A0A087XNQ8_POEFO Loading...

Protein KRI1 homolog

AlphaFold DB , UniProt , Accession A0A087XNQ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 749 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	48.8	Very low	68.2	Low	235 Å²	235	149.5 Å²	149.5	100%	1.158	80%	0.797	S	S	*	*				0	96	0	-63.6	-55.3	-170.6	0	0	109.6
2	P	49.7	Very low	69.9	Low	128 Å²	128	147.8 Å²	147.8	83%	0.831	78%	0.78	S	S	*	*			trans	-89.3	126.1	163.3	31.8	-21.6	0	0	0	108.6
3	G	57.3	Low	71.5	Confident	77 Å²	77	147.2 Å²	147.2	79%	0.794	77%	0.767	S	S	*	*			trans	-61.8	135.9	-177.4	0	0	0	0	0	112.4	S5	G3-S5 PolarHBondContact O-N 3.26Å; G3-S5 VanDerWaalsContact O-N 3.11Å
4	R	51.4	Low	72.7	Confident	250 Å²	250	139.1 Å²	139.1	94%	0.943	73%	0.733	S	S	*	*			trans	-62	109.1	168.5	-79.6	177	172.1	173.2	-2.7	108.2	E6	R4-E6 PolarHBondContact O-N 3.07Å
5	S	65.8	Low	73.7	Confident	105 Å²	105	137.6 Å²	137.6	73%	0.734	72%	0.72	S	S	*	*			trans	-70.1	110.3	165.2	53.4	0	0	0	0	108.5	G3 L7	G3-S5 PolarHBondContact O-N 3.26Å; G3-S5 VanDerWaalsContact O-N 3.11Å; S5-L7 PolarHBondContact O-N 3.33Å
6	E	67.1	Low	74.6	Confident	172 Å²	172	138.4 Å²	138.4	80%	0.804	72%	0.716	S	S	*	*			trans	-65.7	118.7	173.1	-68.1	172.6	179.2	0	0	109.9	R4 K8	R4-E6 PolarHBondContact O-N 3.07Å; E6-K8 PolarHBondContact O-N 3.2Å; E6-K8 VanDerWaalsContact O-N 3.13Å
7	L	76.6	Confident	75.6	Confident	160 Å²	160	137.7 Å²	137.7	84%	0.838	70%	0.703	S	S	*	*			trans	-69.4	106	175.1	-68.2	166.6	0	0	0	108.9	S5 I9	S5-L7 PolarHBondContact O-N 3.33Å; L7-I9 PolarHBondContact O-N 3.18Å
8	K	76.9	Confident	76.3	Confident	199 Å²	199	136.1 Å²	136.1	87%	0.865	69%	0.693	S	S	*	*			trans	-78.5	104.4	170.2	-76.3	-178.4	178.5	179.4	0	109.4	E6	E6-K8 PolarHBondContact O-N 3.2Å; E6-K8 VanDerWaalsContact O-N 3.13Å
9	I	82.3	Confident	76.8	Confident	146 Å²	146	134.4 Å²	134.4	75%	0.749	68%	0.68	S	S	*	*			trans	-73.6	134.1	172.5	-62.3	165.7	0	0	0	108.3	L7 S11	L7-I9 PolarHBondContact O-N 3.18Å; I9-S11 PolarHBondContact O-N 3.13Å
10	N	88.2	Confident	77.5	Confident	99 Å²	99	135.5 Å²	135.5	53%	0.529	68%	0.676	S	S	.	*			trans	-72	95.8	174.9	-174.9	-13.1	0	0	0	109.8	Q12 F13 A14	N10-Q12 VanDerWaalsContact C-N 3.26Å; N10-Q12 PolarHBondContact O-N 3.44Å; N10-Q12 WeakPolarHBondContact OD1-CB 3.27Å; N10-Q12 PolarHBondContact OD1-N 3.18Å; N10-Q12 VanDerWaalsContact OD1-N 3.15Å; N10-F13 HydrophobicContact CB-CB 4.09Å; N10-F13 PolarHBondContact O-N 2.78Å; N10-F13 PolarHBondContact OD1-N 3.49Å; N10-A14 PolarHBondContact O-N 3.24Å
11	S	86.5	Confident	78.1	Confident	74 Å²	74	135.1 Å²	135.1	52%	0.517	67%	0.667	S	S	.	*	H	α-helix	trans	-60.6	-33.9	179.1	54.4	0	0	0	0	112.8	I9 F13 A14 Q15	I9-S11 PolarHBondContact O-N 3.13Å; S11-F13 VanDerWaalsContact C-N 3.34Å; S11-F13 PolarHBondContact O-N 2.93Å; S11-A14 PolarHBondContact O-N 3.47Å; S11-Q15 WeakPolarHBondContact O-CG 3.13Å; S11-Q15 PolarHBondContact O-N 2.98Å
12	Q	88.1	Confident	79.8	Confident	128 Å²	128	127 Å²	127	60%	0.598	63%	0.626	S	S	*	*	H	α-helix	trans	-67.4	-35.8	178.2	-61.7	-174.1	-18	0	0	111.9	N10 K16	N10-Q12 VanDerWaalsContact C-N 3.26Å; N10-Q12 PolarHBondContact O-N 3.44Å; N10-Q12 WeakPolarHBondContact OD1-CB 3.27Å; N10-Q12 PolarHBondContact OD1-N 3.18Å; N10-Q12 VanDerWaalsContact OD1-N 3.15Å; Q12-K16 WeakPolarHBondContact O-CB 3.46Å; Q12-K16 VanDerWaalsContact O-CG 3.3Å; Q12-K16 WeakPolarHBondContact O-CG 3.39Å; Q12-K16 PolarHBondContact O-N 3.29Å; Q12-K16 VanDerWaalsContact O-N 3.11Å
13	F	90.4	Very high	81.5	Confident	140 Å²	140	127.4 Å²	127.4	61%	0.614	62%	0.615	S	S	*	*	H	α-helix	trans	-70.3	-40	174.9	-177	-98.4	0	0	0	111.6	N10 S11 K16 Y17	N10-F13 HydrophobicContact CB-CB 4.09Å; N10-F13 PolarHBondContact O-N 2.78Å; N10-F13 PolarHBondContact OD1-N 3.49Å; S11-F13 VanDerWaalsContact C-N 3.34Å; S11-F13 PolarHBondContact O-N 2.93Å; F13-K16 PolarHBondContact O-N 3.27Å; F13-Y17 WeakPolarHBondContact O-CB 3.33Å; F13-Y17 PolarHBondContact O-N 3.32Å
14	A	88.6	Confident	83.1	Confident	35 Å²	35	128.7 Å²	128.7	29%	0.289	60%	0.6	S	S	.	*	H	α-helix	trans	-60.9	-47.2	175.7	0	0	0	0	0	111.6	N10 S11 K16 Y17 E18	N10-A14 PolarHBondContact O-N 3.24Å; S11-A14 PolarHBondContact O-N 3.47Å; A14-K16 PolarHBondContact O-N 3.11Å; A14-Y17 PolarHBondContact O-N 3.15Å; A14-E18 WeakPolarHBondContact O-CB 3.28Å; A14-E18 VanDerWaalsContact O-CG 3.31Å; A14-E18 WeakPolarHBondContact O-CG 3.32Å; A14-E18 PolarHBondContact O-N 2.77Å
15	Q	87.7	Confident	84.7	Confident	116 Å²	116	121 Å²	121	54%	0.542	58%	0.575	S	S	.	*	H	α-helix	trans	-61.9	-41.2	176.7	-71.5	174	-7.3	0	0	112.5	S11 E18 K19	S11-Q15 WeakPolarHBondContact O-CG 3.13Å; S11-Q15 PolarHBondContact O-N 2.98Å; Q15-E18 PolarHBondContact O-N 3.34Å; Q15-K19 WeakPolarHBondContact O-CB 3.28Å; Q15-K19 WeakPolarHBondContact O-CG 3.44Å; Q15-K19 PolarHBondContact O-N 2.58Å
16	K	88.8	Confident	85.6	Confident	150 Å²	150	116.8 Å²	116.8	65%	0.652	54%	0.544	S	S	*	.	H	α-helix	trans	-64.6	-40.5	175.1	-74.9	179.1	-176.9	-174.5	0	111.9	Q12 F13 A14 Y20	Q12-K16 WeakPolarHBondContact O-CB 3.46Å; Q12-K16 VanDerWaalsContact O-CG 3.3Å; Q12-K16 WeakPolarHBondContact O-CG 3.39Å; Q12-K16 PolarHBondContact O-N 3.29Å; Q12-K16 VanDerWaalsContact O-N 3.11Å; F13-K16 PolarHBondContact O-N 3.27Å; A14-K16 PolarHBondContact O-N 3.11Å; K16-Y20 WeakPolarHBondContact O-CB 3.43Å; K16-Y20 PolarHBondContact O-N 3.02Å
17	Y	92	Very high	86.4	Confident	127 Å²	127	114.3 Å²	114.3	50%	0.498	53%	0.533	S	S	.	.	H	α-helix	trans	-67.3	-41.2	177.4	-177.4	-100.5	0	0	0	112	F13 A14 Y20 R21	F13-Y17 WeakPolarHBondContact O-CB 3.33Å; F13-Y17 PolarHBondContact O-N 3.32Å; A14-Y17 PolarHBondContact O-N 3.15Å; Y17-Y20 PolarHBondContact O-N 2.75Å; Y17-R21 WeakPolarHBondContact O-CB 3.23Å; Y17-R21 PolarHBondContact O-N 3.45Å
18	E	86.8	Confident	86.9	Confident	109 Å²	109	112.2 Å²	112.2	51%	0.509	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-45.6	174.9	-74.3	171.2	-172	0	0	111.6	A14 Q15 Y20 R21 Q22	A14-E18 WeakPolarHBondContact O-CB 3.28Å; A14-E18 VanDerWaalsContact O-CG 3.31Å; A14-E18 WeakPolarHBondContact O-CG 3.32Å; A14-E18 PolarHBondContact O-N 2.77Å; Q15-E18 PolarHBondContact O-N 3.34Å; E18-Y20 PolarHBondContact O-N 3.01Å; E18-R21 PolarHBondContact O-N 2.89Å; E18-Q22 WeakPolarHBondContact O-CB 3.07Å; E18-Q22 VanDerWaalsContact O-CG 3.23Å; E18-Q22 WeakPolarHBondContact O-CG 3.45Å; E18-Q22 PolarHBondContact O-N 3.3Å
19	K	86.9	Confident	86.9	Confident	103 Å²	103	103.3 Å²	103.3	45%	0.448	48%	0.479	S	S	.	.	H	α-helix	trans	-62.2	-40.1	174.8	-73.7	-175.1	177.7	-166.5	0	112.4	Q15 K23 D350	Q15-K19 WeakPolarHBondContact O-CB 3.28Å; Q15-K19 WeakPolarHBondContact O-CG 3.44Å; Q15-K19 PolarHBondContact O-N 2.58Å; K19-K23 WeakPolarHBondContact O-CG 3.2Å; K19-K23 PolarHBondContact O-N 3.41Å; K19-D350 IonicContact NZ-OD2 3.51Å
20	Y	90.2	Very high	86.8	Confident	156 Å²	156	99.4 Å²	99.4	61%	0.612	46%	0.456	S	S	*	.	H	α-helix	trans	-62.4	-46	175.2	177.3	-93.1	0	0	0	111.5	K16 Y17 E18 K23 E24	K16-Y20 WeakPolarHBondContact O-CB 3.43Å; K16-Y20 PolarHBondContact O-N 3.02Å; Y17-Y20 PolarHBondContact O-N 2.75Å; E18-Y20 PolarHBondContact O-N 3.01Å; Y20-K23 PolarHBondContact O-N 3.48Å; Y20-E24 PolarHBondContact O-N 2.88Å
21	R	90.6	Very high	86.5	Confident	128 Å²	128	100.7 Å²	100.7	48%	0.483	46%	0.463	S	S	.	.	H	α-helix	trans	-65.8	-40	179.1	-166.3	-179.2	-172.7	165.8	7.6	112.4	Y17 E18 K23 E24 E25	Y17-R21 WeakPolarHBondContact O-CB 3.23Å; Y17-R21 PolarHBondContact O-N 3.45Å; E18-R21 PolarHBondContact O-N 2.89Å; R21-K23 VanDerWaalsContact C-N 3.34Å; R21-E24 PolarHBondContact O-N 3.45Å; R21-E25 IonicContact NE-OE1 3.65Å; R21-E25 WeakPolarHBondContact O-CB 3.33Å; R21-E25 WeakPolarHBondContact O-CG 3.43Å; R21-E25 PolarHBondContact O-N 2.89Å
22	Q	84.3	Confident	86	Confident	64 Å²	64	104.2 Å²	104.2	30%	0.299	47%	0.465	S	S	.	.	H	α-helix	trans	-62.5	-40.5	174.7	-73.9	171.6	7.3	0	0	111.7	E18 E25 L26 L343	E18-Q22 WeakPolarHBondContact O-CB 3.07Å; E18-Q22 VanDerWaalsContact O-CG 3.23Å; E18-Q22 WeakPolarHBondContact O-CG 3.45Å; E18-Q22 PolarHBondContact O-N 3.3Å; Q22-E25 PolarHBondContact O-N 3.31Å; Q22-L26 VanDerWaalsContact O-CB 3.29Å; Q22-L26 WeakPolarHBondContact O-CB 3.17Å; Q22-L26 PolarHBondContact O-N 2.69Å; Q22-L343 HydrophobicContact CB-CD2 4.28Å; Q22-L343 HydrophobicContact CG-CD2 4.08Å
23	K	86.1	Confident	85	Confident	138 Å²	138	101 Å²	101	60%	0.6	45%	0.449	S	S	*	.	H	α-helix	trans	-65.9	-39.9	174.4	-74.5	-180	178.6	-172.8	0	112.5	K19 Y20 R21 L26 Q27	K19-K23 WeakPolarHBondContact O-CG 3.2Å; K19-K23 PolarHBondContact O-N 3.41Å; Y20-K23 PolarHBondContact O-N 3.48Å; R21-K23 VanDerWaalsContact C-N 3.34Å; K23-L26 PolarHBondContact O-N 3Å; K23-Q27 WeakPolarHBondContact O-CB 3.19Å; K23-Q27 PolarHBondContact O-N 3.46Å
24	E	90.8	Very high	83.6	Confident	103 Å²	103	95.9 Å²	95.9	48%	0.481	44%	0.437	S	S	.	.	H	α-helix	trans	-63.7	-43.8	174.3	-173.1	-172.8	173.2	0	0	111.5	Y20 R21 Q27 K28	Y20-E24 PolarHBondContact O-N 2.88Å; R21-E24 PolarHBondContact O-N 3.45Å; E24-Q27 PolarHBondContact O-N 3.5Å; E24-K28 VanDerWaalsContact O-CB 3.23Å; E24-K28 WeakPolarHBondContact O-CB 3.27Å; E24-K28 PolarHBondContact O-N 3.46Å
25	E	84.6	Confident	81.7	Confident	88 Å²	88	100.4 Å²	100.4	41%	0.411	46%	0.456	S	S	.	.	H	α-helix	trans	-65.3	-41.2	176.7	-75.2	177.5	-178	0	0	111.7	R21 Q22 K28 L29 L343	R21-E25 IonicContact NE-OE1 3.65Å; R21-E25 WeakPolarHBondContact O-CB 3.33Å; R21-E25 WeakPolarHBondContact O-CG 3.43Å; R21-E25 PolarHBondContact O-N 2.89Å; Q22-E25 PolarHBondContact O-N 3.31Å; E25-K28 PolarHBondContact O-N 3.41Å; E25-L29 WeakPolarHBondContact O-CB 3.15Å; E25-L29 VanDerWaalsContact O-CG 3.25Å; E25-L29 WeakPolarHBondContact O-CG 3.46Å; E25-L29 PolarHBondContact O-N 3.2Å; E25-L343 HydrophobicContact CB-CD1 4.22Å
26	L	83.9	Confident	79.6	Confident	17 Å²	17	103 Å²	103	9%	0.089	47%	0.468	C	S	.	.	H	α-helix	trans	-62.2	-47.3	173.5	179.1	162.2	0	0	0	111	Q22 K23 K28 L29 K30 L343 E347	Q22-L26 VanDerWaalsContact O-CB 3.29Å; Q22-L26 WeakPolarHBondContact O-CB 3.17Å; Q22-L26 PolarHBondContact O-N 2.69Å; K23-L26 PolarHBondContact O-N 3Å; L26-K28 VanDerWaalsContact C-N 3.33Å; L26-K28 PolarHBondContact O-N 3.48Å; L26-L29 PolarHBondContact O-N 2.97Å; L26-K30 HydrophobicContact CD2-CD 3.48Å; L26-K30 VanDerWaalsContact CD2-CD 3.48Å; L26-K30 HydrophobicContact CD2-CG 3.87Å; L26-K30 WeakPolarHBondContact O-CB 3.26Å; L26-K30 WeakPolarHBondContact O-CG 3.42Å; L26-K30 PolarHBondContact O-N 3.46Å; L26-L343 HydrophobicContact CB-CD1 4.43Å; L26-E347 VanDerWaalsContact CD1-CD 3.44Å; L26-E347 WeakPolarHBondContact CD1-OE1 3.2Å; L26-E347 WeakPolarHBondContact CD1-OE2 3.47Å
27	Q	83.2	Confident	77.6	Confident	120 Å²	120	97 Å²	97	56%	0.561	45%	0.446	S	S	*	.	H	α-helix	trans	-62	-43	178.2	-173.3	173.9	3	0	0	111	K23 E24 L29 K30 D31	K23-Q27 WeakPolarHBondContact O-CB 3.19Å; K23-Q27 PolarHBondContact O-N 3.46Å; E24-Q27 PolarHBondContact O-N 3.5Å; Q27-L29 VanDerWaalsContact C-N 3.31Å; Q27-L29 PolarHBondContact O-N 2.87Å; Q27-K30 PolarHBondContact O-N 3.29Å; Q27-D31 WeakPolarHBondContact O-CB 3.49Å; Q27-D31 PolarHBondContact O-N 3.05Å
28	K	87.4	Confident	75	Confident	116 Å²	116	95.6 Å²	95.6	50%	0.504	45%	0.447	S	S	.	.	H	α-helix	trans	-64	-34	175.9	-172.9	177.8	-174.1	174.1	0	113	E24 E25 L26 R32	E24-K28 VanDerWaalsContact O-CB 3.23Å; E24-K28 WeakPolarHBondContact O-CB 3.27Å; E24-K28 PolarHBondContact O-N 3.46Å; E25-K28 PolarHBondContact O-N 3.41Å; L26-K28 VanDerWaalsContact C-N 3.33Å; L26-K28 PolarHBondContact O-N 3.48Å; K28-R32 WeakPolarHBondContact O-CB 3.35Å; K28-R32 WeakPolarHBondContact O-CD 3.21Å; K28-R32 WeakPolarHBondContact O-CG 3.45Å; K28-R32 PolarHBondContact O-N 3.06Å
29	L	77.8	Confident	72.4	Confident	13 Å²	13	96.9 Å²	96.9	7%	0.068	46%	0.458	C	S	.	.	H	α-helix	trans	-74	-41.8	173.3	-71.8	171	0	0	0	110.9	E25 L26 Q27 D31 R32 F33 Q336 Q339 L340 L343	E25-L29 WeakPolarHBondContact O-CB 3.15Å; E25-L29 VanDerWaalsContact O-CG 3.25Å; E25-L29 WeakPolarHBondContact O-CG 3.46Å; E25-L29 PolarHBondContact O-N 3.2Å; L26-L29 PolarHBondContact O-N 2.97Å; Q27-L29 VanDerWaalsContact C-N 3.31Å; Q27-L29 PolarHBondContact O-N 2.87Å; L29-D31 PolarHBondContact O-N 3.29Å; L29-R32 PolarHBondContact O-N 2.73Å; L29-R32 VanDerWaalsContact O-N 3.16Å; L29-F33 HydrophobicContact CD2-CD2 4.36Å; L29-F33 HydrophobicContact CD2-CE2 4.01Å; L29-F33 VanDerWaalsContact O-CD2 3.29Å; L29-F33 WeakPolarHBondContact O-CD2 3.23Å; L29-F33 PolarHBondContact O-N 2.88Å; L29-Q336 HydrophobicContact CD2-CB 4.03Å; L29-Q336 HydrophobicContact CD2-CG 4.35Å; L29-Q339 HydrophobicContact CD1-CB 4.28Å; L29-L340 HydrophobicContact CB-CD1 4.38Å; L29-L340 HydrophobicContact CD1-CB 4.18Å; L29-L343 HydrophobicContact CD1-CD1 4.24Å
30	K	80.7	Confident	69.8	Low	64 Å²	64	95.8 Å²	95.8	28%	0.278	46%	0.463	S	S	.	.	H	α-helix	trans	-60.8	-42.2	173.6	-77.1	-169.3	176.1	-172.5	0	112.3	L26 Q27 R32 F33 G34 D35	L26-K30 HydrophobicContact CD2-CD 3.48Å; L26-K30 VanDerWaalsContact CD2-CD 3.48Å; L26-K30 HydrophobicContact CD2-CG 3.87Å; L26-K30 WeakPolarHBondContact O-CB 3.26Å; L26-K30 WeakPolarHBondContact O-CG 3.42Å; L26-K30 PolarHBondContact O-N 3.46Å; Q27-K30 PolarHBondContact O-N 3.29Å; K30-R32 PolarHBondContact O-N 3.18Å; K30-F33 PolarHBondContact O-N 2.77Å; K30-G34 CarbonylContact O-C 3.6Å; K30-G34 WeakPolarHBondContact O-CA 3.49Å; K30-G34 PolarHBondContact O-N 3Å; K30-D35 IonicContact NZ-OD1 2.86Å
31	D	81.3	Confident	66.9	Low	126 Å²	126	94 Å²	94	67%	0.674	46%	0.464	S	S	*	.	H	α-helix	trans	-66.4	-28.1	177.2	-68.3	-20	0	0	0	112.2	Q27 L29	Q27-D31 WeakPolarHBondContact O-CB 3.49Å; Q27-D31 PolarHBondContact O-N 3.05Å; L29-D31 PolarHBondContact O-N 3.29Å
32	R	76.6	Confident	63.7	Low	147 Å²	147	92.3 Å²	92.3	56%	0.555	47%	0.472	S	S	*	.	H	α-helix	trans	-83.2	-36.5	178.2	-76.8	175.5	-179.4	-159.3	-1.2	113.6	K28 L29 K30	K28-R32 WeakPolarHBondContact O-CB 3.35Å; K28-R32 WeakPolarHBondContact O-CD 3.21Å; K28-R32 WeakPolarHBondContact O-CG 3.45Å; K28-R32 PolarHBondContact O-N 3.06Å; L29-R32 PolarHBondContact O-N 2.73Å; L29-R32 VanDerWaalsContact O-N 3.16Å; K30-R32 PolarHBondContact O-N 3.18Å
33	F	66.8	Low	61.1	Low	60 Å²	60	94.1 Å²	94.1	26%	0.263	49%	0.492	S	S	.	.	H	α-helix	trans	-107.3	-8.5	-173.6	-68.6	-78.8	0	0	0	113.9	L29 K30 K333 Q336 L337	L29-F33 HydrophobicContact CD2-CD2 4.36Å; L29-F33 HydrophobicContact CD2-CE2 4.01Å; L29-F33 VanDerWaalsContact O-CD2 3.29Å; L29-F33 WeakPolarHBondContact O-CD2 3.23Å; L29-F33 PolarHBondContact O-N 2.88Å; K30-F33 PolarHBondContact O-N 2.77Å; F33-K333 HydrophobicContact CE1-CB 4.4Å; F33-K333 HydrophobicContact CE1-CG 4.39Å; F33-Q336 HydrophobicContact CE2-CB 3.58Å; F33-Q336 HydrophobicContact CE2-CG 4.44Å; F33-Q336 HydrophobicContact CZ-CB 3.59Å; F33-Q336 HydrophobicContact CZ-CG 4.45Å; F33-Q336 VanDerWaalsContact CZ-OE1 3.24Å; F33-L337 HydrophobicContact CD1-CD2 4.04Å; F33-L337 HydrophobicContact CD1-CG 4.44Å; F33-L337 HydrophobicContact CE1-CD2 4.37Å; F33-L337 HydrophobicContact CE1-CG 4.28Å; F33-L337 HydrophobicContact CG-CD2 4.25Å
34	G	60.3	Low	58.2	Low	34 Å²	34	97 Å²	97	35%	0.351	51%	0.508	S	S	.	.			trans	78.2	160.5	-171.5	0	0	0	0	0	112.4	K30 Q36	K30-G34 CarbonylContact O-C 3.6Å; K30-G34 WeakPolarHBondContact O-CA 3.49Å; K30-G34 PolarHBondContact O-N 3Å; G34-Q36 PolarHBondContact O-N 3.43Å; G34-Q36 VanDerWaalsContact O-N 3.1Å
35	D	48.1	Very low	54.9	Low	129 Å²	129	97.6 Å²	97.6	69%	0.69	52%	0.523	S	S	*	.	S	Bend	trans	-70	-0.1	178.7	-159.6	40.6	0	0	0	113.4	K30 A37	K30-D35 IonicContact NZ-OD1 2.86Å; D35-A37 VanDerWaalsContact C-N 3.29Å; D35-A37 PolarHBondContact O-N 3.09Å
36	Q	43.8	Very low	52.1	Low	170 Å²	170	98.5 Å²	98.5	79%	0.794	54%	0.539	S	S	*	.			trans	-96.5	55.6	-179.1	-159.6	154.7	8	0	0	110.7	G34	G34-Q36 PolarHBondContact O-N 3.43Å; G34-Q36 VanDerWaalsContact O-N 3.1Å
37	A	48.2	Very low	49.4	Very low	25 Å²	25	103 Å²	103	21%	0.207	57%	0.572	C	S	.	*			trans	-144	66.6	175.9	0	0	0	0	0	108.5	D35 L340 K344	D35-A37 VanDerWaalsContact C-N 3.29Å; D35-A37 PolarHBondContact O-N 3.09Å; A37-L340 HydrophobicContact CB-CD1 4.19Å; A37-K344 PolarHBondContact O-NZ 3.49Å
38	D	36	Very low	46.9	Very low	97 Å²	97	102.9 Å²	102.9	52%	0.519	58%	0.575	S	S	.	*			trans	-139.2	131.6	157.9	-89.8	-22.6	0	0	0	111.4	K344	D38-K344 WeakPolarHBondContact OD1-CD 3.47Å; D38-K344 VanDerWaalsContact OD1-CE 3.31Å; D38-K344 WeakPolarHBondContact OD1-CE 3.45Å; D38-K344 IonicContact OD1-NZ 3.95Å; D38-K344 PolarHBondContact OD1-NZ 2.9Å; D38-K344 WeakPolarHBondContact OD2-CD 3.48Å; D38-K344 WeakPolarHBondContact OD2-CE 2.95Å; D38-K344 IonicContact OD2-NZ 2.76Å; D38-K344 PolarHBondContact OD2-NZ 3.14Å
39	D	32.5	Very low	44.2	Very low	136 Å²	136	103.9 Å²	103.9	73%	0.727	59%	0.586	S	S	*	*			trans	67.7	106.5	164.6	-55.2	-41.3	0	0	0	118.7
40	S	33.2	Very low	42.1	Very low	80 Å²	80	106.7 Å²	106.7	56%	0.559	61%	0.607	S	S	*	*				70.8	131.1	55.9	-153.7	0	0	0	0	110.6
41	D	28.5	Very low	40.5	Very low	119 Å²	119	108.7 Å²	108.7	64%	0.636	62%	0.617	S	S	*	*			cis	-161.6	148.1	-8.2	-123.5	-28	0	0	0	104.3
42	S	23.2	Very low	39.1	Very low	93 Å²	93	107.1 Å²	107.1	65%	0.65	61%	0.612	S	S	*	*			trans	-174.4	135.3	135.5	-159.2	0	0	0	0	109.7
43	S	29.7	Very low	38	Very low	102 Å²	102	108.3 Å²	108.3	71%	0.713	62%	0.623	S	S	*	*			trans	-98.3	149	-166.1	-57.4	0	0	0	0	110.6
44	E	24.7	Very low	37.6	Very low	199 Å²	199	108.7 Å²	108.7	93%	0.93	63%	0.628	S	S	*	*			trans	-165.9	101.7	143.7	-113.8	-176.1	-175.9	0	0	111.7
45	S	23.2	Very low	38.3	Very low	115 Å²	115	110.2 Å²	110.2	80%	0.804	63%	0.628	S	S	*	*				-171.9	85.8	122.4	-172.4	0	0	0	0	107.3	S47	S45-S47 PolarHBondContact O-N 3.18Å
46	S	26.2	Very low	39.8	Very low	106 Å²	106	106.1 Å²	106.1	74%	0.741	61%	0.608	S	S	*	*			trans	-61.2	116.9	156.4	-172.1	0	0	0	0	107.7	D48	S46-D48 VanDerWaalsContact C-N 3.32Å; S46-D48 PolarHBondContact OG-N 3.08Å
47	S	25.7	Very low	41.5	Very low	113 Å²	113	99.6 Å²	99.6	79%	0.79	58%	0.584	S	S	*	*			trans	-93.8	86.9	149.5	-164.5	0	0	0	0	104.2	S45 D49	S45-S47 PolarHBondContact O-N 3.18Å; S47-D49 PolarHBondContact O-N 3.44Å
48	D	30.9	Very low	43.2	Very low	117 Å²	117	100.6 Å²	100.6	63%	0.626	59%	0.586	S	S	*	*			trans	-68.9	86.8	161.8	-178.7	43.8	0	0	0	105.9	S46 S50	S46-D48 VanDerWaalsContact C-N 3.32Å; S46-D48 PolarHBondContact OG-N 3.08Å; D48-S50 WeakPolarHBondContact OD1-CB 3.23Å; D48-S50 PolarHBondContact OD1-N 3.42Å; D48-S50 PolarHBondContact OD1-OG 2.87Å
49	D	31.5	Very low	45.4	Very low	137 Å²	137	96.9 Å²	96.9	73%	0.733	57%	0.566	S	S	*	*			trans	-108.8	70.1	147.9	-152	61.9	0	0	0	103.9	S47 E51	S47-D49 PolarHBondContact O-N 3.44Å; D49-E51 PolarHBondContact O-N 2.89Å
50	S	34.2	Very low	47.8	Very low	71 Å²	71	94 Å²	94	50%	0.497	55%	0.545	S	S	.	.			trans	-66.7	91.2	157.9	42.7	0	0	0	0	105.1	D48 V52	D48-S50 WeakPolarHBondContact OD1-CB 3.23Å; D48-S50 PolarHBondContact OD1-N 3.42Å; D48-S50 PolarHBondContact OD1-OG 2.87Å; S50-V52 VanDerWaalsContact C-N 3.25Å; S50-V52 WeakPolarHBondContact O-CG2 3.43Å; S50-V52 PolarHBondContact O-N 3.42Å
51	E	46.1	Very low	50.4	Low	106 Å²	106	91.1 Å²	91.1	50%	0.495	52%	0.523	S	S	.	.			trans	-38.8	103.7	148.6	-169.9	93.8	-133.2	0	0	105.4	D49 E53 L243	D49-E51 PolarHBondContact O-N 2.89Å; E51-E53 HydrophobicContact CG-CG 4.4Å; E51-E53 PolarHBondContact O-N 3.27Å; E51-L243 WeakPolarHBondContact OE1-CG 3.41Å
52	V	51	Low	53.1	Low	93 Å²	93	89.5 Å²	89.5	56%	0.564	51%	0.51	S	S	*	.			trans	-72.8	81	179.7	-177	0	0	0	0	104.8	S50 L54	S50-V52 VanDerWaalsContact C-N 3.25Å; S50-V52 WeakPolarHBondContact O-CG2 3.43Å; S50-V52 PolarHBondContact O-N 3.42Å; V52-L54 HydrophobicContact CG1-CD2 3.6Å; V52-L54 HydrophobicContact CG1-CG 3.95Å; V52-L54 PolarHBondContact O-N 3.14Å
53	E	54.3	Low	56.1	Low	172 Å²	172	85.9 Å²	85.9	80%	0.804	48%	0.483	S	S	*	.			trans	-61.1	87.2	162.4	-70.4	-176	-174.9	0	0	105.5	E51 D55	E51-E53 HydrophobicContact CG-CG 4.4Å; E51-E53 PolarHBondContact O-N 3.27Å; E53-D55 PolarHBondContact O-N 3.39Å
54	L	59.4	Low	58.7	Low	69 Å²	69	84 Å²	84	36%	0.361	46%	0.46	S	S	.	.			trans	-58.2	113.1	171.7	-69	172.3	0	0	0	106.3	V52 D59 Y242	V52-L54 HydrophobicContact CG1-CD2 3.6Å; V52-L54 HydrophobicContact CG1-CG 3.95Å; V52-L54 PolarHBondContact O-N 3.14Å; L54-D59 WeakPolarHBondContact CB-OD1 3.46Å; L54-Y242 HydrophobicContact CD1-CE2 4.16Å
55	D	73.5	Confident	61.6	Low	65 Å²	65	75.9 Å²	75.9	35%	0.348	42%	0.424	S	S	.	.			trans	-52.3	131.2	177.1	179	-3.6	0	0	0	108.3	E53 A57 L58 D59	E53-D55 PolarHBondContact O-N 3.39Å; D55-A57 CarbonylContact O-C 3.58Å; D55-A57 PolarHBondContact O-N 3.14Å; D55-A57 PolarHBondContact OD1-N 2.84Å; D55-L58 HydrophobicContact CB-CB 4.4Å; D55-L58 HydrophobicContact CB-CD1 4.11Å; D55-L58 HydrophobicContact CB-CG 4.08Å; D55-L58 WeakPolarHBondContact O-CA 3.29Å; D55-L58 WeakPolarHBondContact O-CB 3.32Å; D55-L58 PolarHBondContact O-N 3.36Å; D55-D59 PolarHBondContact O-N 3.36Å
56	P	79.8	Confident	64.5	Low	43 Å²	43	72.3 Å²	72.3	28%	0.279	40%	0.395	S	S	.	.	H	α-helix	trans	-50.3	-24.2	173.9	-29.6	34.3	0	0	0	114	R60 E192	P56-R60 VanDerWaalsContact O-CG 3.23Å; P56-R60 WeakPolarHBondContact O-CG 3.29Å; P56-R60 PolarHBondContact O-N 3.11Å; P56-E192 WeakPolarHBondContact CB-OE1 3.18Å; P56-E192 WeakPolarHBondContact CG-OE1 3.44Å; P56-E192 WeakPolarHBondContact CG-OE2 3.43Å
57	A	80.4	Confident	67.2	Low	34 Å²	34	67.3 Å²	67.3	28%	0.281	36%	0.361	S	S	.	.	H	α-helix	trans	-68.5	-42.9	170.1	0	0	0	0	0	113.4	D55 D59 R60 D61	D55-A57 CarbonylContact O-C 3.58Å; D55-A57 PolarHBondContact O-N 3.14Å; D55-A57 PolarHBondContact OD1-N 2.84Å; A57-D59 VanDerWaalsContact C-N 3.35Å; A57-R60 PolarHBondContact O-N 2.91Å; A57-D61 PolarHBondContact O-N 3.49Å
58	L	82.9	Confident	70	Confident	46 Å²	46	62.6 Å²	62.6	24%	0.241	33%	0.327	C	S	.	.	H	α-helix	trans	-65.5	-38.1	175.7	-69.1	174.7	0	0	0	111.5	D55 D61 F62 A88	D55-L58 HydrophobicContact CB-CB 4.4Å; D55-L58 HydrophobicContact CB-CD1 4.11Å; D55-L58 HydrophobicContact CB-CG 4.08Å; D55-L58 WeakPolarHBondContact O-CA 3.29Å; D55-L58 WeakPolarHBondContact O-CB 3.32Å; D55-L58 PolarHBondContact O-N 3.36Å; L58-D61 PolarHBondContact O-N 3.26Å; L58-F62 WeakPolarHBondContact O-CB 3.27Å; L58-F62 PolarHBondContact O-N 2.66Å; L58-A88 HydrophobicContact CD2-CB 3.7Å; L58-A88 HydrophobicContact CG-CB 4.23Å
59	D	82.1	Confident	72.6	Confident	19 Å²	19	62.3 Å²	62.3	10%	0.102	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-44.3	175.3	-79.5	-7.8	0	0	0	111.5	L54 D55 A57 D61 F62 Y63	L54-D59 WeakPolarHBondContact CB-OD1 3.46Å; D55-D59 PolarHBondContact O-N 3.36Å; A57-D59 VanDerWaalsContact C-N 3.35Å; D59-D61 VanDerWaalsContact C-N 3.32Å; D59-D61 PolarHBondContact O-N 2.91Å; D59-F62 WeakPolarHBondContact O-CB 3.18Å; D59-F62 PolarHBondContact O-N 3.35Å; D59-Y63 HydrophobicContact CB-CD2 4.47Å; D59-Y63 HydrophobicContact CB-CE2 4.01Å; D59-Y63 WeakPolarHBondContact O-CD2 3.01Å; D59-Y63 PolarHBondContact O-N 3.25Å
60	R	84.2	Confident	75.1	Confident	75 Å²	75	60.6 Å²	60.6	28%	0.283	31%	0.31	S	S	.	.	H	α-helix	trans	-59.6	-43	174.2	-73.6	171.2	-173.8	127.3	4.3	111.6	P56 A57 R64 E192 Y195	P56-R60 VanDerWaalsContact O-CG 3.23Å; P56-R60 WeakPolarHBondContact O-CG 3.29Å; P56-R60 PolarHBondContact O-N 3.11Å; A57-R60 PolarHBondContact O-N 2.91Å; R60-R64 VanDerWaalsContact O-CG 3.23Å; R60-R64 WeakPolarHBondContact O-CG 3.41Å; R60-R64 PolarHBondContact O-N 2.79Å; R60-E192 IonicContact CZ-OE1 2.61Å; R60-E192 IonicContact NH1-OE1 2.97Å; R60-E192 IonicContact NH2-OE1 2.81Å; R60-E192 PolarHBondContact NH2-OE1 3.3Å; R60-E192 VanDerWaalsContact NH2-OE1 3.16Å; R60-Y195 HydrophobicContact CG-CE1 4.2Å
61	D	85.9	Confident	77.4	Confident	19 Å²	19	61.4 Å²	61.4	10%	0.102	31%	0.305	C	S	.	.	H	α-helix	trans	-66.9	-41.4	176.6	-75.6	-11.5	0	0	0	111.3	A57 L58 D59 Y63 R64 T65 Y84 S85	A57-D61 PolarHBondContact O-N 3.49Å; L58-D61 PolarHBondContact O-N 3.26Å; D59-D61 VanDerWaalsContact C-N 3.32Å; D59-D61 PolarHBondContact O-N 2.91Å; D61-Y63 PolarHBondContact O-N 2.77Å; D61-R64 WeakPolarHBondContact O-CB 3.21Å; D61-R64 PolarHBondContact O-N 2.82Å; D61-R64 IonicContact OD1-CZ 3.78Å; D61-R64 IonicContact OD1-NH1 3.13Å; D61-R64 PolarHBondContact OD1-NH1 2.87Å; D61-T65 WeakPolarHBondContact O-CG2 3.34Å; D61-T65 PolarHBondContact O-N 3.36Å; D61-Y84 HydrophobicContact CB-CD1 4.27Å; D61-S85 PolarHBondContact OD2-OG 3.23Å
62	F	86.6	Confident	79.1	Confident	85 Å²	85	64.1 Å²	64.1	37%	0.373	32%	0.315	S	S	.	.	H	α-helix	trans	-57.9	-50	173.5	175.5	-100.1	0	0	0	111.8	L58 D59 R64 T65 L66	L58-F62 WeakPolarHBondContact O-CB 3.27Å; L58-F62 PolarHBondContact O-N 2.66Å; D59-F62 WeakPolarHBondContact O-CB 3.18Å; D59-F62 PolarHBondContact O-N 3.35Å; F62-R64 VanDerWaalsContact C-N 3.31Å; F62-R64 PolarHBondContact O-N 3.36Å; F62-T65 PolarHBondContact O-N 3.01Å; F62-T65 VanDerWaalsContact O-N 3.11Å; F62-T65 PolarHBondContact O-OG1 3.06Å; F62-L66 HydrophobicContact CE1-CD1 3.88Å; F62-L66 HydrophobicContact CZ-CD1 3.98Å; F62-L66 WeakPolarHBondContact O-CB 3.32Å; F62-L66 PolarHBondContact O-N 2.96Å
63	Y	85.7	Confident	80.5	Confident	18 Å²	18	61 Å²	61	7%	0.071	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-34.8	178.5	-64.4	-55.5	0	0	0	112.9	D59 D61 L66 S67 M214 L217 W221 V237	D59-Y63 HydrophobicContact CB-CD2 4.47Å; D59-Y63 HydrophobicContact CB-CE2 4.01Å; D59-Y63 WeakPolarHBondContact O-CD2 3.01Å; D59-Y63 PolarHBondContact O-N 3.25Å; D61-Y63 PolarHBondContact O-N 2.77Å; Y63-L66 PolarHBondContact O-N 3.19Å; Y63-S67 PolarHBondContact O-N 3.35Å; Y63-M214 HydrophobicContact CG-CE 4.15Å; Y63-L217 HydrophobicContact CD1-CD2 4.06Å; Y63-L217 HydrophobicContact CG-CD2 4.46Å; Y63-W221 HydrophobicContact CD1-CH2 4.16Å; Y63-W221 AromaticContact CE1-CH2 3.91Å; Y63-W221 HydrophobicContact CE1-CH2 3.91Å; Y63-V237 HydrophobicContact CE1-CG1 3.72Å; Y63-V237 VanDerWaalsContact OH-CG1 3.26Å; Y63-V237 WeakPolarHBondContact OH-CG1 3.29Å
64	R	84.4	Confident	81.9	Confident	63 Å²	63	57.2 Å²	57.2	24%	0.238	29%	0.285	C	S	.	.	H	α-helix	trans	-62.8	-43.4	171.4	-72.3	167.7	-177.2	170.5	-5.5	111.4	R60 D61 F62 L66 S67 L68 E210 M214	R60-R64 VanDerWaalsContact O-CG 3.23Å; R60-R64 WeakPolarHBondContact O-CG 3.41Å; R60-R64 PolarHBondContact O-N 2.79Å; D61-R64 WeakPolarHBondContact O-CB 3.21Å; D61-R64 PolarHBondContact O-N 2.82Å; D61-R64 IonicContact OD1-CZ 3.78Å; D61-R64 IonicContact OD1-NH1 3.13Å; D61-R64 PolarHBondContact OD1-NH1 2.87Å; F62-R64 VanDerWaalsContact C-N 3.31Å; F62-R64 PolarHBondContact O-N 3.36Å; R64-L66 VanDerWaalsContact C-N 3.31Å; R64-L66 PolarHBondContact O-N 2.77Å; R64-S67 PolarHBondContact O-N 2.89Å; R64-S67 PolarHBondContact O-OG 3.11Å; R64-L68 WeakPolarHBondContact O-CG 3.28Å; R64-L68 PolarHBondContact O-N 3.17Å; R64-E210 IonicContact CZ-OE2 2.75Å; R64-E210 IonicContact NH2-OE1 3.36Å; R64-E210 PolarHBondContact NH2-OE1 3.43Å; R64-E210 IonicContact NH2-OE2 2.73Å; R64-E210 PolarHBondContact NH2-OE2 3.41Å; R64-M214 HydrophobicContact CB-SD 4.26Å; R64-M214 HydrophobicContact CG-CG 4.27Å; R64-M214 HydrophobicContact CG-SD 3.61Å
65	T	84.7	Confident	82.9	Confident	27 Å²	27	59.3 Å²	59.3	17%	0.166	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-38.6	176.4	70.4	0	0	0	0	112.1	D61 F62 L68 L69 F83 Y84	D61-T65 WeakPolarHBondContact O-CG2 3.34Å; D61-T65 PolarHBondContact O-N 3.36Å; F62-T65 PolarHBondContact O-N 3.01Å; F62-T65 VanDerWaalsContact O-N 3.11Å; F62-T65 PolarHBondContact O-OG1 3.06Å; T65-L68 PolarHBondContact O-N 2.81Å; T65-L69 VanDerWaalsContact O-CB 3.27Å; T65-L69 WeakPolarHBondContact O-CB 3.38Å; T65-L69 PolarHBondContact O-N 3.01Å; T65-F83 HydrophobicContact CG2-CB 3.58Å; T65-F83 HydrophobicContact CG2-CD1 4.34Å; T65-F83 HydrophobicContact CG2-CG 4.2Å; T65-Y84 HydrophobicContact CG2-CE2 4.15Å
66	L	85	Confident	83.2	Confident	40 Å²	40	58.8 Å²	58.8	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-68.4	-39.9	-178.4	-167.5	155.2	0	0	0	111	F62 Y63 R64 L69 K70 L217	F62-L66 HydrophobicContact CE1-CD1 3.88Å; F62-L66 HydrophobicContact CZ-CD1 3.98Å; F62-L66 WeakPolarHBondContact O-CB 3.32Å; F62-L66 PolarHBondContact O-N 2.96Å; Y63-L66 PolarHBondContact O-N 3.19Å; R64-L66 VanDerWaalsContact C-N 3.31Å; R64-L66 PolarHBondContact O-N 2.77Å; L66-L69 PolarHBondContact O-N 3.4Å; L66-K70 HydrophobicContact CD2-CG 3.96Å; L66-K70 WeakPolarHBondContact O-CB 3.36Å; L66-K70 WeakPolarHBondContact O-CG 3.33Å; L66-K70 PolarHBondContact O-N 2.77Å; L66-L217 HydrophobicContact CD2-CD1 3.39Å; L66-L217 HydrophobicContact CD2-CD2 4.15Å; L66-L217 HydrophobicContact CD2-CG 4.41Å
67	S	83.4	Confident	83.3	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.014	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-43.8	176	78.1	0	0	0	0	111.9	Y63 R64 L69 K70 K71 D213	Y63-S67 PolarHBondContact O-N 3.35Å; R64-S67 PolarHBondContact O-N 2.89Å; R64-S67 PolarHBondContact O-OG 3.11Å; S67-L69 VanDerWaalsContact C-N 3.32Å; S67-L69 PolarHBondContact O-N 3.31Å; S67-K70 PolarHBondContact O-N 3.5Å; S67-K71 VanDerWaalsContact O-CB 3.27Å; S67-K71 WeakPolarHBondContact O-CB 3.32Å; S67-K71 PolarHBondContact O-N 3.23Å; S67-D213 WeakPolarHBondContact CB-O 3.49Å; S67-D213 PolarHBondContact OG-O 3.22Å
68	L	84.6	Confident	83.6	Confident	14 Å²	14	69.3 Å²	69.3	7%	0.073	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-39.9	174.9	-67.4	173.2	0	0	0	111.5	R64 T65 K71 K72 D73 I76 F83	R64-L68 WeakPolarHBondContact O-CG 3.28Å; R64-L68 PolarHBondContact O-N 3.17Å; T65-L68 PolarHBondContact O-N 2.81Å; L68-K71 PolarHBondContact O-N 3.06Å; L68-K72 PolarHBondContact O-N 3.03Å; L68-D73 HydrophobicContact CD2-CB 4.19Å; L68-D73 VanDerWaalsContact CD2-OD2 3.32Å; L68-D73 WeakPolarHBondContact CD2-OD2 3.26Å; L68-D73 PolarHBondContact O-N 3.08Å; L68-D73 VanDerWaalsContact O-N 3.15Å; L68-I76 HydrophobicContact CB-CD1 4.23Å; L68-I76 HydrophobicContact CB-CG1 4.49Å; L68-I76 VanDerWaalsContact O-CD1 3.28Å; L68-I76 WeakPolarHBondContact O-CD1 3.35Å; L68-F83 HydrophobicContact CD1-CD1 4.12Å; L68-F83 HydrophobicContact CD1-CE1 3.72Å
69	L	85.5	Confident	83.5	Confident	111 Å²	111	76.9 Å²	76.9	58%	0.581	35%	0.352	S	S	*	.	H	α-helix	trans	-66.8	-44.2	179.7	-173.3	70.7	0	0	0	111.9	T65 L66 S67 K71 K72 I76	T65-L69 VanDerWaalsContact O-CB 3.27Å; T65-L69 WeakPolarHBondContact O-CB 3.38Å; T65-L69 PolarHBondContact O-N 3.01Å; L66-L69 PolarHBondContact O-N 3.4Å; S67-L69 VanDerWaalsContact C-N 3.32Å; S67-L69 PolarHBondContact O-N 3.31Å; L69-K71 VanDerWaalsContact C-N 3.33Å; L69-K72 PolarHBondContact O-N 3.16Å; L69-K72 VanDerWaalsContact O-N 3.13Å; L69-I76 HydrophobicContact CB-CD1 4.37Å; L69-I76 HydrophobicContact CD1-CD1 4.25Å
70	K	83.6	Confident	83.4	Confident	101 Å²	101	83.4 Å²	83.4	44%	0.439	39%	0.387	S	S	.	.	H	α-helix	trans	-68.1	-34.1	177.3	-75.8	-70.9	-169.4	163.4	0	111.9	L66 S67 K72 Y220 E230	L66-K70 HydrophobicContact CD2-CG 3.96Å; L66-K70 WeakPolarHBondContact O-CB 3.36Å; L66-K70 WeakPolarHBondContact O-CG 3.33Å; L66-K70 PolarHBondContact O-N 2.77Å; S67-K70 PolarHBondContact O-N 3.5Å; K70-K72 VanDerWaalsContact C-N 3.28Å; K70-K72 PolarHBondContact O-N 2.94Å; K70-Y220 HydrophobicContact CD-CE1 4.41Å; K70-Y220 PolarHBondContact NZ-OH 3.47Å; K70-E230 IonicContact NZ-OE1 2.77Å; K70-E230 PolarHBondContact NZ-OE1 3.09Å
71	K	82.3	Confident	83.1	Confident	87 Å²	87	81.4 Å²	81.4	38%	0.378	39%	0.387	S	S	.	.	H	α-helix	trans	-74.7	-15.8	172.1	-167.7	172.5	160.5	-139.2	0	113.5	S67 L68 L69 D73 Y216	S67-K71 VanDerWaalsContact O-CB 3.27Å; S67-K71 WeakPolarHBondContact O-CB 3.32Å; S67-K71 PolarHBondContact O-N 3.23Å; L68-K71 PolarHBondContact O-N 3.06Å; L69-K71 VanDerWaalsContact C-N 3.33Å; K71-D73 VanDerWaalsContact C-N 3.3Å; K71-D73 WeakPolarHBondContact CD-OD2 3.43Å; K71-D73 WeakPolarHBondContact CE-OD1 3.46Å; K71-D73 WeakPolarHBondContact CE-OD2 3.47Å; K71-D73 WeakPolarHBondContact CG-OD1 3.34Å; K71-D73 IonicContact NZ-OD1 2.64Å; K71-D73 PolarHBondContact NZ-OD1 3.04Å; K71-D73 IonicContact NZ-OD2 3.18Å; K71-D73 PolarHBondContact NZ-OD2 3.37Å; K71-D73 PolarHBondContact O-N 3.24Å; K71-Y216 HydrophobicContact CD-CD1 4.24Å; K71-Y216 HydrophobicContact CD-CD2 4.08Å; K71-Y216 HydrophobicContact CD-CE1 4.26Å; K71-Y216 HydrophobicContact CD-CE2 4.12Å; K71-Y216 HydrophobicContact CD-CG 4.15Å
72	K	81.3	Confident	82.8	Confident	164 Å²	164	88 Å²	88	71%	0.713	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	43.8	-175	-60.5	178	178.9	174.2	0	112.2	L68 L69 K70	L68-K72 PolarHBondContact O-N 3.03Å; L69-K72 PolarHBondContact O-N 3.16Å; L69-K72 VanDerWaalsContact O-N 3.13Å; K70-K72 VanDerWaalsContact C-N 3.28Å; K70-K72 PolarHBondContact O-N 2.94Å
73	D	80.4	Confident	82.3	Confident	28 Å²	28	87.2 Å²	87.2	15%	0.15	41%	0.411	C	S	.	.			trans	-66.1	143.7	-179.1	-83.5	-23.7	0	0	0	111.7	L68 K71 K75 I76	L68-D73 HydrophobicContact CD2-CB 4.19Å; L68-D73 VanDerWaalsContact CD2-OD2 3.32Å; L68-D73 WeakPolarHBondContact CD2-OD2 3.26Å; L68-D73 PolarHBondContact O-N 3.08Å; L68-D73 VanDerWaalsContact O-N 3.15Å; K71-D73 VanDerWaalsContact C-N 3.3Å; K71-D73 WeakPolarHBondContact CD-OD2 3.43Å; K71-D73 WeakPolarHBondContact CE-OD1 3.46Å; K71-D73 WeakPolarHBondContact CE-OD2 3.47Å; K71-D73 WeakPolarHBondContact CG-OD1 3.34Å; K71-D73 IonicContact NZ-OD1 2.64Å; K71-D73 PolarHBondContact NZ-OD1 3.04Å; K71-D73 IonicContact NZ-OD2 3.18Å; K71-D73 PolarHBondContact NZ-OD2 3.37Å; K71-D73 PolarHBondContact O-N 3.24Å; D73-K75 PolarHBondContact O-N 2.86Å; D73-K75 VanDerWaalsContact O-N 3.11Å; D73-I76 PolarHBondContact O-N 2.72Å
74	P	83.3	Confident	82.1	Confident	91 Å²	91	91.8 Å²	91.8	59%	0.591	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-65.2	-18.2	-174.5	25.5	-34.5	0	0	0	113.8	I76 Y77	P74-I76 PolarHBondContact O-N 3.14Å; P74-Y77 PolarHBondContact O-N 2.81Å
75	K	80.4	Confident	81.7	Confident	114 Å²	114	91.5 Å²	91.5	50%	0.496	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-58.7	-26.3	176.2	-69.1	-178	177.8	179.1	0	113.1	D73 Y77 E78	D73-K75 PolarHBondContact O-N 2.86Å; D73-K75 VanDerWaalsContact O-N 3.11Å; K75-Y77 PolarHBondContact O-N 3.24Å; K75-E78 PolarHBondContact O-N 3.2Å
76	I	80.8	Confident	80.6	Confident	54 Å²	54	96.5 Å²	96.5	28%	0.277	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-67.5	-24.7	178.3	-63	162	0	0	0	111.7	L68 L69 D73 P74 F83	L68-I76 HydrophobicContact CB-CD1 4.23Å; L68-I76 HydrophobicContact CB-CG1 4.49Å; L68-I76 VanDerWaalsContact O-CD1 3.28Å; L68-I76 WeakPolarHBondContact O-CD1 3.35Å; L69-I76 HydrophobicContact CB-CD1 4.37Å; L69-I76 HydrophobicContact CD1-CD1 4.25Å; D73-I76 PolarHBondContact O-N 2.72Å; P74-I76 PolarHBondContact O-N 3.14Å; I76-F83 HydrophobicContact CG1-CZ 4.28Å
77	Y	82	Confident	79	Confident	177 Å²	177	100 Å²	100	69%	0.694	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-92.2	-2.8	-179.6	-56.6	-73.5	0	0	0	113	P74 K75	P74-Y77 PolarHBondContact O-N 2.81Å; K75-Y77 PolarHBondContact O-N 3.24Å
78	E	87.1	Confident	77.4	Confident	120 Å²	120	100.6 Å²	100.6	56%	0.561	48%	0.482	S	S	*	.			trans	-81.2	122.7	174.2	-64.8	-178.4	172.6	0	0	109.4	K75 D80 A81	K75-E78 PolarHBondContact O-N 3.2Å; E78-D80 PolarHBondContact O-N 2.96Å; E78-A81 HydrophobicContact CB-CB 4.38Å; E78-A81 PolarHBondContact O-N 2.86Å
79	K	80.4	Confident	75.6	Confident	205 Å²	205	104.5 Å²	104.5	89%	0.891	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.9	-176.2	-65.5	-178.1	179.6	179.6	0	113.8
80	D	78.9	Confident	73.5	Confident	156 Å²	156	106.6 Å²	106.6	83%	0.834	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-1.7	-174.9	-56	-29	0	0	0	112.6	E78 K82	E78-D80 PolarHBondContact O-N 2.96Å; D80-K82 PolarHBondContact O-N 3.49Å
81	A	78.9	Confident	71.3	Confident	34 Å²	34	109.1 Å²	109.1	28%	0.281	53%	0.528	S	S	.	.			trans	-78.1	109.8	179.7	0	0	0	0	0	110.7	E78 F83	E78-A81 HydrophobicContact CB-CB 4.38Å; E78-A81 PolarHBondContact O-N 2.86Å; A81-F83 HydrophobicContact CB-CD2 4.46Å; A81-F83 HydrophobicContact CB-CE1 4.48Å; A81-F83 HydrophobicContact CB-CE2 3.69Å; A81-F83 HydrophobicContact CB-CZ 3.7Å
82	K	80.6	Confident	68.9	Low	157 Å²	157	113.4 Å²	113.4	68%	0.683	55%	0.55	S	S	*	.			trans	-87.9	114.8	170.8	-65.7	-169.6	176.7	-164.3	0	109.5	D80 E86	D80-K82 PolarHBondContact O-N 3.49Å; K82-E86 IonicContact NZ-OE2 2.66Å; K82-E86 PolarHBondContact NZ-OE2 3.06Å
83	F	75.8	Confident	66.6	Low	68 Å²	68	112.8 Å²	112.8	30%	0.298	55%	0.554	S	S	.	*			trans	-96.7	-22.5	-179.5	-66.8	-74.1	0	0	0	113.7	T65 L68 I76 A81	T65-F83 HydrophobicContact CG2-CB 3.58Å; T65-F83 HydrophobicContact CG2-CD1 4.34Å; T65-F83 HydrophobicContact CG2-CG 4.2Å; L68-F83 HydrophobicContact CD1-CD1 4.12Å; L68-F83 HydrophobicContact CD1-CE1 3.72Å; I76-F83 HydrophobicContact CG1-CZ 4.28Å; A81-F83 HydrophobicContact CB-CD2 4.46Å; A81-F83 HydrophobicContact CB-CE1 4.48Å; A81-F83 HydrophobicContact CB-CE2 3.69Å; A81-F83 HydrophobicContact CB-CZ 3.7Å
84	Y	81.6	Confident	64.2	Low	115 Å²	115	114 Å²	114	45%	0.451	57%	0.573	S	S	.	*	S	Bend	trans	-112.5	136.1	173.9	-63.9	-81.7	0	0	0	108.3	D61 T65 E86	D61-Y84 HydrophobicContact CB-CD1 4.27Å; T65-Y84 HydrophobicContact CG2-CE2 4.15Å; Y84-E86 PolarHBondContact O-N 3.32Å
85	S	75.9	Confident	61.7	Low	56 Å²	56	115.1 Å²	115.1	39%	0.392	58%	0.581	S	S	.	*			trans	-76.2	111.9	171.4	47.8	0	0	0	0	109.1	D61 D87 A88	D61-S85 PolarHBondContact OD2-OG 3.23Å; S85-D87 PolarHBondContact O-N 2.79Å; S85-A88 WeakPolarHBondContact O-CB 3.45Å; S85-A88 PolarHBondContact O-N 3.37Å
86	E	60.5	Low	59.5	Low	132 Å²	132	114.7 Å²	114.7	62%	0.617	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-17.6	178.4	-73.6	169.5	150	0	0	112.7	K82 Y84 S89	K82-E86 IonicContact NZ-OE2 2.66Å; K82-E86 PolarHBondContact NZ-OE2 3.06Å; Y84-E86 PolarHBondContact O-N 3.32Å; E86-S89 PolarHBondContact O-OG 3Å
87	D	51.7	Low	57.4	Low	115 Å²	115	117.8 Å²	117.8	62%	0.615	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-12.3	176	-66.4	-37.7	0	0	0	114.2	S85 K91	S85-D87 PolarHBondContact O-N 2.79Å; D87-K91 WeakPolarHBondContact O-CG 3.45Å; D87-K91 PolarHBondContact O-N 3.47Å
88	A	49.3	Very low	55.3	Low	13 Å²	13	113.7 Å²	113.7	11%	0.107	61%	0.611	C	S	.	*	T	Hydrogen-bonded Turn	trans	-75.5	-32.7	-179.6	0	0	0	0	0	112.1	L58 S85 Q90	L58-A88 HydrophobicContact CD2-CB 3.7Å; L58-A88 HydrophobicContact CG-CB 4.23Å; S85-A88 WeakPolarHBondContact O-CB 3.45Å; S85-A88 PolarHBondContact O-N 3.37Å; A88-Q90 VanDerWaalsContact C-N 3.33Å
89	S	48.1	Very low	53.1	Low	96 Å²	96	116.7 Å²	116.7	67%	0.671	62%	0.622	S	S	*	*	S	Bend	trans	-81	-8	174.4	46.3	0	0	0	0	114.4	E86	E86-S89 PolarHBondContact O-OG 3Å
90	Q	39.7	Very low	51.3	Low	156 Å²	156	115 Å²	115	73%	0.729	62%	0.617	S	S	*	*	S	Bend	trans	-114.8	2	179.9	-73	-162.8	-25	0	0	114	A88 E92	A88-Q90 VanDerWaalsContact C-N 3.33Å; Q90-E92 PolarHBondContact O-N 3.46Å
91	K	39	Very low	49.3	Very low	154 Å²	154	111.7 Å²	111.7	67%	0.67	61%	0.612	S	S	*	*			trans	-80.5	68.5	161	-74.6	176.6	-172.7	169.3	0	109.2	D87 D93	D87-K91 WeakPolarHBondContact O-CG 3.45Å; D87-K91 PolarHBondContact O-N 3.47Å; K91-D93 VanDerWaalsContact C-N 3.32Å; K91-D93 PolarHBondContact O-N 3.18Å
92	E	32	Very low	47.8	Very low	176 Å²	176	119.6 Å²	119.6	82%	0.822	64%	0.64	S	S	*	*			trans	-51.3	109.5	139.7	-75	-79.4	163.8	0	0	105.6	Q90 G94	Q90-E92 PolarHBondContact O-N 3.46Å; E92-G94 PolarHBondContact O-N 2.96Å
93	D	32	Very low	46.7	Very low	151 Å²	151	118.6 Å²	118.6	81%	0.807	65%	0.646	S	S	*	*			trans	-59	88.5	165.7	-90.4	-33.3	0	0	0	107	K91 P95	K91-D93 VanDerWaalsContact C-N 3.32Å; K91-D93 PolarHBondContact O-N 3.18Å; D93-P95 VanDerWaalsContact O-N 3.15Å
94	G	30.8	Very low	46.7	Very low	53 Å²	53	124 Å²	124	55%	0.546	67%	0.669	S	S	.	*			trans	-49.1	127.6	165.7	0	0	0	0	0	106.3	E92 S96	E92-G94 PolarHBondContact O-N 2.96Å; G94-S96 PolarHBondContact O-N 2.91Å
95	P	29.8	Very low	46.3	Very low	116 Å²	116	123.4 Å²	123.4	75%	0.753	68%	0.68	S	S	*	*			trans	-52.3	109.8	-168.6	19.1	-32.7	0	0	0	108.3	D93 T97	D93-P95 VanDerWaalsContact O-N 3.15Å; P95-T97 VanDerWaalsContact C-N 3.34Å; P95-T97 PolarHBondContact O-N 3.19Å
96	S	34.6	Very low	46.2	Very low	105 Å²	105	125.8 Å²	125.8	73%	0.734	69%	0.686	S	S	*	*			trans	-58.7	103.7	-179.2	71.3	0	0	0	0	106.8	G94 S98	G94-S96 PolarHBondContact O-N 2.91Å; S96-S98 PolarHBondContact O-N 3.42Å
97	T	36.2	Very low	47.4	Very low	118 Å²	118	127.7 Å²	127.7	72%	0.724	69%	0.689	S	S	*	*			trans	-75.7	65	175.5	59	0	0	0	0	108.2	P95 K99	P95-T97 VanDerWaalsContact C-N 3.34Å; P95-T97 PolarHBondContact O-N 3.19Å; T97-K99 PolarHBondContact O-N 3.34Å; T97-K99 VanDerWaalsContact O-N 3.1Å
98	S	38.8	Very low	48.9	Very low	91 Å²	91	128 Å²	128	64%	0.636	69%	0.69	S	S	*	*			trans	-73.1	90.2	147.1	63.6	0	0	0	0	105.2	S96 Q100	S96-S98 PolarHBondContact O-N 3.42Å; S98-Q100 PolarHBondContact O-N 3.07Å
99	K	39.8	Very low	50.7	Low	184 Å²	184	135.1 Å²	135.1	80%	0.8	72%	0.719	S	S	*	*			trans	-57.4	96.6	167.5	-70.1	173.1	-177.7	169.1	0	106.1	T97 A101	T97-K99 PolarHBondContact O-N 3.34Å; T97-K99 VanDerWaalsContact O-N 3.1Å; K99-A101 PolarHBondContact O-N 3.24Å
100	Q	42.2	Very low	52.6	Low	169 Å²	169	134 Å²	134	79%	0.79	71%	0.705	S	S	*	*			trans	-45.1	112.3	150.5	-72.6	-75.8	-18.9	0	0	104.4	S98 K102	S98-Q100 PolarHBondContact O-N 3.07Å; Q100-K102 PolarHBondContact O-N 3.32Å
101	A	38.7	Very low	54.7	Low	87 Å²	87	131.9 Å²	131.9	72%	0.719	69%	0.691	S	S	*	*			trans	-55.1	107.7	179.1	0	0	0	0	0	105.8	K99 V103	K99-A101 PolarHBondContact O-N 3.24Å; A101-V103 PolarHBondContact O-N 3.05Å
102	K	46.2	Very low	56.8	Low	200 Å²	200	128 Å²	128	87%	0.87	68%	0.676	S	S	*	*			trans	-53.4	107	178.7	-71.7	-177.5	178.4	-177.5	0	106	Q100 K104	Q100-K102 PolarHBondContact O-N 3.32Å; K102-K104 PolarHBondContact O-N 3.4Å
103	V	57.7	Low	59.4	Low	135 Å²	135	127.9 Å²	127.9	82%	0.818	67%	0.667	S	S	*	*			trans	-56.4	115.3	171.6	179.1	0	0	0	0	104.5	A101	A101-V103 PolarHBondContact O-N 3.05Å
104	K	75.8	Confident	61.8	Low	181 Å²	181	125.2 Å²	125.2	79%	0.787	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-53.7	128.9	-178.1	-69.6	172.7	-179	172.3	0	107.1	K102 M106	K102-K104 PolarHBondContact O-N 3.4Å; K104-M106 PolarHBondContact O-N 3.31Å; K104-M106 VanDerWaalsContact O-N 3.07Å
105	P	73.9	Confident	64.5	Low	104 Å²	104	123 Å²	123	68%	0.675	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-59.3	120.7	178.8	24.7	-32.7	0	0	0	107.9	Y107	P105-Y107 PolarHBondContact O-N 3.17Å
106	M	74.4	Confident	67.1	Low	105 Å²	105	122.6 Å²	122.6	52%	0.517	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-63.8	116.2	177.6	-71.5	-73.7	-69.6	0	0	108.2	K104 D110 K114	K104-M106 PolarHBondContact O-N 3.31Å; K104-M106 VanDerWaalsContact O-N 3.07Å; M106-D110 HydrophobicContact CE-CB 3.91Å; M106-D110 HydrophobicContact SD-CB 4.12Å; M106-K114 HydrophobicContact CE-CB 4.26Å; M106-K114 HydrophobicContact CE-CD 3.71Å
107	Y	83.8	Confident	69.4	Low	172 Å²	172	123.9 Å²	123.9	68%	0.675	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-76.5	158.5	170.1	-96	-97.2	0	0	0	110.2	P105 K109 D110 Y111	P105-Y107 PolarHBondContact O-N 3.17Å; Y107-K109 PolarHBondContact O-N 2.83Å; Y107-K109 VanDerWaalsContact O-N 3.13Å; Y107-D110 PolarHBondContact N-OD2 3.28Å; Y107-D110 CarbonylContact O-C 3.17Å; Y107-D110 WeakPolarHBondContact O-CA 3.23Å; Y107-D110 WeakPolarHBondContact O-CB 2.91Å; Y107-D110 PolarHBondContact O-N 2.85Å; Y107-Y111 PolarHBondContact O-N 2.95Å
108	L	83.9	Confident	71.4	Confident	122 Å²	122	124.7 Å²	124.7	64%	0.639	61%	0.609	S	S	*	*	H	α-helix	trans	-52.8	-37.1	176.7	-173.5	65.1	0	0	0	112	D110 Y111 E112	L108-D110 PolarHBondContact O-N 3.09Å; L108-Y111 WeakPolarHBondContact O-CB 3.23Å; L108-Y111 PolarHBondContact O-N 2.67Å; L108-E112 WeakPolarHBondContact O-CB 3.41Å; L108-E112 VanDerWaalsContact O-CG 3.26Å; L108-E112 WeakPolarHBondContact O-CG 3.47Å; L108-E112 PolarHBondContact O-N 3.36Å
109	K	87.2	Confident	73.1	Confident	163 Å²	163	124 Å²	124	71%	0.709	59%	0.594	S	S	*	*	H	α-helix	trans	-66.2	-33.9	173.9	-66.3	-175.1	177	-177.5	0	113.5	Y107 R113	Y107-K109 PolarHBondContact O-N 2.83Å; Y107-K109 VanDerWaalsContact O-N 3.13Å; K109-R113 WeakPolarHBondContact O-CB 3.49Å; K109-R113 PolarHBondContact O-N 2.94Å
110	D	88.1	Confident	74.8	Confident	72 Å²	72	123.4 Å²	123.4	39%	0.385	59%	0.594	S	S	.	*	H	α-helix	trans	-73.6	-34.9	176.1	-59.9	-34.4	0	0	0	110.4	M106 Y107 L108 K114	M106-D110 HydrophobicContact CE-CB 3.91Å; M106-D110 HydrophobicContact SD-CB 4.12Å; Y107-D110 PolarHBondContact N-OD2 3.28Å; Y107-D110 CarbonylContact O-C 3.17Å; Y107-D110 WeakPolarHBondContact O-CA 3.23Å; Y107-D110 WeakPolarHBondContact O-CB 2.91Å; Y107-D110 PolarHBondContact O-N 2.85Å; L108-D110 PolarHBondContact O-N 3.09Å; D110-K114 WeakPolarHBondContact O-CB 3.35Å; D110-K114 PolarHBondContact O-N 3.14Å
111	Y	84.3	Confident	76.1	Confident	111 Å²	111	117 Å²	117	44%	0.435	57%	0.573	S	S	.	*	H	α-helix	trans	-65.3	-48.7	171	-179.4	-101	0	0	0	111.4	Y107 L108 R113 K114 V115	Y107-Y111 PolarHBondContact O-N 2.95Å; L108-Y111 WeakPolarHBondContact O-CB 3.23Å; L108-Y111 PolarHBondContact O-N 2.67Å; Y111-R113 VanDerWaalsContact C-N 3.34Å; Y111-R113 PolarHBondContact O-N 3.18Å; Y111-K114 CarbonylContact O-C 3.59Å; Y111-K114 PolarHBondContact O-N 2.7Å; Y111-K114 VanDerWaalsContact O-N 3.15Å; Y111-V115 HydrophobicContact CD1-CG2 4.17Å; Y111-V115 HydrophobicContact CE1-CG2 3.82Å; Y111-V115 HydrophobicContact CE2-CG2 4.2Å; Y111-V115 WeakPolarHBondContact O-CB 3.49Å; Y111-V115 VanDerWaalsContact O-CG2 3.27Å; Y111-V115 WeakPolarHBondContact O-CG2 3.33Å; Y111-V115 PolarHBondContact O-N 3.24Å
112	E	83.4	Confident	77.7	Confident	74 Å²	74	119.2 Å²	119.2	35%	0.346	57%	0.566	S	S	.	*	H	α-helix	trans	-58.2	-45.4	174.5	-72.1	167.5	-177.9	0	0	111.3	L108 K114 V115 I116	L108-E112 WeakPolarHBondContact O-CB 3.41Å; L108-E112 VanDerWaalsContact O-CG 3.26Å; L108-E112 WeakPolarHBondContact O-CG 3.47Å; L108-E112 PolarHBondContact O-N 3.36Å; E112-K114 VanDerWaalsContact C-N 3.33Å; E112-K114 PolarHBondContact O-N 3.47Å; E112-V115 PolarHBondContact O-N 3.02Å; E112-I116 WeakPolarHBondContact O-CD1 3.48Å; E112-I116 VanDerWaalsContact O-CG1 3.23Å; E112-I116 WeakPolarHBondContact O-CG1 3.23Å; E112-I116 PolarHBondContact O-N 2.88Å
113	R	85.1	Confident	78.4	Confident	172 Å²	172	114.9 Å²	114.9	65%	0.649	55%	0.545	S	S	*	.	H	α-helix	trans	-62.6	-40.4	176	-171.5	-178.2	-172.1	-154.1	0.9	111.7	K109 Y111 I116 L117	K109-R113 WeakPolarHBondContact O-CB 3.49Å; K109-R113 PolarHBondContact O-N 2.94Å; Y111-R113 VanDerWaalsContact C-N 3.34Å; Y111-R113 PolarHBondContact O-N 3.18Å; R113-I116 PolarHBondContact O-N 3.18Å; R113-L117 WeakPolarHBondContact O-CB 3.4Å; R113-L117 PolarHBondContact O-N 3.1Å
114	K	84.3	Confident	78.5	Confident	96 Å²	96	116.3 Å²	116.3	42%	0.417	54%	0.543	S	S	.	.	H	α-helix	trans	-67.3	-39.8	177.3	-170.4	175.1	-177	-178.9	0	111.4	M106 D110 Y111 E112 I116 L117 E118	M106-K114 HydrophobicContact CE-CB 4.26Å; M106-K114 HydrophobicContact CE-CD 3.71Å; D110-K114 WeakPolarHBondContact O-CB 3.35Å; D110-K114 PolarHBondContact O-N 3.14Å; Y111-K114 CarbonylContact O-C 3.59Å; Y111-K114 PolarHBondContact O-N 2.7Å; Y111-K114 VanDerWaalsContact O-N 3.15Å; E112-K114 VanDerWaalsContact C-N 3.33Å; E112-K114 PolarHBondContact O-N 3.47Å; K114-I116 VanDerWaalsContact C-N 3.32Å; K114-I116 PolarHBondContact O-N 3.12Å; K114-L117 PolarHBondContact O-N 2.82Å; K114-E118 WeakPolarHBondContact CE-OE1 3.15Å; K114-E118 WeakPolarHBondContact CE-OE2 3.46Å; K114-E118 VanDerWaalsContact CG-CD 3.43Å; K114-E118 HydrophobicContact CG-CG 4.09Å; K114-E118 WeakPolarHBondContact CG-OE2 3.26Å; K114-E118 IonicContact NZ-OE1 3.93Å; K114-E118 VanDerWaalsContact O-CB 3.26Å; K114-E118 WeakPolarHBondContact O-CB 3.36Å; K114-E118 PolarHBondContact O-N 3.36Å
115	V	85.9	Confident	77.2	Confident	7 Å²	7	115.2 Å²	115.2	4%	0.042	55%	0.546	C	S	.	.	H	α-helix	trans	-65	-35.7	172.5	172	0	0	0	0	111.2	Y111 E112 K119 E120 G121 Y123	Y111-V115 HydrophobicContact CD1-CG2 4.17Å; Y111-V115 HydrophobicContact CE1-CG2 3.82Å; Y111-V115 HydrophobicContact CE2-CG2 4.2Å; Y111-V115 WeakPolarHBondContact O-CB 3.49Å; Y111-V115 VanDerWaalsContact O-CG2 3.27Å; Y111-V115 WeakPolarHBondContact O-CG2 3.33Å; Y111-V115 PolarHBondContact O-N 3.24Å; E112-V115 PolarHBondContact O-N 3.02Å; V115-K119 HydrophobicContact CG1-CB 4.27Å; V115-K119 CarbonylContact O-C 3.32Å; V115-K119 WeakPolarHBondContact O-CA 3.16Å; V115-K119 VanDerWaalsContact O-CB 3.25Å; V115-K119 WeakPolarHBondContact O-CB 3.09Å; V115-K119 PolarHBondContact O-N 3.18Å; V115-E120 PolarHBondContact O-N 2.78Å; V115-E120 VanDerWaalsContact O-N 3.15Å; V115-G121 PolarHBondContact O-N 3.46Å; V115-Y123 HydrophobicContact CB-CE1 4.5Å; V115-Y123 HydrophobicContact CG1-CD1 4.13Å; V115-Y123 HydrophobicContact CG1-CE1 3.96Å
116	I	84	Confident	76.1	Confident	107 Å²	107	117 Å²	117	55%	0.549	55%	0.55	S	S	.	.	H	α-helix	trans	-71	-38.2	174.3	-66.7	162.8	0	0	0	111.8	E112 R113 K114 E120	E112-I116 WeakPolarHBondContact O-CD1 3.48Å; E112-I116 VanDerWaalsContact O-CG1 3.23Å; E112-I116 WeakPolarHBondContact O-CG1 3.23Å; E112-I116 PolarHBondContact O-N 2.88Å; R113-I116 PolarHBondContact O-N 3.18Å; K114-I116 VanDerWaalsContact C-N 3.32Å; K114-I116 PolarHBondContact O-N 3.12Å; I116-E120 VanDerWaalsContact O-CA 3.24Å; I116-E120 WeakPolarHBondContact O-CA 3.47Å; I116-E120 PolarHBondContact O-N 3.5Å
117	L	84.4	Confident	74.4	Confident	132 Å²	132	118.4 Å²	118.4	69%	0.691	56%	0.559	S	S	*	*	H	α-helix	trans	-79	-42.5	-177.9	-116.1	161	0	0	0	113.3	R113 K114	R113-L117 WeakPolarHBondContact O-CB 3.4Å; R113-L117 PolarHBondContact O-N 3.1Å; K114-L117 PolarHBondContact O-N 2.82Å
118	E	78	Confident	72.7	Confident	135 Å²	135	118.9 Å²	118.9	63%	0.631	57%	0.573	S	S	*	*	H	α-helix	trans	-95.7	-31.9	-174.4	-63.8	179.4	174.7	0	0	112.7	K114	K114-E118 WeakPolarHBondContact CE-OE1 3.15Å; K114-E118 WeakPolarHBondContact CE-OE2 3.46Å; K114-E118 VanDerWaalsContact CG-CD 3.43Å; K114-E118 HydrophobicContact CG-CG 4.09Å; K114-E118 WeakPolarHBondContact CG-OE2 3.26Å; K114-E118 IonicContact NZ-OE1 3.93Å; K114-E118 VanDerWaalsContact O-CB 3.26Å; K114-E118 WeakPolarHBondContact O-CB 3.36Å; K114-E118 PolarHBondContact O-N 3.36Å
119	K	74.6	Confident	71	Confident	75 Å²	75	115.7 Å²	115.7	33%	0.326	56%	0.561	S	S	.	*	S	Bend	trans	-115.2	11.2	-177.5	-63.6	-178.5	169.5	178	0	113.2	V115 G121 K122 E124	V115-K119 HydrophobicContact CG1-CB 4.27Å; V115-K119 CarbonylContact O-C 3.32Å; V115-K119 WeakPolarHBondContact O-CA 3.16Å; V115-K119 VanDerWaalsContact O-CB 3.25Å; V115-K119 WeakPolarHBondContact O-CB 3.09Å; V115-K119 PolarHBondContact O-N 3.18Å; K119-G121 PolarHBondContact O-N 2.92Å; K119-K122 PolarHBondContact O-N 3.45Å; K119-E124 IonicContact NZ-OE1 3.07Å; K119-E124 PolarHBondContact NZ-OE1 2.9Å; K119-E124 IonicContact NZ-OE2 2.66Å
120	E	75.9	Confident	69.4	Low	173 Å²	173	115 Å²	115	81%	0.808	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.3	21.8	-179.9	-59	-174.5	156.6	0	0	114.4	V115 I116	V115-E120 PolarHBondContact O-N 2.78Å; V115-E120 VanDerWaalsContact O-N 3.15Å; I116-E120 VanDerWaalsContact O-CA 3.24Å; I116-E120 WeakPolarHBondContact O-CA 3.47Å; I116-E120 PolarHBondContact O-N 3.5Å
121	G	68.2	Low	67.8	Low	33 Å²	33	119.2 Å²	119.2	34%	0.34	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	90.2	10.6	-178.7	0	0	0	0	0	115.3	V115 K119	V115-G121 PolarHBondContact O-N 3.46Å; K119-G121 PolarHBondContact O-N 2.92Å
122	K	71.9	Confident	66.5	Low	134 Å²	134	118.4 Å²	118.4	58%	0.583	58%	0.583	S	S	*	*			trans	-86.6	116.8	172.4	-62.1	-173.6	-178.1	-176.4	0	111	K119	K119-K122 PolarHBondContact O-N 3.45Å
123	Y	62.4	Low	65.4	Low	110 Å²	110	120.6 Å²	120.6	43%	0.431	59%	0.593	S	S	.	*			trans	-83.6	140.2	170.3	-66.3	-86.3	0	0	0	108.8	V115 D125 D126	V115-Y123 HydrophobicContact CB-CE1 4.5Å; V115-Y123 HydrophobicContact CG1-CD1 4.13Å; V115-Y123 HydrophobicContact CG1-CE1 3.96Å; Y123-D125 PolarHBondContact O-N 3.34Å; Y123-D126 PolarHBondContact O-N 3.01Å
124	E	60.1	Low	64.3	Low	164 Å²	164	114.6 Å²	114.6	77%	0.766	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	1.2	-176.3	-73.2	173.4	164	0	0	114.8	K119	K119-E124 IonicContact NZ-OE1 3.07Å; K119-E124 PolarHBondContact NZ-OE1 2.9Å; K119-E124 IonicContact NZ-OE2 2.66Å
125	D	47.5	Very low	63.3	Low	158 Å²	158	112.2 Å²	112.2	85%	0.845	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-5.7	-177.6	-146.3	23	0	0	0	112.9	Y123	Y123-D125 PolarHBondContact O-N 3.34Å
126	D	51.4	Low	62.4	Low	143 Å²	143	117.5 Å²	117.5	77%	0.765	60%	0.601	S	S	*	*	S	Bend	trans	-119.2	99.2	174.4	-85.1	-37.1	0	0	0	109.9	Y123	Y123-D126 PolarHBondContact O-N 3.01Å
127	D	38.5	Very low	61.5	Low	133 Å²	133	121.1 Å²	121.1	71%	0.711	61%	0.608	S	S	*	*			trans	126	75.9	150.2	-143	14.1	0	0	0	115.5	S129	D127-S129 PolarHBondContact O-N 2.93Å
128	D	47.2	Very low	60.6	Low	182 Å²	182	124.3 Å²	124.3	97%	0.973	61%	0.611	S	S	*	*			trans	-65.8	80.5	156.6	-82.3	-36.4	0	0	0	109.6
129	S	47.9	Very low	59.9	Low	55 Å²	55	124.3 Å²	124.3	39%	0.385	61%	0.611	S	S	.	*			trans	-121.8	131.7	169	73.3	0	0	0	0	111.8	D127 E131 E132	D127-S129 PolarHBondContact O-N 2.93Å; S129-E131 PolarHBondContact O-N 3.48Å; S129-E132 PolarHBondContact O-N 2.86Å
130	D	54.5	Low	59.5	Low	150 Å²	150	130.9 Å²	130.9	80%	0.802	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52	-5.2	-176.5	-74.2	-37.7	0	0	0	115.8
131	E	54.8	Low	59	Low	159 Å²	159	126.8 Å²	126.8	74%	0.743	63%	0.63	S	S	*	*	H	α-helix	trans	-76.7	-31.5	-179.6	-155.7	81.7	-145.6	0	0	112.4	S129 A134 A135	S129-E131 PolarHBondContact O-N 3.48Å; E131-A134 PolarHBondContact O-N 3.4Å; E131-A135 PolarHBondContact O-N 3.43Å
132	E	56.8	Low	59.2	Low	94 Å²	94	129.1 Å²	129.1	44%	0.439	65%	0.645	S	S	.	*	H	α-helix	trans	-73.7	-33	180	-87	-152.6	178	0	0	113.7	S129 A134 A135 K136	S129-E132 PolarHBondContact O-N 2.86Å; E132-A134 VanDerWaalsContact C-N 3.27Å; E132-A134 PolarHBondContact O-N 2.92Å; E132-A135 PolarHBondContact O-N 3.42Å; E132-K136 WeakPolarHBondContact O-CG 3.47Å; E132-K136 PolarHBondContact O-N 3.45Å; E132-K136 IonicContact OE2-NZ 3.88Å; E132-K136 PolarHBondContact OE2-NZ 3.12Å
133	E	60.5	Low	59.2	Low	121 Å²	121	126 Å²	126	57%	0.565	64%	0.64	S	S	*	*	H	α-helix	trans	-66.3	-32.5	174.8	-80.2	-159.6	154.5	0	0	111.8	R137	E133-R137 WeakPolarHBondContact O-CB 3.27Å; E133-R137 PolarHBondContact O-N 2.89Å
134	A	61.6	Low	59.9	Low	46 Å²	46	123.5 Å²	123.5	38%	0.38	64%	0.638	S	S	.	*	H	α-helix	trans	-70.2	-36.8	175.4	0	0	0	0	0	111.8	E131 E132 R138	E131-A134 PolarHBondContact O-N 3.4Å; E132-A134 VanDerWaalsContact C-N 3.27Å; E132-A134 PolarHBondContact O-N 2.92Å; A134-R138 WeakPolarHBondContact O-CG 3.2Å; A134-R138 PolarHBondContact O-N 3.27Å; A134-R138 VanDerWaalsContact O-N 3.12Å
135	A	63	Low	61	Low	46 Å²	46	118.8 Å²	118.8	38%	0.38	62%	0.623	S	S	.	*	H	α-helix	trans	-67.1	-47	173.6	0	0	0	0	0	111.8	E131 E132 R137 R138 E139	E131-A135 PolarHBondContact O-N 3.43Å; E132-A135 PolarHBondContact O-N 3.42Å; A135-R137 VanDerWaalsContact C-N 3.3Å; A135-R137 PolarHBondContact O-N 3.27Å; A135-R138 CarbonylContact O-C 3.54Å; A135-R138 WeakPolarHBondContact O-CA 3.23Å; A135-R138 WeakPolarHBondContact O-CB 3.37Å; A135-R138 PolarHBondContact O-N 2.89Å; A135-E139 PolarHBondContact O-N 3.15Å
136	K	67.1	Low	62.6	Low	118 Å²	118	118.9 Å²	118.9	51%	0.513	61%	0.612	S	S	.	*	H	α-helix	trans	-61.6	-34.9	176.9	-70.7	168.2	-171.2	158.9	0	112.6	E132 R140	E132-K136 WeakPolarHBondContact O-CG 3.47Å; E132-K136 PolarHBondContact O-N 3.45Å; E132-K136 IonicContact OE2-NZ 3.88Å; E132-K136 PolarHBondContact OE2-NZ 3.12Å; K136-R140 WeakPolarHBondContact O-CB 3.26Å; K136-R140 PolarHBondContact O-N 3.29Å
137	R	65.4	Low	64.3	Low	182 Å²	182	116.9 Å²	116.9	69%	0.687	60%	0.601	S	S	*	*	H	α-helix	trans	-68.3	-36.2	171.5	-83.3	-174.2	178.6	125.9	2.6	113	E133 A135 A141	E133-R137 WeakPolarHBondContact O-CB 3.27Å; E133-R137 PolarHBondContact O-N 2.89Å; A135-R137 VanDerWaalsContact C-N 3.3Å; A135-R137 PolarHBondContact O-N 3.27Å; R137-A141 WeakPolarHBondContact O-CB 3.36Å; R137-A141 PolarHBondContact O-N 3.2Å; R137-A141 VanDerWaalsContact O-N 3.08Å
138	R	65.9	Low	66.3	Low	199 Å²	199	115.5 Å²	115.5	75%	0.751	59%	0.59	S	S	*	*	H	α-helix	trans	-70.5	-38	174.7	-77	-179.5	-177.7	177.5	4.6	112	A134 A135 A141 A142	A134-R138 WeakPolarHBondContact O-CG 3.2Å; A134-R138 PolarHBondContact O-N 3.27Å; A134-R138 VanDerWaalsContact O-N 3.12Å; A135-R138 CarbonylContact O-C 3.54Å; A135-R138 WeakPolarHBondContact O-CA 3.23Å; A135-R138 WeakPolarHBondContact O-CB 3.37Å; A135-R138 PolarHBondContact O-N 2.89Å; R138-A141 CarbonylContact O-C 3.58Å; R138-A141 PolarHBondContact O-N 3Å; R138-A142 WeakPolarHBondContact O-CB 3.42Å; R138-A142 PolarHBondContact O-N 3.04Å
139	E	63.2	Low	68.1	Low	135 Å²	135	111.2 Å²	111.2	63%	0.631	56%	0.564	S	S	*	*	H	α-helix	trans	-67.2	-40.8	175.2	-73	177.6	171.6	0	0	112.1	A135 A141 A142 S143	A135-E139 PolarHBondContact O-N 3.15Å; E139-A141 VanDerWaalsContact C-N 3.27Å; E139-A141 PolarHBondContact O-N 2.92Å; E139-A142 CarbonylContact O-C 3.54Å; E139-A142 PolarHBondContact O-N 2.87Å; E139-S143 PolarHBondContact O-N 2.76Å
140	R	65.4	Low	70	Confident	213 Å²	213	111.8 Å²	111.8	80%	0.804	56%	0.561	S	S	*	*	H	α-helix	trans	-66.6	-27.3	172	-175.4	178.1	-91.2	167.3	-7	113	K136 A142 S143	K136-R140 WeakPolarHBondContact O-CB 3.26Å; K136-R140 PolarHBondContact O-N 3.29Å; R140-A142 VanDerWaalsContact C-N 3.34Å; R140-S143 PolarHBondContact O-OG 3.16Å
141	A	66.4	Low	71.6	Confident	88 Å²	88	110.4 Å²	110.4	73%	0.727	55%	0.548	S	S	*	.	H	α-helix	trans	-80.1	-17.8	172.3	0	0	0	0	0	112.8	R137 R138 E139	R137-A141 WeakPolarHBondContact O-CB 3.36Å; R137-A141 PolarHBondContact O-N 3.2Å; R137-A141 VanDerWaalsContact O-N 3.08Å; R138-A141 CarbonylContact O-C 3.58Å; R138-A141 PolarHBondContact O-N 3Å; E139-A141 VanDerWaalsContact C-N 3.27Å; E139-A141 PolarHBondContact O-N 2.92Å
142	A	70.9	Confident	73.2	Confident	81 Å²	81	107 Å²	107	67%	0.669	53%	0.534	S	S	*	.	H	α-helix	trans	-100.4	-6.4	178.6	0	0	0	0	0	113.5	R138 E139 R140	R138-A142 WeakPolarHBondContact O-CB 3.42Å; R138-A142 PolarHBondContact O-N 3.04Å; E139-A142 CarbonylContact O-C 3.54Å; E139-A142 PolarHBondContact O-N 2.87Å; R140-A142 VanDerWaalsContact C-N 3.34Å
143	S	72.8	Confident	74.6	Confident	68 Å²	68	107.9 Å²	107.9	48%	0.476	54%	0.541	S	S	.	.	S	Bend	trans	-64.4	130	172.2	59	0	0	0	0	109.7	E139 R140	E139-S143 PolarHBondContact O-N 2.76Å; R140-S143 PolarHBondContact O-OG 3.16Å
144	P	76.3	Confident	75.9	Confident	59 Å²	59	108.8 Å²	108.8	38%	0.383	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-53.4	149.1	177	-24.8	33.9	0	0	0	111.8	Q148 E149	P144-Q148 HydrophobicContact CB-CB 3.78Å; P144-E149 HydrophobicContact CB-CG 4.21Å
145	S	84.7	Confident	77.2	Confident	64 Å²	64	111.4 Å²	111.4	45%	0.448	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-61.2	149.3	172.8	177.8	0	0	0	0	109.8	I147 Q148 E149	S145-I147 PolarHBondContact O-N 2.66Å; S145-Q148 CarbonylContact O-C 3.46Å; S145-Q148 WeakPolarHBondContact O-CA 3.43Å; S145-Q148 VanDerWaalsContact O-CB 3.32Å; S145-Q148 WeakPolarHBondContact O-CB 3.19Å; S145-Q148 PolarHBondContact O-N 2.69Å; S145-E149 PolarHBondContact O-N 2.99Å
146	Y	79.4	Confident	78.5	Confident	160 Å²	160	112.1 Å²	112.1	63%	0.627	55%	0.55	S	S	*	*	H	α-helix	trans	-46.8	-32.1	171.9	-179.2	-111.1	0	0	0	113.5	Q150	Y146-Q150 HydrophobicContact CE1-CG 4.27Å; Y146-Q150 WeakPolarHBondContact O-CB 3.34Å; Y146-Q150 VanDerWaalsContact O-CG 3.32Å; Y146-Q150 WeakPolarHBondContact O-CG 3.45Å; Y146-Q150 PolarHBondContact O-N 3.05Å; Y146-Q150 PolarHBondContact OH-NE2 3.27Å
147	I	87.4	Confident	79.4	Confident	101 Å²	101	113.5 Å²	113.5	52%	0.518	56%	0.556	S	S	.	*	H	α-helix	trans	-72.7	-34.7	175.8	-62.2	168.1	0	0	0	112.1	S145 K151	S145-I147 PolarHBondContact O-N 2.66Å; I147-K151 VanDerWaalsContact O-CG 3.28Å; I147-K151 WeakPolarHBondContact O-CG 3.48Å; I147-K151 PolarHBondContact O-N 2.94Å; I147-K151 VanDerWaalsContact O-N 3.1Å
148	Q	81.8	Confident	80.3	Confident	105 Å²	105	112.6 Å²	112.6	49%	0.491	55%	0.553	S	S	.	*	H	α-helix	trans	-70	-43.9	172.7	-71.5	171.5	-30.8	0	0	110.2	P144 S145 Q150 K151 D152	P144-Q148 HydrophobicContact CB-CB 3.78Å; S145-Q148 CarbonylContact O-C 3.46Å; S145-Q148 WeakPolarHBondContact O-CA 3.43Å; S145-Q148 VanDerWaalsContact O-CB 3.32Å; S145-Q148 WeakPolarHBondContact O-CB 3.19Å; S145-Q148 PolarHBondContact O-N 2.69Å; Q148-Q150 VanDerWaalsContact C-N 3.34Å; Q148-Q150 PolarHBondContact O-N 3Å; Q148-K151 WeakPolarHBondContact O-CB 3.12Å; Q148-K151 PolarHBondContact O-N 3.37Å; Q148-D152 PolarHBondContact O-N 2.97Å
149	E	84.8	Confident	81.1	Confident	91 Å²	91	109 Å²	109	43%	0.425	54%	0.543	S	S	.	.	H	α-helix	trans	-59.2	-43	174	-63.8	-178.7	158.7	0	0	112	P144 S145 K151 D152 L153	P144-E149 HydrophobicContact CB-CG 4.21Å; S145-E149 PolarHBondContact O-N 2.99Å; E149-K151 VanDerWaalsContact C-N 3.3Å; E149-K151 PolarHBondContact O-N 3.15Å; E149-D152 PolarHBondContact O-N 3.41Å; E149-L153 VanDerWaalsContact O-CB 3.32Å; E149-L153 WeakPolarHBondContact O-CB 3.38Å; E149-L153 VanDerWaalsContact O-CG 3.27Å; E149-L153 WeakPolarHBondContact O-CG 3.31Å; E149-L153 PolarHBondContact O-N 3.44Å
150	Q	87	Confident	81.8	Confident	68 Å²	68	108.3 Å²	108.3	32%	0.318	54%	0.538	S	S	.	.	H	α-helix	trans	-63.8	-33.5	174	-78.6	-172.3	-7.3	0	0	113.2	Y146 Q148 K154	Y146-Q150 HydrophobicContact CE1-CG 4.27Å; Y146-Q150 WeakPolarHBondContact O-CB 3.34Å; Y146-Q150 VanDerWaalsContact O-CG 3.32Å; Y146-Q150 WeakPolarHBondContact O-CG 3.45Å; Y146-Q150 PolarHBondContact O-N 3.05Å; Y146-Q150 PolarHBondContact OH-NE2 3.27Å; Q148-Q150 VanDerWaalsContact C-N 3.34Å; Q148-Q150 PolarHBondContact O-N 3Å; Q150-K154 WeakPolarHBondContact O-CB 3.5Å; Q150-K154 WeakPolarHBondContact O-CG 3.42Å; Q150-K154 PolarHBondContact O-N 2.81Å
151	K	88.6	Confident	82.5	Confident	121 Å²	121	101.7 Å²	101.7	53%	0.526	52%	0.521	S	S	.	.	H	α-helix	trans	-73.6	-44	176.9	-78.6	176.4	179.2	-175.5	0	110.9	I147 Q148 E149 L153 K154 E155	I147-K151 VanDerWaalsContact O-CG 3.28Å; I147-K151 WeakPolarHBondContact O-CG 3.48Å; I147-K151 PolarHBondContact O-N 2.94Å; I147-K151 VanDerWaalsContact O-N 3.1Å; Q148-K151 WeakPolarHBondContact O-CB 3.12Å; Q148-K151 PolarHBondContact O-N 3.37Å; E149-K151 VanDerWaalsContact C-N 3.3Å; E149-K151 PolarHBondContact O-N 3.15Å; K151-L153 VanDerWaalsContact C-N 3.27Å; K151-L153 PolarHBondContact O-N 3.39Å; K151-K154 CarbonylContact O-C 3.59Å; K151-K154 PolarHBondContact O-N 3.3Å; K151-E155 WeakPolarHBondContact O-CB 3.36Å; K151-E155 WeakPolarHBondContact O-CG 3.39Å; K151-E155 PolarHBondContact O-N 3.11Å
152	D	87.9	Confident	82.9	Confident	86 Å²	86	102.2 Å²	102.2	46%	0.46	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-37.5	176.1	-63.7	-15	0	0	0	110.7	Q148 E149 E155 S156	Q148-D152 PolarHBondContact O-N 2.97Å; E149-D152 PolarHBondContact O-N 3.41Å; D152-E155 PolarHBondContact O-N 3.18Å; D152-S156 VanDerWaalsContact O-CB 3.27Å; D152-S156 WeakPolarHBondContact O-CB 3.23Å; D152-S156 PolarHBondContact O-N 3.02Å; D152-S156 PolarHBondContact O-OG 3.45Å
153	L	85.6	Confident	82.6	Confident	113 Å²	113	103.8 Å²	103.8	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-66.2	-40.4	170.8	-77.5	168.5	0	0	0	112.7	E149 K151 E155 S156 F157	E149-L153 VanDerWaalsContact O-CB 3.32Å; E149-L153 WeakPolarHBondContact O-CB 3.38Å; E149-L153 VanDerWaalsContact O-CG 3.27Å; E149-L153 WeakPolarHBondContact O-CG 3.31Å; E149-L153 PolarHBondContact O-N 3.44Å; K151-L153 VanDerWaalsContact C-N 3.27Å; K151-L153 PolarHBondContact O-N 3.39Å; L153-E155 VanDerWaalsContact C-N 3.34Å; L153-S156 WeakPolarHBondContact CA-OG 3.42Å; L153-S156 PolarHBondContact O-OG 2.84Å; L153-F157 VanDerWaalsContact O-CB 3.24Å; L153-F157 WeakPolarHBondContact O-CB 3.49Å; L153-F157 PolarHBondContact O-N 2.79Å
154	K	89.5	Confident	82.2	Confident	140 Å²	140	103.5 Å²	103.5	61%	0.609	50%	0.504	S	S	*	.	H	α-helix	trans	-69.3	-34.9	175.8	-78.1	171.7	-179.3	178.9	0	112	Q150 K151 R158	Q150-K154 WeakPolarHBondContact O-CB 3.5Å; Q150-K154 WeakPolarHBondContact O-CG 3.42Å; Q150-K154 PolarHBondContact O-N 2.81Å; K151-K154 CarbonylContact O-C 3.59Å; K151-K154 PolarHBondContact O-N 3.3Å; K154-R158 VanDerWaalsContact O-CB 3.22Å; K154-R158 WeakPolarHBondContact O-CB 3.28Å; K154-R158 PolarHBondContact O-N 3.29Å
155	E	89.1	Confident	81.1	Confident	101 Å²	101	107 Å²	107	47%	0.472	52%	0.52	S	S	.	.	H	α-helix	trans	-75.3	-37.2	177.1	-73.7	178.9	-164.8	0	0	111.3	K151 D152 L153 R158 K159	K151-E155 WeakPolarHBondContact O-CB 3.36Å; K151-E155 WeakPolarHBondContact O-CG 3.39Å; K151-E155 PolarHBondContact O-N 3.11Å; D152-E155 PolarHBondContact O-N 3.18Å; L153-E155 VanDerWaalsContact C-N 3.34Å; E155-R158 PolarHBondContact O-N 3.31Å; E155-K159 WeakPolarHBondContact O-CB 3.25Å; E155-K159 VanDerWaalsContact O-CG 3.24Å; E155-K159 WeakPolarHBondContact O-CG 3.33Å; E155-K159 PolarHBondContact O-N 3.49Å
156	S	88.7	Confident	79.4	Confident	62 Å²	62	112 Å²	112	43%	0.434	54%	0.535	S	S	.	.	H	α-helix	trans	-68.2	-39.5	172.5	70.1	0	0	0	0	111.5	D152 L153 K159 F160	D152-S156 VanDerWaalsContact O-CB 3.27Å; D152-S156 WeakPolarHBondContact O-CB 3.23Å; D152-S156 PolarHBondContact O-N 3.02Å; D152-S156 PolarHBondContact O-OG 3.45Å; L153-S156 WeakPolarHBondContact CA-OG 3.42Å; L153-S156 PolarHBondContact O-OG 2.84Å; S156-K159 PolarHBondContact O-N 2.9Å; S156-F160 VanDerWaalsContact O-CB 3.25Å; S156-F160 WeakPolarHBondContact O-CB 3.4Å; S156-F160 PolarHBondContact O-N 2.84Å
157	F	86.6	Confident	77.9	Confident	146 Å²	146	112.8 Å²	112.8	64%	0.64	55%	0.545	S	S	*	.	H	α-helix	trans	-67.2	-39.3	174	-154.5	-85.3	0	0	0	111.5	L153 F160 V161	L153-F157 VanDerWaalsContact O-CB 3.24Å; L153-F157 WeakPolarHBondContact O-CB 3.49Å; L153-F157 PolarHBondContact O-N 2.79Å; F157-F160 PolarHBondContact O-N 3.47Å; F157-V161 HydrophobicContact CD1-CG2 3.97Å; F157-V161 HydrophobicContact CE1-CG2 3.94Å; F157-V161 WeakPolarHBondContact O-CB 3.44Å; F157-V161 VanDerWaalsContact O-CG2 3.27Å; F157-V161 WeakPolarHBondContact O-CG2 3.45Å; F157-V161 PolarHBondContact O-N 2.8Å
158	R	84.8	Confident	75.7	Confident	163 Å²	163	116.6 Å²	116.6	62%	0.615	56%	0.561	S	S	*	*	H	α-helix	trans	-64.2	-46.9	174.5	-171.7	-173.1	-59.9	-153.7	-1.6	111.5	K154 E155 F160 V161 E162	K154-R158 VanDerWaalsContact O-CB 3.22Å; K154-R158 WeakPolarHBondContact O-CB 3.28Å; K154-R158 PolarHBondContact O-N 3.29Å; E155-R158 PolarHBondContact O-N 3.31Å; R158-F160 VanDerWaalsContact C-N 3.32Å; R158-F160 PolarHBondContact O-N 3.06Å; R158-V161 PolarHBondContact O-N 2.92Å; R158-E162 WeakPolarHBondContact CD-OE1 3.47Å; R158-E162 HydrophobicContact CG-CG 4.29Å; R158-E162 WeakPolarHBondContact CG-OE1 3.02Å; R158-E162 WeakPolarHBondContact O-CB 3.44Å; R158-E162 WeakPolarHBondContact O-CG 3.35Å; R158-E162 PolarHBondContact O-N 3.34Å
159	K	81.4	Confident	74	Confident	123 Å²	123	120.8 Å²	120.8	54%	0.535	58%	0.58	S	S	.	*	H	α-helix	trans	-60.4	-41.3	175.1	-75.8	174.1	-177.8	174.6	0	112	E155 S156 V161 E162 D163	E155-K159 WeakPolarHBondContact O-CB 3.25Å; E155-K159 VanDerWaalsContact O-CG 3.24Å; E155-K159 WeakPolarHBondContact O-CG 3.33Å; E155-K159 PolarHBondContact O-N 3.49Å; S156-K159 PolarHBondContact O-N 2.9Å; K159-V161 VanDerWaalsContact C-N 3.32Å; K159-V161 PolarHBondContact O-N 3.32Å; K159-E162 PolarHBondContact O-N 3.12Å; K159-D163 VanDerWaalsContact O-CB 3.23Å; K159-D163 WeakPolarHBondContact O-CB 3.47Å; K159-D163 PolarHBondContact O-N 3.2Å
160	F	78.7	Confident	71.6	Confident	121 Å²	121	125.6 Å²	125.6	53%	0.531	60%	0.603	S	S	.	*	H	α-helix	trans	-66.5	-33.8	177.4	-176.8	-100.3	0	0	0	112.9	S156 F157 R158 S164 L177	S156-F160 VanDerWaalsContact O-CB 3.25Å; S156-F160 WeakPolarHBondContact O-CB 3.4Å; S156-F160 PolarHBondContact O-N 2.84Å; F157-F160 PolarHBondContact O-N 3.47Å; R158-F160 VanDerWaalsContact C-N 3.32Å; R158-F160 PolarHBondContact O-N 3.06Å; F160-S164 WeakPolarHBondContact O-CB 3.42Å; F160-S164 PolarHBondContact O-N 3.47Å; F160-L177 HydrophobicContact CE1-CD2 3.56Å; F160-L177 HydrophobicContact CZ-CD2 3.66Å
161	V	81.1	Confident	69.5	Low	75 Å²	75	132.2 Å²	132.2	46%	0.455	63%	0.634	S	S	.	*	H	α-helix	trans	-74.4	-41	173.1	171.5	0	0	0	0	111.1	F157 R158 K159 S164 D165	F157-V161 HydrophobicContact CD1-CG2 3.97Å; F157-V161 HydrophobicContact CE1-CG2 3.94Å; F157-V161 WeakPolarHBondContact O-CB 3.44Å; F157-V161 VanDerWaalsContact O-CG2 3.27Å; F157-V161 WeakPolarHBondContact O-CG2 3.45Å; F157-V161 PolarHBondContact O-N 2.8Å; R158-V161 PolarHBondContact O-N 2.92Å; K159-V161 VanDerWaalsContact C-N 3.32Å; K159-V161 PolarHBondContact O-N 3.32Å; V161-S164 PolarHBondContact O-N 3.29Å; V161-D165 WeakPolarHBondContact O-CB 3.39Å; V161-D165 PolarHBondContact O-N 2.9Å; V161-D165 VanDerWaalsContact O-N 3.11Å
162	E	73.6	Confident	67.2	Low	98 Å²	98	129.9 Å²	129.9	46%	0.458	64%	0.644	S	S	.	*	H	α-helix	trans	-65	-44.8	176	-75	169.8	178	0	0	111.3	R158 K159 S164 D165 E166	R158-E162 WeakPolarHBondContact CD-OE1 3.47Å; R158-E162 HydrophobicContact CG-CG 4.29Å; R158-E162 WeakPolarHBondContact CG-OE1 3.02Å; R158-E162 WeakPolarHBondContact O-CB 3.44Å; R158-E162 WeakPolarHBondContact O-CG 3.35Å; R158-E162 PolarHBondContact O-N 3.34Å; K159-E162 PolarHBondContact O-N 3.12Å; E162-S164 PolarHBondContact O-N 3.42Å; E162-D165 PolarHBondContact O-N 2.75Å; E162-E166 WeakPolarHBondContact O-CB 3.46Å; E162-E166 PolarHBondContact O-N 2.96Å
163	D	65.9	Low	64.9	Low	115 Å²	115	132.4 Å²	132.4	62%	0.615	65%	0.653	S	S	*	*	H	α-helix	trans	-63	-23.6	174.1	-71.3	-18.5	0	0	0	112.2	K159	K159-D163 VanDerWaalsContact O-CB 3.23Å; K159-D163 WeakPolarHBondContact O-CB 3.47Å; K159-D163 PolarHBondContact O-N 3.2Å
164	S	64.3	Low	62.9	Low	62 Å²	62	132.4 Å²	132.4	43%	0.434	67%	0.669	S	S	.	*	H	α-helix	trans	-87.4	-14.9	174.9	-177	0	0	0	0	113.6	F160 V161 E162 L177	F160-S164 WeakPolarHBondContact O-CB 3.42Å; F160-S164 PolarHBondContact O-N 3.47Å; V161-S164 PolarHBondContact O-N 3.29Å; E162-S164 PolarHBondContact O-N 3.42Å; S164-L177 WeakPolarHBondContact OG-CD1 3.35Å
165	D	51.5	Low	60.9	Low	133 Å²	133	130.2 Å²	130.2	71%	0.711	67%	0.671	S	S	*	*	H	α-helix	trans	-105.2	-21	-177.9	-152.5	40.6	0	0	0	111.4	V161 E162	V161-D165 WeakPolarHBondContact O-CB 3.39Å; V161-D165 PolarHBondContact O-N 2.9Å; V161-D165 VanDerWaalsContact O-N 3.11Å; E162-D165 PolarHBondContact O-N 2.75Å
166	E	49.5	Very low	59.2	Low	167 Å²	167	132.5 Å²	132.5	78%	0.78	68%	0.68	S	S	*	*	S	Bend	trans	-91.4	-6.1	-176.7	-144.2	169.6	-154.8	0	0	114.3	E162	E162-E166 WeakPolarHBondContact O-CB 3.46Å; E162-E166 PolarHBondContact O-N 2.96Å
167	E	47.4	Very low	57.9	Low	178 Å²	178	134.7 Å²	134.7	83%	0.832	69%	0.686	S	S	*	*			trans	-105.5	63.8	169.2	-74.2	-165.8	166.7	0	0	111.8
168	E	43	Very low	56.4	Low	181 Å²	181	135.1 Å²	135.1	85%	0.846	69%	0.694	S	S	*	*			trans	-103	75.6	167.9	-153.4	-180	-145.5	0	0	110.2
169	E	45.8	Very low	55.2	Low	192 Å²	192	133 Å²	133	90%	0.897	70%	0.7	S	S	*	*	S	Bend	trans	-161.8	49.5	156.9	-118.6	-178.9	-148.2	0	0	113.8
170	E	34.7	Very low	54.2	Low	192 Å²	192	138.5 Å²	138.5	90%	0.897	72%	0.717	S	S	*	*			trans	-155.9	110.1	151	-136.2	172.5	-179.1	0	0	111.6	G172	E170-G172 PolarHBondContact O-N 2.88Å
171	E	41.1	Very low	53.8	Low	208 Å²	208	140.2 Å²	140.2	97%	0.972	72%	0.72	S	S	*	*			trans	-54.9	120.4	175.3	-74.3	-176.7	140.6	0	0	111.4
172	G	40.8	Very low	53.5	Low	71 Å²	71	144 Å²	144	73%	0.732	74%	0.736	S	S	*	*	S	Bend	trans	160.8	-9.3	159	0	0	0	0	0	121.7	E170	E170-G172 PolarHBondContact O-N 2.88Å
173	E	40.2	Very low	53.7	Low	140 Å²	140	144.1 Å²	144.1	65%	0.654	74%	0.735	S	S	*	*			trans	-143.4	34.1	-177.5	-79.1	-155.7	161.7	0	0	115.5	S175 K176	E173-S175 PolarHBondContact O-N 3.25Å; E173-K176 IonicContact OE1-NZ 2.82Å; E173-K176 PolarHBondContact OE1-NZ 3.39Å; E173-K176 IonicContact OE2-NZ 3.79Å; E173-K176 PolarHBondContact OE2-NZ 2.83Å
174	A	42.3	Very low	54.3	Low	113 Å²	113	141.2 Å²	141.2	93%	0.934	72%	0.721	S	S	*	*			trans	-75	50.3	176.9	0	0	0	0	0	114.4
175	S	48	Very low	54.9	Low	94 Å²	94	145.7 Å²	145.7	66%	0.657	74%	0.736	S	S	*	*			trans	-154.9	51.8	164.8	53.5	0	0	0	0	112.8	E173	E173-S175 PolarHBondContact O-N 3.25Å
176	K	54.1	Low	56.1	Low	149 Å²	149	145.8 Å²	145.8	65%	0.648	73%	0.732	S	S	*	*	S	Bend	trans	-121.1	11.4	165.9	-91.2	174.2	-166.8	153.1	0	114.3	E173	E173-K176 IonicContact OE1-NZ 2.82Å; E173-K176 PolarHBondContact OE1-NZ 3.39Å; E173-K176 IonicContact OE2-NZ 3.79Å; E173-K176 PolarHBondContact OE2-NZ 2.83Å
177	L	61.4	Low	57.7	Low	107 Å²	107	140.7 Å²	140.7	56%	0.56	71%	0.708	S	S	*	*	S	Bend	trans	-93.7	-27.6	171.8	-80.1	150.7	0	0	0	112.7	F160 S164	F160-L177 HydrophobicContact CE1-CD2 3.56Å; F160-L177 HydrophobicContact CZ-CD2 3.66Å; S164-L177 WeakPolarHBondContact OG-CD1 3.35Å
178	L	54.4	Low	59.3	Low	156 Å²	156	137.2 Å²	137.2	82%	0.817	69%	0.69	S	S	*	*			trans	-138.9	109.3	171.5	-66.7	170.9	0	0	0	108.9
179	T	59.4	Low	61	Low	119 Å²	119	132.9 Å²	132.9	73%	0.73	67%	0.673	S	S	*	*			trans	-80	142.1	164.4	49.7	0	0	0	0	108.7	R181	T179-R181 PolarHBondContact O-N 2.73Å
180	R	60.1	Low	62.8	Low	237 Å²	237	130.2 Å²	130.2	89%	0.894	66%	0.658	S	S	*	*			trans	-59	112.1	171.8	-174.2	178.9	175.3	105.9	-2.9	107.3	I182	R180-I182 PolarHBondContact O-N 3.24Å; R180-I182 VanDerWaalsContact O-N 3.08Å
181	R	71.4	Confident	65	Low	158 Å²	158	125 Å²	125	60%	0.596	63%	0.634	S	S	*	*			trans	-55.3	118.5	178.2	-175.6	173.4	168.2	88.9	-3.1	107.9	T179 K183 E187	T179-R181 PolarHBondContact O-N 2.73Å; R181-K183 PolarHBondContact O-N 3.08Å; R181-E187 IonicContact CZ-OE1 2.61Å; R181-E187 IonicContact NE-OE1 3.14Å; R181-E187 PolarHBondContact NE-OE1 2.66Å; R181-E187 IonicContact NE-OE2 3.95Å; R181-E187 PolarHBondContact NE-OE2 3.02Å; R181-E187 IonicContact NH2-OE1 3.61Å; R181-E187 PolarHBondContact NH2-OE1 3.39Å
182	I	74	Confident	66.9	Low	155 Å²	155	117.4 Å²	117.4	80%	0.795	60%	0.598	S	S	*	*			trans	-69	114.8	166.5	-61.2	166.1	0	0	0	104.1	R180 T184	R180-I182 PolarHBondContact O-N 3.24Å; R180-I182 VanDerWaalsContact O-N 3.08Å; I182-T184 PolarHBondContact O-N 3.24Å
183	K	78.6	Confident	68.9	Low	100 Å²	100	116.3 Å²	116.3	44%	0.435	58%	0.582	S	S	.	*			trans	-52.5	126.9	179.9	-66.6	-177.4	180	-173.5	0	108.7	R181 E187 K188 E191	R181-K183 PolarHBondContact O-N 3.08Å; K183-E187 WeakPolarHBondContact CA-OE2 3.35Å; K183-E187 HydrophobicContact CB-CB 4.41Å; K183-K188 HydrophobicContact CB-CG 4.26Å; K183-E191 VanDerWaalsContact CE-OE1 3.23Å; K183-E191 WeakPolarHBondContact CE-OE1 3.31Å; K183-E191 IonicContact NZ-OE1 2.76Å; K183-E191 PolarHBondContact NZ-OE1 2.93Å; K183-E191 IonicContact NZ-OE2 3.99Å; K183-E191 PolarHBondContact NZ-OE2 3.45Å
184	T	78.4	Confident	71	Confident	53 Å²	53	113.9 Å²	113.9	33%	0.325	57%	0.574	S	S	.	*			trans	-67.9	157.9	172.2	50.3	0	0	0	0	109.2	I182 E186 E187 K188	I182-T184 PolarHBondContact O-N 3.24Å; T184-E186 PolarHBondContact O-N 2.98Å; T184-E187 PolarHBondContact O-N 3.23Å; T184-E187 WeakPolarHBondContact OG1-CG 3.16Å; T184-K188 PolarHBondContact O-N 2.92Å
185	Q	75.8	Confident	72.7	Confident	157 Å²	157	110.7 Å²	110.7	73%	0.734	54%	0.538	S	S	*	.	H	α-helix	trans	-53.5	-45.7	176.7	-75.4	168.4	-32.1	0	0	110.9	E187 K188 D189	Q185-E187 PolarHBondContact O-N 3.11Å; Q185-K188 WeakPolarHBondContact O-CA 3.4Å; Q185-K188 WeakPolarHBondContact O-CB 3.32Å; Q185-K188 PolarHBondContact O-N 2.71Å; Q185-D189 PolarHBondContact O-N 2.78Å
186	E	76.9	Confident	74.3	Confident	135 Å²	135	108.2 Å²	108.2	63%	0.631	52%	0.519	S	S	*	.	H	α-helix	trans	-57.2	-24.7	175.8	-59.4	176.9	-175.3	0	0	115.4	T184 K190	T184-E186 PolarHBondContact O-N 2.98Å; E186-K190 WeakPolarHBondContact O-CD 3.22Å; E186-K190 VanDerWaalsContact O-CG 3.25Å; E186-K190 WeakPolarHBondContact O-CG 3.44Å; E186-K190 PolarHBondContact O-N 2.77Å
187	E	82.9	Confident	75.6	Confident	59 Å²	59	104.4 Å²	104.4	28%	0.276	51%	0.505	S	S	.	.	H	α-helix	trans	-83.4	-32.6	175.2	-74.6	171.3	-177	0	0	111.1	R181 K183 T184 Q185 E191	R181-E187 IonicContact CZ-OE1 2.61Å; R181-E187 IonicContact NE-OE1 3.14Å; R181-E187 PolarHBondContact NE-OE1 2.66Å; R181-E187 IonicContact NE-OE2 3.95Å; R181-E187 PolarHBondContact NE-OE2 3.02Å; R181-E187 IonicContact NH2-OE1 3.61Å; R181-E187 PolarHBondContact NH2-OE1 3.39Å; K183-E187 WeakPolarHBondContact CA-OE2 3.35Å; K183-E187 HydrophobicContact CB-CB 4.41Å; T184-E187 PolarHBondContact O-N 3.23Å; T184-E187 WeakPolarHBondContact OG1-CG 3.16Å; Q185-E187 PolarHBondContact O-N 3.11Å; E187-E191 VanDerWaalsContact O-CG 3.25Å; E187-E191 WeakPolarHBondContact O-CG 3.43Å; E187-E191 PolarHBondContact O-N 2.9Å; E187-E191 VanDerWaalsContact O-N 3.12Å
188	K	82.5	Confident	76.7	Confident	105 Å²	105	99.5 Å²	99.5	46%	0.457	48%	0.479	S	S	.	.	H	α-helix	trans	-68.7	-42.2	173.4	-63.3	179.4	179.6	179.3	0	111.1	K183 T184 Q185 K190 E191 E192	K183-K188 HydrophobicContact CB-CG 4.26Å; T184-K188 PolarHBondContact O-N 2.92Å; Q185-K188 WeakPolarHBondContact O-CA 3.4Å; Q185-K188 WeakPolarHBondContact O-CB 3.32Å; Q185-K188 PolarHBondContact O-N 2.71Å; K188-K190 VanDerWaalsContact C-N 3.32Å; K188-K190 PolarHBondContact O-N 3.04Å; K188-E191 WeakPolarHBondContact O-CB 3.35Å; K188-E191 PolarHBondContact O-N 3.33Å; K188-E192 WeakPolarHBondContact O-CG 3.37Å; K188-E192 PolarHBondContact O-N 2.87Å
189	D	79.1	Confident	77.7	Confident	91 Å²	91	92.1 Å²	92.1	49%	0.487	44%	0.441	S	S	.	.	H	α-helix	trans	-64.8	-38	-179.9	-52.2	-24.8	0	0	0	111.3	Q185 E192 A193	Q185-D189 PolarHBondContact O-N 2.78Å; D189-E192 PolarHBondContact O-N 3.38Å; D189-A193 PolarHBondContact O-N 2.9Å
190	K	82.6	Confident	78.4	Confident	135 Å²	135	89.4 Å²	89.4	59%	0.587	42%	0.419	S	S	*	.	H	α-helix	trans	-66.8	-42.8	173.5	-73.8	172.7	-172.6	173.1	0	112.2	E186 K188 E192 A193 D194	E186-K190 WeakPolarHBondContact O-CD 3.22Å; E186-K190 VanDerWaalsContact O-CG 3.25Å; E186-K190 WeakPolarHBondContact O-CG 3.44Å; E186-K190 PolarHBondContact O-N 2.77Å; K188-K190 VanDerWaalsContact C-N 3.32Å; K188-K190 PolarHBondContact O-N 3.04Å; K190-E192 PolarHBondContact O-N 2.84Å; K190-A193 PolarHBondContact O-N 3.33Å; K190-D194 WeakPolarHBondContact O-CB 3.38Å; K190-D194 VanDerWaalsContact O-CG 3.23Å; K190-D194 PolarHBondContact O-N 3.27Å
191	E	81.9	Confident	78.7	Confident	84 Å²	84	79.3 Å²	79.3	39%	0.393	39%	0.389	S	S	.	.	H	α-helix	trans	-62.8	-30.1	174.4	-73.9	174.8	-179.1	0	0	112	K183 E187 K188 Y195	K183-E191 VanDerWaalsContact CE-OE1 3.23Å; K183-E191 WeakPolarHBondContact CE-OE1 3.31Å; K183-E191 IonicContact NZ-OE1 2.76Å; K183-E191 PolarHBondContact NZ-OE1 2.93Å; K183-E191 IonicContact NZ-OE2 3.99Å; K183-E191 PolarHBondContact NZ-OE2 3.45Å; E187-E191 VanDerWaalsContact O-CG 3.25Å; E187-E191 WeakPolarHBondContact O-CG 3.43Å; E187-E191 PolarHBondContact O-N 2.9Å; E187-E191 VanDerWaalsContact O-N 3.12Å; K188-E191 WeakPolarHBondContact O-CB 3.35Å; K188-E191 PolarHBondContact O-N 3.33Å; E191-Y195 WeakPolarHBondContact O-CB 3.25Å; E191-Y195 PolarHBondContact O-N 3.48Å
192	E	80.8	Confident	78.4	Confident	47 Å²	47	79.6 Å²	79.6	22%	0.22	40%	0.397	C	S	.	.	H	α-helix	trans	-75.1	-41.7	175.3	-75.9	168.9	-165.7	0	0	112.6	P56 R60 K188 D189 K190 Y195 V196	P56-E192 WeakPolarHBondContact CB-OE1 3.18Å; P56-E192 WeakPolarHBondContact CG-OE1 3.44Å; P56-E192 WeakPolarHBondContact CG-OE2 3.43Å; R60-E192 IonicContact CZ-OE1 2.61Å; R60-E192 IonicContact NH1-OE1 2.97Å; R60-E192 IonicContact NH2-OE1 2.81Å; R60-E192 PolarHBondContact NH2-OE1 3.3Å; R60-E192 VanDerWaalsContact NH2-OE1 3.16Å; K188-E192 WeakPolarHBondContact O-CG 3.37Å; K188-E192 PolarHBondContact O-N 2.87Å; D189-E192 PolarHBondContact O-N 3.38Å; K190-E192 PolarHBondContact O-N 2.84Å; E192-Y195 WeakPolarHBondContact O-CB 3.4Å; E192-Y195 PolarHBondContact O-N 3.01Å; E192-V196 WeakPolarHBondContact O-CG2 3.35Å; E192-V196 PolarHBondContact O-N 2.99Å
193	A	82.9	Confident	77.7	Confident	48 Å²	48	73.8 Å²	73.8	40%	0.397	37%	0.372	S	S	.	.	H	α-helix	trans	-60.2	-47.5	171.3	0	0	0	0	0	111.3	D189 K190 Y195 V196 D197	D189-A193 PolarHBondContact O-N 2.9Å; K190-A193 PolarHBondContact O-N 3.33Å; A193-Y195 PolarHBondContact O-N 2.92Å; A193-V196 PolarHBondContact O-N 3.32Å; A193-V196 VanDerWaalsContact O-N 3.15Å; A193-D197 PolarHBondContact O-N 3.47Å
194	D	83.3	Confident	76.6	Confident	90 Å²	90	77.7 Å²	77.7	48%	0.481	39%	0.391	S	S	.	.	H	α-helix	trans	-61.1	-34.1	175.9	-70.3	-18.8	0	0	0	111.7	K190 W198	K190-D194 WeakPolarHBondContact O-CB 3.38Å; K190-D194 VanDerWaalsContact O-CG 3.23Å; K190-D194 PolarHBondContact O-N 3.27Å; D194-W198 VanDerWaalsContact O-CB 3.23Å; D194-W198 WeakPolarHBondContact O-CB 3.34Å; D194-W198 PolarHBondContact O-N 3.28Å
195	Y	78	Confident	75.7	Confident	45 Å²	45	79.1 Å²	79.1	18%	0.176	40%	0.397	C	S	.	.	H	α-helix	trans	-71.6	-38.7	175.9	-179	-106.3	0	0	0	112.8	R60 E191 E192 A193 W198 L199 M214	R60-Y195 HydrophobicContact CG-CE1 4.2Å; E191-Y195 WeakPolarHBondContact O-CB 3.25Å; E191-Y195 PolarHBondContact O-N 3.48Å; E192-Y195 WeakPolarHBondContact O-CB 3.4Å; E192-Y195 PolarHBondContact O-N 3.01Å; A193-Y195 PolarHBondContact O-N 2.92Å; Y195-W198 AromaticContact CD2-CE3 3.99Å; Y195-W198 HydrophobicContact CD2-CE3 3.99Å; Y195-W198 HydrophobicContact CD2-CZ3 4.46Å; Y195-W198 AromaticContact CE2-CE3 3.89Å; Y195-W198 HydrophobicContact CE2-CE3 3.89Å; Y195-W198 AromaticContact CE2-CZ3 3.9Å; Y195-W198 HydrophobicContact CE2-CZ3 3.9Å; Y195-W198 WeakPolarHBondContact O-CB 3.27Å; Y195-W198 PolarHBondContact O-N 3.13Å; Y195-L199 HydrophobicContact CD1-CD1 3.9Å; Y195-L199 HydrophobicContact CE1-CD1 3.51Å; Y195-L199 PolarHBondContact O-N 3.15Å; Y195-M214 WeakPolarHBondContact OH-CE 3.31Å
196	V	81.9	Confident	74.6	Confident	43 Å²	43	78.9 Å²	78.9	26%	0.261	40%	0.4	S	S	.	.	H	α-helix	trans	-65.4	-43.4	173.2	168.2	0	0	0	0	110.5	E192 A193 W198 L199 K200 L238	E192-V196 WeakPolarHBondContact O-CG2 3.35Å; E192-V196 PolarHBondContact O-N 2.99Å; A193-V196 PolarHBondContact O-N 3.32Å; A193-V196 VanDerWaalsContact O-N 3.15Å; V196-W198 VanDerWaalsContact C-N 3.28Å; V196-W198 PolarHBondContact O-N 3.31Å; V196-L199 WeakPolarHBondContact O-CB 3.5Å; V196-L199 PolarHBondContact O-N 3.18Å; V196-K200 HydrophobicContact CG1-CD 4.2Å; V196-K200 WeakPolarHBondContact O-CG 3.33Å; V196-K200 PolarHBondContact O-N 3.42Å; V196-L238 HydrophobicContact CG1-CD2 4.22Å
197	D	81.2	Confident	73.4	Confident	68 Å²	68	73.9 Å²	73.9	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-67.2	-32.6	177.1	-73.5	-15.4	0	0	0	112.1	A193 K200 G201 Q202 A203	A193-D197 PolarHBondContact O-N 3.47Å; D197-K200 PolarHBondContact O-N 2.98Å; D197-G201 PolarHBondContact O-N 3.03Å; D197-Q202 PolarHBondContact O-N 2.73Å; D197-A203 PolarHBondContact O-N 3.01Å
198	W	84	Confident	72	Confident	4 Å²	4	76 Å²	76	2%	0.015	40%	0.404	C	S	.	.	H	α-helix	trans	-65.9	-43.7	169.6	176.1	82.5	0	0	0	112.8	D194 Y195 V196 K200 G201 A203 L205 V211 M214 K215 R218	D194-W198 VanDerWaalsContact O-CB 3.23Å; D194-W198 WeakPolarHBondContact O-CB 3.34Å; D194-W198 PolarHBondContact O-N 3.28Å; Y195-W198 AromaticContact CD2-CE3 3.99Å; Y195-W198 HydrophobicContact CD2-CE3 3.99Å; Y195-W198 HydrophobicContact CD2-CZ3 4.46Å; Y195-W198 AromaticContact CE2-CE3 3.89Å; Y195-W198 HydrophobicContact CE2-CE3 3.89Å; Y195-W198 AromaticContact CE2-CZ3 3.9Å; Y195-W198 HydrophobicContact CE2-CZ3 3.9Å; Y195-W198 WeakPolarHBondContact O-CB 3.27Å; Y195-W198 PolarHBondContact O-N 3.13Å; V196-W198 VanDerWaalsContact C-N 3.28Å; V196-W198 PolarHBondContact O-N 3.31Å; W198-K200 VanDerWaalsContact C-N 3.29Å; W198-K200 PolarHBondContact O-N 3.36Å; W198-G201 WeakPolarHBondContact O-CA 3.37Å; W198-G201 PolarHBondContact O-N 3Å; W198-A203 HydrophobicContact CB-CB 4.3Å; W198-L205 HydrophobicContact CB-CD1 4.09Å; W198-L205 HydrophobicContact CG-CB 4.12Å; W198-L205 HydrophobicContact CG-CD1 4.27Å; W198-L205 PolarHBondContact NE1-O 2.85Å; W198-V211 HydrophobicContact CH2-CG1 3.72Å; W198-V211 HydrophobicContact CZ2-CG1 3.32Å; W198-M214 HydrophobicContact CH2-CB 3.52Å; W198-M214 HydrophobicContact CZ3-CB 3.71Å; W198-K215 HydrophobicContact CH2-CG 4.46Å; W198-K215 HydrophobicContact CZ2-CG 4.02Å; W198-R218 WeakPolarHBondContact O-CD 3.24Å; W198-R218 PolarHBondContact O-NE 2.87Å
199	L	76.9	Confident	70.8	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.005	41%	0.412	C	S	.	.	H	α-helix	trans	-61.7	-37.9	173.1	-89	159.6	0	0	0	111.6	Y195 V196 G201 M214 L217 W221	Y195-L199 HydrophobicContact CD1-CD1 3.9Å; Y195-L199 HydrophobicContact CE1-CD1 3.51Å; Y195-L199 PolarHBondContact O-N 3.15Å; V196-L199 WeakPolarHBondContact O-CB 3.5Å; V196-L199 PolarHBondContact O-N 3.18Å; L199-G201 PolarHBondContact O-N 2.8Å; L199-M214 HydrophobicContact CD2-CE 4.03Å; L199-L217 HydrophobicContact CD2-CD2 4.4Å; L199-W221 HydrophobicContact CD2-CE3 4.36Å; L199-W221 HydrophobicContact CD2-CZ3 4.09Å
200	K	73.7	Confident	69.8	Low	63 Å²	63	78.4 Å²	78.4	27%	0.274	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.9	173.6	-72.1	173.5	-177.9	172.5	0	113.4	V196 D197 W198 Q202 N222 R234 L238	V196-K200 HydrophobicContact CG1-CD 4.2Å; V196-K200 WeakPolarHBondContact O-CG 3.33Å; V196-K200 PolarHBondContact O-N 3.42Å; D197-K200 PolarHBondContact O-N 2.98Å; W198-K200 VanDerWaalsContact C-N 3.29Å; W198-K200 PolarHBondContact O-N 3.36Å; K200-Q202 HydrophobicContact CB-CG 4.41Å; K200-N222 PolarHBondContact O-OD1 3.24Å; K200-N222 VanDerWaalsContact O-OD1 3.14Å; K200-R234 VanDerWaalsContact CA-NH2 3.31Å; K200-R234 PolarHBondContact O-NH2 2.89Å; K200-L238 HydrophobicContact CD-CD1 4.48Å; K200-L238 HydrophobicContact CG-CD1 3.78Å
201	G	65.4	Low	68.9	Low	25 Å²	25	73.2 Å²	73.2	26%	0.258	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	6.1	178.2	0	0	0	0	0	115.1	D197 W198 L199 R218	D197-G201 PolarHBondContact O-N 3.03Å; W198-G201 WeakPolarHBondContact O-CA 3.37Å; W198-G201 PolarHBondContact O-N 3Å; L199-G201 PolarHBondContact O-N 2.8Å; G201-R218 PolarHBondContact O-NH2 3.32Å
202	Q	65.7	Low	68.3	Low	164 Å²	164	74.1 Å²	74.1	77%	0.766	40%	0.396	S	S	*	.	S	Bend	trans	-81.4	-28.2	-177.1	-64.1	-67.3	-32.4	0	0	112.6	D197 K200	D197-Q202 PolarHBondContact O-N 2.73Å; K200-Q202 HydrophobicContact CB-CG 4.41Å
203	A	60	Low	67.9	Low	32 Å²	32	74.4 Å²	74.4	26%	0.264	40%	0.399	S	S	.	.	S	Bend	trans	-112.1	146.9	177.6	0	0	0	0	0	112.5	D197 W198 R218	D197-A203 PolarHBondContact O-N 3.01Å; W198-A203 HydrophobicContact CB-CB 4.3Å; A203-R218 VanDerWaalsContact O-CZ 3.29Å; A203-R218 PolarHBondContact O-NH1 2.87Å; A203-R218 PolarHBondContact O-NH2 3.13Å
204	E	54.5	Low	67.5	Low	182 Å²	182	72.2 Å²	72.2	85%	0.85	38%	0.381	S	S	*	.			trans	-104.3	99	170.1	-69.7	-176.8	173.8	0	0	109.3
205	L	60.2	Low	67.3	Low	84 Å²	84	71.3 Å²	71.3	44%	0.44	37%	0.373	S	S	.	.			trans	-100.5	116.1	169.5	-93.3	149	0	0	0	108.4	W198	W198-L205 HydrophobicContact CB-CD1 4.09Å; W198-L205 HydrophobicContact CG-CB 4.12Å; W198-L205 HydrophobicContact CG-CD1 4.27Å; W198-L205 PolarHBondContact NE1-O 2.85Å
206	D	53	Low	67.4	Low	151 Å²	151	74.5 Å²	74.5	81%	0.807	39%	0.385	S	S	*	.			trans	-94.3	91.3	168.1	-91.4	-28.8	0	0	0	109.5	K215	D206-K215 IonicContact OD1-NZ 3.78Å; D206-K215 PolarHBondContact OD1-NZ 2.96Å
207	G	51.5	Low	67.4	Low	31 Å²	31	72.5 Å²	72.5	32%	0.32	37%	0.373	S	S	.	.			trans	-118.2	172.6	174.5	0	0	0	0	0	113.7	V211	G207-V211 VanDerWaalsContact C-CG2 3.5Å; G207-V211 WeakPolarHBondContact O-CB 3.23Å
208	P	52.8	Low	67.4	Low	102 Å²	102	71 Å²	71	66%	0.662	36%	0.363	S	S	*	.			trans	-66	179.4	-168.3	29.2	-36.3	0	0	0	113.9	E210 V211	P208-E210 PolarHBondContact O-N 3.33Å; P208-V211 VanDerWaalsContact O-CB 3.23Å; P208-V211 WeakPolarHBondContact O-CB 3.26Å; P208-V211 VanDerWaalsContact O-CG2 3.32Å; P208-V211 WeakPolarHBondContact O-CG2 3.36Å; P208-V211 PolarHBondContact O-N 3.22Å
209	E	56.6	Low	67.4	Low	134 Å²	134	75.3 Å²	75.3	63%	0.626	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-27.1	-162.5	-52.6	-154.9	120	0	0	117.6	V211 K212 D213	E209-V211 PolarHBondContact O-N 2.8Å; E209-K212 HydrophobicContact CB-CD 4.25Å; E209-K212 HydrophobicContact CG-CD 4.37Å; E209-K212 WeakPolarHBondContact O-CA 3.27Å; E209-K212 WeakPolarHBondContact O-CB 3.31Å; E209-K212 PolarHBondContact O-N 2.98Å; E209-K212 IonicContact OE1-NZ 2.78Å; E209-K212 PolarHBondContact OE1-NZ 3.33Å; E209-D213 PolarHBondContact O-N 3.02Å
210	E	59.2	Low	67.6	Low	114 Å²	114	78.6 Å²	78.6	53%	0.533	40%	0.398	S	S	.	.	H	α-helix	trans	-59	-32.5	171.8	-60.2	176.6	166.2	0	0	112.3	R64 P208 K212 D213 M214	R64-E210 IonicContact CZ-OE2 2.75Å; R64-E210 IonicContact NH2-OE1 3.36Å; R64-E210 PolarHBondContact NH2-OE1 3.43Å; R64-E210 IonicContact NH2-OE2 2.73Å; R64-E210 PolarHBondContact NH2-OE2 3.41Å; P208-E210 PolarHBondContact O-N 3.33Å; E210-K212 VanDerWaalsContact C-N 3.28Å; E210-K212 PolarHBondContact O-N 3.46Å; E210-D213 PolarHBondContact O-N 3.27Å; E210-M214 VanDerWaalsContact O-CG 3.29Å; E210-M214 WeakPolarHBondContact O-CG 3.45Å; E210-M214 PolarHBondContact O-N 2.75Å
211	V	63.5	Low	68	Low	26 Å²	26	76.7 Å²	76.7	16%	0.158	39%	0.39	C	S	.	.	H	α-helix	trans	-67.7	-29.2	172.8	-173.4	0	0	0	0	110.6	W198 G207 P208 E209 M214 K215	W198-V211 HydrophobicContact CH2-CG1 3.72Å; W198-V211 HydrophobicContact CZ2-CG1 3.32Å; G207-V211 VanDerWaalsContact C-CG2 3.5Å; G207-V211 WeakPolarHBondContact O-CB 3.23Å; P208-V211 VanDerWaalsContact O-CB 3.23Å; P208-V211 WeakPolarHBondContact O-CB 3.26Å; P208-V211 VanDerWaalsContact O-CG2 3.32Å; P208-V211 WeakPolarHBondContact O-CG2 3.36Å; P208-V211 PolarHBondContact O-N 3.22Å; E209-V211 PolarHBondContact O-N 2.8Å; V211-M214 CarbonylContact O-C 3.59Å; V211-M214 PolarHBondContact O-N 3.38Å; V211-K215 HydrophobicContact CG1-CG 4.37Å; V211-K215 WeakPolarHBondContact O-CG 3.36Å; V211-K215 PolarHBondContact O-N 2.78Å
212	K	68.7	Low	68.7	Low	103 Å²	103	78.5 Å²	78.5	45%	0.448	39%	0.393	S	S	.	.	H	α-helix	trans	-66.3	-40.1	177.9	-59.7	173.6	-176.4	171.3	0	111.7	E209 E210 M214 K215 Y216	E209-K212 HydrophobicContact CB-CD 4.25Å; E209-K212 HydrophobicContact CG-CD 4.37Å; E209-K212 WeakPolarHBondContact O-CA 3.27Å; E209-K212 WeakPolarHBondContact O-CB 3.31Å; E209-K212 PolarHBondContact O-N 2.98Å; E209-K212 IonicContact OE1-NZ 2.78Å; E209-K212 PolarHBondContact OE1-NZ 3.33Å; E210-K212 VanDerWaalsContact C-N 3.28Å; E210-K212 PolarHBondContact O-N 3.46Å; K212-M214 VanDerWaalsContact C-N 3.26Å; K212-M214 PolarHBondContact O-N 3.46Å; K212-K215 PolarHBondContact O-N 3.43Å; K212-Y216 VanDerWaalsContact O-CD2 3.23Å; K212-Y216 WeakPolarHBondContact O-CD2 3.44Å; K212-Y216 WeakPolarHBondContact O-CE2 3.3Å
213	D	72.1	Confident	69.4	Low	52 Å²	52	74.9 Å²	74.9	28%	0.278	38%	0.379	S	S	.	.	H	α-helix	trans	-70.3	-29.1	177.4	-67.9	-18.7	0	0	0	111	S67 E209 E210	S67-D213 WeakPolarHBondContact CB-O 3.49Å; S67-D213 PolarHBondContact OG-O 3.22Å; E209-D213 PolarHBondContact O-N 3.02Å; E210-D213 PolarHBondContact O-N 3.27Å
214	M	75.9	Confident	70.2	Confident	3 Å²	3	79.6 Å²	79.6	2%	0.015	41%	0.407	C	S	.	.	H	α-helix	trans	-81	-24.7	175.8	-63.8	-57.6	-63.7	0	0	114.2	Y63 R64 Y195 W198 L199 E210 V211 K212 Y216 L217 R218	Y63-M214 HydrophobicContact CG-CE 4.15Å; R64-M214 HydrophobicContact CB-SD 4.26Å; R64-M214 HydrophobicContact CG-CG 4.27Å; R64-M214 HydrophobicContact CG-SD 3.61Å; Y195-M214 WeakPolarHBondContact OH-CE 3.31Å; W198-M214 HydrophobicContact CH2-CB 3.52Å; W198-M214 HydrophobicContact CZ3-CB 3.71Å; L199-M214 HydrophobicContact CD2-CE 4.03Å; E210-M214 VanDerWaalsContact O-CG 3.29Å; E210-M214 WeakPolarHBondContact O-CG 3.45Å; E210-M214 PolarHBondContact O-N 2.75Å; V211-M214 CarbonylContact O-C 3.59Å; V211-M214 PolarHBondContact O-N 3.38Å; K212-M214 VanDerWaalsContact C-N 3.26Å; K212-M214 PolarHBondContact O-N 3.46Å; M214-Y216 VanDerWaalsContact C-N 3.25Å; M214-Y216 PolarHBondContact O-N 3.1Å; M214-L217 HydrophobicContact CE-CD2 4.47Å; M214-L217 PolarHBondContact O-N 3.37Å; M214-L217 VanDerWaalsContact O-N 3.14Å; M214-R218 PolarHBondContact O-N 3.13Å; M214-R218 VanDerWaalsContact O-N 3.14Å
215	K	78.7	Confident	71.4	Confident	70 Å²	70	79.8 Å²	79.8	30%	0.304	41%	0.408	S	S	.	.	H	α-helix	trans	-58.5	-36.7	176.8	-81.9	172.4	-168.6	-154.6	0	111.6	W198 D206 V211 K212 L217 R218 D219	W198-K215 HydrophobicContact CH2-CG 4.46Å; W198-K215 HydrophobicContact CZ2-CG 4.02Å; D206-K215 IonicContact OD1-NZ 3.78Å; D206-K215 PolarHBondContact OD1-NZ 2.96Å; V211-K215 HydrophobicContact CG1-CG 4.37Å; V211-K215 WeakPolarHBondContact O-CG 3.36Å; V211-K215 PolarHBondContact O-N 2.78Å; K212-K215 PolarHBondContact O-N 3.43Å; K215-L217 VanDerWaalsContact C-N 3.33Å; K215-L217 PolarHBondContact O-N 2.78Å; K215-R218 WeakPolarHBondContact O-CB 3.2Å; K215-R218 PolarHBondContact O-N 3.38Å; K215-D219 PolarHBondContact O-N 2.94Å
216	Y	79.8	Confident	72.1	Confident	112 Å²	112	76.9 Å²	76.9	44%	0.439	39%	0.393	S	S	.	.	H	α-helix	trans	-64.3	-35.9	177.6	-58.4	-72	0	0	0	113.2	K71 K212 M214 Y220	K71-Y216 HydrophobicContact CD-CD1 4.24Å; K71-Y216 HydrophobicContact CD-CD2 4.08Å; K71-Y216 HydrophobicContact CD-CE1 4.26Å; K71-Y216 HydrophobicContact CD-CE2 4.12Å; K71-Y216 HydrophobicContact CD-CG 4.15Å; K212-Y216 VanDerWaalsContact O-CD2 3.23Å; K212-Y216 WeakPolarHBondContact O-CD2 3.44Å; K212-Y216 WeakPolarHBondContact O-CE2 3.3Å; M214-Y216 VanDerWaalsContact C-N 3.25Å; M214-Y216 PolarHBondContact O-N 3.1Å; Y216-Y220 VanDerWaalsContact O-CB 3.28Å; Y216-Y220 WeakPolarHBondContact O-CB 3.46Å; Y216-Y220 PolarHBondContact O-N 3.49Å
217	L	81.2	Confident	73.5	Confident	2 Å²	2	75.2 Å²	75.2	1%	0.01	38%	0.384	C	S	.	.	H	α-helix	trans	-71.6	-40.2	177	-174.8	57.2	0	0	0	111	Y63 L66 L199 M214 K215 Y220 W221	Y63-L217 HydrophobicContact CD1-CD2 4.06Å; Y63-L217 HydrophobicContact CG-CD2 4.46Å; L66-L217 HydrophobicContact CD2-CD1 3.39Å; L66-L217 HydrophobicContact CD2-CD2 4.15Å; L66-L217 HydrophobicContact CD2-CG 4.41Å; L199-L217 HydrophobicContact CD2-CD2 4.4Å; M214-L217 HydrophobicContact CE-CD2 4.47Å; M214-L217 PolarHBondContact O-N 3.37Å; M214-L217 VanDerWaalsContact O-N 3.14Å; K215-L217 VanDerWaalsContact C-N 3.33Å; K215-L217 PolarHBondContact O-N 2.78Å; L217-Y220 PolarHBondContact O-N 3.24Å; L217-W221 HydrophobicContact CD1-CD2 4Å; L217-W221 HydrophobicContact CD1-CG 4.28Å; L217-W221 HydrophobicContact CD1-CZ2 3.89Å; L217-W221 HydrophobicContact CD2-CH2 3.98Å; L217-W221 HydrophobicContact CD2-CZ2 3.96Å; L217-W221 HydrophobicContact CD2-CZ3 4.34Å; L217-W221 HydrophobicContact CG-CD2 4.01Å; L217-W221 HydrophobicContact CG-CE3 4.27Å; L217-W221 HydrophobicContact CG-CH2 4.33Å; L217-W221 HydrophobicContact CG-CZ2 4.06Å; L217-W221 HydrophobicContact CG-CZ3 4.43Å; L217-W221 WeakPolarHBondContact O-CB 3.49Å; L217-W221 PolarHBondContact O-N 3.43Å
218	R	82.3	Confident	75	Confident	37 Å²	37	79.6 Å²	79.6	14%	0.14	40%	0.4	C	S	.	.	H	α-helix	trans	-58.3	-48.5	172.4	177.7	-175.3	169.9	159.2	4.8	111.3	W198 G201 A203 M214 K215 W221 N222	W198-R218 WeakPolarHBondContact O-CD 3.24Å; W198-R218 PolarHBondContact O-NE 2.87Å; G201-R218 PolarHBondContact O-NH2 3.32Å; A203-R218 VanDerWaalsContact O-CZ 3.29Å; A203-R218 PolarHBondContact O-NH1 2.87Å; A203-R218 PolarHBondContact O-NH2 3.13Å; M214-R218 PolarHBondContact O-N 3.13Å; M214-R218 VanDerWaalsContact O-N 3.14Å; K215-R218 WeakPolarHBondContact O-CB 3.2Å; K215-R218 PolarHBondContact O-N 3.38Å; R218-W221 PolarHBondContact O-N 3.21Å; R218-N222 WeakPolarHBondContact CG-ND2 3.25Å; R218-N222 WeakPolarHBondContact O-CB 3.22Å; R218-N222 PolarHBondContact O-N 3.11Å; R218-N222 VanDerWaalsContact O-N 3.08Å; R218-N222 PolarHBondContact O-ND2 3.33Å
219	D	82.8	Confident	76.6	Confident	93 Å²	93	82.8 Å²	82.8	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-63.4	-45.7	-179.7	-65.2	-19.4	0	0	0	110.5	K215 W221 N222 D223	K215-D219 PolarHBondContact O-N 2.94Å; D219-W221 PolarHBondContact O-N 3.36Å; D219-N222 PolarHBondContact O-N 3.22Å; D219-D223 PolarHBondContact O-N 3.17Å; D219-D223 VanDerWaalsContact O-N 3.14Å
220	Y	82.2	Confident	77.7	Confident	70 Å²	70	78.5 Å²	78.5	28%	0.275	38%	0.383	S	S	.	.	H	α-helix	trans	-61.9	-40.8	178	-174.5	-100.8	0	0	0	113.3	K70 Y216 L217 N222 L226 E230	K70-Y220 HydrophobicContact CD-CE1 4.41Å; K70-Y220 PolarHBondContact NZ-OH 3.47Å; Y216-Y220 VanDerWaalsContact O-CB 3.28Å; Y216-Y220 WeakPolarHBondContact O-CB 3.46Å; Y216-Y220 PolarHBondContact O-N 3.49Å; L217-Y220 PolarHBondContact O-N 3.24Å; Y220-N222 VanDerWaalsContact C-N 3.3Å; Y220-N222 PolarHBondContact O-N 2.95Å; Y220-L226 HydrophobicContact CD1-CD1 4.19Å; Y220-L226 HydrophobicContact CD2-CD1 4.48Å; Y220-L226 HydrophobicContact CE1-CD1 3.71Å; Y220-L226 HydrophobicContact CE2-CD1 4.08Å; Y220-E230 WeakPolarHBondContact CE1-OE2 3.49Å; Y220-E230 VanDerWaalsContact CZ-OE2 3.31Å; Y220-E230 PolarHBondContact OH-OE1 2.84Å; Y220-E230 PolarHBondContact OH-OE2 3.2Å
221	W	82.1	Confident	78.8	Confident	24 Å²	24	79.7 Å²	79.7	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-73.4	-22.6	178	-78.1	-5.8	0	0	0	113.5	Y63 L199 L217 R218 D219 R234 L238	Y63-W221 HydrophobicContact CD1-CH2 4.16Å; Y63-W221 AromaticContact CE1-CH2 3.91Å; Y63-W221 HydrophobicContact CE1-CH2 3.91Å; L199-W221 HydrophobicContact CD2-CE3 4.36Å; L199-W221 HydrophobicContact CD2-CZ3 4.09Å; L217-W221 HydrophobicContact CD1-CD2 4Å; L217-W221 HydrophobicContact CD1-CG 4.28Å; L217-W221 HydrophobicContact CD1-CZ2 3.89Å; L217-W221 HydrophobicContact CD2-CH2 3.98Å; L217-W221 HydrophobicContact CD2-CZ2 3.96Å; L217-W221 HydrophobicContact CD2-CZ3 4.34Å; L217-W221 HydrophobicContact CG-CD2 4.01Å; L217-W221 HydrophobicContact CG-CE3 4.27Å; L217-W221 HydrophobicContact CG-CH2 4.33Å; L217-W221 HydrophobicContact CG-CZ2 4.06Å; L217-W221 HydrophobicContact CG-CZ3 4.43Å; L217-W221 WeakPolarHBondContact O-CB 3.49Å; L217-W221 PolarHBondContact O-N 3.43Å; R218-W221 PolarHBondContact O-N 3.21Å; D219-W221 PolarHBondContact O-N 3.36Å; W221-R234 HydrophobicContact CD2-CB 4.39Å; W221-R234 HydrophobicContact CD2-CG 4.03Å; W221-R234 HydrophobicContact CE3-CG 4.12Å; W221-R234 HydrophobicContact CG-CG 4.26Å; W221-R234 PolarHBondContact O-NH1 3.36Å; W221-L238 HydrophobicContact CZ3-CD1 4.3Å; W221-L238 HydrophobicContact CZ3-CD2 3.99Å; W221-L238 HydrophobicContact CZ3-CG 4.17Å
222	N	79	Confident	79.9	Confident	62 Å²	62	84.8 Å²	84.8	33%	0.332	40%	0.403	S	S	.	.	H	α-helix	trans	-95.1	-1.7	179.7	-67.2	-38.7	0	0	0	113.5	K200 R218 D219 Y220 P224 R234	K200-N222 PolarHBondContact O-OD1 3.24Å; K200-N222 VanDerWaalsContact O-OD1 3.14Å; R218-N222 WeakPolarHBondContact CG-ND2 3.25Å; R218-N222 WeakPolarHBondContact O-CB 3.22Å; R218-N222 PolarHBondContact O-N 3.11Å; R218-N222 VanDerWaalsContact O-N 3.08Å; R218-N222 PolarHBondContact O-ND2 3.33Å; D219-N222 PolarHBondContact O-N 3.22Å; Y220-N222 VanDerWaalsContact C-N 3.3Å; Y220-N222 PolarHBondContact O-N 2.95Å; N222-P224 WeakPolarHBondContact O-CD 3.35Å; N222-R234 PolarHBondContact OD1-NH1 2.92Å
223	D	82	Confident	80.7	Confident	88 Å²	88	84.5 Å²	84.5	47%	0.471	41%	0.406	S	S	.	.			trans	-70.4	123	173.8	-77.1	-32.4	0	0	0	111.1	D219 Q225 L226	D219-D223 PolarHBondContact O-N 3.17Å; D219-D223 VanDerWaalsContact O-N 3.14Å; D223-Q225 PolarHBondContact O-N 3.09Å; D223-Q225 VanDerWaalsContact O-N 3.09Å; D223-L226 PolarHBondContact O-N 3.1Å
224	P	76.8	Confident	81.1	Confident	131 Å²	131	84 Å²	84	85%	0.851	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	0.2	-176.7	28.5	-35.3	0	0	0	114.6	N222	N222-P224 WeakPolarHBondContact O-CD 3.35Å
225	Q	78.3	Confident	81.5	Confident	187 Å²	187	87.8 Å²	87.8	87%	0.874	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	14.2	177.9	-63.5	-161.1	-48	0	0	113.5	D223	D223-Q225 PolarHBondContact O-N 3.09Å; D223-Q225 VanDerWaalsContact O-N 3.09Å
226	L	74.8	Confident	81.8	Confident	23 Å²	23	88.8 Å²	88.8	12%	0.12	42%	0.423	C	S	.	.			trans	-71.9	145.7	-177.4	-145	72.4	0	0	0	112.4	Y220 D223 E230 R231	Y220-L226 HydrophobicContact CD1-CD1 4.19Å; Y220-L226 HydrophobicContact CD2-CD1 4.48Å; Y220-L226 HydrophobicContact CE1-CD1 3.71Å; Y220-L226 HydrophobicContact CE2-CD1 4.08Å; D223-L226 PolarHBondContact O-N 3.1Å; L226-E230 VanDerWaalsContact CD1-OE2 3.26Å; L226-E230 WeakPolarHBondContact CD1-OE2 3.35Å; L226-E230 HydrophobicContact CD2-CB 3.58Å; L226-E230 HydrophobicContact CG-CB 3.77Å; L226-E230 WeakPolarHBondContact CG-OE2 3.24Å; L226-R231 HydrophobicContact CB-CG 4.2Å; L226-R231 HydrophobicContact CD2-CG 4.34Å
227	D	83	Confident	82.1	Confident	116 Å²	116	85 Å²	85	62%	0.62	41%	0.412	S	S	*	.			trans	-63.4	142.7	174.5	-83	-19	0	0	0	110.8	K229 E230 R231	D227-K229 PolarHBondContact O-N 2.75Å; D227-E230 HydrophobicContact CB-CG 4.44Å; D227-E230 PolarHBondContact O-N 2.98Å; D227-R231 PolarHBondContact O-N 2.86Å; D227-R231 VanDerWaalsContact O-N 3.08Å
228	D	83.9	Confident	82.1	Confident	123 Å²	123	85.7 Å²	85.7	66%	0.658	42%	0.415	S	S	*	.	H	α-helix	trans	-56.1	-28	179.9	-65.8	-36	0	0	0	113.1	R231 F232	D228-R231 IonicContact OD1-NH1 2.87Å; D228-R231 PolarHBondContact OD1-NH1 3.47Å; D228-F232 WeakPolarHBondContact O-CB 3.4Å; D228-F232 PolarHBondContact O-N 2.92Å
229	K	85.1	Confident	82	Confident	168 Å²	168	88.3 Å²	88.3	73%	0.73	43%	0.432	S	S	*	.	H	α-helix	trans	-69.2	-35.2	174.9	-64.9	-179.3	-179	177.1	0	112.9	D227 L233	D227-K229 PolarHBondContact O-N 2.75Å; K229-L233 VanDerWaalsContact O-CG 3.32Å; K229-L233 WeakPolarHBondContact O-CG 3.39Å; K229-L233 PolarHBondContact O-N 2.88Å
230	E	81	Confident	81.9	Confident	44 Å²	44	88.3 Å²	88.3	21%	0.206	43%	0.427	C	S	.	.	H	α-helix	trans	-81.1	-30.2	179	-63.7	-165.3	142.9	0	0	111.4	K70 Y220 L226 D227 L233 R234	K70-E230 IonicContact NZ-OE1 2.77Å; K70-E230 PolarHBondContact NZ-OE1 3.09Å; Y220-E230 WeakPolarHBondContact CE1-OE2 3.49Å; Y220-E230 VanDerWaalsContact CZ-OE2 3.31Å; Y220-E230 PolarHBondContact OH-OE1 2.84Å; Y220-E230 PolarHBondContact OH-OE2 3.2Å; L226-E230 VanDerWaalsContact CD1-OE2 3.26Å; L226-E230 WeakPolarHBondContact CD1-OE2 3.35Å; L226-E230 HydrophobicContact CD2-CB 3.58Å; L226-E230 HydrophobicContact CG-CB 3.77Å; L226-E230 WeakPolarHBondContact CG-OE2 3.24Å; D227-E230 HydrophobicContact CB-CG 4.44Å; D227-E230 PolarHBondContact O-N 2.98Å; E230-L233 PolarHBondContact O-N 3.47Å; E230-R234 WeakPolarHBondContact O-CB 3.33Å; E230-R234 PolarHBondContact O-N 3.44Å
231	R	82.6	Confident	81.4	Confident	140 Å²	140	86.6 Å²	86.6	53%	0.528	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-44.6	167	-64.4	175.3	62.1	-156.9	0.3	111.2	L226 D227 D228 R234 D235	L226-R231 HydrophobicContact CB-CG 4.2Å; L226-R231 HydrophobicContact CD2-CG 4.34Å; D227-R231 PolarHBondContact O-N 2.86Å; D227-R231 VanDerWaalsContact O-N 3.08Å; D228-R231 IonicContact OD1-NH1 2.87Å; D228-R231 PolarHBondContact OD1-NH1 3.47Å; R231-R234 WeakPolarHBondContact O-CB 3.47Å; R231-R234 PolarHBondContact O-N 2.75Å; R231-D235 PolarHBondContact O-N 2.92Å
232	F	86.4	Confident	80.9	Confident	133 Å²	133	89.4 Å²	89.4	58%	0.583	44%	0.442	S	S	*	.	H	α-helix	trans	-60	-45	172.4	178.5	-97.3	0	0	0	111.7	D228 R234 D235 Y236	D228-F232 WeakPolarHBondContact O-CB 3.4Å; D228-F232 PolarHBondContact O-N 2.92Å; F232-R234 PolarHBondContact O-N 2.94Å; F232-D235 PolarHBondContact O-N 3.42Å; F232-Y236 HydrophobicContact CE1-CD2 4.34Å; F232-Y236 HydrophobicContact CE1-CG 4.38Å; F232-Y236 HydrophobicContact CZ-CD2 4.1Å; F232-Y236 WeakPolarHBondContact O-CB 3.4Å; F232-Y236 PolarHBondContact O-N 2.87Å
233	L	84	Confident	80.3	Confident	97 Å²	97	88.8 Å²	88.8	51%	0.508	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-37.8	176.9	-75.7	167.9	0	0	0	113.1	K229 E230 V237	K229-L233 VanDerWaalsContact O-CG 3.32Å; K229-L233 WeakPolarHBondContact O-CG 3.39Å; K229-L233 PolarHBondContact O-N 2.88Å; E230-L233 PolarHBondContact O-N 3.47Å; L233-V237 WeakPolarHBondContact O-CB 3.45Å; L233-V237 VanDerWaalsContact O-CG2 3.26Å; L233-V237 WeakPolarHBondContact O-CG2 3.42Å; L233-V237 PolarHBondContact O-N 2.84Å
234	R	82.3	Confident	79	Confident	42 Å²	42	91.1 Å²	91.1	16%	0.158	45%	0.451	C	S	.	.	H	α-helix	trans	-57.4	-54.2	172.7	170.5	-170.7	168.2	161.2	-0.2	109.8	K200 W221 N222 E230 R231 F232 Y236 V237 L238	K200-R234 VanDerWaalsContact CA-NH2 3.31Å; K200-R234 PolarHBondContact O-NH2 2.89Å; W221-R234 HydrophobicContact CD2-CB 4.39Å; W221-R234 HydrophobicContact CD2-CG 4.03Å; W221-R234 HydrophobicContact CE3-CG 4.12Å; W221-R234 HydrophobicContact CG-CG 4.26Å; W221-R234 PolarHBondContact O-NH1 3.36Å; N222-R234 PolarHBondContact OD1-NH1 2.92Å; E230-R234 WeakPolarHBondContact O-CB 3.33Å; E230-R234 PolarHBondContact O-N 3.44Å; R231-R234 WeakPolarHBondContact O-CB 3.47Å; R231-R234 PolarHBondContact O-N 2.75Å; F232-R234 PolarHBondContact O-N 2.94Å; R234-Y236 VanDerWaalsContact C-N 3.34Å; R234-Y236 PolarHBondContact O-N 3.25Å; R234-V237 PolarHBondContact O-N 3.45Å; R234-L238 HydrophobicContact CG-CD1 3.71Å; R234-L238 HydrophobicContact CG-CG 4.46Å; R234-L238 VanDerWaalsContact O-CB 3.23Å; R234-L238 WeakPolarHBondContact O-CB 3.31Å; R234-L238 WeakPolarHBondContact O-CG 2.81Å; R234-L238 PolarHBondContact O-N 3.37Å
235	D	83.6	Confident	78	Confident	81 Å²	81	89.3 Å²	89.3	43%	0.433	43%	0.431	S	S	.	.	H	α-helix	trans	-69	-35.7	-176.4	-68.3	-10	0	0	0	111.4	R231 F232 N239	R231-D235 PolarHBondContact O-N 2.92Å; F232-D235 PolarHBondContact O-N 3.42Å; D235-N239 WeakPolarHBondContact O-CB 3.42Å; D235-N239 PolarHBondContact O-N 3.3Å; D235-N239 PolarHBondContact O-ND2 2.89Å
236	Y	84.8	Confident	76.6	Confident	91 Å²	91	88.1 Å²	88.1	36%	0.357	43%	0.426	S	S	.	.	H	α-helix	trans	-65.7	-42.6	177.4	-174.2	-103	0	0	0	112.7	F232 R234 K240 G241 Y242	F232-Y236 HydrophobicContact CE1-CD2 4.34Å; F232-Y236 HydrophobicContact CE1-CG 4.38Å; F232-Y236 HydrophobicContact CZ-CD2 4.1Å; F232-Y236 WeakPolarHBondContact O-CB 3.4Å; F232-Y236 PolarHBondContact O-N 2.87Å; R234-Y236 VanDerWaalsContact C-N 3.34Å; R234-Y236 PolarHBondContact O-N 3.25Å; Y236-K240 PolarHBondContact O-N 3.19Å; Y236-G241 WeakPolarHBondContact CE2-O 3.4Å; Y236-G241 VanDerWaalsContact CZ-O 3.3Å; Y236-G241 PolarHBondContact O-N 2.95Å; Y236-G241 PolarHBondContact OH-O 3.36Å; Y236-G241 VanDerWaalsContact OH-O 3.12Å; Y236-Y242 HydrophobicContact CE1-CD1 4.29Å; Y236-Y242 VanDerWaalsContact OH-CA 3.27Å; Y236-Y242 WeakPolarHBondContact OH-CA 3.09Å; Y236-Y242 WeakPolarHBondContact OH-CB 3.23Å
237	V	85.1	Confident	75.3	Confident	33 Å²	33	95 Å²	95	20%	0.2	46%	0.457	C	S	.	.	H	α-helix	trans	-77	-39.1	179.1	174.1	0	0	0	0	111.1	Y63 L233 R234 K240	Y63-V237 HydrophobicContact CE1-CG1 3.72Å; Y63-V237 VanDerWaalsContact OH-CG1 3.26Å; Y63-V237 WeakPolarHBondContact OH-CG1 3.29Å; L233-V237 WeakPolarHBondContact O-CB 3.45Å; L233-V237 VanDerWaalsContact O-CG2 3.26Å; L233-V237 WeakPolarHBondContact O-CG2 3.42Å; L233-V237 PolarHBondContact O-N 2.84Å; R234-V237 PolarHBondContact O-N 3.45Å; V237-K240 PolarHBondContact O-N 3.33Å
238	L	81.6	Confident	73.8	Confident	17 Å²	17	94.8 Å²	94.8	9%	0.089	46%	0.456	C	S	.	.	H	α-helix	trans	-70.3	-37.7	179	-73.8	178.3	0	0	0	113.3	V196 K200 W221 R234 K240	V196-L238 HydrophobicContact CG1-CD2 4.22Å; K200-L238 HydrophobicContact CD-CD1 4.48Å; K200-L238 HydrophobicContact CG-CD1 3.78Å; W221-L238 HydrophobicContact CZ3-CD1 4.3Å; W221-L238 HydrophobicContact CZ3-CD2 3.99Å; W221-L238 HydrophobicContact CZ3-CG 4.17Å; R234-L238 HydrophobicContact CG-CD1 3.71Å; R234-L238 HydrophobicContact CG-CG 4.46Å; R234-L238 VanDerWaalsContact O-CB 3.23Å; R234-L238 WeakPolarHBondContact O-CB 3.31Å; R234-L238 WeakPolarHBondContact O-CG 2.81Å; R234-L238 PolarHBondContact O-N 3.37Å; L238-K240 PolarHBondContact O-N 2.95Å
239	N	81.8	Confident	72.1	Confident	92 Å²	92	94.3 Å²	94.3	49%	0.492	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	7.3	175.4	-60.4	-12.2	0	0	0	111.9	D235 G241	D235-N239 WeakPolarHBondContact O-CB 3.42Å; D235-N239 PolarHBondContact O-N 3.3Å; D235-N239 PolarHBondContact O-ND2 2.89Å; N239-G241 PolarHBondContact O-N 2.64Å
240	K	80.2	Confident	70.4	Confident	92 Å²	92	93.5 Å²	93.5	40%	0.4	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	38.4	-177.7	-57.4	-175.7	177.1	-175.8	0	113.5	Y236 V237 L238 Y242 L243	Y236-K240 PolarHBondContact O-N 3.19Å; V237-K240 PolarHBondContact O-N 3.33Å; L238-K240 PolarHBondContact O-N 2.95Å; K240-Y242 HydrophobicContact CB-CE1 4.19Å; K240-Y242 HydrophobicContact CG-CE1 4.48Å; K240-Y242 PolarHBondContact O-N 2.66Å; K240-L243 WeakPolarHBondContact O-CB 3.34Å; K240-L243 PolarHBondContact O-N 2.86Å
241	G	71.9	Confident	69.2	Low	34 Å²	34	99.1 Å²	99.1	35%	0.351	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	9.2	-176.5	0	0	0	0	0	115.2	Y236 N239	Y236-G241 WeakPolarHBondContact CE2-O 3.4Å; Y236-G241 VanDerWaalsContact CZ-O 3.3Å; Y236-G241 PolarHBondContact O-N 2.95Å; Y236-G241 PolarHBondContact OH-O 3.36Å; Y236-G241 VanDerWaalsContact OH-O 3.12Å; N239-G241 PolarHBondContact O-N 2.64Å
242	Y	71.9	Confident	68.1	Low	84 Å²	84	101.9 Å²	101.9	33%	0.329	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-14.2	166.6	54.9	-95.8	0	0	0	112.7	L54 Y236 K240	L54-Y242 HydrophobicContact CD1-CE2 4.16Å; Y236-Y242 HydrophobicContact CE1-CD1 4.29Å; Y236-Y242 VanDerWaalsContact OH-CA 3.27Å; Y236-Y242 WeakPolarHBondContact OH-CA 3.09Å; Y236-Y242 WeakPolarHBondContact OH-CB 3.23Å; K240-Y242 HydrophobicContact CB-CE1 4.19Å; K240-Y242 HydrophobicContact CG-CE1 4.48Å; K240-Y242 PolarHBondContact O-N 2.66Å
243	L	65.2	Low	66.7	Low	48 Å²	48	102.7 Å²	102.7	25%	0.251	50%	0.503	S	S	.	.	S	Bend	trans	-82.2	129.5	159.2	-104	73.9	0	0	0	107.5	E51 K240 E245	E51-L243 WeakPolarHBondContact OE1-CG 3.41Å; K240-L243 WeakPolarHBondContact O-CB 3.34Å; K240-L243 PolarHBondContact O-N 2.86Å; L243-E245 PolarHBondContact O-N 3.04Å
244	D	54.8	Low	65.8	Low	138 Å²	138	101.5 Å²	101.5	74%	0.738	50%	0.501	S	S	*	.			trans	-73.1	76.2	168.8	-86.2	-25	0	0	0	108.2	E246 E247	D244-E246 PolarHBondContact O-N 3.41Å; D244-E247 PolarHBondContact O-N 2.87Å
245	E	55.1	Low	64.9	Low	92 Å²	92	104.6 Å²	104.6	43%	0.43	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-59.2	-8.2	172.3	-76.4	-178.2	159.9	0	0	112.6	L243 E247 D248 D249	L243-E245 PolarHBondContact O-N 3.04Å; E245-E247 PolarHBondContact O-N 3.29Å; E245-D248 PolarHBondContact O-N 3.28Å; E245-D248 VanDerWaalsContact O-N 3.1Å; E245-D249 PolarHBondContact O-N 3.46Å; E245-D249 VanDerWaalsContact O-N 3.09Å
246	E	49.1	Very low	63.2	Low	162 Å²	162	109.7 Å²	109.7	76%	0.757	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-60.5	-19.9	176	-67	-166.2	174.2	0	0	113.5	D244	D244-E246 PolarHBondContact O-N 3.41Å
247	E	48.4	Very low	61.5	Low	168 Å²	168	110.4 Å²	110.4	79%	0.785	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-86.5	-26.2	172.5	-95.3	-174.9	174.4	0	0	114.1	D244 E245	D244-E247 PolarHBondContact O-N 2.87Å; E245-E247 PolarHBondContact O-N 3.29Å
248	D	51.2	Low	60.4	Low	111 Å²	111	115.4 Å²	115.4	59%	0.594	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-33.3	-176.9	-79	-36.6	0	0	0	113.3	E245 D250 E251 R252	E245-D248 PolarHBondContact O-N 3.28Å; E245-D248 VanDerWaalsContact O-N 3.1Å; D248-D250 VanDerWaalsContact C-N 3.29Å; D248-D250 PolarHBondContact O-N 2.96Å; D248-E251 PolarHBondContact O-N 2.89Å; D248-R252 PolarHBondContact O-N 2.93Å
249	D	48.4	Very low	59.2	Low	114 Å²	114	120.8 Å²	120.8	61%	0.61	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-25.3	178.7	-84.8	-22.6	0	0	0	112.9	E245 E251	E245-D249 PolarHBondContact O-N 3.46Å; E245-D249 VanDerWaalsContact O-N 3.09Å; D249-E251 PolarHBondContact O-N 3.37Å
250	D	49.9	Very low	57.8	Low	150 Å²	150	119.7 Å²	119.7	80%	0.802	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-14.8	173.9	-84.5	-15.6	0	0	0	112.9	D248	D248-D250 VanDerWaalsContact C-N 3.29Å; D248-D250 PolarHBondContact O-N 2.96Å
251	E	54.8	Low	56	Low	163 Å²	163	122.2 Å²	122.2	76%	0.762	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	-12	-178.7	-62.3	-158.9	161.7	0	0	114.6	D248 D249 I253	D248-E251 PolarHBondContact O-N 2.89Å; D249-E251 PolarHBondContact O-N 3.37Å; E251-I253 PolarHBondContact O-N 2.85Å
252	R	60.3	Low	54.7	Low	197 Å²	197	128 Å²	128	74%	0.743	63%	0.626	S	S	*	*			trans	-84.7	96.3	179.4	-164.9	169.5	-165.4	-109.8	1.4	112.4	D248 P254	D248-R252 PolarHBondContact O-N 2.93Å; R252-P254 VanDerWaalsContact O-CD 3.3Å; R252-P254 WeakPolarHBondContact O-CD 3.32Å
253	I	56.4	Low	53.4	Low	151 Å²	151	131.7 Å²	131.7	77%	0.774	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-75.3	118.8	173.3	-54.6	162.9	0	0	0	109.2	E251	E251-I253 PolarHBondContact O-N 2.85Å
254	P	64.2	Low	52.3	Low	72 Å²	72	134.5 Å²	134.5	47%	0.468	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-57.8	143.5	175.2	-25.7	36	0	0	0	112.1	R252	R252-P254 VanDerWaalsContact O-CD 3.3Å; R252-P254 WeakPolarHBondContact O-CD 3.32Å
255	T	63.7	Low	51.7	Low	106 Å²	106	135.1 Å²	135.1	65%	0.65	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-80.2	144.8	-175.7	-50.7	0	0	0	0	110.1	D257 E258	T255-D257 PolarHBondContact O-N 3.35Å; T255-E258 WeakPolarHBondContact O-CB 3.43Å; T255-E258 PolarHBondContact O-N 3Å
256	Y	47.9	Very low	50.9	Low	188 Å²	188	138.4 Å²	138.4	74%	0.737	69%	0.694	S	S	*	*	H	α-helix	trans	-49.5	-24.6	-176.1	-179.5	-99.5	0	0	0	115.7	V260	Y256-V260 HydrophobicContact CD1-CG2 4.17Å; Y256-V260 HydrophobicContact CD2-CG2 4.19Å; Y256-V260 HydrophobicContact CE1-CG2 3.87Å; Y256-V260 HydrophobicContact CE2-CG2 3.9Å; Y256-V260 HydrophobicContact CG-CG2 4.33Å; Y256-V260 WeakPolarHBondContact O-CB 3.3Å; Y256-V260 WeakPolarHBondContact O-CG2 3.32Å; Y256-V260 PolarHBondContact O-N 3.42Å
257	D	50.1	Low	51	Low	107 Å²	107	134.1 Å²	134.1	57%	0.572	68%	0.682	S	S	*	*	H	α-helix	trans	-77.1	-24.2	178.7	-159.6	38.7	0	0	0	113.3	T255 Q261	T255-D257 PolarHBondContact O-N 3.35Å; D257-Q261 PolarHBondContact OD1-NE2 3.39Å
258	E	62.5	Low	51.2	Low	138 Å²	138	134.8 Å²	134.8	65%	0.645	69%	0.685	S	S	*	*	H	α-helix	trans	-80.9	-28.4	179.6	-161.4	171.2	-159.2	0	0	111.8	T255	T255-E258 WeakPolarHBondContact O-CB 3.43Å; T255-E258 PolarHBondContact O-N 3Å
259	L	56.3	Low	51.3	Low	129 Å²	129	136.9 Å²	136.9	68%	0.675	69%	0.692	S	S	*	*	H	α-helix	trans	-86.9	-15.4	176.5	-70.8	167.2	0	0	0	113.7
260	V	51.7	Low	51.8	Low	70 Å²	70	137.7 Å²	137.7	42%	0.424	69%	0.692	S	S	.	*	H	α-helix	trans	-96.9	-12.5	-174.8	170.1	0	0	0	0	112.4	Y256	Y256-V260 HydrophobicContact CD1-CG2 4.17Å; Y256-V260 HydrophobicContact CD2-CG2 4.19Å; Y256-V260 HydrophobicContact CE1-CG2 3.87Å; Y256-V260 HydrophobicContact CE2-CG2 3.9Å; Y256-V260 HydrophobicContact CG-CG2 4.33Å; Y256-V260 WeakPolarHBondContact O-CB 3.3Å; Y256-V260 WeakPolarHBondContact O-CG2 3.32Å; Y256-V260 PolarHBondContact O-N 3.42Å
261	Q	42.7	Very low	52.5	Low	144 Å²	144	132.6 Å²	132.6	67%	0.673	67%	0.674	S	S	*	*	S	Bend	trans	-95.2	4.9	-179.1	-70.9	-176.5	16.8	0	0	114.8	D257 D263	D257-Q261 PolarHBondContact OD1-NE2 3.39Å; Q261-D263 PolarHBondContact O-N 3.05Å
262	E	43.8	Very low	53	Low	157 Å²	157	131.6 Å²	131.6	73%	0.734	67%	0.67	S	S	*	*			trans	-91	54	172.9	-149.7	172.5	-147.6	0	0	111	V264	E262-V264 HydrophobicContact CG-CB 4.4Å; E262-V264 HydrophobicContact CG-CG2 3.51Å; E262-V264 PolarHBondContact O-N 3.17Å
263	D	45.7	Very low	53.6	Low	161 Å²	161	123.8 Å²	123.8	86%	0.861	65%	0.646	S	S	*	*			trans	-77.1	68.4	157.2	-74.5	-31.6	0	0	0	107.2	Q261	Q261-D263 PolarHBondContact O-N 3.05Å
264	V	41.3	Very low	54.5	Low	107 Å²	107	123 Å²	123	65%	0.648	64%	0.637	S	S	*	*			trans	-81	117.2	171	175.6	0	0	0	0	107.1	E262 D266	E262-V264 HydrophobicContact CG-CB 4.4Å; E262-V264 HydrophobicContact CG-CG2 3.51Å; E262-V264 PolarHBondContact O-N 3.17Å; V264-D266 PolarHBondContact O-N 3.33Å
265	D	41.9	Very low	55.3	Low	151 Å²	151	124.4 Å²	124.4	81%	0.807	64%	0.64	S	S	*	*			trans	-37.3	132.5	175.5	-113.3	-23.3	0	0	0	111.9	S267	D265-S267 PolarHBondContact O-N 3.1Å
266	D	39.3	Very low	56.1	Low	160 Å²	160	125.4 Å²	125.4	86%	0.856	64%	0.637	S	S	*	*			trans	-53.6	80.3	171.4	-78.1	-41.6	0	0	0	110.7	V264	V264-D266 PolarHBondContact O-N 3.33Å
267	S	51	Low	57.8	Low	72 Å²	72	124.1 Å²	124.1	50%	0.503	63%	0.631	S	S	.	*			trans	-78.1	132.9	174	173.6	0	0	0	0	108.7	D265 E269 E270	D265-S267 PolarHBondContact O-N 3.1Å; S267-E269 PolarHBondContact O-N 3.03Å; S267-E270 PolarHBondContact O-N 3.41Å
268	E	51.9	Low	59.5	Low	183 Å²	183	123.2 Å²	123.2	86%	0.855	62%	0.623	S	S	*	*	H	α-helix	trans	-53	-17.9	-175.4	-60.9	-179.6	158.8	0	0	114.2
269	E	53	Low	60.6	Low	155 Å²	155	122.7 Å²	122.7	72%	0.724	62%	0.621	S	S	*	*	H	α-helix	trans	-69.6	-30.7	178.2	-169.7	161.9	-164.7	0	0	113.7	S267 G271 E272	S267-E269 PolarHBondContact O-N 3.03Å; E269-G271 VanDerWaalsContact C-N 3.34Å; E269-G271 PolarHBondContact O-N 3.06Å; E269-E272 PolarHBondContact O-N 3.39Å
270	E	58.9	Low	62	Low	130 Å²	130	119.6 Å²	119.6	61%	0.607	61%	0.605	S	S	*	*	H	α-helix	trans	-74.7	-27.1	179	-160.6	171.7	-170.7	0	0	112.1	S267 E272 S273 F274	S267-E270 PolarHBondContact O-N 3.41Å; E270-E272 VanDerWaalsContact C-N 3.34Å; E270-E272 PolarHBondContact O-N 2.88Å; E270-S273 PolarHBondContact O-N 3.42Å; E270-S273 PolarHBondContact O-OG 2.79Å; E270-F274 PolarHBondContact O-N 2.98Å
271	G	64.9	Low	63.6	Low	43 Å²	43	122.6 Å²	122.6	44%	0.443	61%	0.612	S	S	.	*	H	α-helix	trans	-65.8	-32	174.7	0	0	0	0	0	113.9	E269 F274 L275	E269-G271 VanDerWaalsContact C-N 3.34Å; E269-G271 PolarHBondContact O-N 3.06Å; G271-F274 PolarHBondContact O-N 3.05Å; G271-L275 PolarHBondContact O-N 2.92Å
272	E	64.7	Low	65.8	Low	143 Å²	143	120.5 Å²	120.5	67%	0.668	60%	0.603	S	S	*	*	H	α-helix	trans	-70.4	-39.3	175	-62.9	-169	166.1	0	0	111.1	E269 E270 F274 L275 E276	E269-E272 PolarHBondContact O-N 3.39Å; E270-E272 VanDerWaalsContact C-N 3.34Å; E270-E272 PolarHBondContact O-N 2.88Å; E272-F274 PolarHBondContact O-N 2.79Å; E272-L275 PolarHBondContact O-N 3.2Å; E272-L275 VanDerWaalsContact O-N 3.16Å; E272-E276 PolarHBondContact O-N 2.82Å
273	S	73.3	Confident	67.7	Low	33 Å²	33	118.9 Å²	118.9	23%	0.231	59%	0.59	C	S	.	*	H	α-helix	trans	-63.1	-29.2	174.5	84.6	0	0	0	0	112.8	E270 R277	E270-S273 PolarHBondContact O-N 3.42Å; E270-S273 PolarHBondContact O-OG 2.79Å; S273-R277 WeakPolarHBondContact O-CB 3.44Å; S273-R277 WeakPolarHBondContact O-CG 3.28Å; S273-R277 PolarHBondContact O-N 2.79Å; S273-R277 PolarHBondContact OG-NH1 2.84Å
274	F	76	Confident	69.4	Low	133 Å²	133	113.2 Å²	113.2	58%	0.583	56%	0.563	S	S	*	*	H	α-helix	trans	-72	-40.8	175	-178.6	-94.1	0	0	0	111.9	E270 G271 E272 R277 Q278	E270-F274 PolarHBondContact O-N 2.98Å; G271-F274 PolarHBondContact O-N 3.05Å; E272-F274 PolarHBondContact O-N 2.79Å; F274-R277 PolarHBondContact O-N 3.29Å; F274-Q278 PolarHBondContact O-N 2.97Å
275	L	80.6	Confident	71.3	Confident	102 Å²	102	114.5 Å²	114.5	53%	0.534	56%	0.557	S	S	.	*	H	α-helix	trans	-65.2	-43.2	174.2	-83.4	162.8	0	0	0	111.6	G271 E272 R277 Q278 E279	G271-L275 PolarHBondContact O-N 2.92Å; E272-L275 PolarHBondContact O-N 3.2Å; E272-L275 VanDerWaalsContact O-N 3.16Å; L275-R277 PolarHBondContact O-N 3.32Å; L275-Q278 CarbonylContact O-C 3.57Å; L275-Q278 WeakPolarHBondContact O-CA 3.27Å; L275-Q278 WeakPolarHBondContact O-CB 3.48Å; L275-Q278 PolarHBondContact O-N 2.98Å; L275-E279 WeakPolarHBondContact O-CG 3.41Å; L275-E279 PolarHBondContact O-N 3.36Å
276	E	80.6	Confident	73.4	Confident	127 Å²	127	112.7 Å²	112.7	59%	0.593	55%	0.547	S	S	*	.	H	α-helix	trans	-64.2	-40.6	177.3	-164.3	171.2	-157.2	0	0	111.6	E272 Q278 E279 D280	E272-E276 PolarHBondContact O-N 2.82Å; E276-Q278 VanDerWaalsContact C-N 3.26Å; E276-Q278 PolarHBondContact O-N 3.49Å; E276-E279 PolarHBondContact O-N 3.06Å; E276-D280 WeakPolarHBondContact O-CB 3.27Å; E276-D280 PolarHBondContact O-N 2.81Å
277	R	84.3	Confident	75.4	Confident	162 Å²	162	109.6 Å²	109.6	61%	0.611	53%	0.526	S	S	*	.	H	α-helix	trans	-61.6	-32.9	171.2	-78	174	-178	124.4	-4.7	112.7	S273 F274 L275 F281	S273-R277 WeakPolarHBondContact O-CB 3.44Å; S273-R277 WeakPolarHBondContact O-CG 3.28Å; S273-R277 PolarHBondContact O-N 2.79Å; S273-R277 PolarHBondContact OG-NH1 2.84Å; F274-R277 PolarHBondContact O-N 3.29Å; L275-R277 PolarHBondContact O-N 3.32Å; R277-F281 WeakPolarHBondContact O-CB 3.38Å; R277-F281 PolarHBondContact O-N 3.13Å
278	Q	85.9	Confident	76.6	Confident	87 Å²	87	112.5 Å²	112.5	41%	0.407	53%	0.526	S	S	.	.	H	α-helix	trans	-74.3	-40.5	175.9	-172.2	164.7	-31.3	0	0	111.7	F274 L275 E276 F281 E282	F274-Q278 PolarHBondContact O-N 2.97Å; L275-Q278 CarbonylContact O-C 3.57Å; L275-Q278 WeakPolarHBondContact O-CA 3.27Å; L275-Q278 WeakPolarHBondContact O-CB 3.48Å; L275-Q278 PolarHBondContact O-N 2.98Å; E276-Q278 VanDerWaalsContact C-N 3.26Å; E276-Q278 PolarHBondContact O-N 3.49Å; Q278-F281 WeakPolarHBondContact O-CB 3.32Å; Q278-F281 PolarHBondContact O-N 3.21Å; Q278-E282 WeakPolarHBondContact O-CG 3.37Å; Q278-E282 PolarHBondContact O-N 2.93Å
279	E	85.9	Confident	77.6	Confident	127 Å²	127	112.9 Å²	112.9	59%	0.593	53%	0.525	S	S	*	.	H	α-helix	trans	-63.3	-39.8	172.9	-70.4	-177.4	-177.3	0	0	111.9	L275 E276 F281 E282 R283	L275-E279 WeakPolarHBondContact O-CG 3.41Å; L275-E279 PolarHBondContact O-N 3.36Å; E276-E279 PolarHBondContact O-N 3.06Å; E279-F281 VanDerWaalsContact C-N 3.33Å; E279-F281 PolarHBondContact O-N 2.68Å; E279-E282 PolarHBondContact O-N 2.77Å; E279-R283 WeakPolarHBondContact O-CB 3.44Å; E279-R283 PolarHBondContact O-N 3.14Å
280	D	84.1	Confident	78.9	Confident	64 Å²	64	112.9 Å²	112.9	34%	0.342	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-38.5	172	-80.9	-24.9	0	0	0	112.2	E276 R283 S284	E276-D280 WeakPolarHBondContact O-CB 3.27Å; E276-D280 PolarHBondContact O-N 2.81Å; D280-R283 PolarHBondContact O-N 3.43Å; D280-R283 IonicContact OD1-CZ 2.77Å; D280-R283 IonicContact OD1-NH1 3.37Å; D280-R283 PolarHBondContact OD1-NH1 2.85Å; D280-R283 IonicContact OD1-NH2 3.43Å; D280-R283 PolarHBondContact OD1-NH2 3.38Å; D280-S284 VanDerWaalsContact O-CB 3.31Å; D280-S284 WeakPolarHBondContact O-CB 3.32Å; D280-S284 PolarHBondContact O-N 2.78Å; D280-S284 PolarHBondContact O-OG 3.24Å
281	F	85.3	Confident	79.9	Confident	133 Å²	133	110.2 Å²	110.2	58%	0.583	51%	0.513	S	S	*	.	H	α-helix	trans	-66.6	-42.6	174.5	-178.7	-98.6	0	0	0	111.5	R277 Q278 E279 S284 Y285	R277-F281 WeakPolarHBondContact O-CB 3.38Å; R277-F281 PolarHBondContact O-N 3.13Å; Q278-F281 WeakPolarHBondContact O-CB 3.32Å; Q278-F281 PolarHBondContact O-N 3.21Å; E279-F281 VanDerWaalsContact C-N 3.33Å; E279-F281 PolarHBondContact O-N 2.68Å; F281-S284 WeakPolarHBondContact CA-OG 3.49Å; F281-S284 PolarHBondContact O-OG 3.1Å; F281-S284 VanDerWaalsContact O-OG 3.06Å; F281-Y285 WeakPolarHBondContact O-CB 3.48Å; F281-Y285 PolarHBondContact O-N 3.42Å
282	E	88.8	Confident	80.4	Confident	101 Å²	101	115 Å²	115	47%	0.472	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-40	175.5	-71	-177.5	-166.8	0	0	111.7	Q278 E279 Y285 N286	Q278-E282 WeakPolarHBondContact O-CG 3.37Å; Q278-E282 PolarHBondContact O-N 2.93Å; E279-E282 PolarHBondContact O-N 2.77Å; E282-Y285 PolarHBondContact O-N 3.44Å; E282-N286 VanDerWaalsContact O-CB 3.27Å; E282-N286 WeakPolarHBondContact O-CB 2.96Å; E282-N286 PolarHBondContact O-N 3.2Å; E282-N286 PolarHBondContact O-ND2 3.46Å; E282-N286 VanDerWaalsContact O-ND2 3.13Å
283	R	84.3	Confident	80.7	Confident	123 Å²	123	110.2 Å²	110.2	46%	0.464	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-54.3	174.1	-169.9	-179.6	70	-114.4	-4.8	110.4	E279 D280 Y285 N286 F287	E279-R283 WeakPolarHBondContact O-CB 3.44Å; E279-R283 PolarHBondContact O-N 3.14Å; D280-R283 PolarHBondContact O-N 3.43Å; D280-R283 IonicContact OD1-CZ 2.77Å; D280-R283 IonicContact OD1-NH1 3.37Å; D280-R283 PolarHBondContact OD1-NH1 2.85Å; D280-R283 IonicContact OD1-NH2 3.43Å; D280-R283 PolarHBondContact OD1-NH2 3.38Å; R283-Y285 PolarHBondContact O-N 3.28Å; R283-N286 PolarHBondContact O-N 3.26Å; R283-N286 VanDerWaalsContact O-N 3.16Å; R283-F287 HydrophobicContact CB-CD2 4.47Å; R283-F287 HydrophobicContact CG-CD2 3.55Å; R283-F287 HydrophobicContact CG-CE2 3.9Å; R283-F287 WeakPolarHBondContact O-CB 3.39Å; R283-F287 WeakPolarHBondContact O-CD2 3.35Å; R283-F287 PolarHBondContact O-N 3.1Å
284	S	82.2	Confident	80.4	Confident	41 Å²	41	111.3 Å²	111.3	29%	0.287	54%	0.536	S	S	.	.	H	α-helix	trans	-64	-27.2	179.5	62.8	0	0	0	0	112.9	D280 F281 R288	D280-S284 VanDerWaalsContact O-CB 3.31Å; D280-S284 WeakPolarHBondContact O-CB 3.32Å; D280-S284 PolarHBondContact O-N 2.78Å; D280-S284 PolarHBondContact O-OG 3.24Å; F281-S284 WeakPolarHBondContact CA-OG 3.49Å; F281-S284 PolarHBondContact O-OG 3.1Å; F281-S284 VanDerWaalsContact O-OG 3.06Å; S284-R288 WeakPolarHBondContact O-CG 3.4Å; S284-R288 PolarHBondContact O-N 3.41Å
285	Y	79.7	Confident	80.3	Confident	135 Å²	135	113.4 Å²	113.4	53%	0.529	55%	0.553	S	S	.	*	H	α-helix	trans	-77.4	-36.8	173.2	-173.2	-87.5	0	0	0	113.5	F281 E282 R283 R288	F281-Y285 WeakPolarHBondContact O-CB 3.48Å; F281-Y285 PolarHBondContact O-N 3.42Å; E282-Y285 PolarHBondContact O-N 3.44Å; R283-Y285 PolarHBondContact O-N 3.28Å; Y285-R288 VanDerWaalsContact CD2-NH1 3.31Å; Y285-R288 WeakPolarHBondContact O-CD 3.44Å; Y285-R288 WeakPolarHBondContact O-CG 3.41Å
286	N	87.1	Confident	80.2	Confident	113 Å²	113	116 Å²	116	60%	0.604	56%	0.562	S	S	*	*	H	α-helix	trans	-76.2	-36	177.6	-70	-26.6	0	0	0	111.6	E282 R283	E282-N286 VanDerWaalsContact O-CB 3.27Å; E282-N286 WeakPolarHBondContact O-CB 2.96Å; E282-N286 PolarHBondContact O-N 3.2Å; E282-N286 PolarHBondContact O-ND2 3.46Å; E282-N286 VanDerWaalsContact O-ND2 3.13Å; R283-N286 PolarHBondContact O-N 3.26Å; R283-N286 VanDerWaalsContact O-N 3.16Å
287	F	80.9	Confident	80.2	Confident	95 Å²	95	117.2 Å²	117.2	42%	0.417	57%	0.571	S	S	.	*	S	Bend	trans	-100.4	22.1	-178	-61.9	-73	0	0	0	113.8	R283 F289 E290 E291	R283-F287 HydrophobicContact CB-CD2 4.47Å; R283-F287 HydrophobicContact CG-CD2 3.55Å; R283-F287 HydrophobicContact CG-CE2 3.9Å; R283-F287 WeakPolarHBondContact O-CB 3.39Å; R283-F287 WeakPolarHBondContact O-CD2 3.35Å; R283-F287 PolarHBondContact O-N 3.1Å; F287-F289 PolarHBondContact O-N 3.45Å; F287-E290 HydrophobicContact CB-CB 4.48Å; F287-E290 HydrophobicContact CD1-CB 4.49Å; F287-E290 WeakPolarHBondContact CD1-OE2 3.5Å; F287-E290 PolarHBondContact O-N 2.88Å; F287-E291 HydrophobicContact CB-CG 4.1Å; F287-E291 PolarHBondContact O-N 2.89Å
288	R	77.4	Confident	80.1	Confident	133 Å²	133	117.8 Å²	117.8	50%	0.502	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-50.4	-22	-178.6	-70.6	168.5	84.9	87.7	2.4	115.2	S284 Y285 A294	S284-R288 WeakPolarHBondContact O-CG 3.4Å; S284-R288 PolarHBondContact O-N 3.41Å; Y285-R288 VanDerWaalsContact CD2-NH1 3.31Å; Y285-R288 WeakPolarHBondContact O-CD 3.44Å; Y285-R288 WeakPolarHBondContact O-CG 3.41Å; R288-A294 WeakPolarHBondContact O-CB 3.25Å
289	F	71.9	Confident	80	Confident	190 Å²	190	119.6 Å²	119.6	83%	0.833	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-11.4	-177.9	-58.9	-73.3	0	0	0	113.7	F287	F287-F289 PolarHBondContact O-N 3.45Å
290	E	80.6	Confident	79.8	Confident	155 Å²	155	122.3 Å²	122.3	72%	0.724	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-26.6	-178.1	-63.7	-176.8	-175.4	0	0	111.7	F287	F287-E290 HydrophobicContact CB-CB 4.48Å; F287-E290 HydrophobicContact CD1-CB 4.49Å; F287-E290 WeakPolarHBondContact CD1-OE2 3.5Å; F287-E290 PolarHBondContact O-N 2.88Å
291	E	78.9	Confident	79.7	Confident	75 Å²	75	123.6 Å²	123.6	35%	0.35	61%	0.613	S	S	.	*	S	Bend	trans	-69.6	135.3	177	-71.1	-169.8	166.9	0	0	112.4	F287 G293 A294	F287-E291 HydrophobicContact CB-CG 4.1Å; F287-E291 PolarHBondContact O-N 2.89Å; E291-G293 PolarHBondContact O-N 2.86Å; E291-A294 PolarHBondContact O-N 3.31Å
292	P	77.1	Confident	79.1	Confident	142 Å²	142	129 Å²	129	92%	0.922	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	106.4	177.5	26.8	-33	0	0	0	109.6
293	G	70.1	Confident	78.3	Confident	43 Å²	43	130 Å²	130	44%	0.443	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	138.1	-10.5	-176.9	0	0	0	0	0	114.8	E291 L295 Q296	E291-G293 PolarHBondContact O-N 2.86Å; G293-L295 PolarHBondContact O-N 3.11Å; G293-L295 VanDerWaalsContact O-N 3.15Å; G293-Q296 WeakPolarHBondContact O-CB 3.46Å; G293-Q296 PolarHBondContact O-N 2.96Å
294	A	67.8	Low	77.7	Confident	56 Å²	56	128.7 Å²	128.7	46%	0.463	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56	-29.5	176.7	0	0	0	0	0	114.7	R288 E291 Q296	R288-A294 WeakPolarHBondContact O-CB 3.25Å; E291-A294 PolarHBondContact O-N 3.31Å; A294-Q296 VanDerWaalsContact C-N 3.29Å
295	L	73.8	Confident	76.9	Confident	178 Å²	178	131.6 Å²	131.6	93%	0.932	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-13.2	178	-64.4	173.7	0	0	0	112.9	G293	G293-L295 PolarHBondContact O-N 3.11Å; G293-L295 VanDerWaalsContact O-N 3.15Å
296	Q	78.1	Confident	76.4	Confident	157 Å²	157	131 Å²	131	73%	0.734	68%	0.677	S	S	*	*	S	Bend	trans	-95.9	110.7	-175.8	-157.6	163.5	-1.9	0	0	109.9	G293 A294 K298	G293-Q296 WeakPolarHBondContact O-CB 3.46Å; G293-Q296 PolarHBondContact O-N 2.96Å; A294-Q296 VanDerWaalsContact C-N 3.29Å; Q296-K298 PolarHBondContact O-N 3.36Å; Q296-K298 VanDerWaalsContact O-N 3.14Å
297	I	79.6	Confident	75.8	Confident	151 Å²	151	128.3 Å²	128.3	77%	0.774	67%	0.666	S	S	*	*			trans	-71	109.4	-179.5	-59.7	169.4	0	0	0	108.5	T299	I297-T299 HydrophobicContact CG2-CG2 4.45Å; I297-T299 PolarHBondContact O-N 3.49Å
298	K	81.8	Confident	75.1	Confident	174 Å²	174	131.1 Å²	131.1	76%	0.757	69%	0.691	S	S	*	*			trans	-64.3	116.8	172.5	-63.4	-175.5	-179.8	-177.1	0	109.5	Q296	Q296-K298 PolarHBondContact O-N 3.36Å; Q296-K298 VanDerWaalsContact O-N 3.14Å
299	T	84.1	Confident	74.9	Confident	125 Å²	125	134.9 Å²	134.9	77%	0.767	71%	0.705	S	S	*	*			trans	-106.9	118.2	174.5	58	0	0	0	0	110.3	I297	I297-T299 HydrophobicContact CG2-CG2 4.45Å; I297-T299 PolarHBondContact O-N 3.49Å
300	Y	81.6	Confident	74.9	Confident	185 Å²	185	132.1 Å²	132.1	73%	0.725	70%	0.704	S	S	*	*			trans	-87.4	145.2	173.8	-62.1	-78.4	0	0	0	111.2	R302	Y300-R302 PolarHBondContact O-N 3.4Å
301	P	83.8	Confident	74.6	Confident	91 Å²	91	130.2 Å²	130.2	59%	0.591	69%	0.693	S	S	*	*			trans	-62.2	137.4	178	25.6	-33.5	0	0	0	110.8	N303	P301-N303 PolarHBondContact O-N 2.89Å
302	R	71.4	Confident	74.4	Confident	246 Å²	246	133.5 Å²	133.5	93%	0.928	71%	0.713	S	S	*	*	S	Bend	trans	-64.1	-23.7	177.6	-72.6	-174.2	164	96.5	0.8	113.2	Y300	Y300-R302 PolarHBondContact O-N 3.4Å
303	N	72.9	Confident	74.6	Confident	121 Å²	121	130.8 Å²	130.8	65%	0.647	69%	0.691	S	S	*	*	S	Bend	trans	-102.8	99.4	174.1	-69.3	-29.2	0	0	0	107.8	P301 A305	P301-N303 PolarHBondContact O-N 2.89Å; N303-A305 PolarHBondContact O-N 3.46Å
304	I	70.9	Confident	75.2	Confident	97 Å²	97	138 Å²	138	50%	0.497	71%	0.705	S	S	.	*			trans	-83.8	112.8	174.8	-58.5	160.2	0	0	0	106.1	T306 S307	I304-T306 WeakPolarHBondContact CG2-OG1 3.41Å; I304-T306 PolarHBondContact O-N 3.45Å; I304-S307 WeakPolarHBondContact O-CB 3.44Å; I304-S307 PolarHBondContact O-N 2.87Å; I304-S307 PolarHBondContact O-OG 2.98Å
305	A	64.8	Low	75.6	Confident	102 Å²	102	144.2 Å²	144.2	84%	0.843	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-22.6	178.9	0	0	0	0	0	112	N303 S307	N303-A305 PolarHBondContact O-N 3.46Å; A305-S307 PolarHBondContact O-N 2.61Å
306	T	70.4	Confident	76.2	Confident	123 Å²	123	141.4 Å²	141.4	76%	0.755	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	6.8	174.8	64.8	0	0	0	0	114	I304 V308	I304-T306 WeakPolarHBondContact CG2-OG1 3.41Å; I304-T306 PolarHBondContact O-N 3.45Å; T306-V308 PolarHBondContact O-N 2.69Å
307	S	73.5	Confident	76.5	Confident	55 Å²	55	139.2 Å²	139.2	39%	0.385	69%	0.686	S	S	.	*			trans	-72.1	118	175.8	77.6	0	0	0	0	109.9	I304 A305 R309	I304-S307 WeakPolarHBondContact O-CB 3.44Å; I304-S307 PolarHBondContact O-N 2.87Å; I304-S307 PolarHBondContact O-OG 2.98Å; A305-S307 PolarHBondContact O-N 2.61Å; S307-R309 PolarHBondContact O-N 3.04Å
308	V	66.1	Low	76.9	Confident	154 Å²	154	138.5 Å²	138.5	93%	0.933	68%	0.678	S	S	*	*	S	Bend	trans	-57.1	0.9	173.7	-179.9	0	0	0	0	113.7	T306	T306-V308 PolarHBondContact O-N 2.69Å
309	R	73.5	Confident	77.1	Confident	212 Å²	212	137.9 Å²	137.9	80%	0.8	67%	0.671	S	S	*	*	S	Bend	trans	-90.1	117.5	178.2	-169.6	175.9	-176.7	163.8	3.6	110.5	S307	S307-R309 PolarHBondContact O-N 3.04Å
310	T	73.1	Confident	77.1	Confident	132 Å²	132	135.6 Å²	135.6	81%	0.81	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-59.4	135	171	43.3	0	0	0	0	111.4
311	K	72.8	Confident	77.5	Confident	115 Å²	115	132.4 Å²	132.4	50%	0.5	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-97.1	140.3	172.7	-68.8	179.3	-174.4	166.5	0	109.4	D313	K311-D313 PolarHBondContact O-N 3.16Å; K311-D313 VanDerWaalsContact O-N 3.09Å
312	D	76.4	Confident	77.8	Confident	145 Å²	145	131.7 Å²	131.7	78%	0.775	64%	0.637	S	S	*	*			trans	-78.9	90.2	179.3	-77.9	-35.9	0	0	0	111.4	R314	D312-R314 VanDerWaalsContact C-N 3.35Å; D312-R314 PolarHBondContact O-N 3.3Å
313	D	79.7	Confident	78.7	Confident	85 Å²	85	126.7 Å²	126.7	46%	0.455	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.6	4.8	-178.5	-69.2	-39.6	0	0	0	115	K311 R315 K316 Q317	K311-D313 PolarHBondContact O-N 3.16Å; K311-D313 VanDerWaalsContact O-N 3.09Å; D313-R315 PolarHBondContact O-N 2.95Å; D313-K316 HydrophobicContact CB-CB 4.44Å; D313-K316 WeakPolarHBondContact O-CA 3.23Å; D313-K316 WeakPolarHBondContact O-CB 3.39Å; D313-K316 PolarHBondContact O-N 3.49Å; D313-Q317 PolarHBondContact O-N 3.07Å
314	R	82.9	Confident	79.4	Confident	193 Å²	193	125.8 Å²	125.8	73%	0.728	61%	0.614	S	S	*	*	H	α-helix	trans	-53.3	-30.1	179.2	-69.6	178.5	172.4	174.6	-3	114.2	D312 K318	D312-R314 VanDerWaalsContact C-N 3.35Å; D312-R314 PolarHBondContact O-N 3.3Å; R314-K318 VanDerWaalsContact O-CG 3.26Å; R314-K318 WeakPolarHBondContact O-CG 3.47Å; R314-K318 PolarHBondContact O-N 3.28Å
315	R	77.6	Confident	80.2	Confident	187 Å²	187	129.1 Å²	129.1	71%	0.706	62%	0.62	S	S	*	*	H	α-helix	trans	-82.1	-26.9	177.3	-170.6	179.3	-74.1	177.3	-1.5	112.1	D313 R319	D313-R315 PolarHBondContact O-N 2.95Å; R315-R319 WeakPolarHBondContact O-CD 3.32Å; R315-R319 VanDerWaalsContact O-CG 3.28Å; R315-R319 WeakPolarHBondContact O-CG 3.14Å; R315-R319 PolarHBondContact O-N 2.66Å
316	K	85.4	Confident	81.4	Confident	120 Å²	120	128.7 Å²	128.7	52%	0.522	60%	0.599	S	S	.	*	H	α-helix	trans	-72.4	-50.1	176.7	-169.9	-172.4	174.2	-163.7	0	109.7	D313 K318 R319 E320	D313-K316 HydrophobicContact CB-CB 4.44Å; D313-K316 WeakPolarHBondContact O-CA 3.23Å; D313-K316 WeakPolarHBondContact O-CB 3.39Å; D313-K316 PolarHBondContact O-N 3.49Å; K316-K318 PolarHBondContact O-N 3.2Å; K316-R319 WeakPolarHBondContact O-CA 3.32Å; K316-R319 WeakPolarHBondContact O-CB 3.32Å; K316-R319 PolarHBondContact O-N 3.49Å; K316-E320 VanDerWaalsContact CE-OE1 3.24Å; K316-E320 WeakPolarHBondContact CE-OE1 3.29Å; K316-E320 WeakPolarHBondContact CG-OE1 3.34Å; K316-E320 PolarHBondContact O-N 2.93Å
317	Q	83.9	Confident	81.9	Confident	110 Å²	110	127.4 Å²	127.4	51%	0.514	59%	0.587	S	S	.	*	H	α-helix	trans	-56.2	-45.7	174.2	-69.3	174.8	-16.4	0	0	112.2	D313 R319 E320 E321	D313-Q317 PolarHBondContact O-N 3.07Å; Q317-R319 PolarHBondContact O-N 3.03Å; Q317-R319 VanDerWaalsContact O-N 3.15Å; Q317-E320 WeakPolarHBondContact O-CB 3.37Å; Q317-E320 PolarHBondContact O-N 2.92Å; Q317-E320 VanDerWaalsContact O-N 3.07Å; Q317-E321 WeakPolarHBondContact O-CG 3.21Å; Q317-E321 PolarHBondContact O-N 3.38Å
318	K	88.2	Confident	82.3	Confident	137 Å²	137	130.3 Å²	130.3	60%	0.596	59%	0.593	S	S	*	*	H	α-helix	trans	-61.5	-24.4	174.5	-76	-178.4	-178.8	-168.5	0	114.5	R314 K316 V322	R314-K318 VanDerWaalsContact O-CG 3.26Å; R314-K318 WeakPolarHBondContact O-CG 3.47Å; R314-K318 PolarHBondContact O-N 3.28Å; K316-K318 PolarHBondContact O-N 3.2Å; K318-V322 WeakPolarHBondContact O-CG2 3.36Å; K318-V322 PolarHBondContact O-N 2.86Å
319	R	87.1	Confident	83.3	Confident	161 Å²	161	126.5 Å²	126.5	61%	0.608	57%	0.565	S	S	*	*	H	α-helix	trans	-81.7	-36.6	174.7	-72.5	167.8	178.7	179.3	-1.7	111	R315 K316 Q317 V322 K323	R315-R319 WeakPolarHBondContact O-CD 3.32Å; R315-R319 VanDerWaalsContact O-CG 3.28Å; R315-R319 WeakPolarHBondContact O-CG 3.14Å; R315-R319 PolarHBondContact O-N 2.66Å; K316-R319 WeakPolarHBondContact O-CA 3.32Å; K316-R319 WeakPolarHBondContact O-CB 3.32Å; K316-R319 PolarHBondContact O-N 3.49Å; Q317-R319 PolarHBondContact O-N 3.03Å; Q317-R319 VanDerWaalsContact O-N 3.15Å; R319-V322 PolarHBondContact O-N 3.22Å; R319-K323 WeakPolarHBondContact O-CG 3.41Å; R319-K323 PolarHBondContact O-N 3.44Å
320	E	83.1	Confident	83.9	Confident	76 Å²	76	122.3 Å²	122.3	36%	0.355	55%	0.552	S	S	.	*	H	α-helix	trans	-63.9	-46.9	174.1	-73	155.4	-174.9	0	0	110.4	K316 Q317 V322 K323 E324	K316-E320 VanDerWaalsContact CE-OE1 3.24Å; K316-E320 WeakPolarHBondContact CE-OE1 3.29Å; K316-E320 WeakPolarHBondContact CG-OE1 3.34Å; K316-E320 PolarHBondContact O-N 2.93Å; Q317-E320 WeakPolarHBondContact O-CB 3.37Å; Q317-E320 PolarHBondContact O-N 2.92Å; Q317-E320 VanDerWaalsContact O-N 3.07Å; E320-V322 VanDerWaalsContact C-N 3.29Å; E320-V322 PolarHBondContact O-N 3.44Å; E320-K323 CarbonylContact O-C 3.57Å; E320-K323 WeakPolarHBondContact O-CA 3.33Å; E320-K323 WeakPolarHBondContact O-CB 3.45Å; E320-K323 PolarHBondContact O-N 3.22Å; E320-E324 WeakPolarHBondContact O-CG 3.49Å; E320-E324 PolarHBondContact O-N 2.94Å
321	E	89.1	Confident	84.4	Confident	118 Å²	118	121.2 Å²	121.2	55%	0.551	54%	0.538	S	S	*	.	H	α-helix	trans	-56.8	-39.6	173.3	-71.1	171.1	-174	0	0	112.9	Q317 R325	Q317-E321 WeakPolarHBondContact O-CG 3.21Å; Q317-E321 PolarHBondContact O-N 3.38Å; E321-R325 WeakPolarHBondContact O-CB 3.49Å; E321-R325 PolarHBondContact O-N 3.44Å
322	V	91.6	Very high	84.9	Confident	77 Å²	77	120.9 Å²	120.9	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-69.9	-36.9	176.2	169.9	0	0	0	0	111.3	K318 R319 E320 K326	K318-V322 WeakPolarHBondContact O-CG2 3.36Å; K318-V322 PolarHBondContact O-N 2.86Å; R319-V322 PolarHBondContact O-N 3.22Å; E320-V322 VanDerWaalsContact C-N 3.29Å; E320-V322 PolarHBondContact O-N 3.44Å; V322-K326 WeakPolarHBondContact O-CG 3.29Å; V322-K326 PolarHBondContact O-N 2.93Å
323	K	90.8	Very high	85.2	Confident	141 Å²	141	118.6 Å²	118.6	61%	0.613	52%	0.522	S	S	*	.	H	α-helix	trans	-65.7	-47	174.8	-74.9	175.1	177.3	-172.3	0	110.7	R319 E320 R325 K326 L327	R319-K323 WeakPolarHBondContact O-CG 3.41Å; R319-K323 PolarHBondContact O-N 3.44Å; E320-K323 CarbonylContact O-C 3.57Å; E320-K323 WeakPolarHBondContact O-CA 3.33Å; E320-K323 WeakPolarHBondContact O-CB 3.45Å; E320-K323 PolarHBondContact O-N 3.22Å; K323-R325 VanDerWaalsContact C-N 3.31Å; K323-R325 PolarHBondContact O-N 3.35Å; K323-K326 CarbonylContact O-C 3.59Å; K323-K326 WeakPolarHBondContact O-CB 3.04Å; K323-K326 PolarHBondContact O-N 2.73Å; K323-K326 VanDerWaalsContact O-N 3.11Å; K323-L327 WeakPolarHBondContact O-CG 3.1Å; K323-L327 PolarHBondContact O-N 2.94Å
324	E	86.7	Confident	85.1	Confident	101 Å²	101	123.3 Å²	123.3	47%	0.472	53%	0.533	S	S	.	.	H	α-helix	trans	-60.9	-40.3	176.8	-73	179.7	-161.6	0	0	112.1	E320 K326 L327 K328	E320-E324 WeakPolarHBondContact O-CG 3.49Å; E320-E324 PolarHBondContact O-N 2.94Å; E324-K326 VanDerWaalsContact C-N 3.35Å; E324-K326 PolarHBondContact O-N 3.45Å; E324-L327 PolarHBondContact O-N 2.87Å; E324-K328 WeakPolarHBondContact O-CB 3.37Å; E324-K328 WeakPolarHBondContact O-CG 3.19Å; E324-K328 PolarHBondContact O-N 3.04Å; E324-K328 IonicContact OE2-NZ 3.93Å
325	R	87.8	Confident	85.2	Confident	168 Å²	168	119.7 Å²	119.7	63%	0.634	52%	0.524	S	S	*	.	H	α-helix	trans	-60.3	-45.7	172.9	-178.9	-179.7	168.9	170.1	1.8	111.4	E321 K323 L327 K328 E329	E321-R325 WeakPolarHBondContact O-CB 3.49Å; E321-R325 PolarHBondContact O-N 3.44Å; K323-R325 VanDerWaalsContact C-N 3.31Å; K323-R325 PolarHBondContact O-N 3.35Å; R325-L327 VanDerWaalsContact C-N 3.33Å; R325-L327 PolarHBondContact O-N 3.43Å; R325-K328 PolarHBondContact O-N 3.28Å; R325-E329 IonicContact CZ-OE1 3.94Å; R325-E329 IonicContact NE-OE1 3.16Å; R325-E329 PolarHBondContact NE-OE1 3Å; R325-E329 IonicContact NH2-OE1 3.43Å; R325-E329 WeakPolarHBondContact O-CB 3.39Å; R325-E329 WeakPolarHBondContact O-CG 3.22Å; R325-E329 PolarHBondContact O-N 3.01Å
326	K	88.9	Confident	85.4	Confident	92 Å²	92	112.9 Å²	112.9	40%	0.4	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-36.5	177	-73.8	-178.1	176.3	-166.7	0	112.1	V322 K323 E324 K330 D522	V322-K326 WeakPolarHBondContact O-CG 3.29Å; V322-K326 PolarHBondContact O-N 2.93Å; K323-K326 CarbonylContact O-C 3.59Å; K323-K326 WeakPolarHBondContact O-CB 3.04Å; K323-K326 PolarHBondContact O-N 2.73Å; K323-K326 VanDerWaalsContact O-N 3.11Å; E324-K326 VanDerWaalsContact C-N 3.35Å; E324-K326 PolarHBondContact O-N 3.45Å; K326-K330 WeakPolarHBondContact O-CG 3.41Å; K326-K330 PolarHBondContact O-N 2.97Å; K326-D522 IonicContact NZ-OD1 2.83Å; K326-D522 PolarHBondContact NZ-OD1 2.84Å
327	L	81.3	Confident	85	Confident	96 Å²	96	110.3 Å²	110.3	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-66.3	-47.6	175.9	-72.1	172.6	0	0	0	111.5	K323 E324 R325 E329 K330 E331	K323-L327 WeakPolarHBondContact O-CG 3.1Å; K323-L327 PolarHBondContact O-N 2.94Å; E324-L327 PolarHBondContact O-N 2.87Å; R325-L327 VanDerWaalsContact C-N 3.33Å; R325-L327 PolarHBondContact O-N 3.43Å; L327-E329 VanDerWaalsContact C-N 3.3Å; L327-E329 PolarHBondContact O-N 2.92Å; L327-K330 CarbonylContact O-C 3.53Å; L327-K330 WeakPolarHBondContact O-CA 2.97Å; L327-K330 WeakPolarHBondContact O-CB 3.29Å; L327-K330 PolarHBondContact O-N 3.09Å; L327-E331 PolarHBondContact O-N 3.09Å
328	K	82.7	Confident	85.1	Confident	116 Å²	116	111.8 Å²	111.8	50%	0.504	50%	0.497	S	S	.	.	H	α-helix	trans	-60.2	-38.4	175.5	-70.9	168.3	-178.7	165.2	0	112.2	E324 R325 E331 Q332	E324-K328 WeakPolarHBondContact O-CB 3.37Å; E324-K328 WeakPolarHBondContact O-CG 3.19Å; E324-K328 PolarHBondContact O-N 3.04Å; E324-K328 IonicContact OE2-NZ 3.93Å; R325-K328 PolarHBondContact O-N 3.28Å; K328-E331 PolarHBondContact O-N 2.77Å; K328-Q332 WeakPolarHBondContact O-CG 3.42Å; K328-Q332 PolarHBondContact O-N 3.24Å
329	E	87.6	Confident	84.8	Confident	75 Å²	75	110.3 Å²	110.3	35%	0.35	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-34.9	173.6	-74	174.2	-168.8	0	0	112.1	R325 L327 K333	R325-E329 IonicContact CZ-OE1 3.94Å; R325-E329 IonicContact NE-OE1 3.16Å; R325-E329 PolarHBondContact NE-OE1 3Å; R325-E329 IonicContact NH2-OE1 3.43Å; R325-E329 WeakPolarHBondContact O-CB 3.39Å; R325-E329 WeakPolarHBondContact O-CG 3.22Å; R325-E329 PolarHBondContact O-N 3.01Å; L327-E329 VanDerWaalsContact C-N 3.3Å; L327-E329 PolarHBondContact O-N 2.92Å; E329-K333 VanDerWaalsContact O-CG 3.29Å; E329-K333 WeakPolarHBondContact O-CG 3.15Å; E329-K333 PolarHBondContact O-N 3.41Å
330	K	84.9	Confident	84.4	Confident	124 Å²	124	103 Å²	103	54%	0.539	47%	0.465	S	S	.	.	H	α-helix	trans	-70.1	-40.3	173.6	-74.4	176.5	177.9	-169.8	0	112.4	K326 L327 K333 R334	K326-K330 WeakPolarHBondContact O-CG 3.41Å; K326-K330 PolarHBondContact O-N 2.97Å; L327-K330 CarbonylContact O-C 3.53Å; L327-K330 WeakPolarHBondContact O-CA 2.97Å; L327-K330 WeakPolarHBondContact O-CB 3.29Å; L327-K330 PolarHBondContact O-N 3.09Å; K330-K333 WeakPolarHBondContact O-CB 3.47Å; K330-K333 PolarHBondContact O-N 2.84Å; K330-R334 PolarHBondContact O-N 2.92Å
331	E	83.8	Confident	84.3	Confident	108 Å²	108	104 Å²	104	51%	0.505	47%	0.468	S	S	.	.	H	α-helix	trans	-63.3	-46.2	176.6	-74.7	167.5	-173.2	0	0	111.6	L327 K328 K333 R334 E335	L327-E331 PolarHBondContact O-N 3.09Å; K328-E331 PolarHBondContact O-N 2.77Å; E331-K333 VanDerWaalsContact C-N 3.25Å; E331-K333 PolarHBondContact O-N 2.81Å; E331-R334 CarbonylContact O-C 3.58Å; E331-R334 WeakPolarHBondContact O-CA 3.21Å; E331-R334 WeakPolarHBondContact O-CB 3.29Å; E331-R334 PolarHBondContact O-N 3.48Å; E331-E335 WeakPolarHBondContact O-CG 3.18Å; E331-E335 PolarHBondContact O-N 3.45Å
332	Q	84.1	Confident	84.2	Confident	109 Å²	109	102.4 Å²	102.4	51%	0.509	46%	0.463	S	S	.	.	H	α-helix	trans	-59.5	-36.7	174.7	-72	175.8	15.3	0	0	112.3	K328 Q336	K328-Q332 WeakPolarHBondContact O-CG 3.42Å; K328-Q332 PolarHBondContact O-N 3.24Å; Q332-Q336 WeakPolarHBondContact O-CB 3.41Å; Q332-Q336 WeakPolarHBondContact O-CG 3.48Å; Q332-Q336 PolarHBondContact O-N 2.91Å
333	K	81.6	Confident	83.7	Confident	97 Å²	97	99.7 Å²	99.7	42%	0.422	45%	0.446	S	S	.	.	H	α-helix	trans	-67.3	-42.1	173.6	-72.8	173.9	-177.1	179.5	0	111.6	F33 E329 K330 E331 Q336 L337	F33-K333 HydrophobicContact CE1-CB 4.4Å; F33-K333 HydrophobicContact CE1-CG 4.39Å; E329-K333 VanDerWaalsContact O-CG 3.29Å; E329-K333 WeakPolarHBondContact O-CG 3.15Å; E329-K333 PolarHBondContact O-N 3.41Å; K330-K333 WeakPolarHBondContact O-CB 3.47Å; K330-K333 PolarHBondContact O-N 2.84Å; E331-K333 VanDerWaalsContact C-N 3.25Å; E331-K333 PolarHBondContact O-N 2.81Å; K333-Q336 PolarHBondContact O-N 3.16Å; K333-L337 WeakPolarHBondContact O-CG 3.18Å; K333-L337 PolarHBondContact O-N 2.82Å
334	R	78.1	Confident	83.3	Confident	184 Å²	184	93.7 Å²	93.7	69%	0.694	42%	0.42	S	S	*	.	H	α-helix	trans	-61.5	-44.2	174.2	-90.2	-179.2	169	167	-4.8	112	K330 E331 Q336 L337 K338	K330-R334 PolarHBondContact O-N 2.92Å; E331-R334 CarbonylContact O-C 3.58Å; E331-R334 WeakPolarHBondContact O-CA 3.21Å; E331-R334 WeakPolarHBondContact O-CB 3.29Å; E331-R334 PolarHBondContact O-N 3.48Å; R334-Q336 VanDerWaalsContact C-N 3.35Å; R334-Q336 PolarHBondContact O-N 3.47Å; R334-L337 PolarHBondContact O-N 2.81Å; R334-K338 WeakPolarHBondContact O-CG 3.46Å; R334-K338 PolarHBondContact O-N 3.33Å
335	E	84.9	Confident	83	Confident	116 Å²	116	93.5 Å²	93.5	54%	0.542	42%	0.415	S	S	.	.	H	α-helix	trans	-61.7	-41.9	176.3	-71.9	179.6	171.9	0	0	112	E331 K338 Q339	E331-E335 WeakPolarHBondContact O-CG 3.18Å; E331-E335 PolarHBondContact O-N 3.45Å; E335-K338 PolarHBondContact O-N 3.33Å; E335-Q339 WeakPolarHBondContact O-CG 3.37Å; E335-Q339 PolarHBondContact O-N 3.39Å
336	Q	82.4	Confident	82.8	Confident	44 Å²	44	90.2 Å²	90.2	21%	0.206	41%	0.405	C	S	.	.	H	α-helix	trans	-67	-36.9	177	-72.5	170.6	29.3	0	0	112.4	L29 F33 Q332 K333 R334 Q339 L340	L29-Q336 HydrophobicContact CD2-CB 4.03Å; L29-Q336 HydrophobicContact CD2-CG 4.35Å; F33-Q336 HydrophobicContact CE2-CB 3.58Å; F33-Q336 HydrophobicContact CE2-CG 4.44Å; F33-Q336 HydrophobicContact CZ-CB 3.59Å; F33-Q336 HydrophobicContact CZ-CG 4.45Å; F33-Q336 VanDerWaalsContact CZ-OE1 3.24Å; Q332-Q336 WeakPolarHBondContact O-CB 3.41Å; Q332-Q336 WeakPolarHBondContact O-CG 3.48Å; Q332-Q336 PolarHBondContact O-N 2.91Å; K333-Q336 PolarHBondContact O-N 3.16Å; R334-Q336 VanDerWaalsContact C-N 3.35Å; R334-Q336 PolarHBondContact O-N 3.47Å; Q336-Q339 PolarHBondContact O-N 2.88Å; Q336-L340 PolarHBondContact O-N 3.33Å
337	L	77.3	Confident	82.6	Confident	67 Å²	67	88.9 Å²	88.9	35%	0.351	40%	0.4	S	S	.	.	H	α-helix	trans	-66.9	-40.3	171.9	-73.4	172.7	0	0	0	111.9	F33 K333 R334 Q339 L340 K341	F33-L337 HydrophobicContact CD1-CD2 4.04Å; F33-L337 HydrophobicContact CD1-CG 4.44Å; F33-L337 HydrophobicContact CE1-CD2 4.37Å; F33-L337 HydrophobicContact CE1-CG 4.28Å; F33-L337 HydrophobicContact CG-CD2 4.25Å; K333-L337 WeakPolarHBondContact O-CG 3.18Å; K333-L337 PolarHBondContact O-N 2.82Å; R334-L337 PolarHBondContact O-N 2.81Å; L337-Q339 VanDerWaalsContact C-N 3.3Å; L337-Q339 PolarHBondContact O-N 3.36Å; L337-L340 PolarHBondContact O-N 2.97Å; L337-K341 WeakPolarHBondContact O-CG 3.19Å; L337-K341 PolarHBondContact O-N 2.75Å
338	K	86.6	Confident	82.7	Confident	141 Å²	141	88.1 Å²	88.1	61%	0.613	40%	0.396	S	S	*	.	H	α-helix	trans	-60.9	-40.2	173.1	-72.8	177.9	179.6	-172.4	0	111.4	R334 E335 K341 N342	R334-K338 WeakPolarHBondContact O-CG 3.46Å; R334-K338 PolarHBondContact O-N 3.33Å; E335-K338 PolarHBondContact O-N 3.33Å; K338-K341 PolarHBondContact O-N 2.79Å; K338-N342 WeakPolarHBondContact O-CB 3.41Å; K338-N342 PolarHBondContact O-N 3.22Å; K338-N342 PolarHBondContact O-ND2 2.79Å; K338-N342 PolarHBondContact O-OD1 3.49Å
339	Q	80.9	Confident	82.5	Confident	106 Å²	106	86 Å²	86	50%	0.495	39%	0.389	S	S	.	.	H	α-helix	trans	-63.8	-42.9	174.4	-72.4	171.4	5.7	0	0	112.1	L29 E335 Q336 L337 N342 L343	L29-Q339 HydrophobicContact CD1-CB 4.28Å; E335-Q339 WeakPolarHBondContact O-CG 3.37Å; E335-Q339 PolarHBondContact O-N 3.39Å; Q336-Q339 PolarHBondContact O-N 2.88Å; L337-Q339 VanDerWaalsContact C-N 3.3Å; L337-Q339 PolarHBondContact O-N 3.36Å; Q339-N342 PolarHBondContact O-N 3.24Å; Q339-L343 WeakPolarHBondContact O-CG 3.46Å; Q339-L343 PolarHBondContact O-N 3.2Å
340	L	77.8	Confident	82.4	Confident	6 Å²	6	85 Å²	85	3%	0.031	39%	0.386	C	S	.	.	H	α-helix	trans	-60.2	-49.5	174.2	-175.2	166.4	0	0	0	110.7	L29 A37 Q336 L337 N342 L343 K344	L29-L340 HydrophobicContact CB-CD1 4.38Å; L29-L340 HydrophobicContact CD1-CB 4.18Å; A37-L340 HydrophobicContact CB-CD1 4.19Å; Q336-L340 PolarHBondContact O-N 3.33Å; L337-L340 PolarHBondContact O-N 2.97Å; L340-N342 VanDerWaalsContact C-N 3.3Å; L340-N342 PolarHBondContact O-N 2.85Å; L340-L343 PolarHBondContact O-N 3.05Å; L340-K344 HydrophobicContact CD2-CD 3.59Å; L340-K344 HydrophobicContact CD2-CG 4.06Å; L340-K344 WeakPolarHBondContact O-CG 3.43Å; L340-K344 PolarHBondContact O-N 3.33Å
341	K	82.3	Confident	82.3	Confident	99 Å²	99	85 Å²	85	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-56.8	-43.6	176.5	-73	-172.1	174.7	-157.9	0	111.5	L337 K338 K344 R345	L337-K341 WeakPolarHBondContact O-CG 3.19Å; L337-K341 PolarHBondContact O-N 2.75Å; K338-K341 PolarHBondContact O-N 2.79Å; K341-K344 PolarHBondContact O-N 2.85Å; K341-R345 WeakPolarHBondContact O-CB 3.42Å; K341-R345 VanDerWaalsContact O-CG 3.26Å; K341-R345 WeakPolarHBondContact O-CG 3.47Å; K341-R345 PolarHBondContact O-N 3.16Å
342	N	86.3	Confident	82.3	Confident	84 Å²	84	82.2 Å²	82.2	45%	0.449	37%	0.374	S	S	.	.	H	α-helix	trans	-66.7	-37.6	178.8	-71	-14.4	0	0	0	113	K338 Q339 L340 K346	K338-N342 WeakPolarHBondContact O-CB 3.41Å; K338-N342 PolarHBondContact O-N 3.22Å; K338-N342 PolarHBondContact O-ND2 2.79Å; K338-N342 PolarHBondContact O-OD1 3.49Å; Q339-N342 PolarHBondContact O-N 3.24Å; L340-N342 VanDerWaalsContact C-N 3.3Å; L340-N342 PolarHBondContact O-N 2.85Å; N342-K346 VanDerWaalsContact O-CG 3.27Å; N342-K346 WeakPolarHBondContact O-CG 3.35Å; N342-K346 PolarHBondContact O-N 3.5Å; N342-K346 VanDerWaalsContact O-N 3.13Å
343	L	81.4	Confident	82.2	Confident	20 Å²	20	81.7 Å²	81.7	11%	0.105	37%	0.372	C	S	.	.	H	α-helix	trans	-68.4	-41.6	175.5	-72.1	175.9	0	0	0	111.2	Q22 E25 L26 L29 Q339 L340 K346 E347	Q22-L343 HydrophobicContact CB-CD2 4.28Å; Q22-L343 HydrophobicContact CG-CD2 4.08Å; E25-L343 HydrophobicContact CB-CD1 4.22Å; L26-L343 HydrophobicContact CB-CD1 4.43Å; L29-L343 HydrophobicContact CD1-CD1 4.24Å; Q339-L343 WeakPolarHBondContact O-CG 3.46Å; Q339-L343 PolarHBondContact O-N 3.2Å; L340-L343 PolarHBondContact O-N 3.05Å; L343-K346 WeakPolarHBondContact O-CB 3.31Å; L343-K346 PolarHBondContact O-N 3.3Å; L343-E347 WeakPolarHBondContact O-CG 3.4Å; L343-E347 PolarHBondContact O-N 3.06Å
344	K	81.6	Confident	82.2	Confident	15 Å²	15	82.1 Å²	82.1	7%	0.065	38%	0.375	C	S	.	.	H	α-helix	trans	-69	-39.1	177.2	-68.9	-168.3	-176.8	-179.9	0	113.2	A37 D38 L340 K341 K346 E347 I348	A37-K344 PolarHBondContact O-NZ 3.49Å; D38-K344 WeakPolarHBondContact OD1-CD 3.47Å; D38-K344 VanDerWaalsContact OD1-CE 3.31Å; D38-K344 WeakPolarHBondContact OD1-CE 3.45Å; D38-K344 IonicContact OD1-NZ 3.95Å; D38-K344 PolarHBondContact OD1-NZ 2.9Å; D38-K344 WeakPolarHBondContact OD2-CD 3.48Å; D38-K344 WeakPolarHBondContact OD2-CE 2.95Å; D38-K344 IonicContact OD2-NZ 2.76Å; D38-K344 PolarHBondContact OD2-NZ 3.14Å; L340-K344 HydrophobicContact CD2-CD 3.59Å; L340-K344 HydrophobicContact CD2-CG 4.06Å; L340-K344 WeakPolarHBondContact O-CG 3.43Å; L340-K344 PolarHBondContact O-N 3.33Å; K341-K344 PolarHBondContact O-N 2.85Å; K344-K346 VanDerWaalsContact C-N 3.26Å; K344-K346 PolarHBondContact O-N 3.25Å; K344-E347 PolarHBondContact O-N 3.03Å; K344-E347 VanDerWaalsContact O-N 3.13Å; K344-I348 VanDerWaalsContact O-CG1 3.31Å; K344-I348 WeakPolarHBondContact O-CG1 3.4Å; K344-I348 PolarHBondContact O-N 3.48Å
345	R	80.4	Confident	82.3	Confident	96 Å²	96	78 Å²	78	36%	0.362	37%	0.367	S	S	.	.	H	α-helix	trans	-56.5	-41.6	170	-76.6	175.2	172.4	-164.5	-10.9	111.6	K341 I348 M349 D372	K341-R345 WeakPolarHBondContact O-CB 3.42Å; K341-R345 VanDerWaalsContact O-CG 3.26Å; K341-R345 WeakPolarHBondContact O-CG 3.47Å; K341-R345 PolarHBondContact O-N 3.16Å; R345-I348 PolarHBondContact O-N 2.84Å; R345-M349 WeakPolarHBondContact O-CG 3.07Å; R345-M349 PolarHBondContact O-N 3.38Å; R345-D372 IonicContact CZ-OD1 2.92Å; R345-D372 IonicContact NH2-OD1 3.67Å; R345-D372 PolarHBondContact NH2-OD1 3.19Å; R345-D372 IonicContact NH2-OD2 2.73Å
346	K	83.6	Confident	81.9	Confident	99 Å²	99	75.1 Å²	75.1	43%	0.43	35%	0.353	S	S	.	.	H	α-helix	trans	-66.1	-41.1	174.3	-72.2	172.6	-178.6	-175.9	0	112.7	N342 L343 K344 I348 M349 D350	N342-K346 VanDerWaalsContact O-CG 3.27Å; N342-K346 WeakPolarHBondContact O-CG 3.35Å; N342-K346 PolarHBondContact O-N 3.5Å; N342-K346 VanDerWaalsContact O-N 3.13Å; L343-K346 WeakPolarHBondContact O-CB 3.31Å; L343-K346 PolarHBondContact O-N 3.3Å; K344-K346 VanDerWaalsContact C-N 3.26Å; K344-K346 PolarHBondContact O-N 3.25Å; K346-I348 VanDerWaalsContact C-N 3.31Å; K346-I348 PolarHBondContact O-N 2.86Å; K346-M349 HydrophobicContact CB-CE 4.4Å; K346-M349 HydrophobicContact CG-CE 3.89Å; K346-M349 PolarHBondContact O-N 2.9Å; K346-D350 WeakPolarHBondContact O-CB 3.44Å; K346-D350 PolarHBondContact O-N 3.34Å
347	E	85.8	Confident	81.8	Confident	64 Å²	64	80.4 Å²	80.4	30%	0.299	38%	0.378	S	S	.	.	H	α-helix	trans	-63.9	-36.1	174.4	-69.8	-173.1	158.3	0	0	112.6	L26 L343 K344 K351	L26-E347 VanDerWaalsContact CD1-CD 3.44Å; L26-E347 WeakPolarHBondContact CD1-OE1 3.2Å; L26-E347 WeakPolarHBondContact CD1-OE2 3.47Å; L343-E347 WeakPolarHBondContact O-CG 3.4Å; L343-E347 PolarHBondContact O-N 3.06Å; K344-E347 PolarHBondContact O-N 3.03Å; K344-E347 VanDerWaalsContact O-N 3.13Å; E347-K351 WeakPolarHBondContact O-CB 3.49Å; E347-K351 WeakPolarHBondContact O-CG 3.46Å; E347-K351 PolarHBondContact O-N 2.99Å
348	I	83.4	Confident	81.7	Confident	80 Å²	80	84.2 Å²	84.2	41%	0.41	40%	0.398	S	S	.	.	H	α-helix	trans	-67.4	-45.9	174.7	-67.4	164.1	0	0	0	110.2	K344 R345 K346 D350 K351 L352	K344-I348 VanDerWaalsContact O-CG1 3.31Å; K344-I348 WeakPolarHBondContact O-CG1 3.4Å; K344-I348 PolarHBondContact O-N 3.48Å; R345-I348 PolarHBondContact O-N 2.84Å; K346-I348 VanDerWaalsContact C-N 3.31Å; K346-I348 PolarHBondContact O-N 2.86Å; I348-D350 PolarHBondContact O-N 3.49Å; I348-K351 PolarHBondContact O-N 3.25Å; I348-L352 HydrophobicContact CG2-CD1 4Å; I348-L352 HydrophobicContact CG2-CG 4.4Å; I348-L352 WeakPolarHBondContact O-CB 3.44Å; I348-L352 VanDerWaalsContact O-CG 3.31Å; I348-L352 WeakPolarHBondContact O-CG 3.33Å; I348-L352 PolarHBondContact O-N 3.15Å
349	M	77.9	Confident	81.1	Confident	71 Å²	71	81.4 Å²	81.4	35%	0.35	39%	0.393	S	S	.	.	H	α-helix	trans	-61.6	-42	175.8	-71.9	-174.2	-62.6	0	0	112.3	R345 K346 L352 Q353	R345-M349 WeakPolarHBondContact O-CG 3.07Å; R345-M349 PolarHBondContact O-N 3.38Å; K346-M349 HydrophobicContact CB-CE 4.4Å; K346-M349 HydrophobicContact CG-CE 3.89Å; K346-M349 PolarHBondContact O-N 2.9Å; M349-L352 PolarHBondContact O-N 2.94Å; M349-Q353 WeakPolarHBondContact O-CB 3.48Å; M349-Q353 WeakPolarHBondContact O-CG 3.34Å; M349-Q353 PolarHBondContact O-N 2.83Å
350	D	84.6	Confident	79.9	Confident	54 Å²	54	79.3 Å²	79.3	29%	0.289	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-39.8	176.4	-81.9	16.1	0	0	0	111.5	K19 K346 I348 Q353 Q354	K19-D350 IonicContact NZ-OD2 3.51Å; K346-D350 WeakPolarHBondContact O-CB 3.44Å; K346-D350 PolarHBondContact O-N 3.34Å; I348-D350 PolarHBondContact O-N 3.49Å; D350-Q353 PolarHBondContact O-N 3.06Å; D350-Q354 VanDerWaalsContact O-CG 3.31Å; D350-Q354 WeakPolarHBondContact O-CG 3.29Å; D350-Q354 PolarHBondContact O-N 3.33Å
351	K	84.7	Confident	79.1	Confident	124 Å²	124	84 Å²	84	54%	0.539	42%	0.424	S	S	.	.	H	α-helix	trans	-67.5	-39.2	174.5	-74	171.4	-173.3	175.2	0	111.8	E347 I348 Q353 Q354 L355	E347-K351 WeakPolarHBondContact O-CB 3.49Å; E347-K351 WeakPolarHBondContact O-CG 3.46Å; E347-K351 PolarHBondContact O-N 2.99Å; I348-K351 PolarHBondContact O-N 3.25Å; K351-Q353 VanDerWaalsContact C-N 3.34Å; K351-Q354 PolarHBondContact O-N 3.02Å; K351-L355 WeakPolarHBondContact O-CG 3.39Å; K351-L355 PolarHBondContact O-N 2.84Å
352	L	81.9	Confident	78.1	Confident	50 Å²	50	88.1 Å²	88.1	26%	0.262	45%	0.445	S	S	.	.	H	α-helix	trans	-63.6	-40.8	173.6	-75.3	172.3	0	0	0	111.1	I348 M349 L355 Q356 L364	I348-L352 HydrophobicContact CG2-CD1 4Å; I348-L352 HydrophobicContact CG2-CG 4.4Å; I348-L352 WeakPolarHBondContact O-CB 3.44Å; I348-L352 VanDerWaalsContact O-CG 3.31Å; I348-L352 WeakPolarHBondContact O-CG 3.33Å; I348-L352 PolarHBondContact O-N 3.15Å; M349-L352 PolarHBondContact O-N 2.94Å; L352-L355 CarbonylContact O-C 3.59Å; L352-L355 PolarHBondContact O-N 2.99Å; L352-Q356 WeakPolarHBondContact O-CB 3.37Å; L352-Q356 PolarHBondContact O-N 3.25Å; L352-L364 HydrophobicContact CB-CD2 4.05Å
353	Q	82.6	Confident	76.7	Confident	98 Å²	98	92 Å²	92	46%	0.458	46%	0.46	S	S	.	.	H	α-helix	trans	-63.9	-41.4	173.4	-75.2	176.4	-2.1	0	0	112.1	M349 D350 K351 L355 Q356 E357	M349-Q353 WeakPolarHBondContact O-CB 3.48Å; M349-Q353 WeakPolarHBondContact O-CG 3.34Å; M349-Q353 PolarHBondContact O-N 2.83Å; D350-Q353 PolarHBondContact O-N 3.06Å; K351-Q353 VanDerWaalsContact C-N 3.34Å; Q353-L355 VanDerWaalsContact C-N 3.33Å; Q353-L355 PolarHBondContact O-N 3.22Å; Q353-Q356 WeakPolarHBondContact O-CB 3.49Å; Q353-Q356 PolarHBondContact O-N 2.95Å; Q353-E357 WeakPolarHBondContact O-CG 3.48Å; Q353-E357 PolarHBondContact O-N 3.29Å
354	Q	81.6	Confident	75.6	Confident	106 Å²	106	94.9 Å²	94.9	50%	0.495	48%	0.476	S	S	.	.	H	α-helix	trans	-63.5	-38.6	174	-73.8	176.7	-16.6	0	0	112.3	D350 K351 E357 L358	D350-Q354 VanDerWaalsContact O-CG 3.31Å; D350-Q354 WeakPolarHBondContact O-CG 3.29Å; D350-Q354 PolarHBondContact O-N 3.33Å; K351-Q354 PolarHBondContact O-N 3.02Å; Q354-E357 PolarHBondContact O-N 3.5Å; Q354-L358 WeakPolarHBondContact O-CB 3.49Å; Q354-L358 VanDerWaalsContact O-CG 3.28Å; Q354-L358 WeakPolarHBondContact O-CG 3.41Å; Q354-L358 PolarHBondContact O-N 2.92Å
355	L	80.1	Confident	74.3	Confident	99 Å²	99	95.9 Å²	95.9	52%	0.518	49%	0.486	S	S	.	.	H	α-helix	trans	-68.1	-36.7	172.5	-72.2	171.6	0	0	0	111.7	K351 L352 Q353 L358 T359	K351-L355 WeakPolarHBondContact O-CG 3.39Å; K351-L355 PolarHBondContact O-N 2.84Å; L352-L355 CarbonylContact O-C 3.59Å; L352-L355 PolarHBondContact O-N 2.99Å; Q353-L355 VanDerWaalsContact C-N 3.33Å; Q353-L355 PolarHBondContact O-N 3.22Å; L355-L358 PolarHBondContact O-N 3.41Å; L355-T359 VanDerWaalsContact O-CB 3.26Å; L355-T359 WeakPolarHBondContact O-CB 3.49Å; L355-T359 WeakPolarHBondContact O-CG2 3.27Å; L355-T359 PolarHBondContact O-N 2.84Å; L355-T359 PolarHBondContact O-OG1 3.11Å
356	Q	76.1	Confident	73.1	Confident	54 Å²	54	95.8 Å²	95.8	25%	0.252	49%	0.489	S	S	.	.	H	α-helix	trans	-62.2	-43.7	173.9	-169.8	-175.1	3.3	0	0	111.3	L352 Q353 T359 G360 N361 E362 L364	L352-Q356 WeakPolarHBondContact O-CB 3.37Å; L352-Q356 PolarHBondContact O-N 3.25Å; Q353-Q356 WeakPolarHBondContact O-CB 3.49Å; Q353-Q356 PolarHBondContact O-N 2.95Å; Q356-T359 PolarHBondContact O-OG1 3.31Å; Q356-G360 PolarHBondContact O-N 3.38Å; Q356-G360 VanDerWaalsContact O-N 3.1Å; Q356-N361 VanDerWaalsContact CG-O 3.28Å; Q356-N361 WeakPolarHBondContact CG-O 3.02Å; Q356-E362 PolarHBondContact NE2-O 3.48Å; Q356-L364 HydrophobicContact CB-CD2 3.93Å; Q356-L364 HydrophobicContact CB-CG 4.14Å; Q356-L364 HydrophobicContact CG-CD2 4.31Å; Q356-L364 HydrophobicContact CG-CG 4.03Å; Q356-L364 VanDerWaalsContact OE1-CG 3.31Å
357	E	81.7	Confident	72.2	Confident	155 Å²	155	93.7 Å²	93.7	72%	0.724	49%	0.487	S	S	*	.	H	α-helix	trans	-65.2	-37.1	176.7	-72.4	175	-179.7	0	0	112.4	Q353 Q354	Q353-E357 WeakPolarHBondContact O-CG 3.48Å; Q353-E357 PolarHBondContact O-N 3.29Å; Q354-E357 PolarHBondContact O-N 3.5Å
358	L	75	Confident	71	Confident	148 Å²	148	96.1 Å²	96.1	78%	0.775	50%	0.498	S	S	*	.	H	α-helix	trans	-81	-32.1	179.4	-71.9	172.7	0	0	0	113.9	Q354 L355 G360	Q354-L358 WeakPolarHBondContact O-CB 3.49Å; Q354-L358 VanDerWaalsContact O-CG 3.28Å; Q354-L358 WeakPolarHBondContact O-CG 3.41Å; Q354-L358 PolarHBondContact O-N 2.92Å; L355-L358 PolarHBondContact O-N 3.41Å; L358-G360 VanDerWaalsContact C-N 3.33Å
359	T	73.5	Confident	69.9	Low	82 Å²	82	95.7 Å²	95.7	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-83.6	-11.7	178.1	58.9	0	0	0	0	112.5	L355 Q356 N361	L355-T359 VanDerWaalsContact O-CB 3.26Å; L355-T359 WeakPolarHBondContact O-CB 3.49Å; L355-T359 WeakPolarHBondContact O-CG2 3.27Å; L355-T359 PolarHBondContact O-N 2.84Å; L355-T359 PolarHBondContact O-OG1 3.11Å; Q356-T359 PolarHBondContact O-OG1 3.31Å; T359-N361 PolarHBondContact O-N 2.98Å
360	G	55.3	Low	69.4	Low	61 Å²	61	95.8 Å²	95.8	63%	0.629	51%	0.509	S	S	*	.			trans	66.4	6.4	176.5	0	0	0	0	0	114.8	Q356 L358	Q356-G360 PolarHBondContact O-N 3.38Å; Q356-G360 VanDerWaalsContact O-N 3.1Å; L358-G360 VanDerWaalsContact C-N 3.33Å
361	N	60.5	Low	68.6	Low	105 Å²	105	98.1 Å²	98.1	56%	0.561	52%	0.52	S	S	*	.			trans	-84.4	120.7	179.7	-72.2	-32.7	0	0	0	110.1	Q356 T359 Q363	Q356-N361 VanDerWaalsContact CG-O 3.28Å; Q356-N361 WeakPolarHBondContact CG-O 3.02Å; T359-N361 PolarHBondContact O-N 2.98Å; N361-Q363 PolarHBondContact O-N 3.03Å; N361-Q363 VanDerWaalsContact O-N 3.09Å
362	E	62.2	Low	67.8	Low	186 Å²	186	96.9 Å²	96.9	87%	0.869	52%	0.519	S	S	*	.	S	Bend	trans	-65	-13.8	-176.3	-66.8	-173.6	161.1	0	0	113.8	Q356	Q356-E362 PolarHBondContact NE2-O 3.48Å
363	Q	56.3	Low	67.5	Low	165 Å²	165	96.5 Å²	96.5	77%	0.771	53%	0.528	S	S	*	.	S	Bend	trans	-125.2	116.7	-176.9	-68.6	176.5	-15.9	0	0	111.2	N361 A365	N361-Q363 PolarHBondContact O-N 3.03Å; N361-Q363 VanDerWaalsContact O-N 3.09Å; Q363-A365 PolarHBondContact O-N 3.07Å
364	L	58.8	Low	66.9	Low	81 Å²	81	98 Å²	98	42%	0.424	54%	0.539	S	S	.	.			trans	-63.6	121	167	-81.3	161.4	0	0	0	109.3	L352 Q356 F366	L352-L364 HydrophobicContact CB-CD2 4.05Å; Q356-L364 HydrophobicContact CB-CD2 3.93Å; Q356-L364 HydrophobicContact CB-CG 4.14Å; Q356-L364 HydrophobicContact CG-CD2 4.31Å; Q356-L364 HydrophobicContact CG-CG 4.03Å; Q356-L364 VanDerWaalsContact OE1-CG 3.31Å; L364-F366 PolarHBondContact O-N 2.98Å
365	A	54.9	Low	66.7	Low	35 Å²	35	99.9 Å²	99.9	29%	0.289	55%	0.546	S	S	.	.	S	Bend	trans	-77.4	2.3	-171.6	0	0	0	0	0	115.6	Q363 F387	Q363-A365 PolarHBondContact O-N 3.07Å; A365-F387 HydrophobicContact CB-CD1 4.08Å; A365-F387 HydrophobicContact CB-CD2 3.99Å; A365-F387 HydrophobicContact CB-CE1 4.05Å; A365-F387 HydrophobicContact CB-CE2 3.97Å; A365-F387 HydrophobicContact CB-CG 4.06Å; A365-F387 HydrophobicContact CB-CZ 4Å
366	F	55.4	Low	66.7	Low	94 Å²	94	99.1 Å²	99.1	41%	0.412	54%	0.542	S	S	.	.			trans	-125.8	120.8	176.9	-61.4	-73.5	0	0	0	109.4	L364 M384	L364-F366 PolarHBondContact O-N 2.98Å; F366-M384 HydrophobicContact CE1-CE 3.89Å; F366-M384 HydrophobicContact CZ-CE 3.69Å
367	S	64.6	Low	67.1	Low	56 Å²	56	99.9 Å²	99.9	39%	0.392	55%	0.552	S	S	.	*			trans	-79.1	155	171.7	73.6	0	0	0	0	109.8	A369 D370 L371	S367-A369 PolarHBondContact O-N 3.11Å; S367-D370 WeakPolarHBondContact CB-OD2 3.08Å; S367-D370 PolarHBondContact N-OD2 3.17Å; S367-D370 PolarHBondContact O-N 2.7Å; S367-D370 VanDerWaalsContact OG-CG 3.24Å; S367-D370 PolarHBondContact OG-N 3.24Å; S367-D370 PolarHBondContact OG-OD2 3.49Å; S367-L371 PolarHBondContact O-N 2.76Å
368	Q	59.2	Low	67.3	Low	114 Å²	114	98.3 Å²	98.3	53%	0.533	55%	0.548	S	S	.	.	H	α-helix	trans	-52.7	-26.7	173.2	-167.2	101.7	28.3	0	0	111.8	D372	Q368-D372 PolarHBondContact O-N 2.94Å
369	A	60.8	Low	67.6	Low	71 Å²	71	96.6 Å²	96.6	59%	0.587	54%	0.536	S	S	*	.	H	α-helix	trans	-75.9	-28.8	178.3	0	0	0	0	0	113.9	S367 G373	S367-A369 PolarHBondContact O-N 3.11Å; A369-G373 PolarHBondContact O-N 3.03Å; A369-G373 VanDerWaalsContact O-N 3.15Å
370	D	67.9	Low	67.9	Low	74 Å²	74	95.4 Å²	95.4	40%	0.396	53%	0.525	S	S	.	.	H	α-helix	trans	-81.3	-21.2	178.1	-55.3	-49.8	0	0	0	112.2	S367	S367-D370 WeakPolarHBondContact CB-OD2 3.08Å; S367-D370 PolarHBondContact N-OD2 3.17Å; S367-D370 PolarHBondContact O-N 2.7Å; S367-D370 VanDerWaalsContact OG-CG 3.24Å; S367-D370 PolarHBondContact OG-N 3.24Å; S367-D370 PolarHBondContact OG-OD2 3.49Å
371	L	67.1	Low	69.3	Low	103 Å²	103	97 Å²	97	54%	0.539	52%	0.519	S	S	.	.	H	α-helix	trans	-82.4	-30.2	176.2	-77.5	165.5	0	0	0	113.1	S367	S367-L371 PolarHBondContact O-N 2.76Å
372	D	68.3	Low	70.3	Confident	97 Å²	97	97.3 Å²	97.3	52%	0.519	52%	0.517	S	S	.	.	S	Bend	trans	-99.7	-3.2	178.9	-73.6	-38.7	0	0	0	112.2	R345 Q368	R345-D372 IonicContact CZ-OD1 2.92Å; R345-D372 IonicContact NH2-OD1 3.67Å; R345-D372 PolarHBondContact NH2-OD1 3.19Å; R345-D372 IonicContact NH2-OD2 2.73Å; Q368-D372 PolarHBondContact O-N 2.94Å
373	G	76.6	Confident	71.2	Confident	42 Å²	42	90.3 Å²	90.3	43%	0.433	49%	0.485	S	S	.	.	S	Bend	trans	-91.2	151.9	178.1	0	0	0	0	0	113.6	A369 F375	A369-G373 PolarHBondContact O-N 3.03Å; A369-G373 VanDerWaalsContact O-N 3.15Å; G373-F375 PolarHBondContact O-N 3Å
374	D	69.5	Low	72.2	Confident	130 Å²	130	84.6 Å²	84.6	70%	0.695	46%	0.459	S	S	*	.			trans	-60.8	129.9	177.2	-69.6	-42.1	0	0	0	110.7	D376	D374-D376 PolarHBondContact O-N 3.39Å
375	F	77.6	Confident	73.2	Confident	146 Å²	146	87.8 Å²	87.8	64%	0.64	47%	0.472	S	S	*	.			trans	-65.7	101.1	-175.6	-179.6	-95.9	0	0	0	111.3	G373 P377 H380	G373-F375 PolarHBondContact O-N 3Å; F375-P377 HydrophobicContact CD1-CG 4.49Å; F375-P377 HydrophobicContact CE1-CG 4.28Å; F375-P377 WeakPolarHBondContact O-CD 3.19Å; F375-H380 HydrophobicContact CD2-CB 4.45Å; F375-H380 HydrophobicContact CE2-CB 3.77Å; F375-H380 AromaticContact CE2-CD2 3.38Å; F375-H380 WeakPolarHBondContact CE2-CD2 3.45Å; F375-H380 AromaticContact CE2-CG 3.38Å; F375-H380 AromaticContact CE2-ND1 3.87Å; F375-H380 AromaticContact CE2-NE2 3.85Å; F375-H380 HydrophobicContact CZ-CB 3.94Å; F375-H380 AromaticContact CZ-CG 3.63Å; F375-H380 AromaticContact CZ-ND1 3.72Å
376	D	78.4	Confident	74.3	Confident	82 Å²	82	93.2 Å²	93.2	44%	0.439	49%	0.489	S	S	.	.			trans	-91.1	113.5	172.7	-89.2	-16.6	0	0	0	110.7	D374 N378 Q379 H380	D374-D376 PolarHBondContact O-N 3.39Å; D376-N378 PolarHBondContact O-N 3.13Å; D376-N378 VanDerWaalsContact O-N 3.14Å; D376-Q379 HydrophobicContact CB-CB 3.98Å; D376-Q379 HydrophobicContact CB-CG 3.79Å; D376-Q379 PolarHBondContact O-N 2.84Å; D376-Q379 VanDerWaalsContact O-N 3.09Å; D376-Q379 PolarHBondContact OD2-NE2 3.2Å; D376-H380 WeakPolarHBondContact O-CB 3Å; D376-H380 PolarHBondContact O-N 2.91Å
377	P	86.4	Confident	75	Confident	71 Å²	71	93.1 Å²	93.1	46%	0.461	49%	0.489	S	S	.	.	H	α-helix	trans	-56.4	-36.8	-177.1	-26.9	35	0	0	0	113.4	F375 D381	F375-P377 HydrophobicContact CD1-CG 4.49Å; F375-P377 HydrophobicContact CE1-CG 4.28Å; F375-P377 WeakPolarHBondContact O-CD 3.19Å; P377-D381 VanDerWaalsContact O-CB 3.23Å; P377-D381 WeakPolarHBondContact O-CB 3.43Å; P377-D381 PolarHBondContact O-N 3.06Å
378	N	84.7	Confident	75.2	Confident	121 Å²	121	95 Å²	95	65%	0.647	49%	0.49	S	S	*	.	H	α-helix	trans	-72.8	-35	-179.2	-64.1	-38.6	0	0	0	113	D376 Q382	D376-N378 PolarHBondContact O-N 3.13Å; D376-N378 VanDerWaalsContact O-N 3.14Å; N378-Q382 WeakPolarHBondContact O-CB 2.98Å; N378-Q382 WeakPolarHBondContact O-CG 3.32Å; N378-Q382 PolarHBondContact O-N 2.87Å
379	Q	81.1	Confident	76	Confident	112 Å²	112	90.3 Å²	90.3	52%	0.523	47%	0.472	S	S	.	.	H	α-helix	trans	-74.3	-41.6	177.1	-61.1	-168.5	31.4	0	0	109.9	D376 Q382 L383	D376-Q379 HydrophobicContact CB-CB 3.98Å; D376-Q379 HydrophobicContact CB-CG 3.79Å; D376-Q379 PolarHBondContact O-N 2.84Å; D376-Q379 VanDerWaalsContact O-N 3.09Å; D376-Q379 PolarHBondContact OD2-NE2 3.2Å; Q379-Q382 PolarHBondContact O-N 3.31Å; Q379-L383 VanDerWaalsContact O-CG 3.29Å; Q379-L383 WeakPolarHBondContact O-CG 3.49Å; Q379-L383 PolarHBondContact O-N 3.38Å
380	H	80.4	Confident	76.3	Confident	58 Å²	58	94.2 Å²	94.2	27%	0.269	48%	0.483	S	S	.	.	H	α-helix	trans	-60.8	-46.8	173.8	-179.2	-95.6	0	0	0	112.1	F375 D376 Q382 L383 M384	F375-H380 HydrophobicContact CD2-CB 4.45Å; F375-H380 HydrophobicContact CE2-CB 3.77Å; F375-H380 AromaticContact CE2-CD2 3.38Å; F375-H380 WeakPolarHBondContact CE2-CD2 3.45Å; F375-H380 AromaticContact CE2-CG 3.38Å; F375-H380 AromaticContact CE2-ND1 3.87Å; F375-H380 AromaticContact CE2-NE2 3.85Å; F375-H380 HydrophobicContact CZ-CB 3.94Å; F375-H380 AromaticContact CZ-CG 3.63Å; F375-H380 AromaticContact CZ-ND1 3.72Å; D376-H380 WeakPolarHBondContact O-CB 3Å; D376-H380 PolarHBondContact O-N 2.91Å; H380-Q382 VanDerWaalsContact C-N 3.32Å; H380-Q382 PolarHBondContact O-N 3.14Å; H380-L383 PolarHBondContact O-N 3.24Å; H380-L383 VanDerWaalsContact O-N 3.16Å; H380-M384 VanDerWaalsContact CE1-CG 3.47Å; H380-M384 WeakPolarHBondContact CE1-CG 3.39Å; H380-M384 WeakPolarHBondContact O-CB 3.34Å; H380-M384 WeakPolarHBondContact O-CG 2.99Å; H380-M384 PolarHBondContact O-N 3.47Å
381	D	83.6	Confident	76.4	Confident	94 Å²	94	99 Å²	99	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-64.7	-35.8	178.5	-72	-8.4	0	0	0	112	P377 Q385	P377-D381 VanDerWaalsContact O-CB 3.23Å; P377-D381 WeakPolarHBondContact O-CB 3.43Å; P377-D381 PolarHBondContact O-N 3.06Å; D381-Q385 VanDerWaalsContact O-CB 3.27Å; D381-Q385 WeakPolarHBondContact O-CB 3.33Å; D381-Q385 PolarHBondContact O-N 3.33Å
382	Q	83.4	Confident	76.4	Confident	111 Å²	111	100.4 Å²	100.4	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-68.1	-35.7	173.2	-74.8	173.9	32.4	0	0	112.8	N378 Q379 H380 K386	N378-Q382 WeakPolarHBondContact O-CB 2.98Å; N378-Q382 WeakPolarHBondContact O-CG 3.32Å; N378-Q382 PolarHBondContact O-N 2.87Å; Q379-Q382 PolarHBondContact O-N 3.31Å; H380-Q382 VanDerWaalsContact C-N 3.32Å; H380-Q382 PolarHBondContact O-N 3.14Å; Q382-K386 WeakPolarHBondContact O-CB 3.35Å; Q382-K386 WeakPolarHBondContact O-CD 3.49Å; Q382-K386 WeakPolarHBondContact O-CG 3.44Å; Q382-K386 PolarHBondContact O-N 3.04Å; Q382-K386 VanDerWaalsContact O-N 3.17Å
383	L	79.6	Confident	76.4	Confident	39 Å²	39	103.7 Å²	103.7	20%	0.204	51%	0.509	C	S	.	.	H	α-helix	trans	-68.8	-48	173.4	-69.6	168.6	0	0	0	110.1	Q379 H380 Q385 K386 F387	Q379-L383 VanDerWaalsContact O-CG 3.29Å; Q379-L383 WeakPolarHBondContact O-CG 3.49Å; Q379-L383 PolarHBondContact O-N 3.38Å; H380-L383 PolarHBondContact O-N 3.24Å; H380-L383 VanDerWaalsContact O-N 3.16Å; L383-Q385 VanDerWaalsContact C-N 3.29Å; L383-Q385 PolarHBondContact O-N 2.98Å; L383-K386 PolarHBondContact O-N 3.15Å; L383-K386 VanDerWaalsContact O-N 3.11Å; L383-F387 HydrophobicContact CB-CD2 4.3Å; L383-F387 HydrophobicContact CB-CE2 4.25Å; L383-F387 HydrophobicContact CD2-CE2 3.88Å; L383-F387 WeakPolarHBondContact O-CD2 3.24Å; L383-F387 PolarHBondContact O-N 3.5Å
384	M	77.8	Confident	75.7	Confident	45 Å²	45	104.2 Å²	104.2	22%	0.222	51%	0.514	C	S	.	.	H	α-helix	trans	-58.4	-40	176.8	-70.5	-58	110.9	0	0	112.1	F366 H380 F387 F388	F366-M384 HydrophobicContact CE1-CE 3.89Å; F366-M384 HydrophobicContact CZ-CE 3.69Å; H380-M384 VanDerWaalsContact CE1-CG 3.47Å; H380-M384 WeakPolarHBondContact CE1-CG 3.39Å; H380-M384 WeakPolarHBondContact O-CB 3.34Å; H380-M384 WeakPolarHBondContact O-CG 2.99Å; H380-M384 PolarHBondContact O-N 3.47Å; M384-F387 PolarHBondContact O-N 3.06Å; M384-F388 HydrophobicContact CE-CE2 4.43Å; M384-F388 CarbonylContact O-C 3.45Å; M384-F388 VanDerWaalsContact O-CA 3.32Å; M384-F388 WeakPolarHBondContact O-CA 3.44Å; M384-F388 WeakPolarHBondContact O-CB 3.16Å; M384-F388 PolarHBondContact O-N 2.96Å; M384-F388 HydrophobicContact SD-CD2 3.77Å; M384-F388 HydrophobicContact SD-CE2 3.87Å
385	Q	79.5	Confident	75	Confident	148 Å²	148	104.4 Å²	104.4	69%	0.692	51%	0.511	S	S	*	.	H	α-helix	trans	-72.5	-29.3	178.1	-166.3	173.4	13.6	0	0	113.3	D381 L383 G389	D381-Q385 VanDerWaalsContact O-CB 3.27Å; D381-Q385 WeakPolarHBondContact O-CB 3.33Å; D381-Q385 PolarHBondContact O-N 3.33Å; L383-Q385 VanDerWaalsContact C-N 3.29Å; L383-Q385 PolarHBondContact O-N 2.98Å; Q385-G389 WeakPolarHBondContact O-CA 3.34Å; Q385-G389 PolarHBondContact O-N 2.91Å
386	K	79	Confident	73.7	Confident	150 Å²	150	104.4 Å²	104.4	65%	0.652	52%	0.517	S	S	*	.	H	α-helix	trans	-74.4	-33.7	175.3	-76.3	170.6	-175.4	172.4	0	112.5	Q382 L383	Q382-K386 WeakPolarHBondContact O-CB 3.35Å; Q382-K386 WeakPolarHBondContact O-CD 3.49Å; Q382-K386 WeakPolarHBondContact O-CG 3.44Å; Q382-K386 PolarHBondContact O-N 3.04Å; Q382-K386 VanDerWaalsContact O-N 3.17Å; L383-K386 PolarHBondContact O-N 3.15Å; L383-K386 VanDerWaalsContact O-N 3.11Å
387	F	69.6	Low	72.3	Confident	91 Å²	91	107.9 Å²	107.9	40%	0.399	53%	0.531	S	S	.	.	H	α-helix	trans	-96.7	-38.2	-175.9	-64.9	-61.2	0	0	0	113.4	A365 L383 M384	A365-F387 HydrophobicContact CB-CD1 4.08Å; A365-F387 HydrophobicContact CB-CD2 3.99Å; A365-F387 HydrophobicContact CB-CE1 4.05Å; A365-F387 HydrophobicContact CB-CE2 3.97Å; A365-F387 HydrophobicContact CB-CG 4.06Å; A365-F387 HydrophobicContact CB-CZ 4Å; L383-F387 HydrophobicContact CB-CD2 4.3Å; L383-F387 HydrophobicContact CB-CE2 4.25Å; L383-F387 HydrophobicContact CD2-CE2 3.88Å; L383-F387 WeakPolarHBondContact O-CD2 3.24Å; L383-F387 PolarHBondContact O-N 3.5Å; M384-F387 PolarHBondContact O-N 3.06Å
388	F	69.6	Low	70.8	Confident	97 Å²	97	113.3 Å²	113.3	43%	0.425	55%	0.55	S	S	.	*	S	Bend	trans	-110.6	42.4	176.3	-57.5	-76.7	0	0	0	110.8	M384 Y392 Y393	M384-F388 HydrophobicContact CE-CE2 4.43Å; M384-F388 CarbonylContact O-C 3.45Å; M384-F388 VanDerWaalsContact O-CA 3.32Å; M384-F388 WeakPolarHBondContact O-CA 3.44Å; M384-F388 WeakPolarHBondContact O-CB 3.16Å; M384-F388 PolarHBondContact O-N 2.96Å; M384-F388 HydrophobicContact SD-CD2 3.77Å; M384-F388 HydrophobicContact SD-CE2 3.87Å; F388-Y392 AromaticContact CD1-CD1 3.89Å; F388-Y392 HydrophobicContact CD1-CD1 3.89Å; F388-Y392 AromaticContact CD1-CE1 3.99Å; F388-Y392 HydrophobicContact CD1-CE1 3.99Å; F388-Y392 HydrophobicContact CD1-CG 4.2Å; F388-Y393 HydrophobicContact CB-CE2 4.11Å; F388-Y393 WeakPolarHBondContact O-CD2 3.42Å; F388-Y393 WeakPolarHBondContact O-CE2 3.36Å
389	G	74.3	Confident	69.6	Low	15 Å²	15	115.8 Å²	115.8	16%	0.155	56%	0.558	C	S	.	*	S	Bend	trans	-87	-163.2	175.5	0	0	0	0	0	112.9	Q385 E391 Y392 Y393	Q385-G389 WeakPolarHBondContact O-CA 3.34Å; Q385-G389 PolarHBondContact O-N 2.91Å; G389-E391 PolarHBondContact O-N 2.88Å; G389-Y392 PolarHBondContact O-N 3.07Å; G389-Y393 PolarHBondContact O-N 3.02Å
390	D	69	Low	68.8	Low	152 Å²	152	119.8 Å²	119.8	81%	0.813	57%	0.574	S	S	*	*	H	α-helix	trans	-62.5	-14.7	-177.8	-64.3	-21.5	0	0	0	113.8	G394	D390-G394 WeakPolarHBondContact O-CA 3.37Å; D390-G394 PolarHBondContact O-N 3.39Å
391	E	69.5	Low	67.7	Low	175 Å²	175	121.9 Å²	121.9	82%	0.818	59%	0.592	S	S	*	*	H	α-helix	trans	-78.2	-33.7	173.4	-74.3	179.2	169.2	0	0	113	G389	G389-E391 PolarHBondContact O-N 2.88Å
392	Y	66.5	Low	65.7	Low	133 Å²	133	126.1 Å²	126.1	52%	0.522	61%	0.609	S	S	.	*	H	α-helix	trans	-79	-43.9	175.1	177.2	-102.1	0	0	0	111.3	F388 G389	F388-Y392 AromaticContact CD1-CD1 3.89Å; F388-Y392 HydrophobicContact CD1-CD1 3.89Å; F388-Y392 AromaticContact CD1-CE1 3.99Å; F388-Y392 HydrophobicContact CD1-CE1 3.99Å; F388-Y392 HydrophobicContact CD1-CG 4.2Å; G389-Y392 PolarHBondContact O-N 3.07Å
393	Y	68.9	Low	63.9	Low	166 Å²	166	130 Å²	130	65%	0.651	62%	0.624	S	S	*	*	H	α-helix	trans	-83.9	-16.3	179.9	-69.9	-69.8	0	0	0	114.1	F388 G389	F388-Y393 HydrophobicContact CB-CE2 4.11Å; F388-Y393 WeakPolarHBondContact O-CD2 3.42Å; F388-Y393 WeakPolarHBondContact O-CE2 3.36Å; G389-Y393 PolarHBondContact O-N 3.02Å
394	G	62.3	Low	62.2	Low	53 Å²	53	134.7 Å²	134.7	55%	0.546	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.1	-2.4	177.6	0	0	0	0	0	114.2	D390 D396	D390-G394 WeakPolarHBondContact O-CA 3.37Å; D390-G394 PolarHBondContact O-N 3.39Å; G394-D396 PolarHBondContact O-N 3.15Å
395	Q	53.1	Low	60.8	Low	134 Å²	134	139.6 Å²	139.6	63%	0.626	68%	0.677	S	S	*	*	S	Bend	trans	-83.1	94.9	168.8	-152.3	161.1	26.7	0	0	107.4	E397	Q395-E397 PolarHBondContact O-N 2.9Å
396	D	50.6	Low	59.4	Low	145 Å²	145	141.6 Å²	141.6	78%	0.775	69%	0.686	S	S	*	*			trans	-62.9	82.5	171.7	-74.4	-43.9	0	0	0	109.2	G394 E398	G394-D396 PolarHBondContact O-N 3.15Å; D396-E398 VanDerWaalsContact C-N 3.3Å; D396-E398 PolarHBondContact O-N 3.35Å
397	E	48.6	Very low	57.9	Low	156 Å²	156	137.6 Å²	137.6	73%	0.729	69%	0.687	S	S	*	*			trans	-73.9	84.9	169.2	-73.2	-171.8	167.3	0	0	109	Q395 E399	Q395-E397 PolarHBondContact O-N 2.9Å; E397-E399 PolarHBondContact O-N 3.35Å
398	E	55.9	Low	56.5	Low	185 Å²	185	138 Å²	138	86%	0.864	69%	0.694	S	S	*	*			trans	-71	0.4	174.7	-71.7	-174.2	151.9	0	0	114	D396	D396-E398 VanDerWaalsContact C-N 3.3Å; D396-E398 PolarHBondContact O-N 3.35Å
399	E	58.8	Low	55.4	Low	173 Å²	173	141.7 Å²	141.7	81%	0.808	71%	0.713	S	S	*	*	S	Bend	trans	-111.1	100.7	176.4	-73.1	-171.3	165.1	0	0	111.2	E397 P401	E397-E399 PolarHBondContact O-N 3.35Å; E399-P401 WeakPolarHBondContact O-CD 3Å
400	K	65.1	Low	54.2	Low	196 Å²	196	149.8 Å²	149.8	85%	0.852	75%	0.748	S	S	*	*			trans	-51.6	123.5	165.8	-89.3	-176.8	171.3	-171.6	0	109.1	Q402	K400-Q402 PolarHBondContact O-N 2.67Å; K400-Q402 VanDerWaalsContact O-N 3.12Å
401	P	57.4	Low	52.9	Low	102 Å²	102	147.6 Å²	147.6	66%	0.662	74%	0.737	S	S	*	*			trans	-61.1	119.7	171.7	23.9	-32	0	0	0	109	E399 F403	E399-P401 WeakPolarHBondContact O-CD 3Å; P401-F403 PolarHBondContact O-N 3.44Å
402	Q	41.6	Very low	51.6	Low	183 Å²	183	146.5 Å²	146.5	86%	0.855	73%	0.732	S	S	*	*			trans	-69.3	106.1	161.8	-78.8	-170.5	-65.4	0	0	106.4	K400 D404	K400-Q402 PolarHBondContact O-N 2.67Å; K400-Q402 VanDerWaalsContact O-N 3.12Å; Q402-D404 PolarHBondContact O-N 3.45Å
403	F	45.3	Very low	50.6	Low	191 Å²	191	149 Å²	149	84%	0.838	75%	0.748	S	S	*	*			trans	-60.9	116.3	161.9	-88.8	-96.8	0	0	0	107.1	P401 D405	P401-F403 PolarHBondContact O-N 3.44Å; F403-D405 PolarHBondContact O-N 3.05Å
404	D	44	Very low	49.6	Very low	139 Å²	139	150.3 Å²	150.3	74%	0.743	75%	0.752	S	S	*	*			trans	-62.5	121.7	165.8	-82.3	-29.4	0	0	0	107.6	Q402 E406	Q402-D404 PolarHBondContact O-N 3.45Å; D404-E406 PolarHBondContact O-N 3.22Å
405	D	48.7	Very low	48.9	Very low	147 Å²	147	153.6 Å²	153.6	79%	0.786	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-59	9	-177.5	-99.2	-23.5	0	0	0	115	F403	F403-D405 PolarHBondContact O-N 3.05Å
406	E	50	Low	48.6	Very low	190 Å²	190	156.9 Å²	156.9	89%	0.888	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-86.1	-3.6	179.1	-77.1	-173.5	169.4	0	0	113.8	D404	D404-E406 PolarHBondContact O-N 3.22Å
407	G	46.4	Very low	48.2	Very low	66 Å²	66	157.8 Å²	157.8	68%	0.68	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-85.9	-2.1	171.9	0	0	0	0	0	115.3	E409	G407-E409 VanDerWaalsContact C-N 3.28Å; G407-E409 PolarHBondContact O-N 3.35Å
408	N	40.7	Very low	48	Very low	99 Å²	99	155.9 Å²	155.9	53%	0.529	77%	0.768	S	S	.	*	G	3₁₀ helix	trans	-81.8	8	-169.1	-123.2	54.8	0	0	0	115.4	M410	N408-M410 PolarHBondContact O-N 3.04Å
409	E	47.6	Very low	47.6	Very low	176 Å²	176	157.5 Å²	157.5	82%	0.822	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-80.6	1.4	179.4	-151.9	169.4	-156.7	0	0	113.4	G407	G407-E409 VanDerWaalsContact C-N 3.28Å; G407-E409 PolarHBondContact O-N 3.35Å
410	M	47.8	Very low	46.2	Very low	184 Å²	184	155.3 Å²	155.3	91%	0.906	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-114.1	13.4	174.2	-146.1	176.8	-172.7	0	0	114	N408	N408-M410 PolarHBondContact O-N 3.04Å
411	D	43.2	Very low	45.1	Very low	107 Å²	107	149 Å²	149	57%	0.572	76%	0.755	S	S	*	*	S	Bend	trans	-112.3	5.4	170.3	-113.4	-5.1	0	0	0	112.9	H413 W414	D411-H413 PolarHBondContact O-N 3.07Å; D411-W414 PolarHBondContact O-N 2.73Å
412	E	41.7	Very low	43.9	Very low	151 Å²	151	152.5 Å²	152.5	71%	0.706	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	31.3	-176	-117.7	-176.4	-152.3	0	0	115.1
413	H	45.5	Very low	43.1	Very low	185 Å²	185	152.1 Å²	152.1	86%	0.856	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.1	14.6	163.6	-74.5	-16.1	0	0	0	113.6	D411	D411-H413 PolarHBondContact O-N 3.07Å
414	W	48	Very low	43	Very low	194 Å²	194	154.4 Å²	154.4	74%	0.735	76%	0.764	S	S	*	*			trans	-107.8	90.9	165.1	-80.1	32.2	0	0	0	108.9	D411 W416	D411-W414 PolarHBondContact O-N 2.73Å; W414-W416 VanDerWaalsContact C-N 3.31Å; W414-W416 AromaticContact CE3-NE1 3.86Å; W414-W416 PolarHBondContact O-N 2.92Å
415	N	47	Very low	42.1	Very low	123 Å²	123	156.9 Å²	156.9	66%	0.658	77%	0.771	S	S	*	*			trans	-70.2	82.9	177.6	-71.4	-18.7	0	0	0	111.4	D417 T418	N415-D417 PolarHBondContact O-N 2.93Å; N415-T418 PolarHBondContact O-N 2.85Å; N415-T418 PolarHBondContact O-OG1 3.29Å
416	W	46.3	Very low	41.4	Very low	203 Å²	203	159.1 Å²	159.1	77%	0.769	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-67.8	-17.3	166.9	-79	56.2	0	0	0	112.2	W414 T418 W419	W414-W416 VanDerWaalsContact C-N 3.31Å; W414-W416 AromaticContact CE3-NE1 3.86Å; W414-W416 PolarHBondContact O-N 2.92Å; W416-T418 VanDerWaalsContact C-N 3.28Å; W416-T418 PolarHBondContact O-N 3.45Å; W416-W419 VanDerWaalsContact O-CB 3.29Å; W416-W419 WeakPolarHBondContact O-CB 3.35Å; W416-W419 PolarHBondContact O-N 3.34Å; W416-W419 VanDerWaalsContact O-N 3.11Å
417	D	42.1	Very low	40.4	Very low	164 Å²	164	153.7 Å²	153.7	88%	0.877	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-78.1	-2.1	176.6	-86.6	-13.3	0	0	0	115.1	N415 W419	N415-D417 PolarHBondContact O-N 2.93Å; D417-W419 VanDerWaalsContact C-N 3.3Å
418	T	45	Very low	39.3	Very low	116 Å²	116	159.9 Å²	159.9	71%	0.712	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-86.9	1	163.2	29.6	0	0	0	0	113.4	N415 W416 T420	N415-T418 PolarHBondContact O-N 2.85Å; N415-T418 PolarHBondContact O-OG1 3.29Å; W416-T418 VanDerWaalsContact C-N 3.28Å; W416-T418 PolarHBondContact O-N 3.45Å; T418-T420 PolarHBondContact O-N 3.15Å
419	W	47.4	Very low	38.6	Very low	219 Å²	219	160.6 Å²	160.6	83%	0.83	78%	0.784	S	S	*	*			trans	-91.1	85.9	173.5	-172	-97	0	0	0	111.3	W416 D417	W416-W419 VanDerWaalsContact O-CB 3.29Å; W416-W419 WeakPolarHBondContact O-CB 3.35Å; W416-W419 PolarHBondContact O-N 3.34Å; W416-W419 VanDerWaalsContact O-N 3.11Å; D417-W419 VanDerWaalsContact C-N 3.3Å
420	T	30.4	Very low	37.7	Very low	126 Å²	126	159.2 Å²	159.2	77%	0.773	78%	0.777	S	S	*	*			trans	-108.8	101.3	156.1	49.2	0	0	0	0	108.4	T418 E422	T418-T420 PolarHBondContact O-N 3.15Å; T420-E422 PolarHBondContact O-N 3.36Å
421	G	42	Very low	36.9	Very low	63 Å²	63	158 Å²	158	65%	0.649	77%	0.77	S	S	*	*			trans	-79.4	99.9	171.8	0	0	0	0	0	111.6
422	E	30.4	Very low	36.4	Very low	177 Å²	177	161.4 Å²	161.4	83%	0.827	78%	0.782	S	S	*	*			trans	177.3	134.1	154.9	-127	170.3	173	0	0	104.3	T420	T420-E422 PolarHBondContact O-N 3.36Å
423	E	25.4	Very low	36.2	Very low	174 Å²	174	164.9 Å²	164.9	81%	0.813	79%	0.79	S	S	*	*			cis	-162.4	151.6	22.9	-169	177.2	177.6	0	0	105.9	E425	E423-E425 PolarHBondContact O-N 3.04Å
424	R	43.4	Very low	35.5	Very low	239 Å²	239	161.3 Å²	161.3	90%	0.902	79%	0.786	S	S	*	*			trans	-48.6	112.1	170.5	173.2	-170	-171.2	172.6	2.8	112.5
425	E	25.9	Very low	34.8	Very low	192 Å²	192	156.8 Å²	156.8	90%	0.897	79%	0.79	S	S	*	*			trans	-162.8	151.3	146.2	-126.8	177.4	176.7	0	0	113.5	E423	E423-E425 PolarHBondContact O-N 3.04Å
426	E	34.1	Very low	34.5	Very low	194 Å²	194	156.7 Å²	156.7	91%	0.907	80%	0.799	S	S	*	*			trans	-70.9	148.6	-165	-59.4	170.9	151.7	0	0	115.3
427	G	28.2	Very low	34.6	Very low	76 Å²	76	149.9 Å²	149.9	78%	0.784	79%	0.792	S	S	*	*			trans	126.3	113.9	141.3	0	0	0	0	0	120.5
428	F	22.5	Very low	35	Very low	195 Å²	195	147.7 Å²	147.7	86%	0.855	79%	0.786	S	S	*	*			trans	64.9	107.3	132	-138	-99.5	0	0	0	123
429	D	26.2	Very low	35.5	Very low	115 Å²	115	148.1 Å²	148.1	62%	0.615	78%	0.78	S	S	*	*				69.9	136	125.7	-128.8	-8.6	0	0	0	125.5
430	E	29.8	Very low	35.4	Very low	146 Å²	146	141.3 Å²	141.3	68%	0.682	77%	0.765	S	S	*	*			trans	65.5	128.5	143.5	-114.9	171.5	-170.5	0	0	127.1
431	E	30	Very low	36.2	Very low	160 Å²	160	142.2 Å²	142.2	75%	0.748	77%	0.765	S	S	*	*			trans	65.1	148.4	140.7	-88.6	173.9	-175.6	0	0	120.5
432	E	32.5	Very low	37.2	Very low	177 Å²	177	143 Å²	143	83%	0.827	75%	0.754	S	S	*	*			cis	-168.7	155.4	36.4	-165.1	174.9	-178.7	0	0	110.8
433	Y	37.7	Very low	38.2	Very low	224 Å²	224	144 Å²	144	88%	0.878	76%	0.759	S	S	*	*			trans	-104.5	141.9	173.4	-144.4	-99.2	0	0	0	109.6
434	S	31.1	Very low	39.3	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	76%	0.761	S	S	*	*			trans	-150	122.4	165.3	160.4	0	0	0	0	112
435	A	34.1	Very low	39.8	Very low	100 Å²	100	137.1 Å²	137.1	83%	0.826	74%	0.741	S	S	*	*			trans	-142.2	129.2	149.9	0	0	0	0	0	109.1
436	S	39.6	Very low	41.2	Very low	121 Å²	121	132.8 Å²	132.8	85%	0.846	72%	0.723	S	S	*	*			trans	-103.9	137.2	-161.4	173	0	0	0	0	111.8
437	G	49.4	Very low	42.6	Very low	59 Å²	59	130.7 Å²	130.7	61%	0.608	72%	0.715	S	S	*	*			trans	-144.8	142.4	161.9	0	0	0	0	0	109.3
438	P	50	Low	43.6	Very low	118 Å²	118	133.3 Å²	133.3	77%	0.766	71%	0.711	S	S	*	*			trans	-68.5	135.1	-170.5	25.3	-31.7	0	0	0	112.2	D442	P438-D442 WeakPolarHBondContact CA-OD2 2.91Å; P438-D442 WeakPolarHBondContact CB-OD2 3.26Å
439	H	55.5	Low	44.9	Very low	126 Å²	126	129 Å²	129	58%	0.583	71%	0.712	S	S	*	*			trans	-105.9	155	-178	-168.1	-75.7	0	0	0	109.3	D441 D442	H439-D441 PolarHBondContact O-N 3.26Å; H439-D442 PolarHBondContact N-OD2 3.37Å; H439-D442 VanDerWaalsContact O-CG 3.28Å; H439-D442 PolarHBondContact O-N 3.39Å
440	C	45.3	Very low	45.7	Very low	76 Å²	76	131.1 Å²	131.1	51%	0.514	72%	0.723	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.4	8.5	-171.3	27	0	0	0	0	117.4	F445	C440-F445 HydrophobicContact CB-CD1 4.1Å; C440-F445 HydrophobicContact CB-CE1 3.86Å
441	D	47.9	Very low	47.1	Very low	145 Å²	145	131.7 Å²	131.7	78%	0.775	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	1.1	171.5	-69.6	-50.4	0	0	0	112.6	H439	H439-D441 PolarHBondContact O-N 3.26Å
442	D	61.9	Low	48.4	Very low	78 Å²	78	128.9 Å²	128.9	42%	0.417	71%	0.71	S	S	.	*			trans	-66.8	131.2	177.3	-70	-33.9	0	0	0	110.9	P438 H439 D444 F445	P438-D442 WeakPolarHBondContact CA-OD2 2.91Å; P438-D442 WeakPolarHBondContact CB-OD2 3.26Å; H439-D442 PolarHBondContact N-OD2 3.37Å; H439-D442 VanDerWaalsContact O-CG 3.28Å; H439-D442 PolarHBondContact O-N 3.39Å; D442-D444 PolarHBondContact O-N 3.06Å; D442-F445 WeakPolarHBondContact O-CB 3.13Å; D442-F445 PolarHBondContact O-N 3.13Å
443	E	50.8	Low	49.6	Very low	199 Å²	199	125.8 Å²	125.8	93%	0.93	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-12.3	-168.8	-64.7	-178	165.1	0	0	114.8
444	D	49.3	Very low	50.8	Low	158 Å²	158	119 Å²	119	85%	0.845	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	2.3	174.3	-69.1	-28.5	0	0	0	113	D442 I446	D442-D444 PolarHBondContact O-N 3.06Å; D444-I446 PolarHBondContact O-N 2.82Å
445	F	54.3	Low	51.7	Low	111 Å²	111	121.8 Å²	121.8	49%	0.487	69%	0.691	S	S	.	*			trans	-86.1	94.5	178.3	-169.1	-107.8	0	0	0	110.8	C440 D442 M447	C440-F445 HydrophobicContact CB-CD1 4.1Å; C440-F445 HydrophobicContact CB-CE1 3.86Å; D442-F445 WeakPolarHBondContact O-CB 3.13Å; D442-F445 PolarHBondContact O-N 3.13Å; F445-M447 HydrophobicContact CD1-CG 4Å; F445-M447 HydrophobicContact CD1-SD 4.22Å; F445-M447 HydrophobicContact CE1-CE 4.04Å; F445-M447 HydrophobicContact CE1-CG 3.83Å; F445-M447 HydrophobicContact CE1-SD 3.43Å; F445-M447 WeakPolarHBondContact CE1-SD 3.4Å; F445-M447 HydrophobicContact CZ-SD 4.09Å
446	I	55.6	Low	51.9	Low	101 Å²	101	125 Å²	125	52%	0.518	69%	0.689	S	S	.	*			trans	-86.4	126.5	-178.7	-55.9	165	0	0	0	109.6	D444 Y451	D444-I446 PolarHBondContact O-N 2.82Å; I446-Y451 HydrophobicContact CD1-CD2 4.13Å; I446-Y451 HydrophobicContact CD1-CE2 3.78Å
447	M	62.8	Low	51.5	Low	149 Å²	149	125.2 Å²	125.2	73%	0.734	69%	0.685	S	S	*	*			trans	-99.6	21.6	-172	-82.9	-73.8	-117.6	0	0	115.1	F445	F445-M447 HydrophobicContact CD1-CG 4Å; F445-M447 HydrophobicContact CD1-SD 4.22Å; F445-M447 HydrophobicContact CE1-CE 4.04Å; F445-M447 HydrophobicContact CE1-CG 3.83Å; F445-M447 HydrophobicContact CE1-SD 3.43Å; F445-M447 WeakPolarHBondContact CE1-SD 3.4Å; F445-M447 HydrophobicContact CZ-SD 4.09Å
448	D	48.8	Very low	50.5	Low	131 Å²	131	126.4 Å²	126.4	70%	0.701	69%	0.689	S	S	*	*			trans	-104	135.9	177.7	-70.7	-20.5	0	0	0	111.4	D450	D448-D450 VanDerWaalsContact C-N 3.31Å; D448-D450 PolarHBondContact O-N 3.18Å
449	A	49.5	Very low	49.7	Very low	106 Å²	106	125.5 Å²	125.5	88%	0.876	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-0.2	-171.6	0	0	0	0	0	115.8
450	D	44.5	Very low	48.7	Very low	158 Å²	158	128.3 Å²	128.3	85%	0.845	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	22.4	-176	-62	-22.4	0	0	0	113.4	D448 D452	D448-D450 VanDerWaalsContact C-N 3.31Å; D448-D450 PolarHBondContact O-N 3.18Å; D450-D452 PolarHBondContact O-N 3.49Å
451	Y	59.5	Low	48.1	Very low	159 Å²	159	132.8 Å²	132.8	62%	0.624	71%	0.707	S	S	*	*			trans	-72.6	110	178.9	-173.3	-97.9	0	0	0	112.2	I446 P453	I446-Y451 HydrophobicContact CD1-CD2 4.13Å; I446-Y451 HydrophobicContact CD1-CE2 3.78Å; Y451-P453 HydrophobicContact CE1-CB 4.37Å; Y451-P453 WeakPolarHBondContact O-CD 3.37Å
452	D	57	Low	47.1	Very low	101 Å²	101	134.1 Å²	134.1	54%	0.54	71%	0.706	S	S	.	*			trans	-94.5	108.8	176.4	-168.9	-17.8	0	0	0	110.9	D450 S454	D450-D452 PolarHBondContact O-N 3.49Å; D452-S454 PolarHBondContact O-N 3.29Å; D452-S454 PolarHBondContact OD1-N 3.18Å; D452-S454 PolarHBondContact OD1-OG 3.46Å
453	P	57.3	Low	45.5	Very low	111 Å²	111	139.4 Å²	139.4	72%	0.721	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	6.3	-173	28.4	-33.6	0	0	0	114.7	Y451	Y451-P453 HydrophobicContact CE1-CB 4.37Å; Y451-P453 WeakPolarHBondContact O-CD 3.37Å
454	S	61.9	Low	44.4	Very low	81 Å²	81	138.6 Å²	138.6	57%	0.566	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-8	-178.3	66	0	0	0	0	114.9	D452 H456	D452-S454 PolarHBondContact O-N 3.29Å; D452-S454 PolarHBondContact OD1-N 3.18Å; D452-S454 PolarHBondContact OD1-OG 3.46Å; S454-H456 PolarHBondContact O-N 3.32Å
455	Q	49.8	Very low	43.7	Very low	170 Å²	170	140 Å²	140	79%	0.794	72%	0.717	S	S	*	*	S	Bend	trans	-97.4	88.5	177.8	-65.5	-90.6	-14.3	0	0	111.1
456	H	39.2	Very low	42.3	Very low	167 Å²	167	142 Å²	142	77%	0.773	73%	0.728	S	S	*	*			trans	-16.7	146	168	-99.7	-107.8	0	0	0	118.2	S454	S454-H456 PolarHBondContact O-N 3.32Å
457	T	30.3	Very low	41.1	Very low	126 Å²	126	144.7 Å²	144.7	77%	0.773	74%	0.736	S	S	*	*				-174.8	123.5	81.8	35.7	0	0	0	0	114
458	A	28.7	Very low	39.7	Very low	84 Å²	84	147 Å²	147	69%	0.694	74%	0.742	S	S	*	*				33.7	120.7	127.9	0	0	0	0	0	118.1
459	S	33.8	Very low	38.7	Very low	99 Å²	99	150.3 Å²	150.3	69%	0.692	75%	0.75	S	S	*	*				167.6	143.3	51	42.4	0	0	0	0	113.9
460	K	34.9	Very low	37.8	Very low	185 Å²	185	153.5 Å²	153.5	80%	0.804	75%	0.752	S	S	*	*			trans	68.2	108.9	131.4	-69.8	172	-174.2	167.9	0	120.7
461	K	32.1	Very low	37.2	Very low	169 Å²	169	155 Å²	155	74%	0.735	75%	0.75	S	S	*	*				74	127	113.3	-88.3	177.3	170.1	162	0	120.4
462	K	27.9	Very low	36.2	Very low	174 Å²	174	155.4 Å²	155.4	76%	0.757	76%	0.756	S	S	*	*				86.6	111.5	127.8	-82.8	-178.1	173.6	-177	0	119
463	K	26.6	Very low	34.9	Very low	188 Å²	188	156.3 Å²	156.3	82%	0.817	76%	0.76	S	S	*	*				133.2	109.1	122.6	-89.7	176.9	168.5	179.5	0	109.7
464	K	28.5	Very low	33.7	Very low	182 Å²	182	159.1 Å²	159.1	79%	0.791	77%	0.769	S	S	*	*				66.1	112.2	80.2	-160.7	-176.2	-168.4	179.9	0	111.5
465	K	34.5	Very low	32.3	Very low	188 Å²	188	162.5 Å²	162.5	82%	0.817	78%	0.78	S	S	*	*			trans	33.5	114.2	148	-73.5	175.7	163.7	175.3	0	115.8
466	E	25.2	Very low	31.8	Very low	152 Å²	152	160.1 Å²	160.1	71%	0.71	78%	0.779	S	S	*	*			trans	-163.9	131.9	130.3	-93.5	-143.5	133.6	0	0	110.8
467	K	30.7	Very low	32	Very low	159 Å²	159	160.2 Å²	160.2	69%	0.691	78%	0.78	S	S	*	*			trans	69.3	97.3	146.2	-66.2	167.5	179	153.5	0	116.2
468	K	33.4	Very low	31.8	Very low	198 Å²	198	163.2 Å²	163.2	86%	0.861	79%	0.788	S	S	*	*				24	120.7	73.4	-92.6	-169.4	-179.1	-178.9	0	114
469	K	28.3	Very low	31.9	Very low	199 Å²	199	162.3 Å²	162.3	87%	0.865	79%	0.787	S	S	*	*			trans	100.3	106.5	165	-57.3	176.7	179.5	-175.7	0	114.4
470	L	29.7	Very low	32.5	Very low	174 Å²	174	167.1 Å²	167.1	91%	0.911	80%	0.795	S	S	*	*				-166.7	141	93.6	-93.2	157.9	0	0	0	111.7
471	K	32	Very low	32.8	Very low	189 Å²	189	168.6 Å²	168.6	82%	0.822	80%	0.802	S	S	*	*			trans	-68.5	146.5	173	-98.8	-172.2	178.2	-178.7	0	110.6
472	K	37.9	Very low	33.7	Very low	168 Å²	168	169.6 Å²	169.6	73%	0.73	81%	0.806	S	S	*	*				61.2	134.2	122.2	-148	-166.6	168	173.2	0	119.2
473	D	30.3	Very low	35.2	Very low	119 Å²	119	170.9 Å²	170.9	64%	0.636	81%	0.811	S	S	*	*			trans	86.2	96	158.3	-60.4	-40.1	0	0	0	117.8
474	D	31.8	Very low	36.8	Very low	170 Å²	170	168.1 Å²	168.1	91%	0.909	80%	0.799	S	S	*	*				-153.1	123.2	128	-95.4	-30.9	0	0	0	110.5
475	L	33.5	Very low	38.8	Very low	153 Å²	153	162.7 Å²	162.7	80%	0.801	78%	0.784	S	S	*	*			trans	-63.7	175.4	-178.1	-78.4	135.6	0	0	0	113.5
476	P	37.6	Very low	39.8	Very low	119 Å²	119	160.3 Å²	160.3	77%	0.773	78%	0.776	S	S	*	*			cis	-142.4	168.7	17	29.3	-3.9	0	0	0	118.6
477	Q	45.4	Very low	41.3	Very low	170 Å²	170	160.2 Å²	160.2	79%	0.794	77%	0.773	S	S	*	*			trans	-45.5	142.8	159.2	-69.1	171.3	-18.5	0	0	113.5
478	M	26.1	Very low	42.9	Very low	189 Å²	189	155.3 Å²	155.3	93%	0.931	76%	0.757	S	S	*	*				-179.3	136.8	127	-94.7	-52	-178	0	0	111
479	G	30.2	Very low	44.3	Very low	65 Å²	65	149.9 Å²	149.9	67%	0.67	73%	0.734	S	S	*	*	S	Bend	trans	132	79.2	150.4	0	0	0	0	0	117.8
480	K	45.3	Very low	46	Very low	199 Å²	199	143.9 Å²	143.9	87%	0.865	71%	0.714	S	S	*	*			trans	58.1	100.1	153	-56.6	-178.4	-175.7	175.8	0	115.7	K482	K480-K482 VanDerWaalsContact C-N 3.34Å; K480-K482 PolarHBondContact O-N 3.23Å
481	K	41.7	Very low	47.8	Very low	217 Å²	217	141 Å²	141	94%	0.943	70%	0.698	S	S	*	*			trans	-50.6	95.8	163.3	-63.9	-175.1	177.9	-175.4	0	109.5	K483	K481-K483 PolarHBondContact O-N 3.25Å
482	K	51.4	Low	49.6	Very low	190 Å²	190	136 Å²	136	83%	0.826	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-66.1	124.6	164.5	-70.6	-179.2	-178.7	173.5	0	105.3	K480 K484	K480-K482 VanDerWaalsContact C-N 3.34Å; K480-K482 PolarHBondContact O-N 3.23Å; K482-K484 PolarHBondContact O-N 3.29Å; K482-K484 VanDerWaalsContact O-N 3.1Å
483	K	60.2	Low	51.2	Low	201 Å²	201	135.7 Å²	135.7	87%	0.874	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-50.6	120.9	170.4	-66	-177.9	174.6	-171.2	0	106.7	K481 S485	K481-K483 PolarHBondContact O-N 3.25Å; K483-S485 PolarHBondContact O-N 2.8Å
484	K	59.7	Low	53.2	Low	130 Å²	130	136.3 Å²	136.3	57%	0.565	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-55.4	138.3	176.4	-71.1	177.6	174.1	-172.4	0	107.2	K482 V488 E489	K482-K484 PolarHBondContact O-N 3.29Å; K482-K484 VanDerWaalsContact O-N 3.1Å; K484-V488 HydrophobicContact CB-CB 4.25Å; K484-V488 HydrophobicContact CB-CG1 4.13Å; K484-V488 HydrophobicContact CD-CG1 3.95Å; K484-V488 HydrophobicContact CG-CG1 4.18Å; K484-E489 HydrophobicContact CB-CG 4.14Å
485	S	70.9	Confident	55.1	Low	68 Å²	68	137.4 Å²	137.4	48%	0.476	68%	0.683	S	S	.	*	P	Polyproline II helix	trans	-61.5	149.2	175.6	51.7	0	0	0	0	108.7	K483 F487 V488 E489	K483-S485 PolarHBondContact O-N 2.8Å; S485-F487 PolarHBondContact O-N 3.09Å; S485-V488 PolarHBondContact O-N 2.87Å; S485-V488 WeakPolarHBondContact OG-CG2 3.39Å; S485-E489 PolarHBondContact O-N 3.24Å
486	H	54	Low	56.7	Low	137 Å²	137	136 Å²	136	63%	0.634	68%	0.683	S	S	*	*	H	α-helix	trans	-50.5	-30	177.8	-169.9	-37.4	0	0	0	112	E489 V490	H486-E489 PolarHBondContact O-N 3.39Å; H486-V490 WeakPolarHBondContact ND1-CG2 3.31Å; H486-V490 WeakPolarHBondContact O-CB 3.42Å; H486-V490 WeakPolarHBondContact O-CG2 3.41Å; H486-V490 PolarHBondContact O-N 3.08Å
487	F	57.3	Low	57.8	Low	151 Å²	151	136.1 Å²	136.1	66%	0.662	68%	0.681	S	S	*	*	H	α-helix	trans	-66.9	-45.9	175	-171.4	-108.2	0	0	0	113.2	S485 E489 V490 I491	S485-F487 PolarHBondContact O-N 3.09Å; F487-E489 VanDerWaalsContact C-N 3.32Å; F487-E489 PolarHBondContact O-N 3.49Å; F487-V490 PolarHBondContact O-N 3Å; F487-I491 HydrophobicContact CD1-CD1 3.61Å; F487-I491 HydrophobicContact CD2-CD1 4.49Å; F487-I491 HydrophobicContact CE1-CD1 3.29Å; F487-I491 HydrophobicContact CE2-CD1 4.23Å; F487-I491 HydrophobicContact CG-CD1 4.22Å; F487-I491 HydrophobicContact CZ-CD1 3.64Å; F487-I491 VanDerWaalsContact O-CG1 3.32Å; F487-I491 WeakPolarHBondContact O-CG1 3.21Å; F487-I491 PolarHBondContact O-N 3.06Å
488	V	64.6	Low	58.3	Low	56 Å²	56	135.6 Å²	135.6	34%	0.339	68%	0.677	S	S	.	*	H	α-helix	trans	-67.3	-36.1	174.1	174.9	0	0	0	0	110.4	K484 S485 V490 I491 T492	K484-V488 HydrophobicContact CB-CB 4.25Å; K484-V488 HydrophobicContact CB-CG1 4.13Å; K484-V488 HydrophobicContact CD-CG1 3.95Å; K484-V488 HydrophobicContact CG-CG1 4.18Å; S485-V488 PolarHBondContact O-N 2.87Å; S485-V488 WeakPolarHBondContact OG-CG2 3.39Å; V488-V490 VanDerWaalsContact C-N 3.34Å; V488-V490 PolarHBondContact O-N 2.7Å; V488-I491 PolarHBondContact O-N 3.07Å; V488-T492 HydrophobicContact CG1-CG2 4.19Å; V488-T492 WeakPolarHBondContact O-CB 3.45Å; V488-T492 WeakPolarHBondContact O-CG2 3.45Å; V488-T492 PolarHBondContact O-N 3.45Å; V488-T492 PolarHBondContact O-OG1 3.07Å
489	E	62.3	Low	60.1	Low	84 Å²	84	130.8 Å²	130.8	39%	0.393	66%	0.655	S	S	.	*	H	α-helix	trans	-63.6	-38.2	173.8	-74	-176.3	176.7	0	0	112.5	K484 S485 H486 F487 T492 R493	K484-E489 HydrophobicContact CB-CG 4.14Å; S485-E489 PolarHBondContact O-N 3.24Å; H486-E489 PolarHBondContact O-N 3.39Å; F487-E489 VanDerWaalsContact C-N 3.32Å; F487-E489 PolarHBondContact O-N 3.49Å; E489-T492 WeakPolarHBondContact CA-OG1 2.88Å; E489-T492 PolarHBondContact O-N 2.95Å; E489-T492 PolarHBondContact O-OG1 3.27Å; E489-R493 VanDerWaalsContact O-CG 3.32Å; E489-R493 WeakPolarHBondContact O-CG 3.43Å; E489-R493 PolarHBondContact O-N 2.83Å
490	V	64.7	Low	61.8	Low	72 Å²	72	133.1 Å²	133.1	44%	0.436	66%	0.658	S	S	.	*	H	α-helix	trans	-70.5	-37.2	177.2	168.4	0	0	0	0	111.8	H486 F487 V488 R493	H486-V490 WeakPolarHBondContact ND1-CG2 3.31Å; H486-V490 WeakPolarHBondContact O-CB 3.42Å; H486-V490 WeakPolarHBondContact O-CG2 3.41Å; H486-V490 PolarHBondContact O-N 3.08Å; F487-V490 PolarHBondContact O-N 3Å; V488-V490 VanDerWaalsContact C-N 3.34Å; V488-V490 PolarHBondContact O-N 2.7Å; V490-R493 PolarHBondContact O-N 3Å
491	I	66.9	Low	62.6	Low	114 Å²	114	132.2 Å²	132.2	59%	0.585	66%	0.657	S	S	*	*	H	α-helix	trans	-72.4	-32.6	175.6	-66.9	165.6	0	0	0	111.3	F487 V488 R493	F487-I491 HydrophobicContact CD1-CD1 3.61Å; F487-I491 HydrophobicContact CD2-CD1 4.49Å; F487-I491 HydrophobicContact CE1-CD1 3.29Å; F487-I491 HydrophobicContact CE2-CD1 4.23Å; F487-I491 HydrophobicContact CG-CD1 4.22Å; F487-I491 HydrophobicContact CZ-CD1 3.64Å; F487-I491 VanDerWaalsContact O-CG1 3.32Å; F487-I491 WeakPolarHBondContact O-CG1 3.21Å; F487-I491 PolarHBondContact O-N 3.06Å; V488-I491 PolarHBondContact O-N 3.07Å; I491-R493 VanDerWaalsContact C-N 3.32Å
492	T	69.2	Low	63.6	Low	84 Å²	84	128.2 Å²	128.2	52%	0.515	64%	0.642	S	S	.	*	S	Bend	trans	-80.9	-9.4	175.2	59	0	0	0	0	113.9	V488 E489 T494	V488-T492 HydrophobicContact CG1-CG2 4.19Å; V488-T492 WeakPolarHBondContact O-CB 3.45Å; V488-T492 WeakPolarHBondContact O-CG2 3.45Å; V488-T492 PolarHBondContact O-N 3.45Å; V488-T492 PolarHBondContact O-OG1 3.07Å; E489-T492 WeakPolarHBondContact CA-OG1 2.88Å; E489-T492 PolarHBondContact O-N 2.95Å; E489-T492 PolarHBondContact O-OG1 3.27Å; T492-T494 PolarHBondContact O-N 3.34Å
493	R	72.4	Confident	64.6	Low	162 Å²	162	124 Å²	124	61%	0.611	62%	0.623	S	S	*	*	S	Bend	trans	-78.3	115.2	167.4	-77	172	-167.4	-179.4	4.7	106.5	E489 V490 I491 K495	E489-R493 VanDerWaalsContact O-CG 3.32Å; E489-R493 WeakPolarHBondContact O-CG 3.43Å; E489-R493 PolarHBondContact O-N 2.83Å; V490-R493 PolarHBondContact O-N 3Å; I491-R493 VanDerWaalsContact C-N 3.32Å; R493-K495 PolarHBondContact O-N 3.38Å
494	T	72.6	Confident	65.4	Low	132 Å²	132	117.8 Å²	117.8	81%	0.81	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-56.2	134.7	172.5	49.4	0	0	0	0	108.8	T492	T492-T494 PolarHBondContact O-N 3.34Å
495	K	71.7	Confident	65.4	Low	192 Å²	192	119 Å²	119	84%	0.835	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-52.6	132.9	175.6	-63.4	174.3	-177.7	178	0	107.8	R493 V497	R493-K495 PolarHBondContact O-N 3.38Å; K495-V497 PolarHBondContact O-N 3.07Å
496	P	66.7	Low	65.7	Low	124 Å²	124	122.9 Å²	122.9	81%	0.805	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-57.1	133.2	176.3	25.5	-32.6	0	0	0	108	F498	P496-F498 PolarHBondContact O-N 2.77Å
497	V	61.4	Low	66.9	Low	122 Å²	122	120.3 Å²	120.3	74%	0.739	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-58.3	132.4	168.9	177.4	0	0	0	0	106.2	K495 D499	K495-V497 PolarHBondContact O-N 3.07Å; V497-D499 PolarHBondContact O-N 3.47Å
498	F	54.2	Low	67.7	Low	158 Å²	158	120.7 Å²	120.7	69%	0.693	61%	0.605	S	S	*	*			trans	-67.1	103.7	-178.8	178.3	-101.3	0	0	0	108.8	P496 P500	P496-F498 PolarHBondContact O-N 2.77Å; F498-P500 HydrophobicContact CE1-CB 4.5Å; F498-P500 WeakPolarHBondContact O-CD 3.26Å
499	D	64.3	Low	68.2	Low	89 Å²	89	121 Å²	121	48%	0.476	60%	0.604	S	S	.	*			trans	-82.3	119.5	171	-68.4	-37.5	0	0	0	108.1	V497 Q501 E502	V497-D499 PolarHBondContact O-N 3.47Å; D499-Q501 PolarHBondContact O-N 3.29Å; D499-E502 HydrophobicContact CB-CG 3.68Å; D499-E502 WeakPolarHBondContact O-CB 3.35Å; D499-E502 PolarHBondContact O-N 2.56Å
500	P	66.5	Low	68.6	Low	113 Å²	113	120.7 Å²	120.7	73%	0.734	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	6.4	-178.8	25.6	-32.8	0	0	0	114.2	F498	F498-P500 HydrophobicContact CE1-CB 4.5Å; F498-P500 WeakPolarHBondContact O-CD 3.26Å
501	Q	61.5	Low	69.1	Low	180 Å²	180	120.9 Å²	120.9	84%	0.841	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-10.1	172.6	-64.9	-173	-30.5	0	0	113.6	D499	D499-Q501 PolarHBondContact O-N 3.29Å
502	E	64	Low	69.1	Low	134 Å²	134	123 Å²	123	63%	0.626	60%	0.603	S	S	*	*	S	Bend	trans	-75.2	-32.7	-170.6	-74.5	-96.5	135.2	0	0	113.3	D499 Q507	D499-E502 HydrophobicContact CB-CG 3.68Å; D499-E502 WeakPolarHBondContact O-CB 3.35Å; D499-E502 PolarHBondContact O-N 2.56Å; E502-Q507 PolarHBondContact O-NE2 2.88Å; E502-Q507 PolarHBondContact O-OE1 3.44Å
503	K	71.9	Confident	69	Low	100 Å²	100	125.8 Å²	125.8	44%	0.435	61%	0.605	S	S	.	*	S	Bend	trans	-108.1	99.1	177.9	-63.8	-169.5	177.5	-157	0	109.5	E511	K503-E511 WeakPolarHBondContact CE-OE1 3.37Å; K503-E511 VanDerWaalsContact NZ-CD 3.3Å; K503-E511 IonicContact NZ-OE1 3.02Å; K503-E511 PolarHBondContact NZ-OE1 3.16Å; K503-E511 IonicContact NZ-OE2 3.34Å; K503-E511 PolarHBondContact NZ-OE2 3.22Å
504	T	76.6	Confident	68.8	Low	71 Å²	71	122.6 Å²	122.6	44%	0.436	60%	0.596	S	S	.	*			trans	-61.7	153	167.2	56.5	0	0	0	0	109.2	E506 Q507 Y508	T504-E506 PolarHBondContact O-N 3.19Å; T504-E506 VanDerWaalsContact O-N 3.1Å; T504-Q507 WeakPolarHBondContact O-CA 3.39Å; T504-Q507 WeakPolarHBondContact O-CB 3.32Å; T504-Q507 PolarHBondContact O-N 3.46Å; T504-Y508 PolarHBondContact O-N 2.87Å
505	F	60.8	Low	68.5	Low	156 Å²	156	121.4 Å²	121.4	68%	0.684	58%	0.584	S	S	*	*	H	α-helix	trans	-52.2	-34.3	176.7	-174.8	-106.2	0	0	0	112.3	Q507 Y508 L509	F505-Q507 PolarHBondContact O-N 3.4Å; F505-Y508 WeakPolarHBondContact O-CB 3.31Å; F505-Y508 PolarHBondContact O-N 2.98Å; F505-Y508 VanDerWaalsContact O-N 3.14Å; F505-L509 HydrophobicContact CD1-CD1 3.77Å; F505-L509 HydrophobicContact CD1-CG 4.14Å; F505-L509 HydrophobicContact CE1-CD1 3.54Å; F505-L509 HydrophobicContact CE1-CD2 4.23Å; F505-L509 HydrophobicContact CE1-CG 3.9Å; F505-L509 HydrophobicContact CZ-CD1 4.37Å; F505-L509 HydrophobicContact CZ-CD2 4.27Å; F505-L509 HydrophobicContact CZ-CG 4.31Å; F505-L509 WeakPolarHBondContact O-CG 3.33Å; F505-L509 PolarHBondContact O-N 3.43Å
506	E	77.1	Confident	67.6	Low	150 Å²	150	117.3 Å²	117.3	70%	0.701	57%	0.571	S	S	*	*	H	α-helix	trans	-56.2	-42.5	170.1	-102.1	175.8	162.6	0	0	113.5	T504 Y508 L509 D510	T504-E506 PolarHBondContact O-N 3.19Å; T504-E506 VanDerWaalsContact O-N 3.1Å; E506-Y508 VanDerWaalsContact C-N 3.28Å; E506-Y508 PolarHBondContact O-N 2.95Å; E506-L509 PolarHBondContact O-N 2.61Å; E506-D510 WeakPolarHBondContact O-CB 3.4Å; E506-D510 PolarHBondContact O-N 3.07Å
507	Q	78.8	Confident	67.4	Low	83 Å²	83	117.3 Å²	117.3	39%	0.388	56%	0.556	S	S	.	*	H	α-helix	trans	-68.6	-28.8	177.5	-68.4	179	19.1	0	0	112.4	E502 T504 F505 E511	E502-Q507 PolarHBondContact O-NE2 2.88Å; E502-Q507 PolarHBondContact O-OE1 3.44Å; T504-Q507 WeakPolarHBondContact O-CA 3.39Å; T504-Q507 WeakPolarHBondContact O-CB 3.32Å; T504-Q507 PolarHBondContact O-N 3.46Å; F505-Q507 PolarHBondContact O-N 3.4Å; Q507-E511 VanDerWaalsContact O-CB 3.29Å; Q507-E511 WeakPolarHBondContact O-CB 3.35Å; Q507-E511 WeakPolarHBondContact O-CG 3.41Å; Q507-E511 PolarHBondContact O-N 3.04Å
508	Y	74	Confident	67.6	Low	159 Å²	159	116.7 Å²	116.7	62%	0.624	55%	0.545	S	S	*	.	H	α-helix	trans	-74.4	-42.2	175.2	-163.6	-98.3	0	0	0	111.4	T504 F505 E506 D510 E511 Y512	T504-Y508 PolarHBondContact O-N 2.87Å; F505-Y508 WeakPolarHBondContact O-CB 3.31Å; F505-Y508 PolarHBondContact O-N 2.98Å; F505-Y508 VanDerWaalsContact O-N 3.14Å; E506-Y508 VanDerWaalsContact C-N 3.28Å; E506-Y508 PolarHBondContact O-N 2.95Å; Y508-D510 VanDerWaalsContact C-N 3.33Å; Y508-E511 PolarHBondContact O-N 3.33Å; Y508-Y512 PolarHBondContact O-N 3.08Å
509	L	74.8	Confident	68.2	Low	61 Å²	61	113.5 Å²	113.5	32%	0.319	54%	0.535	S	S	.	.	H	α-helix	trans	-61.7	-41.9	169.2	-69.9	178.1	0	0	0	111.3	F505 E506 Y512 Y513	F505-L509 HydrophobicContact CD1-CD1 3.77Å; F505-L509 HydrophobicContact CD1-CG 4.14Å; F505-L509 HydrophobicContact CE1-CD1 3.54Å; F505-L509 HydrophobicContact CE1-CD2 4.23Å; F505-L509 HydrophobicContact CE1-CG 3.9Å; F505-L509 HydrophobicContact CZ-CD1 4.37Å; F505-L509 HydrophobicContact CZ-CD2 4.27Å; F505-L509 HydrophobicContact CZ-CG 4.31Å; F505-L509 WeakPolarHBondContact O-CG 3.33Å; F505-L509 PolarHBondContact O-N 3.43Å; E506-L509 PolarHBondContact O-N 2.61Å; L509-Y512 CarbonylContact O-C 3.58Å; L509-Y512 WeakPolarHBondContact O-CB 3.49Å; L509-Y512 PolarHBondContact O-N 2.86Å; L509-Y513 HydrophobicContact CB-CD2 4.36Å; L509-Y513 HydrophobicContact CB-CE2 4.11Å; L509-Y513 WeakPolarHBondContact O-CD2 3.2Å; L509-Y513 PolarHBondContact O-N 3.15Å
510	D	71.6	Confident	68.6	Low	78 Å²	78	113.5 Å²	113.5	42%	0.417	53%	0.534	S	S	.	.	H	α-helix	trans	-65.6	-37.3	175.2	-115	31	0	0	0	111.9	E506 Y508 Y512 K514	E506-D510 WeakPolarHBondContact O-CB 3.4Å; E506-D510 PolarHBondContact O-N 3.07Å; Y508-D510 VanDerWaalsContact C-N 3.33Å; D510-Y512 VanDerWaalsContact C-N 3.31Å; D510-K514 WeakPolarHBondContact O-CB 3.31Å; D510-K514 WeakPolarHBondContact O-CD 3.06Å; D510-K514 WeakPolarHBondContact O-CG 3.25Å; D510-K514 PolarHBondContact O-N 2.96Å; D510-K514 WeakPolarHBondContact OD2-CE 3.28Å; D510-K514 IonicContact OD2-NZ 3.46Å; D510-K514 PolarHBondContact OD2-NZ 3.5Å
511	E	74.5	Confident	68.5	Low	77 Å²	77	112.8 Å²	112.8	36%	0.36	52%	0.523	S	S	.	.	H	α-helix	trans	-63.9	-39.4	172.9	-82.5	174.2	-173.3	0	0	110.4	K503 Q507 Y508 K514 L515	K503-E511 WeakPolarHBondContact CE-OE1 3.37Å; K503-E511 VanDerWaalsContact NZ-CD 3.3Å; K503-E511 IonicContact NZ-OE1 3.02Å; K503-E511 PolarHBondContact NZ-OE1 3.16Å; K503-E511 IonicContact NZ-OE2 3.34Å; K503-E511 PolarHBondContact NZ-OE2 3.22Å; Q507-E511 VanDerWaalsContact O-CB 3.29Å; Q507-E511 WeakPolarHBondContact O-CB 3.35Å; Q507-E511 WeakPolarHBondContact O-CG 3.41Å; Q507-E511 PolarHBondContact O-N 3.04Å; Y508-E511 PolarHBondContact O-N 3.33Å; E511-K514 PolarHBondContact O-N 2.62Å; E511-L515 WeakPolarHBondContact O-CG 3.47Å; E511-L515 PolarHBondContact O-N 2.85Å
512	Y	67.4	Low	68.3	Low	158 Å²	158	109.7 Å²	109.7	62%	0.62	51%	0.512	S	S	*	.	H	α-helix	trans	-63.5	-51.7	172.1	-179.4	-107.5	0	0	0	112	Y508 L509 D510 K514 L515	Y508-Y512 PolarHBondContact O-N 3.08Å; L509-Y512 CarbonylContact O-C 3.58Å; L509-Y512 WeakPolarHBondContact O-CB 3.49Å; L509-Y512 PolarHBondContact O-N 2.86Å; D510-Y512 VanDerWaalsContact C-N 3.31Å; Y512-K514 PolarHBondContact O-N 3.12Å; Y512-L515 WeakPolarHBondContact O-CB 3.28Å; Y512-L515 PolarHBondContact O-N 3.35Å; Y512-L515 VanDerWaalsContact O-N 3.13Å
513	Y	65.9	Low	67.9	Low	142 Å²	142	108.8 Å²	108.8	56%	0.557	51%	0.512	S	S	*	.	H	α-helix	trans	-66.2	-21.4	175.8	-67.1	-57.3	0	0	0	113.9	L509 L515	L509-Y513 HydrophobicContact CB-CD2 4.36Å; L509-Y513 HydrophobicContact CB-CE2 4.11Å; L509-Y513 WeakPolarHBondContact O-CD2 3.2Å; L509-Y513 PolarHBondContact O-N 3.15Å; Y513-L515 VanDerWaalsContact C-N 3.3Å
514	K	68.6	Low	68.1	Low	95 Å²	95	109.9 Å²	109.9	41%	0.413	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-14.3	176.1	-81.6	162.9	-163.4	155.5	0	112.9	D510 E511 Y512 D516 R527	D510-K514 WeakPolarHBondContact O-CB 3.31Å; D510-K514 WeakPolarHBondContact O-CD 3.06Å; D510-K514 WeakPolarHBondContact O-CG 3.25Å; D510-K514 PolarHBondContact O-N 2.96Å; D510-K514 WeakPolarHBondContact OD2-CE 3.28Å; D510-K514 IonicContact OD2-NZ 3.46Å; D510-K514 PolarHBondContact OD2-NZ 3.5Å; E511-K514 PolarHBondContact O-N 2.62Å; Y512-K514 PolarHBondContact O-N 3.12Å; K514-D516 VanDerWaalsContact C-N 3.33Å; K514-R527 VanDerWaalsContact O-CZ 3.29Å; K514-R527 PolarHBondContact O-NE 2.89Å; K514-R527 VanDerWaalsContact O-NE 3.09Å; K514-R527 PolarHBondContact O-NH2 3.14Å
515	L	65.8	Low	68	Low	107 Å²	107	109.9 Å²	109.9	56%	0.56	52%	0.523	S	S	*	.	S	Bend	trans	-76.5	-23.6	178.6	-71.1	164.8	0	0	0	112.3	E511 Y512 Y513 Y517	E511-L515 WeakPolarHBondContact O-CG 3.47Å; E511-L515 PolarHBondContact O-N 2.85Å; Y512-L515 WeakPolarHBondContact O-CB 3.28Å; Y512-L515 PolarHBondContact O-N 3.35Å; Y512-L515 VanDerWaalsContact O-N 3.13Å; Y513-L515 VanDerWaalsContact C-N 3.3Å; L515-Y517 WeakPolarHBondContact O-CD1 3.2Å
516	D	54	Low	68.2	Low	106 Å²	106	104.6 Å²	104.6	57%	0.567	51%	0.505	S	S	*	.			trans	-64.7	138.3	170.3	-59.3	-28	0	0	0	109.9	K514 R527	K514-D516 VanDerWaalsContact C-N 3.33Å; D516-R527 WeakPolarHBondContact O-CD 3.4Å; D516-R527 PolarHBondContact O-NE 3.04Å
517	Y	60.9	Low	67.9	Low	125 Å²	125	101.5 Å²	101.5	49%	0.49	49%	0.487	S	S	.	.			trans	-127.3	131.1	172.8	44	-95.2	0	0	0	107.8	L515 I520 P525	L515-Y517 WeakPolarHBondContact O-CD1 3.2Å; Y517-I520 HydrophobicContact CD2-CD1 4.45Å; Y517-I520 HydrophobicContact CD2-CG1 3.92Å; Y517-I520 HydrophobicContact CE2-CD1 3.81Å; Y517-I520 HydrophobicContact CE2-CG1 3.79Å; Y517-P525 HydrophobicContact CD1-CB 3.38Å; Y517-P525 HydrophobicContact CD1-CG 4.27Å; Y517-P525 HydrophobicContact CD2-CB 3.65Å; Y517-P525 HydrophobicContact CE1-CB 3.84Å; Y517-P525 HydrophobicContact CE1-CG 4.28Å; Y517-P525 HydrophobicContact CE2-CB 4.09Å; Y517-P525 HydrophobicContact CG-CB 3.27Å; Y517-P525 HydrophobicContact CG-CG 4.47Å
518	E	66.1	Low	67.4	Low	109 Å²	109	103.9 Å²	103.9	51%	0.509	50%	0.496	S	S	.	.	S	Bend	trans	-81.8	-21.4	-170.9	-65.5	169.8	-114.6	0	0	111.8	C526 R527 F528	E518-C526 PolarHBondContact N-O 2.76Å; E518-C526 VanDerWaalsContact N-O 3.09Å; E518-R527 WeakPolarHBondContact OE1-CG 3.22Å; E518-F528 HydrophobicContact CB-CD2 4.28Å; E518-F528 PolarHBondContact OE1-N 2.89Å; E518-F528 WeakPolarHBondContact OE2-CD2 2.97Å
519	D	66.9	Low	67.4	Low	90 Å²	90	106.9 Å²	106.9	48%	0.481	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	155.9	-179.6	-165	0.9	0	0	0	111.6	C526	D519-C526 PolarHBondContact N-O 2.99Å; D519-C526 CarbonylContact O-C 3.6Å; D519-C526 WeakPolarHBondContact O-CA 3.43Å; D519-C526 WeakPolarHBondContact O-CB 3.42Å; D519-C526 PolarHBondContact O-N 3.48Å; D519-C526 VanDerWaalsContact O-O 3.08Å
520	I	73.4	Confident	67.5	Low	90 Å²	90	113.3 Å²	113.3	46%	0.462	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	96.7	173.5	-54.5	172	0	0	0	108.4	Y517	Y517-I520 HydrophobicContact CD2-CD1 4.45Å; Y517-I520 HydrophobicContact CD2-CG1 3.92Å; Y517-I520 HydrophobicContact CE2-CD1 3.81Å; Y517-I520 HydrophobicContact CE2-CG1 3.79Å
521	I	63.7	Low	67.8	Low	97 Å²	97	113.8 Å²	113.8	50%	0.497	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.9	176.3	-54.9	172.8	0	0	0	108.2	D523 L524	I521-D523 PolarHBondContact O-N 2.84Å; I521-L524 PolarHBondContact N-O 2.97Å; I521-L524 PolarHBondContact O-N 3.23Å
522	D	56.9	Low	68.1	Low	115 Å²	115	118.9 Å²	118.9	62%	0.615	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	55	178.8	-81.2	-26.7	0	0	0	113	K326 L524	K326-D522 IonicContact NZ-OD1 2.83Å; K326-D522 PolarHBondContact NZ-OD1 2.84Å; D522-L524 PolarHBondContact O-N 3.43Å
523	D	56.6	Low	68.9	Low	115 Å²	115	115.8 Å²	115.8	62%	0.615	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	4	175.4	-53.7	-43.1	0	0	0	116.2	I521	I521-D523 PolarHBondContact O-N 2.84Å
524	L	75.8	Confident	69.9	Low	123 Å²	123	111.2 Å²	111.2	64%	0.644	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	115.7	169.6	-70.9	172.4	0	0	0	109.5	I521 D522 C526	I521-L524 PolarHBondContact N-O 2.97Å; I521-L524 PolarHBondContact O-N 3.23Å; D522-L524 PolarHBondContact O-N 3.43Å; L524-C526 PolarHBondContact O-N 3.31Å; L524-C526 VanDerWaalsContact O-N 3.11Å; L524-C526 PolarHBondContact O-SG 2.79Å
525	P	73.5	Confident	70.8	Confident	71 Å²	71	112 Å²	112	46%	0.461	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	117.2	172.5	-15.2	26.9	0	0	0	110	Y517	Y517-P525 HydrophobicContact CD1-CB 3.38Å; Y517-P525 HydrophobicContact CD1-CG 4.27Å; Y517-P525 HydrophobicContact CD2-CB 3.65Å; Y517-P525 HydrophobicContact CE1-CB 3.84Å; Y517-P525 HydrophobicContact CE1-CG 4.28Å; Y517-P525 HydrophobicContact CE2-CB 4.09Å; Y517-P525 HydrophobicContact CG-CB 3.27Å; Y517-P525 HydrophobicContact CG-CG 4.47Å
526	C	65.3	Low	71.8	Confident	45 Å²	45	108.6 Å²	108.6	30%	0.304	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	114.9	-175.9	-70.9	0	0	0	0	109.6	E518 D519 L524	E518-C526 PolarHBondContact N-O 2.76Å; E518-C526 VanDerWaalsContact N-O 3.09Å; D519-C526 PolarHBondContact N-O 2.99Å; D519-C526 CarbonylContact O-C 3.6Å; D519-C526 WeakPolarHBondContact O-CA 3.43Å; D519-C526 WeakPolarHBondContact O-CB 3.42Å; D519-C526 PolarHBondContact O-N 3.48Å; D519-C526 VanDerWaalsContact O-O 3.08Å; L524-C526 PolarHBondContact O-N 3.31Å; L524-C526 VanDerWaalsContact O-N 3.11Å; L524-C526 PolarHBondContact O-SG 2.79Å
527	R	70.9	Confident	73.4	Confident	86 Å²	86	109.1 Å²	109.1	33%	0.325	53%	0.532	S	S	.	.			trans	-101.6	145.1	164.6	-176.9	160.8	40.1	81.8	4.1	109.7	K514 D516 E518 R529	K514-R527 VanDerWaalsContact O-CZ 3.29Å; K514-R527 PolarHBondContact O-NE 2.89Å; K514-R527 VanDerWaalsContact O-NE 3.09Å; K514-R527 PolarHBondContact O-NH2 3.14Å; D516-R527 WeakPolarHBondContact O-CD 3.4Å; D516-R527 PolarHBondContact O-NE 3.04Å; E518-R527 WeakPolarHBondContact OE1-CG 3.22Å; R527-R529 PolarHBondContact O-N 3.32Å
528	F	69.1	Low	74.6	Confident	133 Å²	133	105.4 Å²	105.4	58%	0.583	52%	0.518	S	S	*	.			trans	-63.6	107.8	168.6	-70.4	-86.1	0	0	0	108.3	E518 Y530	E518-F528 HydrophobicContact CB-CD2 4.28Å; E518-F528 PolarHBondContact OE1-N 2.89Å; E518-F528 WeakPolarHBondContact OE2-CD2 2.97Å; F528-Y530 HydrophobicContact CB-CE2 4.33Å; F528-Y530 PolarHBondContact O-N 2.78Å
529	R	72.8	Confident	75.5	Confident	222 Å²	222	101.1 Å²	101.1	84%	0.838	50%	0.503	S	S	*	.			trans	-76	92.9	178.5	-67.4	-171.6	179.6	123.3	1.8	108.8	R527 R531	R527-R529 PolarHBondContact O-N 3.32Å; R529-R531 PolarHBondContact O-N 3.29Å
530	Y	77.9	Confident	76.6	Confident	195 Å²	195	97.6 Å²	97.6	77%	0.765	48%	0.484	S	S	*	.			trans	-65.2	125.8	164.4	-59.9	-71.7	0	0	0	108.8	F528	F528-Y530 HydrophobicContact CB-CE2 4.33Å; F528-Y530 PolarHBondContact O-N 2.78Å
531	R	76.6	Confident	77.3	Confident	88 Å²	88	96.6 Å²	96.6	33%	0.332	48%	0.483	S	S	.	.			trans	-99.6	124.4	173.1	174.3	173.4	157.8	70.7	14.7	107	R529 V533 R566 E568 E571	R529-R531 PolarHBondContact O-N 3.29Å; R531-V533 PolarHBondContact O-N 2.88Å; R531-R566 PolarHBondContact NE-O 3.14Å; R531-R566 PolarHBondContact NH2-O 3.37Å; R531-E568 IonicContact CZ-OE1 2.77Å; R531-E568 IonicContact NH1-OE1 3.04Å; R531-E568 PolarHBondContact NH1-OE1 2.94Å; R531-E571 IonicContact CZ-OE1 3.85Å; R531-E571 IonicContact NE-OE1 3.58Å; R531-E571 PolarHBondContact NE-OE1 2.85Å; R531-E571 VanDerWaalsContact NH2-CD 3.33Å; R531-E571 IonicContact NH2-OE1 3.79Å; R531-E571 PolarHBondContact NH2-OE1 2.79Å; R531-E571 IonicContact NH2-OE2 2.69Å; R531-E571 PolarHBondContact NH2-OE2 3.47Å
532	Q	81.8	Confident	78.5	Confident	185 Å²	185	96.7 Å²	96.7	86%	0.864	49%	0.488	S	S	*	.			trans	-62.1	112.2	169.2	-166.2	177	15.1	0	0	107.9
533	V	84.8	Confident	80	Confident	92 Å²	92	96.6 Å²	96.6	56%	0.558	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-91	140.4	177.7	-177.9	0	0	0	0	108.2	R531	R531-V533 PolarHBondContact O-N 2.88Å
534	V	85.6	Confident	81.4	Confident	46 Å²	46	92 Å²	92	28%	0.279	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-68.3	126	177	-167.4	0	0	0	0	109.6	N536 E571 M572 L575	V534-N536 PolarHBondContact O-N 3.46Å; V534-E571 HydrophobicContact CG2-CB 4.46Å; V534-E571 PolarHBondContact N-OE2 2.86Å; V534-M572 HydrophobicContact CG1-SD 4.17Å; V534-M572 HydrophobicContact CG2-SD 4.39Å; V534-L575 HydrophobicContact CB-CD1 3.9Å; V534-L575 HydrophobicContact CG1-CD1 3.31Å
535	P	88.7	Confident	82.1	Confident	111 Å²	111	89.7 Å²	89.7	72%	0.721	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-59.3	131.7	179.3	24	-34	0	0	0	110.5	L575	P535-L575 WeakPolarHBondContact O-CD2 3.28Å
536	N	86.1	Confident	82.8	Confident	36 Å²	36	93.4 Å²	93.4	19%	0.193	47%	0.465	C	S	.	.			trans	-144	114.9	-173.3	-175.1	6.5	0	0	0	112.7	V534 F538 L575	V534-N536 PolarHBondContact O-N 3.46Å; N536-F538 HydrophobicContact CB-CZ 4.5Å; N536-F538 VanDerWaalsContact ND2-CE1 3.28Å; N536-F538 WeakPolarHBondContact ND2-CE1 3.46Å; N536-F538 WeakPolarHBondContact O-CD2 3.49Å; N536-F538 PolarHBondContact O-N 3.3Å; N536-F538 PolarHBondContact OD1-N 2.87Å; N536-L575 HydrophobicContact CB-CD2 3.58Å; N536-L575 HydrophobicContact CB-CG 4.08Å; N536-L575 VanDerWaalsContact CG-CD2 3.41Å; N536-L575 VanDerWaalsContact OD1-CD2 3.29Å; N536-L575 WeakPolarHBondContact OD1-CD2 3.37Å
537	D	87.6	Confident	83.9	Confident	118 Å²	118	95.3 Å²	95.3	63%	0.631	48%	0.475	S	S	*	.			trans	-82.4	2.4	179.7	-43.2	-44.3	0	0	0	113.1	G539 L540	D537-G539 PolarHBondContact O-N 3.35Å; D537-L540 PolarHBondContact O-N 3.21Å
538	F	86.3	Confident	84.7	Confident	46 Å²	46	91.7 Å²	91.7	20%	0.202	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	19	-176	-62.5	-77.5	0	0	0	115.1	N536 L540 W556 C557 T562 Y578	N536-F538 HydrophobicContact CB-CZ 4.5Å; N536-F538 VanDerWaalsContact ND2-CE1 3.28Å; N536-F538 WeakPolarHBondContact ND2-CE1 3.46Å; N536-F538 WeakPolarHBondContact O-CD2 3.49Å; N536-F538 PolarHBondContact O-N 3.3Å; N536-F538 PolarHBondContact OD1-N 2.87Å; F538-L540 VanDerWaalsContact C-N 3.31Å; F538-W556 PolarHBondContact O-NE1 2.86Å; F538-C557 HydrophobicContact CD1-CB 4.38Å; F538-C557 VanDerWaalsContact CD1-SG 3.51Å; F538-C557 HydrophobicContact CG-CB 4.48Å; F538-T562 HydrophobicContact CD2-CG2 4.37Å; F538-T562 HydrophobicContact CE1-CG2 4.17Å; F538-T562 HydrophobicContact CE2-CG2 3.66Å; F538-T562 HydrophobicContact CZ-CG2 3.56Å; F538-Y578 HydrophobicContact CB-CD1 4.34Å; F538-Y578 HydrophobicContact CB-CG 4.37Å; F538-Y578 HydrophobicContact CD1-CD1 4.38Å; F538-Y578 AromaticContact CD1-CD2 3.64Å; F538-Y578 HydrophobicContact CD1-CD2 3.64Å; F538-Y578 HydrophobicContact CD1-CE1 4.38Å; F538-Y578 AromaticContact CD1-CE2 3.63Å; F538-Y578 HydrophobicContact CD1-CE2 3.63Å; F538-Y578 HydrophobicContact CD1-CG 4.06Å; F538-Y578 HydrophobicContact CE1-CD2 4.26Å; F538-Y578 HydrophobicContact CE1-CE2 4.03Å; F538-Y578 WeakPolarHBondContact O-CD1 3.27Å
539	G	85.7	Confident	85.8	Confident	19 Å²	19	89.9 Å²	89.9	20%	0.196	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	15	-179	0	0	0	0	0	114.4	D537 G582 K588	D537-G539 PolarHBondContact O-N 3.35Å; G539-G582 WeakPolarHBondContact O-CA 3.48Å; G539-K588 WeakPolarHBondContact O-CE 3.39Å; G539-K588 PolarHBondContact O-NZ 3.31Å
540	L	88.6	Confident	86.5	Confident	16 Å²	16	85 Å²	85	8%	0.084	45%	0.45	C	S	.	.			trans	-105.3	149.8	174.1	-63.1	179.9	0	0	0	110.1	D537 F538 E544 I545 L553 W556 L592	D537-L540 PolarHBondContact O-N 3.21Å; F538-L540 VanDerWaalsContact C-N 3.31Å; L540-E544 WeakPolarHBondContact CA-OE2 3.29Å; L540-I545 HydrophobicContact CB-CD1 4Å; L540-I545 HydrophobicContact CB-CG1 3.76Å; L540-I545 HydrophobicContact CD1-CG1 4.02Å; L540-L553 HydrophobicContact CD1-CD2 3.61Å; L540-W556 HydrophobicContact CD1-CG 4.33Å; L540-W556 HydrophobicContact CD2-CD2 4.4Å; L540-W556 HydrophobicContact CD2-CG 4.35Å; L540-L592 HydrophobicContact CD2-CD1 3.66Å
541	T	89.4	Confident	87.1	Confident	70 Å²	70	83.4 Å²	83.4	43%	0.429	45%	0.45	S	S	.	.			trans	-85.3	159.5	169.6	60.5	0	0	0	0	110.2	D543 E544 I545	T541-D543 PolarHBondContact O-N 3.49Å; T541-E544 PolarHBondContact N-OE2 3.4Å; T541-E544 VanDerWaalsContact N-OE2 3.07Å; T541-E544 PolarHBondContact O-N 3.01Å; T541-E544 WeakPolarHBondContact OG1-CB 3.23Å; T541-E544 WeakPolarHBondContact OG1-CG 3.24Å; T541-E544 PolarHBondContact OG1-N 3.12Å; T541-I545 WeakPolarHBondContact O-CG1 3.49Å; T541-I545 PolarHBondContact O-N 3.32Å
542	T	88	Confident	87.7	Confident	99 Å²	99	80.1 Å²	80.1	61%	0.607	44%	0.438	S	S	*	.	H	α-helix	trans	-55.6	-41.2	177	46.7	0	0	0	0	111.8	I545 L546	T542-I545 PolarHBondContact O-N 3.34Å; T542-L546 WeakPolarHBondContact O-CG 3.26Å; T542-L546 PolarHBondContact O-N 3.02Å
543	D	88.6	Confident	88.1	Confident	112 Å²	112	72.7 Å²	72.7	60%	0.599	41%	0.405	S	S	*	.	H	α-helix	trans	-69.5	-38.8	-178.3	-52.8	-10.6	0	0	0	111.1	T541 I545 L546 T547	T541-D543 PolarHBondContact O-N 3.49Å; D543-I545 VanDerWaalsContact C-N 3.31Å; D543-I545 PolarHBondContact O-N 3.04Å; D543-L546 PolarHBondContact O-N 2.96Å; D543-T547 WeakPolarHBondContact O-CB 3.3Å; D543-T547 VanDerWaalsContact O-CG2 3.29Å; D543-T547 WeakPolarHBondContact O-CG2 3.21Å; D543-T547 PolarHBondContact O-N 2.64Å; D543-T547 PolarHBondContact O-OG1 3.14Å
544	E	86.6	Confident	88.4	Confident	19 Å²	19	71.4 Å²	71.4	9%	0.089	39%	0.394	C	S	.	.	H	α-helix	trans	-64.2	-34.4	173.2	-76.5	170.9	171.4	0	0	112	L540 T541 A548 K588 L592 V595 Y596	L540-E544 WeakPolarHBondContact CA-OE2 3.29Å; T541-E544 PolarHBondContact N-OE2 3.4Å; T541-E544 VanDerWaalsContact N-OE2 3.07Å; T541-E544 PolarHBondContact O-N 3.01Å; T541-E544 WeakPolarHBondContact OG1-CB 3.23Å; T541-E544 WeakPolarHBondContact OG1-CG 3.24Å; T541-E544 PolarHBondContact OG1-N 3.12Å; E544-A548 WeakPolarHBondContact O-CB 3.48Å; E544-A548 PolarHBondContact O-N 2.83Å; E544-A548 VanDerWaalsContact O-N 3.15Å; E544-K588 IonicContact OE1-NZ 2.69Å; E544-K588 PolarHBondContact OE1-NZ 2.78Å; E544-K588 VanDerWaalsContact OE1-NZ 3.14Å; E544-K588 IonicContact OE2-NZ 3.39Å; E544-K588 PolarHBondContact OE2-NZ 2.87Å; E544-L592 HydrophobicContact CB-CD1 4.44Å; E544-V595 HydrophobicContact CG-CG1 4.48Å; E544-Y596 PolarHBondContact OE1-OH 2.74Å
545	I	89.5	Confident	88.5	Confident	75 Å²	75	78.3 Å²	78.3	39%	0.385	42%	0.416	S	S	.	.	H	α-helix	trans	-72.3	-41	179	-66.9	164.7	0	0	0	110.9	L540 T541 T542 D543 L553	L540-I545 HydrophobicContact CB-CD1 4Å; L540-I545 HydrophobicContact CB-CG1 3.76Å; L540-I545 HydrophobicContact CD1-CG1 4.02Å; T541-I545 WeakPolarHBondContact O-CG1 3.49Å; T541-I545 PolarHBondContact O-N 3.32Å; T542-I545 PolarHBondContact O-N 3.34Å; D543-I545 VanDerWaalsContact C-N 3.31Å; D543-I545 PolarHBondContact O-N 3.04Å; I545-L553 HydrophobicContact CG2-CD1 4.39Å
546	L	88.7	Confident	88.5	Confident	148 Å²	148	73.9 Å²	73.9	78%	0.775	38%	0.384	S	S	*	.	H	α-helix	trans	-74.1	-30.5	-178.5	-69.4	173.5	0	0	0	112.9	T542 D543	T542-L546 WeakPolarHBondContact O-CG 3.26Å; T542-L546 PolarHBondContact O-N 3.02Å; D543-L546 PolarHBondContact O-N 2.96Å
547	T	88.8	Confident	88.6	Confident	86 Å²	86	72.9 Å²	72.9	53%	0.528	38%	0.38	S	S	.	.	H	α-helix	trans	-88.7	-23.6	-178.8	53.4	0	0	0	0	113.6	D543 V595	D543-T547 WeakPolarHBondContact O-CB 3.3Å; D543-T547 VanDerWaalsContact O-CG2 3.29Å; D543-T547 WeakPolarHBondContact O-CG2 3.21Å; D543-T547 PolarHBondContact O-N 2.64Å; D543-T547 PolarHBondContact O-OG1 3.14Å; T547-V595 WeakPolarHBondContact OG1-CG2 3.32Å
548	A	88	Confident	88.7	Confident	9 Å²	9	69.8 Å²	69.8	7%	0.074	37%	0.368	C	S	.	.	S	Bend	trans	-79.2	149.9	-176.9	0	0	0	0	0	113.7	E544 L553 L592 V595	E544-A548 WeakPolarHBondContact O-CB 3.48Å; E544-A548 PolarHBondContact O-N 2.83Å; E544-A548 VanDerWaalsContact O-N 3.15Å; A548-L553 HydrophobicContact CB-CD1 4.33Å; A548-L553 HydrophobicContact CB-CD2 3.86Å; A548-L553 HydrophobicContact CB-CG 3.89Å; A548-L592 HydrophobicContact CB-CD2 3.85Å; A548-V595 HydrophobicContact CB-CG2 3.67Å
549	N	91.1	Very high	88.6	Confident	95 Å²	95	72.9 Å²	72.9	51%	0.508	39%	0.386	S	S	.	.			trans	-70	141	171	-73.2	-41.4	0	0	0	112.5	Q551 E552 L553 S594	N549-Q551 PolarHBondContact O-N 3.26Å; N549-E552 HydrophobicContact CB-CG 4.27Å; N549-E552 WeakPolarHBondContact O-CA 3.47Å; N549-E552 WeakPolarHBondContact O-CB 3.46Å; N549-E552 PolarHBondContact O-N 2.92Å; N549-L553 PolarHBondContact O-N 3.1Å; N549-S594 PolarHBondContact N-OG 2.98Å
550	D	89.2	Confident	88.7	Confident	120 Å²	120	81 Å²	81	64%	0.642	41%	0.411	S	S	*	.	H	α-helix	trans	-54	-32.6	178.3	-71.4	-12.5	0	0	0	114.4	N554	D550-N554 VanDerWaalsContact O-CB 3.28Å; D550-N554 WeakPolarHBondContact O-CB 3.48Å; D550-N554 PolarHBondContact O-N 3.02Å; D550-N554 PolarHBondContact O-ND2 3.3Å
551	Q	89.8	Confident	88.6	Confident	161 Å²	161	84.9 Å²	84.9	75%	0.752	42%	0.424	S	S	*	.	H	α-helix	trans	-69.4	-34.8	177.2	-63.6	-172.2	4.5	0	0	112	N549 R555	N549-Q551 PolarHBondContact O-N 3.26Å; Q551-R555 VanDerWaalsContact O-CG 3.23Å; Q551-R555 WeakPolarHBondContact O-CG 3.41Å; Q551-R555 PolarHBondContact O-N 3.08Å
552	E	89.8	Confident	88.3	Confident	19 Å²	19	84.4 Å²	84.4	9%	0.089	42%	0.421	C	S	.	.	H	α-helix	trans	-75.2	-41.7	178	-64.4	-176.4	175	0	0	110.5	N549 N554 R555 W556 V591 L592 S593 S594	N549-E552 HydrophobicContact CB-CG 4.27Å; N549-E552 WeakPolarHBondContact O-CA 3.47Å; N549-E552 WeakPolarHBondContact O-CB 3.46Å; N549-E552 PolarHBondContact O-N 2.92Å; E552-N554 PolarHBondContact O-N 3.07Å; E552-R555 WeakPolarHBondContact O-CB 3.45Å; E552-R555 PolarHBondContact O-N 3.35Å; E552-R555 VanDerWaalsContact O-N 3.1Å; E552-W556 PolarHBondContact O-N 3.09Å; E552-V591 WeakPolarHBondContact CB-O 3.29Å; E552-V591 WeakPolarHBondContact CG-O 3.07Å; E552-L592 HydrophobicContact CB-CD2 4.06Å; E552-L592 VanDerWaalsContact OE2-CA 3.31Å; E552-L592 WeakPolarHBondContact OE2-CA 3.37Å; E552-S593 PolarHBondContact OE1-OG 3.42Å; E552-S593 PolarHBondContact OE2-N 3.33Å; E552-S594 PolarHBondContact OE1-N 3.43Å; E552-S594 VanDerWaalsContact OE1-N 3.14Å; E552-S594 WeakPolarHBondContact OE2-CB 3.32Å; E552-S594 PolarHBondContact OE2-N 3.5Å; E552-S594 PolarHBondContact OE2-OG 2.98Å
553	L	88.9	Confident	87.9	Confident	30 Å²	30	84.6 Å²	84.6	16%	0.157	43%	0.425	C	S	.	.	H	α-helix	trans	-59.1	-45.5	172.2	-67.6	176.5	0	0	0	111.5	L540 I545 A548 N549 R555 W556 C557 L592	L540-L553 HydrophobicContact CD1-CD2 3.61Å; I545-L553 HydrophobicContact CG2-CD1 4.39Å; A548-L553 HydrophobicContact CB-CD1 4.33Å; A548-L553 HydrophobicContact CB-CD2 3.86Å; A548-L553 HydrophobicContact CB-CG 3.89Å; N549-L553 PolarHBondContact O-N 3.1Å; L553-R555 PolarHBondContact O-N 3.48Å; L553-W556 PolarHBondContact O-N 3.24Å; L553-W556 VanDerWaalsContact O-N 3.07Å; L553-C557 CarbonylContact O-C 3.53Å; L553-C557 PolarHBondContact O-N 3.25Å; L553-L592 HydrophobicContact CD2-CD2 4.16Å
554	N	90.9	Very high	87.7	Confident	64 Å²	64	83.6 Å²	83.6	34%	0.342	42%	0.418	S	S	.	.	H	α-helix	trans	-62.6	-27.8	175.9	-86.3	-57.4	0	0	0	113.8	D550 E552 C557 S558 L559	D550-N554 VanDerWaalsContact O-CB 3.28Å; D550-N554 WeakPolarHBondContact O-CB 3.48Å; D550-N554 PolarHBondContact O-N 3.02Å; D550-N554 PolarHBondContact O-ND2 3.3Å; E552-N554 PolarHBondContact O-N 3.07Å; N554-C557 WeakPolarHBondContact CA-O 3.24Å; N554-C557 CarbonylContact O-C 3.55Å; N554-S558 WeakPolarHBondContact O-CA 3.44Å; N554-S558 PolarHBondContact O-N 3.01Å; N554-L559 WeakPolarHBondContact OD1-CG 3.25Å; N554-L559 PolarHBondContact OD1-N 3.21Å
555	R	88.8	Confident	87.5	Confident	192 Å²	192	92 Å²	92	73%	0.725	46%	0.455	S	S	*	.	H	α-helix	trans	-76.3	-33.9	173.9	-70.7	168.7	88.8	179.3	5.1	111.8	Q551 E552 L553 V591	Q551-R555 VanDerWaalsContact O-CG 3.23Å; Q551-R555 WeakPolarHBondContact O-CG 3.41Å; Q551-R555 PolarHBondContact O-N 3.08Å; E552-R555 WeakPolarHBondContact O-CB 3.45Å; E552-R555 PolarHBondContact O-N 3.35Å; E552-R555 VanDerWaalsContact O-N 3.1Å; L553-R555 PolarHBondContact O-N 3.48Å; R555-V591 HydrophobicContact CB-CG1 4.04Å
556	W	87.9	Confident	87.2	Confident	18 Å²	18	90.7 Å²	90.7	7%	0.068	45%	0.445	C	S	.	.	H	α-helix	trans	-72.1	-51.8	175.3	-172.8	-102.6	0	0	0	112.1	F538 L540 E552 L553 K581 K587 K588 V591	F538-W556 PolarHBondContact O-NE1 2.86Å; L540-W556 HydrophobicContact CD1-CG 4.33Å; L540-W556 HydrophobicContact CD2-CD2 4.4Å; L540-W556 HydrophobicContact CD2-CG 4.35Å; E552-W556 PolarHBondContact O-N 3.09Å; L553-W556 PolarHBondContact O-N 3.24Å; L553-W556 VanDerWaalsContact O-N 3.07Å; W556-K581 HydrophobicContact CH2-CB 4.01Å; W556-K581 WeakPolarHBondContact CH2-O 3.23Å; W556-K581 HydrophobicContact CZ2-CB 3.79Å; W556-K587 HydrophobicContact CH2-CB 4.33Å; W556-K587 HydrophobicContact CZ3-CB 3.98Å; W556-K588 HydrophobicContact CH2-CG 3.7Å; W556-K588 HydrophobicContact CZ2-CG 4.16Å; W556-K588 HydrophobicContact CZ3-CG 4.22Å; W556-V591 HydrophobicContact CB-CG1 3.91Å; W556-V591 HydrophobicContact CE3-CB 3.93Å; W556-V591 HydrophobicContact CE3-CG1 4Å; W556-V591 HydrophobicContact CE3-CG2 4.06Å; W556-V591 HydrophobicContact CZ3-CB 4.47Å; W556-V591 HydrophobicContact CZ3-CG2 4.4Å
557	C	88.6	Confident	87.3	Confident	14 Å²	14	86.3 Å²	86.3	10%	0.095	43%	0.427	C	S	.	.	S	Bend	trans	-142.4	118.1	173.7	-167.4	0	0	0	0	109.1	F538 L553 N554 Y578	F538-C557 HydrophobicContact CD1-CB 4.38Å; F538-C557 VanDerWaalsContact CD1-SG 3.51Å; F538-C557 HydrophobicContact CG-CB 4.48Å; L553-C557 CarbonylContact O-C 3.53Å; L553-C557 PolarHBondContact O-N 3.25Å; N554-C557 WeakPolarHBondContact CA-O 3.24Å; N554-C557 CarbonylContact O-C 3.55Å; C557-Y578 HydrophobicContact CB-CE1 4.36Å; C557-Y578 PolarHBondContact SG-OH 3.07Å
558	S	89.3	Confident	87.2	Confident	54 Å²	54	88 Å²	88	38%	0.378	43%	0.429	S	S	.	.			trans	-70.8	145.6	179	59.5	0	0	0	0	111.4	N554 R560 R561 T562	N554-S558 WeakPolarHBondContact O-CA 3.44Å; N554-S558 PolarHBondContact O-N 3.01Å; S558-R560 PolarHBondContact O-N 2.95Å; S558-R560 VanDerWaalsContact O-N 3.16Å; S558-R561 WeakPolarHBondContact O-CA 3.47Å; S558-R561 WeakPolarHBondContact O-CB 3.41Å; S558-R561 PolarHBondContact O-N 2.89Å; S558-T562 PolarHBondContact O-N 2.77Å
559	L	85.7	Confident	87.3	Confident	111 Å²	111	98 Å²	98	58%	0.581	47%	0.465	S	S	*	.	H	α-helix	trans	-54.2	-36.1	174.9	-72.6	167.3	0	0	0	113	N554 R561 T562 C563	N554-L559 WeakPolarHBondContact OD1-CG 3.25Å; N554-L559 PolarHBondContact OD1-N 3.21Å; L559-R561 PolarHBondContact O-N 3.42Å; L559-T562 PolarHBondContact O-N 2.76Å; L559-T562 VanDerWaalsContact O-N 3.12Å; L559-T562 PolarHBondContact O-OG1 2.96Å; L559-C563 PolarHBondContact O-N 3.39Å; L559-C563 VanDerWaalsContact O-N 3.08Å; L559-C563 PolarHBondContact O-SG 3.2Å
560	R	87.8	Confident	87.2	Confident	190 Å²	190	98.3 Å²	98.3	72%	0.717	46%	0.463	S	S	*	.	H	α-helix	trans	-61.3	-30.4	173.7	-176.2	174.6	176.5	-177.3	3.8	112.3	S558 T562 M564	S558-R560 PolarHBondContact O-N 2.95Å; S558-R560 VanDerWaalsContact O-N 3.16Å; R560-T562 VanDerWaalsContact C-N 3.34Å; R560-M564 HydrophobicContact CG-CG 4.08Å; R560-M564 HydrophobicContact CG-SD 3.55Å; R560-M564 VanDerWaalsContact CG-SD 3.55Å; R560-M564 WeakPolarHBondContact O-CB 3.38Å; R560-M564 WeakPolarHBondContact O-CG 3.1Å
561	R	85.1	Confident	87.1	Confident	96 Å²	96	93.7 Å²	93.7	36%	0.362	44%	0.437	S	S	.	.	H	α-helix	trans	-70.5	-32.9	178.3	-169.6	92.6	-177.2	-169.9	1.5	111.1	S558 L559 R566 D574	S558-R561 WeakPolarHBondContact O-CA 3.47Å; S558-R561 WeakPolarHBondContact O-CB 3.41Å; S558-R561 PolarHBondContact O-N 2.89Å; L559-R561 PolarHBondContact O-N 3.42Å; R561-R566 VanDerWaalsContact CA-NH2 3.32Å; R561-R566 VanDerWaalsContact O-CZ 3.26Å; R561-R566 PolarHBondContact O-NH1 3.1Å; R561-R566 PolarHBondContact O-NH2 3.48Å; R561-D574 IonicContact CZ-OD1 2.73Å; R561-D574 IonicContact NE-OD1 3.76Å; R561-D574 IonicContact NE-OD2 2.9Å; R561-D574 IonicContact NH2-OD1 3.77Å; R561-D574 PolarHBondContact NH2-OD1 3.13Å; R561-D574 IonicContact NH2-OD2 2.61Å
562	T	82.4	Confident	87.1	Confident	61 Å²	61	90.4 Å²	90.4	37%	0.374	42%	0.423	S	S	.	.	H	α-helix	trans	-84.1	-39.6	-176.6	62.6	0	0	0	0	112.5	F538 S558 L559 R560	F538-T562 HydrophobicContact CD2-CG2 4.37Å; F538-T562 HydrophobicContact CE1-CG2 4.17Å; F538-T562 HydrophobicContact CE2-CG2 3.66Å; F538-T562 HydrophobicContact CZ-CG2 3.56Å; S558-T562 PolarHBondContact O-N 2.77Å; L559-T562 PolarHBondContact O-N 2.76Å; L559-T562 VanDerWaalsContact O-N 3.12Å; L559-T562 PolarHBondContact O-OG1 2.96Å; R560-T562 VanDerWaalsContact C-N 3.34Å
563	C	80.1	Confident	87.1	Confident	103 Å²	103	92.2 Å²	92.2	70%	0.696	44%	0.438	S	S	*	.	H	α-helix	trans	-86.4	-8.2	-176.2	-55.2	0	0	0	0	115.2	L559	L559-C563 PolarHBondContact O-N 3.39Å; L559-C563 VanDerWaalsContact O-N 3.08Å; L559-C563 PolarHBondContact O-SG 3.2Å
564	M	85.3	Confident	87.1	Confident	91 Å²	91	91.1 Å²	91.1	45%	0.448	43%	0.432	S	S	.	.	S	Bend	trans	-81.1	128	-178.7	-81.9	179.7	69	0	0	111.7	R560 R566	R560-M564 HydrophobicContact CG-CG 4.08Å; R560-M564 HydrophobicContact CG-SD 3.55Å; R560-M564 VanDerWaalsContact CG-SD 3.55Å; R560-M564 WeakPolarHBondContact O-CB 3.38Å; R560-M564 WeakPolarHBondContact O-CG 3.1Å; M564-R566 PolarHBondContact O-N 3.17Å
565	F	82.8	Confident	87	Confident	196 Å²	196	88.9 Å²	88.9	86%	0.86	42%	0.42	S	S	*	.			trans	-55.4	122.1	168.1	-63.2	-64.2	0	0	0	111
566	R	83.3	Confident	87.1	Confident	46 Å²	46	86.4 Å²	86.4	17%	0.174	41%	0.414	C	S	.	.			trans	-125	164.6	175.4	-72.6	-164.4	-175.7	106.8	33.1	110.5	R531 R561 M564 E570 E571 D574	R531-R566 PolarHBondContact NE-O 3.14Å; R531-R566 PolarHBondContact NH2-O 3.37Å; R561-R566 VanDerWaalsContact CA-NH2 3.32Å; R561-R566 VanDerWaalsContact O-CZ 3.26Å; R561-R566 PolarHBondContact O-NH1 3.1Å; R561-R566 PolarHBondContact O-NH2 3.48Å; M564-R566 PolarHBondContact O-N 3.17Å; R566-E570 HydrophobicContact CB-CB 4.14Å; R566-E571 HydrophobicContact CB-CG 4.11Å; R566-E571 VanDerWaalsContact O-OE1 3.06Å; R566-D574 IonicContact CZ-OD2 3.92Å; R566-D574 IonicContact NE-OD2 3.68Å; R566-D574 IonicContact NH1-OD2 3.21Å; R566-D574 PolarHBondContact NH1-OD2 2.99Å
567	S	89.2	Confident	87.3	Confident	56 Å²	56	89.1 Å²	89.1	39%	0.392	43%	0.431	S	S	.	.			trans	-76.4	154.5	171.9	60.1	0	0	0	0	111.3	R569 E570 E571	S567-R569 PolarHBondContact O-N 2.86Å; S567-R569 VanDerWaalsContact O-N 3.13Å; S567-E570 PolarHBondContact N-OE2 3.29Å; S567-E570 WeakPolarHBondContact O-CA 3.39Å; S567-E570 WeakPolarHBondContact O-CB 3.46Å; S567-E570 PolarHBondContact O-N 2.93Å; S567-E570 VanDerWaalsContact OG-CD 3.27Å; S567-E570 VanDerWaalsContact OG-CG 3.26Å; S567-E570 WeakPolarHBondContact OG-CG 3.34Å; S567-E570 PolarHBondContact OG-OE2 2.97Å; S567-E571 PolarHBondContact O-N 3.41Å
568	E	87.8	Confident	87.3	Confident	121 Å²	121	88.8 Å²	88.8	57%	0.565	43%	0.427	S	S	*	.	H	α-helix	trans	-56.3	-36.5	-179	-64.4	170	-163.7	0	0	111.8	R531 E570 E571 M572	R531-E568 IonicContact CZ-OE1 2.77Å; R531-E568 IonicContact NH1-OE1 3.04Å; R531-E568 PolarHBondContact NH1-OE1 2.94Å; E568-E570 VanDerWaalsContact C-N 3.32Å; E568-E570 PolarHBondContact O-N 2.69Å; E568-E571 PolarHBondContact O-N 3.12Å; E568-M572 WeakPolarHBondContact O-CB 3.46Å; E568-M572 VanDerWaalsContact O-CG 3.22Å; E568-M572 WeakPolarHBondContact O-CG 3.06Å; E568-M572 PolarHBondContact O-N 2.85Å
569	R	88.9	Confident	87.3	Confident	221 Å²	221	92.6 Å²	92.6	83%	0.834	44%	0.437	S	S	*	.	H	α-helix	trans	-64.8	-37.2	177.2	-171.9	176	-176	160.5	4.2	112.4	S567 S573	S567-R569 PolarHBondContact O-N 2.86Å; S567-R569 VanDerWaalsContact O-N 3.13Å; R569-S573 WeakPolarHBondContact O-CB 3.36Å; R569-S573 PolarHBondContact O-N 3.46Å; R569-S573 VanDerWaalsContact O-N 3.07Å
570	E	89.6	Confident	87.5	Confident	101 Å²	101	91.3 Å²	91.3	47%	0.472	43%	0.434	S	S	.	.	H	α-helix	trans	-74.5	-39.9	176.6	-71.2	170.4	151.8	0	0	111.3	R566 S567 E568 S573 D574	R566-E570 HydrophobicContact CB-CB 4.14Å; S567-E570 PolarHBondContact N-OE2 3.29Å; S567-E570 WeakPolarHBondContact O-CA 3.39Å; S567-E570 WeakPolarHBondContact O-CB 3.46Å; S567-E570 PolarHBondContact O-N 2.93Å; S567-E570 VanDerWaalsContact OG-CD 3.27Å; S567-E570 VanDerWaalsContact OG-CG 3.26Å; S567-E570 WeakPolarHBondContact OG-CG 3.34Å; S567-E570 PolarHBondContact OG-OE2 2.97Å; E568-E570 VanDerWaalsContact C-N 3.32Å; E568-E570 PolarHBondContact O-N 2.69Å; E570-S573 WeakPolarHBondContact O-CB 3.43Å; E570-S573 PolarHBondContact O-N 3.47Å; E570-D574 WeakPolarHBondContact O-CB 3.37Å; E570-D574 PolarHBondContact O-N 2.77Å
571	E	88.1	Confident	87.5	Confident	22 Å²	22	86 Å²	86	10%	0.103	42%	0.416	C	S	.	.	H	α-helix	trans	-60	-45.6	173.2	-68.5	168.3	-159.1	0	0	111.3	R531 V534 R566 S567 E568 S573 D574 L575	R531-E571 IonicContact CZ-OE1 3.85Å; R531-E571 IonicContact NE-OE1 3.58Å; R531-E571 PolarHBondContact NE-OE1 2.85Å; R531-E571 VanDerWaalsContact NH2-CD 3.33Å; R531-E571 IonicContact NH2-OE1 3.79Å; R531-E571 PolarHBondContact NH2-OE1 2.79Å; R531-E571 IonicContact NH2-OE2 2.69Å; R531-E571 PolarHBondContact NH2-OE2 3.47Å; V534-E571 HydrophobicContact CG2-CB 4.46Å; V534-E571 PolarHBondContact N-OE2 2.86Å; R566-E571 HydrophobicContact CB-CG 4.11Å; R566-E571 VanDerWaalsContact O-OE1 3.06Å; S567-E571 PolarHBondContact O-N 3.41Å; E568-E571 PolarHBondContact O-N 3.12Å; E571-S573 VanDerWaalsContact C-N 3.31Å; E571-S573 PolarHBondContact O-N 3.38Å; E571-D574 PolarHBondContact O-N 2.75Å; E571-L575 PolarHBondContact O-N 3.3Å
572	M	89.6	Confident	87.6	Confident	93 Å²	93	82.1 Å²	82.1	46%	0.458	41%	0.406	S	S	.	.	H	α-helix	trans	-65.7	-32.1	175.2	-72.5	-65.1	-81.1	0	0	113.1	V534 E568 L575 K576	V534-M572 HydrophobicContact CG1-SD 4.17Å; V534-M572 HydrophobicContact CG2-SD 4.39Å; E568-M572 WeakPolarHBondContact O-CB 3.46Å; E568-M572 VanDerWaalsContact O-CG 3.22Å; E568-M572 WeakPolarHBondContact O-CG 3.06Å; E568-M572 PolarHBondContact O-N 2.85Å; M572-L575 HydrophobicContact SD-CD1 3.97Å; M572-K576 WeakPolarHBondContact O-CG 3.44Å; M572-K576 PolarHBondContact O-N 3.34Å
573	S	89.8	Confident	87.7	Confident	56 Å²	56	86.5 Å²	86.5	39%	0.392	42%	0.422	S	S	.	.	H	α-helix	trans	-69.5	-43.9	172.5	-175.2	0	0	0	0	110.9	R569 E570 E571 K576 N577	R569-S573 WeakPolarHBondContact O-CB 3.36Å; R569-S573 PolarHBondContact O-N 3.46Å; R569-S573 VanDerWaalsContact O-N 3.07Å; E570-S573 WeakPolarHBondContact O-CB 3.43Å; E570-S573 PolarHBondContact O-N 3.47Å; E571-S573 VanDerWaalsContact C-N 3.31Å; E571-S573 PolarHBondContact O-N 3.38Å; S573-K576 PolarHBondContact O-N 3.01Å; S573-N577 WeakPolarHBondContact O-CB 3.26Å; S573-N577 PolarHBondContact O-N 3.18Å; S573-N577 PolarHBondContact O-ND2 2.85Å; S573-N577 PolarHBondContact OG-ND2 3.24Å
574	D	88.9	Confident	88.1	Confident	8 Å²	8	84.8 Å²	84.8	4%	0.043	41%	0.405	C	S	.	.	H	α-helix	trans	-61.3	-45.6	176.3	-79.2	-21.7	0	0	0	110.9	R561 R566 E570 E571 K576 N577 Y578	R561-D574 IonicContact CZ-OD1 2.73Å; R561-D574 IonicContact NE-OD1 3.76Å; R561-D574 IonicContact NE-OD2 2.9Å; R561-D574 IonicContact NH2-OD1 3.77Å; R561-D574 PolarHBondContact NH2-OD1 3.13Å; R561-D574 IonicContact NH2-OD2 2.61Å; R566-D574 IonicContact CZ-OD2 3.92Å; R566-D574 IonicContact NE-OD2 3.68Å; R566-D574 IonicContact NH1-OD2 3.21Å; R566-D574 PolarHBondContact NH1-OD2 2.99Å; E570-D574 WeakPolarHBondContact O-CB 3.37Å; E570-D574 PolarHBondContact O-N 2.77Å; E571-D574 PolarHBondContact O-N 2.75Å; D574-K576 VanDerWaalsContact C-N 3.32Å; D574-K576 PolarHBondContact O-N 3.49Å; D574-N577 PolarHBondContact O-N 2.71Å; D574-N577 VanDerWaalsContact O-N 3.13Å; D574-Y578 HydrophobicContact CB-CD2 4.08Å; D574-Y578 HydrophobicContact CB-CE2 4.12Å; D574-Y578 WeakPolarHBondContact O-CB 3.47Å; D574-Y578 WeakPolarHBondContact O-CD2 3.28Å; D574-Y578 PolarHBondContact O-N 3.22Å
575	L	88.6	Confident	88	Confident	17 Å²	17	84.2 Å²	84.2	9%	0.089	41%	0.407	C	S	.	.	H	α-helix	trans	-52.8	-48	172.6	-84.6	165.5	0	0	0	112.7	V534 P535 N536 E571 M572 Y578 K579	V534-L575 HydrophobicContact CB-CD1 3.9Å; V534-L575 HydrophobicContact CG1-CD1 3.31Å; P535-L575 WeakPolarHBondContact O-CD2 3.28Å; N536-L575 HydrophobicContact CB-CD2 3.58Å; N536-L575 HydrophobicContact CB-CG 4.08Å; N536-L575 VanDerWaalsContact CG-CD2 3.41Å; N536-L575 VanDerWaalsContact OD1-CD2 3.29Å; N536-L575 WeakPolarHBondContact OD1-CD2 3.37Å; E571-L575 PolarHBondContact O-N 3.3Å; M572-L575 HydrophobicContact SD-CD1 3.97Å; L575-Y578 PolarHBondContact O-N 2.81Å; L575-K579 VanDerWaalsContact O-CB 3.3Å; L575-K579 WeakPolarHBondContact O-CB 3.39Å; L575-K579 WeakPolarHBondContact O-CG 3.34Å; L575-K579 PolarHBondContact O-N 2.86Å
576	K	90.4	Very high	88.2	Confident	139 Å²	139	84.9 Å²	84.9	60%	0.604	40%	0.404	S	S	*	.	H	α-helix	trans	-64.4	-44.4	177.4	-71.1	173.5	-176.7	-178.2	0	111.5	M572 S573 D574 Y578 K579 V580	M572-K576 WeakPolarHBondContact O-CG 3.44Å; M572-K576 PolarHBondContact O-N 3.34Å; S573-K576 PolarHBondContact O-N 3.01Å; D574-K576 VanDerWaalsContact C-N 3.32Å; D574-K576 PolarHBondContact O-N 3.49Å; K576-Y578 VanDerWaalsContact C-N 3.34Å; K576-Y578 PolarHBondContact O-N 3.2Å; K576-K579 PolarHBondContact O-N 3.38Å; K576-V580 VanDerWaalsContact O-CG2 3.28Å; K576-V580 WeakPolarHBondContact O-CG2 3.37Å; K576-V580 PolarHBondContact O-N 2.95Å
577	N	91.6	Very high	88.1	Confident	76 Å²	76	87.7 Å²	87.7	41%	0.406	42%	0.417	S	S	.	.	H	α-helix	trans	-62.9	-41.8	179.2	-67.9	-31.4	0	0	0	111.7	S573 D574 V580 K581	S573-N577 WeakPolarHBondContact O-CB 3.26Å; S573-N577 PolarHBondContact O-N 3.18Å; S573-N577 PolarHBondContact O-ND2 2.85Å; S573-N577 PolarHBondContact OG-ND2 3.24Å; D574-N577 PolarHBondContact O-N 2.71Å; D574-N577 VanDerWaalsContact O-N 3.13Å; N577-V580 PolarHBondContact O-N 3Å; N577-K581 WeakPolarHBondContact O-CB 3.43Å; N577-K581 VanDerWaalsContact O-CG 3.26Å; N577-K581 WeakPolarHBondContact O-CG 3.07Å; N577-K581 PolarHBondContact O-N 2.89Å
578	Y	90.2	Very high	87.9	Confident	6 Å²	6	85.8 Å²	85.8	2%	0.024	40%	0.402	C	S	.	.	H	α-helix	trans	-77.9	-32.1	-179.5	-75.7	-66.6	0	0	0	112.8	F538 C557 D574 L575 K576 K581 G582	F538-Y578 HydrophobicContact CB-CD1 4.34Å; F538-Y578 HydrophobicContact CB-CG 4.37Å; F538-Y578 HydrophobicContact CD1-CD1 4.38Å; F538-Y578 AromaticContact CD1-CD2 3.64Å; F538-Y578 HydrophobicContact CD1-CD2 3.64Å; F538-Y578 HydrophobicContact CD1-CE1 4.38Å; F538-Y578 AromaticContact CD1-CE2 3.63Å; F538-Y578 HydrophobicContact CD1-CE2 3.63Å; F538-Y578 HydrophobicContact CD1-CG 4.06Å; F538-Y578 HydrophobicContact CE1-CD2 4.26Å; F538-Y578 HydrophobicContact CE1-CE2 4.03Å; F538-Y578 WeakPolarHBondContact O-CD1 3.27Å; C557-Y578 HydrophobicContact CB-CE1 4.36Å; C557-Y578 PolarHBondContact SG-OH 3.07Å; D574-Y578 HydrophobicContact CB-CD2 4.08Å; D574-Y578 HydrophobicContact CB-CE2 4.12Å; D574-Y578 WeakPolarHBondContact O-CB 3.47Å; D574-Y578 WeakPolarHBondContact O-CD2 3.28Å; D574-Y578 PolarHBondContact O-N 3.22Å; L575-Y578 PolarHBondContact O-N 2.81Å; K576-Y578 VanDerWaalsContact C-N 3.34Å; K576-Y578 PolarHBondContact O-N 3.2Å; Y578-K581 HydrophobicContact CD1-CD 3.89Å; Y578-K581 HydrophobicContact CE1-CD 4.03Å; Y578-K581 PolarHBondContact O-N 3.13Å; Y578-G582 PolarHBondContact O-N 3.41Å
579	K	88.9	Confident	87.7	Confident	135 Å²	135	83.5 Å²	83.5	59%	0.587	39%	0.39	S	S	*	.	H	α-helix	trans	-60.6	-45.1	166.9	-76.1	177.8	-178.3	-171.3	0	111.3	L575 K576 G582 Q583	L575-K579 VanDerWaalsContact O-CB 3.3Å; L575-K579 WeakPolarHBondContact O-CB 3.39Å; L575-K579 WeakPolarHBondContact O-CG 3.34Å; L575-K579 PolarHBondContact O-N 2.86Å; K576-K579 PolarHBondContact O-N 3.38Å; K579-G582 PolarHBondContact O-N 3.38Å; K579-Q583 WeakPolarHBondContact O-CG 3.37Å; K579-Q583 PolarHBondContact O-N 3.05Å; K579-Q583 VanDerWaalsContact O-N 3.12Å
580	V	89.7	Confident	87.6	Confident	84 Å²	84	80.1 Å²	80.1	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-66.8	-38	175.4	173.5	0	0	0	0	111.6	K576 N577 N584	K576-V580 VanDerWaalsContact O-CG2 3.28Å; K576-V580 WeakPolarHBondContact O-CG2 3.37Å; K576-V580 PolarHBondContact O-N 2.95Å; N577-V580 PolarHBondContact O-N 3Å; V580-N584 PolarHBondContact O-ND2 3.45Å
581	K	87.5	Confident	87.4	Confident	79 Å²	79	76.9 Å²	76.9	34%	0.343	37%	0.371	S	S	.	.	H	α-helix	trans	-67.4	-40.2	174.4	-76.8	175.9	175.3	-173.7	0	112.2	W556 N577 Y578 Q583 N584	W556-K581 HydrophobicContact CH2-CB 4.01Å; W556-K581 WeakPolarHBondContact CH2-O 3.23Å; W556-K581 HydrophobicContact CZ2-CB 3.79Å; N577-K581 WeakPolarHBondContact O-CB 3.43Å; N577-K581 VanDerWaalsContact O-CG 3.26Å; N577-K581 WeakPolarHBondContact O-CG 3.07Å; N577-K581 PolarHBondContact O-N 2.89Å; Y578-K581 HydrophobicContact CD1-CD 3.89Å; Y578-K581 HydrophobicContact CE1-CD 4.03Å; Y578-K581 PolarHBondContact O-N 3.13Å; K581-Q583 VanDerWaalsContact C-N 3.29Å; K581-Q583 PolarHBondContact O-N 3.49Å; K581-N584 WeakPolarHBondContact O-CB 3.45Å; K581-N584 PolarHBondContact O-N 2.98Å
582	G	86.1	Confident	87.3	Confident	14 Å²	14	75.8 Å²	75.8	14%	0.144	37%	0.366	C	S	.	.	H	α-helix	trans	-62.8	-34.9	177.9	0	0	0	0	0	112.6	G539 Y578 K579 N584 K588	G539-G582 WeakPolarHBondContact O-CA 3.48Å; Y578-G582 PolarHBondContact O-N 3.41Å; K579-G582 PolarHBondContact O-N 3.38Å; G582-N584 PolarHBondContact O-N 3.46Å; G582-K588 WeakPolarHBondContact O-CE 3.15Å
583	Q	85.8	Confident	87	Confident	153 Å²	153	73.8 Å²	73.8	72%	0.715	36%	0.361	S	S	*	.	H	α-helix	trans	-66.3	-20.8	172.2	-71.4	174.1	-4.7	0	0	113.4	K579 K581 V585	K579-Q583 WeakPolarHBondContact O-CG 3.37Å; K579-Q583 PolarHBondContact O-N 3.05Å; K579-Q583 VanDerWaalsContact O-N 3.12Å; K581-Q583 VanDerWaalsContact C-N 3.29Å; K581-Q583 PolarHBondContact O-N 3.49Å; Q583-V585 PolarHBondContact O-N 3.42Å; Q583-V585 VanDerWaalsContact O-N 3.1Å
584	N	88.4	Confident	86.7	Confident	66 Å²	66	72.2 Å²	72.2	35%	0.353	35%	0.35	S	S	.	.			trans	-85	82.1	178.4	-72.1	-67.8	0	0	0	111.2	V580 K581 G582 R586 K587 K588	V580-N584 PolarHBondContact O-ND2 3.45Å; K581-N584 WeakPolarHBondContact O-CB 3.45Å; K581-N584 PolarHBondContact O-N 2.98Å; G582-N584 PolarHBondContact O-N 3.46Å; N584-R586 PolarHBondContact O-N 3.44Å; N584-R586 VanDerWaalsContact O-N 3.14Å; N584-K587 HydrophobicContact CB-CB 4.25Å; N584-K587 HydrophobicContact CB-CD 4.16Å; N584-K587 HydrophobicContact CB-CG 4.27Å; N584-K587 PolarHBondContact O-N 2.9Å; N584-K588 PolarHBondContact O-N 3.43Å
585	V	83.8	Confident	86.4	Confident	79 Å²	79	73.2 Å²	73.2	48%	0.479	36%	0.356	S	S	.	.	H	α-helix	trans	-53.1	-36.7	178.4	-176.7	0	0	0	0	112.4	Q583 K587 K588 K589	Q583-V585 PolarHBondContact O-N 3.42Å; Q583-V585 VanDerWaalsContact O-N 3.1Å; V585-K587 VanDerWaalsContact C-N 3.33Å; V585-K587 PolarHBondContact O-N 3.42Å; V585-K588 WeakPolarHBondContact O-CB 3.26Å; V585-K588 PolarHBondContact O-N 3.46Å; V585-K589 HydrophobicContact CG1-CD 4.39Å; V585-K589 HydrophobicContact CG1-CG 4.28Å; V585-K589 WeakPolarHBondContact O-CG 3.44Å; V585-K589 PolarHBondContact O-N 3.2Å
586	R	85.3	Confident	85.9	Confident	211 Å²	211	73.8 Å²	73.8	80%	0.796	36%	0.357	S	S	*	.	H	α-helix	trans	-60	-41.2	177.2	-68.8	-176.5	177.2	168.8	0.6	113.1	N584 E590	N584-R586 PolarHBondContact O-N 3.44Å; N584-R586 VanDerWaalsContact O-N 3.14Å; R586-E590 WeakPolarHBondContact O-CB 3.32Å; R586-E590 VanDerWaalsContact O-CG 3.31Å; R586-E590 WeakPolarHBondContact O-CG 2.9Å; R586-E590 PolarHBondContact O-N 3.48Å
587	K	82.4	Confident	84.8	Confident	105 Å²	105	69.3 Å²	69.3	46%	0.457	34%	0.344	S	S	.	.	H	α-helix	trans	-74.2	-33.1	178.9	-68.4	-178.9	-179.6	171.4	0	111.1	W556 N584 V585 E590 V591	W556-K587 HydrophobicContact CH2-CB 4.33Å; W556-K587 HydrophobicContact CZ3-CB 3.98Å; N584-K587 HydrophobicContact CB-CB 4.25Å; N584-K587 HydrophobicContact CB-CD 4.16Å; N584-K587 HydrophobicContact CB-CG 4.27Å; N584-K587 PolarHBondContact O-N 2.9Å; V585-K587 VanDerWaalsContact C-N 3.33Å; V585-K587 PolarHBondContact O-N 3.42Å; K587-E590 PolarHBondContact O-N 3.04Å; K587-V591 WeakPolarHBondContact O-CB 3.22Å; K587-V591 VanDerWaalsContact O-CG2 3.25Å; K587-V591 WeakPolarHBondContact O-CG2 3.34Å; K587-V591 PolarHBondContact O-N 2.95Å; K587-V591 VanDerWaalsContact O-N 3.08Å
588	K	84.4	Confident	83.2	Confident	16 Å²	16	72.7 Å²	72.7	7%	0.07	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-51	171.3	-72.8	-167.6	167.4	-158.6	0	110.8	G539 E544 W556 G582 N584 V585 E590 V591 L592 Y596	G539-K588 WeakPolarHBondContact O-CE 3.39Å; G539-K588 PolarHBondContact O-NZ 3.31Å; E544-K588 IonicContact OE1-NZ 2.69Å; E544-K588 PolarHBondContact OE1-NZ 2.78Å; E544-K588 VanDerWaalsContact OE1-NZ 3.14Å; E544-K588 IonicContact OE2-NZ 3.39Å; E544-K588 PolarHBondContact OE2-NZ 2.87Å; W556-K588 HydrophobicContact CH2-CG 3.7Å; W556-K588 HydrophobicContact CZ2-CG 4.16Å; W556-K588 HydrophobicContact CZ3-CG 4.22Å; G582-K588 WeakPolarHBondContact O-CE 3.15Å; N584-K588 PolarHBondContact O-N 3.43Å; V585-K588 WeakPolarHBondContact O-CB 3.26Å; V585-K588 PolarHBondContact O-N 3.46Å; K588-E590 VanDerWaalsContact C-N 3.32Å; K588-E590 PolarHBondContact O-N 3.46Å; K588-V591 PolarHBondContact O-N 2.89Å; K588-L592 WeakPolarHBondContact O-CA 3.31Å; K588-L592 VanDerWaalsContact O-CB 3.31Å; K588-L592 WeakPolarHBondContact O-CB 3.47Å; K588-L592 PolarHBondContact O-N 3.13Å; K588-Y596 HydrophobicContact CB-CE2 3.91Å
589	K	83.9	Confident	81.5	Confident	72 Å²	72	78.4 Å²	78.4	31%	0.313	38%	0.384	S	S	.	.	H	α-helix	trans	-59.5	-37.6	176.4	-69.2	-166.2	164.7	-137.1	0	113.7	V585 Y596 D600	V585-K589 HydrophobicContact CG1-CD 4.39Å; V585-K589 HydrophobicContact CG1-CG 4.28Å; V585-K589 WeakPolarHBondContact O-CG 3.44Å; V585-K589 PolarHBondContact O-N 3.2Å; K589-Y596 HydrophobicContact CB-CG 4.36Å; K589-Y596 HydrophobicContact CD-CD1 4.35Å; K589-Y596 HydrophobicContact CG-CD1 3.75Å; K589-Y596 HydrophobicContact CG-CD2 4.12Å; K589-Y596 HydrophobicContact CG-CE1 4.22Å; K589-Y596 HydrophobicContact CG-CG 3.66Å; K589-D600 IonicContact NZ-OD1 3.83Å; K589-D600 PolarHBondContact NZ-OD1 3.12Å; K589-D600 VanDerWaalsContact NZ-OD1 3.07Å; K589-D600 IonicContact NZ-OD2 2.71Å; K589-D600 PolarHBondContact NZ-OD2 3.02Å
590	E	86.1	Confident	79.6	Confident	151 Å²	151	73.9 Å²	73.9	71%	0.706	37%	0.366	S	S	*	.	H	α-helix	trans	-72.2	-30	178.2	-78.5	175.8	-175.9	0	0	113.8	R586 K587 K588	R586-E590 WeakPolarHBondContact O-CB 3.32Å; R586-E590 VanDerWaalsContact O-CG 3.31Å; R586-E590 WeakPolarHBondContact O-CG 2.9Å; R586-E590 PolarHBondContact O-N 3.48Å; K587-E590 PolarHBondContact O-N 3.04Å; K588-E590 VanDerWaalsContact C-N 3.32Å; K588-E590 PolarHBondContact O-N 3.46Å
591	V	86.7	Confident	77.7	Confident	32 Å²	32	76.5 Å²	76.5	19%	0.194	37%	0.371	C	S	.	.	H	α-helix	trans	-97.1	-42.8	-174.9	176.2	0	0	0	0	111.5	E552 R555 W556 K587 K588 S593	E552-V591 WeakPolarHBondContact CB-O 3.29Å; E552-V591 WeakPolarHBondContact CG-O 3.07Å; R555-V591 HydrophobicContact CB-CG1 4.04Å; W556-V591 HydrophobicContact CB-CG1 3.91Å; W556-V591 HydrophobicContact CE3-CB 3.93Å; W556-V591 HydrophobicContact CE3-CG1 4Å; W556-V591 HydrophobicContact CE3-CG2 4.06Å; W556-V591 HydrophobicContact CZ3-CB 4.47Å; W556-V591 HydrophobicContact CZ3-CG2 4.4Å; K587-V591 WeakPolarHBondContact O-CB 3.22Å; K587-V591 VanDerWaalsContact O-CG2 3.25Å; K587-V591 WeakPolarHBondContact O-CG2 3.34Å; K587-V591 PolarHBondContact O-N 2.95Å; K587-V591 VanDerWaalsContact O-N 3.08Å; K588-V591 PolarHBondContact O-N 2.89Å; V591-S593 VanDerWaalsContact C-N 3.3Å; V591-S593 PolarHBondContact O-N 2.99Å
592	L	84.5	Confident	75.8	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	40%	0.395	C	S	.	.			trans	-93.8	62.6	175.5	-56.5	178.9	0	0	0	109.2	L540 E544 A548 E552 L553 K588 S594 V595 Y596	L540-L592 HydrophobicContact CD2-CD1 3.66Å; E544-L592 HydrophobicContact CB-CD1 4.44Å; A548-L592 HydrophobicContact CB-CD2 3.85Å; E552-L592 HydrophobicContact CB-CD2 4.06Å; E552-L592 VanDerWaalsContact OE2-CA 3.31Å; E552-L592 WeakPolarHBondContact OE2-CA 3.37Å; L553-L592 HydrophobicContact CD2-CD2 4.16Å; K588-L592 WeakPolarHBondContact O-CA 3.31Å; K588-L592 VanDerWaalsContact O-CB 3.31Å; K588-L592 WeakPolarHBondContact O-CB 3.47Å; K588-L592 PolarHBondContact O-N 3.13Å; L592-S594 PolarHBondContact O-N 3.28Å; L592-V595 HydrophobicContact CB-CB 4.45Å; L592-V595 HydrophobicContact CB-CG2 4.43Å; L592-Y596 HydrophobicContact CB-CD2 4Å; L592-Y596 HydrophobicContact CB-CE2 4.24Å; L592-Y596 HydrophobicContact CD1-CE2 4.3Å; L592-Y596 WeakPolarHBondContact O-CD2 3.4Å; L592-Y596 PolarHBondContact O-N 2.93Å
593	S	84	Confident	74	Confident	51 Å²	51	85.3 Å²	85.3	36%	0.357	42%	0.415	S	S	.	.	H	α-helix	trans	-61	-37	177.8	35	0	0	0	0	111.5	E552 V591 S597	E552-S593 PolarHBondContact OE1-OG 3.42Å; E552-S593 PolarHBondContact OE2-N 3.33Å; V591-S593 VanDerWaalsContact C-N 3.3Å; V591-S593 PolarHBondContact O-N 2.99Å; S593-S597 WeakPolarHBondContact O-CA 3.38Å; S593-S597 WeakPolarHBondContact O-CB 3.43Å; S593-S597 PolarHBondContact O-N 3.03Å; S593-S597 PolarHBondContact O-OG 2.75Å
594	S	83.8	Confident	72.1	Confident	22 Å²	22	83.3 Å²	83.3	15%	0.154	41%	0.409	C	S	.	.	H	α-helix	trans	-56.5	-55.4	179.7	53.5	0	0	0	0	112.5	N549 E552 L592 Y596 S597	N549-S594 PolarHBondContact N-OG 2.98Å; E552-S594 PolarHBondContact OE1-N 3.43Å; E552-S594 VanDerWaalsContact OE1-N 3.14Å; E552-S594 WeakPolarHBondContact OE2-CB 3.32Å; E552-S594 PolarHBondContact OE2-N 3.5Å; E552-S594 PolarHBondContact OE2-OG 2.98Å; L592-S594 PolarHBondContact O-N 3.28Å; S594-Y596 PolarHBondContact O-N 2.95Å; S594-S597 PolarHBondContact O-OG 3.27Å
595	V	81.6	Confident	69.9	Low	29 Å²	29	89.1 Å²	89.1	18%	0.176	43%	0.434	C	S	.	.	H	α-helix	trans	-64.4	-42.1	-176.8	-174.5	0	0	0	0	112.7	E544 T547 A548 L592	E544-V595 HydrophobicContact CG-CG1 4.48Å; T547-V595 WeakPolarHBondContact OG1-CG2 3.32Å; A548-V595 HydrophobicContact CB-CG2 3.67Å; L592-V595 HydrophobicContact CB-CB 4.45Å; L592-V595 HydrophobicContact CB-CG2 4.43Å
596	Y	78	Confident	67.9	Low	30 Å²	30	89.4 Å²	89.4	12%	0.118	45%	0.445	C	S	.	.	H	α-helix	trans	-94.4	-14.7	-174.2	-69.5	-79.1	0	0	0	113.9	E544 K588 K589 L592 S594 D600	E544-Y596 PolarHBondContact OE1-OH 2.74Å; K588-Y596 HydrophobicContact CB-CE2 3.91Å; K589-Y596 HydrophobicContact CB-CG 4.36Å; K589-Y596 HydrophobicContact CD-CD1 4.35Å; K589-Y596 HydrophobicContact CG-CD1 3.75Å; K589-Y596 HydrophobicContact CG-CD2 4.12Å; K589-Y596 HydrophobicContact CG-CE1 4.22Å; K589-Y596 HydrophobicContact CG-CG 3.66Å; L592-Y596 HydrophobicContact CB-CD2 4Å; L592-Y596 HydrophobicContact CB-CE2 4.24Å; L592-Y596 HydrophobicContact CD1-CE2 4.3Å; L592-Y596 WeakPolarHBondContact O-CD2 3.4Å; L592-Y596 PolarHBondContact O-N 2.93Å; S594-Y596 PolarHBondContact O-N 2.95Å; Y596-D600 WeakPolarHBondContact O-CB 3.17Å; Y596-D600 PolarHBondContact O-N 2.61Å; Y596-D600 VanDerWaalsContact O-N 3.07Å
597	S	67.6	Low	66	Low	45 Å²	45	87.3 Å²	87.3	32%	0.315	44%	0.441	S	S	.	.	H	α-helix	trans	-75.5	-23.5	176.3	66.9	0	0	0	0	113.1	S593 S594 E599 D600 K601	S593-S597 WeakPolarHBondContact O-CA 3.38Å; S593-S597 WeakPolarHBondContact O-CB 3.43Å; S593-S597 PolarHBondContact O-N 3.03Å; S593-S597 PolarHBondContact O-OG 2.75Å; S594-S597 PolarHBondContact O-OG 3.27Å; S597-E599 VanDerWaalsContact C-N 3.32Å; S597-D600 PolarHBondContact O-N 3.37Å; S597-K601 VanDerWaalsContact O-CG 3.31Å; S597-K601 WeakPolarHBondContact O-CG 3.43Å; S597-K601 PolarHBondContact O-N 3.01Å
598	E	59.3	Low	64	Low	146 Å²	146	87.6 Å²	87.6	68%	0.682	46%	0.457	S	S	*	.	H	α-helix	trans	-68	-35.1	174.1	-65.8	-168.7	158.6	0	0	111.5
599	E	53.2	Low	62.2	Low	127 Å²	127	95.6 Å²	95.6	59%	0.593	49%	0.491	S	S	*	.	H	α-helix	trans	-78.6	-33.5	172.6	-60.4	-177.5	159.4	0	0	112.9	S597	S597-E599 VanDerWaalsContact C-N 3.32Å
600	D	49.3	Very low	60.3	Low	39 Å²	39	95.7 Å²	95.7	21%	0.209	50%	0.495	C	S	.	.	H	α-helix	trans	-84.5	-6.6	-176.8	-71.1	-24.3	0	0	0	113.3	K589 Y596 S597 E602 T603 L604	K589-D600 IonicContact NZ-OD1 3.83Å; K589-D600 PolarHBondContact NZ-OD1 3.12Å; K589-D600 VanDerWaalsContact NZ-OD1 3.07Å; K589-D600 IonicContact NZ-OD2 2.71Å; K589-D600 PolarHBondContact NZ-OD2 3.02Å; Y596-D600 WeakPolarHBondContact O-CB 3.17Å; Y596-D600 PolarHBondContact O-N 2.61Å; Y596-D600 VanDerWaalsContact O-N 3.07Å; S597-D600 PolarHBondContact O-N 3.37Å; D600-E602 PolarHBondContact O-N 2.95Å; D600-T603 PolarHBondContact O-N 3.45Å; D600-T603 VanDerWaalsContact O-N 3.09Å; D600-T603 PolarHBondContact O-OG1 3.32Å; D600-L604 HydrophobicContact CB-CD1 3.74Å; D600-L604 HydrophobicContact CB-CG 4.06Å; D600-L604 VanDerWaalsContact O-CB 3.29Å; D600-L604 WeakPolarHBondContact O-CB 3.11Å; D600-L604 VanDerWaalsContact O-CG 3.24Å; D600-L604 WeakPolarHBondContact O-CG 3.39Å; D600-L604 PolarHBondContact O-N 3.1Å
601	K	50.1	Low	58.7	Low	140 Å²	140	90.7 Å²	90.7	61%	0.609	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-31.5	172.1	-87.4	168.5	-170.6	172.4	0	112.7	S597 T603	S597-K601 VanDerWaalsContact O-CG 3.31Å; S597-K601 WeakPolarHBondContact O-CG 3.43Å; S597-K601 PolarHBondContact O-N 3.01Å; K601-T603 VanDerWaalsContact C-N 3.34Å
602	E	46.8	Very low	57.4	Low	184 Å²	184	97.7 Å²	97.7	86%	0.86	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.9	175.9	-67.3	-171.8	161.8	0	0	113.6	D600	D600-E602 PolarHBondContact O-N 2.95Å
603	T	49.2	Very low	56.1	Low	93 Å²	93	106.2 Å²	106.2	57%	0.571	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-13.6	-176.3	64.4	0	0	0	0	114.7	D600 K601	D600-T603 PolarHBondContact O-N 3.45Å; D600-T603 VanDerWaalsContact O-N 3.09Å; D600-T603 PolarHBondContact O-OG1 3.32Å; K601-T603 VanDerWaalsContact C-N 3.34Å
604	L	45.8	Very low	54.8	Low	112 Å²	112	111.8 Å²	111.8	59%	0.586	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-90.1	-10.3	-177.4	-72.5	174	0	0	0	115.4	D600 A606 K607	D600-L604 HydrophobicContact CB-CD1 3.74Å; D600-L604 HydrophobicContact CB-CG 4.06Å; D600-L604 VanDerWaalsContact O-CB 3.29Å; D600-L604 WeakPolarHBondContact O-CB 3.11Å; D600-L604 VanDerWaalsContact O-CG 3.24Å; D600-L604 WeakPolarHBondContact O-CG 3.39Å; D600-L604 PolarHBondContact O-N 3.1Å; L604-A606 PolarHBondContact O-N 3.26Å; L604-A606 VanDerWaalsContact O-N 3.13Å; L604-K607 PolarHBondContact O-N 2.86Å
605	E	41.3	Very low	53.9	Low	187 Å²	187	118 Å²	118	87%	0.874	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-63	-16.4	171.4	-68.6	-163.7	154.8	0	0	113
606	A	42.4	Very low	52.9	Low	85 Å²	85	121.8 Å²	121.8	70%	0.702	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-91.4	-9.9	-176.7	0	0	0	0	0	115.8	L604	L604-A606 PolarHBondContact O-N 3.26Å; L604-A606 VanDerWaalsContact O-N 3.13Å
607	K	44.9	Very low	52.3	Low	167 Å²	167	129.6 Å²	129.6	73%	0.726	63%	0.631	S	S	*	*			trans	-146.9	66	-178.2	-67.9	-172.9	-179	163.1	0	114.6	L604 K609	L604-K607 PolarHBondContact O-N 2.86Å; K607-K609 PolarHBondContact O-N 3.3Å
608	S	41.4	Very low	52	Low	111 Å²	111	132.7 Å²	132.7	78%	0.776	64%	0.643	S	S	*	*			trans	-67.3	98.8	159.5	65.5	0	0	0	0	110.6	L610	S608-L610 PolarHBondContact O-N 2.99Å; S608-L610 VanDerWaalsContact O-N 3.12Å
609	K	45.6	Very low	52.2	Low	184 Å²	184	133.8 Å²	133.8	80%	0.8	64%	0.641	S	S	*	*			trans	-75	99.6	173	-74.7	176.3	-178.1	167.9	0	110.2	K607 G611	K607-K609 PolarHBondContact O-N 3.3Å; K609-G611 PolarHBondContact O-N 3.46Å
610	L	45.9	Very low	52.6	Low	74 Å²	74	134.6 Å²	134.6	39%	0.387	64%	0.643	S	S	.	*			trans	-49.9	121.4	165.5	-78	155.2	0	0	0	111.1	S608 R614	S608-L610 PolarHBondContact O-N 2.99Å; S608-L610 VanDerWaalsContact O-N 3.12Å; L610-R614 HydrophobicContact CD2-CB 4.14Å; L610-R614 VanDerWaalsContact CD2-CZ 3.43Å; L610-R614 VanDerWaalsContact CD2-NH1 3.32Å
611	G	52.2	Low	53	Low	47 Å²	47	135.7 Å²	135.7	49%	0.485	66%	0.657	S	S	.	*			trans	-60.7	150.3	-179.2	0	0	0	0	0	113.5	K609 K613 R614 R615	K609-G611 PolarHBondContact O-N 3.46Å; G611-K613 PolarHBondContact O-N 3.26Å; G611-R614 PolarHBondContact O-N 2.9Å; G611-R615 PolarHBondContact O-N 3.39Å
612	K	58.8	Low	53.2	Low	179 Å²	179	136.8 Å²	136.8	78%	0.778	67%	0.665	S	S	*	*	H	α-helix	trans	-44.9	-39	-175.2	-90.7	176	172.9	175.3	0	114.5	R614 R615 D616	K612-R614 PolarHBondContact O-N 3.01Å; K612-R615 PolarHBondContact O-N 2.77Å; K612-D616 PolarHBondContact O-N 3.33Å
613	K	56.3	Low	53.5	Low	178 Å²	178	136.3 Å²	136.3	77%	0.774	66%	0.66	S	S	*	*	H	α-helix	trans	-65.5	-32.2	177.4	-86.1	-178	173.3	178.3	0	114.4	G611 R617	G611-K613 PolarHBondContact O-N 3.26Å; K613-R617 WeakPolarHBondContact O-CG 3.22Å; K613-R617 PolarHBondContact O-N 3.3Å
614	R	57.9	Low	53.2	Low	168 Å²	168	139 Å²	139	63%	0.634	67%	0.666	S	S	*	*	H	α-helix	trans	-77.4	-35	175.4	-73.9	-173.6	77.9	-173.5	3.6	111.3	L610 G611 K612 R617 L618	L610-R614 HydrophobicContact CD2-CB 4.14Å; L610-R614 VanDerWaalsContact CD2-CZ 3.43Å; L610-R614 VanDerWaalsContact CD2-NH1 3.32Å; G611-R614 PolarHBondContact O-N 2.9Å; K612-R614 PolarHBondContact O-N 3.01Å; R614-R617 PolarHBondContact O-N 3.22Å; R614-L618 PolarHBondContact O-N 3.01Å
615	R	63.5	Low	53.2	Low	153 Å²	153	137.2 Å²	137.2	58%	0.577	68%	0.675	S	S	*	*	H	α-helix	trans	-67.2	-40.1	175.7	-167.7	175.1	-69.6	159.4	-1.1	112.4	G611 K612 R617 L618 R619	G611-R615 PolarHBondContact O-N 3.39Å; K612-R615 PolarHBondContact O-N 2.77Å; R615-R617 VanDerWaalsContact C-N 3.34Å; R615-L618 PolarHBondContact O-N 3Å; R615-R619 WeakPolarHBondContact O-CB 3.43Å; R615-R619 PolarHBondContact O-N 3.49Å
616	D	62.2	Low	52.9	Low	108 Å²	108	137.3 Å²	137.3	58%	0.578	68%	0.675	S	S	*	*	H	α-helix	trans	-70.6	-29.4	175.4	-74.5	-24	0	0	0	112.7	K612 K620	K612-D616 PolarHBondContact O-N 3.33Å; D616-K620 WeakPolarHBondContact O-CB 3.43Å; D616-K620 PolarHBondContact O-N 3.33Å; D616-K620 VanDerWaalsContact O-N 3.08Å
617	R	65.4	Low	52.7	Low	195 Å²	195	136.7 Å²	136.7	74%	0.736	68%	0.677	S	S	*	*	H	α-helix	trans	-71	-42.4	173.3	-78.1	179.5	179.9	-171.9	-1.2	112.2	K613 R614 R615 K620 A621	K613-R617 WeakPolarHBondContact O-CG 3.22Å; K613-R617 PolarHBondContact O-N 3.3Å; R614-R617 PolarHBondContact O-N 3.22Å; R615-R617 VanDerWaalsContact C-N 3.34Å; R617-K620 PolarHBondContact O-N 3.48Å; R617-A621 WeakPolarHBondContact O-CB 3.22Å; R617-A621 PolarHBondContact O-N 3.35Å
618	L	61.3	Low	52.5	Low	109 Å²	109	132.6 Å²	132.6	57%	0.571	67%	0.674	S	S	*	*	H	α-helix	trans	-62.3	-44.3	173.5	-87.1	160.1	0	0	0	111.6	R614 R615 K620 A621 E622	R614-L618 PolarHBondContact O-N 3.01Å; R615-L618 PolarHBondContact O-N 3Å; L618-K620 PolarHBondContact O-N 3.33Å; L618-A621 PolarHBondContact O-N 3.46Å; L618-E622 VanDerWaalsContact O-CB 3.32Å; L618-E622 WeakPolarHBondContact O-CB 3.33Å; L618-E622 PolarHBondContact O-N 3.01Å
619	R	62.2	Low	52.6	Low	169 Å²	169	133.9 Å²	133.9	64%	0.638	67%	0.672	S	S	*	*	H	α-helix	trans	-68.8	-19.6	177.8	-142.4	-176.1	-171.1	-156.7	1.6	113.8	R615 K623	R615-R619 WeakPolarHBondContact O-CB 3.43Å; R615-R619 PolarHBondContact O-N 3.49Å; R619-K623 WeakPolarHBondContact O-CG 3.4Å
620	K	62.6	Low	52.2	Low	145 Å²	145	133.4 Å²	133.4	63%	0.63	67%	0.673	S	S	*	*	H	α-helix	trans	-88.3	-33.8	175.5	-161.8	176.7	-174.9	-174	0	111.5	D616 R617 L618 K623 Q624	D616-K620 WeakPolarHBondContact O-CB 3.43Å; D616-K620 PolarHBondContact O-N 3.33Å; D616-K620 VanDerWaalsContact O-N 3.08Å; R617-K620 PolarHBondContact O-N 3.48Å; L618-K620 PolarHBondContact O-N 3.33Å; K620-K623 PolarHBondContact O-N 2.99Å; K620-Q624 PolarHBondContact O-N 3.45Å
621	A	57.8	Low	52	Low	62 Å²	62	133.3 Å²	133.3	51%	0.512	68%	0.682	S	S	.	*	H	α-helix	trans	-68.5	-41.3	170.3	0	0	0	0	0	111.5	R617 L618 K623 Q624	R617-A621 WeakPolarHBondContact O-CB 3.22Å; R617-A621 PolarHBondContact O-N 3.35Å; L618-A621 PolarHBondContact O-N 3.46Å; A621-K623 PolarHBondContact O-N 2.83Å; A621-Q624 CarbonylContact O-C 3.59Å; A621-Q624 PolarHBondContact O-N 3.31Å; A621-Q624 VanDerWaalsContact O-N 3.1Å
622	E	54	Low	51.9	Low	163 Å²	163	135.6 Å²	135.6	76%	0.762	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-21.3	176.8	-160.4	178.9	-158.4	0	0	113.1	L618	L618-E622 VanDerWaalsContact O-CB 3.32Å; L618-E622 WeakPolarHBondContact O-CB 3.33Å; L618-E622 PolarHBondContact O-N 3.01Å
623	K	53.5	Low	51.2	Low	173 Å²	173	134.2 Å²	134.2	75%	0.752	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-15.3	173.8	-85.8	-176	173.6	-171.1	0	114.1	R619 K620 A621	R619-K623 WeakPolarHBondContact O-CG 3.4Å; K620-K623 PolarHBondContact O-N 2.99Å; A621-K623 PolarHBondContact O-N 2.83Å
624	Q	42.6	Very low	50.5	Low	150 Å²	150	129.1 Å²	129.1	70%	0.701	67%	0.674	S	S	*	*	S	Bend	trans	-109.2	77.8	171.8	-69.2	-166.5	-23.3	0	0	106.3	K620 A621 E626	K620-Q624 PolarHBondContact O-N 3.45Å; A621-Q624 CarbonylContact O-C 3.59Å; A621-Q624 PolarHBondContact O-N 3.31Å; A621-Q624 VanDerWaalsContact O-N 3.1Å; Q624-E626 PolarHBondContact O-N 2.85Å
625	G	45.6	Very low	49.6	Very low	75 Å²	75	127.2 Å²	127.2	77%	0.773	68%	0.676	S	S	*	*			trans	-64.5	96.3	-177	0	0	0	0	0	111.5
626	E	34.3	Very low	48.5	Very low	189 Å²	189	126 Å²	126	88%	0.883	68%	0.681	S	S	*	*	S	Bend	trans	-145.5	119.7	157.5	-69	-169.6	159.7	0	0	109	Q624	Q624-E626 PolarHBondContact O-N 2.85Å
627	G	37.6	Very low	47.3	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	69%	0.693	S	S	*	*			trans	46.1	89.9	157.8	0	0	0	0	0	119.9	D629	G627-D629 VanDerWaalsContact C-N 3.34Å; G627-D629 PolarHBondContact O-N 3.1Å
628	A	42.3	Very low	46	Very low	80 Å²	80	123.9 Å²	123.9	66%	0.661	69%	0.689	S	S	*	*	S	Bend	trans	-84.5	3.3	175.1	0	0	0	0	0	115.2
629	D	41.8	Very low	44.7	Very low	138 Å²	138	124.7 Å²	124.7	74%	0.738	70%	0.698	S	S	*	*	S	Bend	trans	-103.3	-15.8	-170.2	-63.3	-35.4	0	0	0	114.8	G627	G627-D629 VanDerWaalsContact C-N 3.34Å; G627-D629 PolarHBondContact O-N 3.1Å
630	E	39.1	Very low	43.2	Very low	175 Å²	175	124.4 Å²	124.4	82%	0.818	71%	0.71	S	S	*	*	S	Bend	trans	-93.8	-20.4	-179.9	-77.4	-179	158.9	0	0	114.5
631	A	41	Very low	41.6	Very low	71 Å²	71	121.8 Å²	121.8	59%	0.587	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-16.6	-177.9	0	0	0	0	0	114.3
632	V	50.9	Low	40.3	Very low	95 Å²	95	125.4 Å²	125.4	58%	0.576	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-24.9	-178.2	-167.4	0	0	0	0	111.4
633	Q	42.8	Very low	39.2	Very low	150 Å²	150	126.8 Å²	126.8	70%	0.701	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-34.7	174.5	-87.5	176.5	-13.6	0	0	113.3	L635	Q633-L635 VanDerWaalsContact C-N 3.27Å; Q633-L635 PolarHBondContact O-N 3.24Å
634	A	41.2	Very low	38.1	Very low	71 Å²	71	128.2 Å²	128.2	59%	0.587	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-9.6	-179.4	0	0	0	0	0	115.2
635	L	40.1	Very low	37.4	Very low	129 Å²	129	124.4 Å²	124.4	68%	0.675	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-16.1	-179.7	-88.4	161.9	0	0	0	113.9	Q633	Q633-L635 VanDerWaalsContact C-N 3.27Å; Q633-L635 PolarHBondContact O-N 3.24Å
636	N	41	Very low	36.6	Very low	127 Å²	127	128.4 Å²	128.4	68%	0.679	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-16.1	178.4	-70.3	-22.1	0	0	0	113
637	E	35.8	Very low	36.4	Very low	180 Å²	180	127.5 Å²	127.5	84%	0.841	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-2	-180	-91.5	179.1	162.8	0	0	114.9
638	A	37.7	Very low	36	Very low	78 Å²	78	130.6 Å²	130.6	65%	0.645	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	9.2	-175.2	0	0	0	0	0	115.1
639	V	35.1	Very low	35.5	Very low	126 Å²	126	134.1 Å²	134.1	76%	0.764	75%	0.747	S	S	*	*	S	Bend	trans	-120	-4	-175.8	-171.7	0	0	0	0	113.4	S641	V639-S641 PolarHBondContact O-N 2.88Å
640	D	30.6	Very low	35	Very low	164 Å²	164	134.9 Å²	134.9	88%	0.877	75%	0.75	S	S	*	*	S	Bend	trans	-99.6	32.4	-178.9	-152.7	24.1	0	0	0	114.2
641	S	28.6	Very low	34.9	Very low	90 Å²	90	131.9 Å²	131.9	63%	0.629	75%	0.746	S	S	*	*	S	Bend	trans	-141.8	117.6	171.8	64.5	0	0	0	0	111.4	V639	V639-S641 PolarHBondContact O-N 2.88Å
642	T	29.8	Very low	34.4	Very low	138 Å²	138	137.4 Å²	137.4	85%	0.847	76%	0.756	S	S	*	*			trans	89	70.4	163.3	77.6	0	0	0	0	117.6
643	E	31.9	Very low	33.4	Very low	191 Å²	191	142.1 Å²	142.1	89%	0.893	77%	0.769	S	S	*	*			trans	-91.9	126	131.7	-72.7	-176.8	164.4	0	0	107.8
644	E	30.3	Very low	32.8	Very low	203 Å²	203	143.5 Å²	143.5	95%	0.949	78%	0.775	S	S	*	*			trans	140.2	121.7	154.1	-76.7	-171	-175.1	0	0	112.7
645	G	27.8	Very low	32.1	Very low	70 Å²	70	149.7 Å²	149.7	72%	0.722	79%	0.789	S	S	*	*			trans	123.1	86.5	159.3	0	0	0	0	0	117.9
646	D	28.4	Very low	31.5	Very low	159 Å²	159	155.5 Å²	155.5	85%	0.85	80%	0.802	S	S	*	*			trans	46.1	136.2	132.8	-58.7	-26.5	0	0	0	125.4
647	E	29.8	Very low	30.8	Very low	170 Å²	170	156.7 Å²	156.7	79%	0.794	80%	0.801	S	S	*	*			trans	66.1	110.8	143.4	-70.4	-172.5	161.7	0	0	124
648	I	30.7	Very low	30.4	Very low	138 Å²	138	156.4 Å²	156.4	71%	0.708	81%	0.805	S	S	*	*			trans	52.3	107.8	135.3	-34.7	173.6	0	0	0	120.9
649	L	31	Very low	29.9	Very low	153 Å²	153	159.5 Å²	159.5	80%	0.801	81%	0.806	S	S	*	*				147	113.6	124	-77.5	178.8	0	0	0	114.5
650	L	32.4	Very low	29.6	Very low	155 Å²	155	161.7 Å²	161.7	81%	0.812	81%	0.808	S	S	*	*			trans	5.1	149.4	143.2	-71.3	172.1	0	0	0	119.9
651	P	36.6	Very low	29.3	Very low	111 Å²	111	162.9 Å²	162.9	72%	0.721	81%	0.808	S	S	*	*				-157.9	155.9	66.3	38	-14.6	0	0	0	121.7
652	K	30.7	Very low	29.2	Very low	187 Å²	187	164.9 Å²	164.9	81%	0.813	82%	0.816	S	S	*	*			trans	67.2	116.1	142.1	-72	172	-179.6	173.3	0	120.8
653	K	29.3	Very low	29.1	Very low	194 Å²	194	167.5 Å²	167.5	84%	0.843	82%	0.819	S	S	*	*				171.9	121.1	102.3	-95.5	176.8	-171.9	173.4	0	113.8
654	Q	29.4	Very low	28.9	Very low	179 Å²	179	167.3 Å²	167.3	84%	0.836	82%	0.818	S	S	*	*			trans	127	89.1	141.1	-70.7	-175.8	1.5	0	0	118.4
655	K	27.4	Very low	28.6	Very low	201 Å²	201	164.4 Å²	164.4	87%	0.874	82%	0.815	S	S	*	*				55.2	102.1	126.9	-65.1	-172.8	176.6	-177.1	0	119.4
656	R	27.3	Very low	28.5	Very low	251 Å²	251	166 Å²	166	95%	0.947	82%	0.821	S	S	*	*			trans	-81.1	133.7	143.6	-69.5	177.8	169.9	-177.6	-3	109.9
657	K	26.6	Very low	28.4	Very low	152 Å²	152	166.8 Å²	166.8	66%	0.661	82%	0.82	S	S	*	*			trans	-158.1	123	159.4	-93.7	-176.6	170.6	-167.8	0	103.5	E659	K657-E659 HydrophobicContact CB-CG 4.39Å; K657-E659 HydrophobicContact CD-CG 3.91Å; K657-E659 WeakPolarHBondContact CD-OE1 3.32Å; K657-E659 WeakPolarHBondContact CE-OE1 3.47Å; K657-E659 HydrophobicContact CG-CG 4.15Å; K657-E659 IonicContact NZ-OE1 2.85Å; K657-E659 PolarHBondContact NZ-OE1 3.25Å
658	L	26.7	Very low	28.4	Very low	175 Å²	175	167 Å²	167	92%	0.916	82%	0.821	S	S	*	*			cis	42.7	85.8	23	-88.1	165	0	0	0	112.9
659	E	28.3	Very low	28.2	Very low	142 Å²	142	166.6 Å²	166.6	66%	0.664	82%	0.824	S	S	*	*			trans	-132.4	111.5	156.4	-81.8	-177.6	161	0	0	108.1	K657	K657-E659 HydrophobicContact CB-CG 4.39Å; K657-E659 HydrophobicContact CD-CG 3.91Å; K657-E659 WeakPolarHBondContact CD-OE1 3.32Å; K657-E659 WeakPolarHBondContact CE-OE1 3.47Å; K657-E659 HydrophobicContact CG-CG 4.15Å; K657-E659 IonicContact NZ-OE1 2.85Å; K657-E659 PolarHBondContact NZ-OE1 3.25Å
660	E	27.2	Very low	28	Very low	173 Å²	173	163.5 Å²	163.5	81%	0.808	82%	0.821	S	S	*	*			trans	-68.3	146.3	140.7	-74.9	-176.5	147.1	0	0	109.4
661	Q	26.1	Very low	27.8	Very low	189 Å²	189	163.1 Å²	163.1	88%	0.883	82%	0.819	S	S	*	*			trans	-9.2	118.6	153.4	-58.7	170.9	29.4	0	0	116
662	T	25.4	Very low	27.4	Very low	131 Å²	131	164.6 Å²	164.6	80%	0.804	82%	0.817	S	S	*	*			trans	-103.5	115.5	149.3	51.1	0	0	0	0	108.4
663	Q	27.9	Very low	27.3	Very low	194 Å²	194	162.8 Å²	162.8	91%	0.907	81%	0.811	S	S	*	*			trans	-107.6	111.7	145.9	-77.4	-175.2	-34.5	0	0	105.4
664	E	26.8	Very low	27.2	Very low	186 Å²	186	160.9 Å²	160.9	87%	0.869	81%	0.81	S	S	*	*			trans	-117	135.2	158.5	-78.3	-177.3	176.4	0	0	107.9
665	T	25.5	Very low	27	Very low	143 Å²	143	156 Å²	156	88%	0.877	81%	0.808	S	S	*	*			trans	-71.2	139.7	168.9	45.3	0	0	0	0	110.4
666	A	25.8	Very low	27	Very low	103 Å²	103	150 Å²	150	85%	0.851	80%	0.803	S	S	*	*			trans	-154.5	115.4	148.2	0	0	0	0	0	109.3
667	E	25.6	Very low	27.1	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.822	80%	0.798	S	S	*	*			trans	-86.6	167.4	161	-77.1	-176.7	149.9	0	0	110.4
668	Q	30.4	Very low	27.3	Very low	175 Å²	175	145.8 Å²	145.8	82%	0.818	80%	0.801	S	S	*	*			trans	98.7	133.7	160.3	-53.5	-171.8	5.3	0	0	116.3
669	V	26.2	Very low	27.4	Very low	128 Å²	128	148.4 Å²	148.4	78%	0.776	80%	0.799	S	S	*	*			cis	-167.6	162.4	0.9	132.9	0	0	0	0	108
670	A	26.5	Very low	27.8	Very low	89 Å²	89	147.4 Å²	147.4	74%	0.736	80%	0.802	S	S	*	*			trans	83.4	137.7	160.5	0	0	0	0	0	119.1
671	D	27.9	Very low	28.1	Very low	146 Å²	146	148.2 Å²	148.2	78%	0.781	81%	0.806	S	S	*	*			cis	-165.3	161.8	-12.2	-146.7	-18.9	0	0	0	109.1
672	E	29	Very low	28.4	Very low	143 Å²	143	151 Å²	151	67%	0.668	81%	0.809	S	S	*	*			trans	75	123.5	153.3	-68.1	-145	165.1	0	0	126.1
673	Q	28.6	Very low	29	Very low	149 Å²	149	150.1 Å²	150.1	70%	0.696	81%	0.805	S	S	*	*			trans	101.7	112.4	136.1	-73.9	178.7	35.6	0	0	123.1
674	N	26.9	Very low	29.3	Very low	153 Å²	153	145.6 Å²	145.6	82%	0.818	80%	0.801	S	S	*	*			trans	71.7	118.3	135.8	-77.1	-33.9	0	0	0	122.6
675	G	25.1	Very low	29.6	Very low	76 Å²	76	148.3 Å²	148.3	78%	0.784	80%	0.803	S	S	*	*				90.7	108.2	113.2	0	0	0	0	0	119.1
676	G	26.3	Very low	30.1	Very low	75 Å²	75	148.2 Å²	148.2	77%	0.773	80%	0.802	S	S	*	*				65.3	123.9	126.8	0	0	0	0	0	121.6
677	E	30.9	Very low	30.6	Very low	179 Å²	179	152.7 Å²	152.7	84%	0.836	80%	0.802	S	S	*	*			trans	93.6	109.8	146	-55.9	-166.3	155.5	0	0	120.9
678	N	30.2	Very low	31.1	Very low	136 Å²	136	153.4 Å²	153.4	73%	0.727	80%	0.803	S	S	*	*				40.5	113	124.5	-55.4	-34.4	0	0	0	119.6
679	R	29.6	Very low	31.4	Very low	231 Å²	231	151.1 Å²	151.1	87%	0.872	80%	0.803	S	S	*	*				157.6	126	114.1	-88.3	168.6	175	177.2	-0.8	112.3
680	T	35.7	Very low	31.7	Very low	121 Å²	121	156.6 Å²	156.6	74%	0.742	81%	0.81	S	S	*	*			trans	25.9	136.1	139.3	55.7	0	0	0	0	120.8
681	E	34	Very low	31.9	Very low	190 Å²	190	164.5 Å²	164.5	89%	0.888	82%	0.82	S	S	*	*			trans	95.5	92.8	161.8	-51.6	-170.2	-177.1	0	0	116.6
682	R	32.5	Very low	32.3	Very low	248 Å²	248	162.8 Å²	162.8	94%	0.936	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-101.6	129.8	161	-85	-176	166.6	-170.1	-3.5	110.3
683	P	38.4	Very low	32.9	Very low	112 Å²	112	160.2 Å²	160.2	73%	0.727	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-72.4	148.8	176.4	29.4	-33.3	0	0	0	112.1	W685	P683-W685 PolarHBondContact O-N 3.24Å
684	A	34.1	Very low	33.2	Very low	99 Å²	99	156.3 Å²	156.3	82%	0.818	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-65.6	120.5	-175.5	0	0	0	0	0	112.8
685	W	32	Very low	33.5	Very low	242 Å²	242	160.3 Å²	160.3	92%	0.917	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-90.3	125	164.2	-80.8	7.7	0	0	0	111.1	P683 K687	P683-W685 PolarHBondContact O-N 3.24Å; W685-K687 PolarHBondContact O-N 3.42Å
686	V	36.9	Very low	33.9	Very low	141 Å²	141	162.9 Å²	162.9	86%	0.855	84%	0.838	S	S	*	*			trans	-68	108.3	174.7	177.8	0	0	0	0	109.1	K688	V686-K688 PolarHBondContact O-N 3.26Å
687	K	36.3	Very low	34.4	Very low	197 Å²	197	168 Å²	168	86%	0.857	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-73.3	118.8	172.2	-70.3	-176.8	177.5	-179.9	0	110.1	W685	W685-K687 PolarHBondContact O-N 3.42Å
688	K	36.5	Very low	34.7	Very low	191 Å²	191	165.1 Å²	165.1	83%	0.83	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-62	138.8	164.4	-66.1	178.9	179.8	176.4	0	109.5	V686 R690	V686-K688 PolarHBondContact O-N 3.26Å; K688-R690 PolarHBondContact O-N 3.08Å
689	P	35.3	Very low	35.3	Very low	127 Å²	127	161.4 Å²	161.4	83%	0.825	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-76.5	124.8	178.6	29	-30.9	0	0	0	111.1
690	R	33	Very low	36.1	Very low	244 Å²	244	156.5 Å²	156.5	92%	0.921	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-70	130.9	167.7	-63.8	175.3	83.9	154	2.1	108.9	K688 S692	K688-R690 PolarHBondContact O-N 3.08Å; R690-S692 PolarHBondContact O-N 3.32Å
691	R	31	Very low	37.2	Very low	254 Å²	254	157 Å²	157	96%	0.958	82%	0.815	S	S	*	*			trans	-76.5	103.9	169.4	-76.2	-178.8	166	-167.2	-3.2	108.8
692	S	36.2	Very low	38.7	Very low	111 Å²	111	149.3 Å²	149.3	78%	0.776	79%	0.786	S	S	*	*			trans	-84.9	116.7	164.3	57.4	0	0	0	0	109.1	R690 G694	R690-S692 PolarHBondContact O-N 3.32Å; S692-G694 PolarHBondContact O-N 3.25Å
693	G	42.3	Very low	40.8	Very low	88 Å²	88	137.6 Å²	137.6	91%	0.907	74%	0.742	S	S	*	*			trans	-62.5	118.6	161.7	0	0	0	0	0	109.4
694	G	33.8	Very low	42.8	Very low	68 Å²	68	137.5 Å²	137.5	70%	0.701	73%	0.73	S	S	*	*			trans	-171	127.9	177.3	0	0	0	0	0	109.1	S692	S692-G694 PolarHBondContact O-N 3.25Å
695	R	33.5	Very low	44.8	Very low	237 Å²	237	135.9 Å²	135.9	89%	0.894	71%	0.707	S	S	*	*			trans	-38	143.1	-178	-76.3	175.1	169.6	-169.4	-3.2	113.5	K697	R695-K697 PolarHBondContact O-N 3.23Å
696	P	34.3	Very low	46.9	Very low	129 Å²	129	128.3 Å²	128.3	84%	0.838	70%	0.704	S	S	*	*			trans	-68	101.2	172.9	29.1	-31.2	0	0	0	109	S698	P696-S698 PolarHBondContact O-N 3.25Å
697	K	35.4	Very low	48.7	Very low	183 Å²	183	125.1 Å²	125.1	80%	0.796	70%	0.699	S	S	*	*			trans	-65.8	104.5	165.2	-75.7	-176.9	179.5	177.4	0	107.5	R695 G699	R695-K697 PolarHBondContact O-N 3.23Å; K697-G699 PolarHBondContact O-N 3.33Å
698	S	36.8	Very low	50.6	Low	118 Å²	118	124.9 Å²	124.9	83%	0.825	69%	0.693	S	S	*	*			trans	-49.3	119.6	171.8	52.6	0	0	0	0	111.5	P696	P696-S698 PolarHBondContact O-N 3.25Å
699	G	44.6	Very low	52.8	Low	59 Å²	59	122.1 Å²	122.1	61%	0.608	68%	0.683	S	S	*	*			trans	82.4	47.8	147.6	0	0	0	0	0	118.8	K697 K701	K697-G699 PolarHBondContact O-N 3.33Å; G699-K701 PolarHBondContact O-N 3.09Å
700	I	46.2	Very low	55.1	Low	127 Å²	127	118.9 Å²	118.9	65%	0.651	66%	0.656	S	S	*	*			trans	-90.7	74.9	167.2	-48.2	173.1	0	0	0	109.7	G702	I700-G702 PolarHBondContact O-N 2.95Å
701	K	58.9	Low	57.6	Low	133 Å²	133	109.8 Å²	109.8	58%	0.578	63%	0.63	S	S	*	*			trans	-79.2	104.3	163.6	-68.7	-176.6	-176.5	175	0	108.5	G699 R712 Y726	G699-K701 PolarHBondContact O-N 3.09Å; K701-R712 PolarHBondContact O-NE 3.22Å; K701-Y726 HydrophobicContact CB-CE2 4.02Å; K701-Y726 HydrophobicContact CD-CE2 4.37Å; K701-Y726 VanDerWaalsContact CD-OH 3.31Å; K701-Y726 WeakPolarHBondContact CD-OH 3.33Å
702	G	64.3	Low	60	Low	27 Å²	27	101 Å²	101	28%	0.278	60%	0.597	S	S	.	*			trans	-66.3	162.5	174.1	0	0	0	0	0	112.7	I700 F710	I700-G702 PolarHBondContact O-N 2.95Å; G702-F710 WeakPolarHBondContact CA-O 3.31Å
703	V	78.2	Confident	62.1	Low	2 Å²	2	103.5 Å²	103.5	1%	0.012	60%	0.596	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.4	131.1	177.9	178.1	0	0	0	0	108.1	I705 F710 L715 L725 Y726	V703-I705 HydrophobicContact CG1-CD1 4.45Å; V703-I705 HydrophobicContact CG1-CG1 4.11Å; V703-F710 PolarHBondContact N-O 2.88Å; V703-F710 PolarHBondContact O-N 3.38Å; V703-L715 HydrophobicContact CB-CD1 3.79Å; V703-L715 HydrophobicContact CG1-CD1 4.34Å; V703-L715 HydrophobicContact CG2-CD1 4.13Å; V703-L725 HydrophobicContact CG1-CB 3.73Å; V703-Y726 HydrophobicContact CG2-CD2 4.46Å
704	K	78.7	Confident	63.9	Low	110 Å²	110	106 Å²	106	48%	0.478	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.7	123.7	177	-52.2	-164.5	-178.4	-151.3	0	110.7	R708 E709 Q729	K704-R708 WeakPolarHBondContact CA-O 3.33Å; K704-E709 HydrophobicContact CD-CG 4.25Å; K704-E709 WeakPolarHBondContact CE-OE1 3.47Å; K704-E709 HydrophobicContact CG-CG 4.07Å; K704-E709 IonicContact NZ-OE1 2.68Å; K704-E709 PolarHBondContact NZ-OE1 3.03Å; K704-Q729 VanDerWaalsContact CB-NE2 3.34Å
705	I	76.4	Confident	66.3	Low	65 Å²	65	103 Å²	103	33%	0.333	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	124.3	174.9	-53.8	177.2	0	0	0	106.7	V703 G707 R708 F710 L715 L725	V703-I705 HydrophobicContact CG1-CD1 4.45Å; V703-I705 HydrophobicContact CG1-CG1 4.11Å; I705-G707 VanDerWaalsContact C-N 3.29Å; I705-G707 PolarHBondContact O-N 3.26Å; I705-R708 PolarHBondContact N-O 3.37Å; I705-R708 PolarHBondContact O-N 3.21Å; I705-F710 HydrophobicContact CB-CD2 4.08Å; I705-F710 HydrophobicContact CB-CE2 4.13Å; I705-F710 HydrophobicContact CG1-CD2 4.45Å; I705-L715 HydrophobicContact CD1-CD1 4.42Å; I705-L715 HydrophobicContact CD1-CD2 3.73Å; I705-L725 HydrophobicContact CD1-CD1 4Å
706	G	75.6	Confident	68.7	Low	84 Å²	84	99.3 Å²	99.3	87%	0.866	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	32.5	179.1	0	0	0	0	0	114.9	R708	G706-R708 VanDerWaalsContact C-N 3.27Å; G706-R708 PolarHBondContact O-N 3Å
707	G	74.9	Confident	71.2	Confident	73 Å²	73	97.3 Å²	97.3	75%	0.753	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-6.6	179.7	0	0	0	0	0	115.5	I705	I705-G707 VanDerWaalsContact C-N 3.29Å; I705-G707 PolarHBondContact O-N 3.26Å
708	R	76.3	Confident	73.6	Confident	193 Å²	193	96 Å²	96	73%	0.728	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	146	176.1	-63.5	-177.7	-176.4	-132.1	1.8	111.4	K704 I705 G706 F710	K704-R708 WeakPolarHBondContact CA-O 3.33Å; I705-R708 PolarHBondContact N-O 3.37Å; I705-R708 PolarHBondContact O-N 3.21Å; G706-R708 VanDerWaalsContact C-N 3.27Å; G706-R708 PolarHBondContact O-N 3Å; R708-F710 HydrophobicContact CB-CE2 4Å; R708-F710 HydrophobicContact CB-CZ 4.33Å
709	E	83.9	Confident	75.8	Confident	132 Å²	132	93.7 Å²	93.7	62%	0.617	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.6	177.7	-47.8	-161.6	163.9	0	0	110.1	K704	K704-E709 HydrophobicContact CD-CG 4.25Å; K704-E709 WeakPolarHBondContact CE-OE1 3.47Å; K704-E709 HydrophobicContact CG-CG 4.07Å; K704-E709 IonicContact NZ-OE1 2.68Å; K704-E709 PolarHBondContact NZ-OE1 3.03Å
710	F	83.2	Confident	77.7	Confident	59 Å²	59	94.8 Å²	94.8	26%	0.259	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.1	175.6	-67.4	-85.9	0	0	0	110.7	G702 V703 I705 R708 L715	G702-F710 WeakPolarHBondContact CA-O 3.31Å; V703-F710 PolarHBondContact N-O 2.88Å; V703-F710 PolarHBondContact O-N 3.38Å; I705-F710 HydrophobicContact CB-CD2 4.08Å; I705-F710 HydrophobicContact CB-CE2 4.13Å; I705-F710 HydrophobicContact CG1-CD2 4.45Å; R708-F710 HydrophobicContact CB-CE2 4Å; R708-F710 HydrophobicContact CB-CZ 4.33Å; F710-L715 HydrophobicContact CB-CD1 4.03Å; F710-L715 HydrophobicContact CB-CD2 3.93Å; F710-L715 HydrophobicContact CB-CG 3.82Å; F710-L715 HydrophobicContact CG-CD2 4.32Å
711	S	85.1	Confident	79.5	Confident	54 Å²	54	94.1 Å²	94.1	38%	0.378	51%	0.506	S	S	.	.			trans	-70.1	150.1	172.4	77.7	0	0	0	0	110.3	H713 R714 L715	S711-H713 VanDerWaalsContact C-N 3.26Å; S711-H713 PolarHBondContact O-N 2.68Å; S711-R714 PolarHBondContact O-N 3.26Å; S711-R714 WeakPolarHBondContact OG-CB 3.44Å; S711-R714 PolarHBondContact OG-N 3.29Å; S711-L715 PolarHBondContact O-N 3.32Å; S711-L715 VanDerWaalsContact O-N 3.09Å
712	R	81.5	Confident	80.7	Confident	70 Å²	70	88.8 Å²	88.8	26%	0.264	49%	0.485	S	S	.	.	H	α-helix	trans	-62.2	-34.6	-179.3	-62.8	-171.3	170.2	179.1	-6.9	112.6	K701 K716 P722	K701-R712 PolarHBondContact O-NE 3.22Å; R712-K716 WeakPolarHBondContact O-CB 3.15Å; R712-K716 PolarHBondContact O-N 3.49Å; R712-P722 HydrophobicContact CB-CB 3.79Å; R712-P722 HydrophobicContact CB-CG 4.02Å; R712-P722 HydrophobicContact CG-CB 3.83Å; R712-P722 HydrophobicContact CG-CG 4.42Å
713	H	80.3	Confident	81.6	Confident	162 Å²	162	96.1 Å²	96.1	75%	0.75	50%	0.504	S	S	*	.	H	α-helix	trans	-67.2	-42.3	176.8	-73.9	86	0	0	0	111.6	S711 K716 A717	S711-H713 VanDerWaalsContact C-N 3.26Å; S711-H713 PolarHBondContact O-N 2.68Å; H713-K716 PolarHBondContact O-N 3.05Å; H713-A717 PolarHBondContact O-N 2.91Å
714	R	81.3	Confident	81.8	Confident	141 Å²	141	105.6 Å²	105.6	53%	0.532	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-41.5	176.3	-169.7	166.7	-176.6	160.2	2.8	111.6	S711 A717 Y718	S711-R714 PolarHBondContact O-N 3.26Å; S711-R714 WeakPolarHBondContact OG-CB 3.44Å; S711-R714 PolarHBondContact OG-N 3.29Å; R714-A717 WeakPolarHBondContact O-CB 2.88Å; R714-A717 PolarHBondContact O-N 3.21Å; R714-Y718 HydrophobicContact CG-CD2 4.2Å; R714-Y718 HydrophobicContact CG-CE2 3.78Å; R714-Y718 WeakPolarHBondContact O-CD2 3.45Å; R714-Y718 PolarHBondContact O-N 2.93Å
715	L	82.5	Confident	82	Confident	5 Å²	5	101.2 Å²	101.2	3%	0.026	52%	0.522	C	S	.	.	H	α-helix	trans	-65	-38.1	174.9	-69.4	172	0	0	0	112.7	V703 I705 F710 S711 A717 Y718 G719 L720 P722 L725	V703-L715 HydrophobicContact CB-CD1 3.79Å; V703-L715 HydrophobicContact CG1-CD1 4.34Å; V703-L715 HydrophobicContact CG2-CD1 4.13Å; I705-L715 HydrophobicContact CD1-CD1 4.42Å; I705-L715 HydrophobicContact CD1-CD2 3.73Å; F710-L715 HydrophobicContact CB-CD1 4.03Å; F710-L715 HydrophobicContact CB-CD2 3.93Å; F710-L715 HydrophobicContact CB-CG 3.82Å; F710-L715 HydrophobicContact CG-CD2 4.32Å; S711-L715 PolarHBondContact O-N 3.32Å; S711-L715 VanDerWaalsContact O-N 3.09Å; L715-A717 VanDerWaalsContact C-N 3.32Å; L715-Y718 CarbonylContact O-C 3.57Å; L715-Y718 PolarHBondContact O-N 3.21Å; L715-G719 PolarHBondContact O-N 3.42Å; L715-L720 CarbonylContact C-O 3.39Å; L715-L720 HydrophobicContact CB-CB 4.38Å; L715-L720 HydrophobicContact CD2-CD1 4.3Å; L715-L720 WeakPolarHBondContact O-CB 3.08Å; L715-L720 PolarHBondContact O-N 3.17Å; L715-P722 HydrophobicContact CB-CB 4.37Å; L715-P722 HydrophobicContact CD1-CB 4.33Å; L715-L725 HydrophobicContact CD1-CD1 4.46Å
716	K	84.6	Confident	82.4	Confident	159 Å²	159	100.2 Å²	100.2	69%	0.691	51%	0.514	S	S	*	.	H	α-helix	trans	-64.6	-37.6	175.1	-165.1	-179.6	-179.9	-170.2	0	111.6	R712 H713 Y718 G719	R712-K716 WeakPolarHBondContact O-CB 3.15Å; R712-K716 PolarHBondContact O-N 3.49Å; H713-K716 PolarHBondContact O-N 3.05Å; K716-Y718 VanDerWaalsContact C-N 3.25Å; K716-Y718 PolarHBondContact O-N 3.07Å; K716-G719 PolarHBondContact O-N 2.99Å
717	A	87.3	Confident	82.7	Confident	87 Å²	87	102.8 Å²	102.8	72%	0.719	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-28.9	174.8	0	0	0	0	0	113.1	H713 R714 L715 G719	H713-A717 PolarHBondContact O-N 2.91Å; R714-A717 WeakPolarHBondContact O-CB 2.88Å; R714-A717 PolarHBondContact O-N 3.21Å; L715-A717 VanDerWaalsContact C-N 3.32Å; A717-G719 VanDerWaalsContact C-N 3.32Å
718	Y	84.8	Confident	83.2	Confident	155 Å²	155	106.4 Å²	106.4	61%	0.608	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	16.5	172.2	-68.2	-71.7	0	0	0	113.5	R714 L715 K716 L720	R714-Y718 HydrophobicContact CG-CD2 4.2Å; R714-Y718 HydrophobicContact CG-CE2 3.78Å; R714-Y718 WeakPolarHBondContact O-CD2 3.45Å; R714-Y718 PolarHBondContact O-N 2.93Å; L715-Y718 CarbonylContact O-C 3.57Å; L715-Y718 PolarHBondContact O-N 3.21Å; K716-Y718 VanDerWaalsContact C-N 3.25Å; K716-Y718 PolarHBondContact O-N 3.07Å; Y718-L720 PolarHBondContact O-N 3.46Å
719	G	83.2	Confident	83.5	Confident	70 Å²	70	99.7 Å²	99.7	72%	0.722	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	9.5	178.8	0	0	0	0	0	115.2	L715 K716 A717	L715-G719 PolarHBondContact O-N 3.42Å; K716-G719 PolarHBondContact O-N 2.99Å; A717-G719 VanDerWaalsContact C-N 3.32Å
720	L	84.3	Confident	83.5	Confident	82 Å²	82	96.7 Å²	96.7	43%	0.429	46%	0.457	S	S	.	.			trans	-95.2	131.1	-177.5	-74.9	153.6	0	0	0	111.3	L715 Y718 P722 L725	L715-L720 CarbonylContact C-O 3.39Å; L715-L720 HydrophobicContact CB-CB 4.38Å; L715-L720 HydrophobicContact CD2-CD1 4.3Å; L715-L720 WeakPolarHBondContact O-CB 3.08Å; L715-L720 PolarHBondContact O-N 3.17Å; Y718-L720 PolarHBondContact O-N 3.46Å; L720-P722 WeakPolarHBondContact O-CD 3.45Å; L720-L725 HydrophobicContact CB-CD1 4.16Å; L720-L725 HydrophobicContact CD2-CD1 4.36Å
721	N	85.4	Confident	83.6	Confident	114 Å²	114	95.4 Å²	95.4	61%	0.61	46%	0.461	S	S	*	.			trans	-74.6	106.6	-179.5	-87.3	-50.9	0	0	0	112.8	R723 R724 L725	N721-R723 PolarHBondContact O-N 3.31Å; N721-R724 HydrophobicContact CB-CB 4.17Å; N721-R724 PolarHBondContact O-N 3.01Å; N721-L725 WeakPolarHBondContact O-CG 3.35Å; N721-L725 PolarHBondContact O-N 3.27Å
722	P	82.4	Confident	83.4	Confident	20 Å²	20	100.9 Å²	100.9	13%	0.13	47%	0.473	C	S	.	.	H	α-helix	trans	-70.8	-32.4	-170.3	27.9	-34.2	0	0	0	113	R712 L715 L720 Y726	R712-P722 HydrophobicContact CB-CB 3.79Å; R712-P722 HydrophobicContact CB-CG 4.02Å; R712-P722 HydrophobicContact CG-CB 3.83Å; R712-P722 HydrophobicContact CG-CG 4.42Å; L715-P722 HydrophobicContact CB-CB 4.37Å; L715-P722 HydrophobicContact CD1-CB 4.33Å; L720-P722 WeakPolarHBondContact O-CD 3.45Å; P722-Y726 WeakPolarHBondContact O-CB 3.38Å; P722-Y726 PolarHBondContact O-N 3.38Å
723	R	83.1	Confident	83.5	Confident	182 Å²	182	102.7 Å²	102.7	69%	0.687	48%	0.484	S	S	*	.	H	α-helix	trans	-65.1	-45.8	176.9	-84.6	-175.3	158.7	-175.9	-3.9	111.8	N721 L725 Y726 F727	N721-R723 PolarHBondContact O-N 3.31Å; R723-L725 VanDerWaalsContact C-N 3.34Å; R723-L725 PolarHBondContact O-N 3.04Å; R723-Y726 WeakPolarHBondContact O-CB 3.14Å; R723-Y726 PolarHBondContact O-N 3.38Å; R723-F727 WeakPolarHBondContact O-CD2 3.47Å; R723-F727 PolarHBondContact O-N 3.46Å; R723-F727 VanDerWaalsContact O-N 3.07Å
724	R	83.4	Confident	83.7	Confident	200 Å²	200	101.5 Å²	101.5	76%	0.755	48%	0.477	S	S	*	.	H	α-helix	trans	-63.8	-40.9	-179.7	-171.3	175	168.5	-166.1	-4.1	111.4	N721 R728	N721-R724 HydrophobicContact CB-CB 4.17Å; N721-R724 PolarHBondContact O-N 3.01Å; R724-R728 WeakPolarHBondContact O-CB 3.5Å; R724-R728 PolarHBondContact O-N 3.46Å
725	L	82.4	Confident	83.8	Confident	19 Å²	19	103.6 Å²	103.6	10%	0.099	49%	0.485	C	S	.	.	H	α-helix	trans	-68.4	-38.3	176.8	-65.4	170.5	0	0	0	112.6	V703 I705 L715 L720 N721 R723 R728 Q729	V703-L725 HydrophobicContact CG1-CB 3.73Å; I705-L725 HydrophobicContact CD1-CD1 4Å; L715-L725 HydrophobicContact CD1-CD1 4.46Å; L720-L725 HydrophobicContact CB-CD1 4.16Å; L720-L725 HydrophobicContact CD2-CD1 4.36Å; N721-L725 WeakPolarHBondContact O-CG 3.35Å; N721-L725 PolarHBondContact O-N 3.27Å; R723-L725 VanDerWaalsContact C-N 3.34Å; R723-L725 PolarHBondContact O-N 3.04Å; L725-R728 VanDerWaalsContact CD2-NH2 3.29Å; L725-R728 PolarHBondContact O-N 3.22Å; L725-Q729 WeakPolarHBondContact O-CB 3.47Å; L725-Q729 PolarHBondContact O-N 3.01Å
726	Y	84.9	Confident	83.9	Confident	44 Å²	44	109.6 Å²	109.6	17%	0.173	51%	0.511	C	S	.	.	H	α-helix	trans	-60.6	-48.5	174.3	-179	-105.7	0	0	0	112.5	K701 V703 P722 R723 R728 Q729 L730	K701-Y726 HydrophobicContact CB-CE2 4.02Å; K701-Y726 HydrophobicContact CD-CE2 4.37Å; K701-Y726 VanDerWaalsContact CD-OH 3.31Å; K701-Y726 WeakPolarHBondContact CD-OH 3.33Å; V703-Y726 HydrophobicContact CG2-CD2 4.46Å; P722-Y726 WeakPolarHBondContact O-CB 3.38Å; P722-Y726 PolarHBondContact O-N 3.38Å; R723-Y726 WeakPolarHBondContact O-CB 3.14Å; R723-Y726 PolarHBondContact O-N 3.38Å; Y726-R728 VanDerWaalsContact C-N 3.34Å; Y726-R728 PolarHBondContact O-N 3.03Å; Y726-Q729 WeakPolarHBondContact O-CB 3.48Å; Y726-Q729 PolarHBondContact O-N 3.18Å; Y726-L730 HydrophobicContact CD1-CD1 3.97Å; Y726-L730 HydrophobicContact CE1-CD1 3.37Å; Y726-L730 HydrophobicContact CE1-CG 4.38Å; Y726-L730 PolarHBondContact O-N 2.99Å
727	F	83.1	Confident	83.9	Confident	137 Å²	137	106.7 Å²	106.7	60%	0.601	50%	0.5	S	S	*	.	H	α-helix	trans	-67	-34.6	177.6	-75.3	-67.3	0	0	0	112.7	R723 Q729 L730 G731	R723-F727 WeakPolarHBondContact O-CD2 3.47Å; R723-F727 PolarHBondContact O-N 3.46Å; R723-F727 VanDerWaalsContact O-N 3.07Å; F727-Q729 VanDerWaalsContact C-N 3.32Å; F727-Q729 PolarHBondContact O-N 3.47Å; F727-L730 HydrophobicContact CD1-CD1 4.38Å; F727-L730 PolarHBondContact O-N 3.25Å; F727-G731 PolarHBondContact O-N 3.46Å
728	R	83.8	Confident	83.8	Confident	149 Å²	149	108.6 Å²	108.6	56%	0.562	49%	0.494	S	S	*	.	H	α-helix	trans	-63	-39	172.5	-167.7	174.7	74.4	176.2	4.1	111.9	R724 L725 Y726 G731 R732	R724-R728 WeakPolarHBondContact O-CB 3.5Å; R724-R728 PolarHBondContact O-N 3.46Å; L725-R728 VanDerWaalsContact CD2-NH2 3.29Å; L725-R728 PolarHBondContact O-N 3.22Å; Y726-R728 VanDerWaalsContact C-N 3.34Å; Y726-R728 PolarHBondContact O-N 3.03Å; R728-G731 PolarHBondContact O-N 3.48Å; R728-R732 WeakPolarHBondContact O-CG 3.47Å; R728-R732 PolarHBondContact O-N 3.48Å; R728-R732 VanDerWaalsContact O-N 3.13Å
729	Q	83.4	Confident	83.8	Confident	53 Å²	53	106.5 Å²	106.5	25%	0.248	49%	0.49	C	S	.	.	H	α-helix	trans	-67.4	-44.2	176.5	-170.3	-178.3	-3.3	0	0	111.8	K704 L725 Y726 F727 G731 R732 H733	K704-Q729 VanDerWaalsContact CB-NE2 3.34Å; L725-Q729 WeakPolarHBondContact O-CB 3.47Å; L725-Q729 PolarHBondContact O-N 3.01Å; Y726-Q729 WeakPolarHBondContact O-CB 3.48Å; Y726-Q729 PolarHBondContact O-N 3.18Å; F727-Q729 VanDerWaalsContact C-N 3.32Å; F727-Q729 PolarHBondContact O-N 3.47Å; Q729-G731 VanDerWaalsContact C-N 3.33Å; Q729-G731 PolarHBondContact O-N 2.94Å; Q729-R732 PolarHBondContact O-N 2.95Å; Q729-H733 PolarHBondContact O-N 3.06Å
730	L	83.7	Confident	83.9	Confident	68 Å²	68	109.9 Å²	109.9	36%	0.356	48%	0.484	S	S	.	.	H	α-helix	trans	-59.4	-42.4	173.7	-88.8	168	0	0	0	112.2	Y726 F727 R732 H733 K734	Y726-L730 HydrophobicContact CD1-CD1 3.97Å; Y726-L730 HydrophobicContact CE1-CD1 3.37Å; Y726-L730 HydrophobicContact CE1-CG 4.38Å; Y726-L730 PolarHBondContact O-N 2.99Å; F727-L730 HydrophobicContact CD1-CD1 4.38Å; F727-L730 PolarHBondContact O-N 3.25Å; L730-R732 PolarHBondContact O-N 3.13Å; L730-H733 PolarHBondContact O-N 3.32Å; L730-K734 PolarHBondContact O-N 3.25Å
731	G	84.6	Confident	83.9	Confident	33 Å²	33	112.9 Å²	112.9	34%	0.34	49%	0.494	S	S	.	.	H	α-helix	trans	-60.5	-41.9	175.8	0	0	0	0	0	112.8	F727 R728 Q729 K734 R735	F727-G731 PolarHBondContact O-N 3.46Å; R728-G731 PolarHBondContact O-N 3.48Å; Q729-G731 VanDerWaalsContact C-N 3.33Å; Q729-G731 PolarHBondContact O-N 2.94Å; G731-K734 PolarHBondContact O-N 3.22Å; G731-R735 WeakPolarHBondContact O-CG 3.46Å; G731-R735 PolarHBondContact O-N 3.4Å
732	R	82.5	Confident	83.7	Confident	168 Å²	168	112.4 Å²	112.4	63%	0.634	49%	0.491	S	S	*	.	H	α-helix	trans	-64.9	-37.8	174.6	-72	-176.4	179.3	-146.4	-0.7	112.4	R728 Q729 L730 R735 K736	R728-R732 WeakPolarHBondContact O-CG 3.47Å; R728-R732 PolarHBondContact O-N 3.48Å; R728-R732 VanDerWaalsContact O-N 3.13Å; Q729-R732 PolarHBondContact O-N 2.95Å; L730-R732 PolarHBondContact O-N 3.13Å; R732-R735 PolarHBondContact O-N 3.37Å; R732-K736 WeakPolarHBondContact O-CG 3.39Å; R732-K736 PolarHBondContact O-N 3.45Å
733	H	82.3	Confident	83.7	Confident	108 Å²	108	118.3 Å²	118.3	50%	0.5	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-46	177.2	-127.9	-85.3	0	0	0	111.7	Q729 L730 R735 K736 E737	Q729-H733 PolarHBondContact O-N 3.06Å; L730-H733 PolarHBondContact O-N 3.32Å; H733-R735 PolarHBondContact O-N 3.21Å; H733-K736 PolarHBondContact O-N 2.94Å; H733-E737 IonicContact ND1-OE1 3.18Å; H733-E737 PolarHBondContact ND1-OE1 3.45Å; H733-E737 WeakPolarHBondContact O-CG 3.44Å; H733-E737 PolarHBondContact O-N 3.31Å
734	K	84.8	Confident	83.5	Confident	138 Å²	138	116 Å²	116	60%	0.6	51%	0.509	S	S	*	.	H	α-helix	trans	-61.3	-41.6	176.1	-73	-173.1	176.4	-171.9	0	112.5	L730 G731 E737 Q738	L730-K734 PolarHBondContact O-N 3.25Å; G731-K734 PolarHBondContact O-N 3.22Å; K734-E737 PolarHBondContact O-N 2.91Å; K734-Q738 WeakPolarHBondContact O-CG 3.47Å; K734-Q738 PolarHBondContact O-N 3.48Å
735	R	83.4	Confident	83.2	Confident	184 Å²	184	113.6 Å²	113.6	69%	0.694	50%	0.504	S	S	*	.	H	α-helix	trans	-63	-44.5	174.9	-74.1	-177.3	-178.1	-177.7	-0.5	112.1	G731 R732 H733 E737 Q738 E739	G731-R735 WeakPolarHBondContact O-CG 3.46Å; G731-R735 PolarHBondContact O-N 3.4Å; R732-R735 PolarHBondContact O-N 3.37Å; H733-R735 PolarHBondContact O-N 3.21Å; R735-E737 VanDerWaalsContact C-N 3.31Å; R735-E737 PolarHBondContact O-N 2.94Å; R735-Q738 PolarHBondContact O-N 2.85Å; R735-E739 WeakPolarHBondContact O-CG 3.31Å; R735-E739 PolarHBondContact O-N 2.93Å
736	K	84.9	Confident	82.8	Confident	132 Å²	132	118.7 Å²	118.7	57%	0.574	53%	0.532	S	S	*	.	H	α-helix	trans	-62.1	-37.1	174.8	-76.2	-174.5	176	-169.7	0	112.7	R732 H733 K740	R732-K736 WeakPolarHBondContact O-CG 3.39Å; R732-K736 PolarHBondContact O-N 3.45Å; H733-K736 PolarHBondContact O-N 2.94Å; K736-K740 WeakPolarHBondContact O-CB 3.44Å; K736-K740 VanDerWaalsContact O-CG 3.24Å; K736-K740 WeakPolarHBondContact O-CG 3.24Å; K736-K740 PolarHBondContact O-N 3.41Å
737	E	84.7	Confident	82.2	Confident	98 Å²	98	124.6 Å²	124.6	46%	0.458	56%	0.561	S	S	.	*	H	α-helix	trans	-68.6	-39	175.4	-76.6	166.2	-156.9	0	0	112	H733 K734 R735 K740 K741	H733-E737 IonicContact ND1-OE1 3.18Å; H733-E737 PolarHBondContact ND1-OE1 3.45Å; H733-E737 WeakPolarHBondContact O-CG 3.44Å; H733-E737 PolarHBondContact O-N 3.31Å; K734-E737 PolarHBondContact O-N 2.91Å; R735-E737 VanDerWaalsContact C-N 3.31Å; R735-E737 PolarHBondContact O-N 2.94Å; E737-K740 PolarHBondContact O-N 3.25Å; E737-K741 VanDerWaalsContact O-CG 3.31Å; E737-K741 WeakPolarHBondContact O-CG 3.32Å; E737-K741 PolarHBondContact O-N 3.02Å
738	Q	84.4	Confident	81.2	Confident	126 Å²	126	126 Å²	126	59%	0.589	57%	0.569	S	S	*	*	H	α-helix	trans	-65.9	-45.1	173.4	-74.4	179.4	-18.6	0	0	111.8	K734 R735 K740 K741 L742	K734-Q738 WeakPolarHBondContact O-CG 3.47Å; K734-Q738 PolarHBondContact O-N 3.48Å; R735-Q738 PolarHBondContact O-N 2.85Å; Q738-K740 VanDerWaalsContact C-N 3.33Å; Q738-K740 PolarHBondContact O-N 3.03Å; Q738-K741 WeakPolarHBondContact O-CB 3.46Å; Q738-K741 PolarHBondContact O-N 2.96Å; Q738-K741 VanDerWaalsContact O-N 3.13Å; Q738-L742 WeakPolarHBondContact O-CG 3.36Å; Q738-L742 PolarHBondContact O-N 3.49Å
739	E	84.6	Confident	79.6	Confident	112 Å²	112	124.4 Å²	124.4	52%	0.523	60%	0.6	S	S	.	*	H	α-helix	trans	-60.7	-40	174	-77.2	174.4	-176.8	0	0	112.2	R735 K741 L742 K743	R735-E739 WeakPolarHBondContact O-CG 3.31Å; R735-E739 PolarHBondContact O-N 2.93Å; E739-K741 VanDerWaalsContact C-N 3.35Å; E739-L742 PolarHBondContact O-N 3.28Å; E739-K743 WeakPolarHBondContact O-CB 3.4Å; E739-K743 WeakPolarHBondContact O-CG 3.48Å; E739-K743 PolarHBondContact O-N 2.83Å
740	K	85.3	Confident	79.4	Confident	140 Å²	140	128 Å²	128	61%	0.609	62%	0.618	S	S	*	*	H	α-helix	trans	-64.1	-39.6	173.5	-77.2	179.9	-176.8	-169.5	0	111.9	K736 E737 Q738 K744	K736-K740 WeakPolarHBondContact O-CB 3.44Å; K736-K740 VanDerWaalsContact O-CG 3.24Å; K736-K740 WeakPolarHBondContact O-CG 3.24Å; K736-K740 PolarHBondContact O-N 3.41Å; E737-K740 PolarHBondContact O-N 3.25Å; Q738-K740 VanDerWaalsContact C-N 3.33Å; Q738-K740 PolarHBondContact O-N 3.03Å; K740-K744 WeakPolarHBondContact O-CB 3.4Å; K740-K744 WeakPolarHBondContact O-CG 3.45Å; K740-K744 PolarHBondContact O-N 3.42Å
741	K	84.4	Confident	79.2	Confident	145 Å²	145	131.2 Å²	131.2	63%	0.63	63%	0.631	S	S	*	*	H	α-helix	trans	-65.5	-39.8	175	-75.2	178	179.9	-172.1	0	111.7	E737 Q738 E739 K745	E737-K741 VanDerWaalsContact O-CG 3.31Å; E737-K741 WeakPolarHBondContact O-CG 3.32Å; E737-K741 PolarHBondContact O-N 3.02Å; Q738-K741 WeakPolarHBondContact O-CB 3.46Å; Q738-K741 PolarHBondContact O-N 2.96Å; Q738-K741 VanDerWaalsContact O-N 3.13Å; E739-K741 VanDerWaalsContact C-N 3.35Å; K741-K745 WeakPolarHBondContact O-CG 3.36Å; K741-K745 PolarHBondContact O-N 3.1Å
742	L	82.6	Confident	78.9	Confident	105 Å²	105	136.6 Å²	136.6	55%	0.55	65%	0.647	S	S	.	*	H	α-helix	trans	-68.2	-41.9	175.8	-69.7	170.4	0	0	0	111.9	Q738 E739 K744 K745 N746	Q738-L742 WeakPolarHBondContact O-CG 3.36Å; Q738-L742 PolarHBondContact O-N 3.49Å; E739-L742 PolarHBondContact O-N 3.28Å; L742-K744 PolarHBondContact O-N 3.35Å; L742-K745 PolarHBondContact O-N 3.08Å; L742-N746 PolarHBondContact O-N 3.5Å; L742-N746 PolarHBondContact O-OD1 3.14Å
743	K	81.5	Confident	78.7	Confident	143 Å²	143	134.8 Å²	134.8	62%	0.622	65%	0.648	S	S	*	*	H	α-helix	trans	-64.5	-37.4	174.8	-75.9	-176.9	177.7	-172.6	0	113	E739 N746 Q747	E739-K743 WeakPolarHBondContact O-CB 3.4Å; E739-K743 WeakPolarHBondContact O-CG 3.48Å; E739-K743 PolarHBondContact O-N 2.83Å; K743-N746 PolarHBondContact O-N 3.13Å; K743-Q747 WeakPolarHBondContact O-CG 3.48Å; K743-Q747 PolarHBondContact O-N 3.38Å; K743-Q747 VanDerWaalsContact O-N 3.14Å
744	K	79.1	Confident	78.5	Confident	134 Å²	134	136.4 Å²	136.4	58%	0.583	66%	0.658	S	S	*	*	H	α-helix	trans	-65.2	-43.3	172.9	-76.5	-175.4	175	-159.2	0	111.7	K740 L742 N746 Q747 E748	K740-K744 WeakPolarHBondContact O-CB 3.4Å; K740-K744 WeakPolarHBondContact O-CG 3.45Å; K740-K744 PolarHBondContact O-N 3.42Å; L742-K744 PolarHBondContact O-N 3.35Å; K744-N746 VanDerWaalsContact C-N 3.3Å; K744-N746 PolarHBondContact O-N 2.85Å; K744-Q747 PolarHBondContact O-N 3.4Å; K744-Q747 VanDerWaalsContact O-N 3.08Å; K744-E748 WeakPolarHBondContact O-CG 3.4Å; K744-E748 PolarHBondContact O-N 2.94Å; K744-E748 VanDerWaalsContact O-N 3.1Å
745	K	77.4	Confident	78.1	Confident	149 Å²	149	136.3 Å²	136.3	65%	0.648	66%	0.661	S	S	*	*	H	α-helix	trans	-61.1	-36.4	174.1	-78.8	-173.6	172	-165.9	0	113.3	K741 L742 Q747 G749	K741-K745 WeakPolarHBondContact O-CG 3.36Å; K741-K745 PolarHBondContact O-N 3.1Å; L742-K745 PolarHBondContact O-N 3.08Å; K745-Q747 VanDerWaalsContact C-N 3.29Å; K745-Q747 PolarHBondContact O-N 3.43Å; K745-G749 PolarHBondContact O-N 3.4Å
746	N	74.6	Confident	77.7	Confident	127 Å²	127	132.9 Å²	132.9	68%	0.679	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-5	176.2	-66.5	2.2	0	0	0	114	L742 K743 K744	L742-N746 PolarHBondContact O-N 3.5Å; L742-N746 PolarHBondContact O-OD1 3.14Å; K743-N746 PolarHBondContact O-N 3.13Å; K744-N746 VanDerWaalsContact C-N 3.3Å; K744-N746 PolarHBondContact O-N 2.85Å
747	Q	70.7	Confident	77.1	Confident	167 Å²	167	133 Å²	133	78%	0.78	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-16.8	172.1	-78.9	-177.4	-23.7	0	0	112.2	K743 K744 K745	K743-Q747 WeakPolarHBondContact O-CG 3.48Å; K743-Q747 PolarHBondContact O-N 3.38Å; K743-Q747 VanDerWaalsContact O-N 3.14Å; K744-Q747 PolarHBondContact O-N 3.4Å; K744-Q747 VanDerWaalsContact O-N 3.08Å; K745-Q747 VanDerWaalsContact C-N 3.29Å; K745-Q747 PolarHBondContact O-N 3.43Å
748	E	63.2	Low	76.5	Confident	166 Å²	166	135.9 Å²	135.9	78%	0.776	68%	0.683	S	S	*	*			trans	-99.4	-5	180	-73.7	173	177.3	0	0	113.2	K744	K744-E748 WeakPolarHBondContact O-CG 3.4Å; K744-E748 PolarHBondContact O-N 2.94Å; K744-E748 VanDerWaalsContact O-N 3.1Å
749	G	50.3	Low	75.8	Confident	117 Å²	117	136.8 Å²	136.8	100%	1.206	69%	0.691	S	S	*	*			trans	-121.7	0	168.6	0	0	0	0	0	109.7	K745	K745-G749 PolarHBondContact O-N 3.4Å

Retrieved 749 of 749 residues in 620.7 ms (Link to these results)

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