O-N 3.17Å; I277-R280 PolarHBondContact O-N 3.13Å; R280-K282 PolarHBondContact O-N 3.13Å; R280-L283 PolarHBondContact O-N 2.82Å; R280-R284 PolarHBondContact O-N 2.88Å
281	T	82.9	Confident	85.5	Confident	4 Å²	4	66.6 Å²	66.6	3%	0.025	34%	0.339	C	S	.	.	H	α-helix	trans	-59.7	-31.2	173.1	-58.6	0	0	0	0	112.2	K215 L219 I261 N262 I277 T279 L283 V289	K215-T281 PolarHBondContact NZ-O 3.07Å; L219-T281 HydrophobicContact CD1-CG2 3.82Å; L219-T281 HydrophobicContact CG-CG2 4.26Å; I261-T281 HydrophobicContact CG2-CG2 4.19Å; N262-T281 WeakPolarHBondContact ND2-CG2 3.48Å; I277-T281 PolarHBondContact O-N 2.83Å; I277-T281 PolarHBondContact O-OG1 2.77Å; T279-T281 PolarHBondContact O-N 2.99Å; T281-L283 PolarHBondContact O-N 2.93Å; T281-V289 HydrophobicContact CG2-CB 4.25Å; T281-V289 HydrophobicContact CG2-CG1 3.69Å; T281-V289 HydrophobicContact CG2-CG2 3.5Å
282	K	79.4	Confident	85.5	Confident	114 Å²	114	66.7 Å²	66.7	50%	0.496	34%	0.341	S	S	.	.	H	α-helix	trans	-66.8	-24.1	172.7	-58.3	-178.1	178.9	-179.6	0	113.2	K215 T279 R280	K215-K282 VanDerWaalsContact CE-O 3.32Å; K215-K282 WeakPolarHBondContact CE-O 3.38Å; K215-K282 PolarHBondContact NZ-O 2.77Å; T279-K282 VanDerWaalsContact O-CB 3.23Å; T279-K282 WeakPolarHBondContact O-CB 3.38Å; T279-K282 PolarHBondContact O-N 2.65Å; R280-K282 PolarHBondContact O-N 3.13Å
283	L	77.8	Confident	85.5	Confident	147 Å²	147	62.6 Å²	62.6	77%	0.77	32%	0.322	S	S	*	.	H	α-helix	trans	-94.6	-13.2	-177.1	-58.8	176.5	0	0	0	114	R280 T281	R280-L283 PolarHBondContact O-N 2.82Å; T281-L283 PolarHBondContact O-N 2.93Å
284	R	78.2	Confident	85.4	Confident	95 Å²	95	58.5 Å²	58.5	36%	0.358	30%	0.303	S	S	.	.			trans	-65	146.5	178.6	-101.3	-166.9	-173.6	179.7	11.2	113.2	K215 E264 R280 D286	K215-R284 PolarHBondContact NZ-O 2.71Å; E264-R284 IonicContact OE1-NH2 2.78Å; R280-R284 PolarHBondContact O-N 2.88Å; R284-D286 VanDerWaalsContact C-N 3.27Å; R284-D286 PolarHBondContact O-N 2.74Å
285	P	73.4	Confident	85.2	Confident	131 Å²	131	61.4 Å²	61.4	85%	0.851	31%	0.314	S	S	*	.			trans	-77.2	-8.6	174.8	30.3	-34	0	0	0	114.3
286	D	78.9	Confident	84	Confident	65 Å²	65	62 Å²	62	35%	0.348	32%	0.316	S	S	.	.			trans	-64.6	128.9	-178.4	-161.7	-38.5	0	0	0	111.6	K215 R284 T288	K215-D286 WeakPolarHBondContact CD-O 3.36Å; R284-D286 VanDerWaalsContact C-N 3.27Å; R284-D286 PolarHBondContact O-N 2.74Å; D286-T288 PolarHBondContact O-N 3.35Å; D286-T288 PolarHBondContact OD1-N 2.85Å; D286-T288 PolarHBondContact OD1-OG1 3.18Å
287	P	81.4	Confident	82	Confident	98 Å²	98	67.9 Å²	67.9	64%	0.636	33%	0.328	S	S	*	.	S	Bend	trans	-70.1	-12.4	177.9	29.6	-37.6	0	0	0	113.7	K215	K215-P287 WeakPolarHBondContact CB-O 3.49Å; K215-P287 PolarHBondContact N-O 3.04Å
288	T	85.4	Confident	79.7	Confident	64 Å²	64	70.9 Å²	70.9	39%	0.393	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	152.6	-179.1	58.7	0	0	0	0	111.8	V213 D286	V213-T288 CarbonylContact O-C 3.55Å; V213-T288 WeakPolarHBondContact O-CA 3.13Å; D286-T288 PolarHBondContact O-N 3.35Å; D286-T288 PolarHBondContact OD1-N 2.85Å; D286-T288 PolarHBondContact OD1-OG1 3.18Å
289	V	88.1	Confident	76.9	Confident	2 Å²	2	75.8 Å²	75.8	1%	0.012	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.4	175	179.3	0	0	0	0	109.6	C212 V213 K215 L219 I261 N262 T281 I291	C212-V289 CarbonylContact C-O 3.48Å; C212-V289 WeakPolarHBondContact CA-O 3.36Å; V213-V289 PolarHBondContact N-O 3.02Å; V213-V289 PolarHBondContact O-N 3.48Å; K215-V289 HydrophobicContact CB-CG2 4.44Å; L219-V289 HydrophobicContact CD1-CG1 4Å; L219-V289 HydrophobicContact CD2-CB 3.85Å; L219-V289 HydrophobicContact CD2-CG1 3.81Å; L219-V289 HydrophobicContact CD2-CG2 3.92Å; L219-V289 HydrophobicContact CG-CG1 4.43Å; I261-V289 HydrophobicContact CG2-CG1 3.74Å; N262-V289 WeakPolarHBondContact OD1-CA 3.45Å; T281-V289 HydrophobicContact CG2-CB 4.25Å; T281-V289 HydrophobicContact CG2-CG1 3.69Å; T281-V289 HydrophobicContact CG2-CG2 3.5Å; V289-I291 HydrophobicContact CG1-CD1 4.33Å; V289-I291 HydrophobicContact CG1-CG1 3.89Å
290	E	87.4	Confident	74.3	Confident	59 Å²	59	76.8 Å²	76.8	28%	0.276	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	126	175.2	-172.4	179.6	169	0	0	109.4	L210 I211 I261 N262	L210-E290 HydrophobicContact CD1-CG 3.53Å; L210-E290 HydrophobicContact CD2-CG 4.34Å; L210-E290 WeakPolarHBondContact CD2-OE1 3.29Å; L210-E290 HydrophobicContact CG-CG 4.1Å; I211-E290 CarbonylContact O-C 3.55Å; I211-E290 WeakPolarHBondContact O-CA 3.39Å; I261-E290 CarbonylContact C-O 3.55Å; I261-E290 WeakPolarHBondContact CA-O 3.27Å; N262-E290 PolarHBondContact N-O 2.89Å; N262-E290 PolarHBondContact OD1-N 2.91Å; N262-E290 VanDerWaalsContact OD1-N 3.08Å
291	I	91.7	Very high	71.6	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	120.6	-179.6	-53.8	177.2	0	0	0	108.6	I211 V213 L219 L221 L252 L258 I261 V289	I211-I291 HydrophobicContact CD1-CB 4.4Å; I211-I291 HydrophobicContact CG1-CB 3.9Å; I211-I291 WeakPolarHBondContact CG1-O 3.26Å; I211-I291 PolarHBondContact N-O 3.38Å; I211-I291 PolarHBondContact O-N 3.35Å; V213-I291 HydrophobicContact CG2-CD1 4.08Å; L219-I291 HydrophobicContact CD1-CD1 4.38Å; L219-I291 HydrophobicContact CD2-CD1 4.13Å; L221-I291 HydrophobicContact CD1-CD1 4.37Å; L252-I291 HydrophobicContact CD1-CD1 3.87Å; L252-I291 HydrophobicContact CD1-CG2 4.31Å; L258-I291 HydrophobicContact CD2-CG2 3.89Å; I261-I291 HydrophobicContact CG1-CG1 4.38Å; I261-I291 HydrophobicContact CG1-CG2 4.27Å; V289-I291 HydrophobicContact CG1-CD1 4.33Å; V289-I291 HydrophobicContact CG1-CG1 3.89Å
292	A	89	Confident	68.9	Low	7 Å²	7	82 Å²	82	6%	0.058	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.8	170.9	0	0	0	0	0	109.7	I208 Q209 L210 V259 S260	I208-A292 HydrophobicContact CG2-CB 4.12Å; Q209-A292 CarbonylContact O-C 3.32Å; Q209-A292 VanDerWaalsContact O-CA 3.29Å; Q209-A292 WeakPolarHBondContact O-CA 3.25Å; L210-A292 HydrophobicContact CD1-CB 3.9Å; V259-A292 HydrophobicContact CB-CB 4.17Å; V259-A292 PolarHBondContact N-O 3.41Å; S260-A292 PolarHBondContact N-O 3.33Å; S260-A292 PolarHBondContact O-N 2.97Å; S260-A292 VanDerWaalsContact OG-CB 3.28Å; S260-A292 WeakPolarHBondContact OG-CB 3.35Å
293	F	91.8	Very high	66.6	Low	2 Å²	2	81.8 Å²	81.8	1%	0.009	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	158.4	-178.9	72.4	-81.3	0	0	0	112.3	Q209 I211 L252 D256 Q257 L258 R295	Q209-F293 HydrophobicContact CB-CD1 4.2Å; Q209-F293 HydrophobicContact CB-CE1 3.74Å; Q209-F293 HydrophobicContact CB-CE2 4.22Å; Q209-F293 HydrophobicContact CB-CZ 3.75Å; Q209-F293 HydrophobicContact CG-CZ 4.49Å; Q209-F293 PolarHBondContact N-O 3.28Å; Q209-F293 PolarHBondContact O-N 2.93Å; I211-F293 HydrophobicContact CD1-CE1 4.22Å; I211-F293 HydrophobicContact CG1-CD1 4.42Å; I211-F293 HydrophobicContact CG1-CE1 4.15Å; I211-F293 HydrophobicContact CG2-CE1 3.88Å; L252-F293 HydrophobicContact CD2-CB 4.22Å; L252-F293 HydrophobicContact CD2-CD1 3.4Å; L252-F293 HydrophobicContact CD2-CD2 4.04Å; L252-F293 HydrophobicContact CD2-CE1 3.63Å; L252-F293 HydrophobicContact CD2-CE2 4.24Å; L252-F293 HydrophobicContact CD2-CG 3.61Å; L252-F293 HydrophobicContact CD2-CZ 4.05Å; D256-F293 HydrophobicContact CB-CD2 3.89Å; D256-F293 WeakPolarHBondContact OD2-CE2 3.48Å; Q257-F293 CarbonylContact O-C 3.55Å; Q257-F293 WeakPolarHBondContact O-CA 3.48Å; Q257-F293 VanDerWaalsContact O-CB 3.25Å; Q257-F293 WeakPolarHBondContact O-CB 3.07Å; L258-F293 HydrophobicContact CD2-CB 4.34Å; F293-R295 HydrophobicContact CE2-CB 4.23Å
294	I	87.3	Confident	64.6	Low	13 Å²	13	80.3 Å²	80.3	7%	0.067	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.6	172.5	-61.6	163.4	0	0	0	107.8	I208 Q257 V259 R296	I208-I294 HydrophobicContact CB-CG1 4.4Å; I208-I294 HydrophobicContact CG1-CD1 3.95Å; I208-I294 HydrophobicContact CG1-CG1 3.7Å; Q257-I294 HydrophobicContact CB-CB 4.26Å; Q257-I294 PolarHBondContact N-O 3.07Å; Q257-I294 PolarHBondContact O-N 3.47Å; V259-I294 HydrophobicContact CG2-CD1 3.76Å; V259-I294 HydrophobicContact CG2-CG1 3.77Å; I294-R296 PolarHBondContact O-N 3.39Å
295	R	85	Confident	62.1	Low	62 Å²	62	79.5 Å²	79.5	23%	0.234	49%	0.486	C	S	.	.			trans	-77.6	101.5	173.8	178.1	59	56.2	88.1	1.6	108.6	R251 Q253 D256 F293	R251-R295 PolarHBondContact O-NH2 2.91Å; Q253-R295 VanDerWaalsContact CD-CZ 3.43Å; Q253-R295 VanDerWaalsContact OE1-NH1 3.11Å; D256-R295 VanDerWaalsContact CG-NE 3.35Å; D256-R295 WeakPolarHBondContact OD1-CD 3.48Å; D256-R295 IonicContact OD1-CZ 2.75Å; D256-R295 IonicContact OD1-NE 2.88Å; D256-R295 PolarHBondContact OD1-NE 3.37Å; D256-R295 IonicContact OD1-NH2 3.79Å; D256-R295 IonicContact OD2-CZ 3.72Å; D256-R295 IonicContact OD2-NE 3.24Å; D256-R295 PolarHBondContact OD2-NE 2.97Å; D256-R295 IonicContact OD2-NH2 3.12Å; D256-R295 PolarHBondContact OD2-NH2 3.22Å; F293-R295 HydrophobicContact CE2-CB 4.23Å
296	R	65.6	Low	59.9	Low	142 Å²	142	77.9 Å²	77.9	54%	0.536	48%	0.478	S	S	.	.			trans	-71	130.6	162.9	-66.1	-166.5	70.2	142.5	2.1	107.7	I294 S298	I294-R296 PolarHBondContact O-N 3.39Å; R296-S298 VanDerWaalsContact C-N 3.28Å; R296-S298 PolarHBondContact O-N 2.79Å
297	R	47.8	Very low	57.4	Low	193 Å²	193	83 Å²	83	73%	0.728	50%	0.499	S	S	*	.			trans	-61.9	96.7	168.3	-61.9	-177.5	95.3	178.9	7.6	106.8	S299	R297-S299 PolarHBondContact O-N 2.84Å
298	S	40.4	Very low	54.8	Low	76 Å²	76	84 Å²	84	53%	0.531	51%	0.509	S	S	.	.			trans	-74.1	119.2	166.2	-60.7	0	0	0	0	106.3	R296 S300	R296-S298 VanDerWaalsContact C-N 3.28Å; R296-S298 PolarHBondContact O-N 2.79Å; S298-S300 PolarHBondContact O-N 3.31Å; S298-S300 VanDerWaalsContact O-N 3.08Å
299	S	30.3	Very low	52.6	Low	116 Å²	116	86.2 Å²	86.2	81%	0.811	52%	0.524	S	S	*	.			trans	-49.3	116.2	150.1	25.6	0	0	0	0	106.7	R297 S301	R297-S299 PolarHBondContact O-N 2.84Å; S299-S301 PolarHBondContact O-N 3.46Å
300	S	32.8	Very low	49.8	Very low	101 Å²	101	92.3 Å²	92.3	71%	0.706	56%	0.561	S	S	*	*			trans	-18.4	119.7	179.7	48.6	0	0	0	0	116.8	S298	S298-S300 PolarHBondContact O-N 3.31Å; S298-S300 VanDerWaalsContact O-N 3.08Å
301	S	28.2	Very low	46.8	Very low	103 Å²	103	94.3 Å²	94.3	72%	0.72	58%	0.581	S	S	*	*			trans	36.8	119.8	131.9	61.1	0	0	0	0	119.1	S299	S299-S301 PolarHBondContact O-N 3.46Å
302	S	27.6	Very low	43.7	Very low	132 Å²	132	101 Å²	101	92%	0.923	62%	0.616	S	S	*	*			trans	-147.3	90.8	143.1	-73.1	0	0	0	0	110.8
303	S	31.3	Very low	40.7	Very low	110 Å²	110	109.2 Å²	109.2	77%	0.769	65%	0.653	S	S	*	*			trans	-137	130.4	145.3	63.2	0	0	0	0	104.9
304	S	34.6	Very low	37.5	Very low	116 Å²	116	112.8 Å²	112.8	81%	0.811	69%	0.69	S	S	*	*			cis	-176.4	147.4	9.2	22.9	0	0	0	0	107.6
305	G	26.9	Very low	34.5	Very low	77 Å²	77	118.2 Å²	118.2	79%	0.794	73%	0.728	S	S	*	*			trans	78.6	141.4	163.8	0	0	0	0	0	116.2
306	S	26.8	Very low	31.6	Very low	97 Å²	97	118.5 Å²	118.5	68%	0.678	75%	0.751	S	S	*	*			cis	-175.6	158.2	34.2	57.3	0	0	0	0	113.2
307	H	26.1	Very low	29.8	Very low	172 Å²	172	119.1 Å²	119.1	80%	0.796	77%	0.77	S	S	*	*			trans	72.1	126.4	157.4	-54	-61.3	0	0	0	120.7
308	S	26.6	Very low	28.7	Very low	121 Å²	121	113.1 Å²	113.1	85%	0.846	77%	0.768	S	S	*	*				-158.8	158.2	117.8	-84	0	0	0	0	111.7
309	P	39.8	Very low	28.1	Very low	109 Å²	109	114.5 Å²	114.5	71%	0.708	78%	0.784	S	S	*	*			trans	-123.1	179.5	-133.4	44.5	-33.7	0	0	0	115.9
310	V	28.1	Very low	27.8	Very low	130 Å²	130	112.2 Å²	112.2	79%	0.788	78%	0.779	S	S	*	*			trans	78.8	132.8	150.8	175.8	0	0	0	0	115.9
311	C	24.3	Very low	28.3	Very low	101 Å²	101	112.8 Å²	112.8	68%	0.682	78%	0.781	S	S	*	*			cis	-158.5	133.8	33.2	-126	0	0	0	0	109.8
312	L	26.8	Very low	28.2	Very low	141 Å²	141	116 Å²	116	74%	0.738	78%	0.784	S	S	*	*				57	111.9	105	-81.9	160	0	0	0	119.5
313	Q	26.8	Very low	28.2	Very low	179 Å²	179	115.2 Å²	115.2	84%	0.836	77%	0.774	S	S	*	*				86.4	120.7	124.2	-152.8	143.2	13	0	0	120.8
314	G	24.1	Very low	28	Very low	77 Å²	77	119 Å²	119	79%	0.794	78%	0.777	S	S	*	*			trans	177.1	119.7	163	0	0	0	0	0	113.1
315	C	24.5	Very low	27.5	Very low	127 Å²	127	117.8 Å²	117.8	86%	0.858	77%	0.773	S	S	*	*			trans	-71.8	151.9	-169.8	-61.5	0	0	0	0	116.1
316	G	24.8	Very low	27.6	Very low	69 Å²	69	122.7 Å²	122.7	71%	0.711	78%	0.78	S	S	*	*				73.1	133.4	119.4	0	0	0	0	0	121.6
317	V	26.4	Very low	27.5	Very low	154 Å²	154	121.1 Å²	121.1	93%	0.933	78%	0.779	S	S	*	*			trans	90.1	120.4	147.6	-165.3	0	0	0	0	118.1
318	G	25.8	Very low	27.5	Very low	67 Å²	67	121.7 Å²	121.7	69%	0.691	79%	0.787	S	S	*	*				115.6	114.3	127.7	0	0	0	0	0	119.4
319	A	27.5	Very low	27.4	Very low	105 Å²	105	119.3 Å²	119.3	87%	0.868	78%	0.782	S	S	*	*			trans	72.5	126	140.3	0	0	0	0	0	120.8
320	G	24.1	Very low	26.9	Very low	69 Å²	69	120 Å²	120	71%	0.711	79%	0.79	S	S	*	*			trans	-72.4	-158.8	152.9	0	0	0	0	0	111.6
321	P	42.5	Very low	27	Very low	113 Å²	113	118.8 Å²	118.8	73%	0.734	79%	0.793	S	S	*	*			cis	-143.9	179.7	4.4	45.4	-27	0	0	0	115.8
322	Q	26.9	Very low	27.1	Very low	169 Å²	169	118.3 Å²	118.3	79%	0.79	80%	0.796	S	S	*	*			trans	59.3	129.8	151.9	-67.7	-162.1	64.5	0	0	122
323	T	28.4	Very low	27.2	Very low	116 Å²	116	119.7 Å²	119.7	71%	0.712	80%	0.803	S	S	*	*				172.7	136.1	95	35	0	0	0	0	114
324	K	25.9	Very low	27.4	Very low	191 Å²	191	119 Å²	119	83%	0.83	80%	0.8	S	S	*	*			trans	55.6	112.9	144.7	-66.7	177.4	176.7	177.3	0	119.5
325	A	25.3	Very low	27.6	Very low	90 Å²	90	124 Å²	124	74%	0.744	80%	0.803	S	S	*	*				78.4	119.4	66.4	0	0	0	0	0	114.2
326	L	28.1	Very low	27.5	Very low	179 Å²	179	123.8 Å²	123.8	94%	0.937	80%	0.798	S	S	*	*				-176.7	131.2	118.6	-92.4	165.6	0	0	0	109.4
327	G	23.9	Very low	27.6	Very low	64 Å²	64	129.8 Å²	129.8	66%	0.66	81%	0.81	S	S	*	*			trans	-115.8	169.9	169.7	0	0	0	0	0	111.2
328	L	27.5	Very low	27.6	Very low	184 Å²	184	128.5 Å²	128.5	96%	0.963	80%	0.802	S	S	*	*			trans	-164.6	119.1	158.3	-126.1	75	0	0	0	103.2
329	G	25	Very low	27.6	Very low	71 Å²	71	131.8 Å²	131.8	73%	0.732	81%	0.809	S	S	*	*			cis	122.9	90.4	47.9	0	0	0	0	0	105.6
330	S	29	Very low	27.4	Very low	124 Å²	124	136.2 Å²	136.2	87%	0.867	81%	0.808	S	S	*	*				79.1	119.2	98.6	-167.2	0	0	0	0	115.5
331	A	29.1	Very low	27.8	Very low	105 Å²	105	140.1 Å²	140.1	87%	0.868	81%	0.811	S	S	*	*				-162.2	130.3	129.9	0	0	0	0	0	110.1
332	A	26.6	Very low	26.9	Very low	90 Å²	90	141.3 Å²	141.3	74%	0.744	82%	0.817	S	S	*	*			trans	-95.1	166.1	-171.4	0	0	0	0	0	112.9
333	L	29.7	Very low	26.8	Very low	170 Å²	170	138.3 Å²	138.3	89%	0.89	82%	0.815	S	S	*	*			trans	-160.7	147.7	130.4	-102.4	162.5	0	0	0	111
334	Q	30.2	Very low	26.9	Very low	165 Å²	165	138.2 Å²	138.2	77%	0.771	82%	0.819	S	S	*	*			trans	-77.9	163.4	-163.5	-59.1	163.8	-23.7	0	0	111.4
335	Q	28	Very low	26.9	Very low	182 Å²	182	140.6 Å²	140.6	85%	0.85	82%	0.823	S	S	*	*				-174.4	142.6	71.4	-116	167.1	-14.3	0	0	112.4
336	T	23.5	Very low	27	Very low	122 Å²	122	143.4 Å²	143.4	75%	0.748	83%	0.825	S	S	*	*			trans	-64.5	150.5	171.3	-29.8	0	0	0	0	113
337	M	26.6	Very low	27.8	Very low	195 Å²	195	140.5 Å²	140.5	96%	0.961	82%	0.817	S	S	*	*				-166.4	136.1	122.8	-72.4	-142.6	-179.5	0	0	111
338	V	26.5	Very low	27.9	Very low	128 Å²	128	142 Å²	142	78%	0.776	82%	0.823	S	S	*	*			trans	-112.2	143.7	-179.1	165.4	0	0	0	0	108.9
339	T	26.3	Very low	27.7	Very low	135 Å²	135	137.9 Å²	137.9	83%	0.828	81%	0.809	S	S	*	*			trans	-177.2	150.4	146.6	25.5	0	0	0	0	108.1
340	K	22.5	Very low	27.7	Very low	198 Å²	198	142.9 Å²	142.9	86%	0.861	81%	0.813	S	S	*	*			cis	-174.4	155.5	-18.5	-172.8	171.4	177.8	177.9	0	104.8
341	I	31.9	Very low	27.6	Very low	151 Å²	151	142.7 Å²	142.7	77%	0.774	81%	0.807	S	S	*	*			trans	-87.2	150.1	-165.5	-45.6	153.7	0	0	0	112
342	T	24.4	Very low	27.3	Very low	138 Å²	138	145.2 Å²	145.2	85%	0.847	81%	0.805	S	S	*	*			trans	-174.8	116.2	142.3	17.9	0	0	0	0	108
343	S	24.6	Very low	27.9	Very low	106 Å²	106	146.5 Å²	146.5	74%	0.741	81%	0.805	S	S	*	*				76.2	112.3	55.1	176.3	0	0	0	0	116
344	S	30.5	Very low	28.7	Very low	115 Å²	115	144 Å²	144	80%	0.804	80%	0.799	S	S	*	*			trans	164	148.6	139.8	52.4	0	0	0	0	108.7
345	R	25	Very low	28.4	Very low	241 Å²	241	143.3 Å²	143.3	91%	0.909	81%	0.806	S	S	*	*			cis	-172.7	139.3	-4.6	172.8	177.8	-164.6	161.8	3.4	107.4
346	N	28.5	Very low	28.3	Very low	148 Å²	148	141.4 Å²	141.4	79%	0.791	80%	0.802	S	S	*	*			trans	-56.8	176.1	170.2	-86	-11	0	0	0	114
347	P	44.9	Very low	28.5	Very low	119 Å²	119	141.1 Å²	141.1	77%	0.773	80%	0.8	S	S	*	*			cis	-160.8	179.4	43.9	42.2	-17.6	0	0	0	122.2
348	A	24.7	Very low	28.4	Very low	95 Å²	95	138.5 Å²	138.5	79%	0.785	80%	0.795	S	S	*	*			trans	79.6	139.1	152.5	0	0	0	0	0	118
349	C	24.6	Very low	28.4	Very low	98 Å²	98	140.1 Å²	140.1	66%	0.662	79%	0.794	S	S	*	*			cis	-163.8	144.1	15.1	-140.2	0	0	0	0	110.5
350	E	24.2	Very low	28.3	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	79%	0.794	S	S	*	*			trans	50.2	143.3	130.6	-72.1	-177.7	175.1	0	0	121.4
351	T	26.6	Very low	28.4	Very low	120 Å²	120	141.6 Å²	141.6	74%	0.736	79%	0.794	S	S	*	*			cis	-170.2	157.4	4.4	-82.1	0	0	0	0	108.4
352	L	24.4	Very low	28.1	Very low	158 Å²	158	140.7 Å²	140.7	83%	0.827	80%	0.795	S	S	*	*			trans	-58.2	-169.1	-178.2	-52.8	163.2	0	0	0	116.1
353	P	37.3	Very low	28	Very low	117 Å²	117	138 Å²	138	76%	0.76	79%	0.787	S	S	*	*			cis	-136.1	-171.7	-16	15.6	13.1	0	0	0	115.1
354	P	46.4	Very low	28.8	Very low	117 Å²	117	139.1 Å²	139.1	76%	0.76	79%	0.792	S	S	*	*			trans	-100.8	161.8	-174.5	38.9	-31.6	0	0	0	114.9
355	V	24.6	Very low	28.5	Very low	152 Å²	152	136.9 Å²	136.9	92%	0.921	79%	0.787	S	S	*	*			trans	-145.6	141.5	167.2	-178.4	0	0	0	0	113.1
356	N	25.9	Very low	28.6	Very low	142 Å²	142	136.6 Å²	136.6	76%	0.759	79%	0.786	S	S	*	*			trans	-83.2	155.8	-175.7	-99.9	-33	0	0	0	115.4
357	V	27.6	Very low	28.4	Very low	116 Å²	116	134.5 Å²	134.5	70%	0.703	78%	0.778	S	S	*	*			trans	57.1	129.9	136.2	-177.5	0	0	0	0	119.5
358	T	25.8	Very low	27.4	Very low	139 Å²	139	135.8 Å²	135.8	85%	0.853	77%	0.774	S	S	*	*				-164.9	136.4	125.6	-67.1	0	0	0	0	111.9
359	Q	25.6	Very low	27.4	Very low	163 Å²	163	138.3 Å²	138.3	76%	0.762	77%	0.77	S	S	*	*			trans	-78.2	159.4	177.1	-56.9	165	-29.8	0	0	113.2
360	V	24.8	Very low	27.4	Very low	137 Å²	137	140.2 Å²	140.2	83%	0.83	78%	0.778	S	S	*	*			trans	-161	105.6	130.3	-163.5	0	0	0	0	107
361	R	23.6	Very low	27.3	Very low	227 Å²	227	135.1 Å²	135.1	86%	0.857	77%	0.773	S	S	*	*				43.6	126	93	-163.4	159.3	-87.1	167.9	-4.7	113.8
362	V	25.8	Very low	27.2	Very low	132 Å²	132	135.5 Å²	135.5	80%	0.8	78%	0.775	S	S	*	*				-170.5	130.6	94.8	159.3	0	0	0	0	108.5
363	A	22.2	Very low	27.1	Very low	81 Å²	81	133 Å²	133	67%	0.669	77%	0.77	S	S	*	*			trans	-93	-155.6	167.7	0	0	0	0	0	108.7
364	P	41.9	Very low	26.5	Very low	130 Å²	130	133 Å²	133	84%	0.844	77%	0.773	S	S	*	*			cis	-139	-177.9	-21	30.7	-8.8	0	0	0	113.6
365	G	24.1	Very low	25.5	Very low	68 Å²	68	131.8 Å²	131.8	70%	0.701	77%	0.773	S	S	*	*			trans	132.4	137.4	139.3	0	0	0	0	0	113.3
366	R	26.1	Very low	26.5	Very low	235 Å²	235	130.2 Å²	130.2	89%	0.887	77%	0.766	S	S	*	*			cis	-171.9	143.6	-2	-121.2	-172.6	177.4	-173.3	-2.3	105.9
367	T	24.8	Very low	26.4	Very low	103 Å²	103	132 Å²	132	63%	0.632	77%	0.77	S	S	*	*			trans	25.5	143.3	132.4	43.7	0	0	0	0	119.2
368	E	23.9	Very low	26.5	Very low	147 Å²	147	130.9 Å²	130.9	69%	0.687	77%	0.767	S	S	*	*			cis	178.5	161.1	25.9	-118.1	172.5	150.1	0	0	111.3
369	Q	26.1	Very low	26.3	Very low	148 Å²	148	131.3 Å²	131.3	69%	0.692	76%	0.764	S	S	*	*			trans	68.5	109.5	138.4	-73.3	174.6	32.5	0	0	124.5
370	T	23.5	Very low	26.3	Very low	137 Å²	137	128.5 Å²	128.5	84%	0.84	76%	0.762	S	S	*	*				39	131.1	110.5	-22.7	0	0	0	0	121.6
371	G	23	Very low	26.4	Very low	69 Å²	69	127 Å²	127	71%	0.711	76%	0.758	S	S	*	*			trans	164.1	64.1	158.3	0	0	0	0	0	120
372	V	22.8	Very low	26.5	Very low	127 Å²	127	122 Å²	122	77%	0.77	75%	0.753	S	S	*	*			trans	34.4	132.5	136.1	-147.7	0	0	0	0	123.4
373	S	23.6	Very low	26.4	Very low	105 Å²	105	122.5 Å²	122.5	73%	0.734	75%	0.751	S	S	*	*			trans	61.9	143.1	143.7	48.6	0	0	0	0	120
374	S	24	Very low	26.6	Very low	117 Å²	117	125.1 Å²	125.1	82%	0.818	76%	0.759	S	S	*	*			cis	-171.9	165.2	7.8	35.5	0	0	0	0	109.4
375	A	25.1	Very low	25.7	Very low	92 Å²	92	126.5 Å²	126.5	76%	0.76	76%	0.759	S	S	*	*			trans	-61.3	-164.2	180	0	0	0	0	0	115.4
376	P	47.3	Very low	26.7	Very low	119 Å²	119	128.4 Å²	128.4	77%	0.773	76%	0.759	S	S	*	*			cis	-144.2	-170.5	-0.3	38.9	-16	0	0	0	115.6
377	Q	23.5	Very low	26.6	Very low	180 Å²	180	124.6 Å²	124.6	84%	0.841	76%	0.757	S	S	*	*			trans	159.5	113.6	146.7	-89.5	179.8	-6.7	0	0	108.6
378	S	28.1	Very low	26.7	Very low	92 Å²	92	125 Å²	125	64%	0.643	76%	0.763	S	S	*	*				87.1	145.5	63.3	68.4	0	0	0	0	115
379	D	23.2	Very low	26.8	Very low	149 Å²	149	121.7 Å²	121.7	80%	0.797	77%	0.769	S	S	*	*			trans	107.1	137.3	167.7	-54.6	-6.2	0	0	0	115.1
380	S	25.4	Very low	26.7	Very low	103 Å²	103	120.3 Å²	120.3	72%	0.72	78%	0.775	S	S	*	*			cis	148.2	128.5	-25.5	58.9	0	0	0	0	107.7
381	S	26.1	Very low	26.9	Very low	106 Å²	106	118.6 Å²	118.6	74%	0.741	77%	0.769	S	S	*	*			trans	158	109.4	150.2	56.9	0	0	0	0	110.7
382	T	25.3	Very low	27	Very low	121 Å²	121	124.3 Å²	124.3	74%	0.742	78%	0.777	S	S	*	*				58.7	113.4	82.2	60.3	0	0	0	0	116.1
383	D	24.2	Very low	27.3	Very low	144 Å²	144	123.5 Å²	123.5	77%	0.77	78%	0.775	S	S	*	*				165.8	137.3	101.5	-98.7	-23.4	0	0	0	117.4
384	T	26.7	Very low	27.6	Very low	135 Å²	135	124.4 Å²	124.4	83%	0.828	78%	0.778	S	S	*	*			trans	44.6	135.5	147.7	43.1	0	0	0	0	128.1
385	N	23.8	Very low	27.9	Very low	159 Å²	159	126.6 Å²	126.6	85%	0.85	78%	0.776	S	S	*	*			trans	-69.5	-174	167.5	-89.6	-32.3	0	0	0	115
386	P	43.6	Very low	28	Very low	108 Å²	108	134 Å²	134	70%	0.701	78%	0.784	S	S	*	*			cis	-145.1	-172.9	14.6	35.5	-10.4	0	0	0	119.1
387	D	24.6	Very low	27	Very low	156 Å²	156	136.5 Å²	136.5	83%	0.834	78%	0.783	S	S	*	*			trans	77	141.2	156.7	-85.5	-9.4	0	0	0	120.9
388	S	27.7	Very low	27	Very low	111 Å²	111	132.9 Å²	132.9	78%	0.776	78%	0.776	S	S	*	*			cis	-171.1	153.3	-0.4	38.8	0	0	0	0	111
389	G	25.5	Very low	27.3	Very low	78 Å²	78	134 Å²	134	80%	0.804	78%	0.783	S	S	*	*			trans	128.8	88.5	150.9	0	0	0	0	0	122.7
390	S	24.3	Very low	27.7	Very low	118 Å²	118	133.1 Å²	133.1	83%	0.825	78%	0.778	S	S	*	*			trans	48.9	121.2	136.7	162.7	0	0	0	0	121.5
391	S	26.6	Very low	28	Very low	102 Å²	102	132.5 Å²	132.5	71%	0.713	77%	0.774	S	S	*	*				175.6	152.2	59.1	39.9	0	0	0	0	114.3
392	Q	25.8	Very low	28.7	Very low	188 Å²	188	132.8 Å²	132.8	88%	0.879	78%	0.776	S	S	*	*			trans	80.2	158.4	165.3	-69.3	-171.2	-47.5	0	0	121.4
393	P	29.2	Very low	29.9	Very low	110 Å²	110	131.1 Å²	131.1	71%	0.714	77%	0.769	S	S	*	*				-95.4	172.4	-90.3	33.2	-14	0	0	0	114.2	Q395	P393-Q395 PolarHBondContact O-N 3.38Å; P393-Q395 VanDerWaalsContact O-N 3.14Å
394	P	30.3	Very low	31.8	Very low	125 Å²	125	126.6 Å²	126.6	81%	0.812	75%	0.748	S	S	*	*			trans	-80.4	105.3	-169.3	32	-31.9	0	0	0	112.3	R396	P394-R396 PolarHBondContact O-N 2.85Å
395	Q	28.6	Very low	33.7	Very low	163 Å²	163	124.6 Å²	124.6	76%	0.762	73%	0.725	S	S	*	*			trans	-78.7	109.5	155.3	-71.5	-151.5	-28.9	0	0	108.9	P393 K397	P393-Q395 PolarHBondContact O-N 3.38Å; P393-Q395 VanDerWaalsContact O-N 3.14Å; Q395-K397 VanDerWaalsContact C-N 3.27Å; Q395-K397 PolarHBondContact O-N 2.75Å
396	R	28.1	Very low	36.1	Very low	246 Å²	246	118.3 Å²	118.3	93%	0.928	69%	0.691	S	S	*	*			trans	-68.7	87.9	166.2	-70.6	-174	-174.3	163.8	1.8	109	P394 C398	P394-R396 PolarHBondContact O-N 2.85Å; R396-C398 PolarHBondContact O-N 3.12Å
397	K	25.3	Very low	37.6	Very low	173 Å²	173	117.8 Å²	117.8	75%	0.752	68%	0.677	S	S	*	*			trans	-82.9	94.6	157	-69.7	178.7	-179.6	177.3	0	106.8	Q395 S399	Q395-K397 VanDerWaalsContact C-N 3.27Å; Q395-K397 PolarHBondContact O-N 2.75Å; K397-S399 PolarHBondContact O-N 3.12Å
398	C	25.1	Very low	40	Very low	103 Å²	103	112.1 Å²	112.1	70%	0.696	65%	0.647	S	S	*	*			trans	-80.1	89.6	166.8	-120.8	0	0	0	0	107.8	R396 L400	R396-C398 PolarHBondContact O-N 3.12Å; C398-L400 VanDerWaalsContact C-N 3.27Å; C398-L400 HydrophobicContact CB-CD1 4.34Å; C398-L400 HydrophobicContact CB-CG 4.1Å; C398-L400 PolarHBondContact O-N 3.01Å; C398-L400 VanDerWaalsContact O-N 3.11Å
399	S	34.8	Very low	42.2	Very low	115 Å²	115	113.2 Å²	113.2	80%	0.804	64%	0.64	S	S	*	*			trans	-71.7	90.9	155.6	56.2	0	0	0	0	107	K397	K397-S399 PolarHBondContact O-N 3.12Å
400	L	29.7	Very low	44.4	Very low	132 Å²	132	112.5 Å²	112.5	69%	0.691	61%	0.613	S	S	*	*			trans	-96.7	113.4	171.3	-67.8	177.1	0	0	0	109	C398	C398-L400 VanDerWaalsContact C-N 3.27Å; C398-L400 HydrophobicContact CB-CD1 4.34Å; C398-L400 HydrophobicContact CB-CG 4.1Å; C398-L400 PolarHBondContact O-N 3.01Å; C398-L400 VanDerWaalsContact O-N 3.11Å
401	S	32.5	Very low	46.8	Very low	89 Å²	89	107 Å²	107	62%	0.622	57%	0.574	S	S	*	*			trans	-48.6	164.2	174.6	51.2	0	0	0	0	114.5	S403	S401-S403 PolarHBondContact O-N 3.27Å
402	S	41.8	Very low	48.9	Very low	113 Å²	113	106.1 Å²	106.1	79%	0.79	56%	0.559	S	S	*	*	S	Bend	trans	-49.3	41	169.8	-53.1	0	0	0	0	117.8
403	S	50.3	Low	51	Low	86 Å²	86	102.2 Å²	102.2	60%	0.601	54%	0.541	S	S	*	.			trans	-132.4	12.4	-172.7	-166.8	0	0	0	0	114.8	S401 R405	S401-S403 PolarHBondContact O-N 3.27Å; S403-R405 PolarHBondContact O-N 3.44Å
404	C	62.5	Low	52.8	Low	49 Å²	49	97.1 Å²	97.1	33%	0.331	51%	0.508	S	S	.	.			trans	-64.9	122.6	172.7	-63	0	0	0	0	109.9	F444 L480	C404-F444 HydrophobicContact CB-CB 4.22Å; C404-F444 WeakPolarHBondContact O-CB 3.48Å; C404-F444 PolarHBondContact O-N 3.43Å; C404-L480 HydrophobicContact CB-CD1 4.47Å
405	R	67.8	Low	54.9	Low	92 Å²	92	91.5 Å²	91.5	35%	0.347	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	139.7	175.5	-55.2	-173.1	74.5	110.6	2.6	109.2	S403 D437 T441 V442 L480	S403-R405 PolarHBondContact O-N 3.44Å; R405-D437 IonicContact CZ-OD1 3.37Å; R405-D437 IonicContact CZ-OD2 3.46Å; R405-D437 IonicContact NE-OD2 3.18Å; R405-D437 IonicContact NH1-OD2 3.34Å; R405-D437 PolarHBondContact NH1-OD2 2.97Å; R405-D437 IonicContact NH2-OD1 3.72Å; R405-D437 PolarHBondContact NH2-OD1 3.05Å; R405-D437 IonicContact NH2-OD2 3.32Å; R405-D437 PolarHBondContact NH2-OD2 3.44Å; R405-T441 PolarHBondContact NH2-O 3.01Å; R405-V442 CarbonylContact C-O 3.56Å; R405-V442 WeakPolarHBondContact CA-O 3.38Å; R405-L480 VanDerWaalsContact O-CD2 3.31Å; R405-L480 WeakPolarHBondContact O-CD2 3.2Å
406	F	73.4	Confident	56.9	Low	28 Å²	28	89.2 Å²	89.2	12%	0.123	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	156.6	176.2	69.4	-79.9	0	0	0	110.1	L411 T441 V442 F447 L480	F406-L411 HydrophobicContact CE2-CB 4.46Å; F406-L411 HydrophobicContact CE2-CD1 3.93Å; F406-L411 HydrophobicContact CZ-CD1 4.01Å; F406-T441 CarbonylContact O-C 3.53Å; F406-T441 VanDerWaalsContact O-CA 3.28Å; F406-T441 WeakPolarHBondContact O-CA 3.43Å; F406-V442 PolarHBondContact N-O 3.43Å; F406-V442 PolarHBondContact O-N 2.85Å; F406-F447 HydrophobicContact CE1-CB 3.57Å; F406-F447 HydrophobicContact CE1-CD1 4.04Å; F406-F447 HydrophobicContact CE1-CD2 4.4Å; F406-F447 AromaticContact CE1-CG 3.75Å; F406-F447 HydrophobicContact CE1-CG 3.75Å; F406-F447 HydrophobicContact CZ-CB 3.72Å; F406-F447 HydrophobicContact CZ-CD1 4.06Å; F406-F447 AromaticContact CZ-CD2 3.74Å; F406-F447 HydrophobicContact CZ-CD2 3.74Å; F406-F447 HydrophobicContact CZ-CE2 4.36Å; F406-F447 AromaticContact CZ-CG 3.56Å; F406-F447 HydrophobicContact CZ-CG 3.56Å; F406-L480 HydrophobicContact CB-CD2 4.17Å
407	K	76.5	Confident	58.7	Low	96 Å²	96	82.9 Å²	82.9	42%	0.417	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	136.6	178.8	-65.6	-174.5	177.7	179.8	0	110.7	E409 R410 G440 T441	K407-E409 HydrophobicContact CB-CG 3.82Å; K407-E409 HydrophobicContact CD-CG 4.34Å; K407-E409 WeakPolarHBondContact CD-OE1 3.28Å; K407-E409 IonicContact NZ-OE1 3.4Å; K407-E409 PolarHBondContact NZ-OE1 3.31Å; K407-E409 PolarHBondContact O-N 3.24Å; K407-E409 VanDerWaalsContact O-N 3.08Å; K407-R410 PolarHBondContact O-N 3.12Å; K407-G440 WeakPolarHBondContact CA-O 3.43Å; K407-T441 HydrophobicContact CG-CG2 3.8Å
408	L	75.2	Confident	60.7	Low	38 Å²	38	76.3 Å²	76.3	20%	0.199	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-59.8	-23.8	-179.3	-175.6	62.1	0	0	0	112.7	R410 L411 L434 A436 G440 V442	L408-R410 VanDerWaalsContact C-N 3.3Å; L408-R410 PolarHBondContact O-N 2.88Å; L408-L411 HydrophobicContact CD1-CB 4.37Å; L408-L411 HydrophobicContact CD1-CD2 3.84Å; L408-L411 WeakPolarHBondContact O-CB 3.25Å; L408-L411 PolarHBondContact O-N 3.32Å; L408-L434 HydrophobicContact CD1-CB 4.24Å; L408-L434 HydrophobicContact CD1-CD1 4.11Å; L408-A436 HydrophobicContact CD2-CB 3.99Å; L408-G440 PolarHBondContact N-O 3.25Å; L408-V442 HydrophobicContact CB-CG2 4.06Å; L408-V442 HydrophobicContact CD1-CG2 4.02Å; L408-V442 HydrophobicContact CG-CG2 4.49Å
409	E	72.6	Confident	62.5	Low	134 Å²	134	73.7 Å²	73.7	63%	0.626	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-65.5	-27.9	175.1	69.3	-167.9	174.5	0	0	113.7	K407 L411	K407-E409 HydrophobicContact CB-CG 3.82Å; K407-E409 HydrophobicContact CD-CG 4.34Å; K407-E409 WeakPolarHBondContact CD-OE1 3.28Å; K407-E409 IonicContact NZ-OE1 3.4Å; K407-E409 PolarHBondContact NZ-OE1 3.31Å; K407-E409 PolarHBondContact O-N 3.24Å; K407-E409 VanDerWaalsContact O-N 3.08Å; E409-L411 VanDerWaalsContact C-N 3.27Å; E409-L411 PolarHBondContact O-N 3.23Å
410	R	71.9	Confident	64.3	Low	63 Å²	63	68.5 Å²	68.5	24%	0.238	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-88.2	7.3	177.4	-64.2	-169	178.2	-171.7	-6.7	113.3	K407 L408 E412 Q413 A414 L479 S482	K407-R410 PolarHBondContact O-N 3.12Å; L408-R410 VanDerWaalsContact C-N 3.3Å; L408-R410 PolarHBondContact O-N 2.88Å; R410-E412 VanDerWaalsContact C-N 3.28Å; R410-E412 PolarHBondContact O-N 2.99Å; R410-Q413 PolarHBondContact O-N 2.82Å; R410-A414 PolarHBondContact O-N 2.85Å; R410-L479 PolarHBondContact NH1-O 3Å; R410-S482 VanDerWaalsContact CZ-OG 3.28Å; R410-S482 PolarHBondContact NH1-OG 2.99Å; R410-S482 PolarHBondContact NH2-OG 3.19Å; R410-S482 VanDerWaalsContact NH2-OG 3.12Å
411	L	74.6	Confident	66	Low	2 Å²	2	71.4 Å²	71.4	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-59.2	-37.8	-179.2	-176.8	68.9	0	0	0	112.6	F406 L408 E409 A414 L415 L430 R431 L434 F447	F406-L411 HydrophobicContact CE2-CB 4.46Å; F406-L411 HydrophobicContact CE2-CD1 3.93Å; F406-L411 HydrophobicContact CZ-CD1 4.01Å; L408-L411 HydrophobicContact CD1-CB 4.37Å; L408-L411 HydrophobicContact CD1-CD2 3.84Å; L408-L411 WeakPolarHBondContact O-CB 3.25Å; L408-L411 PolarHBondContact O-N 3.32Å; E409-L411 VanDerWaalsContact C-N 3.27Å; E409-L411 PolarHBondContact O-N 3.23Å; L411-A414 PolarHBondContact O-N 3.2Å; L411-L415 HydrophobicContact CG-CD1 4.1Å; L411-L415 WeakPolarHBondContact O-CD1 3.35Å; L411-L415 VanDerWaalsContact O-CG 3.25Å; L411-L415 WeakPolarHBondContact O-CG 3.37Å; L411-L415 PolarHBondContact O-N 3.48Å; L411-L430 HydrophobicContact CD1-CD2 3.62Å; L411-L430 HydrophobicContact CD2-CB 4.46Å; L411-L430 HydrophobicContact CD2-CD2 3.76Å; L411-L430 HydrophobicContact CG-CD2 4.02Å; L411-R431 HydrophobicContact CD2-CG 3.99Å; L411-L434 HydrophobicContact CD1-CD1 3.73Å; L411-L434 HydrophobicContact CD2-CD1 4Å; L411-F447 HydrophobicContact CD1-CD2 3.52Å; L411-F447 HydrophobicContact CD1-CE2 3.32Å; L411-F447 HydrophobicContact CD1-CZ 4.36Å
412	E	70.8	Confident	68	Low	83 Å²	83	67.9 Å²	67.9	39%	0.388	36%	0.356	S	S	.	.	H	α-helix	trans	-69.2	-42.1	179.5	-70.1	-179.9	170.1	0	0	111.6	R410 A414 L415 D416 R431	R410-E412 VanDerWaalsContact C-N 3.28Å; R410-E412 PolarHBondContact O-N 2.99Å; E412-A414 VanDerWaalsContact C-N 3.31Å; E412-A414 PolarHBondContact O-N 3.14Å; E412-L415 PolarHBondContact O-N 3.38Å; E412-L415 VanDerWaalsContact O-N 3.17Å; E412-D416 PolarHBondContact O-N 3.5Å; E412-R431 IonicContact OE1-CZ 3.75Å; E412-R431 VanDerWaalsContact OE1-CZ 3.25Å; E412-R431 IonicContact OE1-NH1 3.9Å; E412-R431 PolarHBondContact OE1-NH1 2.66Å; E412-R431 IonicContact OE1-NH2 2.93Å; E412-R431 PolarHBondContact OE1-NH2 3.15Å; E412-R431 IonicContact OE2-NH2 3.72Å
413	Q	69.1	Low	69.6	Low	107 Å²	107	66.7 Å²	66.7	50%	0.5	34%	0.344	S	S	.	.	H	α-helix	trans	-63.1	-37.7	174.4	-72.8	169.4	-5.1	0	0	112	R410 L417	R410-Q413 PolarHBondContact O-N 2.82Å; Q413-L417 WeakPolarHBondContact O-CD1 3.5Å; Q413-L417 WeakPolarHBondContact O-CG 3.48Å; Q413-L417 PolarHBondContact O-N 3.35Å; Q413-L417 VanDerWaalsContact O-N 3.12Å
414	A	68.8	Low	70.8	Confident	3 Å²	3	67.8 Å²	67.8	3%	0.025	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-38.3	174.4	0	0	0	0	0	112.5	R410 L411 E412 I418 F447 F476	R410-A414 PolarHBondContact O-N 2.85Å; L411-A414 PolarHBondContact O-N 3.2Å; E412-A414 VanDerWaalsContact C-N 3.31Å; E412-A414 PolarHBondContact O-N 3.14Å; A414-I418 VanDerWaalsContact O-CD1 3.25Å; A414-I418 WeakPolarHBondContact O-CD1 3.18Å; A414-I418 WeakPolarHBondContact O-CG1 3.42Å; A414-I418 PolarHBondContact O-N 3.46Å; A414-F447 HydrophobicContact CB-CE1 4.46Å; A414-F447 HydrophobicContact CB-CZ 4.05Å; A414-F476 HydrophobicContact CB-CE1 3.65Å; A414-F476 HydrophobicContact CB-CZ 4.2Å
415	L	72.8	Confident	71.3	Confident	6 Å²	6	68.8 Å²	68.8	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-70.7	-40.5	178.1	-72.5	163.7	0	0	0	112.2	L411 E412 I418 G419 L420 P422 L430 F447 I451	L411-L415 HydrophobicContact CG-CD1 4.1Å; L411-L415 WeakPolarHBondContact O-CD1 3.35Å; L411-L415 VanDerWaalsContact O-CG 3.25Å; L411-L415 WeakPolarHBondContact O-CG 3.37Å; L411-L415 PolarHBondContact O-N 3.48Å; E412-L415 PolarHBondContact O-N 3.38Å; E412-L415 VanDerWaalsContact O-N 3.17Å; L415-I418 PolarHBondContact O-N 3.06Å; L415-G419 PolarHBondContact O-N 3.01Å; L415-L420 PolarHBondContact O-N 2.89Å; L415-P422 HydrophobicContact CD1-CG 4.22Å; L415-L430 HydrophobicContact CD1-CD2 4.41Å; L415-F447 HydrophobicContact CD2-CE2 4.37Å; L415-F447 HydrophobicContact CD2-CZ 4.47Å; L415-I451 HydrophobicContact CD2-CD1 3.33Å
416	D	71.1	Confident	71.7	Confident	116 Å²	116	66.5 Å²	66.5	62%	0.62	35%	0.349	S	S	*	.	H	α-helix	trans	-64.7	-39	177.1	-80.9	-18.1	0	0	0	112.1	E412 I418 G419	E412-D416 PolarHBondContact O-N 3.5Å; D416-I418 VanDerWaalsContact C-N 3.27Å; D416-I418 PolarHBondContact O-N 3.15Å; D416-G419 PolarHBondContact O-N 2.85Å
417	L	66.1	Low	71.6	Confident	113 Å²	113	68.8 Å²	68.8	59%	0.592	36%	0.356	S	S	*	.	H	α-helix	trans	-64.5	-30.3	175.4	-79.8	161.9	0	0	0	113.2	Q413 G419 L479	Q413-L417 WeakPolarHBondContact O-CD1 3.5Å; Q413-L417 WeakPolarHBondContact O-CG 3.48Å; Q413-L417 PolarHBondContact O-N 3.35Å; Q413-L417 VanDerWaalsContact O-N 3.12Å; L417-G419 PolarHBondContact O-N 3.39Å; L417-L479 HydrophobicContact CD1-CD1 3.36Å; L417-L479 HydrophobicContact CD1-CG 4.11Å
418	I	67.4	Low	71.3	Confident	34 Å²	34	71.2 Å²	71.2	17%	0.174	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.3	176.4	-58.3	163.1	0	0	0	110.7	A414 L415 D416 L420 F447 F471 F476	A414-I418 VanDerWaalsContact O-CD1 3.25Å; A414-I418 WeakPolarHBondContact O-CD1 3.18Å; A414-I418 WeakPolarHBondContact O-CG1 3.42Å; A414-I418 PolarHBondContact O-N 3.46Å; L415-I418 PolarHBondContact O-N 3.06Å; D416-I418 VanDerWaalsContact C-N 3.27Å; D416-I418 PolarHBondContact O-N 3.15Å; I418-L420 HydrophobicContact CB-CG 4.49Å; I418-L420 HydrophobicContact CG2-CD1 3.85Å; I418-L420 HydrophobicContact CG2-CG 3.96Å; I418-L420 PolarHBondContact O-N 3.07Å; I418-F447 HydrophobicContact CD1-CE1 4.02Å; I418-F447 HydrophobicContact CD1-CZ 3.97Å; I418-F471 HydrophobicContact CD1-CE1 4.39Å; I418-F471 HydrophobicContact CG1-CE1 4.46Å; I418-F471 HydrophobicContact CG2-CE1 4.25Å; I418-F476 HydrophobicContact CD1-CE2 4.44Å; I418-F476 HydrophobicContact CD1-CZ 3.98Å; I418-F476 HydrophobicContact CG1-CE2 4.31Å; I418-F476 HydrophobicContact CG1-CZ 4.02Å
419	G	62.7	Low	71.4	Confident	49 Å²	49	70.8 Å²	70.8	51%	0.505	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	14.5	179.8	0	0	0	0	0	113.8	L415 D416 L417	L415-G419 PolarHBondContact O-N 3.01Å; D416-G419 PolarHBondContact O-N 2.85Å; L417-G419 PolarHBondContact O-N 3.39Å
420	L	71.9	Confident	71.7	Confident	6 Å²	6	64.4 Å²	64.4	3%	0.031	34%	0.341	C	S	.	.			trans	-86.1	129.9	176.3	-66.2	173.3	0	0	0	109.2	L415 I418 P422 I451 F455 L459	L415-L420 PolarHBondContact O-N 2.89Å; I418-L420 HydrophobicContact CB-CG 4.49Å; I418-L420 HydrophobicContact CG2-CD1 3.85Å; I418-L420 HydrophobicContact CG2-CG 3.96Å; I418-L420 PolarHBondContact O-N 3.07Å; L420-P422 VanDerWaalsContact C-CD 3.41Å; L420-P422 WeakPolarHBondContact O-CD 3.3Å; L420-I451 HydrophobicContact CD1-CG2 3.95Å; L420-F455 HydrophobicContact CD1-CB 4.21Å; L420-F455 HydrophobicContact CD1-CD1 4.2Å; L420-F455 HydrophobicContact CD1-CG 4.05Å; L420-F455 HydrophobicContact CD2-CD1 4.36Å; L420-L459 HydrophobicContact CD1-CD1 4.2Å; L420-L459 HydrophobicContact CD2-CD1 4.38Å
421	K	65.4	Low	71.9	Confident	192 Å²	192	66.4 Å²	66.4	84%	0.835	35%	0.349	S	S	*	.			trans	-103.5	83	172.1	-71.2	-169.8	176.4	-179.5	0	110.7
422	P	74.7	Confident	71.9	Confident	15 Å²	15	70.6 Å²	70.6	10%	0.097	38%	0.379	C	S	.	.			trans	-73.6	138.3	-176	31.1	-38.2	0	0	0	112.8	L415 L420 Q426 R427 F455	L415-P422 HydrophobicContact CD1-CG 4.22Å; L420-P422 VanDerWaalsContact C-CD 3.41Å; L420-P422 WeakPolarHBondContact O-CD 3.3Å; P422-Q426 HydrophobicContact CB-CB 4.28Å; P422-R427 HydrophobicContact CB-CG 3.83Å; P422-R427 HydrophobicContact CG-CG 3.61Å; P422-R427 PolarHBondContact O-NE 2.9Å; P422-F455 HydrophobicContact CB-CE1 3.65Å; P422-F455 HydrophobicContact CB-CZ 3.58Å
423	T	76.2	Confident	72.1	Confident	88 Å²	88	72 Å²	72	54%	0.54	38%	0.38	S	S	.	.			trans	-65.1	154	172.3	-48.5	0	0	0	0	110.4	A425 Q426 R427	T423-A425 PolarHBondContact O-N 2.77Å; T423-A425 VanDerWaalsContact O-N 3.16Å; T423-Q426 WeakPolarHBondContact O-CA 3.08Å; T423-Q426 WeakPolarHBondContact O-CB 3.25Å; T423-Q426 PolarHBondContact O-N 3.24Å; T423-Q426 PolarHBondContact OG1-OE1 3.27Å; T423-R427 PolarHBondContact O-N 3.14Å
424	D	74.6	Confident	72.5	Confident	109 Å²	109	67.1 Å²	67.1	58%	0.583	36%	0.358	S	S	*	.	H	α-helix	trans	-53.2	-38.5	179.6	-70.5	-56.6	0	0	0	112.9	Q426 R427 Q428	D424-Q426 PolarHBondContact O-N 3.08Å; D424-R427 PolarHBondContact O-N 2.84Å; D424-R427 IonicContact OD1-CZ 3.25Å; D424-R427 IonicContact OD1-NE 2.67Å; D424-R427 IonicContact OD1-NH1 3.54Å; D424-R427 PolarHBondContact OD1-NH1 3.43Å; D424-R427 IonicContact OD1-NH2 3.85Å; D424-R427 PolarHBondContact OD1-NH2 2.86Å; D424-R427 IonicContact OD2-NH2 2.94Å; D424-Q428 PolarHBondContact O-N 3.09Å
425	A	74.2	Confident	72.4	Confident	70 Å²	70	77.4 Å²	77.4	58%	0.579	40%	0.396	S	S	*	.	H	α-helix	trans	-63.5	-38.1	175.3	0	0	0	0	0	113	T423 A429	T423-A425 PolarHBondContact O-N 2.77Å; T423-A425 VanDerWaalsContact O-N 3.16Å; A425-A429 WeakPolarHBondContact O-CB 3.29Å; A425-A429 PolarHBondContact O-N 3.33Å
426	Q	74.6	Confident	72.5	Confident	44 Å²	44	79.3 Å²	79.3	21%	0.206	41%	0.413	C	S	.	.	H	α-helix	trans	-72.7	-36.3	177.2	-66.1	171.4	-55	0	0	111.2	P422 T423 D424 A429 L430 F455	P422-Q426 HydrophobicContact CB-CB 4.28Å; T423-Q426 WeakPolarHBondContact O-CA 3.08Å; T423-Q426 WeakPolarHBondContact O-CB 3.25Å; T423-Q426 PolarHBondContact O-N 3.24Å; T423-Q426 PolarHBondContact OG1-OE1 3.27Å; D424-Q426 PolarHBondContact O-N 3.08Å; Q426-A429 PolarHBondContact O-N 3.44Å; Q426-L430 PolarHBondContact O-N 2.91Å; Q426-F455 HydrophobicContact CB-CZ 3.98Å
427	R	71.8	Confident	72.5	Confident	76 Å²	76	77.1 Å²	77.1	29%	0.287	40%	0.401	S	S	.	.	H	α-helix	trans	-63.2	-41.8	173.5	-71.5	-176	-100.9	148.2	5.8	111.8	P422 T423 D424 L430 R431	P422-R427 HydrophobicContact CB-CG 3.83Å; P422-R427 HydrophobicContact CG-CG 3.61Å; P422-R427 PolarHBondContact O-NE 2.9Å; T423-R427 PolarHBondContact O-N 3.14Å; D424-R427 PolarHBondContact O-N 2.84Å; D424-R427 IonicContact OD1-CZ 3.25Å; D424-R427 IonicContact OD1-NE 2.67Å; D424-R427 IonicContact OD1-NH1 3.54Å; D424-R427 PolarHBondContact OD1-NH1 3.43Å; D424-R427 IonicContact OD1-NH2 3.85Å; D424-R427 PolarHBondContact OD1-NH2 2.86Å; D424-R427 IonicContact OD2-NH2 2.94Å; R427-L430 PolarHBondContact O-N 2.85Å; R427-R431 PolarHBondContact O-N 3.25Å; R427-R431 VanDerWaalsContact O-N 3.08Å
428	Q	70.9	Confident	72.4	Confident	148 Å²	148	78.6 Å²	78.6	69%	0.692	42%	0.417	S	S	*	.	H	α-helix	trans	-69.6	-35.8	176.1	-167	171.7	10.4	0	0	112.3	D424 S432	D424-Q428 PolarHBondContact O-N 3.09Å; Q428-S432 WeakPolarHBondContact O-CB 3.28Å; Q428-S432 PolarHBondContact O-N 3.36Å; Q428-S432 PolarHBondContact O-OG 2.86Å
429	A	78.1	Confident	72.4	Confident	28 Å²	28	82 Å²	82	23%	0.231	44%	0.44	C	S	.	.	H	α-helix	trans	-64.4	-41	172.7	0	0	0	0	0	112.1	A425 Q426 S432 R433 L454	A425-A429 WeakPolarHBondContact O-CB 3.29Å; A425-A429 PolarHBondContact O-N 3.33Å; Q426-A429 PolarHBondContact O-N 3.44Å; A429-S432 WeakPolarHBondContact CA-OG 3.4Å; A429-S432 PolarHBondContact O-OG 2.82Å; A429-S432 VanDerWaalsContact O-OG 3.12Å; A429-R433 VanDerWaalsContact O-CB 3.29Å; A429-R433 WeakPolarHBondContact O-CB 3.42Å; A429-R433 WeakPolarHBondContact O-CG 3.4Å; A429-R433 PolarHBondContact O-N 2.87Å; A429-R433 VanDerWaalsContact O-N 3.09Å; A429-L454 HydrophobicContact CB-CD1 4.5Å
430	L	78.8	Confident	72.8	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.005	43%	0.432	C	S	.	.	H	α-helix	trans	-65.4	-45	177.2	-133.4	107.5	0	0	0	111.5	L411 L415 Q426 R427 R433 L434 F447 I451 L454 F455	L411-L430 HydrophobicContact CD1-CD2 3.62Å; L411-L430 HydrophobicContact CD2-CB 4.46Å; L411-L430 HydrophobicContact CD2-CD2 3.76Å; L411-L430 HydrophobicContact CG-CD2 4.02Å; L415-L430 HydrophobicContact CD1-CD2 4.41Å; Q426-L430 PolarHBondContact O-N 2.91Å; R427-L430 PolarHBondContact O-N 2.85Å; L430-R433 PolarHBondContact O-N 3.25Å; L430-L434 HydrophobicContact CD2-CD1 3.63Å; L430-L434 HydrophobicContact CG-CD1 4.14Å; L430-L434 VanDerWaalsContact O-CB 3.3Å; L430-L434 WeakPolarHBondContact O-CB 3.17Å; L430-L434 VanDerWaalsContact O-CG 3.26Å; L430-L434 WeakPolarHBondContact O-CG 3.27Å; L430-L434 PolarHBondContact O-N 3.38Å; L430-F447 HydrophobicContact CD2-CD2 4.11Å; L430-F447 HydrophobicContact CD2-CE2 3.99Å; L430-I451 HydrophobicContact CD1-CD1 3.9Å; L430-I451 HydrophobicContact CD2-CD1 4.2Å; L430-L454 HydrophobicContact CD1-CD1 3.67Å; L430-L454 HydrophobicContact CG-CD1 4.43Å; L430-F455 HydrophobicContact CD1-CE2 3.63Å; L430-F455 HydrophobicContact CD1-CZ 4.46Å
431	R	74.8	Confident	73	Confident	104 Å²	104	82.3 Å²	82.3	39%	0.392	44%	0.439	S	S	.	.	H	α-helix	trans	-67.3	-33.7	178.5	-77.1	-177.2	169.1	119.3	-3.7	114	L411 E412 R427	L411-R431 HydrophobicContact CD2-CG 3.99Å; E412-R431 IonicContact OE1-CZ 3.75Å; E412-R431 VanDerWaalsContact OE1-CZ 3.25Å; E412-R431 IonicContact OE1-NH1 3.9Å; E412-R431 PolarHBondContact OE1-NH1 2.66Å; E412-R431 IonicContact OE1-NH2 2.93Å; E412-R431 PolarHBondContact OE1-NH2 3.15Å; E412-R431 IonicContact OE2-NH2 3.72Å; R427-R431 PolarHBondContact O-N 3.25Å; R427-R431 VanDerWaalsContact O-N 3.08Å
432	S	74.8	Confident	73.6	Confident	91 Å²	91	73.2 Å²	73.2	64%	0.636	40%	0.399	S	S	*	.	H	α-helix	trans	-78.9	-26.1	178.4	54.4	0	0	0	0	113.1	Q428 A429	Q428-S432 WeakPolarHBondContact O-CB 3.28Å; Q428-S432 PolarHBondContact O-N 3.36Å; Q428-S432 PolarHBondContact O-OG 2.86Å; A429-S432 WeakPolarHBondContact CA-OG 3.4Å; A429-S432 PolarHBondContact O-OG 2.82Å; A429-S432 VanDerWaalsContact O-OG 3.12Å
433	R	74.9	Confident	73.8	Confident	111 Å²	111	73.1 Å²	73.1	42%	0.419	40%	0.4	S	S	.	.	H	α-helix	trans	-94.9	-29.5	-178.6	-66	-179	68.4	-175.2	-3.2	113.7	A429 L430 R435 L450 E453	A429-R433 VanDerWaalsContact O-CB 3.29Å; A429-R433 WeakPolarHBondContact O-CB 3.42Å; A429-R433 WeakPolarHBondContact O-CG 3.4Å; A429-R433 PolarHBondContact O-N 2.87Å; A429-R433 VanDerWaalsContact O-N 3.09Å; L430-R433 PolarHBondContact O-N 3.25Å; R433-R435 PolarHBondContact O-N 3Å; R433-L450 HydrophobicContact CB-CD1 4.16Å; R433-L450 HydrophobicContact CB-CD2 3.99Å; R433-E453 IonicContact CZ-OE1 3.48Å; R433-E453 VanDerWaalsContact CZ-OE1 3.24Å; R433-E453 IonicContact CZ-OE2 2.85Å; R433-E453 IonicContact NH1-OE1 3.77Å; R433-E453 PolarHBondContact NH1-OE1 2.83Å; R433-E453 IonicContact NH1-OE2 3.25Å; R433-E453 IonicContact NH2-OE1 2.77Å; R433-E453 PolarHBondContact NH2-OE1 2.87Å; R433-E453 IonicContact NH2-OE2 2.84Å; R433-E453 PolarHBondContact NH2-OE2 3.47Å
434	L	78.8	Confident	73.7	Confident	6 Å²	6	71.2 Å²	71.2	3%	0.031	38%	0.384	C	S	.	.	S	Bend	trans	-73.8	109.6	169.7	-69.9	169.5	0	0	0	109.1	L408 L411 L430 A436 V442 D446 F447 L450	L408-L434 HydrophobicContact CD1-CB 4.24Å; L408-L434 HydrophobicContact CD1-CD1 4.11Å; L411-L434 HydrophobicContact CD1-CD1 3.73Å; L411-L434 HydrophobicContact CD2-CD1 4Å; L430-L434 HydrophobicContact CD2-CD1 3.63Å; L430-L434 HydrophobicContact CG-CD1 4.14Å; L430-L434 VanDerWaalsContact O-CB 3.3Å; L430-L434 WeakPolarHBondContact O-CB 3.17Å; L430-L434 VanDerWaalsContact O-CG 3.26Å; L430-L434 WeakPolarHBondContact O-CG 3.27Å; L430-L434 PolarHBondContact O-N 3.38Å; L434-A436 PolarHBondContact O-N 2.78Å; L434-V442 HydrophobicContact CB-CG1 4.15Å; L434-V442 HydrophobicContact CB-CG2 4.37Å; L434-V442 HydrophobicContact CD2-CG1 3.65Å; L434-V442 HydrophobicContact CG-CG1 4.33Å; L434-D446 HydrophobicContact CD2-CB 4.38Å; L434-F447 HydrophobicContact CD1-CD2 4.21Å; L434-F447 HydrophobicContact CD2-CB 4.24Å; L434-L450 HydrophobicContact CD2-CD1 3.36Å; L434-L450 HydrophobicContact CG-CD1 3.76Å
435	R	66.8	Low	73.6	Confident	219 Å²	219	69 Å²	69	83%	0.826	38%	0.375	S	S	*	.			trans	-78.1	110.4	173.6	-71.1	-160.7	172.4	-168.8	-0.3	109.4	R433	R433-R435 PolarHBondContact O-N 3Å
436	A	73.3	Confident	73.7	Confident	46 Å²	46	69.8 Å²	69.8	38%	0.38	37%	0.369	S	S	.	.			trans	-71.3	134.3	166.8	0	0	0	0	0	109.6	L408 L434 V442	L408-A436 HydrophobicContact CD2-CB 3.99Å; L434-A436 PolarHBondContact O-N 2.78Å; A436-V442 HydrophobicContact CB-CG2 4.36Å
437	D	71.8	Confident	74	Confident	69 Å²	69	68 Å²	68	37%	0.369	36%	0.36	S	S	.	.			trans	-62.1	167.1	167.6	-84	11.9	0	0	0	110.3	R405 T439 G440 T441	R405-D437 IonicContact CZ-OD1 3.37Å; R405-D437 IonicContact CZ-OD2 3.46Å; R405-D437 IonicContact NE-OD2 3.18Å; R405-D437 IonicContact NH1-OD2 3.34Å; R405-D437 PolarHBondContact NH1-OD2 2.97Å; R405-D437 IonicContact NH2-OD1 3.72Å; R405-D437 PolarHBondContact NH2-OD1 3.05Å; R405-D437 IonicContact NH2-OD2 3.32Å; R405-D437 PolarHBondContact NH2-OD2 3.44Å; D437-T439 PolarHBondContact O-N 3.38Å; D437-G440 PolarHBondContact O-N 3.05Å; D437-T441 PolarHBondContact N-O 2.83Å; D437-T441 VanDerWaalsContact N-O 3.08Å
438	P	64.3	Low	74	Confident	144 Å²	144	66.9 Å²	66.9	94%	0.935	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-17.2	174.5	-25	33.8	0	0	0	114.4
439	T	67.9	Low	74.1	Confident	107 Å²	107	63.3 Å²	63.3	66%	0.656	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	2.4	177.1	59.8	0	0	0	0	114.1	D437 T441	D437-T439 PolarHBondContact O-N 3.38Å; T439-T441 PolarHBondContact OG1-OG1 2.9Å; T439-T441 VanDerWaalsContact OG1-OG1 3.07Å
440	G	71.3	Confident	74	Confident	33 Å²	33	62.8 Å²	62.8	34%	0.34	34%	0.343	S	S	.	.	S	Bend	trans	77.8	15.1	178.1	0	0	0	0	0	115.3	K407 L408 D437	K407-G440 WeakPolarHBondContact CA-O 3.43Å; L408-G440 PolarHBondContact N-O 3.25Å; D437-G440 PolarHBondContact O-N 3.05Å
441	T	75.1	Confident	74	Confident	28 Å²	28	62.9 Å²	62.9	17%	0.172	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	147.9	-178.2	51.9	0	0	0	0	113.1	R405 F406 K407 D437 T439	R405-T441 PolarHBondContact NH2-O 3.01Å; F406-T441 CarbonylContact O-C 3.53Å; F406-T441 VanDerWaalsContact O-CA 3.28Å; F406-T441 WeakPolarHBondContact O-CA 3.43Å; K407-T441 HydrophobicContact CG-CG2 3.8Å; D437-T441 PolarHBondContact N-O 2.83Å; D437-T441 VanDerWaalsContact N-O 3.08Å; T439-T441 PolarHBondContact OG1-OG1 2.9Å; T439-T441 VanDerWaalsContact OG1-OG1 3.07Å
442	V	77.6	Confident	73.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	140.6	-177.3	-175.3	0	0	0	0	109.7	R405 F406 L408 L434 A436	R405-V442 CarbonylContact C-O 3.56Å; R405-V442 WeakPolarHBondContact CA-O 3.38Å; F406-V442 PolarHBondContact N-O 3.43Å; F406-V442 PolarHBondContact O-N 2.85Å; L408-V442 HydrophobicContact CB-CG2 4.06Å; L408-V442 HydrophobicContact CD1-CG2 4.02Å; L408-V442 HydrophobicContact CG-CG2 4.49Å; L434-V442 HydrophobicContact CB-CG1 4.15Å; L434-V442 HydrophobicContact CB-CG2 4.37Å; L434-V442 HydrophobicContact CD2-CG1 3.65Å; L434-V442 HydrophobicContact CG-CG1 4.33Å; A436-V442 HydrophobicContact CB-CG2 4.36Å
443	A	78.5	Confident	73.9	Confident	14 Å²	14	63.4 Å²	63.4	12%	0.116	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	135.6	175.8	0	0	0	0	0	111	T445 D446 F447	A443-T445 PolarHBondContact O-N 3.13Å; A443-D446 PolarHBondContact O-N 2.98Å; A443-D446 VanDerWaalsContact O-N 3.16Å; A443-F447 PolarHBondContact O-N 3.38Å
444	F	74.3	Confident	73.8	Confident	47 Å²	47	60.2 Å²	60.2	21%	0.206	33%	0.327	C	S	.	.	H	α-helix	trans	-61.2	-32.7	179.5	-176.3	-97.6	0	0	0	112.2	C404 D446 F447 E448 F476	C404-F444 HydrophobicContact CB-CB 4.22Å; C404-F444 WeakPolarHBondContact O-CB 3.48Å; C404-F444 PolarHBondContact O-N 3.43Å; F444-D446 VanDerWaalsContact C-N 3.34Å; F444-D446 PolarHBondContact O-N 2.98Å; F444-F447 HydrophobicContact CD2-CD1 4.31Å; F444-F447 HydrophobicContact CE2-CD1 4.28Å; F444-F447 PolarHBondContact O-N 3.43Å; F444-E448 WeakPolarHBondContact O-CB 3.01Å; F444-E448 PolarHBondContact O-N 3.05Å; F444-F476 HydrophobicContact CE2-CD2 4.31Å; F444-F476 HydrophobicContact CE2-CG 4.33Å
445	T	73.4	Confident	73.4	Confident	64 Å²	64	60 Å²	60	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-39.2	176.1	51.6	0	0	0	0	112.8	A443 S449	A443-T445 PolarHBondContact O-N 3.13Å; T445-S449 WeakPolarHBondContact O-CB 3.17Å; T445-S449 PolarHBondContact O-N 3.09Å
446	D	77	Confident	73.3	Confident	86 Å²	86	55.5 Å²	55.5	46%	0.46	31%	0.312	S	S	.	.	H	α-helix	trans	-73.3	-38.5	-179.9	-63.8	-12.2	0	0	0	110.6	L434 A443 F444 L450	L434-D446 HydrophobicContact CD2-CB 4.38Å; A443-D446 PolarHBondContact O-N 2.98Å; A443-D446 VanDerWaalsContact O-N 3.16Å; F444-D446 VanDerWaalsContact C-N 3.34Å; F444-D446 PolarHBondContact O-N 2.98Å; D446-L450 WeakPolarHBondContact O-CB 3.3Å; D446-L450 WeakPolarHBondContact O-CG 3.48Å; D446-L450 PolarHBondContact O-N 3.43Å
447	F	79.2	Confident	72.7	Confident	5 Å²	5	57.5 Å²	57.5	2%	0.022	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-49.7	172	172.9	-109.9	0	0	0	111.8	F406 L411 A414 L415 I418 L430 L434 A443 F444 S449 L450 I451	F406-F447 HydrophobicContact CE1-CB 3.57Å; F406-F447 HydrophobicContact CE1-CD1 4.04Å; F406-F447 HydrophobicContact CE1-CD2 4.4Å; F406-F447 AromaticContact CE1-CG 3.75Å; F406-F447 HydrophobicContact CE1-CG 3.75Å; F406-F447 HydrophobicContact CZ-CB 3.72Å; F406-F447 HydrophobicContact CZ-CD1 4.06Å; F406-F447 AromaticContact CZ-CD2 3.74Å; F406-F447 HydrophobicContact CZ-CD2 3.74Å; F406-F447 HydrophobicContact CZ-CE2 4.36Å; F406-F447 AromaticContact CZ-CG 3.56Å; F406-F447 HydrophobicContact CZ-CG 3.56Å; L411-F447 HydrophobicContact CD1-CD2 3.52Å; L411-F447 HydrophobicContact CD1-CE2 3.32Å; L411-F447 HydrophobicContact CD1-CZ 4.36Å; A414-F447 HydrophobicContact CB-CE1 4.46Å; A414-F447 HydrophobicContact CB-CZ 4.05Å; L415-F447 HydrophobicContact CD2-CE2 4.37Å; L415-F447 HydrophobicContact CD2-CZ 4.47Å; I418-F447 HydrophobicContact CD1-CE1 4.02Å; I418-F447 HydrophobicContact CD1-CZ 3.97Å; L430-F447 HydrophobicContact CD2-CD2 4.11Å; L430-F447 HydrophobicContact CD2-CE2 3.99Å; L434-F447 HydrophobicContact CD1-CD2 4.21Å; L434-F447 HydrophobicContact CD2-CB 4.24Å; A443-F447 PolarHBondContact O-N 3.38Å; F444-F447 HydrophobicContact CD2-CD1 4.31Å; F444-F447 HydrophobicContact CE2-CD1 4.28Å; F444-F447 PolarHBondContact O-N 3.43Å; F447-S449 VanDerWaalsContact C-N 3.33Å; F447-S449 PolarHBondContact O-N 3.24Å; F447-L450 PolarHBondContact O-N 3.21Å; F447-I451 HydrophobicContact CD2-CD1 4.44Å; F447-I451 HydrophobicContact CD2-CG1 4.02Å; F447-I451 HydrophobicContact CE1-CG1 4.25Å; F447-I451 HydrophobicContact CE2-CD1 3.75Å; F447-I451 HydrophobicContact CE2-CG1 3.66Å; F447-I451 HydrophobicContact CG-CG1 4.46Å; F447-I451 HydrophobicContact CZ-CD1 4.04Å; F447-I451 HydrophobicContact CZ-CG1 3.8Å; F447-I451 VanDerWaalsContact O-CG1 3.27Å; F447-I451 WeakPolarHBondContact O-CG1 3.44Å; F447-I451 PolarHBondContact O-N 3.35Å
448	E	72.8	Confident	72	Confident	54 Å²	54	57.5 Å²	57.5	25%	0.252	32%	0.319	S	S	.	.	H	α-helix	trans	-60.3	-43	179.3	-168.8	-174.5	171.4	0	0	111.8	F444 I451 R452	F444-E448 WeakPolarHBondContact O-CB 3.01Å; F444-E448 PolarHBondContact O-N 3.05Å; E448-I451 PolarHBondContact O-N 3.07Å; E448-R452 WeakPolarHBondContact O-CG 3.43Å; E448-R452 PolarHBondContact O-N 3.34Å; E448-R452 IonicContact OE1-CZ 3.85Å; E448-R452 IonicContact OE1-NE 3.68Å; E448-R452 PolarHBondContact OE1-NE 2.93Å; E448-R452 VanDerWaalsContact OE1-NE 3.12Å; E448-R452 IonicContact OE1-NH2 3.16Å; E448-R452 PolarHBondContact OE1-NH2 3.33Å
449	S	72.3	Confident	71.9	Confident	73 Å²	73	52.2 Å²	52.2	51%	0.51	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-43.3	177.2	-171.1	0	0	0	0	112.1	T445 F447 R452 E453	T445-S449 WeakPolarHBondContact O-CB 3.17Å; T445-S449 PolarHBondContact O-N 3.09Å; F447-S449 VanDerWaalsContact C-N 3.33Å; F447-S449 PolarHBondContact O-N 3.24Å; S449-R452 PolarHBondContact O-N 3.2Å; S449-E453 WeakPolarHBondContact O-CB 3.4Å; S449-E453 PolarHBondContact O-N 2.91Å
450	L	77	Confident	71.4	Confident	17 Å²	17	53 Å²	53	9%	0.089	28%	0.279	C	S	.	.	H	α-helix	trans	-72.1	-32.5	-179.2	-81.8	162.3	0	0	0	112.9	R433 L434 D446 F447 E453 L454	R433-L450 HydrophobicContact CB-CD1 4.16Å; R433-L450 HydrophobicContact CB-CD2 3.99Å; L434-L450 HydrophobicContact CD2-CD1 3.36Å; L434-L450 HydrophobicContact CG-CD1 3.76Å; D446-L450 WeakPolarHBondContact O-CB 3.3Å; D446-L450 WeakPolarHBondContact O-CG 3.48Å; D446-L450 PolarHBondContact O-N 3.43Å; F447-L450 PolarHBondContact O-N 3.21Å; L450-E453 PolarHBondContact O-N 2.88Å; L450-L454 HydrophobicContact CD2-CD1 4.49Å; L450-L454 WeakPolarHBondContact O-CB 3.3Å; L450-L454 WeakPolarHBondContact O-CG 3.4Å; L450-L454 PolarHBondContact O-N 3.01Å
451	I	77.4	Confident	70.6	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-65.8	-46.6	172.7	-67.1	-68.2	0	0	0	110.6	L415 L420 L430 F447 E448 E453 L454 F455 L459	L415-I451 HydrophobicContact CD2-CD1 3.33Å; L420-I451 HydrophobicContact CD1-CG2 3.95Å; L430-I451 HydrophobicContact CD1-CD1 3.9Å; L430-I451 HydrophobicContact CD2-CD1 4.2Å; F447-I451 HydrophobicContact CD2-CD1 4.44Å; F447-I451 HydrophobicContact CD2-CG1 4.02Å; F447-I451 HydrophobicContact CE1-CG1 4.25Å; F447-I451 HydrophobicContact CE2-CD1 3.75Å; F447-I451 HydrophobicContact CE2-CG1 3.66Å; F447-I451 HydrophobicContact CG-CG1 4.46Å; F447-I451 HydrophobicContact CZ-CD1 4.04Å; F447-I451 HydrophobicContact CZ-CG1 3.8Å; F447-I451 VanDerWaalsContact O-CG1 3.27Å; F447-I451 WeakPolarHBondContact O-CG1 3.44Å; F447-I451 PolarHBondContact O-N 3.35Å; E448-I451 PolarHBondContact O-N 3.07Å; I451-E453 PolarHBondContact O-N 3.07Å; I451-L454 PolarHBondContact O-N 3.4Å; I451-F455 HydrophobicContact CD1-CD2 4.05Å; I451-F455 HydrophobicContact CD1-CE2 4.1Å; I451-F455 HydrophobicContact CG2-CD2 4.49Å; I451-F455 WeakPolarHBondContact O-CB 3.36Å; I451-F455 PolarHBondContact O-N 2.94Å; I451-L459 HydrophobicContact CG2-CD1 4.12Å
452	R	71.8	Confident	69.5	Low	102 Å²	102	63.5 Å²	63.5	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-62.9	-30.9	176.7	-70.5	174.3	-173.9	-86.3	4.6	112.5	E448 S449 K456	E448-R452 WeakPolarHBondContact O-CG 3.43Å; E448-R452 PolarHBondContact O-N 3.34Å; E448-R452 IonicContact OE1-CZ 3.85Å; E448-R452 IonicContact OE1-NE 3.68Å; E448-R452 PolarHBondContact OE1-NE 2.93Å; E448-R452 VanDerWaalsContact OE1-NE 3.12Å; E448-R452 IonicContact OE1-NH2 3.16Å; E448-R452 PolarHBondContact OE1-NH2 3.33Å; S449-R452 PolarHBondContact O-N 3.2Å; R452-K456 WeakPolarHBondContact O-CB 3.43Å
453	E	75.6	Confident	68.4	Low	105 Å²	105	69.8 Å²	69.8	49%	0.491	35%	0.348	S	S	.	.	H	α-helix	trans	-76.2	-49.1	176.8	-167.9	-168.4	142.4	0	0	112.5	R433 S449 L450 I451	R433-E453 IonicContact CZ-OE1 3.48Å; R433-E453 VanDerWaalsContact CZ-OE1 3.24Å; R433-E453 IonicContact CZ-OE2 2.85Å; R433-E453 IonicContact NH1-OE1 3.77Å; R433-E453 PolarHBondContact NH1-OE1 2.83Å; R433-E453 IonicContact NH1-OE2 3.25Å; R433-E453 IonicContact NH2-OE1 2.77Å; R433-E453 PolarHBondContact NH2-OE1 2.87Å; R433-E453 IonicContact NH2-OE2 2.84Å; R433-E453 PolarHBondContact NH2-OE2 3.47Å; S449-E453 WeakPolarHBondContact O-CB 3.4Å; S449-E453 PolarHBondContact O-N 2.91Å; L450-E453 PolarHBondContact O-N 2.88Å; I451-E453 PolarHBondContact O-N 3.07Å
454	L	72.8	Confident	66.7	Low	44 Å²	44	71.8 Å²	71.8	23%	0.23	37%	0.371	C	S	.	.	H	α-helix	trans	-85.2	-24.2	-170.8	-70.2	171	0	0	0	114.1	A429 L430 L450 I451	A429-L454 HydrophobicContact CB-CD1 4.5Å; L430-L454 HydrophobicContact CD1-CD1 3.67Å; L430-L454 HydrophobicContact CG-CD1 4.43Å; L450-L454 HydrophobicContact CD2-CD1 4.49Å; L450-L454 WeakPolarHBondContact O-CB 3.3Å; L450-L454 WeakPolarHBondContact O-CG 3.4Å; L450-L454 PolarHBondContact O-N 3.01Å; I451-L454 PolarHBondContact O-N 3.4Å
455	F	70.4	Confident	65.3	Low	0 Å²	0	76 Å²	76	0%	0	40%	0.4	C	S	.	.	S	Bend	trans	-115.4	13.2	-174.3	-63.2	-93.2	0	0	0	113.3	L420 P422 Q426 L430 I451 P457 Q458 L459	L420-F455 HydrophobicContact CD1-CB 4.21Å; L420-F455 HydrophobicContact CD1-CD1 4.2Å; L420-F455 HydrophobicContact CD1-CG 4.05Å; L420-F455 HydrophobicContact CD2-CD1 4.36Å; P422-F455 HydrophobicContact CB-CE1 3.65Å; P422-F455 HydrophobicContact CB-CZ 3.58Å; Q426-F455 HydrophobicContact CB-CZ 3.98Å; L430-F455 HydrophobicContact CD1-CE2 3.63Å; L430-F455 HydrophobicContact CD1-CZ 4.46Å; I451-F455 HydrophobicContact CD1-CD2 4.05Å; I451-F455 HydrophobicContact CD1-CE2 4.1Å; I451-F455 HydrophobicContact CG2-CD2 4.49Å; I451-F455 WeakPolarHBondContact O-CB 3.36Å; I451-F455 PolarHBondContact O-N 2.94Å; F455-P457 VanDerWaalsContact C-CD 3.48Å; F455-Q458 PolarHBondContact O-N 2.94Å; F455-L459 HydrophobicContact CB-CD1 3.62Å; F455-L459 PolarHBondContact O-N 2.86Å
456	K	66.3	Low	63.6	Low	125 Å²	125	81.5 Å²	81.5	54%	0.543	42%	0.421	S	S	.	.	H	α-helix	trans	-45.1	-49	-179.7	-157.6	174.9	-179.4	-178.5	0	114.9	R452 Q458 E460	R452-K456 WeakPolarHBondContact O-CB 3.43Å; K456-Q458 PolarHBondContact O-N 2.89Å; K456-E460 WeakPolarHBondContact O-CG 3.16Å; K456-E460 PolarHBondContact O-N 2.71Å; K456-E460 VanDerWaalsContact O-N 3.1Å
457	P	59.4	Low	61.7	Low	89 Å²	89	81.5 Å²	81.5	58%	0.578	43%	0.428	S	S	*	.	H	α-helix	trans	-70.7	-30.7	179.6	26.9	-33.9	0	0	0	113.5	F455 E461	F455-P457 VanDerWaalsContact C-CD 3.48Å; P457-E461 PolarHBondContact O-N 3Å
458	Q	58.2	Low	60	Low	68 Å²	68	86.8 Å²	86.8	32%	0.318	47%	0.466	S	S	.	.	H	α-helix	trans	-79.3	-32.3	179.4	-76.1	165.4	-30.7	0	0	112	F455 K456 L462	F455-Q458 PolarHBondContact O-N 2.94Å; K456-Q458 PolarHBondContact O-N 2.89Å; Q458-L462 WeakPolarHBondContact O-CB 3.45Å; Q458-L462 PolarHBondContact O-N 2.9Å; Q458-L462 VanDerWaalsContact O-N 3.14Å
459	L	61	Low	58.4	Low	34 Å²	34	87.9 Å²	87.9	18%	0.178	48%	0.48	C	S	.	.	H	α-helix	trans	-68.6	-35.8	170.3	-97.9	108.7	0	0	0	112.1	L420 I451 F455 E461 F463	L420-L459 HydrophobicContact CD1-CD1 4.2Å; L420-L459 HydrophobicContact CD2-CD1 4.38Å; I451-L459 HydrophobicContact CG2-CD1 4.12Å; F455-L459 HydrophobicContact CB-CD1 3.62Å; F455-L459 PolarHBondContact O-N 2.86Å; L459-E461 VanDerWaalsContact C-N 3.35Å; L459-F463 WeakPolarHBondContact O-CB 3.44Å; L459-F463 PolarHBondContact O-N 3.22Å
460	E	57.3	Low	57	Low	123 Å²	123	94.6 Å²	94.6	58%	0.575	49%	0.494	S	S	*	.	H	α-helix	trans	-70.3	-29	175.8	-79.6	171.5	178.6	0	0	112.9	K456	K456-E460 WeakPolarHBondContact O-CG 3.16Å; K456-E460 PolarHBondContact O-N 2.71Å; K456-E460 VanDerWaalsContact O-N 3.1Å
461	E	56.1	Low	55.4	Low	171 Å²	171	97.4 Å²	97.4	80%	0.799	51%	0.505	S	S	*	.	H	α-helix	trans	-80.7	-34.7	177.7	-161.6	175.8	-166.2	0	0	113	P457 L459	P457-E461 PolarHBondContact O-N 3Å; L459-E461 VanDerWaalsContact C-N 3.35Å
462	L	52.2	Low	53.8	Low	110 Å²	110	100 Å²	100	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-79.5	-30.7	175.6	-100	146.8	0	0	0	113.4	Q458	Q458-L462 WeakPolarHBondContact O-CB 3.45Å; Q458-L462 PolarHBondContact O-N 2.9Å; Q458-L462 VanDerWaalsContact O-N 3.14Å
463	F	52.4	Low	52.7	Low	132 Å²	132	99 Å²	99	58%	0.579	53%	0.53	S	S	*	.	S	Bend	trans	-124.4	75.4	-177.5	-58.6	-81.9	0	0	0	109.4	L459 T465	L459-F463 WeakPolarHBondContact O-CB 3.44Å; L459-F463 PolarHBondContact O-N 3.22Å; F463-T465 PolarHBondContact O-N 2.77Å
464	G	43.3	Very low	51.3	Low	57 Å²	57	100.1 Å²	100.1	59%	0.588	54%	0.54	S	S	*	.			trans	-48.7	139.1	174.5	0	0	0	0	0	111.7	Q466	G464-Q466 VanDerWaalsContact C-N 3.33Å; G464-Q466 PolarHBondContact O-N 3.11Å
465	T	46.2	Very low	50.1	Low	136 Å²	136	103.1 Å²	103.1	83%	0.834	56%	0.556	S	S	*	*	S	Bend	trans	-38.2	74.2	-169.5	35	0	0	0	0	117.2	F463	F463-T465 PolarHBondContact O-N 2.77Å
466	Q	37.5	Very low	49	Very low	178 Å²	178	104.7 Å²	104.7	83%	0.832	56%	0.563	S	S	*	*	S	Bend	trans	-159.8	134.9	150	-79.1	-51.3	-60	0	0	108.5	G464	G464-Q466 VanDerWaalsContact C-N 3.33Å; G464-Q466 PolarHBondContact O-N 3.11Å
467	S	36.4	Very low	48.2	Very low	87 Å²	87	101.6 Å²	101.6	61%	0.608	56%	0.557	S	S	*	*			trans	79.9	86.3	172.5	-159.7	0	0	0	0	117.5	S469	S467-S469 PolarHBondContact O-N 3.14Å; S467-S469 PolarHBondContact OG-N 3.35Å; S467-S469 PolarHBondContact OG-O 3.45Å
468	S	43.5	Very low	47.8	Very low	116 Å²	116	101.4 Å²	101.4	81%	0.811	56%	0.557	S	S	*	*			trans	-68.1	82.7	140.8	-98.9	0	0	0	0	109.1
469	S	40.1	Very low	47.4	Very low	77 Å²	77	99.9 Å²	99.9	54%	0.538	55%	0.551	S	S	.	*			trans	168.9	130.5	150.9	79	0	0	0	0	104.8	S467	S467-S469 PolarHBondContact O-N 3.14Å; S467-S469 PolarHBondContact OG-N 3.35Å; S467-S469 PolarHBondContact OG-O 3.45Å
470	R	41.1	Very low	46.9	Very low	213 Å²	213	102.2 Å²	102.2	80%	0.804	56%	0.564	S	S	*	*				-148.9	114.5	51.3	-58.8	167.6	-158.6	145.4	5.8	107.9	T472	R470-T472 VanDerWaalsContact C-N 3.27Å; R470-T472 HydrophobicContact CB-CG2 4.05Å; R470-T472 PolarHBondContact O-N 3.39Å
471	F	43.7	Very low	46.3	Very low	76 Å²	76	104.3 Å²	104.3	33%	0.333	57%	0.574	S	S	.	*			trans	-74.1	96	145.1	-73.2	-82.1	0	0	0	104.4	I418 S473	I418-F471 HydrophobicContact CD1-CE1 4.39Å; I418-F471 HydrophobicContact CG1-CE1 4.46Å; I418-F471 HydrophobicContact CG2-CE1 4.25Å; F471-S473 PolarHBondContact O-N 2.94Å; F471-S473 VanDerWaalsContact O-N 3.09Å
472	T	44.9	Very low	45.4	Very low	57 Å²	57	98 Å²	98	35%	0.35	55%	0.548	S	S	.	.			trans	-67	109.7	172.9	28.8	0	0	0	0	107.2	R470 D474 D475	R470-T472 VanDerWaalsContact C-N 3.27Å; R470-T472 HydrophobicContact CB-CG2 4.05Å; R470-T472 PolarHBondContact O-N 3.39Å; T472-D474 PolarHBondContact O-N 3Å; T472-D475 PolarHBondContact O-N 3.32Å; T472-D475 VanDerWaalsContact O-N 3.15Å; T472-D475 PolarHBondContact OG1-OD2 3.48Å
473	S	47.8	Very low	45.1	Very low	82 Å²	82	98.7 Å²	98.7	57%	0.573	56%	0.559	S	S	*	*	H	α-helix	trans	-52.9	-16.8	173	-174.5	0	0	0	0	112.7	F471 S477	F471-S473 PolarHBondContact O-N 2.94Å; F471-S473 VanDerWaalsContact O-N 3.09Å; S473-S477 PolarHBondContact O-N 3.3Å; S473-S477 PolarHBondContact O-OG 2.92Å
474	D	46.3	Very low	44.7	Very low	128 Å²	128	98 Å²	98	68%	0.684	57%	0.566	S	S	*	*	H	α-helix	trans	-70.3	-35.1	179	-65.2	-28	0	0	0	112.9	T472 F476 S477	T472-D474 PolarHBondContact O-N 3Å; D474-F476 PolarHBondContact O-N 3.24Å; D474-S477 WeakPolarHBondContact O-CB 3.08Å; D474-S477 PolarHBondContact O-N 2.98Å
475	D	48.6	Very low	44.3	Very low	106 Å²	106	102 Å²	102	57%	0.567	57%	0.574	S	S	*	*	H	α-helix	trans	-70.9	-34.3	-179.6	-67.5	-46.6	0	0	0	112	T472 S478	T472-D475 PolarHBondContact O-N 3.32Å; T472-D475 VanDerWaalsContact O-N 3.15Å; T472-D475 PolarHBondContact OG1-OD2 3.48Å; D475-S478 PolarHBondContact O-OG 2.92Å
476	F	46.6	Very low	44.1	Very low	33 Å²	33	100.7 Å²	100.7	15%	0.145	57%	0.568	C	S	.	*	H	α-helix	trans	-80.6	-14.9	176.1	-82.8	-78.8	0	0	0	113.9	A414 I418 F444 D474 S478 L479 L480	A414-F476 HydrophobicContact CB-CE1 3.65Å; A414-F476 HydrophobicContact CB-CZ 4.2Å; I418-F476 HydrophobicContact CD1-CE2 4.44Å; I418-F476 HydrophobicContact CD1-CZ 3.98Å; I418-F476 HydrophobicContact CG1-CE2 4.31Å; I418-F476 HydrophobicContact CG1-CZ 4.02Å; F444-F476 HydrophobicContact CE2-CD2 4.31Å; F444-F476 HydrophobicContact CE2-CG 4.33Å; D474-F476 PolarHBondContact O-N 3.24Å; F476-S478 PolarHBondContact O-N 3.34Å; F476-L479 HydrophobicContact CD1-CD1 3.83Å; F476-L479 HydrophobicContact CE1-CD1 3.93Å; F476-L479 PolarHBondContact O-N 3.36Å; F476-L479 VanDerWaalsContact O-N 3.11Å; F476-L480 PolarHBondContact O-N 2.96Å
477	S	49.6	Very low	44.3	Very low	60 Å²	60	97.8 Å²	97.8	42%	0.42	56%	0.564	S	S	.	*	H	α-helix	trans	-63.8	-30.3	174.4	-63.2	0	0	0	0	111.3	S473 D474 L479 L480	S473-S477 PolarHBondContact O-N 3.3Å; S473-S477 PolarHBondContact O-OG 2.92Å; D474-S477 WeakPolarHBondContact O-CB 3.08Å; D474-S477 PolarHBondContact O-N 2.98Å; S477-L479 VanDerWaalsContact C-N 3.28Å; S477-L479 PolarHBondContact O-N 3.45Å; S477-L480 PolarHBondContact O-N 3.05Å
478	S	51.3	Low	44.8	Very low	85 Å²	85	98.5 Å²	98.5	59%	0.594	57%	0.567	S	S	*	*	H	α-helix	trans	-65.7	-25.8	173.7	72.3	0	0	0	0	114	D475 F476	D475-S478 PolarHBondContact O-OG 2.92Å; F476-S478 PolarHBondContact O-N 3.34Å
479	L	49.3	Very low	45	Very low	36 Å²	36	98.7 Å²	98.7	19%	0.188	57%	0.568	C	S	.	*	H	α-helix	trans	-90.3	-16.1	179.2	-77.6	178.1	0	0	0	113.8	R410 L417 F476 S477 E481	R410-L479 PolarHBondContact NH1-O 3Å; L417-L479 HydrophobicContact CD1-CD1 3.36Å; L417-L479 HydrophobicContact CD1-CG 4.11Å; F476-L479 HydrophobicContact CD1-CD1 3.83Å; F476-L479 HydrophobicContact CE1-CD1 3.93Å; F476-L479 PolarHBondContact O-N 3.36Å; F476-L479 VanDerWaalsContact O-N 3.11Å; S477-L479 VanDerWaalsContact C-N 3.28Å; S477-L479 PolarHBondContact O-N 3.45Å; L479-E481 VanDerWaalsContact C-N 3.34Å
480	L	49.8	Very low	45.5	Very low	83 Å²	83	100.6 Å²	100.6	44%	0.435	57%	0.572	S	S	.	*	H	α-helix	trans	-83.9	-13.4	178.1	-70.9	171.8	0	0	0	112.5	C404 R405 F406 F476 S477 S482	C404-L480 HydrophobicContact CB-CD1 4.47Å; R405-L480 VanDerWaalsContact O-CD2 3.31Å; R405-L480 WeakPolarHBondContact O-CD2 3.2Å; F406-L480 HydrophobicContact CB-CD2 4.17Å; F476-L480 PolarHBondContact O-N 2.96Å; S477-L480 PolarHBondContact O-N 3.05Å; L480-S482 PolarHBondContact O-N 3.15Å
481	E	45.8	Very low	46.3	Very low	168 Å²	168	94 Å²	94	79%	0.785	56%	0.559	S	S	*	*			trans	-82	83.7	171.7	-142	162.3	-146.3	0	0	109.2	L479	L479-E481 VanDerWaalsContact C-N 3.34Å
482	S	37	Very low	47	Very low	38 Å²	38	97.4 Å²	97.4	27%	0.266	58%	0.58	S	S	.	*			trans	-84.8	134.3	159.8	-61.7	0	0	0	0	108.3	R410 L480 T484	R410-S482 VanDerWaalsContact CZ-OG 3.28Å; R410-S482 PolarHBondContact NH1-OG 2.99Å; R410-S482 PolarHBondContact NH2-OG 3.19Å; R410-S482 VanDerWaalsContact NH2-OG 3.12Å; L480-S482 PolarHBondContact O-N 3.15Å; S482-T484 VanDerWaalsContact C-N 3.31Å; S482-T484 PolarHBondContact O-N 3.15Å; S482-T484 PolarHBondContact O-OG1 3.15Å
483	P	45.3	Very low	47.8	Very low	124 Å²	124	98.3 Å²	98.3	81%	0.805	59%	0.589	S	S	*	*			trans	-68.8	91.2	-174.1	30	-33.4	0	0	0	108.4
484	T	43.5	Very low	48.7	Very low	119 Å²	119	99 Å²	99	73%	0.73	59%	0.586	S	S	*	*			trans	-108.4	67.6	174.5	-37.2	0	0	0	0	106.8	S482	S482-T484 VanDerWaalsContact C-N 3.31Å; S482-T484 PolarHBondContact O-N 3.15Å; S482-T484 PolarHBondContact O-OG1 3.15Å
485	N	36.6	Very low	50.1	Low	140 Å²	140	96.6 Å²	96.6	75%	0.749	57%	0.573	S	S	*	*	S	Bend	trans	-161.6	131.9	155	-83.9	-40.8	0	0	0	107
486	P	41.1	Very low	51.7	Low	108 Å²	108	97.1 Å²	97.1	70%	0.701	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-58.2	140.9	163.7	28.4	-30.9	0	0	0	107.2
487	P	43	Very low	53.4	Low	117 Å²	117	102 Å²	102	76%	0.76	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-59.3	128.6	-176.7	24.8	-31.4	0	0	0	108.1	S489	P487-S489 PolarHBondContact O-N 2.59Å
488	P	45.6	Very low	55.2	Low	102 Å²	102	105 Å²	105	66%	0.662	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-61.1	127.3	158.3	28.4	-28.8	0	0	0	104.7	L490	P488-L490 VanDerWaalsContact C-N 3.31Å; P488-L490 PolarHBondContact O-N 2.92Å
489	S	48	Very low	56.8	Low	121 Å²	121	106.7 Å²	106.7	85%	0.846	61%	0.606	S	S	*	*			trans	-51.7	97.3	173.8	49.3	0	0	0	0	109.2	P487	P487-S489 PolarHBondContact O-N 2.59Å
490	L	49.6	Very low	58.7	Low	116 Å²	116	111.4 Å²	111.4	61%	0.607	63%	0.627	S	S	*	*			trans	-69.6	136.9	165.3	-67.7	177.4	0	0	0	106.5	P488 D492	P488-L490 VanDerWaalsContact C-N 3.31Å; P488-L490 PolarHBondContact O-N 2.92Å; L490-D492 PolarHBondContact O-N 3.46Å
491	S	59.3	Low	60.7	Low	76 Å²	76	113.7 Å²	113.7	53%	0.531	63%	0.634	S	S	.	*			trans	-63.1	132	178.3	-175.3	0	0	0	0	108.6	S493 D494	S491-S493 PolarHBondContact O-N 3.01Å; S491-D494 PolarHBondContact O-N 3.49Å
492	D	57.3	Low	62.9	Low	146 Å²	146	110.4 Å²	110.4	78%	0.781	62%	0.621	S	S	*	*	H	α-helix	trans	-49.8	-15.9	177.1	-82.9	-30	0	0	0	114	L490	L490-D492 PolarHBondContact O-N 3.46Å
493	S	63.1	Low	65.6	Low	76 Å²	76	116.9 Å²	116.9	53%	0.531	64%	0.64	S	S	.	*	H	α-helix	trans	-74.5	-35.9	176.2	-167.8	0	0	0	0	113.9	S491	S491-S493 PolarHBondContact O-N 3.01Å
494	D	65.3	Low	68	Low	96 Å²	96	118.2 Å²	118.2	51%	0.513	63%	0.632	S	S	.	*	H	α-helix	trans	-78.2	-36.8	-174.5	-68	-27.1	0	0	0	111	S491 L496 E497 E498	S491-D494 PolarHBondContact O-N 3.49Å; D494-L496 VanDerWaalsContact C-N 3.28Å; D494-L496 PolarHBondContact O-N 3.03Å; D494-E497 PolarHBondContact O-N 3.2Å; D494-E498 PolarHBondContact O-N 3.13Å; D494-E498 VanDerWaalsContact O-N 3.14Å
495	D	76.1	Confident	70.4	Confident	78 Å²	78	116.9 Å²	116.9	42%	0.417	62%	0.618	S	S	.	*	H	α-helix	trans	-64.9	-31.9	175.9	-76.1	-1.5	0	0	0	112.4	M499	D495-M499 WeakPolarHBondContact O-CB 3.4Å; D495-M499 PolarHBondContact O-N 2.93Å; D495-M499 VanDerWaalsContact O-N 3.07Å
496	L	82	Confident	73.2	Confident	118 Å²	118	115.8 Å²	115.8	62%	0.618	61%	0.608	S	S	*	*	H	α-helix	trans	-71.6	-38.8	179.8	-158	114.5	0	0	0	111.6	D494 M499 E500	D494-L496 VanDerWaalsContact C-N 3.28Å; D494-L496 PolarHBondContact O-N 3.03Å; L496-M499 PolarHBondContact O-N 3.23Å; L496-E500 WeakPolarHBondContact O-CB 3.44Å; L496-E500 PolarHBondContact O-N 3.42Å
497	E	83	Confident	75.8	Confident	135 Å²	135	114.5 Å²	114.5	63%	0.631	59%	0.594	S	S	*	*	H	α-helix	trans	-74	-35.2	179.8	-166.2	151.5	-164.7	0	0	111.6	D494 E500 K501	D494-E497 PolarHBondContact O-N 3.2Å; E497-E500 PolarHBondContact O-N 3.41Å; E497-K501 WeakPolarHBondContact O-CB 3.42Å; E497-K501 PolarHBondContact O-N 2.93Å
498	E	87.2	Confident	78.3	Confident	122 Å²	122	114.9 Å²	114.9	57%	0.57	59%	0.586	S	S	*	*	H	α-helix	trans	-65.9	-41.9	171.2	-170.4	170.3	-168.4	0	0	111.9	D494 E500 K501 L502	D494-E498 PolarHBondContact O-N 3.13Å; D494-E498 VanDerWaalsContact O-N 3.14Å; E498-E500 PolarHBondContact O-N 2.94Å; E498-K501 PolarHBondContact O-N 3.41Å; E498-L502 HydrophobicContact CG-CD1 4.22Å; E498-L502 WeakPolarHBondContact O-CB 3.5Å; E498-L502 PolarHBondContact O-N 2.96Å
499	M	84.6	Confident	80.7	Confident	122 Å²	122	112.1 Å²	112.1	60%	0.601	57%	0.572	S	S	*	*	H	α-helix	trans	-63.9	-39.9	175.3	-169.6	-168.1	-57.5	0	0	112	D495 L496 L502 R503	D495-M499 WeakPolarHBondContact O-CB 3.4Å; D495-M499 PolarHBondContact O-N 2.93Å; D495-M499 VanDerWaalsContact O-N 3.07Å; L496-M499 PolarHBondContact O-N 3.23Å; M499-L502 PolarHBondContact O-N 2.7Å; M499-R503 WeakPolarHBondContact O-CB 3.38Å; M499-R503 PolarHBondContact O-N 3.49Å
500	E	88.9	Confident	83	Confident	134 Å²	134	110.8 Å²	110.8	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-65.7	-40.8	176.8	-174	166.2	-154.4	0	0	111.6	L496 E497 E498 R503 K504	L496-E500 WeakPolarHBondContact O-CB 3.44Å; L496-E500 PolarHBondContact O-N 3.42Å; E497-E500 PolarHBondContact O-N 3.41Å; E498-E500 PolarHBondContact O-N 2.94Å; E500-R503 PolarHBondContact O-N 2.9Å; E500-K504 PolarHBondContact O-N 2.9Å
501	K	91.8	Very high	85.2	Confident	132 Å²	132	112 Å²	112	57%	0.574	56%	0.555	S	S	*	*	H	α-helix	trans	-61.8	-48.9	174.3	-172.5	-174.4	176.5	-143.8	0	111.9	E497 E498 R503 K504 E505	E497-K501 WeakPolarHBondContact O-CB 3.42Å; E497-K501 PolarHBondContact O-N 2.93Å; E498-K501 PolarHBondContact O-N 3.41Å; K501-R503 VanDerWaalsContact C-N 3.28Å; K501-R503 PolarHBondContact O-N 3.49Å; K501-K504 WeakPolarHBondContact O-CB 3.26Å; K501-K504 PolarHBondContact O-N 3.19Å; K501-K504 VanDerWaalsContact O-N 3.12Å; K501-E505 WeakPolarHBondContact CE-OE1 3.24Å; K501-E505 IonicContact NZ-OE1 3.58Å; K501-E505 WeakPolarHBondContact O-CG 3.46Å; K501-E505 PolarHBondContact O-N 2.9Å
502	L	93.7	Very high	87	Confident	99 Å²	99	114 Å²	114	52%	0.518	56%	0.556	S	S	.	*	H	α-helix	trans	-59.3	-39.8	176	-81.6	160.8	0	0	0	112	E498 M499 K504 E505 H506	E498-L502 HydrophobicContact CG-CD1 4.22Å; E498-L502 WeakPolarHBondContact O-CB 3.5Å; E498-L502 PolarHBondContact O-N 2.96Å; M499-L502 PolarHBondContact O-N 2.7Å; L502-K504 VanDerWaalsContact C-N 3.32Å; L502-K504 PolarHBondContact O-N 3.09Å; L502-E505 PolarHBondContact O-N 3.38Å; L502-H506 WeakPolarHBondContact O-CB 3.47Å; L502-H506 PolarHBondContact O-N 3.31Å
503	R	93.1	Very high	88.8	Confident	174 Å²	174	111.2 Å²	111.2	66%	0.657	54%	0.54	S	S	*	.	H	α-helix	trans	-64.5	-38.8	176.9	-157.8	-173.6	-166.8	110.6	1.6	111.5	M499 E500 K501 I507	M499-R503 WeakPolarHBondContact O-CB 3.38Å; M499-R503 PolarHBondContact O-N 3.49Å; E500-R503 PolarHBondContact O-N 2.9Å; K501-R503 VanDerWaalsContact C-N 3.28Å; K501-R503 PolarHBondContact O-N 3.49Å; R503-I507 HydrophobicContact CG-CD1 4.43Å; R503-I507 WeakPolarHBondContact O-CD1 3.3Å; R503-I507 VanDerWaalsContact O-CG1 3.22Å; R503-I507 WeakPolarHBondContact O-CG1 3.45Å; R503-I507 PolarHBondContact O-N 3.22Å
504	K	95.3	Very high	90.4	Very high	151 Å²	151	113.6 Å²	113.6	66%	0.657	54%	0.541	S	S	*	.	H	α-helix	trans	-67.2	-46.6	176.3	-172.8	-179.7	176.9	-175.9	0	111.7	E500 K501 L502 H506 I507 E508	E500-K504 PolarHBondContact O-N 2.9Å; K501-K504 WeakPolarHBondContact O-CB 3.26Å; K501-K504 PolarHBondContact O-N 3.19Å; K501-K504 VanDerWaalsContact O-N 3.12Å; L502-K504 VanDerWaalsContact C-N 3.32Å; L502-K504 PolarHBondContact O-N 3.09Å; K504-H506 VanDerWaalsContact C-N 3.32Å; K504-H506 PolarHBondContact O-N 2.97Å; K504-I507 PolarHBondContact O-N 3.23Å; K504-E508 WeakPolarHBondContact O-CB 3.44Å; K504-E508 PolarHBondContact O-N 2.81Å
505	E	94.6	Very high	91.9	Very high	91 Å²	91	112.3 Å²	112.3	43%	0.425	54%	0.537	S	S	.	.	H	α-helix	trans	-59.9	-42.1	175.8	-71.4	174.6	-175.8	0	0	111.3	K501 L502 I507 E508 A509	K501-E505 WeakPolarHBondContact CE-OE1 3.24Å; K501-E505 IonicContact NZ-OE1 3.58Å; K501-E505 WeakPolarHBondContact O-CG 3.46Å; K501-E505 PolarHBondContact O-N 2.9Å; L502-E505 PolarHBondContact O-N 3.38Å; E505-I507 PolarHBondContact O-N 2.8Å; E505-E508 PolarHBondContact O-N 2.97Å; E505-A509 WeakPolarHBondContact O-CB 3.09Å; E505-A509 PolarHBondContact O-N 3.08Å
506	H	94.6	Very high	92.9	Very high	117 Å²	117	112.8 Å²	112.8	54%	0.542	54%	0.539	S	S	.	.	H	α-helix	trans	-62.6	-41.7	175	178.2	-96.5	0	0	0	112.7	L502 K504 E508 L510	L502-H506 WeakPolarHBondContact O-CB 3.47Å; L502-H506 PolarHBondContact O-N 3.31Å; K504-H506 VanDerWaalsContact C-N 3.32Å; K504-H506 PolarHBondContact O-N 2.97Å; H506-E508 VanDerWaalsContact C-N 3.34Å; H506-L510 VanDerWaalsContact CE1-CD1 3.41Å; H506-L510 WeakPolarHBondContact CE1-CD1 3.41Å; H506-L510 WeakPolarHBondContact O-CG 3.38Å; H506-L510 PolarHBondContact O-N 3.48Å
507	I	95.6	Very high	93.5	Very high	81 Å²	81	112.9 Å²	112.9	42%	0.415	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-38.1	176.3	-69.7	163.8	0	0	0	111	R503 K504 E505 K511	R503-I507 HydrophobicContact CG-CD1 4.43Å; R503-I507 WeakPolarHBondContact O-CD1 3.3Å; R503-I507 VanDerWaalsContact O-CG1 3.22Å; R503-I507 WeakPolarHBondContact O-CG1 3.45Å; R503-I507 PolarHBondContact O-N 3.22Å; K504-I507 PolarHBondContact O-N 3.23Å; E505-I507 PolarHBondContact O-N 2.8Å; I507-K511 WeakPolarHBondContact O-CG 3.49Å; I507-K511 PolarHBondContact O-N 3.05Å; I507-K511 VanDerWaalsContact O-N 3.13Å
508	E	96	Very high	94.2	Very high	126 Å²	126	111.8 Å²	111.8	59%	0.589	53%	0.531	S	S	*	.	H	α-helix	trans	-66.4	-46.1	176.8	-173.2	165.2	-157.5	0	0	111.6	K504 E505 H506 L510 K511 E512	K504-E508 WeakPolarHBondContact O-CB 3.44Å; K504-E508 PolarHBondContact O-N 2.81Å; E505-E508 PolarHBondContact O-N 2.97Å; H506-E508 VanDerWaalsContact C-N 3.34Å; E508-L510 VanDerWaalsContact C-N 3.32Å; E508-L510 PolarHBondContact O-N 2.86Å; E508-K511 WeakPolarHBondContact O-CB 3.42Å; E508-K511 PolarHBondContact O-N 2.8Å; E508-K511 VanDerWaalsContact O-N 3.08Å; E508-E512 PolarHBondContact O-N 3.18Å
509	A	95.2	Very high	94.6	Very high	44 Å²	44	112 Å²	112	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-59.4	-40.7	174.9	0	0	0	0	0	112.3	E505 K511 E512 I513	E505-A509 WeakPolarHBondContact O-CB 3.09Å; E505-A509 PolarHBondContact O-N 3.08Å; A509-K511 VanDerWaalsContact C-N 3.32Å; A509-K511 PolarHBondContact O-N 3.43Å; A509-E512 PolarHBondContact O-N 2.81Å; A509-I513 VanDerWaalsContact O-CG1 3.3Å; A509-I513 WeakPolarHBondContact O-CG1 3.34Å; A509-I513 PolarHBondContact O-N 3.16Å
510	L	96	Very high	95.2	Very high	92 Å²	92	110.9 Å²	110.9	48%	0.482	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-35.5	175.4	-75.9	177.5	0	0	0	112.9	H506 E508 K514	H506-L510 VanDerWaalsContact CE1-CD1 3.41Å; H506-L510 WeakPolarHBondContact CE1-CD1 3.41Å; H506-L510 WeakPolarHBondContact O-CG 3.38Å; H506-L510 PolarHBondContact O-N 3.48Å; E508-L510 VanDerWaalsContact C-N 3.32Å; E508-L510 PolarHBondContact O-N 2.86Å; L510-K514 PolarHBondContact O-N 3.08Å; L510-K514 VanDerWaalsContact O-N 3.11Å
511	K	96.3	Very high	95.6	Very high	142 Å²	142	109 Å²	109	62%	0.617	53%	0.525	S	S	*	.	H	α-helix	trans	-66.8	-43.1	173.9	-72.7	173.8	-179.1	178.4	0	110.8	I507 E508 A509 K514 T515	I507-K511 WeakPolarHBondContact O-CG 3.49Å; I507-K511 PolarHBondContact O-N 3.05Å; I507-K511 VanDerWaalsContact O-N 3.13Å; E508-K511 WeakPolarHBondContact O-CB 3.42Å; E508-K511 PolarHBondContact O-N 2.8Å; E508-K511 VanDerWaalsContact O-N 3.08Å; A509-K511 VanDerWaalsContact C-N 3.32Å; A509-K511 PolarHBondContact O-N 3.43Å; K511-K514 PolarHBondContact O-N 3.34Å; K511-T515 WeakPolarHBondContact O-CG2 3.17Å; K511-T515 PolarHBondContact O-N 3.01Å; K511-T515 PolarHBondContact O-OG1 3.22Å
512	E	96.6	Very high	95.8	Very high	118 Å²	118	106.7 Å²	106.7	55%	0.551	52%	0.516	S	S	*	.	H	α-helix	trans	-61.6	-46.9	177.5	-171.2	174.5	-174.5	0	0	111.4	E508 A509 K514 T515 L516	E508-E512 PolarHBondContact O-N 3.18Å; A509-E512 PolarHBondContact O-N 2.81Å; E512-K514 VanDerWaalsContact C-N 3.27Å; E512-K514 PolarHBondContact O-N 2.98Å; E512-T515 WeakPolarHBondContact CA-OG1 3.19Å; E512-T515 PolarHBondContact O-N 2.62Å; E512-T515 VanDerWaalsContact O-N 3.1Å; E512-T515 PolarHBondContact O-OG1 2.93Å; E512-L516 HydrophobicContact CG-CD1 4.12Å; E512-L516 HydrophobicContact CG-CG 4.46Å; E512-L516 WeakPolarHBondContact O-CG 3.41Å; E512-L516 PolarHBondContact O-N 3.38Å
513	I	96.1	Very high	95.9	Very high	87 Å²	87	105.7 Å²	105.7	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-55.7	-43.9	174.9	-70.1	166.1	0	0	0	110.9	A509 L516 Q517	A509-I513 VanDerWaalsContact O-CG1 3.3Å; A509-I513 WeakPolarHBondContact O-CG1 3.34Å; A509-I513 PolarHBondContact O-N 3.16Å; I513-L516 PolarHBondContact O-N 3.38Å; I513-Q517 WeakPolarHBondContact O-CG 3.32Å; I513-Q517 PolarHBondContact O-N 3.44Å
514	K	97	Very high	96.1	Very high	127 Å²	127	103 Å²	103	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-64.2	-43.2	177.9	-170.2	-178.2	176.6	-172.5	0	111.9	L510 K511 E512 L516 Q517 E518	L510-K514 PolarHBondContact O-N 3.08Å; L510-K514 VanDerWaalsContact O-N 3.11Å; K511-K514 PolarHBondContact O-N 3.34Å; E512-K514 VanDerWaalsContact C-N 3.27Å; E512-K514 PolarHBondContact O-N 2.98Å; K514-L516 VanDerWaalsContact C-N 3.34Å; K514-L516 PolarHBondContact O-N 2.83Å; K514-Q517 WeakPolarHBondContact O-CB 3.12Å; K514-Q517 PolarHBondContact O-N 3.16Å; K514-E518 WeakPolarHBondContact CE-OE1 3.28Å; K514-E518 WeakPolarHBondContact O-CG 3.44Å; K514-E518 PolarHBondContact O-N 3.36Å
515	T	96.7	Very high	96.2	Very high	68 Å²	68	103.1 Å²	103.1	42%	0.417	51%	0.509	S	S	.	.	H	α-helix	trans	-64.4	-38.2	176.7	55.3	0	0	0	0	112.4	K511 E512 E518 Q519	K511-T515 WeakPolarHBondContact O-CG2 3.17Å; K511-T515 PolarHBondContact O-N 3.01Å; K511-T515 PolarHBondContact O-OG1 3.22Å; E512-T515 WeakPolarHBondContact CA-OG1 3.19Å; E512-T515 PolarHBondContact O-N 2.62Å; E512-T515 VanDerWaalsContact O-N 3.1Å; E512-T515 PolarHBondContact O-OG1 2.93Å; T515-E518 PolarHBondContact O-N 3.16Å; T515-Q519 WeakPolarHBondContact O-CG 3.42Å; T515-Q519 PolarHBondContact O-N 3.44Å
516	L	96.1	Very high	96.3	Very high	88 Å²	88	101.6 Å²	101.6	46%	0.461	51%	0.506	S	S	.	.	H	α-helix	trans	-68.1	-36.5	175.9	-70	172.4	0	0	0	111.8	E512 I513 K514 Q519 L520	E512-L516 HydrophobicContact CG-CD1 4.12Å; E512-L516 HydrophobicContact CG-CG 4.46Å; E512-L516 WeakPolarHBondContact O-CG 3.41Å; E512-L516 PolarHBondContact O-N 3.38Å; I513-L516 PolarHBondContact O-N 3.38Å; K514-L516 VanDerWaalsContact C-N 3.34Å; K514-L516 PolarHBondContact O-N 2.83Å; L516-Q519 PolarHBondContact O-N 3.27Å; L516-L520 WeakPolarHBondContact O-CB 3.34Å; L516-L520 PolarHBondContact O-N 2.92Å
517	Q	96.1	Very high	96.3	Very high	120 Å²	120	102.2 Å²	102.2	56%	0.561	51%	0.509	S	S	*	.	H	α-helix	trans	-62.6	-42.6	172.7	-77.1	176.7	-18.6	0	0	111.9	I513 K514 L520 V521	I513-Q517 WeakPolarHBondContact O-CG 3.32Å; I513-Q517 PolarHBondContact O-N 3.44Å; K514-Q517 WeakPolarHBondContact O-CB 3.12Å; K514-Q517 PolarHBondContact O-N 3.16Å; Q517-L520 PolarHBondContact O-N 3.27Å; Q517-V521 WeakPolarHBondContact O-CG2 3.46Å; Q517-V521 PolarHBondContact O-N 2.99Å; Q517-V521 VanDerWaalsContact O-N 3.1Å
518	E	96.8	Very high	96.4	Very high	113 Å²	113	102.8 Å²	102.8	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-63.7	-42.5	175.8	-71.3	170.5	-170.2	0	0	111.4	K514 T515 L520 V521 E522	K514-E518 WeakPolarHBondContact CE-OE1 3.28Å; K514-E518 WeakPolarHBondContact O-CG 3.44Å; K514-E518 PolarHBondContact O-N 3.36Å; T515-E518 PolarHBondContact O-N 3.16Å; E518-L520 PolarHBondContact O-N 3.04Å; E518-V521 PolarHBondContact O-N 3.26Å; E518-E522 WeakPolarHBondContact O-CB 3.4Å; E518-E522 PolarHBondContact O-N 3.06Å
519	Q	96.3	Very high	96.4	Very high	126 Å²	126	102.6 Å²	102.6	59%	0.589	51%	0.509	S	S	*	.	H	α-helix	trans	-64.1	-37.2	174.9	-74.2	-178.8	-6.5	0	0	113.1	T515 L516 E522 S523	T515-Q519 WeakPolarHBondContact O-CG 3.42Å; T515-Q519 PolarHBondContact O-N 3.44Å; L516-Q519 PolarHBondContact O-N 3.27Å; Q519-E522 PolarHBondContact O-N 3.33Å; Q519-S523 VanDerWaalsContact O-CB 3.3Å; Q519-S523 WeakPolarHBondContact O-CB 3.07Å; Q519-S523 PolarHBondContact O-N 3.07Å
520	L	96.1	Very high	96.4	Very high	99 Å²	99	105.9 Å²	105.9	52%	0.518	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-44	176.6	-179.6	65.2	0	0	0	111.3	L516 Q517 E518 S523 Q524	L516-L520 WeakPolarHBondContact O-CB 3.34Å; L516-L520 PolarHBondContact O-N 2.92Å; Q517-L520 PolarHBondContact O-N 3.27Å; E518-L520 PolarHBondContact O-N 3.04Å; L520-S523 PolarHBondContact O-N 2.76Å; L520-Q524 WeakPolarHBondContact O-CB 3.21Å; L520-Q524 VanDerWaalsContact O-CG 3.29Å; L520-Q524 WeakPolarHBondContact O-CG 3.26Å; L520-Q524 PolarHBondContact O-N 2.87Å
521	V	97.4	Very high	96.3	Very high	94 Å²	94	105.7 Å²	105.7	57%	0.57	52%	0.516	S	S	*	.	H	α-helix	trans	-64.3	-42.5	177.5	172.6	0	0	0	0	110.8	Q517 E518 Q524 R525	Q517-V521 WeakPolarHBondContact O-CG2 3.46Å; Q517-V521 PolarHBondContact O-N 2.99Å; Q517-V521 VanDerWaalsContact O-N 3.1Å; E518-V521 PolarHBondContact O-N 3.26Å; V521-Q524 PolarHBondContact O-N 3.33Å; V521-R525 PolarHBondContact O-N 3.49Å
522	E	96.7	Very high	96.3	Very high	83 Å²	83	103.3 Å²	103.3	39%	0.388	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-43.5	177	-173.7	53.9	-132.8	0	0	111.6	E518 Q519 Q524 R525 V526	E518-E522 WeakPolarHBondContact O-CB 3.4Å; E518-E522 PolarHBondContact O-N 3.06Å; Q519-E522 PolarHBondContact O-N 3.33Å; E522-Q524 PolarHBondContact O-N 3.21Å; E522-R525 VanDerWaalsContact CD-NH2 3.34Å; E522-R525 WeakPolarHBondContact O-CB 3.44Å; E522-R525 PolarHBondContact O-N 2.94Å; E522-R525 IonicContact OE1-CZ 2.96Å; E522-R525 IonicContact OE1-NE 2.67Å; E522-R525 PolarHBondContact OE1-NE 3.17Å; E522-R525 IonicContact OE1-NH2 3.83Å; E522-R525 PolarHBondContact OE1-NH2 2.86Å; E522-R525 IonicContact OE2-CZ 2.63Å; E522-R525 IonicContact OE2-NE 3.04Å; E522-R525 PolarHBondContact OE2-NE 3.23Å; E522-R525 IonicContact OE2-NH2 3Å; E522-R525 PolarHBondContact OE2-NH2 3.18Å; E522-V526 WeakPolarHBondContact O-CG2 3.49Å; E522-V526 PolarHBondContact O-N 3.11Å
523	S	95.3	Very high	96.4	Very high	78 Å²	78	102 Å²	102	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-41.3	175.4	-179.9	0	0	0	0	112.2	Q519 L520 R525 V526 H527	Q519-S523 VanDerWaalsContact O-CB 3.3Å; Q519-S523 WeakPolarHBondContact O-CB 3.07Å; Q519-S523 PolarHBondContact O-N 3.07Å; L520-S523 PolarHBondContact O-N 2.76Å; S523-R525 VanDerWaalsContact C-N 3.33Å; S523-R525 PolarHBondContact O-N 3.28Å; S523-V526 PolarHBondContact O-N 2.93Å; S523-H527 WeakPolarHBondContact O-CB 3.31Å; S523-H527 PolarHBondContact O-N 3.3Å
524	Q	97.3	Very high	96.2	Very high	117 Å²	117	103.4 Å²	103.4	55%	0.547	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-40.1	174.6	-77.2	175.4	-8.3	0	0	112	L520 V521 E522 H527 Q528	L520-Q524 WeakPolarHBondContact O-CB 3.21Å; L520-Q524 VanDerWaalsContact O-CG 3.29Å; L520-Q524 WeakPolarHBondContact O-CG 3.26Å; L520-Q524 PolarHBondContact O-N 2.87Å; V521-Q524 PolarHBondContact O-N 3.33Å; E522-Q524 PolarHBondContact O-N 3.21Å; Q524-H527 PolarHBondContact O-N 3.21Å; Q524-Q528 PolarHBondContact O-N 3.36Å
525	R	97.5	Very high	96.1	Very high	154 Å²	154	101.2 Å²	101.2	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-61.4	-49	176.1	-175.4	-177.7	75.4	143.6	3.7	111.8	V521 E522 S523 H527 Q528 E529	V521-R525 PolarHBondContact O-N 3.49Å; E522-R525 VanDerWaalsContact CD-NH2 3.34Å; E522-R525 WeakPolarHBondContact O-CB 3.44Å; E522-R525 PolarHBondContact O-N 2.94Å; E522-R525 IonicContact OE1-CZ 2.96Å; E522-R525 IonicContact OE1-NE 2.67Å; E522-R525 PolarHBondContact OE1-NE 3.17Å; E522-R525 IonicContact OE1-NH2 3.83Å; E522-R525 PolarHBondContact OE1-NH2 2.86Å; E522-R525 IonicContact OE2-CZ 2.63Å; E522-R525 IonicContact OE2-NE 3.04Å; E522-R525 PolarHBondContact OE2-NE 3.23Å; E522-R525 IonicContact OE2-NH2 3Å; E522-R525 PolarHBondContact OE2-NH2 3.18Å; S523-R525 VanDerWaalsContact C-N 3.33Å; S523-R525 PolarHBondContact O-N 3.28Å; R525-H527 VanDerWaalsContact C-N 3.28Å; R525-H527 PolarHBondContact O-N 3.07Å; R525-Q528 PolarHBondContact O-N 2.75Å; R525-E529 PolarHBondContact O-N 3.42Å
526	V	96.9	Very high	96.2	Very high	60 Å²	60	102.6 Å²	102.6	36%	0.364	51%	0.507	S	S	.	.	H	α-helix	trans	-62.6	-38.2	177.8	173.8	0	0	0	0	111	E522 S523 Q528 E529 L530	E522-V526 WeakPolarHBondContact O-CG2 3.49Å; E522-V526 PolarHBondContact O-N 3.11Å; S523-V526 PolarHBondContact O-N 2.93Å; V526-Q528 VanDerWaalsContact C-N 3.34Å; V526-Q528 PolarHBondContact O-N 2.8Å; V526-E529 PolarHBondContact O-N 3.45Å; V526-L530 HydrophobicContact CG1-CD1 4.05Å; V526-L530 HydrophobicContact CG1-CG 4.41Å; V526-L530 WeakPolarHBondContact O-CG 2.7Å; V526-L530 PolarHBondContact O-N 2.99Å
527	H	94.3	Very high	96.1	Very high	129 Å²	129	102.2 Å²	102.2	60%	0.597	51%	0.508	S	S	*	.	H	α-helix	trans	-61.5	-43	175.9	-169.3	69.8	0	0	0	112	S523 Q524 R525 L530 E531	S523-H527 WeakPolarHBondContact O-CB 3.31Å; S523-H527 PolarHBondContact O-N 3.3Å; Q524-H527 PolarHBondContact O-N 3.21Å; R525-H527 VanDerWaalsContact C-N 3.28Å; R525-H527 PolarHBondContact O-N 3.07Å; H527-L530 PolarHBondContact O-N 3.47Å; H527-E531 WeakPolarHBondContact O-CB 3.13Å; H527-E531 PolarHBondContact O-N 3.36Å
528	Q	96.8	Very high	95.9	Very high	94 Å²	94	103.5 Å²	103.5	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-64.2	-41.5	176.6	-166.6	62.7	61.8	0	0	112	Q524 R525 V526 E531 D532	Q524-Q528 PolarHBondContact O-N 3.36Å; R525-Q528 PolarHBondContact O-N 2.75Å; V526-Q528 VanDerWaalsContact C-N 3.34Å; V526-Q528 PolarHBondContact O-N 2.8Å; Q528-E531 PolarHBondContact NE2-OE2 2.98Å; Q528-E531 VanDerWaalsContact NE2-OE2 3.08Å; Q528-E531 PolarHBondContact O-N 2.99Å; Q528-D532 PolarHBondContact O-N 3.29Å
529	E	97.2	Very high	95.9	Very high	122 Å²	122	103.1 Å²	103.1	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-62.8	-42.6	177.1	-175.5	176.3	-176.7	0	0	111.9	R525 V526 E531 D532 E533	R525-E529 PolarHBondContact O-N 3.42Å; V526-E529 PolarHBondContact O-N 3.45Å; E529-E531 VanDerWaalsContact C-N 3.33Å; E529-E531 PolarHBondContact O-N 3.38Å; E529-D532 PolarHBondContact O-N 2.98Å; E529-E533 PolarHBondContact O-N 3.06Å
530	L	94.8	Very high	95.7	Very high	112 Å²	112	102.9 Å²	102.9	59%	0.586	51%	0.508	S	S	*	.	H	α-helix	trans	-66	-36	175.5	-72.3	172.5	0	0	0	112.3	V526 H527 L534	V526-L530 HydrophobicContact CG1-CD1 4.05Å; V526-L530 HydrophobicContact CG1-CG 4.41Å; V526-L530 WeakPolarHBondContact O-CG 2.7Å; V526-L530 PolarHBondContact O-N 2.99Å; H527-L530 PolarHBondContact O-N 3.47Å; L530-L534 VanDerWaalsContact O-CB 3.31Å; L530-L534 WeakPolarHBondContact O-CB 3.44Å; L530-L534 PolarHBondContact O-N 2.58Å
531	E	94.9	Very high	95.4	Very high	88 Å²	88	101.2 Å²	101.2	41%	0.411	51%	0.509	S	S	.	.	H	α-helix	trans	-65.3	-40.2	175	-170.9	176.1	-152.4	0	0	111.5	H527 Q528 E529 L534 N535	H527-E531 WeakPolarHBondContact O-CB 3.13Å; H527-E531 PolarHBondContact O-N 3.36Å; Q528-E531 PolarHBondContact NE2-OE2 2.98Å; Q528-E531 VanDerWaalsContact NE2-OE2 3.08Å; Q528-E531 PolarHBondContact O-N 2.99Å; E529-E531 VanDerWaalsContact C-N 3.33Å; E529-E531 PolarHBondContact O-N 3.38Å; E531-L534 PolarHBondContact O-N 3.5Å; E531-N535 WeakPolarHBondContact O-CB 3.39Å; E531-N535 PolarHBondContact O-N 2.99Å; E531-N535 PolarHBondContact O-ND2 3.25Å; E531-N535 VanDerWaalsContact O-ND2 3.08Å
532	D	96.6	Very high	95.3	Very high	92 Å²	92	102 Å²	102	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-44.2	176.3	-72.1	-17.7	0	0	0	111.9	Q528 E529 L534 N535 K536	Q528-D532 PolarHBondContact O-N 3.29Å; E529-D532 PolarHBondContact O-N 2.98Å; D532-L534 PolarHBondContact O-N 3.36Å; D532-N535 PolarHBondContact O-N 2.96Å; D532-K536 WeakPolarHBondContact O-CB 3.39Å; D532-K536 PolarHBondContact O-N 3Å
533	E	97.1	Very high	95.2	Very high	90 Å²	90	100.9 Å²	100.9	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-37.4	174.3	-77.4	-64.7	139.4	0	0	111.9	E529 N535 K536 V537	E529-E533 PolarHBondContact O-N 3.06Å; E533-N535 VanDerWaalsContact C-N 3.34Å; E533-N535 PolarHBondContact O-N 2.89Å; E533-K536 VanDerWaalsContact CD-NZ 3.33Å; E533-K536 WeakPolarHBondContact O-CB 3.39Å; E533-K536 PolarHBondContact O-N 3.05Å; E533-K536 IonicContact OE1-NZ 2.66Å; E533-K536 PolarHBondContact OE1-NZ 3.48Å; E533-K536 IonicContact OE2-NZ 3.62Å; E533-K536 PolarHBondContact OE2-NZ 2.86Å; E533-V537 WeakPolarHBondContact O-CG2 3.25Å; E533-V537 PolarHBondContact O-N 3.17Å
534	L	93	Very high	94.8	Very high	117 Å²	117	98.4 Å²	98.4	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-62	-43	173.4	178.9	63	0	0	0	111.5	L530 E531 D532 K536 V537 K538	L530-L534 VanDerWaalsContact O-CB 3.31Å; L530-L534 WeakPolarHBondContact O-CB 3.44Å; L530-L534 PolarHBondContact O-N 2.58Å; E531-L534 PolarHBondContact O-N 3.5Å; D532-L534 PolarHBondContact O-N 3.36Å; L534-K536 VanDerWaalsContact C-N 3.33Å; L534-K536 PolarHBondContact O-N 3.07Å; L534-V537 PolarHBondContact O-N 2.83Å; L534-K538 VanDerWaalsContact O-CB 3.25Å; L534-K538 WeakPolarHBondContact O-CB 3.04Å; L534-K538 PolarHBondContact O-N 2.68Å
535	N	94.8	Very high	94.3	Very high	81 Å²	81	94.9 Å²	94.9	43%	0.433	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-38.7	177	-77.5	-40.7	0	0	0	112	E531 D532 E533 K538 Q539	E531-N535 WeakPolarHBondContact O-CB 3.39Å; E531-N535 PolarHBondContact O-N 2.99Å; E531-N535 PolarHBondContact O-ND2 3.25Å; E531-N535 VanDerWaalsContact O-ND2 3.08Å; D532-N535 PolarHBondContact O-N 2.96Å; E533-N535 VanDerWaalsContact C-N 3.34Å; E533-N535 PolarHBondContact O-N 2.89Å; N535-K538 PolarHBondContact O-N 3.47Å; N535-Q539 PolarHBondContact O-N 3.21Å
536	K	97.4	Very high	94	Very high	98 Å²	98	91.6 Å²	91.6	43%	0.426	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-50.8	174.5	177.3	177.5	155.5	-142	0	112	D532 E533 L534 K538 Q539 E540	D532-K536 WeakPolarHBondContact O-CB 3.39Å; D532-K536 PolarHBondContact O-N 3Å; E533-K536 VanDerWaalsContact CD-NZ 3.33Å; E533-K536 WeakPolarHBondContact O-CB 3.39Å; E533-K536 PolarHBondContact O-N 3.05Å; E533-K536 IonicContact OE1-NZ 2.66Å; E533-K536 PolarHBondContact OE1-NZ 3.48Å; E533-K536 IonicContact OE2-NZ 3.62Å; E533-K536 PolarHBondContact OE2-NZ 2.86Å; L534-K536 VanDerWaalsContact C-N 3.33Å; L534-K536 PolarHBondContact O-N 3.07Å; K536-K538 VanDerWaalsContact C-N 3.28Å; K536-K538 PolarHBondContact O-N 2.95Å; K536-Q539 WeakPolarHBondContact O-CB 3.34Å; K536-Q539 PolarHBondContact O-N 3.32Å; K536-E540 PolarHBondContact O-N 3.06Å
537	V	94.4	Very high	93.8	Very high	79 Å²	79	94.8 Å²	94.8	48%	0.479	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-39	176.7	171.8	0	0	0	0	111.3	E533 L534 Q539 E540 A541	E533-V537 WeakPolarHBondContact O-CG2 3.25Å; E533-V537 PolarHBondContact O-N 3.17Å; L534-V537 PolarHBondContact O-N 2.83Å; V537-Q539 VanDerWaalsContact C-N 3.33Å; V537-Q539 PolarHBondContact O-N 2.81Å; V537-E540 PolarHBondContact O-N 3.39Å; V537-A541 WeakPolarHBondContact O-CB 3.42Å; V537-A541 PolarHBondContact O-N 2.86Å
538	K	93.1	Very high	93.2	Very high	147 Å²	147	91.2 Å²	91.2	64%	0.639	47%	0.473	S	S	*	.	H	α-helix	trans	-61.2	-40.5	174.8	179.8	-179	177.4	-177.7	0	112.2	L534 N535 K536 K542	L534-K538 VanDerWaalsContact O-CB 3.25Å; L534-K538 WeakPolarHBondContact O-CB 3.04Å; L534-K538 PolarHBondContact O-N 2.68Å; N535-K538 PolarHBondContact O-N 3.47Å; K536-K538 VanDerWaalsContact C-N 3.28Å; K536-K538 PolarHBondContact O-N 2.95Å; K538-K542 WeakPolarHBondContact O-CB 3.28Å; K538-K542 PolarHBondContact O-N 3.43Å
539	Q	95.3	Very high	92.9	Very high	106 Å²	106	93.1 Å²	93.1	50%	0.495	48%	0.476	S	S	.	.	H	α-helix	trans	-68.7	-42.2	176.7	-177.1	57.8	31.2	0	0	111.4	N535 K536 V537 A541 K542 V543	N535-Q539 PolarHBondContact O-N 3.21Å; K536-Q539 WeakPolarHBondContact O-CB 3.34Å; K536-Q539 PolarHBondContact O-N 3.32Å; V537-Q539 VanDerWaalsContact C-N 3.33Å; V537-Q539 PolarHBondContact O-N 2.81Å; Q539-A541 PolarHBondContact O-N 3.26Å; Q539-K542 WeakPolarHBondContact O-CB 3.48Å; Q539-K542 PolarHBondContact O-N 3.42Å; Q539-V543 WeakPolarHBondContact O-CG2 3.34Å; Q539-V543 PolarHBondContact O-N 2.97Å
540	E	92.9	Very high	92.6	Very high	120 Å²	120	90.4 Å²	90.4	56%	0.561	47%	0.468	S	S	*	.	H	α-helix	trans	-60.5	-44.4	174.3	-70.8	178.1	-173	0	0	111.7	K536 V537 K542 V543 G544	K536-E540 PolarHBondContact O-N 3.06Å; V537-E540 PolarHBondContact O-N 3.39Å; E540-K542 VanDerWaalsContact C-N 3.31Å; E540-K542 PolarHBondContact O-N 2.83Å; E540-V543 PolarHBondContact O-N 2.97Å; E540-G544 PolarHBondContact O-N 3.21Å
541	A	90.1	Very high	92.3	Very high	64 Å²	64	89.9 Å²	89.9	53%	0.529	47%	0.465	S	S	.	.	H	α-helix	trans	-62.3	-37.8	175.6	0	0	0	0	0	112.3	V537 Q539 G544 A545	V537-A541 WeakPolarHBondContact O-CB 3.42Å; V537-A541 PolarHBondContact O-N 2.86Å; Q539-A541 PolarHBondContact O-N 3.26Å; A541-G544 PolarHBondContact O-N 2.93Å; A541-A545 WeakPolarHBondContact O-CB 3.43Å; A541-A545 PolarHBondContact O-N 3.02Å
542	K	94.2	Very high	91.7	Very high	112 Å²	112	92.7 Å²	92.7	49%	0.487	47%	0.472	S	S	.	.	H	α-helix	trans	-64.5	-44.9	175.6	-175.3	-177.4	174.7	-172.2	0	111.6	K538 Q539 E540 A545 E546	K538-K542 WeakPolarHBondContact O-CB 3.28Å; K538-K542 PolarHBondContact O-N 3.43Å; Q539-K542 WeakPolarHBondContact O-CB 3.48Å; Q539-K542 PolarHBondContact O-N 3.42Å; E540-K542 VanDerWaalsContact C-N 3.31Å; E540-K542 PolarHBondContact O-N 2.83Å; K542-A545 PolarHBondContact O-N 2.75Å; K542-E546 VanDerWaalsContact CE-OE1 3.31Å; K542-E546 WeakPolarHBondContact CE-OE1 3.48Å; K542-E546 PolarHBondContact O-N 3.19Å
543	V	94.6	Very high	91.4	Very high	59 Å²	59	92.6 Å²	92.6	36%	0.358	48%	0.475	S	S	.	.	H	α-helix	trans	-61	-48.2	175.8	174	0	0	0	0	110	Q539 E540 A545 E546 E547	Q539-V543 WeakPolarHBondContact O-CG2 3.34Å; Q539-V543 PolarHBondContact O-N 2.97Å; E540-V543 PolarHBondContact O-N 2.97Å; V543-A545 VanDerWaalsContact C-N 3.27Å; V543-A545 PolarHBondContact O-N 3Å; V543-E546 WeakPolarHBondContact O-CB 3.18Å; V543-E546 PolarHBondContact O-N 3.5Å; V543-E547 WeakPolarHBondContact O-CG 3.35Å; V543-E547 PolarHBondContact O-N 2.99Å
544	G	87.3	Confident	91	Very high	26 Å²	26	96.3 Å²	96.3	27%	0.268	49%	0.485	S	S	.	.	H	α-helix	trans	-59.5	-35	176.4	0	0	0	0	0	113.6	E540 A541 S548	E540-G544 PolarHBondContact O-N 3.21Å; A541-G544 PolarHBondContact O-N 2.93Å; G544-S548 WeakPolarHBondContact O-CB 3.34Å; G544-S548 PolarHBondContact O-N 3.08Å; G544-S548 PolarHBondContact O-OG 3.26Å
545	A	87.3	Confident	90.4	Very high	43 Å²	43	94.7 Å²	94.7	36%	0.355	48%	0.476	S	S	.	.	H	α-helix	trans	-70.3	-34.3	175.1	0	0	0	0	0	113.1	A541 K542 V543 R549	A541-A545 WeakPolarHBondContact O-CB 3.43Å; A541-A545 PolarHBondContact O-N 3.02Å; K542-A545 PolarHBondContact O-N 2.75Å; V543-A545 VanDerWaalsContact C-N 3.27Å; V543-A545 PolarHBondContact O-N 3Å; A545-R549 WeakPolarHBondContact O-CG 3.5Å; A545-R549 PolarHBondContact O-N 2.8Å; A545-R549 PolarHBondContact O-NE 2.95Å
546	E	91.1	Very high	90.1	Very high	85 Å²	85	96 Å²	96	40%	0.397	48%	0.479	S	S	.	.	H	α-helix	trans	-69.7	-42.4	173.5	-74.9	172.2	-169.4	0	0	111.9	K542 V543 R549 T550	K542-E546 VanDerWaalsContact CE-OE1 3.31Å; K542-E546 WeakPolarHBondContact CE-OE1 3.48Å; K542-E546 PolarHBondContact O-N 3.19Å; V543-E546 WeakPolarHBondContact O-CB 3.18Å; V543-E546 PolarHBondContact O-N 3.5Å; E546-R549 PolarHBondContact O-N 3.03Å; E546-R549 IonicContact OE1-NH2 3.77Å; E546-T550 PolarHBondContact O-N 3.29Å; E546-T550 PolarHBondContact O-OG1 3.42Å
547	E	92	Very high	89.6	Confident	126 Å²	126	96.9 Å²	96.9	59%	0.589	49%	0.488	S	S	*	.	H	α-helix	trans	-61.2	-44.7	172.9	-70.2	-178.2	169.3	0	0	111.4	V543 R549 T550 L551	V543-E547 WeakPolarHBondContact O-CG 3.35Å; V543-E547 PolarHBondContact O-N 2.99Å; E547-R549 VanDerWaalsContact C-N 3.32Å; E547-R549 PolarHBondContact O-N 3.05Å; E547-T550 WeakPolarHBondContact O-CB 3.46Å; E547-T550 PolarHBondContact O-N 2.86Å; E547-L551 WeakPolarHBondContact O-CB 3.38Å; E547-L551 PolarHBondContact O-N 3.02Å
548	S	83.5	Confident	88.8	Confident	54 Å²	54	95.8 Å²	95.8	38%	0.378	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-38	176.3	-64.1	0	0	0	0	112.6	G544 R552	G544-S548 WeakPolarHBondContact O-CB 3.34Å; G544-S548 PolarHBondContact O-N 3.08Å; G544-S548 PolarHBondContact O-OG 3.26Å; S548-R552 WeakPolarHBondContact O-CG 3.43Å; S548-R552 PolarHBondContact O-N 3.39Å
549	R	89.4	Confident	88.3	Confident	134 Å²	134	94.4 Å²	94.4	51%	0.506	48%	0.484	S	S	.	.	H	α-helix	trans	-63.7	-47.6	173.8	-81.2	-177.1	-79.9	177.9	-3.5	111	A545 E546 E547 L551 R552 T553	A545-R549 WeakPolarHBondContact O-CG 3.5Å; A545-R549 PolarHBondContact O-N 2.8Å; A545-R549 PolarHBondContact O-NE 2.95Å; E546-R549 PolarHBondContact O-N 3.03Å; E546-R549 IonicContact OE1-NH2 3.77Å; E547-R549 VanDerWaalsContact C-N 3.32Å; E547-R549 PolarHBondContact O-N 3.05Å; R549-L551 VanDerWaalsContact C-N 3.31Å; R549-L551 PolarHBondContact O-N 3.18Å; R549-R552 PolarHBondContact O-N 3.17Å; R549-T553 PolarHBondContact O-N 3.09Å; R549-T553 VanDerWaalsContact O-N 3.07Å; R549-T553 PolarHBondContact O-OG1 3.44Å
550	T	91.7	Very high	87.7	Confident	66 Å²	66	94.6 Å²	94.6	41%	0.405	48%	0.484	S	S	.	.	H	α-helix	trans	-60.3	-42.9	178.3	-56.3	0	0	0	0	111.4	E546 E547 T553 R554	E546-T550 PolarHBondContact O-N 3.29Å; E546-T550 PolarHBondContact O-OG1 3.42Å; E547-T550 WeakPolarHBondContact O-CB 3.46Å; E547-T550 PolarHBondContact O-N 2.86Å; T550-T553 PolarHBondContact O-N 3.35Å; T550-R554 WeakPolarHBondContact O-CG 3.34Å; T550-R554 PolarHBondContact O-N 3.02Å
551	L	86.9	Confident	87.1	Confident	100 Å²	100	91.2 Å²	91.2	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-64.4	-42.7	178.4	-170.6	64.7	0	0	0	111.7	E547 R549 T553 R554 I555	E547-L551 WeakPolarHBondContact O-CB 3.38Å; E547-L551 PolarHBondContact O-N 3.02Å; R549-L551 VanDerWaalsContact C-N 3.31Å; R549-L551 PolarHBondContact O-N 3.18Å; L551-T553 VanDerWaalsContact C-N 3.35Å; L551-T553 PolarHBondContact O-N 2.97Å; L551-R554 PolarHBondContact O-N 2.83Å; L551-R554 VanDerWaalsContact O-N 3.16Å; L551-I555 HydrophobicContact CG-CD1 4.25Å; L551-I555 WeakPolarHBondContact O-CG1 3.45Å; L551-I555 PolarHBondContact O-N 3.26Å
552	R	83.6	Confident	86.7	Confident	147 Å²	147	91.4 Å²	91.4	56%	0.555	47%	0.467	S	S	*	.	H	α-helix	trans	-59.1	-43.4	174.3	-77.5	-173.4	-69.9	-90.5	4	112.4	S548 R549 R554 I555 Q556	S548-R552 WeakPolarHBondContact O-CG 3.43Å; S548-R552 PolarHBondContact O-N 3.39Å; R549-R552 PolarHBondContact O-N 3.17Å; R552-R554 VanDerWaalsContact C-N 3.32Å; R552-R554 PolarHBondContact O-N 2.84Å; R552-I555 PolarHBondContact O-N 2.94Å; R552-Q556 PolarHBondContact O-N 3.26Å
553	T	90.8	Very high	86.2	Confident	91 Å²	91	93.2 Å²	93.2	56%	0.558	48%	0.475	S	S	*	.	H	α-helix	trans	-61.2	-40.6	175.2	-54.6	0	0	0	0	111.8	R549 T550 L551 Q556 L557	R549-T553 PolarHBondContact O-N 3.09Å; R549-T553 VanDerWaalsContact O-N 3.07Å; R549-T553 PolarHBondContact O-OG1 3.44Å; T550-T553 PolarHBondContact O-N 3.35Å; L551-T553 VanDerWaalsContact C-N 3.35Å; L551-T553 PolarHBondContact O-N 2.97Å; T553-Q556 PolarHBondContact O-N 3.04Å; T553-L557 PolarHBondContact O-N 2.93Å
554	R	86.6	Confident	85.7	Confident	168 Å²	168	96.9 Å²	96.9	63%	0.634	49%	0.488	S	S	*	.	H	α-helix	trans	-65.9	-39.4	176.3	-67.6	-175.9	-153.6	167.3	7.7	112.5	T550 L551 R552 L557 A558	T550-R554 WeakPolarHBondContact O-CG 3.34Å; T550-R554 PolarHBondContact O-N 3.02Å; L551-R554 PolarHBondContact O-N 2.83Å; L551-R554 VanDerWaalsContact O-N 3.16Å; R552-R554 VanDerWaalsContact C-N 3.32Å; R552-R554 PolarHBondContact O-N 2.84Å; R554-L557 PolarHBondContact O-N 2.96Å; R554-A558 WeakPolarHBondContact O-CB 3.36Å; R554-A558 PolarHBondContact O-N 2.92Å
555	I	81.8	Confident	85.4	Confident	82 Å²	82	97 Å²	97	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-47.8	175.6	-69.5	166.8	0	0	0	110	L551 R552 L557 A558 E559	L551-I555 HydrophobicContact CG-CD1 4.25Å; L551-I555 WeakPolarHBondContact O-CG1 3.45Å; L551-I555 PolarHBondContact O-N 3.26Å; R552-I555 PolarHBondContact O-N 2.94Å; I555-L557 VanDerWaalsContact C-N 3.33Å; I555-L557 PolarHBondContact O-N 3.06Å; I555-A558 WeakPolarHBondContact O-CB 2.96Å; I555-A558 PolarHBondContact O-N 3.48Å; I555-A558 VanDerWaalsContact O-N 3.13Å; I555-E559 HydrophobicContact CG2-CG 4.34Å; I555-E559 WeakPolarHBondContact O-CG 3.49Å; I555-E559 PolarHBondContact O-N 3.41Å
556	Q	87.8	Confident	85.2	Confident	108 Å²	108	100.5 Å²	100.5	51%	0.505	49%	0.491	S	S	.	.	H	α-helix	trans	-58.5	-44.9	177.9	-175.1	-177.5	-15.2	0	0	111.9	R552 T553 A558 E559 E560	R552-Q556 PolarHBondContact O-N 3.26Å; T553-Q556 PolarHBondContact O-N 3.04Å; Q556-A558 VanDerWaalsContact C-N 3.31Å; Q556-A558 PolarHBondContact O-N 2.71Å; Q556-E559 PolarHBondContact O-N 3Å; Q556-E560 PolarHBondContact NE2-OE1 3.46Å; Q556-E560 WeakPolarHBondContact O-CG 3.48Å; Q556-E560 PolarHBondContact O-N 3.04Å
557	L	86.9	Confident	85	Confident	117 Å²	117	97.8 Å²	97.8	61%	0.613	49%	0.486	S	S	*	.	H	α-helix	trans	-63.4	-38.3	177.5	-171.8	147.7	0	0	0	111.8	T553 R554 I555 A561	T553-L557 PolarHBondContact O-N 2.93Å; R554-L557 PolarHBondContact O-N 2.96Å; I555-L557 VanDerWaalsContact C-N 3.33Å; I555-L557 PolarHBondContact O-N 3.06Å; L557-A561 WeakPolarHBondContact O-CB 3.26Å; L557-A561 PolarHBondContact O-N 2.81Å
558	A	78.3	Confident	84.6	Confident	57 Å²	57	94.6 Å²	94.6	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-66.7	-40.1	174.8	0	0	0	0	0	112.3	R554 I555 Q556 A561 Q562	R554-A558 WeakPolarHBondContact O-CB 3.36Å; R554-A558 PolarHBondContact O-N 2.92Å; I555-A558 WeakPolarHBondContact O-CB 2.96Å; I555-A558 PolarHBondContact O-N 3.48Å; I555-A558 VanDerWaalsContact O-N 3.13Å; Q556-A558 VanDerWaalsContact C-N 3.31Å; Q556-A558 PolarHBondContact O-N 2.71Å; A558-A561 PolarHBondContact O-N 3.45Å; A558-Q562 WeakPolarHBondContact O-CB 3.35Å; A558-Q562 PolarHBondContact O-N 3.01Å
559	E	81.9	Confident	84.6	Confident	118 Å²	118	94.5 Å²	94.5	55%	0.551	47%	0.465	S	S	*	.	H	α-helix	trans	-64	-42.9	175	-74.4	177.5	174.8	0	0	111.9	I555 Q556 Q562 K563	I555-E559 HydrophobicContact CG2-CG 4.34Å; I555-E559 WeakPolarHBondContact O-CG 3.49Å; I555-E559 PolarHBondContact O-N 3.41Å; Q556-E559 PolarHBondContact O-N 3Å; E559-Q562 PolarHBondContact O-N 2.68Å; E559-K563 WeakPolarHBondContact O-CB 3.34Å; E559-K563 PolarHBondContact O-N 3.32Å
560	E	82.1	Confident	84.5	Confident	109 Å²	109	94.7 Å²	94.7	51%	0.509	47%	0.473	S	S	.	.	H	α-helix	trans	-61.9	-46.1	174.9	-74.8	174.9	-168.8	0	0	111.2	Q556 Q562 K563 Q564	Q556-E560 PolarHBondContact NE2-OE1 3.46Å; Q556-E560 WeakPolarHBondContact O-CG 3.48Å; Q556-E560 PolarHBondContact O-N 3.04Å; E560-Q562 PolarHBondContact O-N 2.9Å; E560-K563 PolarHBondContact O-N 2.99Å; E560-Q564 PolarHBondContact O-N 3.21Å
561	A	81.3	Confident	84.4	Confident	50 Å²	50	96.1 Å²	96.1	41%	0.413	48%	0.479	S	S	.	.	H	α-helix	trans	-61.8	-41.9	175.9	0	0	0	0	0	112.3	L557 A558 Q564 A565	L557-A561 WeakPolarHBondContact O-CB 3.26Å; L557-A561 PolarHBondContact O-N 2.81Å; A558-A561 PolarHBondContact O-N 3.45Å; A561-Q564 PolarHBondContact O-N 3.4Å; A561-A565 PolarHBondContact O-N 2.86Å
562	Q	81.9	Confident	84.5	Confident	67 Å²	67	93.9 Å²	93.9	31%	0.313	46%	0.463	S	S	.	.	H	α-helix	trans	-67.6	-37.5	177.2	-162.6	-168.3	8.4	0	0	111.8	A558 E559 E560 Q564 A565 R566	A558-Q562 WeakPolarHBondContact O-CB 3.35Å; A558-Q562 PolarHBondContact O-N 3.01Å; E559-Q562 PolarHBondContact O-N 2.68Å; E560-Q562 PolarHBondContact O-N 2.9Å; Q562-Q564 VanDerWaalsContact C-N 3.35Å; Q562-A565 PolarHBondContact O-N 3.48Å; Q562-R566 PolarHBondContact O-N 2.9Å
563	K	83.9	Confident	84.9	Confident	150 Å²	150	90 Å²	90	65%	0.652	45%	0.452	S	S	*	.	H	α-helix	trans	-63.4	-42.1	174	-174.7	-177	177.5	-174.4	0	111.1	E559 E560 R566 G567	E559-K563 WeakPolarHBondContact O-CB 3.34Å; E559-K563 PolarHBondContact O-N 3.32Å; E560-K563 PolarHBondContact O-N 2.99Å; K563-R566 PolarHBondContact O-N 3.26Å; K563-G567 PolarHBondContact O-N 2.92Å
564	Q	84.4	Confident	85	Confident	137 Å²	137	91.7 Å²	91.7	64%	0.64	45%	0.453	S	S	*	.	H	α-helix	trans	-62.3	-44.8	175.5	-174.8	178.1	3.7	0	0	111.6	E560 A561 Q562 R566 G567 M568	E560-Q564 PolarHBondContact O-N 3.21Å; A561-Q564 PolarHBondContact O-N 3.4Å; Q562-Q564 VanDerWaalsContact C-N 3.35Å; Q564-R566 PolarHBondContact O-N 3.5Å; Q564-G567 WeakPolarHBondContact O-CA 3.27Å; Q564-G567 PolarHBondContact O-N 3.45Å; Q564-G567 VanDerWaalsContact O-N 3.11Å; Q564-M568 WeakPolarHBondContact O-CG 3.41Å; Q564-M568 PolarHBondContact O-N 3.23Å
565	A	80.8	Confident	85.3	Confident	29 Å²	29	86.7 Å²	86.7	24%	0.24	44%	0.441	C	S	.	.	H	α-helix	trans	-60.2	-42.8	177.3	0	0	0	0	0	112.5	A561 Q562 G567 M568 E569	A561-A565 PolarHBondContact O-N 2.86Å; Q562-A565 PolarHBondContact O-N 3.48Å; A565-G567 VanDerWaalsContact C-N 3.33Å; A565-G567 PolarHBondContact O-N 3.49Å; A565-M568 PolarHBondContact O-N 3.03Å; A565-E569 PolarHBondContact O-N 3.02Å
566	R	83.3	Confident	85.8	Confident	115 Å²	115	83.2 Å²	83.2	43%	0.434	42%	0.424	S	S	.	.	H	α-helix	trans	-64.1	-36.6	173.5	-72	-167.9	-61.4	-95.8	-2	112.7	Q562 K563 Q564 E569 M570	Q562-R566 PolarHBondContact O-N 2.9Å; K563-R566 PolarHBondContact O-N 3.26Å; Q564-R566 PolarHBondContact O-N 3.5Å; R566-E569 PolarHBondContact O-N 2.8Å; R566-M570 WeakPolarHBondContact O-CG 3.33Å; R566-M570 PolarHBondContact O-N 3.46Å; R566-M570 VanDerWaalsContact O-N 3.12Å
567	G	85.8	Confident	86.1	Confident	28 Å²	28	83.1 Å²	83.1	29%	0.289	42%	0.423	S	S	.	.	H	α-helix	trans	-59.9	-49.1	173.3	0	0	0	0	0	111.4	K563 Q564 A565 E569 M570 D571	K563-G567 PolarHBondContact O-N 2.92Å; Q564-G567 WeakPolarHBondContact O-CA 3.27Å; Q564-G567 PolarHBondContact O-N 3.45Å; Q564-G567 VanDerWaalsContact O-N 3.11Å; A565-G567 VanDerWaalsContact C-N 3.33Å; A565-G567 PolarHBondContact O-N 3.49Å; G567-E569 VanDerWaalsContact C-N 3.3Å; G567-E569 PolarHBondContact O-N 2.99Å; G567-M570 WeakPolarHBondContact O-CB 3.49Å; G567-M570 PolarHBondContact O-N 3.07Å; G567-M570 VanDerWaalsContact O-N 3.09Å; G567-D571 VanDerWaalsContact O-CG 3.29Å; G567-D571 PolarHBondContact O-N 2.86Å
568	M	82.9	Confident	86.5	Confident	59 Å²	59	82.9 Å²	82.9	29%	0.291	42%	0.421	S	S	.	.	H	α-helix	trans	-59.9	-38.7	176.9	-67.7	178	66.9	0	0	112.5	Q564 A565 M570 D571 Y572 F626	Q564-M568 WeakPolarHBondContact O-CG 3.41Å; Q564-M568 PolarHBondContact O-N 3.23Å; A565-M568 PolarHBondContact O-N 3.03Å; M568-M570 VanDerWaalsContact C-N 3.33Å; M568-M570 PolarHBondContact O-N 3.46Å; M568-D571 PolarHBondContact O-N 3.14Å; M568-Y572 WeakPolarHBondContact O-CD2 3.39Å; M568-Y572 PolarHBondContact O-N 3.4Å; M568-F626 HydrophobicContact CE-CE1 4.11Å; M568-F626 HydrophobicContact CE-CE2 4.32Å; M568-F626 HydrophobicContact CE-CZ 3.64Å
569	E	84.7	Confident	87.1	Confident	53 Å²	53	81.1 Å²	81.1	25%	0.248	40%	0.404	C	S	.	.	H	α-helix	trans	-61.2	-41	174.9	-171.9	-174.2	156.9	0	0	112.2	A565 R566 G567 E573 K623 E627	A565-E569 PolarHBondContact O-N 3.02Å; R566-E569 PolarHBondContact O-N 2.8Å; G567-E569 VanDerWaalsContact C-N 3.3Å; G567-E569 PolarHBondContact O-N 2.99Å; E569-E573 PolarHBondContact O-N 3.32Å; E569-E573 VanDerWaalsContact O-N 3.13Å; E569-K623 HydrophobicContact CG-CG 4.37Å; E569-E627 HydrophobicContact CG-CG 4.3Å
570	M	88	Confident	87.6	Confident	137 Å²	137	79.5 Å²	79.5	68%	0.675	40%	0.397	S	S	*	.	H	α-helix	trans	-66.7	-41.2	174.9	-68.6	-177.5	62.3	0	0	112.2	R566 G567 M568 Y572 E573 E574	R566-M570 WeakPolarHBondContact O-CG 3.33Å; R566-M570 PolarHBondContact O-N 3.46Å; R566-M570 VanDerWaalsContact O-N 3.12Å; G567-M570 WeakPolarHBondContact O-CB 3.49Å; G567-M570 PolarHBondContact O-N 3.07Å; G567-M570 VanDerWaalsContact O-N 3.09Å; M568-M570 VanDerWaalsContact C-N 3.33Å; M568-M570 PolarHBondContact O-N 3.46Å; M570-Y572 VanDerWaalsContact C-N 3.32Å; M570-Y572 PolarHBondContact O-N 3.1Å; M570-E573 WeakPolarHBondContact O-CB 3.16Å; M570-E573 PolarHBondContact O-N 3.02Å; M570-E573 VanDerWaalsContact O-N 3.15Å; M570-E574 PolarHBondContact O-N 3.25Å
571	D	89.4	Confident	88.2	Confident	97 Å²	97	77.2 Å²	77.2	52%	0.519	40%	0.396	S	S	.	.	H	α-helix	trans	-61.3	-42.3	177.5	-63.1	-22.1	0	0	0	110.8	G567 M568 E573 E574 V575	G567-D571 VanDerWaalsContact O-CG 3.29Å; G567-D571 PolarHBondContact O-N 2.86Å; M568-D571 PolarHBondContact O-N 3.14Å; D571-E573 VanDerWaalsContact C-N 3.34Å; D571-E573 PolarHBondContact O-N 2.69Å; D571-E574 PolarHBondContact O-N 3.18Å; D571-V575 WeakPolarHBondContact O-CG2 3.44Å; D571-V575 PolarHBondContact O-N 3.27Å
572	Y	88.4	Confident	88.7	Confident	52 Å²	52	78.9 Å²	78.9	20%	0.204	40%	0.395	C	S	.	.	H	α-helix	trans	-63.9	-37.4	174.4	-81.6	-65.4	0	0	0	112.5	M568 M570 V575 I576 A622 F626	M568-Y572 WeakPolarHBondContact O-CD2 3.39Å; M568-Y572 PolarHBondContact O-N 3.4Å; M570-Y572 VanDerWaalsContact C-N 3.32Å; M570-Y572 PolarHBondContact O-N 3.1Å; Y572-V575 PolarHBondContact O-N 3.47Å; Y572-I576 WeakPolarHBondContact O-CB 3.36Å; Y572-I576 WeakPolarHBondContact O-CD1 3.35Å; Y572-I576 WeakPolarHBondContact O-CG1 3.47Å; Y572-I576 PolarHBondContact O-N 3.47Å; Y572-A622 HydrophobicContact CD1-CB 4.33Å; Y572-A622 HydrophobicContact CE1-CB 3.79Å; Y572-A622 HydrophobicContact CE2-CB 4.46Å; Y572-F626 HydrophobicContact CD2-CD2 4.18Å; Y572-F626 HydrophobicContact CD2-CE2 4.34Å; Y572-F626 AromaticContact CE2-CD2 3.82Å; Y572-F626 HydrophobicContact CE2-CD2 3.82Å; Y572-F626 AromaticContact CE2-CE2 3.54Å; Y572-F626 HydrophobicContact CE2-CE2 3.54Å; Y572-F626 HydrophobicContact CE2-CZ 4.49Å
573	E	91.5	Very high	89.2	Confident	67 Å²	67	76.1 Å²	76.1	31%	0.313	38%	0.383	S	S	.	.	H	α-helix	trans	-64.8	-41.4	175.9	-168	72.2	160.7	0	0	112	E569 M570 D571 I576 H577 K623	E569-E573 PolarHBondContact O-N 3.32Å; E569-E573 VanDerWaalsContact O-N 3.13Å; M570-E573 WeakPolarHBondContact O-CB 3.16Å; M570-E573 PolarHBondContact O-N 3.02Å; M570-E573 VanDerWaalsContact O-N 3.15Å; D571-E573 VanDerWaalsContact C-N 3.34Å; D571-E573 PolarHBondContact O-N 2.69Å; E573-I576 PolarHBondContact O-N 2.91Å; E573-H577 PolarHBondContact O-CD2 3.44Å; E573-H577 PolarHBondContact O-N 3.06Å; E573-K623 VanDerWaalsContact CD-NZ 3.27Å; E573-K623 IonicContact OE1-NZ 3.35Å; E573-K623 VanDerWaalsContact OE2-CD 3.24Å; E573-K623 WeakPolarHBondContact OE2-CD 3.45Å; E573-K623 WeakPolarHBondContact OE2-CE 3.47Å; E573-K623 IonicContact OE2-NZ 2.59Å; E573-K623 PolarHBondContact OE2-NZ 3.12Å
574	E	93.8	Very high	89.6	Confident	125 Å²	125	71.5 Å²	71.5	58%	0.584	37%	0.372	S	S	*	.	H	α-helix	trans	-64	-44.3	176	-173.3	172.8	-173.9	0	0	111.4	M570 D571 I576 H577 L578	M570-E574 PolarHBondContact O-N 3.25Å; D571-E574 PolarHBondContact O-N 3.18Å; E574-I576 VanDerWaalsContact C-N 3.32Å; E574-I576 PolarHBondContact O-N 3.5Å; E574-H577 PolarHBondContact O-N 2.93Å; E574-L578 HydrophobicContact CG-CD1 4.32Å; E574-L578 WeakPolarHBondContact O-CG 3.22Å; E574-L578 PolarHBondContact O-N 3.49Å
575	V	93.2	Very high	89.9	Confident	63 Å²	63	70 Å²	70	38%	0.382	37%	0.365	S	S	.	.	H	α-helix	trans	-60.7	-42.2	175.3	170.8	0	0	0	0	111.3	D571 Y572 L578 L579	D571-V575 WeakPolarHBondContact O-CG2 3.44Å; D571-V575 PolarHBondContact O-N 3.27Å; Y572-V575 PolarHBondContact O-N 3.47Å; V575-L578 PolarHBondContact O-N 3.34Å; V575-L579 HydrophobicContact CG1-CD1 3.8Å; V575-L579 HydrophobicContact CG1-CG 4.31Å; V575-L579 WeakPolarHBondContact O-CB 3.28Å; V575-L579 VanDerWaalsContact O-CG 3.26Å; V575-L579 WeakPolarHBondContact O-CG 3.48Å; V575-L579 PolarHBondContact O-N 3.29Å
576	I	92.1	Very high	90.3	Very high	10 Å²	10	69.2 Å²	69.2	5%	0.051	36%	0.357	C	S	.	.	H	α-helix	trans	-59.6	-49.8	176.2	-74.7	164	0	0	0	110.1	Y572 E573 E574 L578 L579 E580 L616 E620 K623	Y572-I576 WeakPolarHBondContact O-CB 3.36Å; Y572-I576 WeakPolarHBondContact O-CD1 3.35Å; Y572-I576 WeakPolarHBondContact O-CG1 3.47Å; Y572-I576 PolarHBondContact O-N 3.47Å; E573-I576 PolarHBondContact O-N 2.91Å; E574-I576 VanDerWaalsContact C-N 3.32Å; E574-I576 PolarHBondContact O-N 3.5Å; I576-L578 PolarHBondContact O-N 2.94Å; I576-L579 PolarHBondContact O-N 2.95Å; I576-E580 HydrophobicContact CG2-CG 4.41Å; I576-E580 WeakPolarHBondContact O-CB 3.48Å; I576-E580 VanDerWaalsContact O-CG 3.31Å; I576-E580 WeakPolarHBondContact O-CG 3.46Å; I576-E580 PolarHBondContact O-N 3.32Å; I576-L616 HydrophobicContact CB-CD1 4.22Å; I576-L616 HydrophobicContact CG1-CD1 4.23Å; I576-L616 HydrophobicContact CG2-CD1 3.87Å; I576-E620 HydrophobicContact CD1-CG 4.06Å; I576-E620 HydrophobicContact CG1-CG 4.23Å; I576-K623 HydrophobicContact CD1-CB 4.2Å; I576-K623 HydrophobicContact CD1-CD 3.88Å
577	H	93.9	Very high	90.5	Very high	106 Å²	106	68.3 Å²	68.3	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-61.1	-40.6	178.3	-78.8	-45.3	0	0	0	113.5	E573 E574 E580 A581	E573-H577 PolarHBondContact O-CD2 3.44Å; E573-H577 PolarHBondContact O-N 3.06Å; E574-H577 PolarHBondContact O-N 2.93Å; H577-E580 IonicContact ND1-OE2 3.5Å; H577-E580 PolarHBondContact ND1-OE2 2.88Å; H577-E580 PolarHBondContact O-N 3.06Å; H577-A581 WeakPolarHBondContact O-CB 3.31Å; H577-A581 PolarHBondContact O-N 2.75Å
578	L	94.6	Very high	90.5	Very high	111 Å²	111	70.3 Å²	70.3	58%	0.581	36%	0.363	S	S	*	.	H	α-helix	trans	-64.6	-43	176	-71.2	172.7	0	0	0	111.7	E574 V575 I576 A581 E582	E574-L578 HydrophobicContact CG-CD1 4.32Å; E574-L578 WeakPolarHBondContact O-CG 3.22Å; E574-L578 PolarHBondContact O-N 3.49Å; V575-L578 PolarHBondContact O-N 3.34Å; I576-L578 PolarHBondContact O-N 2.94Å; L578-A581 PolarHBondContact O-N 3.42Å; L578-E582 WeakPolarHBondContact O-CB 3.23Å; L578-E582 PolarHBondContact O-N 3.24Å
579	L	91.3	Very high	90.5	Very high	21 Å²	21	71.1 Å²	71.1	11%	0.11	37%	0.366	C	S	.	.	H	α-helix	trans	-65.3	-41.4	176.5	-72.7	172.1	0	0	0	111.7	V575 I576 I583 L612 Q615 L616	V575-L579 HydrophobicContact CG1-CD1 3.8Å; V575-L579 HydrophobicContact CG1-CG 4.31Å; V575-L579 WeakPolarHBondContact O-CB 3.28Å; V575-L579 VanDerWaalsContact O-CG 3.26Å; V575-L579 WeakPolarHBondContact O-CG 3.48Å; V575-L579 PolarHBondContact O-N 3.29Å; I576-L579 PolarHBondContact O-N 2.95Å; L579-I583 WeakPolarHBondContact O-CB 3.49Å; L579-I583 VanDerWaalsContact O-CD1 3.3Å; L579-I583 WeakPolarHBondContact O-CD1 3.39Å; L579-I583 WeakPolarHBondContact O-CG1 3.42Å; L579-I583 PolarHBondContact O-N 2.85Å; L579-L612 HydrophobicContact CD2-CD2 3.76Å; L579-Q615 HydrophobicContact CD1-CB 4.26Å; L579-Q615 HydrophobicContact CD2-CB 4.46Å; L579-L616 HydrophobicContact CB-CB 4.32Å; L579-L616 HydrophobicContact CB-CD1 4.01Å; L579-L616 HydrophobicContact CD1-CB 4.3Å; L579-L616 HydrophobicContact CD1-CD1 4.5Å
580	E	92.9	Very high	90.2	Very high	84 Å²	84	75.5 Å²	75.5	39%	0.393	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-44.9	174.6	-74.5	178.9	152.9	0	0	112	I576 H577 I583 A584 L616	I576-E580 HydrophobicContact CG2-CG 4.41Å; I576-E580 WeakPolarHBondContact O-CB 3.48Å; I576-E580 VanDerWaalsContact O-CG 3.31Å; I576-E580 WeakPolarHBondContact O-CG 3.46Å; I576-E580 PolarHBondContact O-N 3.32Å; H577-E580 IonicContact ND1-OE2 3.5Å; H577-E580 PolarHBondContact ND1-OE2 2.88Å; H577-E580 PolarHBondContact O-N 3.06Å; E580-I583 PolarHBondContact O-N 3.36Å; E580-A584 WeakPolarHBondContact O-CB 3.46Å; E580-A584 PolarHBondContact O-N 2.9Å; E580-L616 HydrophobicContact CG-CD1 4.05Å; E580-L616 HydrophobicContact CG-CD2 4.11Å
581	A	93.8	Very high	89.5	Confident	60 Å²	60	74 Å²	74	50%	0.496	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-47.5	178.3	0	0	0	0	0	111.9	H577 L578 I583 A584 E585	H577-A581 WeakPolarHBondContact O-CB 3.31Å; H577-A581 PolarHBondContact O-N 2.75Å; L578-A581 PolarHBondContact O-N 3.42Å; A581-I583 PolarHBondContact O-N 2.96Å; A581-A584 WeakPolarHBondContact O-CB 3.35Å; A581-A584 PolarHBondContact O-N 3.06Å; A581-A584 VanDerWaalsContact O-N 3.17Å; A581-E585 PolarHBondContact O-N 3.22Å
582	E	92.9	Very high	88.6	Confident	85 Å²	85	76.2 Å²	76.2	40%	0.397	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-42.5	177.6	-175.8	68.7	-155.7	0	0	111.4	L578 A584 E585 L586 L612	L578-E582 WeakPolarHBondContact O-CB 3.23Å; L578-E582 PolarHBondContact O-N 3.24Å; E582-A584 VanDerWaalsContact C-N 3.31Å; E582-A584 PolarHBondContact O-N 2.94Å; E582-E585 PolarHBondContact O-N 3.45Å; E582-L586 HydrophobicContact CG-CD1 4.15Å; E582-L586 WeakPolarHBondContact O-CB 3.47Å; E582-L586 WeakPolarHBondContact O-CG 3.43Å; E582-L586 PolarHBondContact O-N 3.29Å; E582-L612 HydrophobicContact CB-CD1 4.41Å; E582-L612 HydrophobicContact CG-CD1 3.59Å
583	I	91.6	Very high	87.3	Confident	10 Å²	10	79.1 Å²	79.1	5%	0.051	40%	0.401	C	S	.	.	H	α-helix	trans	-61.7	-40.9	175	-70.9	163.2	0	0	0	110.7	L579 E580 A581 K587 V609 L612 E613 L616	L579-I583 WeakPolarHBondContact O-CB 3.49Å; L579-I583 VanDerWaalsContact O-CD1 3.3Å; L579-I583 WeakPolarHBondContact O-CD1 3.39Å; L579-I583 WeakPolarHBondContact O-CG1 3.42Å; L579-I583 PolarHBondContact O-N 2.85Å; E580-I583 PolarHBondContact O-N 3.36Å; A581-I583 PolarHBondContact O-N 2.96Å; I583-K587 HydrophobicContact CG2-CD 3.88Å; I583-K587 VanDerWaalsContact O-CB 3.3Å; I583-K587 WeakPolarHBondContact O-CB 3.43Å; I583-K587 WeakPolarHBondContact O-CG 3.42Å; I583-K587 PolarHBondContact O-N 2.89Å; I583-V609 HydrophobicContact CG2-CG1 4.43Å; I583-L612 HydrophobicContact CD1-CB 4.01Å; I583-L612 HydrophobicContact CG1-CB 3.66Å; I583-L612 HydrophobicContact CG1-CD1 4.39Å; I583-E613 HydrophobicContact CD1-CG 3.89Å; I583-E613 HydrophobicContact CG1-CG 4.42Å; I583-E613 HydrophobicContact CG2-CG 4.35Å; I583-L616 HydrophobicContact CD1-CB 4.23Å; I583-L616 HydrophobicContact CD1-CD2 3.83Å
584	A	91.7	Very high	85.7	Confident	52 Å²	52	81.1 Å²	81.1	43%	0.43	42%	0.42	S	S	.	.	H	α-helix	trans	-66.8	-40.4	177.8	0	0	0	0	0	111.9	E580 A581 E582 K587 T588	E580-A584 WeakPolarHBondContact O-CB 3.46Å; E580-A584 PolarHBondContact O-N 2.9Å; A581-A584 WeakPolarHBondContact O-CB 3.35Å; A581-A584 PolarHBondContact O-N 3.06Å; A581-A584 VanDerWaalsContact O-N 3.17Å; E582-A584 VanDerWaalsContact C-N 3.31Å; E582-A584 PolarHBondContact O-N 2.94Å; A584-K587 PolarHBondContact O-N 2.67Å; A584-T588 WeakPolarHBondContact O-CB 3.42Å; A584-T588 PolarHBondContact O-N 2.82Å; A584-T588 PolarHBondContact O-OG1 3.43Å
585	E	92.3	Very high	83.7	Confident	105 Å²	105	79.5 Å²	79.5	49%	0.491	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-50.5	176.6	-171.9	176.7	168.1	0	0	111.3	A581 E582 K587 T588 Q589	A581-E585 PolarHBondContact O-N 3.22Å; E582-E585 PolarHBondContact O-N 3.45Å; E585-K587 VanDerWaalsContact C-N 3.27Å; E585-K587 PolarHBondContact O-N 2.95Å; E585-T588 WeakPolarHBondContact O-CA 3.39Å; E585-T588 WeakPolarHBondContact O-CB 3.5Å; E585-T588 PolarHBondContact O-N 3.16Å; E585-Q589 WeakPolarHBondContact O-CG 3.31Å; E585-Q589 PolarHBondContact O-N 2.97Å; E585-Q589 PolarHBondContact OE1-NE2 3.26Å; E585-Q589 VanDerWaalsContact OE1-NE2 3.17Å
586	L	88.4	Confident	81.9	Confident	13 Å²	13	82.6 Å²	82.6	7%	0.068	45%	0.447	C	S	.	.	H	α-helix	trans	-62.7	-33.1	177.9	-68.6	173	0	0	0	112.5	E582 R590 L605 V609 L612	E582-L586 HydrophobicContact CG-CD1 4.15Å; E582-L586 WeakPolarHBondContact O-CB 3.47Å; E582-L586 WeakPolarHBondContact O-CG 3.43Å; E582-L586 PolarHBondContact O-N 3.29Å; L586-R590 PolarHBondContact O-N 3.5Å; L586-L605 HydrophobicContact CD2-CD1 3.97Å; L586-V609 HydrophobicContact CB-CG2 3.71Å; L586-V609 HydrophobicContact CD1-CG2 4.26Å; L586-L612 HydrophobicContact CD1-CD1 3.47Å; L586-L612 VanDerWaalsContact CD1-CD1 3.47Å
587	K	86.7	Confident	80.1	Confident	97 Å²	97	85.2 Å²	85.2	42%	0.422	46%	0.463	S	S	.	.	H	α-helix	trans	-68.4	-35.8	172	-78.8	173.8	-179.3	169.2	0	112	I583 A584 E585 R590 V591 E613	I583-K587 HydrophobicContact CG2-CD 3.88Å; I583-K587 VanDerWaalsContact O-CB 3.3Å; I583-K587 WeakPolarHBondContact O-CB 3.43Å; I583-K587 WeakPolarHBondContact O-CG 3.42Å; I583-K587 PolarHBondContact O-N 2.89Å; A584-K587 PolarHBondContact O-N 2.67Å; E585-K587 VanDerWaalsContact C-N 3.27Å; E585-K587 PolarHBondContact O-N 2.95Å; K587-R590 WeakPolarHBondContact O-CB 3.49Å; K587-R590 PolarHBondContact O-N 3.4Å; K587-V591 WeakPolarHBondContact O-CG2 3.34Å; K587-V591 PolarHBondContact O-N 3.08Å; K587-E613 WeakPolarHBondContact CE-OE1 3.33Å; K587-E613 IonicContact NZ-OE1 2.73Å; K587-E613 PolarHBondContact NZ-OE1 3.09Å
588	T	87.4	Confident	78.8	Confident	70 Å²	70	87.2 Å²	87.2	43%	0.429	47%	0.471	S	S	.	.	H	α-helix	trans	-71.7	-45	177.5	-54.9	0	0	0	0	111.5	A584 E585 R590 V591 E592	A584-T588 WeakPolarHBondContact O-CB 3.42Å; A584-T588 PolarHBondContact O-N 2.82Å; A584-T588 PolarHBondContact O-OG1 3.43Å; E585-T588 WeakPolarHBondContact O-CA 3.39Å; E585-T588 WeakPolarHBondContact O-CB 3.5Å; E585-T588 PolarHBondContact O-N 3.16Å; T588-R590 PolarHBondContact O-N 3.15Å; T588-V591 WeakPolarHBondContact O-CA 3.25Å; T588-V591 PolarHBondContact O-N 3.11Å; T588-E592 HydrophobicContact CG2-CG 4.39Å; T588-E592 PolarHBondContact O-N 3.08Å
589	Q	82.6	Confident	77.7	Confident	75 Å²	75	90.1 Å²	90.1	35%	0.35	48%	0.479	S	S	.	.	H	α-helix	trans	-57	-33.3	174.3	-70.1	177.9	14.5	0	0	112.2	E585 H593	E585-Q589 WeakPolarHBondContact O-CG 3.31Å; E585-Q589 PolarHBondContact O-N 2.97Å; E585-Q589 PolarHBondContact OE1-NE2 3.26Å; E585-Q589 VanDerWaalsContact OE1-NE2 3.17Å; Q589-H593 PolarHBondContact O-N 2.99Å
590	R	77.6	Confident	76.9	Confident	145 Å²	145	96.8 Å²	96.8	55%	0.547	51%	0.509	S	S	.	.	H	α-helix	trans	-66.4	-34.7	173.2	-170.4	-178.5	174.4	-110.6	-6.9	113.2	L586 K587 T588 L605	L586-R590 PolarHBondContact O-N 3.5Å; K587-R590 WeakPolarHBondContact O-CB 3.49Å; K587-R590 PolarHBondContact O-N 3.4Å; T588-R590 PolarHBondContact O-N 3.15Å; R590-L605 HydrophobicContact CB-CD2 4.01Å
591	V	73.8	Confident	76.2	Confident	107 Å²	107	97.5 Å²	97.5	65%	0.648	51%	0.513	S	S	*	.	H	α-helix	trans	-82.1	-33.4	-177.1	175.5	0	0	0	0	111.3	K587 T588 P594	K587-V591 WeakPolarHBondContact O-CG2 3.34Å; K587-V591 PolarHBondContact O-N 3.08Å; T588-V591 WeakPolarHBondContact O-CA 3.25Å; T588-V591 PolarHBondContact O-N 3.11Å; V591-P594 WeakPolarHBondContact O-CD 3.5Å; V591-P594 VanDerWaalsContact O-CG 3.28Å; V591-P594 WeakPolarHBondContact O-CG 3.22Å
592	E	70.4	Confident	75.6	Confident	142 Å²	142	96.3 Å²	96.3	66%	0.664	50%	0.503	S	S	*	.	H	α-helix	trans	-81.7	-20.9	-178.1	-69	-172.5	163.2	0	0	114.7	T588 P594	T588-E592 HydrophobicContact CG2-CG 4.39Å; T588-E592 PolarHBondContact O-N 3.08Å; E592-P594 VanDerWaalsContact O-CD 3.32Å; E592-P594 WeakPolarHBondContact O-CD 3.49Å
593	H	61.5	Low	75	Confident	114 Å²	114	95.2 Å²	95.2	53%	0.528	50%	0.5	S	S	.	.			trans	-113.3	61.4	175.6	-72.6	-60.4	0	0	0	115.6	Q589 T597	Q589-H593 PolarHBondContact O-N 2.99Å; H593-T597 HydrophobicContact CB-CG2 4.37Å; H593-T597 PolarHBondContact O-OG1 3.32Å
594	P	56.8	Low	74.8	Confident	108 Å²	108	99.5 Å²	99.5	70%	0.701	52%	0.52	S	S	*	.			trans	-81	-16.3	175.7	-8.3	25.9	0	0	0	114.5	V591 E592	V591-P594 WeakPolarHBondContact O-CD 3.5Å; V591-P594 VanDerWaalsContact O-CG 3.28Å; V591-P594 WeakPolarHBondContact O-CG 3.22Å; E592-P594 VanDerWaalsContact O-CD 3.32Å; E592-P594 WeakPolarHBondContact O-CD 3.49Å
595	A	52.3	Low	74.5	Confident	91 Å²	91	98.9 Å²	98.9	75%	0.752	51%	0.509	S	S	*	.	S	Bend	trans	-105.3	-9.9	-157	0	0	0	0	0	116.7
596	T	54.4	Low	74.2	Confident	129 Å²	129	98.5 Å²	98.5	79%	0.791	51%	0.505	S	S	*	.	S	Bend	trans	-143.6	-1.8	-175.5	52	0	0	0	0	116.3
597	T	56.3	Low	74.3	Confident	64 Å²	64	104.9 Å²	104.9	39%	0.393	53%	0.533	S	S	.	.			trans	-87.4	140	-175.7	33.6	0	0	0	0	112.3	H593 E601	H593-T597 HydrophobicContact CB-CG2 4.37Å; H593-T597 PolarHBondContact O-OG1 3.32Å; T597-E601 WeakPolarHBondContact CG2-OE2 3.29Å
598	K	64.8	Low	74.5	Confident	148 Å²	148	104.9 Å²	104.9	64%	0.643	53%	0.533	S	S	*	.			trans	-64.2	140.5	178.2	-70	173.5	-178.8	171.7	0	108.6	E600 E601 A602	K598-E600 PolarHBondContact O-N 2.91Å; K598-E601 HydrophobicContact CB-CG 4.48Å; K598-E601 PolarHBondContact N-OE2 3.37Å; K598-E601 PolarHBondContact O-N 3.45Å; K598-A602 PolarHBondContact O-N 2.88Å
599	K	71.9	Confident	74.6	Confident	173 Å²	173	102.4 Å²	102.4	75%	0.752	52%	0.517	S	S	*	.	H	α-helix	trans	-48.3	-32.1	177.8	-171.7	176.4	179.4	179.8	0	113	D603	K599-D603 PolarHBondContact O-N 3.5Å; K599-D603 VanDerWaalsContact O-N 3.15Å
600	E	75.1	Confident	75	Confident	160 Å²	160	101.4 Å²	101.4	75%	0.748	52%	0.522	S	S	*	.	H	α-helix	trans	-62.8	-42.3	175.7	-129.4	168.5	-176.3	0	0	113.7	K598 D603 E604	K598-E600 PolarHBondContact O-N 2.91Å; E600-D603 PolarHBondContact O-N 2.9Å; E600-E604 PolarHBondContact O-N 3.12Å
601	E	78.8	Confident	75.7	Confident	99 Å²	99	99.2 Å²	99.2	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-69.5	-38.2	179.3	-68.3	169.1	164	0	0	111.2	T597 K598 D603 E604 L605	T597-E601 WeakPolarHBondContact CG2-OE2 3.29Å; K598-E601 HydrophobicContact CB-CG 4.48Å; K598-E601 PolarHBondContact N-OE2 3.37Å; K598-E601 PolarHBondContact O-N 3.45Å; E601-D603 VanDerWaalsContact C-N 3.33Å; E601-D603 PolarHBondContact O-N 2.97Å; E601-E604 PolarHBondContact O-N 3.01Å; E601-L605 WeakPolarHBondContact O-CB 3.47Å; E601-L605 PolarHBondContact O-N 3.14Å
602	A	79.4	Confident	76.4	Confident	35 Å²	35	95.5 Å²	95.5	29%	0.289	50%	0.497	S	S	.	.	H	α-helix	trans	-66.5	-35	175.4	0	0	0	0	0	112.4	K598 K606	K598-A602 PolarHBondContact O-N 2.88Å; A602-K606 WeakPolarHBondContact O-CG 3.34Å; A602-K606 PolarHBondContact O-N 3.28Å
603	D	82.1	Confident	77.4	Confident	62 Å²	62	92.2 Å²	92.2	33%	0.332	48%	0.481	S	S	.	.	H	α-helix	trans	-77.4	-30.2	176.1	-73.3	-23.5	0	0	0	112.1	K599 E600 E601 K606 K607	K599-D603 PolarHBondContact O-N 3.5Å; K599-D603 VanDerWaalsContact O-N 3.15Å; E600-D603 PolarHBondContact O-N 2.9Å; E601-D603 VanDerWaalsContact C-N 3.33Å; E601-D603 PolarHBondContact O-N 2.97Å; D603-K606 IonicContact OD1-NZ 2.84Å; D603-K606 PolarHBondContact OD1-NZ 2.91Å; D603-K607 WeakPolarHBondContact O-CG 3.41Å; D603-K607 PolarHBondContact O-N 2.79Å; D603-K607 VanDerWaalsContact O-N 3.13Å
604	E	86.5	Confident	78.8	Confident	101 Å²	101	90.2 Å²	90.2	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-67.2	-42.9	170.5	-163.1	-174.2	152.4	0	0	111.9	E600 E601 K606 K607 K608	E600-E604 PolarHBondContact O-N 3.12Å; E601-E604 PolarHBondContact O-N 3.01Å; E604-K606 VanDerWaalsContact C-N 3.32Å; E604-K606 PolarHBondContact O-N 3.3Å; E604-K607 WeakPolarHBondContact O-CB 3.27Å; E604-K607 PolarHBondContact O-N 2.99Å; E604-K607 VanDerWaalsContact O-N 3.14Å; E604-K608 PolarHBondContact O-N 3.34Å; E604-K608 VanDerWaalsContact OE1-CE 3.28Å; E604-K608 WeakPolarHBondContact OE1-CE 3.37Å; E604-K608 IonicContact OE1-NZ 2.88Å; E604-K608 PolarHBondContact OE1-NZ 2.93Å
605	L	84.9	Confident	80.3	Confident	38 Å²	38	89.7 Å²	89.7	20%	0.199	47%	0.468	C	S	.	.	H	α-helix	trans	-62.3	-39.9	176.4	-146.3	74.9	0	0	0	111.5	L586 R590 E601 K607 K608 V609	L586-L605 HydrophobicContact CD2-CD1 3.97Å; R590-L605 HydrophobicContact CB-CD2 4.01Å; E601-L605 WeakPolarHBondContact O-CB 3.47Å; E601-L605 PolarHBondContact O-N 3.14Å; L605-K607 PolarHBondContact O-N 3.47Å; L605-K608 PolarHBondContact O-N 2.92Å; L605-V609 WeakPolarHBondContact O-CG2 3.22Å; L605-V609 PolarHBondContact O-N 3.2Å
606	K	86.6	Confident	82.2	Confident	97 Å²	97	86.4 Å²	86.4	42%	0.422	44%	0.437	S	S	.	.	H	α-helix	trans	-61.2	-41.6	172.8	-75.6	175.6	-162.1	156.4	0	112.5	A602 D603 E604 A610	A602-K606 WeakPolarHBondContact O-CG 3.34Å; A602-K606 PolarHBondContact O-N 3.28Å; D603-K606 IonicContact OD1-NZ 2.84Å; D603-K606 PolarHBondContact OD1-NZ 2.91Å; E604-K606 VanDerWaalsContact C-N 3.32Å; E604-K606 PolarHBondContact O-N 3.3Å; K606-A610 WeakPolarHBondContact O-CB 3.49Å; K606-A610 PolarHBondContact O-N 3.42Å
607	K	90.7	Very high	83.9	Confident	147 Å²	147	87.8 Å²	87.8	64%	0.639	43%	0.428	S	S	*	.	H	α-helix	trans	-63.4	-42.6	176.7	-74.4	175.4	-177.6	175.8	0	111.1	D603 E604 L605 A610 I611	D603-K607 WeakPolarHBondContact O-CG 3.41Å; D603-K607 PolarHBondContact O-N 2.79Å; D603-K607 VanDerWaalsContact O-N 3.13Å; E604-K607 WeakPolarHBondContact O-CB 3.27Å; E604-K607 PolarHBondContact O-N 2.99Å; E604-K607 VanDerWaalsContact O-N 3.14Å; L605-K607 PolarHBondContact O-N 3.47Å; K607-A610 PolarHBondContact O-N 3.43Å; K607-I611 WeakPolarHBondContact O-CG1 3.4Å; K607-I611 PolarHBondContact O-N 2.96Å
608	K	89.5	Confident	85.5	Confident	97 Å²	97	91 Å²	91	42%	0.422	44%	0.436	S	S	.	.	H	α-helix	trans	-61.8	-47.1	177	-70.8	178.1	-176.2	166.5	0	111.9	E604 L605 A610 I611 L612	E604-K608 PolarHBondContact O-N 3.34Å; E604-K608 VanDerWaalsContact OE1-CE 3.28Å; E604-K608 WeakPolarHBondContact OE1-CE 3.37Å; E604-K608 IonicContact OE1-NZ 2.88Å; E604-K608 PolarHBondContact OE1-NZ 2.93Å; L605-K608 PolarHBondContact O-N 2.92Å; K608-A610 VanDerWaalsContact C-N 3.34Å; K608-A610 PolarHBondContact O-N 3.09Å; K608-I611 PolarHBondContact O-N 3.35Å; K608-L612 WeakPolarHBondContact O-CG 3.45Å; K608-L612 PolarHBondContact O-N 3.08Å
609	V	89.9	Confident	86.6	Confident	18 Å²	18	84.8 Å²	84.8	11%	0.109	41%	0.412	C	S	.	.	H	α-helix	trans	-58.8	-44.2	175	172.1	0	0	0	0	111.5	I583 L586 L605 I611 L612 E613	I583-V609 HydrophobicContact CG2-CG1 4.43Å; L586-V609 HydrophobicContact CB-CG2 3.71Å; L586-V609 HydrophobicContact CD1-CG2 4.26Å; L605-V609 WeakPolarHBondContact O-CG2 3.22Å; L605-V609 PolarHBondContact O-N 3.2Å; V609-I611 VanDerWaalsContact C-N 3.32Å; V609-I611 PolarHBondContact O-N 3.33Å; V609-L612 PolarHBondContact O-N 3.2Å; V609-E613 HydrophobicContact CG1-CG 4.26Å; V609-E613 WeakPolarHBondContact O-CB 3.37Å; V609-E613 WeakPolarHBondContact O-CG 3.35Å; V609-E613 PolarHBondContact O-N 3.26Å
610	A	90.8	Very high	87.4	Confident	55 Å²	55	79.5 Å²	79.5	46%	0.455	39%	0.39	S	S	.	.	H	α-helix	trans	-64.2	-34.3	179.3	0	0	0	0	0	113.4	K606 K607 K608 C614	K606-A610 WeakPolarHBondContact O-CB 3.49Å; K606-A610 PolarHBondContact O-N 3.42Å; K607-A610 PolarHBondContact O-N 3.43Å; K608-A610 VanDerWaalsContact C-N 3.34Å; K608-A610 PolarHBondContact O-N 3.09Å; A610-C614 WeakPolarHBondContact O-CB 3.42Å; A610-C614 PolarHBondContact O-N 3.39Å; A610-C614 VanDerWaalsContact O-N 3.15Å
611	I	92.3	Very high	88	Confident	99 Å²	99	76.6 Å²	76.6	51%	0.508	38%	0.383	S	S	.	.	H	α-helix	trans	-69.2	-46	175.8	-68.3	165	0	0	0	110.4	K607 K608 V609 C614 Q615	K607-I611 WeakPolarHBondContact O-CG1 3.4Å; K607-I611 PolarHBondContact O-N 2.96Å; K608-I611 PolarHBondContact O-N 3.35Å; V609-I611 VanDerWaalsContact C-N 3.32Å; V609-I611 PolarHBondContact O-N 3.33Å; I611-C614 VanDerWaalsContact O-CB 3.28Å; I611-C614 WeakPolarHBondContact O-CB 3.46Å; I611-C614 PolarHBondContact O-N 2.84Å; I611-C614 VanDerWaalsContact O-N 3.13Å; I611-Q615 PolarHBondContact O-N 3.37Å
612	L	89.9	Confident	88.3	Confident	29 Å²	29	73 Å²	73	15%	0.152	37%	0.371	C	S	.	.	H	α-helix	trans	-64.8	-39.9	177.9	-67.5	170.7	0	0	0	111.9	L579 E582 I583 L586 K608 V609 C614 Q615 L616	L579-L612 HydrophobicContact CD2-CD2 3.76Å; E582-L612 HydrophobicContact CB-CD1 4.41Å; E582-L612 HydrophobicContact CG-CD1 3.59Å; I583-L612 HydrophobicContact CD1-CB 4.01Å; I583-L612 HydrophobicContact CG1-CB 3.66Å; I583-L612 HydrophobicContact CG1-CD1 4.39Å; L586-L612 HydrophobicContact CD1-CD1 3.47Å; L586-L612 VanDerWaalsContact CD1-CD1 3.47Å; K608-L612 WeakPolarHBondContact O-CG 3.45Å; K608-L612 PolarHBondContact O-N 3.08Å; V609-L612 PolarHBondContact O-N 3.2Å; L612-C614 PolarHBondContact O-N 2.98Å; L612-Q615 PolarHBondContact O-N 3.39Å; L612-Q615 VanDerWaalsContact O-N 3.17Å; L612-L616 WeakPolarHBondContact O-CB 3.49Å; L612-L616 PolarHBondContact O-N 3.03Å
613	E	90.4	Very high	88.6	Confident	73 Å²	73	72.8 Å²	72.8	34%	0.341	36%	0.363	S	S	.	.	H	α-helix	trans	-63.3	-28.7	173.1	-74.9	178.8	167.4	0	0	112.6	I583 K587 V609 R617	I583-E613 HydrophobicContact CD1-CG 3.89Å; I583-E613 HydrophobicContact CG1-CG 4.42Å; I583-E613 HydrophobicContact CG2-CG 4.35Å; K587-E613 WeakPolarHBondContact CE-OE1 3.33Å; K587-E613 IonicContact NZ-OE1 2.73Å; K587-E613 PolarHBondContact NZ-OE1 3.09Å; V609-E613 HydrophobicContact CG1-CG 4.26Å; V609-E613 WeakPolarHBondContact O-CB 3.37Å; V609-E613 WeakPolarHBondContact O-CG 3.35Å; V609-E613 PolarHBondContact O-N 3.26Å; E613-R617 WeakPolarHBondContact O-CG 3.45Å; E613-R617 PolarHBondContact O-N 3.28Å; E613-R617 PolarHBondContact O-NE 3.42Å
614	C	90.9	Very high	88.9	Confident	71 Å²	71	76.2 Å²	76.2	48%	0.48	38%	0.375	S	S	.	.	H	α-helix	trans	-71.7	-44.9	171.9	-169.5	0	0	0	0	111.6	A610 I611 L612 R617 K618	A610-C614 WeakPolarHBondContact O-CB 3.42Å; A610-C614 PolarHBondContact O-N 3.39Å; A610-C614 VanDerWaalsContact O-N 3.15Å; I611-C614 VanDerWaalsContact O-CB 3.28Å; I611-C614 WeakPolarHBondContact O-CB 3.46Å; I611-C614 PolarHBondContact O-N 2.84Å; I611-C614 VanDerWaalsContact O-N 3.13Å; L612-C614 PolarHBondContact O-N 2.98Å; C614-R617 PolarHBondContact O-N 3.29Å; C614-K618 PolarHBondContact O-N 3.47Å
615	Q	89.5	Confident	88.8	Confident	98 Å²	98	72.6 Å²	72.6	46%	0.458	36%	0.364	S	S	.	.	H	α-helix	trans	-65.2	-38.1	176.7	-72.2	179.7	-13.4	0	0	112.5	L579 I611 L612 K618 S619	L579-Q615 HydrophobicContact CD1-CB 4.26Å; L579-Q615 HydrophobicContact CD2-CB 4.46Å; I611-Q615 PolarHBondContact O-N 3.37Å; L612-Q615 PolarHBondContact O-N 3.39Å; L612-Q615 VanDerWaalsContact O-N 3.17Å; Q615-K618 PolarHBondContact O-N 2.73Å; Q615-S619 PolarHBondContact O-N 3.21Å; Q615-S619 PolarHBondContact O-OG 2.91Å
616	L	90.7	Very high	88.6	Confident	22 Å²	22	71.6 Å²	71.6	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-52.7	174.5	178.3	62.9	0	0	0	110.1	I576 L579 E580 I583 L612 K618 S619 E620	I576-L616 HydrophobicContact CB-CD1 4.22Å; I576-L616 HydrophobicContact CG1-CD1 4.23Å; I576-L616 HydrophobicContact CG2-CD1 3.87Å; L579-L616 HydrophobicContact CB-CB 4.32Å; L579-L616 HydrophobicContact CB-CD1 4.01Å; L579-L616 HydrophobicContact CD1-CB 4.3Å; L579-L616 HydrophobicContact CD1-CD1 4.5Å; E580-L616 HydrophobicContact CG-CD1 4.05Å; E580-L616 HydrophobicContact CG-CD2 4.11Å; I583-L616 HydrophobicContact CD1-CB 4.23Å; I583-L616 HydrophobicContact CD1-CD2 3.83Å; L612-L616 WeakPolarHBondContact O-CB 3.49Å; L612-L616 PolarHBondContact O-N 3.03Å; L616-K618 VanDerWaalsContact C-N 3.28Å; L616-K618 PolarHBondContact O-N 3.44Å; L616-S619 PolarHBondContact O-N 3.26Å; L616-S619 VanDerWaalsContact O-N 3.09Å; L616-E620 HydrophobicContact CD1-CG 4.26Å; L616-E620 HydrophobicContact CG-CG 4.4Å; L616-E620 WeakPolarHBondContact O-CG 3.26Å; L616-E620 PolarHBondContact O-N 2.82Å
617	R	90.6	Very high	88.4	Confident	157 Å²	157	70.4 Å²	70.4	59%	0.592	36%	0.355	S	S	*	.	H	α-helix	trans	-59.8	-36	177.1	-76	-171.6	-66.3	154.8	-1.9	113.3	E613 C614 T621	E613-R617 WeakPolarHBondContact O-CG 3.45Å; E613-R617 PolarHBondContact O-N 3.28Å; E613-R617 PolarHBondContact O-NE 3.42Å; C614-R617 PolarHBondContact O-N 3.29Å; R617-T621 WeakPolarHBondContact O-CB 3.3Å; R617-T621 PolarHBondContact O-N 3.49Å; R617-T621 VanDerWaalsContact O-N 3.07Å; R617-T621 PolarHBondContact O-OG1 2.95Å
618	K	90.3	Very high	88	Confident	131 Å²	131	69.3 Å²	69.3	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-63.3	-46.8	174.9	-170.1	-176	177.1	-169.7	0	110.5	C614 Q615 L616 T621 A622 T703	C614-K618 PolarHBondContact O-N 3.47Å; Q615-K618 PolarHBondContact O-N 2.73Å; L616-K618 VanDerWaalsContact C-N 3.28Å; L616-K618 PolarHBondContact O-N 3.44Å; K618-T621 PolarHBondContact O-N 3.04Å; K618-A622 PolarHBondContact O-N 3.48Å; K618-T703 PolarHBondContact NZ-OG1 3.38Å; K618-T703 VanDerWaalsContact NZ-OG1 3.14Å
619	S	87.1	Confident	87.7	Confident	19 Å²	19	65.1 Å²	65.1	13%	0.133	34%	0.336	C	S	.	.	H	α-helix	trans	-67.9	-42.1	-179.4	-52.6	0	0	0	0	112.3	Q615 L616 T621 A622 K623	Q615-S619 PolarHBondContact O-N 3.21Å; Q615-S619 PolarHBondContact O-OG 2.91Å; L616-S619 PolarHBondContact O-N 3.26Å; L616-S619 VanDerWaalsContact O-N 3.09Å; S619-T621 VanDerWaalsContact C-N 3.32Å; S619-T621 PolarHBondContact O-N 3.34Å; S619-A622 PolarHBondContact O-N 3.46Å; S619-K623 PolarHBondContact O-N 3.37Å
620	E	88.9	Confident	87.2	Confident	61 Å²	61	65.6 Å²	65.6	29%	0.285	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-39.5	173.4	-71.4	176.9	148.9	0	0	112.5	I576 L616 K624	I576-E620 HydrophobicContact CD1-CG 4.06Å; I576-E620 HydrophobicContact CG1-CG 4.23Å; L616-E620 HydrophobicContact CD1-CG 4.26Å; L616-E620 HydrophobicContact CG-CG 4.4Å; L616-E620 WeakPolarHBondContact O-CG 3.26Å; L616-E620 PolarHBondContact O-N 2.82Å; E620-K624 WeakPolarHBondContact O-CB 3.21Å; E620-K624 WeakPolarHBondContact O-CG 3.22Å; E620-K624 PolarHBondContact O-N 3.42Å
621	T	87.6	Confident	86.8	Confident	99 Å²	99	64.8 Å²	64.8	61%	0.607	34%	0.336	S	S	*	.	H	α-helix	trans	-69.4	-40.3	178.5	-56.3	0	0	0	0	110.9	R617 K618 S619 G625	R617-T621 WeakPolarHBondContact O-CB 3.3Å; R617-T621 PolarHBondContact O-N 3.49Å; R617-T621 VanDerWaalsContact O-N 3.07Å; R617-T621 PolarHBondContact O-OG1 2.95Å; K618-T621 PolarHBondContact O-N 3.04Å; S619-T621 VanDerWaalsContact C-N 3.32Å; S619-T621 PolarHBondContact O-N 3.34Å; T621-G625 PolarHBondContact O-N 3.02Å
622	A	85.6	Confident	86.4	Confident	25 Å²	25	64.3 Å²	64.3	21%	0.207	33%	0.33	C	S	.	.	H	α-helix	trans	-61.9	-50.1	174.6	0	0	0	0	0	111	Y572 K618 S619 K624 G625 F626	Y572-A622 HydrophobicContact CD1-CB 4.33Å; Y572-A622 HydrophobicContact CE1-CB 3.79Å; Y572-A622 HydrophobicContact CE2-CB 4.46Å; K618-A622 PolarHBondContact O-N 3.48Å; S619-A622 PolarHBondContact O-N 3.46Å; A622-K624 PolarHBondContact O-N 3.41Å; A622-G625 WeakPolarHBondContact O-CA 3.25Å; A622-G625 PolarHBondContact O-N 3.33Å; A622-F626 VanDerWaalsContact O-CD2 3.28Å; A622-F626 WeakPolarHBondContact O-CD2 3.46Å; A622-F626 PolarHBondContact O-N 3.04Å; A622-F626 VanDerWaalsContact O-N 3.1Å
623	K	86.9	Confident	86.1	Confident	29 Å²	29	66.3 Å²	66.3	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-55.2	-49.4	176.9	-167.9	-167.8	178.6	-144.4	0	112.2	E569 E573 I576 S619 G625 F626 E627	E569-K623 HydrophobicContact CG-CG 4.37Å; E573-K623 VanDerWaalsContact CD-NZ 3.27Å; E573-K623 IonicContact OE1-NZ 3.35Å; E573-K623 VanDerWaalsContact OE2-CD 3.24Å; E573-K623 WeakPolarHBondContact OE2-CD 3.45Å; E573-K623 WeakPolarHBondContact OE2-CE 3.47Å; E573-K623 IonicContact OE2-NZ 2.59Å; E573-K623 PolarHBondContact OE2-NZ 3.12Å; I576-K623 HydrophobicContact CD1-CB 4.2Å; I576-K623 HydrophobicContact CD1-CD 3.88Å; S619-K623 PolarHBondContact O-N 3.37Å; K623-G625 PolarHBondContact O-N 2.97Å; K623-F626 PolarHBondContact O-N 2.97Å; K623-F626 VanDerWaalsContact O-N 3.08Å; K623-E627 WeakPolarHBondContact CE-OE1 3Å; K623-E627 HydrophobicContact CG-CG 4.46Å; K623-E627 IonicContact NZ-OE1 3.81Å; K623-E627 PolarHBondContact NZ-OE1 3.42Å; K623-E627 PolarHBondContact O-N 2.92Å
624	K	86.8	Confident	85.5	Confident	135 Å²	135	66.8 Å²	66.8	59%	0.587	35%	0.346	S	S	*	.	H	α-helix	trans	-59.7	-34.2	176.7	-75.8	175.4	-178.4	169.1	0	112.6	E620 A622 M628	E620-K624 WeakPolarHBondContact O-CB 3.21Å; E620-K624 WeakPolarHBondContact O-CG 3.22Å; E620-K624 PolarHBondContact O-N 3.42Å; A622-K624 PolarHBondContact O-N 3.41Å; K624-M628 WeakPolarHBondContact O-CB 3.25Å; K624-M628 PolarHBondContact O-N 3.26Å
625	G	84.1	Confident	85	Confident	24 Å²	24	65.9 Å²	65.9	25%	0.247	34%	0.34	C	S	.	.	H	α-helix	trans	-62.8	-43.6	173.8	0	0	0	0	0	112.9	T621 A622 K623 S629	T621-G625 PolarHBondContact O-N 3.02Å; A622-G625 WeakPolarHBondContact O-CA 3.25Å; A622-G625 PolarHBondContact O-N 3.33Å; K623-G625 PolarHBondContact O-N 2.97Å; G625-S629 WeakPolarHBondContact O-CB 3.3Å; G625-S629 PolarHBondContact O-N 3.05Å; G625-S629 VanDerWaalsContact O-N 3.12Å; G625-S629 PolarHBondContact O-OG 2.81Å
626	F	81.4	Confident	84.8	Confident	18 Å²	18	63 Å²	63	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-67.6	-46.6	175	-78.2	-73.6	0	0	0	112.5	M568 Y572 A622 K623 M628 S629 T630 V696 D700	M568-F626 HydrophobicContact CE-CE1 4.11Å; M568-F626 HydrophobicContact CE-CE2 4.32Å; M568-F626 HydrophobicContact CE-CZ 3.64Å; Y572-F626 HydrophobicContact CD2-CD2 4.18Å; Y572-F626 HydrophobicContact CD2-CE2 4.34Å; Y572-F626 AromaticContact CE2-CD2 3.82Å; Y572-F626 HydrophobicContact CE2-CD2 3.82Å; Y572-F626 AromaticContact CE2-CE2 3.54Å; Y572-F626 HydrophobicContact CE2-CE2 3.54Å; Y572-F626 HydrophobicContact CE2-CZ 4.49Å; A622-F626 VanDerWaalsContact O-CD2 3.28Å; A622-F626 WeakPolarHBondContact O-CD2 3.46Å; A622-F626 PolarHBondContact O-N 3.04Å; A622-F626 VanDerWaalsContact O-N 3.1Å; K623-F626 PolarHBondContact O-N 2.97Å; K623-F626 VanDerWaalsContact O-N 3.08Å; F626-M628 PolarHBondContact O-N 3.33Å; F626-S629 PolarHBondContact O-N 3.16Å; F626-T630 WeakPolarHBondContact O-CB 3.41Å; F626-T630 PolarHBondContact O-N 3.32Å; F626-T630 PolarHBondContact O-OG1 2.97Å; F626-V696 HydrophobicContact CD1-CG1 3.81Å; F626-V696 HydrophobicContact CD2-CG1 4.14Å; F626-V696 HydrophobicContact CE1-CG1 3.54Å; F626-V696 HydrophobicContact CE2-CG1 3.86Å; F626-V696 HydrophobicContact CG-CG1 4.09Å; F626-V696 HydrophobicContact CZ-CG1 3.56Å; F626-D700 VanDerWaalsContact CZ-OD2 3.29Å; F626-D700 WeakPolarHBondContact CZ-OD2 3.47Å
627	E	82.6	Confident	84.2	Confident	72 Å²	72	65.6 Å²	65.6	34%	0.336	34%	0.343	S	S	.	.	H	α-helix	trans	-57.9	-49	176.6	-74.5	175.3	175.7	0	0	111.2	E569 K623 S629 T630 G631	E569-E627 HydrophobicContact CG-CG 4.3Å; K623-E627 WeakPolarHBondContact CE-OE1 3Å; K623-E627 HydrophobicContact CG-CG 4.46Å; K623-E627 IonicContact NZ-OE1 3.81Å; K623-E627 PolarHBondContact NZ-OE1 3.42Å; K623-E627 PolarHBondContact O-N 2.92Å; E627-S629 VanDerWaalsContact C-N 3.33Å; E627-S629 PolarHBondContact O-N 2.82Å; E627-T630 PolarHBondContact O-N 2.88Å; E627-G631 PolarHBondContact O-N 3.08Å
628	M	83.3	Confident	83.6	Confident	123 Å²	123	63.7 Å²	63.7	61%	0.606	34%	0.34	S	S	*	.	H	α-helix	trans	-62.8	-39	179.8	-167.9	93.9	-169.5	0	0	111.9	K624 F626 K632	K624-M628 WeakPolarHBondContact O-CB 3.25Å; K624-M628 PolarHBondContact O-N 3.26Å; F626-M628 PolarHBondContact O-N 3.33Å; M628-K632 VanDerWaalsContact O-CG 3.29Å; M628-K632 WeakPolarHBondContact O-CG 3.09Å; M628-K632 PolarHBondContact O-N 3.47Å
629	S	82.1	Confident	83.1	Confident	10 Å²	10	58.4 Å²	58.4	7%	0.07	32%	0.318	C	S	.	.	H	α-helix	trans	-72.4	-39.4	179.6	-61.4	0	0	0	0	112	G625 F626 E627 K632 L633 V696	G625-S629 WeakPolarHBondContact O-CB 3.3Å; G625-S629 PolarHBondContact O-N 3.05Å; G625-S629 VanDerWaalsContact O-N 3.12Å; G625-S629 PolarHBondContact O-OG 2.81Å; F626-S629 PolarHBondContact O-N 3.16Å; E627-S629 VanDerWaalsContact C-N 3.33Å; E627-S629 PolarHBondContact O-N 2.82Å; S629-K632 PolarHBondContact O-N 3.42Å; S629-L633 PolarHBondContact O-N 3.07Å; S629-V696 WeakPolarHBondContact OG-CG2 3.4Å
630	T	80.2	Confident	82.8	Confident	28 Å²	28	59.4 Å²	59.4	17%	0.172	32%	0.324	C	S	.	.	H	α-helix	trans	-66.6	-40.9	175.2	-54.1	0	0	0	0	111.2	F626 E627 L633 L634	F626-T630 WeakPolarHBondContact O-CB 3.41Å; F626-T630 PolarHBondContact O-N 3.32Å; F626-T630 PolarHBondContact O-OG1 2.97Å; E627-T630 PolarHBondContact O-N 2.88Å; T630-L633 WeakPolarHBondContact O-CB 3.46Å; T630-L633 PolarHBondContact O-N 2.99Å; T630-L634 WeakPolarHBondContact O-CG 3.43Å; T630-L634 PolarHBondContact O-N 2.98Å
631	G	81.5	Confident	82.1	Confident	38 Å²	38	62 Å²	62	39%	0.392	34%	0.336	S	S	.	.	H	α-helix	trans	-62.3	-43.6	174.3	0	0	0	0	0	113	E627 L633 L634 S635	E627-G631 PolarHBondContact O-N 3.08Å; G631-L633 VanDerWaalsContact C-N 3.33Å; G631-L633 PolarHBondContact O-N 3.28Å; G631-L634 PolarHBondContact O-N 3.12Å; G631-S635 PolarHBondContact O-N 2.7Å
632	K	84.2	Confident	81.4	Confident	88 Å²	88	60 Å²	60	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-63.4	-37.6	174.3	-72.8	175.8	-174	177	0	112.5	M628 S629 S635 F636 L689 S692	M628-K632 VanDerWaalsContact O-CG 3.29Å; M628-K632 WeakPolarHBondContact O-CG 3.09Å; M628-K632 PolarHBondContact O-N 3.47Å; S629-K632 PolarHBondContact O-N 3.42Å; K632-S635 PolarHBondContact O-N 3.06Å; K632-F636 WeakPolarHBondContact O-CB 3.28Å; K632-F636 PolarHBondContact O-N 3.37Å; K632-L689 HydrophobicContact CB-CD1 3.72Å; K632-S692 PolarHBondContact NZ-OG 3Å; K632-S692 VanDerWaalsContact NZ-OG 3.15Å
633	L	82.9	Confident	81	Confident	71 Å²	71	61.1 Å²	61.1	37%	0.372	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-45.2	176	176.4	64.3	0	0	0	111.4	S629 T630 G631 F636 V637 L689	S629-L633 PolarHBondContact O-N 3.07Å; T630-L633 WeakPolarHBondContact O-CB 3.46Å; T630-L633 PolarHBondContact O-N 2.99Å; G631-L633 VanDerWaalsContact C-N 3.33Å; G631-L633 PolarHBondContact O-N 3.28Å; L633-F636 PolarHBondContact O-N 3.38Å; L633-V637 WeakPolarHBondContact O-CG2 3.44Å; L633-V637 PolarHBondContact O-N 2.89Å; L633-L689 HydrophobicContact CB-CD1 4.21Å; L633-L689 HydrophobicContact CB-CD2 4.38Å; L633-L689 HydrophobicContact CD1-CD2 3.76Å
634	L	78.5	Confident	80.4	Confident	84 Å²	84	63.8 Å²	63.8	44%	0.44	34%	0.337	S	S	.	.	H	α-helix	trans	-62.4	-45.2	177	-71.4	170.7	0	0	0	111.7	T630 G631 F636 V637 E638	T630-L634 WeakPolarHBondContact O-CG 3.43Å; T630-L634 PolarHBondContact O-N 2.98Å; G631-L634 PolarHBondContact O-N 3.12Å; L634-F636 VanDerWaalsContact C-N 3.31Å; L634-F636 PolarHBondContact O-N 2.97Å; L634-V637 PolarHBondContact O-N 3.17Å; L634-V637 VanDerWaalsContact O-N 3.14Å; L634-E638 PolarHBondContact O-N 3.41Å
635	S	81.3	Confident	79.5	Confident	51 Å²	51	63.1 Å²	63.1	36%	0.357	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-40	176	-177.1	0	0	0	0	112.2	G631 K632 E638 N639	G631-S635 PolarHBondContact O-N 2.7Å; K632-S635 PolarHBondContact O-N 3.06Å; S635-E638 PolarHBondContact O-N 3.4Å; S635-N639 PolarHBondContact O-N 3.33Å; S635-N639 PolarHBondContact O-ND2 3.37Å; S635-N639 PolarHBondContact O-OD1 3.43Å
636	F	83.7	Confident	78.7	Confident	37 Å²	37	68.1 Å²	68.1	16%	0.162	36%	0.356	C	S	.	.	H	α-helix	trans	-63.5	-41.3	175	176.8	-102	0	0	0	111.9	K632 L633 L634 N639 V640 L682 E685 A686 L689	K632-F636 WeakPolarHBondContact O-CB 3.28Å; K632-F636 PolarHBondContact O-N 3.37Å; L633-F636 PolarHBondContact O-N 3.38Å; L634-F636 VanDerWaalsContact C-N 3.31Å; L634-F636 PolarHBondContact O-N 2.97Å; F636-N639 PolarHBondContact O-N 3.11Å; F636-V640 HydrophobicContact CD1-CG2 4.13Å; F636-V640 HydrophobicContact CE1-CG2 3.68Å; F636-V640 HydrophobicContact CE2-CG2 4.13Å; F636-V640 HydrophobicContact CZ-CG2 3.68Å; F636-V640 VanDerWaalsContact O-CG2 3.3Å; F636-V640 WeakPolarHBondContact O-CG2 3.48Å; F636-V640 PolarHBondContact O-N 3.35Å; F636-L682 HydrophobicContact CD2-CD1 4.21Å; F636-L682 HydrophobicContact CE2-CD1 3.61Å; F636-L682 HydrophobicContact CE2-CG 4.03Å; F636-L682 HydrophobicContact CZ-CD1 4.24Å; F636-L682 HydrophobicContact CZ-CG 4.38Å; F636-E685 HydrophobicContact CD2-CB 4.21Å; F636-E685 HydrophobicContact CD2-CG 3.93Å; F636-E685 HydrophobicContact CE2-CB 4.39Å; F636-A686 HydrophobicContact CE2-CB 3.8Å; F636-A686 HydrophobicContact CZ-CB 3.71Å; F636-L689 HydrophobicContact CB-CD2 3.89Å; F636-L689 HydrophobicContact CD1-CD2 3.96Å; F636-L689 HydrophobicContact CG-CD2 3.95Å
637	V	79.5	Confident	77.6	Confident	78 Å²	78	70.2 Å²	70.2	47%	0.473	37%	0.373	S	S	.	.	H	α-helix	trans	-62.2	-42.9	176.5	171	0	0	0	0	111.5	L633 L634 N639 V640 Q641	L633-V637 WeakPolarHBondContact O-CG2 3.44Å; L633-V637 PolarHBondContact O-N 2.89Å; L634-V637 PolarHBondContact O-N 3.17Å; L634-V637 VanDerWaalsContact O-N 3.14Å; V637-N639 VanDerWaalsContact C-N 3.34Å; V637-N639 PolarHBondContact O-N 3.38Å; V637-V640 PolarHBondContact O-N 3.36Å; V637-Q641 WeakPolarHBondContact O-CB 3.42Å; V637-Q641 PolarHBondContact O-N 3.1Å
638	E	77.7	Confident	75.7	Confident	117 Å²	117	74 Å²	74	55%	0.547	39%	0.39	S	S	.	.	H	α-helix	trans	-60.5	-42.8	174.2	-69.9	176.1	175.9	0	0	111.5	L634 S635 V640 Q641 D642	L634-E638 PolarHBondContact O-N 3.41Å; S635-E638 PolarHBondContact O-N 3.4Å; E638-V640 PolarHBondContact O-N 3.48Å; E638-Q641 PolarHBondContact O-N 3.21Å; E638-D642 WeakPolarHBondContact O-CB 3.29Å; E638-D642 PolarHBondContact O-N 2.96Å
639	N	79.9	Confident	73.5	Confident	20 Å²	20	70.1 Å²	70.1	11%	0.107	38%	0.382	C	S	.	.	H	α-helix	trans	-65.1	-39.1	177.5	-64.1	-24	0	0	0	112.4	S635 F636 V637 F643 W677 L682 E685	S635-N639 PolarHBondContact O-N 3.33Å; S635-N639 PolarHBondContact O-ND2 3.37Å; S635-N639 PolarHBondContact O-OD1 3.43Å; F636-N639 PolarHBondContact O-N 3.11Å; V637-N639 VanDerWaalsContact C-N 3.34Å; V637-N639 PolarHBondContact O-N 3.38Å; N639-F643 WeakPolarHBondContact O-CB 3.36Å; N639-F643 PolarHBondContact O-N 3.32Å; N639-W677 HydrophobicContact CB-CD2 4.32Å; N639-W677 HydrophobicContact CB-CE3 4.48Å; N639-W677 HydrophobicContact CB-CH2 4.14Å; N639-W677 HydrophobicContact CB-CZ2 3.94Å; N639-W677 HydrophobicContact CB-CZ3 4.4Å; N639-W677 WeakPolarHBondContact ND2-CH2 3.42Å; N639-W677 WeakPolarHBondContact ND2-CZ2 3.39Å; N639-W677 WeakPolarHBondContact OD1-CZ2 3.31Å; N639-L682 HydrophobicContact CB-CD1 4.5Å; N639-E685 PolarHBondContact ND2-OE1 3.36Å; N639-E685 PolarHBondContact ND2-OE2 2.86Å; N639-E685 VanDerWaalsContact ND2-OE2 3.13Å
640	V	81.4	Confident	71.2	Confident	40 Å²	40	75.8 Å²	75.8	24%	0.242	42%	0.418	C	S	.	.	H	α-helix	trans	-64.6	-43.6	174.1	174.2	0	0	0	0	110.6	F636 V637 E638 F643 L644 L682	F636-V640 HydrophobicContact CD1-CG2 4.13Å; F636-V640 HydrophobicContact CE1-CG2 3.68Å; F636-V640 HydrophobicContact CE2-CG2 4.13Å; F636-V640 HydrophobicContact CZ-CG2 3.68Å; F636-V640 VanDerWaalsContact O-CG2 3.3Å; F636-V640 WeakPolarHBondContact O-CG2 3.48Å; F636-V640 PolarHBondContact O-N 3.35Å; V637-V640 PolarHBondContact O-N 3.36Å; E638-V640 PolarHBondContact O-N 3.48Å; V640-F643 PolarHBondContact O-N 2.98Å; V640-L644 HydrophobicContact CG1-CD1 4.01Å; V640-L644 HydrophobicContact CG1-CG 4.36Å; V640-L644 WeakPolarHBondContact O-CG 3.42Å; V640-L644 PolarHBondContact O-N 3.01Å; V640-L682 HydrophobicContact CG2-CD1 3.79Å; V640-L682 HydrophobicContact CG2-CD2 4.15Å; V640-L682 HydrophobicContact CG2-CG 4.34Å
641	Q	72.4	Confident	68.8	Low	116 Å²	116	81 Å²	81	54%	0.542	45%	0.45	S	S	.	.	H	α-helix	trans	-62.3	-45.9	178.9	-176.1	176.8	8.2	0	0	111.4	V637 E638 F643 L644 L645	V637-Q641 WeakPolarHBondContact O-CB 3.42Å; V637-Q641 PolarHBondContact O-N 3.1Å; E638-Q641 PolarHBondContact O-N 3.21Å; Q641-F643 PolarHBondContact O-N 3.34Å; Q641-L644 PolarHBondContact O-N 2.63Å; Q641-L645 HydrophobicContact CG-CD1 3.95Å; Q641-L645 WeakPolarHBondContact O-CB 2.95Å; Q641-L645 WeakPolarHBondContact O-CD1 3.33Å; Q641-L645 WeakPolarHBondContact O-CG 3.3Å; Q641-L645 PolarHBondContact O-N 3Å
642	D	73.8	Confident	66.5	Low	56 Å²	56	88.6 Å²	88.6	30%	0.299	47%	0.472	S	S	.	.	H	α-helix	trans	-59.5	-44.3	174.3	-84	-2.1	0	0	0	111.3	E638 L645 E646 K674	E638-D642 WeakPolarHBondContact O-CB 3.29Å; E638-D642 PolarHBondContact O-N 2.96Å; D642-L645 PolarHBondContact O-N 3.04Å; D642-E646 WeakPolarHBondContact O-CB 3.44Å; D642-E646 PolarHBondContact O-N 2.67Å; D642-K674 IonicContact OD2-NZ 3.53Å; D642-K674 PolarHBondContact OD2-NZ 3.44Å
643	F	76.9	Confident	63.8	Low	48 Å²	48	90 Å²	90	21%	0.211	49%	0.494	C	S	.	.	H	α-helix	trans	-63.5	-41	177.9	177.1	-99.9	0	0	0	113.2	N639 V640 Q641 E646 S647 W677 A679 L682	N639-F643 WeakPolarHBondContact O-CB 3.36Å; N639-F643 PolarHBondContact O-N 3.32Å; V640-F643 PolarHBondContact O-N 2.98Å; Q641-F643 PolarHBondContact O-N 3.34Å; F643-E646 PolarHBondContact O-N 2.67Å; F643-S647 WeakPolarHBondContact O-CB 3.41Å; F643-S647 PolarHBondContact O-N 3.08Å; F643-S647 PolarHBondContact O-OG 3.12Å; F643-W677 HydrophobicContact CB-CB 4.49Å; F643-W677 HydrophobicContact CD2-CB 4.09Å; F643-W677 WeakPolarHBondContact CD2-O 3.49Å; F643-W677 VanDerWaalsContact CE2-O 3.23Å; F643-W677 WeakPolarHBondContact CE2-O 3.46Å; F643-A679 HydrophobicContact CZ-CB 4.5Å; F643-L682 HydrophobicContact CD1-CD2 4.14Å; F643-L682 HydrophobicContact CG-CD2 4.42Å
644	L	74.3	Confident	61.3	Low	86 Å²	86	97.7 Å²	97.7	45%	0.45	52%	0.519	S	S	.	.	H	α-helix	trans	-67.4	-41.8	176.4	-70.4	174.4	0	0	0	111.2	V640 Q641 E646 S647 H648	V640-L644 HydrophobicContact CG1-CD1 4.01Å; V640-L644 HydrophobicContact CG1-CG 4.36Å; V640-L644 WeakPolarHBondContact O-CG 3.42Å; V640-L644 PolarHBondContact O-N 3.01Å; Q641-L644 PolarHBondContact O-N 2.63Å; L644-E646 VanDerWaalsContact C-N 3.3Å; L644-E646 PolarHBondContact O-N 2.94Å; L644-S647 PolarHBondContact O-N 3.4Å; L644-H648 PolarHBondContact O-CD2 3.18Å; L644-H648 PolarHBondContact O-N 3.22Å
645	L	68.8	Low	58.9	Low	120 Å²	120	99.4 Å²	99.4	63%	0.628	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-37.4	175.7	-77.5	160	0	0	0	112.4	Q641 D642	Q641-L645 HydrophobicContact CG-CD1 3.95Å; Q641-L645 WeakPolarHBondContact O-CB 2.95Å; Q641-L645 WeakPolarHBondContact O-CD1 3.33Å; Q641-L645 WeakPolarHBondContact O-CG 3.3Å; Q641-L645 PolarHBondContact O-N 3Å; D642-L645 PolarHBondContact O-N 3.04Å
646	E	66.7	Low	56.5	Low	130 Å²	130	103 Å²	103	61%	0.607	56%	0.563	S	S	*	*	H	α-helix	trans	-75.3	-28.8	178	-159.9	168.4	-157.3	0	0	112.5	D642 F643 L644	D642-E646 WeakPolarHBondContact O-CB 3.44Å; D642-E646 PolarHBondContact O-N 2.67Å; F643-E646 PolarHBondContact O-N 2.67Å; L644-E646 VanDerWaalsContact C-N 3.3Å; L644-E646 PolarHBondContact O-N 2.94Å
647	S	57.7	Low	53.9	Low	62 Å²	62	104.7 Å²	104.7	43%	0.434	59%	0.592	S	S	.	*	H	α-helix	trans	-79.7	-18.7	178.8	-59.1	0	0	0	0	114.2	F643 L644	F643-S647 WeakPolarHBondContact O-CB 3.41Å; F643-S647 PolarHBondContact O-N 3.08Å; F643-S647 PolarHBondContact O-OG 3.12Å; L644-S647 PolarHBondContact O-N 3.4Å
648	H	43.5	Very low	51.5	Low	150 Å²	150	108.6 Å²	108.6	69%	0.694	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	36.3	-177	-68.5	-59	0	0	0	114.3	L644	L644-H648 PolarHBondContact O-CD2 3.18Å; L644-H648 PolarHBondContact O-N 3.22Å
649	G	35.6	Very low	49.2	Very low	42 Å²	42	108.9 Å²	108.9	43%	0.433	62%	0.619	S	S	.	*	S	Bend	trans	-66.6	153.4	159.2	0	0	0	0	0	111.2	T651	G649-T651 PolarHBondContact O-N 2.77Å
650	P	35.1	Very low	46.8	Very low	129 Å²	129	117.2 Å²	117.2	84%	0.838	65%	0.654	S	S	*	*			trans	-59.3	111.4	-169.7	23.8	-32	0	0	0	110.7	K652	P650-K652 PolarHBondContact O-N 2.7Å
651	T	29.7	Very low	44.5	Very low	138 Å²	138	120.2 Å²	120.2	85%	0.847	68%	0.684	S	S	*	*			trans	-64.5	96.1	175.6	47.5	0	0	0	0	109	G649 S653	G649-T651 PolarHBondContact O-N 2.77Å; T651-S653 PolarHBondContact O-N 2.91Å
652	K	32.1	Very low	42.3	Very low	197 Å²	197	118.5 Å²	118.5	86%	0.857	70%	0.697	S	S	*	*			trans	-72.8	122	164	-79.1	-178	176.7	179	0	108.5	P650	P650-K652 PolarHBondContact O-N 2.7Å
653	S	28.4	Very low	40.2	Very low	118 Å²	118	121.5 Å²	121.5	83%	0.825	72%	0.722	S	S	*	*			trans	-45.7	138.3	168.4	-177.2	0	0	0	0	112	T651 S655	T651-S653 PolarHBondContact O-N 2.91Å; S653-S655 PolarHBondContact O-N 2.86Å
654	Y	31.2	Very low	37.9	Very low	232 Å²	232	123.7 Å²	123.7	91%	0.91	74%	0.744	S	S	*	*			trans	-59.1	129.4	171.3	-86.3	-99.4	0	0	0	110.7
655	S	26.9	Very low	35.8	Very low	120 Å²	120	124.2 Å²	124.2	84%	0.839	75%	0.754	S	S	*	*			trans	-143.2	129.3	148.9	-170.3	0	0	0	0	109.6	S653	S653-S655 PolarHBondContact O-N 2.86Å
656	S	31.8	Very low	33.9	Very low	126 Å²	126	127.1 Å²	127.1	88%	0.881	77%	0.765	S	S	*	*			trans	-68.1	137.6	-177.8	-175.9	0	0	0	0	111.7
657	G	28.3	Very low	32	Very low	74 Å²	74	124.7 Å²	124.7	76%	0.763	77%	0.774	S	S	*	*			trans	173.8	116.3	173.2	0	0	0	0	0	112
658	D	28.3	Very low	30.6	Very low	160 Å²	160	127.9 Å²	127.9	86%	0.856	79%	0.791	S	S	*	*			trans	-81.8	171.8	-165.3	-149	-17.1	0	0	0	114.1
659	V	30.4	Very low	30.3	Very low	122 Å²	122	125.5 Å²	125.5	74%	0.739	79%	0.789	S	S	*	*			trans	104.3	96.1	158.7	-164.5	0	0	0	0	120
660	K	30.2	Very low	30.2	Very low	195 Å²	195	129.6 Å²	129.6	85%	0.848	81%	0.807	S	S	*	*				85.3	99.5	123.9	-154.3	171.7	-174.3	177.2	0	122.6
661	A	31.4	Very low	30.5	Very low	104 Å²	104	134.6 Å²	134.6	86%	0.86	81%	0.81	S	S	*	*			trans	18.1	130	134	0	0	0	0	0	122.1
662	G	27	Very low	30.8	Very low	79 Å²	79	138.6 Å²	138.6	81%	0.814	81%	0.811	S	S	*	*			trans	-161.4	113.8	150.8	0	0	0	0	0	111.7
663	S	30.3	Very low	31.2	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	82%	0.816	S	S	*	*			trans	-66.6	163.1	168.4	68.1	0	0	0	0	110.8
664	S	28.1	Very low	31.8	Very low	95 Å²	95	142.9 Å²	142.9	66%	0.664	81%	0.808	S	S	*	*			cis	-176.3	148	39.3	53.4	0	0	0	0	110.3
665	S	29.9	Very low	32.7	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	79%	0.794	S	S	*	*			trans	42.4	146.5	135.2	73	0	0	0	0	121.8
666	H	29.3	Very low	34.2	Very low	182 Å²	182	134.6 Å²	134.6	84%	0.843	78%	0.781	S	S	*	*			cis	-164.6	150.3	19.3	-110.2	-59.3	0	0	0	109.2
667	G	26.4	Very low	35.6	Very low	79 Å²	79	131.7 Å²	131.7	81%	0.814	75%	0.751	S	S	*	*			trans	169.2	110.2	161.2	0	0	0	0	0	112.9
668	V	28.2	Very low	37.9	Very low	128 Å²	128	131.6 Å²	131.6	78%	0.776	74%	0.736	S	S	*	*			trans	-124.9	158.4	-168.1	177.7	0	0	0	0	108.6
669	P	38.3	Very low	40	Very low	101 Å²	101	127.1 Å²	127.1	66%	0.656	72%	0.721	S	S	*	*			cis	-125.4	-174.6	-30.3	35.6	-18.2	0	0	0	112.5
670	P	32.8	Very low	42.2	Very low	127 Å²	127	124.8 Å²	124.8	83%	0.825	72%	0.715	S	S	*	*				-123.3	141.1	123.5	33.8	-26.4	0	0	0	111.8	Y672	P670-Y672 PolarHBondContact O-N 3.1Å; P670-Y672 VanDerWaalsContact O-N 3.07Å
671	R	41.5	Very low	44.6	Very low	234 Å²	234	118.5 Å²	118.5	88%	0.883	69%	0.693	S	S	*	*			trans	-66	100.9	-179.9	-73.1	176	172.5	162.7	-3.1	111
672	Y	35.2	Very low	47	Very low	222 Å²	222	114.7 Å²	114.7	87%	0.871	66%	0.658	S	S	*	*			trans	-143.6	102.5	141.5	-91.8	-85.9	0	0	0	106.5	P670 K674	P670-Y672 PolarHBondContact O-N 3.1Å; P670-Y672 VanDerWaalsContact O-N 3.07Å; Y672-K674 PolarHBondContact O-N 3.29Å; Y672-K674 VanDerWaalsContact O-N 3.09Å
673	R	41.5	Very low	49.3	Very low	257 Å²	257	113.2 Å²	113.2	97%	0.97	64%	0.638	S	S	*	*			trans	-71.6	98.2	164.3	-84.7	-152.5	-166.3	-162	8	106.9
674	K	40.8	Very low	51.7	Low	148 Å²	148	111.7 Å²	111.7	64%	0.643	62%	0.618	S	S	*	*			trans	-102.9	114	146.2	-79.6	-170.7	172.5	-170.1	0	105.7	D642 Y672	D642-K674 IonicContact OD2-NZ 3.53Å; D642-K674 PolarHBondContact OD2-NZ 3.44Å; Y672-K674 PolarHBondContact O-N 3.29Å; Y672-K674 VanDerWaalsContact O-N 3.09Å
675	S	50	Low	54.2	Low	90 Å²	90	109.3 Å²	109.3	63%	0.629	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-59.6	139.1	167.9	-177.5	0	0	0	0	107.3	W677	S675-W677 PolarHBondContact O-N 3.26Å
676	P	58.9	Low	56.7	Low	88 Å²	88	106.2 Å²	106.2	57%	0.571	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-58.1	119.3	167.3	-15	27.7	0	0	0	106.8	T678	P676-T678 PolarHBondContact O-N 3.29Å
677	W	60.4	Low	59.1	Low	66 Å²	66	103.7 Å²	103.7	25%	0.25	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-67.4	122.8	173.4	-74.5	88.1	0	0	0	107.1	N639 F643 S675 L682 E685	N639-W677 HydrophobicContact CB-CD2 4.32Å; N639-W677 HydrophobicContact CB-CE3 4.48Å; N639-W677 HydrophobicContact CB-CH2 4.14Å; N639-W677 HydrophobicContact CB-CZ2 3.94Å; N639-W677 HydrophobicContact CB-CZ3 4.4Å; N639-W677 WeakPolarHBondContact ND2-CH2 3.42Å; N639-W677 WeakPolarHBondContact ND2-CZ2 3.39Å; N639-W677 WeakPolarHBondContact OD1-CZ2 3.31Å; F643-W677 HydrophobicContact CB-CB 4.49Å; F643-W677 HydrophobicContact CD2-CB 4.09Å; F643-W677 WeakPolarHBondContact CD2-O 3.49Å; F643-W677 VanDerWaalsContact CE2-O 3.23Å; F643-W677 WeakPolarHBondContact CE2-O 3.46Å; S675-W677 PolarHBondContact O-N 3.26Å; W677-L682 HydrophobicContact CE3-CD1 4.45Å; W677-E685 WeakPolarHBondContact CH2-OE2 3.36Å; W677-E685 WeakPolarHBondContact CZ3-OE2 3.45Å
678	T	76.4	Confident	61.7	Low	71 Å²	71	104.6 Å²	104.6	44%	0.436	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-93.2	154	172	64	0	0	0	0	109.4	P676 A680 T681 L682	P676-T678 PolarHBondContact O-N 3.29Å; T678-A680 PolarHBondContact O-N 3.48Å; T678-A680 VanDerWaalsContact O-N 3.08Å; T678-T681 PolarHBondContact N-OG1 2.91Å; T678-T681 PolarHBondContact O-N 3.36Å; T678-T681 PolarHBondContact O-OG1 3.34Å; T678-T681 WeakPolarHBondContact OG1-CG2 3.5Å; T678-T681 PolarHBondContact OG1-N 2.94Å; T678-T681 PolarHBondContact OG1-OG1 3.22Å; T678-L682 PolarHBondContact O-N 2.95Å
679	A	73.8	Confident	64.3	Low	67 Å²	67	99.4 Å²	99.4	55%	0.554	51%	0.513	S	S	*	.	H	α-helix	trans	-53.8	-31.6	173.5	0	0	0	0	0	112.3	F643 A683	F643-A679 HydrophobicContact CZ-CB 4.5Å; A679-A683 VanDerWaalsContact O-CB 3.28Å; A679-A683 WeakPolarHBondContact O-CB 3.42Å; A679-A683 PolarHBondContact O-N 2.91Å
680	A	75.4	Confident	66.2	Low	72 Å²	72	98.3 Å²	98.3	60%	0.595	51%	0.505	S	S	*	.	H	α-helix	trans	-70.1	-42.1	176.1	0	0	0	0	0	113.1	T678 A683 Q684	T678-A680 PolarHBondContact O-N 3.48Å; T678-A680 VanDerWaalsContact O-N 3.08Å; A680-A683 PolarHBondContact O-N 3.45Å; A680-Q684 WeakPolarHBondContact O-CB 3.47Å; A680-Q684 PolarHBondContact O-N 3.46Å
681	T	80	Confident	68.4	Low	63 Å²	63	99.2 Å²	99.2	39%	0.387	49%	0.492	S	S	.	.	H	α-helix	trans	-68.2	-38.7	176.3	48	0	0	0	0	111.5	T678 Q684 E685	T678-T681 PolarHBondContact N-OG1 2.91Å; T678-T681 PolarHBondContact O-N 3.36Å; T678-T681 PolarHBondContact O-OG1 3.34Å; T678-T681 WeakPolarHBondContact OG1-CG2 3.5Å; T678-T681 PolarHBondContact OG1-N 2.94Å; T678-T681 PolarHBondContact OG1-OG1 3.22Å; T681-Q684 PolarHBondContact O-N 3.04Å; T681-E685 PolarHBondContact O-N 3.11Å
682	L	81.8	Confident	70.1	Confident	24 Å²	24	89.2 Å²	89.2	13%	0.126	46%	0.458	C	S	.	.	H	α-helix	trans	-65.8	-42	176.2	-168.5	68.8	0	0	0	111.7	F636 N639 V640 F643 W677 T678 Q684 E685 A686	F636-L682 HydrophobicContact CD2-CD1 4.21Å; F636-L682 HydrophobicContact CE2-CD1 3.61Å; F636-L682 HydrophobicContact CE2-CG 4.03Å; F636-L682 HydrophobicContact CZ-CD1 4.24Å; F636-L682 HydrophobicContact CZ-CG 4.38Å; N639-L682 HydrophobicContact CB-CD1 4.5Å; V640-L682 HydrophobicContact CG2-CD1 3.79Å; V640-L682 HydrophobicContact CG2-CD2 4.15Å; V640-L682 HydrophobicContact CG2-CG 4.34Å; F643-L682 HydrophobicContact CD1-CD2 4.14Å; F643-L682 HydrophobicContact CG-CD2 4.42Å; W677-L682 HydrophobicContact CE3-CD1 4.45Å; T678-L682 PolarHBondContact O-N 2.95Å; L682-Q684 VanDerWaalsContact C-N 3.3Å; L682-Q684 PolarHBondContact O-N 3.4Å; L682-E685 PolarHBondContact O-N 3.43Å; L682-A686 WeakPolarHBondContact O-CB 3.33Å; L682-A686 PolarHBondContact O-N 2.87Å
683	A	76	Confident	72	Confident	49 Å²	49	81.3 Å²	81.3	41%	0.405	43%	0.433	S	S	.	.	H	α-helix	trans	-64.7	-33.6	175.1	0	0	0	0	0	112.7	A679 A680 K687	A679-A683 VanDerWaalsContact O-CB 3.28Å; A679-A683 WeakPolarHBondContact O-CB 3.42Å; A679-A683 PolarHBondContact O-N 2.91Å; A680-A683 PolarHBondContact O-N 3.45Å; A683-K687 WeakPolarHBondContact O-CG 3.4Å; A683-K687 PolarHBondContact O-N 3.06Å
684	Q	80.1	Confident	73.6	Confident	87 Å²	87	76.1 Å²	76.1	41%	0.407	41%	0.413	S	S	.	.	H	α-helix	trans	-70.1	-43.8	175.5	-176.8	62.1	19.1	0	0	111.5	A680 T681 L682 A686 K687 E688	A680-Q684 WeakPolarHBondContact O-CB 3.47Å; A680-Q684 PolarHBondContact O-N 3.46Å; T681-Q684 PolarHBondContact O-N 3.04Å; L682-Q684 VanDerWaalsContact C-N 3.3Å; L682-Q684 PolarHBondContact O-N 3.4Å; Q684-A686 PolarHBondContact O-N 3.47Å; Q684-K687 WeakPolarHBondContact O-CB 3.36Å; Q684-K687 PolarHBondContact O-N 3.2Å; Q684-E688 PolarHBondContact NE2-OE1 3.13Å; Q684-E688 PolarHBondContact O-N 3.08Å
685	E	82.2	Confident	75.1	Confident	45 Å²	45	71.7 Å²	71.7	21%	0.21	40%	0.404	C	S	.	.	H	α-helix	trans	-62.3	-42.1	175.5	-167.6	178.1	-152.8	0	0	111.5	F636 N639 W677 T681 L682 K687 E688 L689	F636-E685 HydrophobicContact CD2-CB 4.21Å; F636-E685 HydrophobicContact CD2-CG 3.93Å; F636-E685 HydrophobicContact CE2-CB 4.39Å; N639-E685 PolarHBondContact ND2-OE1 3.36Å; N639-E685 PolarHBondContact ND2-OE2 2.86Å; N639-E685 VanDerWaalsContact ND2-OE2 3.13Å; W677-E685 WeakPolarHBondContact CH2-OE2 3.36Å; W677-E685 WeakPolarHBondContact CZ3-OE2 3.45Å; T681-E685 PolarHBondContact O-N 3.11Å; L682-E685 PolarHBondContact O-N 3.43Å; E685-K687 VanDerWaalsContact C-N 3.3Å; E685-K687 PolarHBondContact O-N 3.26Å; E685-E688 PolarHBondContact O-N 3.02Å; E685-E688 VanDerWaalsContact O-N 3.11Å; E685-L689 WeakPolarHBondContact O-CB 3.16Å; E685-L689 PolarHBondContact O-N 2.92Å
686	A	81	Confident	75.9	Confident	30 Å²	30	68.5 Å²	68.5	25%	0.248	38%	0.381	C	S	.	.	H	α-helix	trans	-58.5	-39.7	174.4	0	0	0	0	0	112.7	F636 L682 Q684 T690	F636-A686 HydrophobicContact CE2-CB 3.8Å; F636-A686 HydrophobicContact CZ-CB 3.71Å; L682-A686 WeakPolarHBondContact O-CB 3.33Å; L682-A686 PolarHBondContact O-N 2.87Å; Q684-A686 PolarHBondContact O-N 3.47Å; A686-T690 WeakPolarHBondContact O-CB 3.45Å; A686-T690 PolarHBondContact O-N 2.76Å; A686-T690 PolarHBondContact O-OG1 3.49Å
687	K	79.3	Confident	76.1	Confident	129 Å²	129	69.2 Å²	69.2	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-67.7	-36.2	175.7	-75.3	174.7	-177.3	176.8	0	112.5	A683 Q684 E685 R691	A683-K687 WeakPolarHBondContact O-CG 3.4Å; A683-K687 PolarHBondContact O-N 3.06Å; Q684-K687 WeakPolarHBondContact O-CB 3.36Å; Q684-K687 PolarHBondContact O-N 3.2Å; E685-K687 VanDerWaalsContact C-N 3.3Å; E685-K687 PolarHBondContact O-N 3.26Å; K687-R691 PolarHBondContact O-N 2.94Å; K687-R691 VanDerWaalsContact O-N 3.17Å
688	E	81.9	Confident	76.1	Confident	98 Å²	98	71.6 Å²	71.6	46%	0.458	39%	0.393	S	S	.	.	H	α-helix	trans	-71.7	-41.6	177.3	-74.4	175.3	-166.5	0	0	111.7	Q684 E685 R691 S692	Q684-E688 PolarHBondContact NE2-OE1 3.13Å; Q684-E688 PolarHBondContact O-N 3.08Å; E685-E688 PolarHBondContact O-N 3.02Å; E685-E688 VanDerWaalsContact O-N 3.11Å; E688-R691 PolarHBondContact O-N 2.95Å; E688-S692 PolarHBondContact O-N 3.47Å
689	L	83.4	Confident	75	Confident	19 Å²	19	73 Å²	73	10%	0.099	40%	0.401	C	S	.	.	H	α-helix	trans	-60.1	-46.6	172.8	179.9	62.9	0	0	0	111.5	K632 L633 F636 E685 R691 S692 V693	K632-L689 HydrophobicContact CB-CD1 3.72Å; L633-L689 HydrophobicContact CB-CD1 4.21Å; L633-L689 HydrophobicContact CB-CD2 4.38Å; L633-L689 HydrophobicContact CD1-CD2 3.76Å; F636-L689 HydrophobicContact CB-CD2 3.89Å; F636-L689 HydrophobicContact CD1-CD2 3.96Å; F636-L689 HydrophobicContact CG-CD2 3.95Å; E685-L689 WeakPolarHBondContact O-CB 3.16Å; E685-L689 PolarHBondContact O-N 2.92Å; L689-R691 VanDerWaalsContact C-N 3.28Å; L689-R691 PolarHBondContact O-N 2.92Å; L689-S692 WeakPolarHBondContact O-CB 3.41Å; L689-S692 PolarHBondContact O-N 3.12Å; L689-V693 HydrophobicContact CD1-CG2 4.26Å; L689-V693 WeakPolarHBondContact O-CG2 3.42Å; L689-V693 PolarHBondContact O-N 3.24Å
690	T	78.4	Confident	73.7	Confident	79 Å²	79	72.5 Å²	72.5	49%	0.485	39%	0.39	S	S	.	.	H	α-helix	trans	-58.9	-40.1	177	-57.3	0	0	0	0	111.7	A686 R694	A686-T690 WeakPolarHBondContact O-CB 3.45Å; A686-T690 PolarHBondContact O-N 2.76Å; A686-T690 PolarHBondContact O-OG1 3.49Å; T690-R694 VanDerWaalsContact O-CB 3.28Å; T690-R694 WeakPolarHBondContact O-CB 3.41Å; T690-R694 PolarHBondContact O-N 3.36Å
691	R	78.8	Confident	71.9	Confident	145 Å²	145	76 Å²	76	55%	0.547	40%	0.398	S	S	.	.	H	α-helix	trans	-65.1	-42.3	173.6	-94.6	-179.1	-78.3	127.2	-3.4	112.3	K687 E688 L689 R694 A695	K687-R691 PolarHBondContact O-N 2.94Å; K687-R691 VanDerWaalsContact O-N 3.17Å; E688-R691 PolarHBondContact O-N 2.95Å; L689-R691 VanDerWaalsContact C-N 3.28Å; L689-R691 PolarHBondContact O-N 2.92Å; R691-R694 PolarHBondContact O-N 3.14Å; R691-A695 WeakPolarHBondContact O-CB 3.49Å; R691-A695 PolarHBondContact O-N 3.07Å
692	S	76.9	Confident	69.9	Low	24 Å²	24	79.7 Å²	79.7	17%	0.168	41%	0.414	C	S	.	.	H	α-helix	trans	-62.8	-46.1	178.7	-162.2	0	0	0	0	111.6	K632 E688 L689 A695 V696	K632-S692 PolarHBondContact NZ-OG 3Å; K632-S692 VanDerWaalsContact NZ-OG 3.15Å; E688-S692 PolarHBondContact O-N 3.47Å; L689-S692 WeakPolarHBondContact O-CB 3.41Å; L689-S692 PolarHBondContact O-N 3.12Å; S692-A695 PolarHBondContact O-N 3.33Å; S692-V696 PolarHBondContact O-N 3.37Å
693	V	75	Confident	67.9	Low	57 Å²	57	83.1 Å²	83.1	35%	0.345	44%	0.437	S	S	.	.	H	α-helix	trans	-66.8	-42	178.7	174.7	0	0	0	0	111.1	L689 A695 V696 L697	L689-V693 HydrophobicContact CD1-CG2 4.26Å; L689-V693 WeakPolarHBondContact O-CG2 3.42Å; L689-V693 PolarHBondContact O-N 3.24Å; V693-A695 VanDerWaalsContact C-N 3.33Å; V693-A695 PolarHBondContact O-N 3.48Å; V693-V696 PolarHBondContact O-N 3.33Å; V693-L697 HydrophobicContact CG1-CD1 4.08Å; V693-L697 WeakPolarHBondContact O-CG 3.41Å; V693-L697 PolarHBondContact O-N 2.99Å; V693-L697 VanDerWaalsContact O-N 3.09Å
694	R	74.6	Confident	65.9	Low	147 Å²	147	94.4 Å²	94.4	56%	0.555	48%	0.477	S	S	*	.	H	α-helix	trans	-60.9	-41.2	176.1	-174.4	-179.4	-61.3	-165	-1.9	112.2	T690 R691 V696 L697 E698	T690-R694 VanDerWaalsContact O-CB 3.28Å; T690-R694 WeakPolarHBondContact O-CB 3.41Å; T690-R694 PolarHBondContact O-N 3.36Å; R691-R694 PolarHBondContact O-N 3.14Å; R694-V696 VanDerWaalsContact C-N 3.26Å; R694-V696 PolarHBondContact O-N 2.99Å; R694-L697 PolarHBondContact O-N 3.49Å; R694-E698 WeakPolarHBondContact CD-OE1 3.22Å; R694-E698 HydrophobicContact CG-CG 4.14Å; R694-E698 WeakPolarHBondContact CG-OE1 3.4Å; R694-E698 WeakPolarHBondContact O-CB 3.49Å; R694-E698 WeakPolarHBondContact O-CG 3.36Å; R694-E698 PolarHBondContact O-N 2.93Å
695	A	72.4	Confident	65.2	Low	55 Å²	55	94.8 Å²	94.8	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-63.2	-31.1	178.3	0	0	0	0	0	112.9	R691 S692 V693 V699	R691-A695 WeakPolarHBondContact O-CB 3.49Å; R691-A695 PolarHBondContact O-N 3.07Å; S692-A695 PolarHBondContact O-N 3.33Å; V693-A695 VanDerWaalsContact C-N 3.33Å; V693-A695 PolarHBondContact O-N 3.48Å; A695-V699 WeakPolarHBondContact O-CG2 3.38Å
696	V	67.8	Low	64.3	Low	24 Å²	24	97.4 Å²	97.4	15%	0.145	50%	0.495	C	S	.	.	H	α-helix	trans	-73.9	-43.3	174	177.2	0	0	0	0	111	F626 S629 S692 V693 R694 E698 V699	F626-V696 HydrophobicContact CD1-CG1 3.81Å; F626-V696 HydrophobicContact CD2-CG1 4.14Å; F626-V696 HydrophobicContact CE1-CG1 3.54Å; F626-V696 HydrophobicContact CE2-CG1 3.86Å; F626-V696 HydrophobicContact CG-CG1 4.09Å; F626-V696 HydrophobicContact CZ-CG1 3.56Å; S629-V696 WeakPolarHBondContact OG-CG2 3.4Å; S692-V696 PolarHBondContact O-N 3.37Å; V693-V696 PolarHBondContact O-N 3.33Å; R694-V696 VanDerWaalsContact C-N 3.26Å; R694-V696 PolarHBondContact O-N 2.99Å; V696-E698 PolarHBondContact O-N 3.44Å; V696-V699 PolarHBondContact O-N 2.99Å
697	L	62.7	Low	63.4	Low	102 Å²	102	101.1 Å²	101.1	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-67.8	-32	178.8	-67.5	173.3	0	0	0	113.5	V693 R694 V699	V693-L697 HydrophobicContact CG1-CD1 4.08Å; V693-L697 WeakPolarHBondContact O-CG 3.41Å; V693-L697 PolarHBondContact O-N 2.99Å; V693-L697 VanDerWaalsContact O-N 3.09Å; R694-L697 PolarHBondContact O-N 3.49Å; L697-V699 VanDerWaalsContact C-N 3.33Å
698	E	59.6	Low	62.4	Low	116 Å²	116	99.5 Å²	99.5	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-74.9	-20.8	177.4	-77	178.1	-177.2	0	0	112.9	R694 V696	R694-E698 WeakPolarHBondContact CD-OE1 3.22Å; R694-E698 HydrophobicContact CG-CG 4.14Å; R694-E698 WeakPolarHBondContact CG-OE1 3.4Å; R694-E698 WeakPolarHBondContact O-CB 3.49Å; R694-E698 WeakPolarHBondContact O-CG 3.36Å; R694-E698 PolarHBondContact O-N 2.93Å; V696-E698 PolarHBondContact O-N 3.44Å
699	V	53.6	Low	61.2	Low	100 Å²	100	99.6 Å²	99.6	61%	0.606	51%	0.508	S	S	*	.	H	α-helix	trans	-76.5	-29.3	175.3	171.9	0	0	0	0	111.6	A695 V696 L697	A695-V699 WeakPolarHBondContact O-CG2 3.38Å; V696-V699 PolarHBondContact O-N 2.99Å; L697-V699 VanDerWaalsContact C-N 3.33Å
700	D	46.9	Very low	59.7	Low	58 Å²	58	104.9 Å²	104.9	31%	0.31	54%	0.535	S	S	.	.	H	α-helix	trans	-86.7	-13.1	179.8	-76.8	-14.3	0	0	0	114.2	F626 L702	F626-D700 VanDerWaalsContact CZ-OD2 3.29Å; F626-D700 WeakPolarHBondContact CZ-OD2 3.47Å; D700-L702 PolarHBondContact O-N 2.8Å
701	L	37.6	Very low	58.4	Low	146 Å²	146	106.8 Å²	106.8	76%	0.764	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-2.4	174	-81.7	166.5	0	0	0	113.9
702	L	38.7	Very low	56.8	Low	139 Å²	139	103.8 Å²	103.8	73%	0.728	54%	0.538	S	S	*	.	S	Bend	trans	-127.4	69.9	175.9	-70.8	170.9	0	0	0	109.8	D700	D700-L702 PolarHBondContact O-N 2.8Å
703	T	39	Very low	55.1	Low	97 Å²	97	110.5 Å²	110.5	60%	0.595	57%	0.569	S	S	*	*			trans	165.6	93.6	136.3	33.6	0	0	0	0	110.7	K618	K618-T703 PolarHBondContact NZ-OG1 3.38Å; K618-T703 VanDerWaalsContact NZ-OG1 3.14Å
704	F	33.9	Very low	53.3	Low	285 Å²	285	115.4 Å²	115.4	100%	1.25	59%	0.589	S	S	*	*			trans	-120	0	142.3	-88.2	-78	0	0	0	108

Retrieved 704 of 704 residues in 1596.7 ms (Link to these results)

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