A0A087YBA8_POEFO Loading...

Protein phosphatase 1 regulatory subunit 21

AlphaFold DB , UniProt , Accession A0A087YBA8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 785 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	48.1	Very low	68.2	Low	216 Å²	216	114.9 Å²	114.9	100%	1.064	60%	0.602	S	S	*	*				0	-51.9	0	-68	-179.5	-178.5	0	0	112.7	N3 V4	M1-N3 VanDerWaalsContact C-N 3.33Å; M1-N3 PolarHBondContact O-N 3.34Å; M1-V4 WeakPolarHBondContact O-CB 3.42Å; M1-V4 PolarHBondContact O-N 3.08Å
2	A	51.9	Low	69.5	Low	70 Å²	70	110.6 Å²	110.6	58%	0.579	59%	0.588	S	S	*	*	H	α-helix	trans	-42.5	-43.7	-173.2	0	0	0	0	0	117.3	V4 T5 D6	A2-V4 VanDerWaalsContact C-N 3.25Å; A2-V4 PolarHBondContact O-N 3.02Å; A2-T5 WeakPolarHBondContact CA-OG1 3.1Å; A2-T5 PolarHBondContact O-N 2.82Å; A2-T5 PolarHBondContact O-OG1 2.79Å; A2-D6 PolarHBondContact O-N 3.43Å; A2-D6 VanDerWaalsContact O-N 3.07Å
3	N	53.2	Low	70.8	Confident	141 Å²	141	112.2 Å²	112.2	75%	0.754	59%	0.587	S	S	*	*	H	α-helix	trans	-64	-27.2	-179.8	-66.9	12.9	0	0	0	113.6	M1 L7	M1-N3 VanDerWaalsContact C-N 3.33Å; M1-N3 PolarHBondContact O-N 3.34Å; N3-L7 WeakPolarHBondContact O-CB 3.25Å; N3-L7 PolarHBondContact O-N 2.65Å; N3-L7 VanDerWaalsContact O-N 3.1Å
4	V	60.3	Low	71.7	Confident	98 Å²	98	112.4 Å²	112.4	59%	0.594	59%	0.588	S	S	*	*	H	α-helix	trans	-73.8	-46.3	178.6	-176.9	0	0	0	0	110.1	M1 A2 D6 L7 Q8	M1-V4 WeakPolarHBondContact O-CB 3.42Å; M1-V4 PolarHBondContact O-N 3.08Å; A2-V4 VanDerWaalsContact C-N 3.25Å; A2-V4 PolarHBondContact O-N 3.02Å; V4-D6 VanDerWaalsContact C-N 3.34Å; V4-D6 PolarHBondContact O-N 3.46Å; V4-L7 PolarHBondContact O-N 2.73Å; V4-Q8 VanDerWaalsContact O-CB 3.31Å; V4-Q8 WeakPolarHBondContact O-CB 3.19Å; V4-Q8 PolarHBondContact O-N 2.7Å
5	T	66.1	Low	72.6	Confident	84 Å²	84	108.5 Å²	108.5	52%	0.515	58%	0.579	S	S	.	*	H	α-helix	trans	-62.2	-39.1	176.2	37.3	0	0	0	0	112.5	A2 T9	A2-T5 WeakPolarHBondContact CA-OG1 3.1Å; A2-T5 PolarHBondContact O-N 2.82Å; A2-T5 PolarHBondContact O-OG1 2.79Å; T5-T9 WeakPolarHBondContact O-CB 3.48Å; T5-T9 PolarHBondContact O-N 2.86Å; T5-T9 PolarHBondContact O-OG1 2.8Å
6	D	70.8	Confident	73.3	Confident	79 Å²	79	108.6 Å²	108.6	42%	0.422	58%	0.575	S	S	.	*	H	α-helix	trans	-70.3	-40.2	177.6	-179.4	50	0	0	0	112.2	A2 V4 T9 K10	A2-D6 PolarHBondContact O-N 3.43Å; A2-D6 VanDerWaalsContact O-N 3.07Å; V4-D6 VanDerWaalsContact C-N 3.34Å; V4-D6 PolarHBondContact O-N 3.46Å; D6-T9 PolarHBondContact O-N 2.91Å; D6-K10 WeakPolarHBondContact O-CD 3.04Å; D6-K10 WeakPolarHBondContact O-CG 3.34Å; D6-K10 PolarHBondContact O-N 3.35Å; D6-K10 WeakPolarHBondContact OD1-CE 3.42Å; D6-K10 IonicContact OD1-NZ 2.69Å; D6-K10 WeakPolarHBondContact OD2-CE 3.21Å; D6-K10 IonicContact OD2-NZ 3.61Å; D6-K10 PolarHBondContact OD2-NZ 3.32Å
7	L	74	Confident	74.1	Confident	101 Å²	101	107.3 Å²	107.3	53%	0.529	57%	0.565	S	S	.	*	H	α-helix	trans	-63.4	-44.1	172.8	-169	71	0	0	0	111.7	N3 V4 T9 K10 Y11	N3-L7 WeakPolarHBondContact O-CB 3.25Å; N3-L7 PolarHBondContact O-N 2.65Å; N3-L7 VanDerWaalsContact O-N 3.1Å; V4-L7 PolarHBondContact O-N 2.73Å; L7-T9 VanDerWaalsContact C-N 3.32Å; L7-T9 PolarHBondContact O-N 3.45Å; L7-K10 WeakPolarHBondContact O-CB 3.18Å; L7-K10 PolarHBondContact O-N 3.44Å; L7-K10 VanDerWaalsContact O-N 3.15Å; L7-Y11 HydrophobicContact CD1-CE2 4.32Å; L7-Y11 HydrophobicContact CD2-CE2 4.43Å; L7-Y11 HydrophobicContact CG-CD2 4.13Å; L7-Y11 HydrophobicContact CG-CE2 4.08Å; L7-Y11 WeakPolarHBondContact O-CD2 3.04Å; L7-Y11 PolarHBondContact O-N 3.5Å
8	Q	78.3	Confident	74.7	Confident	134 Å²	134	110 Å²	110	63%	0.626	57%	0.567	S	S	*	*	H	α-helix	trans	-65.5	-34.8	178.1	-168.5	167.7	0.5	0	0	112	V4 Y11 S12	V4-Q8 VanDerWaalsContact O-CB 3.31Å; V4-Q8 WeakPolarHBondContact O-CB 3.19Å; V4-Q8 PolarHBondContact O-N 2.7Å; Q8-Y11 PolarHBondContact O-N 3.31Å; Q8-S12 WeakPolarHBondContact O-CB 3.24Å; Q8-S12 PolarHBondContact O-N 3.05Å
9	T	79.6	Confident	75.3	Confident	68 Å²	68	107.9 Å²	107.9	42%	0.417	56%	0.564	S	S	.	*	H	α-helix	trans	-64	-40	171.5	-57.1	0	0	0	0	111.7	T5 D6 L7 S12 K13	T5-T9 WeakPolarHBondContact O-CB 3.48Å; T5-T9 PolarHBondContact O-N 2.86Å; T5-T9 PolarHBondContact O-OG1 2.8Å; D6-T9 PolarHBondContact O-N 2.91Å; L7-T9 VanDerWaalsContact C-N 3.32Å; L7-T9 PolarHBondContact O-N 3.45Å; T9-S12 PolarHBondContact O-N 2.75Å; T9-K13 WeakPolarHBondContact O-CG 3.19Å; T9-K13 PolarHBondContact O-N 2.66Å
10	K	82.6	Confident	75.9	Confident	117 Å²	117	107.9 Å²	107.9	51%	0.509	56%	0.558	S	S	.	*	H	α-helix	trans	-66.5	-42.9	175.8	-71.8	160.7	-178.9	170.4	0	112	D6 L7 K13 L14	D6-K10 WeakPolarHBondContact O-CD 3.04Å; D6-K10 WeakPolarHBondContact O-CG 3.34Å; D6-K10 PolarHBondContact O-N 3.35Å; D6-K10 WeakPolarHBondContact OD1-CE 3.42Å; D6-K10 IonicContact OD1-NZ 2.69Å; D6-K10 WeakPolarHBondContact OD2-CE 3.21Å; D6-K10 IonicContact OD2-NZ 3.61Å; D6-K10 PolarHBondContact OD2-NZ 3.32Å; L7-K10 WeakPolarHBondContact O-CB 3.18Å; L7-K10 PolarHBondContact O-N 3.44Å; L7-K10 VanDerWaalsContact O-N 3.15Å; K10-K13 PolarHBondContact O-N 3.31Å; K10-L14 WeakPolarHBondContact O-CB 3.08Å; K10-L14 PolarHBondContact O-N 2.67Å
11	Y	85.9	Confident	76.3	Confident	156 Å²	156	107.4 Å²	107.4	61%	0.612	56%	0.556	S	S	*	*	H	α-helix	trans	-61.8	-41.3	172.1	-89.5	-76.9	0	0	0	112.8	L7 Q8 L14 A15	L7-Y11 HydrophobicContact CD1-CE2 4.32Å; L7-Y11 HydrophobicContact CD2-CE2 4.43Å; L7-Y11 HydrophobicContact CG-CD2 4.13Å; L7-Y11 HydrophobicContact CG-CE2 4.08Å; L7-Y11 WeakPolarHBondContact O-CD2 3.04Å; L7-Y11 PolarHBondContact O-N 3.5Å; Q8-Y11 PolarHBondContact O-N 3.31Å; Y11-L14 PolarHBondContact O-N 3.34Å; Y11-A15 WeakPolarHBondContact O-CB 3.14Å; Y11-A15 PolarHBondContact O-N 3.49Å
12	S	82.9	Confident	78.3	Confident	63 Å²	63	105.3 Å²	105.3	44%	0.441	54%	0.537	S	S	.	.	H	α-helix	trans	-61.6	-46.5	176.7	-175.5	0	0	0	0	112	Q8 T9 L14 A15 Q16	Q8-S12 WeakPolarHBondContact O-CB 3.24Å; Q8-S12 PolarHBondContact O-N 3.05Å; T9-S12 PolarHBondContact O-N 2.75Å; S12-L14 PolarHBondContact O-N 2.84Å; S12-A15 PolarHBondContact O-N 2.75Å; S12-Q16 WeakPolarHBondContact O-CG 3.4Å; S12-Q16 PolarHBondContact O-N 2.82Å
13	K	86.8	Confident	80	Confident	132 Å²	132	104.5 Å²	104.5	57%	0.574	53%	0.53	S	S	*	.	H	α-helix	trans	-60.2	-44.1	174.1	-73.2	178.3	178.3	-177.9	0	112.1	T9 K10 A15 Q16 E17	T9-K13 WeakPolarHBondContact O-CG 3.19Å; T9-K13 PolarHBondContact O-N 2.66Å; K10-K13 PolarHBondContact O-N 3.31Å; K13-A15 VanDerWaalsContact C-N 3.34Å; K13-A15 PolarHBondContact O-N 3.3Å; K13-Q16 PolarHBondContact O-N 3.39Å; K13-E17 PolarHBondContact O-N 2.73Å
14	L	83.9	Confident	81.3	Confident	115 Å²	115	103.1 Å²	103.1	60%	0.602	52%	0.519	S	S	*	.	H	α-helix	trans	-62.8	-39.6	177.7	-175	61.5	0	0	0	112.2	K10 Y11 S12 E17 Y18	K10-L14 WeakPolarHBondContact O-CB 3.08Å; K10-L14 PolarHBondContact O-N 2.67Å; Y11-L14 PolarHBondContact O-N 3.34Å; S12-L14 PolarHBondContact O-N 2.84Å; L14-E17 PolarHBondContact O-N 2.8Å; L14-Y18 VanDerWaalsContact O-CB 3.31Å; L14-Y18 WeakPolarHBondContact O-CB 3.49Å; L14-Y18 PolarHBondContact O-N 2.8Å
15	A	84.2	Confident	82.4	Confident	54 Å²	54	102.4 Å²	102.4	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-35.5	174.8	0	0	0	0	0	112.7	Y11 S12 K13 S19	Y11-A15 WeakPolarHBondContact O-CB 3.14Å; Y11-A15 PolarHBondContact O-N 3.49Å; S12-A15 PolarHBondContact O-N 2.75Å; K13-A15 VanDerWaalsContact C-N 3.34Å; K13-A15 PolarHBondContact O-N 3.3Å; A15-S19 WeakPolarHBondContact O-CB 3.48Å; A15-S19 PolarHBondContact O-N 2.93Å; A15-S19 PolarHBondContact O-OG 3.41Å
16	Q	84.1	Confident	83.3	Confident	110 Å²	110	105.2 Å²	105.2	51%	0.514	52%	0.519	S	S	.	.	H	α-helix	trans	-66.8	-47.4	173.2	-73.1	179.5	-9.1	0	0	111.9	S12 K13 S19 K20	S12-Q16 WeakPolarHBondContact O-CG 3.4Å; S12-Q16 PolarHBondContact O-N 2.82Å; K13-Q16 PolarHBondContact O-N 3.39Å; Q16-S19 WeakPolarHBondContact O-CB 3.21Å; Q16-S19 PolarHBondContact O-N 3.24Å; Q16-S19 VanDerWaalsContact O-N 3.16Å; Q16-K20 WeakPolarHBondContact O-CG 3.18Å; Q16-K20 PolarHBondContact O-N 3.48Å
17	E	87.3	Confident	84.1	Confident	86 Å²	86	106.4 Å²	106.4	40%	0.402	53%	0.529	S	S	.	.	H	α-helix	trans	-64.4	-40.2	176.7	-64.7	-48.1	132.1	0	0	112.2	K13 L14 S19 K20 L21	K13-E17 PolarHBondContact O-N 2.73Å; L14-E17 PolarHBondContact O-N 2.8Å; E17-S19 VanDerWaalsContact C-N 3.28Å; E17-S19 PolarHBondContact O-N 2.79Å; E17-K20 PolarHBondContact O-N 3.28Å; E17-K20 IonicContact OE1-NZ 3.81Å; E17-K20 PolarHBondContact OE1-NZ 2.76Å; E17-K20 WeakPolarHBondContact OE2-CD 3.1Å; E17-K20 IonicContact OE2-NZ 3.09Å; E17-K20 PolarHBondContact OE2-NZ 3.46Å; E17-L21 WeakPolarHBondContact O-CB 3.16Å; E17-L21 WeakPolarHBondContact O-CG 3.1Å; E17-L21 PolarHBondContact O-N 3.34Å
18	Y	84.6	Confident	84.5	Confident	156 Å²	156	106.8 Å²	106.8	61%	0.612	53%	0.531	S	S	*	.	H	α-helix	trans	-59.9	-38.5	172.1	-178.3	-105.5	0	0	0	112.2	L14 L21 R22	L14-Y18 VanDerWaalsContact O-CB 3.31Å; L14-Y18 WeakPolarHBondContact O-CB 3.49Å; L14-Y18 PolarHBondContact O-N 2.8Å; Y18-L21 PolarHBondContact O-N 3.41Å; Y18-R22 VanDerWaalsContact O-CB 3.3Å; Y18-R22 WeakPolarHBondContact O-CB 3.22Å; Y18-R22 PolarHBondContact O-N 3.49Å
19	S	85.4	Confident	85	Confident	71 Å²	71	107.1 Å²	107.1	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-68.3	-40.9	176.8	-59.6	0	0	0	0	112.3	A15 Q16 E17 R22 A23	A15-S19 WeakPolarHBondContact O-CB 3.48Å; A15-S19 PolarHBondContact O-N 2.93Å; A15-S19 PolarHBondContact O-OG 3.41Å; Q16-S19 WeakPolarHBondContact O-CB 3.21Å; Q16-S19 PolarHBondContact O-N 3.24Å; Q16-S19 VanDerWaalsContact O-N 3.16Å; E17-S19 VanDerWaalsContact C-N 3.28Å; E17-S19 PolarHBondContact O-N 2.79Å; S19-R22 PolarHBondContact O-N 3.49Å; S19-A23 PolarHBondContact O-N 3.27Å
20	K	87.3	Confident	85.5	Confident	106 Å²	106	109.8 Å²	109.8	46%	0.461	54%	0.536	S	S	.	.	H	α-helix	trans	-61.3	-49.3	172.2	-69.2	170.6	-176.5	173.4	0	111.4	Q16 E17 R22 A23 Q24	Q16-K20 WeakPolarHBondContact O-CG 3.18Å; Q16-K20 PolarHBondContact O-N 3.48Å; E17-K20 PolarHBondContact O-N 3.28Å; E17-K20 IonicContact OE1-NZ 3.81Å; E17-K20 PolarHBondContact OE1-NZ 2.76Å; E17-K20 WeakPolarHBondContact OE2-CD 3.1Å; E17-K20 IonicContact OE2-NZ 3.09Å; E17-K20 PolarHBondContact OE2-NZ 3.46Å; K20-R22 VanDerWaalsContact C-N 3.3Å; K20-R22 PolarHBondContact O-N 3.44Å; K20-A23 PolarHBondContact O-N 2.81Å; K20-Q24 WeakPolarHBondContact O-CG 3.37Å; K20-Q24 PolarHBondContact O-N 2.82Å
21	L	84.6	Confident	85.6	Confident	98 Å²	98	106.8 Å²	106.8	51%	0.513	53%	0.533	S	S	.	.	H	α-helix	trans	-59.3	-40.4	177.7	-79.5	165	0	0	0	111.7	E17 Y18 Q24 N25	E17-L21 WeakPolarHBondContact O-CB 3.16Å; E17-L21 WeakPolarHBondContact O-CG 3.1Å; E17-L21 PolarHBondContact O-N 3.34Å; Y18-L21 PolarHBondContact O-N 3.41Å; L21-Q24 PolarHBondContact O-N 2.85Å; L21-N25 WeakPolarHBondContact O-CB 3.32Å; L21-N25 PolarHBondContact O-N 2.77Å
22	R	89.8	Confident	85.6	Confident	173 Å²	173	103 Å²	103	65%	0.653	53%	0.526	S	S	*	.	H	α-helix	trans	-63.6	-44.1	175.2	-173.6	178.7	-179.4	-171.8	0.9	112.1	Y18 S19 K20 N25 Q26	Y18-R22 VanDerWaalsContact O-CB 3.3Å; Y18-R22 WeakPolarHBondContact O-CB 3.22Å; Y18-R22 PolarHBondContact O-N 3.49Å; S19-R22 PolarHBondContact O-N 3.49Å; K20-R22 VanDerWaalsContact C-N 3.3Å; K20-R22 PolarHBondContact O-N 3.44Å; R22-N25 PolarHBondContact O-N 2.86Å; R22-Q26 PolarHBondContact O-N 2.8Å
23	A	87.5	Confident	86	Confident	52 Å²	52	104.2 Å²	104.2	43%	0.43	53%	0.53	S	S	.	.	H	α-helix	trans	-64.7	-45.1	176.4	0	0	0	0	0	111.9	S19 K20 N25 Q26 V27	S19-A23 PolarHBondContact O-N 3.27Å; K20-A23 PolarHBondContact O-N 2.81Å; A23-N25 VanDerWaalsContact C-N 3.33Å; A23-N25 PolarHBondContact O-N 2.78Å; A23-Q26 WeakPolarHBondContact O-CB 3.45Å; A23-Q26 PolarHBondContact O-N 3.31Å; A23-Q26 VanDerWaalsContact O-N 3.12Å; A23-V27 PolarHBondContact O-N 3.26Å
24	Q	82.4	Confident	86.2	Confident	113 Å²	113	101.3 Å²	101.3	53%	0.528	52%	0.521	S	S	.	.	H	α-helix	trans	-60	-41.8	173.8	-72.2	174.1	-10.9	0	0	111.8	K20 L21 Q26 V27 L28	K20-Q24 WeakPolarHBondContact O-CG 3.37Å; K20-Q24 PolarHBondContact O-N 2.82Å; L21-Q24 PolarHBondContact O-N 2.85Å; Q24-Q26 VanDerWaalsContact C-N 3.29Å; Q24-Q26 PolarHBondContact O-N 2.61Å; Q24-V27 PolarHBondContact O-N 3.39Å; Q24-L28 WeakPolarHBondContact O-CB 3.45Å; Q24-L28 WeakPolarHBondContact O-CG 3.32Å; Q24-L28 PolarHBondContact O-N 2.92Å
25	N	82.5	Confident	86.4	Confident	82 Å²	82	101.5 Å²	101.5	44%	0.439	52%	0.519	S	S	.	.	H	α-helix	trans	-60.7	-37.2	174.2	-121.6	-99	0	0	0	112.4	L21 R22 A23 K29	L21-N25 WeakPolarHBondContact O-CB 3.32Å; L21-N25 PolarHBondContact O-N 2.77Å; R22-N25 PolarHBondContact O-N 2.86Å; A23-N25 VanDerWaalsContact C-N 3.33Å; A23-N25 PolarHBondContact O-N 2.78Å; N25-K29 WeakPolarHBondContact O-CB 3.44Å; N25-K29 VanDerWaalsContact O-CG 3.28Å; N25-K29 WeakPolarHBondContact O-CG 3.35Å; N25-K29 PolarHBondContact O-N 3.2Å
26	Q	84.1	Confident	86.6	Confident	143 Å²	143	105 Å²	105	67%	0.668	53%	0.526	S	S	*	.	H	α-helix	trans	-70	-39.8	178.6	-169.8	169.6	-6.3	0	0	111.9	R22 A23 Q24 K30	R22-Q26 PolarHBondContact O-N 2.8Å; A23-Q26 WeakPolarHBondContact O-CB 3.45Å; A23-Q26 PolarHBondContact O-N 3.31Å; A23-Q26 VanDerWaalsContact O-N 3.12Å; Q24-Q26 VanDerWaalsContact C-N 3.29Å; Q24-Q26 PolarHBondContact O-N 2.61Å; Q26-K30 PolarHBondContact O-N 2.85Å
27	V	87.9	Confident	86.9	Confident	104 Å²	104	102.5 Å²	102.5	63%	0.63	52%	0.524	S	S	*	.	H	α-helix	trans	-65	-46.7	172.6	176.1	0	0	0	0	111.1	A23 Q24 K29 K30 A31	A23-V27 PolarHBondContact O-N 3.26Å; Q24-V27 PolarHBondContact O-N 3.39Å; V27-K29 PolarHBondContact O-N 2.89Å; V27-K30 PolarHBondContact O-N 3.28Å; V27-A31 PolarHBondContact O-N 2.85Å
28	L	83.1	Confident	87	Confident	109 Å²	109	102.6 Å²	102.6	57%	0.571	53%	0.527	S	S	*	.	H	α-helix	trans	-62.2	-42.1	177.9	-74.7	167.4	0	0	0	112.2	Q24 K30 A31 V32	Q24-L28 WeakPolarHBondContact O-CB 3.45Å; Q24-L28 WeakPolarHBondContact O-CG 3.32Å; Q24-L28 PolarHBondContact O-N 2.92Å; L28-K30 VanDerWaalsContact C-N 3.33Å; L28-K30 PolarHBondContact O-N 3.47Å; L28-A31 PolarHBondContact O-N 3.48Å; L28-V32 WeakPolarHBondContact O-CG2 3.21Å; L28-V32 PolarHBondContact O-N 3.37Å
29	K	87.9	Confident	87.2	Confident	141 Å²	141	98.5 Å²	98.5	61%	0.613	52%	0.522	S	S	*	.	H	α-helix	trans	-62.1	-39.8	174.1	-78.5	180	-179.4	-171.2	0	112.2	N25 V27 V32 V33	N25-K29 WeakPolarHBondContact O-CB 3.44Å; N25-K29 VanDerWaalsContact O-CG 3.28Å; N25-K29 WeakPolarHBondContact O-CG 3.35Å; N25-K29 PolarHBondContact O-N 3.2Å; V27-K29 PolarHBondContact O-N 2.89Å; K29-V32 PolarHBondContact O-N 2.86Å; K29-V33 WeakPolarHBondContact O-CG2 3.31Å; K29-V33 PolarHBondContact O-N 2.94Å; K29-V33 VanDerWaalsContact O-N 3.09Å
30	K	90.4	Very high	87.4	Confident	125 Å²	125	97.6 Å²	97.6	54%	0.543	52%	0.518	S	S	.	.	H	α-helix	trans	-63.7	-49.1	174.4	-167.2	-168.9	-176.5	-57.8	0	110.8	Q26 V27 L28 V32 V33 D34	Q26-K30 PolarHBondContact O-N 2.85Å; V27-K30 PolarHBondContact O-N 3.28Å; L28-K30 VanDerWaalsContact C-N 3.33Å; L28-K30 PolarHBondContact O-N 3.47Å; K30-V32 VanDerWaalsContact C-N 3.3Å; K30-V32 PolarHBondContact O-N 2.84Å; K30-V33 PolarHBondContact O-N 2.89Å; K30-V33 VanDerWaalsContact O-N 3.07Å; K30-D34 VanDerWaalsContact NZ-CG 3.25Å; K30-D34 IonicContact NZ-OD1 2.67Å; K30-D34 PolarHBondContact NZ-OD1 2.95Å; K30-D34 IonicContact NZ-OD2 3.39Å; K30-D34 PolarHBondContact NZ-OD2 2.69Å; K30-D34 VanDerWaalsContact O-CG 3.23Å; K30-D34 PolarHBondContact O-N 3.29Å
31	A	85.7	Confident	87.6	Confident	53 Å²	53	95.3 Å²	95.3	44%	0.438	52%	0.516	S	S	.	.	H	α-helix	trans	-58.3	-39.2	177.9	0	0	0	0	0	112.8	V27 L28 E35	V27-A31 PolarHBondContact O-N 2.85Å; L28-A31 PolarHBondContact O-N 3.48Å; A31-E35 VanDerWaalsContact O-CB 3.24Å; A31-E35 WeakPolarHBondContact O-CB 3.36Å; A31-E35 PolarHBondContact O-N 3.28Å
32	V	86.2	Confident	87.7	Confident	78 Å²	78	96 Å²	96	47%	0.473	52%	0.519	S	S	.	.	H	α-helix	trans	-66.1	-38	174.8	169	0	0	0	0	112.1	L28 K29 K30 Q36	L28-V32 WeakPolarHBondContact O-CG2 3.21Å; L28-V32 PolarHBondContact O-N 3.37Å; K29-V32 PolarHBondContact O-N 2.86Å; K30-V32 VanDerWaalsContact C-N 3.3Å; K30-V32 PolarHBondContact O-N 2.84Å; V32-Q36 WeakPolarHBondContact O-CB 3.28Å; V32-Q36 WeakPolarHBondContact O-CG 3.17Å; V32-Q36 PolarHBondContact O-N 3.45Å
33	V	91.2	Very high	87.7	Confident	88 Å²	88	94.3 Å²	94.3	53%	0.533	52%	0.517	S	S	.	.	H	α-helix	trans	-70.2	-44.2	175.4	169.7	0	0	0	0	111.4	K29 K30 E35 Q36 A37	K29-V33 WeakPolarHBondContact O-CG2 3.31Å; K29-V33 PolarHBondContact O-N 2.94Å; K29-V33 VanDerWaalsContact O-N 3.09Å; K30-V33 PolarHBondContact O-N 2.89Å; K30-V33 VanDerWaalsContact O-N 3.07Å; V33-E35 VanDerWaalsContact C-N 3.3Å; V33-E35 PolarHBondContact O-N 3.3Å; V33-Q36 PolarHBondContact O-N 3.4Å; V33-A37 WeakPolarHBondContact O-CB 3.36Å; V33-A37 PolarHBondContact O-N 2.81Å
34	D	89.3	Confident	88	Confident	71 Å²	71	96 Å²	96	38%	0.38	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-41.2	176.7	-62.6	-22.9	0	0	0	110.1	K30 A37 N38	K30-D34 VanDerWaalsContact NZ-CG 3.25Å; K30-D34 IonicContact NZ-OD1 2.67Å; K30-D34 PolarHBondContact NZ-OD1 2.95Å; K30-D34 IonicContact NZ-OD2 3.39Å; K30-D34 PolarHBondContact NZ-OD2 2.69Å; K30-D34 VanDerWaalsContact O-CG 3.23Å; K30-D34 PolarHBondContact O-N 3.29Å; D34-A37 PolarHBondContact O-N 3.03Å; D34-N38 PolarHBondContact O-N 3.28Å
35	E	89.6	Confident	88.2	Confident	119 Å²	119	95.1 Å²	95.1	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-71.5	-36.4	177	-172.5	61.4	-170.8	0	0	113.2	A31 V33 A37 N38 S39	A31-E35 VanDerWaalsContact O-CB 3.24Å; A31-E35 WeakPolarHBondContact O-CB 3.36Å; A31-E35 PolarHBondContact O-N 3.28Å; V33-E35 VanDerWaalsContact C-N 3.3Å; V33-E35 PolarHBondContact O-N 3.3Å; E35-A37 VanDerWaalsContact C-N 3.31Å; E35-A37 PolarHBondContact O-N 3.09Å; E35-N38 PolarHBondContact O-N 2.89Å; E35-S39 WeakPolarHBondContact O-CB 3.42Å; E35-S39 PolarHBondContact O-N 2.85Å
36	Q	87.7	Confident	88.5	Confident	126 Å²	126	96.2 Å²	96.2	59%	0.589	52%	0.52	S	S	*	.	H	α-helix	trans	-63.9	-37.3	171.7	-78	172	3	0	0	111.8	V32 V33 S39 A40	V32-Q36 WeakPolarHBondContact O-CB 3.28Å; V32-Q36 WeakPolarHBondContact O-CG 3.17Å; V32-Q36 PolarHBondContact O-N 3.45Å; V33-Q36 PolarHBondContact O-N 3.4Å; Q36-S39 PolarHBondContact O-N 3.2Å; Q36-A40 WeakPolarHBondContact O-CB 3.36Å; Q36-A40 PolarHBondContact O-N 2.92Å
37	A	89.7	Confident	88.8	Confident	58 Å²	58	94.2 Å²	94.2	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-67.4	-42.3	174	0	0	0	0	0	112.2	V33 D34 E35 A40 S41	V33-A37 WeakPolarHBondContact O-CB 3.36Å; V33-A37 PolarHBondContact O-N 2.81Å; D34-A37 PolarHBondContact O-N 3.03Å; E35-A37 VanDerWaalsContact C-N 3.31Å; E35-A37 PolarHBondContact O-N 3.09Å; A37-A40 PolarHBondContact O-N 3.38Å; A37-S41 WeakPolarHBondContact O-CB 3.31Å; A37-S41 PolarHBondContact O-N 3.07Å
38	N	90.7	Very high	89	Confident	88 Å²	88	95 Å²	95	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-59.7	-45.9	172	-74.7	-22.2	0	0	0	111.7	D34 E35 A40 S41 L42	D34-N38 PolarHBondContact O-N 3.28Å; E35-N38 PolarHBondContact O-N 2.89Å; N38-A40 VanDerWaalsContact C-N 3.34Å; N38-A40 PolarHBondContact O-N 2.97Å; N38-S41 PolarHBondContact O-N 3.4Å; N38-L42 WeakPolarHBondContact O-CB 3.27Å; N38-L42 WeakPolarHBondContact O-CG 3.28Å; N38-L42 PolarHBondContact O-N 3.45Å
39	S	88.3	Confident	89.3	Confident	71 Å²	71	97.5 Å²	97.5	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-61.2	-41	178.1	-169.3	0	0	0	0	112.2	E35 Q36 K43	E35-S39 WeakPolarHBondContact O-CB 3.42Å; E35-S39 PolarHBondContact O-N 2.85Å; Q36-S39 PolarHBondContact O-N 3.2Å; S39-K43 VanDerWaalsContact O-CB 3.29Å; S39-K43 WeakPolarHBondContact O-CB 3.4Å; S39-K43 PolarHBondContact O-N 3.18Å
40	A	89.6	Confident	89.4	Confident	51 Å²	51	94 Å²	94	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-47.1	173.3	0	0	0	0	0	112.1	Q36 A37 N38 L42 K43 D44	Q36-A40 WeakPolarHBondContact O-CB 3.36Å; Q36-A40 PolarHBondContact O-N 2.92Å; A37-A40 PolarHBondContact O-N 3.38Å; N38-A40 VanDerWaalsContact C-N 3.34Å; N38-A40 PolarHBondContact O-N 2.97Å; A40-L42 PolarHBondContact O-N 3.32Å; A40-K43 WeakPolarHBondContact O-CB 3.4Å; A40-K43 PolarHBondContact O-N 2.86Å; A40-D44 PolarHBondContact O-N 2.67Å
41	S	90.9	Very high	89.4	Confident	59 Å²	59	93.9 Å²	93.9	41%	0.413	50%	0.497	S	S	.	.	H	α-helix	trans	-58.5	-46.7	176.6	178.3	0	0	0	0	112.3	A37 N38 K43 D44 Q45	A37-S41 WeakPolarHBondContact O-CB 3.31Å; A37-S41 PolarHBondContact O-N 3.07Å; N38-S41 PolarHBondContact O-N 3.4Å; S41-K43 VanDerWaalsContact C-N 3.33Å; S41-K43 PolarHBondContact O-N 3.36Å; S41-D44 PolarHBondContact O-N 3.06Å; S41-Q45 WeakPolarHBondContact O-CB 3.48Å; S41-Q45 WeakPolarHBondContact O-CG 3.29Å; S41-Q45 PolarHBondContact O-N 2.84Å; S41-Q45 PolarHBondContact OG-NE2 3.46Å; S41-Q45 VanDerWaalsContact OG-NE2 3.15Å
42	L	87.9	Confident	89.5	Confident	111 Å²	111	93.8 Å²	93.8	58%	0.581	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-39	176.1	-72.8	169.4	0	0	0	112	N38 A40 Q45 L46	N38-L42 WeakPolarHBondContact O-CB 3.27Å; N38-L42 WeakPolarHBondContact O-CG 3.28Å; N38-L42 PolarHBondContact O-N 3.45Å; A40-L42 PolarHBondContact O-N 3.32Å; L42-Q45 PolarHBondContact O-N 3.14Å; L42-L46 WeakPolarHBondContact O-CB 3.2Å; L42-L46 PolarHBondContact O-N 2.99Å
43	K	89.9	Confident	89.7	Confident	139 Å²	139	94.3 Å²	94.3	60%	0.604	49%	0.493	S	S	*	.	H	α-helix	trans	-65.8	-36.5	177.3	-169.7	172.1	-173.6	172.9	0	112.5	S39 A40 S41 K47	S39-K43 VanDerWaalsContact O-CB 3.29Å; S39-K43 WeakPolarHBondContact O-CB 3.4Å; S39-K43 PolarHBondContact O-N 3.18Å; A40-K43 WeakPolarHBondContact O-CB 3.4Å; A40-K43 PolarHBondContact O-N 2.86Å; S41-K43 VanDerWaalsContact C-N 3.33Å; S41-K43 PolarHBondContact O-N 3.36Å; K43-K47 WeakPolarHBondContact O-CG 3.48Å; K43-K47 PolarHBondContact O-N 3.37Å; K43-K47 VanDerWaalsContact O-N 3.1Å
44	D	92.1	Very high	89.8	Confident	87 Å²	87	97.7 Å²	97.7	47%	0.465	50%	0.496	S	S	.	.	H	α-helix	trans	-78.7	-34.7	176.7	-73.3	-19.1	0	0	0	112.7	A40 S41 L46 K47 Q48	A40-D44 PolarHBondContact O-N 2.67Å; S41-D44 PolarHBondContact O-N 3.06Å; D44-L46 VanDerWaalsContact C-N 3.31Å; D44-L46 PolarHBondContact O-N 2.86Å; D44-K47 PolarHBondContact O-N 2.88Å; D44-K47 WeakPolarHBondContact OD1-CD 3.48Å; D44-K47 VanDerWaalsContact OD1-CE 3.3Å; D44-K47 WeakPolarHBondContact OD1-CE 3.4Å; D44-K47 IonicContact OD1-NZ 2.58Å; D44-K47 PolarHBondContact OD1-NZ 2.91Å; D44-Q48 WeakPolarHBondContact O-CB 3.36Å; D44-Q48 PolarHBondContact O-N 3.5Å
45	Q	88.4	Confident	89.8	Confident	94 Å²	94	100.4 Å²	100.4	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-40.7	167.3	-73.3	177.1	59.3	0	0	111.7	S41 L42 Q48 R49	S41-Q45 WeakPolarHBondContact O-CB 3.48Å; S41-Q45 WeakPolarHBondContact O-CG 3.29Å; S41-Q45 PolarHBondContact O-N 2.84Å; S41-Q45 PolarHBondContact OG-NE2 3.46Å; S41-Q45 VanDerWaalsContact OG-NE2 3.15Å; L42-Q45 PolarHBondContact O-N 3.14Å; Q45-Q48 WeakPolarHBondContact O-CB 3.47Å; Q45-Q48 PolarHBondContact O-N 3.31Å; Q45-R49 WeakPolarHBondContact O-CG 3.36Å; Q45-R49 PolarHBondContact O-N 3.2Å
46	L	88.4	Confident	89.7	Confident	105 Å²	105	100.2 Å²	100.2	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-64.1	-47.4	176.6	-170.4	149.6	0	0	0	111.2	L42 D44 Q48 R49 D50	L42-L46 WeakPolarHBondContact O-CB 3.2Å; L42-L46 PolarHBondContact O-N 2.99Å; D44-L46 VanDerWaalsContact C-N 3.31Å; D44-L46 PolarHBondContact O-N 2.86Å; L46-Q48 VanDerWaalsContact C-N 3.26Å; L46-Q48 PolarHBondContact O-N 2.86Å; L46-R49 PolarHBondContact O-N 3.33Å; L46-D50 WeakPolarHBondContact CD2-OD2 3.33Å; L46-D50 PolarHBondContact O-N 2.85Å
47	K	90.8	Very high	89.6	Confident	101 Å²	101	99.1 Å²	99.1	44%	0.439	50%	0.498	S	S	.	.	H	α-helix	trans	-55.1	-40.8	171.3	-68.5	170.8	-166.2	166.3	0	112.4	K43 D44 R49 D50 Q51	K43-K47 WeakPolarHBondContact O-CG 3.48Å; K43-K47 PolarHBondContact O-N 3.37Å; K43-K47 VanDerWaalsContact O-N 3.1Å; D44-K47 PolarHBondContact O-N 2.88Å; D44-K47 WeakPolarHBondContact OD1-CD 3.48Å; D44-K47 VanDerWaalsContact OD1-CE 3.3Å; D44-K47 WeakPolarHBondContact OD1-CE 3.4Å; D44-K47 IonicContact OD1-NZ 2.58Å; D44-K47 PolarHBondContact OD1-NZ 2.91Å; K47-R49 VanDerWaalsContact C-N 3.33Å; K47-D50 PolarHBondContact O-N 2.88Å; K47-Q51 WeakPolarHBondContact O-CG 3.41Å; K47-Q51 PolarHBondContact O-N 2.9Å
48	Q	90.8	Very high	89.6	Confident	121 Å²	121	102.8 Å²	102.8	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-67.6	-35.4	179.2	-164.8	-175	28.7	0	0	111.5	D44 Q45 L46 S52	D44-Q48 WeakPolarHBondContact O-CB 3.36Å; D44-Q48 PolarHBondContact O-N 3.5Å; Q45-Q48 WeakPolarHBondContact O-CB 3.47Å; Q45-Q48 PolarHBondContact O-N 3.31Å; L46-Q48 VanDerWaalsContact C-N 3.26Å; L46-Q48 PolarHBondContact O-N 2.86Å; Q48-S52 WeakPolarHBondContact O-CB 3.43Å; Q48-S52 PolarHBondContact O-N 3.31Å
49	R	89.5	Confident	89.6	Confident	162 Å²	162	104.4 Å²	104.4	61%	0.611	51%	0.51	S	S	*	.	H	α-helix	trans	-69.5	-43.7	172.9	-69.3	-69	138.6	86	4.7	111.7	Q45 L46 K47 Q51 S52 L53	Q45-R49 WeakPolarHBondContact O-CG 3.36Å; Q45-R49 PolarHBondContact O-N 3.2Å; L46-R49 PolarHBondContact O-N 3.33Å; K47-R49 VanDerWaalsContact C-N 3.33Å; R49-Q51 VanDerWaalsContact C-N 3.31Å; R49-Q51 PolarHBondContact O-N 2.88Å; R49-S52 WeakPolarHBondContact O-CB 3.26Å; R49-S52 PolarHBondContact O-N 3.4Å; R49-S52 VanDerWaalsContact O-N 3.09Å; R49-L53 VanDerWaalsContact O-CB 3.32Å; R49-L53 WeakPolarHBondContact O-CB 3.27Å; R49-L53 PolarHBondContact O-N 3.49Å
50	D	89.8	Confident	89.5	Confident	68 Å²	68	107.5 Å²	107.5	36%	0.364	52%	0.519	S	S	.	.	H	α-helix	trans	-57.6	-42.7	173.7	-67.1	-15.8	0	0	0	111.8	L46 K47 L53 R54	L46-D50 WeakPolarHBondContact CD2-OD2 3.33Å; L46-D50 PolarHBondContact O-N 2.85Å; K47-D50 PolarHBondContact O-N 2.88Å; D50-L53 PolarHBondContact O-N 3.37Å; D50-R54 WeakPolarHBondContact O-CB 3.26Å; D50-R54 VanDerWaalsContact O-CG 3.32Å; D50-R54 WeakPolarHBondContact O-CG 3.48Å; D50-R54 PolarHBondContact O-N 2.82Å
51	Q	90.5	Very high	89.5	Confident	122 Å²	122	110.5 Å²	110.5	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-66.9	-35.8	175.4	-73.7	179.9	15.7	0	0	112.9	K47 R49 K55	K47-Q51 WeakPolarHBondContact O-CG 3.41Å; K47-Q51 PolarHBondContact O-N 2.9Å; R49-Q51 VanDerWaalsContact C-N 3.31Å; R49-Q51 PolarHBondContact O-N 2.88Å; Q51-K55 WeakPolarHBondContact O-CG 3.44Å; Q51-K55 PolarHBondContact O-N 3.46Å
52	S	88.8	Confident	89.4	Confident	51 Å²	51	110.7 Å²	110.7	36%	0.357	53%	0.529	S	S	.	.	H	α-helix	trans	-69.8	-40.4	175.3	-166.4	0	0	0	0	111.7	Q48 R49 K55 Q56	Q48-S52 WeakPolarHBondContact O-CB 3.43Å; Q48-S52 PolarHBondContact O-N 3.31Å; R49-S52 WeakPolarHBondContact O-CB 3.26Å; R49-S52 PolarHBondContact O-N 3.4Å; R49-S52 VanDerWaalsContact O-N 3.09Å; S52-K55 PolarHBondContact O-N 3.37Å; S52-Q56 WeakPolarHBondContact O-CG 3.41Å; S52-Q56 PolarHBondContact O-N 3.32Å
53	L	90	Very high	89.4	Confident	89 Å²	89	110 Å²	110	47%	0.466	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-46.9	179.2	-174.1	148.7	0	0	0	110.3	R49 D50 K55 Q56 E57	R49-L53 VanDerWaalsContact O-CB 3.32Å; R49-L53 WeakPolarHBondContact O-CB 3.27Å; R49-L53 PolarHBondContact O-N 3.49Å; D50-L53 PolarHBondContact O-N 3.37Å; L53-K55 VanDerWaalsContact C-N 3.26Å; L53-K55 PolarHBondContact O-N 2.87Å; L53-Q56 CarbonylContact O-C 3.59Å; L53-Q56 WeakPolarHBondContact O-CA 3.22Å; L53-Q56 WeakPolarHBondContact O-CB 3.46Å; L53-Q56 PolarHBondContact O-N 2.75Å; L53-E57 VanDerWaalsContact CD2-CD 3.42Å; L53-E57 HydrophobicContact CD2-CG 4.06Å; L53-E57 WeakPolarHBondContact CD2-OE1 3.42Å; L53-E57 WeakPolarHBondContact O-CG 3.28Å; L53-E57 PolarHBondContact O-N 2.72Å
54	R	92.6	Very high	89.2	Confident	159 Å²	159	106 Å²	106	60%	0.6	52%	0.515	S	S	*	.	H	α-helix	trans	-60.3	-30.9	174.4	-71.2	176.6	-168.4	-171.4	4.5	114.2	D50 E57 Q58	D50-R54 WeakPolarHBondContact O-CB 3.26Å; D50-R54 VanDerWaalsContact O-CG 3.32Å; D50-R54 WeakPolarHBondContact O-CG 3.48Å; D50-R54 PolarHBondContact O-N 2.82Å; R54-E57 WeakPolarHBondContact CA-OE2 3.4Å; R54-Q58 VanDerWaalsContact O-CG 3.28Å; R54-Q58 WeakPolarHBondContact O-CG 3.49Å; R54-Q58 PolarHBondContact O-N 2.95Å; R54-Q58 VanDerWaalsContact O-N 3.07Å
55	K	90.8	Very high	89.1	Confident	127 Å²	127	108.5 Å²	108.5	55%	0.552	52%	0.522	S	S	*	.	H	α-helix	trans	-69.8	-43.1	172	-74.7	174.6	179.4	-176.2	0	111.3	Q51 S52 L53 E57 Q58 E59	Q51-K55 WeakPolarHBondContact O-CG 3.44Å; Q51-K55 PolarHBondContact O-N 3.46Å; S52-K55 PolarHBondContact O-N 3.37Å; L53-K55 VanDerWaalsContact C-N 3.26Å; L53-K55 PolarHBondContact O-N 2.87Å; K55-E57 VanDerWaalsContact C-N 3.33Å; K55-E57 PolarHBondContact O-N 2.88Å; K55-Q58 PolarHBondContact O-N 2.73Å; K55-E59 WeakPolarHBondContact O-CB 3.47Å; K55-E59 WeakPolarHBondContact O-CG 3.49Å; K55-E59 PolarHBondContact O-N 3.43Å
56	Q	87.1	Confident	89.1	Confident	115 Å²	115	111.5 Å²	111.5	54%	0.537	53%	0.529	S	S	.	.	H	α-helix	trans	-66.4	-33.4	176	-71.5	175	-28.1	0	0	112.4	S52 L53 E59 M60	S52-Q56 WeakPolarHBondContact O-CG 3.41Å; S52-Q56 PolarHBondContact O-N 3.32Å; L53-Q56 CarbonylContact O-C 3.59Å; L53-Q56 WeakPolarHBondContact O-CA 3.22Å; L53-Q56 WeakPolarHBondContact O-CB 3.46Å; L53-Q56 PolarHBondContact O-N 2.75Å; Q56-E59 PolarHBondContact O-N 3.5Å; Q56-M60 VanDerWaalsContact O-CB 3.29Å; Q56-M60 WeakPolarHBondContact O-CB 3.46Å; Q56-M60 WeakPolarHBondContact O-CG 3.25Å; Q56-M60 PolarHBondContact O-N 2.86Å
57	E	85.9	Confident	88.9	Confident	104 Å²	104	111.4 Å²	111.4	49%	0.486	53%	0.529	S	S	.	.	H	α-helix	trans	-63.2	-46.7	169.1	-70.4	173.7	145.3	0	0	111.3	L53 R54 K55 E59 M60 D61	L53-E57 VanDerWaalsContact CD2-CD 3.42Å; L53-E57 HydrophobicContact CD2-CG 4.06Å; L53-E57 WeakPolarHBondContact CD2-OE1 3.42Å; L53-E57 WeakPolarHBondContact O-CG 3.28Å; L53-E57 PolarHBondContact O-N 2.72Å; R54-E57 WeakPolarHBondContact CA-OE2 3.4Å; K55-E57 VanDerWaalsContact C-N 3.33Å; K55-E57 PolarHBondContact O-N 2.88Å; E57-E59 VanDerWaalsContact C-N 3.34Å; E57-E59 PolarHBondContact O-N 2.67Å; E57-M60 WeakPolarHBondContact O-CB 3.37Å; E57-M60 PolarHBondContact O-N 2.87Å; E57-D61 PolarHBondContact O-N 3.49Å
58	Q	89.8	Confident	88.6	Confident	135 Å²	135	112 Å²	112	63%	0.631	53%	0.534	S	S	*	.	H	α-helix	trans	-65.2	-34.5	176	-72.8	172.9	-4	0	0	113.2	R54 K55 S62	R54-Q58 VanDerWaalsContact O-CG 3.28Å; R54-Q58 WeakPolarHBondContact O-CG 3.49Å; R54-Q58 PolarHBondContact O-N 2.95Å; R54-Q58 VanDerWaalsContact O-N 3.07Å; K55-Q58 PolarHBondContact O-N 2.73Å; Q58-S62 WeakPolarHBondContact O-CB 3.39Å; Q58-S62 PolarHBondContact O-N 2.84Å
59	E	89.3	Confident	88.3	Confident	121 Å²	121	112.3 Å²	112.3	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-68.6	-41.8	172	-74.1	169.9	-164.1	0	0	111.3	K55 Q56 E57 S62 L63	K55-E59 WeakPolarHBondContact O-CB 3.47Å; K55-E59 WeakPolarHBondContact O-CG 3.49Å; K55-E59 PolarHBondContact O-N 3.43Å; Q56-E59 PolarHBondContact O-N 3.5Å; E57-E59 VanDerWaalsContact C-N 3.34Å; E57-E59 PolarHBondContact O-N 2.67Å; E59-S62 PolarHBondContact O-N 3.37Å; E59-L63 WeakPolarHBondContact O-CB 3.44Å; E59-L63 VanDerWaalsContact O-CG 3.24Å; E59-L63 WeakPolarHBondContact O-CG 3.37Å; E59-L63 PolarHBondContact O-N 2.81Å
60	M	87.6	Confident	88	Confident	137 Å²	137	109.5 Å²	109.5	68%	0.675	53%	0.531	S	S	*	.	H	α-helix	trans	-59.9	-46.6	172.5	-82.1	-83.9	-70.9	0	0	112.1	Q56 E57 L63 S64	Q56-M60 VanDerWaalsContact O-CB 3.29Å; Q56-M60 WeakPolarHBondContact O-CB 3.46Å; Q56-M60 WeakPolarHBondContact O-CG 3.25Å; Q56-M60 PolarHBondContact O-N 2.86Å; E57-M60 WeakPolarHBondContact O-CB 3.37Å; E57-M60 PolarHBondContact O-N 2.87Å; M60-L63 PolarHBondContact O-N 3.46Å; M60-S64 WeakPolarHBondContact O-CB 3.39Å; M60-S64 PolarHBondContact O-N 2.87Å
61	D	89.2	Confident	87.7	Confident	113 Å²	113	109 Å²	109	60%	0.604	54%	0.536	S	S	*	.	H	α-helix	trans	-65	-40.3	177.4	-76.5	-21.7	0	0	0	111.7	E57 S64 F65	E57-D61 PolarHBondContact O-N 3.49Å; D61-S64 PolarHBondContact O-N 3.44Å; D61-F65 WeakPolarHBondContact O-CB 3.34Å; D61-F65 PolarHBondContact O-N 2.95Å
62	S	89.1	Confident	87.4	Confident	64 Å²	64	109.5 Å²	109.5	45%	0.448	54%	0.537	S	S	.	.	H	α-helix	trans	-64.6	-41.5	175.4	-176.5	0	0	0	0	112.5	Q58 E59 R66	Q58-S62 WeakPolarHBondContact O-CB 3.39Å; Q58-S62 PolarHBondContact O-N 2.84Å; E59-S62 PolarHBondContact O-N 3.37Å; S62-R66 WeakPolarHBondContact O-CB 3.45Å; S62-R66 PolarHBondContact O-N 3.38Å
63	L	86.4	Confident	87.3	Confident	97 Å²	97	115.2 Å²	115.2	51%	0.508	55%	0.551	S	S	.	*	H	α-helix	trans	-70.1	-38	174.1	-71.8	170.4	0	0	0	112	E59 M60 R66 N67	E59-L63 WeakPolarHBondContact O-CB 3.44Å; E59-L63 VanDerWaalsContact O-CG 3.24Å; E59-L63 WeakPolarHBondContact O-CG 3.37Å; E59-L63 PolarHBondContact O-N 2.81Å; M60-L63 PolarHBondContact O-N 3.46Å; L63-R66 PolarHBondContact O-N 3.38Å; L63-N67 WeakPolarHBondContact O-CB 3.41Å; L63-N67 VanDerWaalsContact O-CG 3.31Å; L63-N67 PolarHBondContact O-N 3.36Å
64	S	86.8	Confident	86.9	Confident	54 Å²	54	114.4 Å²	114.4	38%	0.378	55%	0.549	S	S	.	.	H	α-helix	trans	-61.7	-47.1	173.7	-176.1	0	0	0	0	111	M60 D61 R66 N67 Q68	M60-S64 WeakPolarHBondContact O-CB 3.39Å; M60-S64 PolarHBondContact O-N 2.87Å; D61-S64 PolarHBondContact O-N 3.44Å; S64-R66 PolarHBondContact O-N 3.49Å; S64-N67 PolarHBondContact O-N 3.5Å; S64-Q68 WeakPolarHBondContact O-CG 3.38Å; S64-Q68 PolarHBondContact O-N 2.97Å
65	F	89.7	Confident	86.3	Confident	139 Å²	139	111.9 Å²	111.9	61%	0.61	54%	0.544	S	S	*	.	H	α-helix	trans	-62.1	-43.2	175.3	-174.6	-96.6	0	0	0	112.2	D61 Q68 Q69	D61-F65 WeakPolarHBondContact O-CB 3.34Å; D61-F65 PolarHBondContact O-N 2.95Å; F65-Q68 PolarHBondContact O-N 2.86Å; F65-Q69 WeakPolarHBondContact O-CB 3.21Å; F65-Q69 PolarHBondContact O-N 2.74Å
66	R	87.5	Confident	85.8	Confident	157 Å²	157	110.5 Å²	110.5	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-61.8	-41.1	172.3	-87.1	-177.9	166.7	169.9	-2.1	112.7	S62 L63 S64 Q69 L70	S62-R66 WeakPolarHBondContact O-CB 3.45Å; S62-R66 PolarHBondContact O-N 3.38Å; L63-R66 PolarHBondContact O-N 3.38Å; S64-R66 PolarHBondContact O-N 3.49Å; R66-Q69 PolarHBondContact O-N 2.76Å; R66-L70 WeakPolarHBondContact O-CB 3.32Å; R66-L70 WeakPolarHBondContact O-CG 3.25Å; R66-L70 PolarHBondContact O-N 2.82Å
67	N	84.5	Confident	85.3	Confident	104 Å²	104	108.7 Å²	108.7	56%	0.556	54%	0.536	S	S	*	.	H	α-helix	trans	-67.8	-37	176.8	-78.1	-18.3	0	0	0	111.9	L63 S64 L70 A71	L63-N67 WeakPolarHBondContact O-CB 3.41Å; L63-N67 VanDerWaalsContact O-CG 3.31Å; L63-N67 PolarHBondContact O-N 3.36Å; S64-N67 PolarHBondContact O-N 3.5Å; N67-L70 PolarHBondContact O-N 2.86Å; N67-A71 VanDerWaalsContact O-CB 3.22Å; N67-A71 WeakPolarHBondContact O-CB 3.44Å; N67-A71 PolarHBondContact O-N 3.13Å
68	Q	85.8	Confident	84.8	Confident	114 Å²	114	109.5 Å²	109.5	53%	0.533	54%	0.54	S	S	.	.	H	α-helix	trans	-66.7	-38	171.4	-72.1	-175.7	10.3	0	0	112.3	S64 F65 A71 K72	S64-Q68 WeakPolarHBondContact O-CG 3.38Å; S64-Q68 PolarHBondContact O-N 2.97Å; F65-Q68 PolarHBondContact O-N 2.86Å; Q68-A71 PolarHBondContact O-N 3.23Å; Q68-K72 WeakPolarHBondContact O-CB 3Å; Q68-K72 WeakPolarHBondContact O-CG 3.32Å; Q68-K72 PolarHBondContact O-N 2.84Å
69	Q	84.4	Confident	84.1	Confident	127 Å²	127	109 Å²	109	59%	0.593	54%	0.537	S	S	*	.	H	α-helix	trans	-68.1	-39.2	175.3	-169.7	178	42.8	0	0	111.9	F65 R66 R73	F65-Q69 WeakPolarHBondContact O-CB 3.21Å; F65-Q69 PolarHBondContact O-N 2.74Å; R66-Q69 PolarHBondContact O-N 2.76Å; Q69-R73 WeakPolarHBondContact O-CB 3.42Å; Q69-R73 PolarHBondContact O-N 3.37Å
70	L	83.6	Confident	83.4	Confident	102 Å²	102	109.2 Å²	109.2	53%	0.534	54%	0.538	S	S	.	.	H	α-helix	trans	-66.1	-44.3	172	-78.7	166.1	0	0	0	111.4	R66 N67 R73 V74	R66-L70 WeakPolarHBondContact O-CB 3.32Å; R66-L70 WeakPolarHBondContact O-CG 3.25Å; R66-L70 PolarHBondContact O-N 2.82Å; N67-L70 PolarHBondContact O-N 2.86Å; L70-R73 CarbonylContact O-C 3.59Å; L70-R73 PolarHBondContact O-N 2.82Å; L70-R73 VanDerWaalsContact O-N 3.16Å; L70-V74 WeakPolarHBondContact O-CG2 3.14Å; L70-V74 PolarHBondContact O-N 3.19Å
71	A	81.8	Confident	82.4	Confident	57 Å²	57	107.3 Å²	107.3	47%	0.471	53%	0.531	S	S	.	.	H	α-helix	trans	-58.5	-50.6	176.3	0	0	0	0	0	111.1	N67 Q68 R73 V74 E75	N67-A71 VanDerWaalsContact O-CB 3.22Å; N67-A71 WeakPolarHBondContact O-CB 3.44Å; N67-A71 PolarHBondContact O-N 3.13Å; Q68-A71 PolarHBondContact O-N 3.23Å; A71-R73 VanDerWaalsContact C-N 3.27Å; A71-R73 PolarHBondContact O-N 3.32Å; A71-V74 CarbonylContact O-C 3.58Å; A71-V74 PolarHBondContact O-N 3.47Å; A71-V74 VanDerWaalsContact O-N 3.09Å; A71-E75 VanDerWaalsContact O-CB 3.31Å; A71-E75 WeakPolarHBondContact O-CB 3.27Å; A71-E75 PolarHBondContact O-N 3.07Å
72	K	85.9	Confident	81.1	Confident	133 Å²	133	105.7 Å²	105.7	58%	0.578	53%	0.533	S	S	*	.	H	α-helix	trans	-62.1	-31.5	175.1	-74.5	-175.5	174.4	-174.9	0	113.5	Q68 L76	Q68-K72 WeakPolarHBondContact O-CB 3Å; Q68-K72 WeakPolarHBondContact O-CG 3.32Å; Q68-K72 PolarHBondContact O-N 2.84Å; K72-L76 WeakPolarHBondContact O-CB 3.33Å; K72-L76 VanDerWaalsContact O-CG 3.28Å; K72-L76 WeakPolarHBondContact O-CG 3.12Å; K72-L76 PolarHBondContact O-N 2.84Å
73	R	85.9	Confident	79.8	Confident	172 Å²	172	106.7 Å²	106.7	65%	0.649	55%	0.545	S	S	*	.	H	α-helix	trans	-73	-35.5	173.7	-173.1	173.6	-178.7	129	7	112.1	Q69 L70 A71 L77	Q69-R73 WeakPolarHBondContact O-CB 3.42Å; Q69-R73 PolarHBondContact O-N 3.37Å; L70-R73 CarbonylContact O-C 3.59Å; L70-R73 PolarHBondContact O-N 2.82Å; L70-R73 VanDerWaalsContact O-N 3.16Å; A71-R73 VanDerWaalsContact C-N 3.27Å; A71-R73 PolarHBondContact O-N 3.32Å; R73-L77 HydrophobicContact CG-CD1 4.13Å; R73-L77 WeakPolarHBondContact O-CB 3.34Å; R73-L77 WeakPolarHBondContact O-CD1 3.45Å; R73-L77 WeakPolarHBondContact O-CG 3.15Å; R73-L77 PolarHBondContact O-N 3.16Å
74	V	80.7	Confident	78.5	Confident	71 Å²	71	106 Å²	106	43%	0.43	55%	0.548	S	S	.	.	H	α-helix	trans	-69.7	-40.8	173.6	168.7	0	0	0	0	110.6	L70 A71 L77 Q78	L70-V74 WeakPolarHBondContact O-CG2 3.14Å; L70-V74 PolarHBondContact O-N 3.19Å; A71-V74 CarbonylContact O-C 3.58Å; A71-V74 PolarHBondContact O-N 3.47Å; A71-V74 VanDerWaalsContact O-N 3.09Å; V74-L77 CarbonylContact O-C 3.58Å; V74-L77 PolarHBondContact O-N 2.85Å; V74-Q78 HydrophobicContact CG1-CG 4.37Å; V74-Q78 WeakPolarHBondContact O-CB 3.44Å; V74-Q78 VanDerWaalsContact O-CG 3.22Å; V74-Q78 WeakPolarHBondContact O-CG 3.44Å; V74-Q78 PolarHBondContact O-N 3.33Å
75	E	80.2	Confident	76.9	Confident	107 Å²	107	111.3 Å²	111.3	50%	0.5	57%	0.567	S	S	.	*	H	α-helix	trans	-57.9	-52.7	173.4	-171.6	170.8	-137.1	0	0	110.6	A71 L77 Q78 E79	A71-E75 VanDerWaalsContact O-CB 3.31Å; A71-E75 WeakPolarHBondContact O-CB 3.27Å; A71-E75 PolarHBondContact O-N 3.07Å; E75-L77 PolarHBondContact O-N 2.88Å; E75-Q78 CarbonylContact O-C 3.6Å; E75-Q78 WeakPolarHBondContact O-CB 3.21Å; E75-Q78 PolarHBondContact O-N 2.73Å; E75-Q78 VanDerWaalsContact O-N 3.1Å; E75-E79 WeakPolarHBondContact O-CG 3.38Å; E75-E79 PolarHBondContact O-N 2.95Å
76	L	80.3	Confident	75.1	Confident	97 Å²	97	107.5 Å²	107.5	51%	0.508	57%	0.567	S	S	.	*	H	α-helix	trans	-60.8	-38.8	173.7	-73.2	168	0	0	0	113.3	K72 Q78 E79 E80	K72-L76 WeakPolarHBondContact O-CB 3.33Å; K72-L76 VanDerWaalsContact O-CG 3.28Å; K72-L76 WeakPolarHBondContact O-CG 3.12Å; K72-L76 PolarHBondContact O-N 2.84Å; L76-Q78 VanDerWaalsContact C-N 3.31Å; L76-Q78 PolarHBondContact O-N 3.09Å; L76-E79 PolarHBondContact O-N 2.85Å; L76-E80 WeakPolarHBondContact O-CB 3.37Å; L76-E80 WeakPolarHBondContact O-CG 3.34Å; L76-E80 PolarHBondContact O-N 3.4Å
77	L	77.8	Confident	72.9	Confident	77 Å²	77	111.4 Å²	111.4	40%	0.403	58%	0.582	S	S	.	*	H	α-helix	trans	-70	-27.7	175.5	-75.7	167.6	0	0	0	112.6	R73 V74 E75 L81	R73-L77 HydrophobicContact CG-CD1 4.13Å; R73-L77 WeakPolarHBondContact O-CB 3.34Å; R73-L77 WeakPolarHBondContact O-CD1 3.45Å; R73-L77 WeakPolarHBondContact O-CG 3.15Å; R73-L77 PolarHBondContact O-N 3.16Å; V74-L77 CarbonylContact O-C 3.58Å; V74-L77 PolarHBondContact O-N 2.85Å; E75-L77 PolarHBondContact O-N 2.88Å; L77-L81 WeakPolarHBondContact O-CB 3.25Å; L77-L81 WeakPolarHBondContact O-CG 3.48Å; L77-L81 PolarHBondContact O-N 3.43Å
78	Q	74.2	Confident	70.5	Confident	122 Å²	122	112 Å²	112	57%	0.57	59%	0.594	S	S	*	*	H	α-helix	trans	-75.5	-36.6	172.5	-75.7	169.8	-11	0	0	111.2	V74 E75 L76 L81 A82	V74-Q78 HydrophobicContact CG1-CG 4.37Å; V74-Q78 WeakPolarHBondContact O-CB 3.44Å; V74-Q78 VanDerWaalsContact O-CG 3.22Å; V74-Q78 WeakPolarHBondContact O-CG 3.44Å; V74-Q78 PolarHBondContact O-N 3.33Å; E75-Q78 CarbonylContact O-C 3.6Å; E75-Q78 WeakPolarHBondContact O-CB 3.21Å; E75-Q78 PolarHBondContact O-N 2.73Å; E75-Q78 VanDerWaalsContact O-N 3.1Å; L76-Q78 VanDerWaalsContact C-N 3.31Å; L76-Q78 PolarHBondContact O-N 3.09Å; Q78-L81 PolarHBondContact O-N 2.84Å; Q78-A82 VanDerWaalsContact O-CB 3.27Å; Q78-A82 WeakPolarHBondContact O-CB 3.42Å; Q78-A82 PolarHBondContact O-N 2.92Å
79	E	75.9	Confident	68.5	Low	123 Å²	123	116.6 Å²	116.6	58%	0.575	61%	0.612	S	S	*	*	H	α-helix	trans	-64.8	-43.1	169.2	-69.7	-177.6	156.3	0	0	111.7	E75 L76 A82 A83	E75-E79 WeakPolarHBondContact O-CG 3.38Å; E75-E79 PolarHBondContact O-N 2.95Å; L76-E79 PolarHBondContact O-N 2.85Å; E79-A82 PolarHBondContact O-N 2.87Å; E79-A83 WeakPolarHBondContact O-CB 3.44Å; E79-A83 PolarHBondContact O-N 3.43Å
80	E	73.8	Confident	66.3	Low	126 Å²	126	121.7 Å²	121.7	59%	0.589	63%	0.632	S	S	*	*	H	α-helix	trans	-64.6	-37.8	174.6	-76.2	-179.9	174.9	0	0	112.5	L76 S84	L76-E80 WeakPolarHBondContact O-CB 3.37Å; L76-E80 WeakPolarHBondContact O-CG 3.34Å; L76-E80 PolarHBondContact O-N 3.4Å; E80-S84 VanDerWaalsContact O-CB 3.26Å; E80-S84 WeakPolarHBondContact O-CB 3.45Å; E80-S84 PolarHBondContact O-N 2.97Å; E80-S84 PolarHBondContact O-OG 2.99Å
81	L	66.8	Low	64.1	Low	98 Å²	98	121.1 Å²	121.1	51%	0.513	65%	0.651	S	S	.	*	H	α-helix	trans	-65.7	-50.9	171.9	-83.9	163.9	0	0	0	111.5	L77 Q78 A83 S84 E85	L77-L81 WeakPolarHBondContact O-CB 3.25Å; L77-L81 WeakPolarHBondContact O-CG 3.48Å; L77-L81 PolarHBondContact O-N 3.43Å; Q78-L81 PolarHBondContact O-N 2.84Å; L81-A83 PolarHBondContact O-N 2.89Å; L81-S84 WeakPolarHBondContact CA-OG 3.44Å; L81-S84 PolarHBondContact O-N 2.86Å; L81-S84 PolarHBondContact O-OG 2.83Å; L81-E85 PolarHBondContact O-N 3.37Å
82	A	62.9	Low	62.3	Low	79 Å²	79	129.3 Å²	129.3	65%	0.653	68%	0.676	S	S	*	*	H	α-helix	trans	-60	-32.4	177.7	0	0	0	0	0	112.8	Q78 E79	Q78-A82 VanDerWaalsContact O-CB 3.27Å; Q78-A82 WeakPolarHBondContact O-CB 3.42Å; Q78-A82 PolarHBondContact O-N 2.92Å; E79-A82 PolarHBondContact O-N 2.87Å
83	A	60.8	Low	60.2	Low	84 Å²	84	126.7 Å²	126.7	69%	0.694	69%	0.687	S	S	*	*	H	α-helix	trans	-76.7	-25.2	174.4	0	0	0	0	0	113.9	E79 L81	E79-A83 WeakPolarHBondContact O-CB 3.44Å; E79-A83 PolarHBondContact O-N 3.43Å; L81-A83 PolarHBondContact O-N 2.89Å
84	S	58.8	Low	58.4	Low	84 Å²	84	127.2 Å²	127.2	59%	0.587	69%	0.694	S	S	*	*	H	α-helix	trans	-97.4	-23.8	-174.9	57.1	0	0	0	0	115	E80 L81 G86	E80-S84 VanDerWaalsContact O-CB 3.26Å; E80-S84 WeakPolarHBondContact O-CB 3.45Å; E80-S84 PolarHBondContact O-N 2.97Å; E80-S84 PolarHBondContact O-OG 2.99Å; L81-S84 WeakPolarHBondContact CA-OG 3.44Å; L81-S84 PolarHBondContact O-N 2.86Å; L81-S84 PolarHBondContact O-OG 2.83Å; S84-G86 PolarHBondContact O-N 2.86Å
85	E	54.8	Low	56.8	Low	164 Å²	164	126.7 Å²	126.7	77%	0.766	70%	0.702	S	S	*	*	S	Bend	trans	-68.6	-2.5	177.9	-70.8	-168.4	149.5	0	0	114.5	L81 R87	L81-E85 PolarHBondContact O-N 3.37Å; E85-R87 PolarHBondContact O-N 3.32Å; E85-R87 VanDerWaalsContact O-N 3.16Å
86	G	50.2	Low	55.5	Low	59 Å²	59	128.3 Å²	128.3	61%	0.608	71%	0.714	S	S	*	*			trans	-78.9	29.3	-173.2	0	0	0	0	0	119.8	S84	S84-G86 PolarHBondContact O-N 2.86Å
87	R	41.8	Very low	54.5	Low	240 Å²	240	129.2 Å²	129.2	91%	0.906	73%	0.729	S	S	*	*			trans	-166.7	106.7	176.5	-93.6	134.9	-167.8	-143	6.8	118.5	E85	E85-R87 PolarHBondContact O-N 3.32Å; E85-R87 VanDerWaalsContact O-N 3.16Å
88	S	35.2	Very low	53.6	Low	116 Å²	116	131.8 Å²	131.8	81%	0.811	75%	0.75	S	S	*	*			trans	110	0	135.4	-40.4	0	0	0	0	131.5
89	K	43.7	Very low	52.1	Low	210 Å²	210	134.2 Å²	134.2	91%	0.913	77%	0.766	S	S	*	*				0	0	0	-58.4	175.9	172.6	176.2	0	135.1
90	K	37.9	Very low	50.2	Low	235 Å²	235	137.1 Å²	137.1	100%	1.022	78%	0.78	S	S	*	*				0	0	0	-87.3	169.6	-177.7	179.5	0	129.4
91	G	37.8	Very low	48.4	Very low	90 Å²	90	137.8 Å²	137.8	93%	0.928	80%	0.795	S	S	*	*				0	0	0	0	0	0	0	0	130.4
92	K	42.9	Very low	46.2	Very low	228 Å²	228	137 Å²	137	99%	0.991	81%	0.81	S	S	*	*				0	0	0	-137.6	-170.8	173.2	-179.1	0	127.8
93	G	42.3	Very low	44.1	Very low	78 Å²	78	141.5 Å²	141.5	80%	0.804	82%	0.823	S	S	*	*				0	0	0	0	0	0	0	0	128.3
94	K	47.3	Very low	42.1	Very low	184 Å²	184	145.6 Å²	145.6	80%	0.8	83%	0.828	S	S	*	*				0	0	0	-156.2	-113	166.5	-169.5	0	125.6	D96	K94-D96 IonicContact NZ-OD1 2.64Å; K94-D96 PolarHBondContact NZ-OD1 3.35Å; K94-D96 IonicContact NZ-OD2 2.95Å; K94-D96 PolarHBondContact NZ-OD2 3.48Å
95	G	47.4	Very low	40.8	Very low	59 Å²	59	148.7 Å²	148.7	61%	0.608	84%	0.843	S	S	*	*				0	0	0	0	0	0	0	0	126.7
96	D	52.4	Low	40.5	Very low	141 Å²	141	150.3 Å²	150.3	75%	0.754	85%	0.851	S	S	*	*				0	0	0	-51	-85.6	0	0	0	122.2	K94	K94-D96 IonicContact NZ-OD1 2.64Å; K94-D96 PolarHBondContact NZ-OD1 3.35Å; K94-D96 IonicContact NZ-OD2 2.95Å; K94-D96 PolarHBondContact NZ-OD2 3.48Å
97	S	60	Low	40.6	Very low	117 Å²	117	153.2 Å²	153.2	82%	0.818	86%	0.861	S	S	*	*				0	0	0	-67.4	0	0	0	0	122.9
98	P	59.3	Low	41.4	Very low	130 Å²	130	147 Å²	147	84%	0.844	85%	0.85	S	S	*	*				0	0	0	43.3	-23.6	0	0	0	128.8
99	L	42.8	Very low	42.4	Very low	173 Å²	173	149.3 Å²	149.3	91%	0.906	85%	0.845	S	S	*	*				0	0	0	-71.9	-173.5	0	0	0	129.7
100	Q	35.3	Very low	43	Very low	184 Å²	184	145.7 Å²	145.7	86%	0.86	84%	0.836	S	S	*	*				0	0	0	-4.3	-172.8	-96.8	0	0	129.7
101	P	35.8	Very low	43.7	Very low	141 Å²	141	142.6 Å²	142.6	92%	0.916	83%	0.826	S	S	*	*				0	0	0	50.3	-39.9	0	0	0	129.8
102	G	20.2	Very low	44.7	Very low	80 Å²	80	141.5 Å²	141.5	83%	0.825	80%	0.798	S	S	*	*				0	0	0	0	0	0	0	0	128.6
103	L	18.5	Very low	45.6	Very low	175 Å²	175	135.6 Å²	135.6	92%	0.916	78%	0.777	S	S	*	*				0	0	0	-80.1	176.3	0	0	0	122.2
104	Q	19.4	Very low	46.3	Very low	170 Å²	170	138.2 Å²	138.2	79%	0.794	77%	0.768	S	S	*	*				0	0	0	165.4	179.8	-15.8	0	0	120.3
105	T	30.8	Very low	46.8	Very low	149 Å²	149	136.4 Å²	136.4	91%	0.914	76%	0.76	S	S	*	*				0	0	0	-78.1	0	0	0	0	125
106	Q	48.4	Very low	47.5	Very low	198 Å²	198	135.4 Å²	135.4	93%	0.925	74%	0.739	S	S	*	*				0	0	0	-162.7	179.7	10.6	0	0	124.5
107	S	53.1	Low	48	Very low	119 Å²	119	133.2 Å²	133.2	83%	0.832	73%	0.727	S	S	*	*				0	0	0	-156.1	0	0	0	0	126.4
108	V	59.3	Low	47.9	Very low	109 Å²	109	133.4 Å²	133.4	66%	0.661	71%	0.714	S	S	*	*				0	0	0	-147	0	0	0	0	129.3
109	F	56	Low	48	Very low	165 Å²	165	133 Å²	133	72%	0.724	70%	0.702	S	S	*	*				0	0	0	-76.8	-63.9	0	0	0	136.5	D112 K116	F109-D112 VanDerWaalsContact C-OD2 3.29Å; F109-K116 VanDerWaalsContact N-NZ 3.19Å
110	N	55.8	Low	48.9	Very low	134 Å²	134	129 Å²	129	72%	0.717	68%	0.681	S	S	*	*	S	Bend		0	0	0	-144.7	108.8	0	0	0	134	D112 L113	N110-D112 VanDerWaalsContact C-CB 3.43Å; N110-D112 HydrophobicContact CB-CB 4.19Å; N110-D112 PolarHBondContact N-OD2 3.26Å; N110-L113 WeakPolarHBondContact O-CA 3.38Å; N110-L113 WeakPolarHBondContact O-CB 3.3Å; N110-L113 PolarHBondContact O-N 3.07Å
111	E	53.9	Low	50.5	Low	171 Å²	171	126.3 Å²	126.3	80%	0.799	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn		0	-44	0	163.1	-168.6	-176.3	0	0	108.9	L113 Q114	E111-L113 PolarHBondContact O-N 3.35Å; E111-Q114 WeakPolarHBondContact O-CB 3.36Å; E111-Q114 PolarHBondContact O-N 2.91Å
112	D	58.1	Low	51.7	Low	67 Å²	67	129 Å²	129	36%	0.358	66%	0.66	S	S	.	*	H	α-helix		6.2	-36	110.6	-162.9	44.8	0	0	0	117.6	F109 N110 K115 K116	F109-D112 VanDerWaalsContact C-OD2 3.29Å; N110-D112 VanDerWaalsContact C-CB 3.43Å; N110-D112 HydrophobicContact CB-CB 4.19Å; N110-D112 PolarHBondContact N-OD2 3.26Å; D112-K115 PolarHBondContact O-N 3Å; D112-K116 WeakPolarHBondContact O-CA 3.46Å; D112-K116 WeakPolarHBondContact O-CB 3.46Å; D112-K116 VanDerWaalsContact O-CG 3.23Å; D112-K116 WeakPolarHBondContact O-CG 3.31Å; D112-K116 PolarHBondContact O-N 3.49Å; D112-K116 VanDerWaalsContact OD1-CE 3.26Å; D112-K116 WeakPolarHBondContact OD1-CE 3.3Å; D112-K116 IonicContact OD1-NZ 2.61Å; D112-K116 PolarHBondContact OD1-NZ 2.72Å; D112-K116 WeakPolarHBondContact OD2-CE 3.47Å; D112-K116 IonicContact OD2-NZ 2.77Å; D112-K116 PolarHBondContact OD2-NZ 2.99Å
113	L	60.4	Low	53.8	Low	103 Å²	103	130.2 Å²	130.2	54%	0.539	65%	0.647	S	S	.	*	H	α-helix	trans	-64.6	-43.1	170.7	-178.8	69.3	0	0	0	111.4	N110 E111 K115 K116 I117	N110-L113 WeakPolarHBondContact O-CA 3.38Å; N110-L113 WeakPolarHBondContact O-CB 3.3Å; N110-L113 PolarHBondContact O-N 3.07Å; E111-L113 PolarHBondContact O-N 3.35Å; L113-K115 VanDerWaalsContact C-N 3.31Å; L113-K115 PolarHBondContact O-N 3.43Å; L113-K116 PolarHBondContact O-N 2.85Å; L113-I117 HydrophobicContact CG-CD1 4.19Å; L113-I117 WeakPolarHBondContact O-CD1 3.32Å; L113-I117 WeakPolarHBondContact O-CG1 3.41Å; L113-I117 PolarHBondContact O-N 2.87Å
114	Q	57.3	Low	56.4	Low	133 Å²	133	128.1 Å²	128.1	62%	0.621	63%	0.633	S	S	*	*	H	α-helix	trans	-61.2	-42.7	176.8	-166.2	73.1	29.5	0	0	110.6	E111	E111-Q114 WeakPolarHBondContact O-CB 3.36Å; E111-Q114 PolarHBondContact O-N 2.91Å
115	K	58.6	Low	59	Low	146 Å²	146	124.6 Å²	124.6	64%	0.635	62%	0.618	S	S	*	*	H	α-helix	trans	-76.7	-32.5	179	-69.7	-179.9	177.5	172.6	0	113.4	D112 L113 I117 E118 E119	D112-K115 PolarHBondContact O-N 3Å; L113-K115 VanDerWaalsContact C-N 3.31Å; L113-K115 PolarHBondContact O-N 3.43Å; K115-I117 VanDerWaalsContact C-N 3.34Å; K115-E118 PolarHBondContact O-N 3.28Å; K115-E119 PolarHBondContact O-N 3.43Å
116	K	61.5	Low	60.9	Low	38 Å²	38	123.6 Å²	123.6	17%	0.165	60%	0.603	C	S	.	*	H	α-helix	trans	-74.3	-24.7	175.3	-80.9	172.6	171.6	163	0	112.8	F109 D112 L113 N120	F109-K116 VanDerWaalsContact N-NZ 3.19Å; D112-K116 WeakPolarHBondContact O-CA 3.46Å; D112-K116 WeakPolarHBondContact O-CB 3.46Å; D112-K116 VanDerWaalsContact O-CG 3.23Å; D112-K116 WeakPolarHBondContact O-CG 3.31Å; D112-K116 PolarHBondContact O-N 3.49Å; D112-K116 VanDerWaalsContact OD1-CE 3.26Å; D112-K116 WeakPolarHBondContact OD1-CE 3.3Å; D112-K116 IonicContact OD1-NZ 2.61Å; D112-K116 PolarHBondContact OD1-NZ 2.72Å; D112-K116 WeakPolarHBondContact OD2-CE 3.47Å; D112-K116 IonicContact OD2-NZ 2.77Å; D112-K116 PolarHBondContact OD2-NZ 2.99Å; L113-K116 PolarHBondContact O-N 2.85Å; K116-N120 WeakPolarHBondContact O-CB 3.29Å; K116-N120 PolarHBondContact O-N 3.45Å; K116-N120 PolarHBondContact O-ND2 3.02Å
117	I	63	Low	61.9	Low	95 Å²	95	121.7 Å²	121.7	49%	0.487	59%	0.592	S	S	.	*	H	α-helix	trans	-60.3	-53.3	165.4	-73.5	162.2	0	0	0	108.7	L113 K115 E119 E121	L113-I117 HydrophobicContact CG-CD1 4.19Å; L113-I117 WeakPolarHBondContact O-CD1 3.32Å; L113-I117 WeakPolarHBondContact O-CG1 3.41Å; L113-I117 PolarHBondContact O-N 2.87Å; K115-I117 VanDerWaalsContact C-N 3.34Å; I117-E119 PolarHBondContact O-N 3.37Å; I117-E121 VanDerWaalsContact O-CB 3.3Å; I117-E121 WeakPolarHBondContact O-CB 3.22Å; I117-E121 PolarHBondContact O-N 3.47Å
118	E	57.9	Low	63.2	Low	121 Å²	121	123.6 Å²	123.6	57%	0.565	58%	0.582	S	S	*	*	H	α-helix	trans	-62	-41.1	178.9	-63.3	173.5	178.8	0	0	113.7	K115 R122	K115-E118 PolarHBondContact O-N 3.28Å; E118-R122 PolarHBondContact O-N 2.91Å
119	E	62	Low	64.2	Low	123 Å²	123	123.3 Å²	123.3	58%	0.575	57%	0.574	S	S	*	*	H	α-helix	trans	-75.4	-41.1	-179.1	-172.4	173.2	-155.7	0	0	113.1	K115 I117 E121 R122 L123	K115-E119 PolarHBondContact O-N 3.43Å; I117-E119 PolarHBondContact O-N 3.37Å; E119-E121 VanDerWaalsContact C-N 3.31Å; E119-E121 PolarHBondContact O-N 3.48Å; E119-R122 PolarHBondContact O-N 3.49Å; E119-L123 HydrophobicContact CG-CD1 4.47Å; E119-L123 PolarHBondContact O-N 2.96Å
120	N	62.3	Low	65	Low	88 Å²	88	118 Å²	118	47%	0.471	56%	0.56	S	S	.	*	H	α-helix	trans	-64.3	-38.4	174.9	-82.1	-84.1	0	0	0	111.2	K116 R122 L123 H124	K116-N120 WeakPolarHBondContact O-CB 3.29Å; K116-N120 PolarHBondContact O-N 3.45Å; K116-N120 PolarHBondContact O-ND2 3.02Å; N120-R122 VanDerWaalsContact C-N 3.28Å; N120-R122 PolarHBondContact O-N 2.88Å; N120-L123 PolarHBondContact O-N 3.14Å; N120-H124 WeakPolarHBondContact O-CB 3.32Å; N120-H124 PolarHBondContact O-N 3Å
121	E	67.4	Low	66	Low	128 Å²	128	115.1 Å²	115.1	60%	0.598	55%	0.545	S	S	*	.	H	α-helix	trans	-55.2	-45.4	176.3	-175	168.3	-144.2	0	0	110.9	I117 E119 I125	I117-E121 VanDerWaalsContact O-CB 3.3Å; I117-E121 WeakPolarHBondContact O-CB 3.22Å; I117-E121 PolarHBondContact O-N 3.47Å; E119-E121 VanDerWaalsContact C-N 3.31Å; E119-E121 PolarHBondContact O-N 3.48Å; E121-I125 WeakPolarHBondContact O-CD1 3.3Å; E121-I125 VanDerWaalsContact O-CG1 3.31Å; E121-I125 WeakPolarHBondContact O-CG1 3.37Å; E121-I125 PolarHBondContact O-N 3.43Å
122	R	62.3	Low	67.2	Low	198 Å²	198	110.5 Å²	110.5	75%	0.747	52%	0.523	S	S	*	.	H	α-helix	trans	-69.3	-43	177.2	-173.2	173.7	179.6	157.5	2.6	114	E118 E119 N120 I125 Q126	E118-R122 PolarHBondContact O-N 2.91Å; E119-R122 PolarHBondContact O-N 3.49Å; N120-R122 VanDerWaalsContact C-N 3.28Å; N120-R122 PolarHBondContact O-N 2.88Å; R122-I125 PolarHBondContact O-N 3Å; R122-Q126 PolarHBondContact O-N 3.07Å
123	L	64.2	Low	68.4	Low	105 Å²	105	112.7 Å²	112.7	55%	0.55	53%	0.531	S	S	.	.	H	α-helix	trans	-69.8	-35.1	-179.6	-87	169.7	0	0	0	112.4	E119 N120 I125 Q126 F127	E119-L123 HydrophobicContact CG-CD1 4.47Å; E119-L123 PolarHBondContact O-N 2.96Å; N120-L123 PolarHBondContact O-N 3.14Å; L123-I125 PolarHBondContact O-N 2.86Å; L123-Q126 PolarHBondContact O-N 3.33Å; L123-F127 PolarHBondContact O-N 2.69Å
124	H	73	Confident	69.2	Low	131 Å²	131	114.1 Å²	114.1	61%	0.606	54%	0.535	S	S	*	.	H	α-helix	trans	-59.1	-45.9	173.1	-103.1	-84.9	0	0	0	111.6	N120 Q126 Y128	N120-H124 WeakPolarHBondContact O-CB 3.32Å; N120-H124 PolarHBondContact O-N 3Å; H124-Q126 PolarHBondContact O-N 2.88Å; H124-Y128 WeakPolarHBondContact O-CB 3.33Å; H124-Y128 PolarHBondContact O-N 3.46Å
125	I	73.6	Confident	70.5	Confident	95 Å²	95	116 Å²	116	49%	0.487	54%	0.536	S	S	.	.	H	α-helix	trans	-54.9	-51.6	179.1	-69.2	162.6	0	0	0	110.8	E121 R122 L123 Y128 E129	E121-I125 WeakPolarHBondContact O-CD1 3.3Å; E121-I125 VanDerWaalsContact O-CG1 3.31Å; E121-I125 WeakPolarHBondContact O-CG1 3.37Å; E121-I125 PolarHBondContact O-N 3.43Å; R122-I125 PolarHBondContact O-N 3Å; L123-I125 PolarHBondContact O-N 2.86Å; I125-Y128 PolarHBondContact O-N 3.36Å; I125-E129 WeakPolarHBondContact O-CG 3.48Å; I125-E129 PolarHBondContact O-N 3.3Å
126	Q	69.9	Low	71.7	Confident	129 Å²	129	114.4 Å²	114.4	60%	0.603	53%	0.529	S	S	*	.	H	α-helix	trans	-75.4	-32.6	-170.5	-155.2	172	44.8	0	0	113.8	R122 L123 H124 A130	R122-Q126 PolarHBondContact O-N 3.07Å; L123-Q126 PolarHBondContact O-N 3.33Å; H124-Q126 PolarHBondContact O-N 2.88Å; Q126-A130 PolarHBondContact O-N 2.7Å
127	F	71.1	Confident	72.8	Confident	157 Å²	157	118.3 Å²	118.3	69%	0.689	55%	0.546	S	S	*	.	H	α-helix	trans	-68.3	-41.7	171	-179.8	-95.1	0	0	0	111.3	L123 A130 D131	L123-F127 PolarHBondContact O-N 2.69Å; F127-A130 PolarHBondContact O-N 2.92Å; F127-D131 PolarHBondContact O-N 3.39Å; F127-D131 VanDerWaalsContact O-N 3.09Å
128	Y	79.5	Confident	73.6	Confident	159 Å²	159	118.7 Å²	118.7	62%	0.624	55%	0.546	S	S	*	.	H	α-helix	trans	-62	-43	178.4	-173	-90.8	0	0	0	112	H124 I125 A130 E132	H124-Y128 WeakPolarHBondContact O-CB 3.33Å; H124-Y128 PolarHBondContact O-N 3.46Å; I125-Y128 PolarHBondContact O-N 3.36Å; Y128-A130 VanDerWaalsContact C-N 3.29Å; Y128-A130 PolarHBondContact O-N 2.76Å; Y128-E132 HydrophobicContact CD1-CG 4.41Å; Y128-E132 HydrophobicContact CE1-CG 4.17Å; Y128-E132 VanDerWaalsContact O-CB 3.29Å; Y128-E132 WeakPolarHBondContact O-CB 3.3Å; Y128-E132 PolarHBondContact O-N 2.93Å
129	E	81.2	Confident	74.9	Confident	104 Å²	104	115.6 Å²	115.6	49%	0.486	54%	0.541	S	S	.	.	H	α-helix	trans	-58.7	-34.8	174.4	-77.8	179.4	165.1	0	0	113.7	I125 Q133	I125-E129 WeakPolarHBondContact O-CG 3.48Å; I125-E129 PolarHBondContact O-N 3.3Å; E129-Q133 WeakPolarHBondContact O-CG 3.48Å; E129-Q133 PolarHBondContact O-N 2.94Å; E129-Q133 PolarHBondContact O-NE2 2.99Å
130	A	71.5	Confident	76.2	Confident	53 Å²	53	116 Å²	116	44%	0.438	54%	0.543	S	S	.	.	H	α-helix	trans	-79.9	-42.6	-178.2	0	0	0	0	0	112.6	Q126 F127 Y128 E132 Q133 H134	Q126-A130 PolarHBondContact O-N 2.7Å; F127-A130 PolarHBondContact O-N 2.92Å; Y128-A130 VanDerWaalsContact C-N 3.29Å; Y128-A130 PolarHBondContact O-N 2.76Å; A130-E132 VanDerWaalsContact C-N 3.34Å; A130-Q133 PolarHBondContact O-N 3.35Å; A130-H134 PolarHBondContact O-N 3.04Å
131	D	76.9	Confident	77.3	Confident	74 Å²	74	117.3 Å²	117.3	40%	0.396	55%	0.55	S	S	.	.	H	α-helix	trans	-60.1	-46.3	172.5	-170.6	68.5	0	0	0	110.1	F127 Q133 H134 R135	F127-D131 PolarHBondContact O-N 3.39Å; F127-D131 VanDerWaalsContact O-N 3.09Å; D131-Q133 VanDerWaalsContact C-N 3.3Å; D131-Q133 PolarHBondContact O-N 2.96Å; D131-H134 PolarHBondContact O-N 3.31Å; D131-R135 WeakPolarHBondContact O-CB 3.35Å; D131-R135 PolarHBondContact O-N 3.39Å; D131-R135 IonicContact OD2-NH1 3.92Å; D131-R135 PolarHBondContact OD2-NH1 3.38Å
132	E	80.1	Confident	78.2	Confident	74 Å²	74	118.5 Å²	118.5	35%	0.346	55%	0.549	S	S	.	.	H	α-helix	trans	-48	-48.4	172.8	-103.1	-103.9	90.2	0	0	112.7	Y128 A130 K136	Y128-E132 HydrophobicContact CD1-CG 4.41Å; Y128-E132 HydrophobicContact CE1-CG 4.17Å; Y128-E132 VanDerWaalsContact O-CB 3.29Å; Y128-E132 WeakPolarHBondContact O-CB 3.3Å; Y128-E132 PolarHBondContact O-N 2.93Å; A130-E132 VanDerWaalsContact C-N 3.34Å; E132-K136 VanDerWaalsContact O-CB 3.27Å; E132-K136 WeakPolarHBondContact O-CB 3.43Å; E132-K136 WeakPolarHBondContact O-CD 3.48Å; E132-K136 WeakPolarHBondContact O-CG 3.44Å; E132-K136 PolarHBondContact O-N 2.97Å; E132-K136 WeakPolarHBondContact OE1-CE 3.44Å; E132-K136 IonicContact OE1-NZ 2.7Å; E132-K136 PolarHBondContact OE1-NZ 2.89Å; E132-K136 VanDerWaalsContact OE1-NZ 3.09Å; E132-K136 IonicContact OE2-NZ 3.96Å; E132-K136 PolarHBondContact OE2-NZ 3.28Å
133	Q	82.9	Confident	79.5	Confident	112 Å²	112	111.6 Å²	111.6	52%	0.523	53%	0.534	S	S	.	.	H	α-helix	trans	-70	-36.4	-176.5	-76.1	179.9	54.9	0	0	113.8	E129 A130 D131 K137	E129-Q133 WeakPolarHBondContact O-CG 3.48Å; E129-Q133 PolarHBondContact O-N 2.94Å; E129-Q133 PolarHBondContact O-NE2 2.99Å; A130-Q133 PolarHBondContact O-N 3.35Å; D131-Q133 VanDerWaalsContact C-N 3.3Å; D131-Q133 PolarHBondContact O-N 2.96Å; Q133-K137 PolarHBondContact O-N 2.94Å
134	H	77.8	Confident	80.8	Confident	134 Å²	134	114.7 Å²	114.7	62%	0.62	54%	0.538	S	S	*	.	H	α-helix	trans	-72.9	-46	174.9	-91.5	-89.9	0	0	0	111.4	A130 D131 K136 K137 E138	A130-H134 PolarHBondContact O-N 3.04Å; D131-H134 PolarHBondContact O-N 3.31Å; H134-K136 VanDerWaalsContact C-N 3.26Å; H134-K136 PolarHBondContact O-N 2.95Å; H134-K137 PolarHBondContact O-N 3.47Å; H134-K137 VanDerWaalsContact O-N 3.11Å; H134-E138 PolarHBondContact O-N 2.91Å
135	R	82.9	Confident	81.5	Confident	171 Å²	171	113.5 Å²	113.5	65%	0.645	54%	0.535	S	S	*	.	H	α-helix	trans	-57.2	-38.3	176.2	-163.6	177.2	-161.6	128.8	-0.1	112.1	D131 A139	D131-R135 WeakPolarHBondContact O-CB 3.35Å; D131-R135 PolarHBondContact O-N 3.39Å; D131-R135 IonicContact OD2-NH1 3.92Å; D131-R135 PolarHBondContact OD2-NH1 3.38Å; R135-A139 VanDerWaalsContact O-CB 3.23Å; R135-A139 WeakPolarHBondContact O-CB 3.28Å; R135-A139 PolarHBondContact O-N 3.4Å
136	K	84	Confident	82.3	Confident	114 Å²	114	115.8 Å²	115.8	50%	0.496	54%	0.544	S	S	.	.	H	α-helix	trans	-60.7	-51.6	171.3	-81.8	164.6	174.8	161.1	0	113	E132 H134 A139 E140	E132-K136 VanDerWaalsContact O-CB 3.27Å; E132-K136 WeakPolarHBondContact O-CB 3.43Å; E132-K136 WeakPolarHBondContact O-CD 3.48Å; E132-K136 WeakPolarHBondContact O-CG 3.44Å; E132-K136 PolarHBondContact O-N 2.97Å; E132-K136 WeakPolarHBondContact OE1-CE 3.44Å; E132-K136 IonicContact OE1-NZ 2.7Å; E132-K136 PolarHBondContact OE1-NZ 2.89Å; E132-K136 VanDerWaalsContact OE1-NZ 3.09Å; E132-K136 IonicContact OE2-NZ 3.96Å; E132-K136 PolarHBondContact OE2-NZ 3.28Å; H134-K136 VanDerWaalsContact C-N 3.26Å; H134-K136 PolarHBondContact O-N 2.95Å; K136-A139 PolarHBondContact O-N 3.01Å; K136-E140 WeakPolarHBondContact O-CB 3.22Å; K136-E140 PolarHBondContact O-N 2.8Å
137	K	85.6	Confident	83.4	Confident	119 Å²	119	115.8 Å²	115.8	52%	0.517	54%	0.542	S	S	.	.	H	α-helix	trans	-67.5	-37.4	-178.5	-72.3	173	-177.8	167.2	0	113	Q133 H134 E140 L141	Q133-K137 PolarHBondContact O-N 2.94Å; H134-K137 PolarHBondContact O-N 3.47Å; H134-K137 VanDerWaalsContact O-N 3.11Å; K137-E140 PolarHBondContact O-N 3.02Å; K137-L141 PolarHBondContact O-N 3.2Å
138	E	79.3	Confident	84.1	Confident	103 Å²	103	112.7 Å²	112.7	48%	0.481	53%	0.532	S	S	.	.	H	α-helix	trans	-70.8	-36.2	178.4	-149.3	-171	158.7	0	0	111.3	H134 R142	H134-E138 PolarHBondContact O-N 2.91Å; E138-R142 WeakPolarHBondContact O-CB 3.48Å; E138-R142 WeakPolarHBondContact O-CG 3.45Å; E138-R142 PolarHBondContact O-N 2.89Å; E138-R142 VanDerWaalsContact O-N 3.1Å; E138-R142 IonicContact OE1-CZ 2.64Å; E138-R142 IonicContact OE1-NH1 2.66Å; E138-R142 PolarHBondContact OE1-NH1 2.85Å; E138-R142 IonicContact OE1-NH2 3.53Å; E138-R142 PolarHBondContact OE1-NH2 3.37Å; E138-R142 IonicContact OE2-NH1 2.73Å
139	A	84.4	Confident	84.5	Confident	57 Å²	57	110.8 Å²	110.8	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-65.4	-43.6	168.8	0	0	0	0	0	112.2	R135 K136 L141 R142 A143	R135-A139 VanDerWaalsContact O-CB 3.23Å; R135-A139 WeakPolarHBondContact O-CB 3.28Å; R135-A139 PolarHBondContact O-N 3.4Å; K136-A139 PolarHBondContact O-N 3.01Å; A139-L141 PolarHBondContact O-N 2.81Å; A139-R142 PolarHBondContact O-N 2.79Å; A139-A143 WeakPolarHBondContact O-CB 3.05Å; A139-A143 PolarHBondContact O-N 2.92Å
140	E	90.3	Very high	85	Confident	131 Å²	131	107.4 Å²	107.4	61%	0.612	52%	0.523	S	S	*	.	H	α-helix	trans	-59.7	-44.9	178.9	-173.8	-176.9	-178.2	0	0	112.2	K136 K137 R144	K136-E140 WeakPolarHBondContact O-CB 3.22Å; K136-E140 PolarHBondContact O-N 2.8Å; K137-E140 PolarHBondContact O-N 3.02Å; E140-R144 WeakPolarHBondContact O-CB 3.31Å; E140-R144 PolarHBondContact O-N 3.41Å
141	L	84.7	Confident	86	Confident	116 Å²	116	108.3 Å²	108.3	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-74	-36.4	178.8	-72.5	177.2	0	0	0	113.3	K137 A139 R144 L145	K137-L141 PolarHBondContact O-N 3.2Å; A139-L141 PolarHBondContact O-N 2.81Å; L141-R144 PolarHBondContact O-N 3.42Å; L141-L145 PolarHBondContact O-N 2.88Å
142	R	87.8	Confident	86.5	Confident	153 Å²	153	107.6 Å²	107.6	58%	0.577	52%	0.522	S	S	*	.	H	α-helix	trans	-63.6	-49.4	172.2	-77.7	-166.6	-179.8	98.2	12.8	111.3	E138 A139 R144 L145 E146	E138-R142 WeakPolarHBondContact O-CB 3.48Å; E138-R142 WeakPolarHBondContact O-CG 3.45Å; E138-R142 PolarHBondContact O-N 2.89Å; E138-R142 VanDerWaalsContact O-N 3.1Å; E138-R142 IonicContact OE1-CZ 2.64Å; E138-R142 IonicContact OE1-NH1 2.66Å; E138-R142 PolarHBondContact OE1-NH1 2.85Å; E138-R142 IonicContact OE1-NH2 3.53Å; E138-R142 PolarHBondContact OE1-NH2 3.37Å; E138-R142 IonicContact OE2-NH1 2.73Å; A139-R142 PolarHBondContact O-N 2.79Å; R142-R144 PolarHBondContact O-N 3.07Å; R142-L145 PolarHBondContact O-N 3.3Å; R142-L145 VanDerWaalsContact O-N 3.07Å; R142-E146 VanDerWaalsContact O-CB 3.3Å; R142-E146 WeakPolarHBondContact O-CB 3.42Å; R142-E146 PolarHBondContact O-N 3.37Å
143	A	89.8	Confident	87	Confident	52 Å²	52	111.2 Å²	111.2	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-58.5	-30.2	176.4	0	0	0	0	0	112.5	A139 K147	A139-A143 WeakPolarHBondContact O-CB 3.05Å; A139-A143 PolarHBondContact O-N 2.92Å; A143-K147 WeakPolarHBondContact O-CB 3.35Å; A143-K147 PolarHBondContact O-N 3.25Å
144	R	91.2	Very high	87.3	Confident	171 Å²	171	111.9 Å²	111.9	65%	0.645	54%	0.542	S	S	*	.	H	α-helix	trans	-77.1	-34	175.7	-170.7	170.8	-177.1	165.4	1.5	113.8	E140 L141 R142 L148	E140-R144 WeakPolarHBondContact O-CB 3.31Å; E140-R144 PolarHBondContact O-N 3.41Å; L141-R144 PolarHBondContact O-N 3.42Å; R142-R144 PolarHBondContact O-N 3.07Å; R144-L148 HydrophobicContact CG-CD1 4.49Å; R144-L148 WeakPolarHBondContact O-CG 3.24Å; R144-L148 PolarHBondContact O-N 3.07Å
145	L	86.3	Confident	88	Confident	105 Å²	105	111.6 Å²	111.6	55%	0.55	54%	0.541	S	S	.	.	H	α-helix	trans	-70.3	-51.4	172.4	-98.7	166.6	0	0	0	110.8	L141 R142 K147 L148 E149	L141-L145 PolarHBondContact O-N 2.88Å; R142-L145 PolarHBondContact O-N 3.3Å; R142-L145 VanDerWaalsContact O-N 3.07Å; L145-K147 PolarHBondContact O-N 3.41Å; L145-L148 PolarHBondContact O-N 2.91Å; L145-E149 PolarHBondContact O-N 3.3Å
146	E	90.8	Very high	88.4	Confident	143 Å²	143	108.4 Å²	108.4	67%	0.668	53%	0.533	S	S	*	.	H	α-helix	trans	-53.3	-39.3	176.1	-173.6	173.7	-159.8	0	0	111.7	R142 G150	R142-E146 VanDerWaalsContact O-CB 3.3Å; R142-E146 WeakPolarHBondContact O-CB 3.42Å; R142-E146 PolarHBondContact O-N 3.37Å; E146-G150 PolarHBondContact O-N 3.21Å
147	K	92.4	Very high	88.8	Confident	129 Å²	129	106 Å²	106	56%	0.561	54%	0.535	S	S	*	.	H	α-helix	trans	-67.4	-39.9	173.1	-175.7	172.4	-172.9	-66.7	0	114	A143 L145 E151	A143-K147 WeakPolarHBondContact O-CB 3.35Å; A143-K147 PolarHBondContact O-N 3.25Å; L145-K147 PolarHBondContact O-N 3.41Å; K147-E151 IonicContact NZ-OE1 3.13Å; K147-E151 PolarHBondContact NZ-OE1 3.3Å; K147-E151 WeakPolarHBondContact O-CB 3.45Å; K147-E151 VanDerWaalsContact O-CG 3.28Å; K147-E151 WeakPolarHBondContact O-CG 3.39Å; K147-E151 PolarHBondContact O-N 3.22Å
148	L	86.8	Confident	89.2	Confident	92 Å²	92	104.1 Å²	104.1	48%	0.482	53%	0.533	S	S	.	.	H	α-helix	trans	-75	-35.2	179.9	-78	169.4	0	0	0	112.5	R144 L145 E151 A152	R144-L148 HydrophobicContact CG-CD1 4.49Å; R144-L148 WeakPolarHBondContact O-CG 3.24Å; R144-L148 PolarHBondContact O-N 3.07Å; L145-L148 PolarHBondContact O-N 2.91Å; L148-E151 PolarHBondContact O-N 3Å; L148-A152 WeakPolarHBondContact O-CB 3.49Å; L148-A152 PolarHBondContact O-N 2.84Å
149	E	88.6	Confident	89.7	Confident	119 Å²	119	102.8 Å²	102.8	56%	0.556	53%	0.531	S	S	*	.	H	α-helix	trans	-67.3	-44.2	173.5	-69	174.4	153.9	0	0	109.8	L145 E151 A152 E153	L145-E149 PolarHBondContact O-N 3.3Å; E149-E151 PolarHBondContact O-N 3.14Å; E149-A152 PolarHBondContact O-N 3.46Å; E149-E153 PolarHBondContact O-N 3.34Å
150	G	91.2	Very high	90.1	Very high	34 Å²	34	103.8 Å²	103.8	35%	0.351	53%	0.529	S	S	.	.	H	α-helix	trans	-60.1	-42.4	171.2	0	0	0	0	0	114.2	E146 A152 E153 E154	E146-G150 PolarHBondContact O-N 3.21Å; G150-A152 VanDerWaalsContact C-N 3.32Å; G150-A152 PolarHBondContact O-N 3.2Å; G150-E153 PolarHBondContact O-N 3.3Å; G150-E154 WeakPolarHBondContact O-CB 3.44Å; G150-E154 PolarHBondContact O-N 3.44Å
151	E	91.5	Very high	90.2	Very high	71 Å²	71	98.8 Å²	98.8	33%	0.332	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-36.7	174.6	-80.6	172.2	-177.2	0	0	112.4	K147 L148 E149 H155	K147-E151 IonicContact NZ-OE1 3.13Å; K147-E151 PolarHBondContact NZ-OE1 3.3Å; K147-E151 WeakPolarHBondContact O-CB 3.45Å; K147-E151 VanDerWaalsContact O-CG 3.28Å; K147-E151 WeakPolarHBondContact O-CG 3.39Å; K147-E151 PolarHBondContact O-N 3.22Å; L148-E151 PolarHBondContact O-N 3Å; E149-E151 PolarHBondContact O-N 3.14Å; E151-H155 WeakPolarHBondContact O-CB 3.37Å; E151-H155 VanDerWaalsContact O-CG 3.25Å; E151-H155 PolarHBondContact O-N 3.06Å; E151-H155 PolarHBondContact O-ND1 3.46Å
152	A	87.6	Confident	90.6	Very high	60 Å²	60	97 Å²	97	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-71.6	-42.6	177	0	0	0	0	0	112.5	L148 E149 G150 H155 Q156	L148-A152 WeakPolarHBondContact O-CB 3.49Å; L148-A152 PolarHBondContact O-N 2.84Å; E149-A152 PolarHBondContact O-N 3.46Å; G150-A152 VanDerWaalsContact C-N 3.32Å; G150-A152 PolarHBondContact O-N 3.2Å; A152-H155 PolarHBondContact O-N 3.03Å; A152-Q156 PolarHBondContact O-N 3.12Å
153	E	91	Very high	90.7	Very high	149 Å²	149	93.2 Å²	93.2	70%	0.696	50%	0.497	S	S	*	.	H	α-helix	trans	-64.1	-41.7	174	-71.7	-171.1	168.7	0	0	111.7	E149 G150 H155 Q156 A157	E149-E153 PolarHBondContact O-N 3.34Å; G150-E153 PolarHBondContact O-N 3.3Å; E153-H155 PolarHBondContact O-N 2.95Å; E153-Q156 PolarHBondContact O-N 3.18Å; E153-A157 VanDerWaalsContact O-CB 3.31Å; E153-A157 WeakPolarHBondContact O-CB 3.46Å; E153-A157 PolarHBondContact O-N 3.01Å
154	E	89.9	Confident	90.9	Very high	126 Å²	126	94.4 Å²	94.4	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-59.7	-45.9	173.9	-175.7	178.6	-169.8	0	0	111.2	G150 A157 V158	G150-E154 WeakPolarHBondContact O-CB 3.44Å; G150-E154 PolarHBondContact O-N 3.44Å; E154-A157 PolarHBondContact O-N 3.28Å; E154-V158 WeakPolarHBondContact O-CB 3.48Å; E154-V158 VanDerWaalsContact O-CG2 3.3Å; E154-V158 WeakPolarHBondContact O-CG2 3.31Å; E154-V158 PolarHBondContact O-N 2.88Å
155	H	91.7	Very high	91.1	Very high	129 Å²	129	92.2 Å²	92.2	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-64.6	-40.8	177.6	-74.9	4.2	0	0	0	113.1	E151 A152 E153 V158 V159	E151-H155 WeakPolarHBondContact O-CB 3.37Å; E151-H155 VanDerWaalsContact O-CG 3.25Å; E151-H155 PolarHBondContact O-N 3.06Å; E151-H155 PolarHBondContact O-ND1 3.46Å; A152-H155 PolarHBondContact O-N 3.03Å; E153-H155 PolarHBondContact O-N 2.95Å; H155-V158 PolarHBondContact O-N 3.47Å; H155-V159 WeakPolarHBondContact O-CG2 3.44Å; H155-V159 PolarHBondContact O-N 2.8Å
156	Q	91.7	Very high	91.4	Very high	104 Å²	104	94.7 Å²	94.7	49%	0.486	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-45.1	175.9	-176	57.9	41.9	0	0	111.1	A152 E153 V158 V159 D160	A152-Q156 PolarHBondContact O-N 3.12Å; E153-Q156 PolarHBondContact O-N 3.18Å; Q156-V158 VanDerWaalsContact C-N 3.27Å; Q156-V158 PolarHBondContact O-N 3.41Å; Q156-V159 PolarHBondContact O-N 2.98Å; Q156-D160 PolarHBondContact NE2-OD1 3.46Å; Q156-D160 VanDerWaalsContact NE2-OD1 3.12Å; Q156-D160 PolarHBondContact NE2-OD2 3.06Å; Q156-D160 PolarHBondContact O-N 3.22Å
157	A	92.3	Very high	91.5	Very high	63 Å²	63	91.2 Å²	91.2	52%	0.521	49%	0.486	S	S	.	.	H	α-helix	trans	-60.6	-34.7	175.4	0	0	0	0	0	112.7	E153 E154 G161	E153-A157 VanDerWaalsContact O-CB 3.31Å; E153-A157 WeakPolarHBondContact O-CB 3.46Å; E153-A157 PolarHBondContact O-N 3.01Å; E154-A157 PolarHBondContact O-N 3.28Å; A157-G161 WeakPolarHBondContact O-CA 3.43Å; A157-G161 PolarHBondContact O-N 3.32Å
158	V	93.3	Very high	91.6	Very high	80 Å²	80	89.5 Å²	89.5	49%	0.485	48%	0.48	S	S	.	.	H	α-helix	trans	-67.8	-41.7	172.2	167.2	0	0	0	0	111.7	E154 H155 Q156 L162	E154-V158 WeakPolarHBondContact O-CB 3.48Å; E154-V158 VanDerWaalsContact O-CG2 3.3Å; E154-V158 WeakPolarHBondContact O-CG2 3.31Å; E154-V158 PolarHBondContact O-N 2.88Å; H155-V158 PolarHBondContact O-N 3.47Å; Q156-V158 VanDerWaalsContact C-N 3.27Å; Q156-V158 PolarHBondContact O-N 3.41Å; V158-L162 HydrophobicContact CG1-CD1 4Å; V158-L162 WeakPolarHBondContact O-CB 3.43Å; V158-L162 VanDerWaalsContact O-CG 3.25Å; V158-L162 WeakPolarHBondContact O-CG 3.29Å; V158-L162 PolarHBondContact O-N 2.96Å
159	V	90.5	Very high	92	Very high	74 Å²	74	87.5 Å²	87.5	45%	0.448	47%	0.472	S	S	.	.	H	α-helix	trans	-65.8	-45.1	177.5	169.6	0	0	0	0	111.8	H155 Q156 L162 T163	H155-V159 WeakPolarHBondContact O-CG2 3.44Å; H155-V159 PolarHBondContact O-N 2.8Å; Q156-V159 PolarHBondContact O-N 2.98Å; V159-L162 PolarHBondContact O-N 3.15Å; V159-T163 WeakPolarHBondContact O-CB 3.17Å; V159-T163 PolarHBondContact O-N 3.06Å; V159-T163 PolarHBondContact O-OG1 3.38Å
160	D	92.4	Very high	92.1	Very high	79 Å²	79	86.3 Å²	86.3	42%	0.422	47%	0.468	S	S	.	.	H	α-helix	trans	-69.7	-38.7	178	-67.7	-32.7	0	0	0	111.4	Q156 L162 T163 T164	Q156-D160 PolarHBondContact NE2-OD1 3.46Å; Q156-D160 VanDerWaalsContact NE2-OD1 3.12Å; Q156-D160 PolarHBondContact NE2-OD2 3.06Å; Q156-D160 PolarHBondContact O-N 3.22Å; D160-L162 VanDerWaalsContact C-N 3.33Å; D160-L162 PolarHBondContact O-N 3.11Å; D160-T163 PolarHBondContact O-N 3.01Å; D160-T164 WeakPolarHBondContact O-CB 3.43Å; D160-T164 PolarHBondContact O-N 3.4Å; D160-T164 PolarHBondContact O-OG1 3.35Å
161	G	93.1	Very high	92.2	Very high	26 Å²	26	90.6 Å²	90.6	27%	0.268	48%	0.479	S	S	.	.	H	α-helix	trans	-63.8	-33.2	173	0	0	0	0	0	113.5	A157 K165	A157-G161 WeakPolarHBondContact O-CA 3.43Å; A157-G161 PolarHBondContact O-N 3.32Å; G161-K165 WeakPolarHBondContact O-CD 3.34Å; G161-K165 WeakPolarHBondContact O-CG 3.38Å; G161-K165 PolarHBondContact O-N 3Å
162	L	92.5	Very high	92.4	Very high	79 Å²	79	93.2 Å²	93.2	41%	0.414	49%	0.486	S	S	.	.	H	α-helix	trans	-74.8	-42.4	171.3	-76.3	170.1	0	0	0	111.9	V158 V159 D160 T164 K165 Y166	V158-L162 HydrophobicContact CG1-CD1 4Å; V158-L162 WeakPolarHBondContact O-CB 3.43Å; V158-L162 VanDerWaalsContact O-CG 3.25Å; V158-L162 WeakPolarHBondContact O-CG 3.29Å; V158-L162 PolarHBondContact O-N 2.96Å; V159-L162 PolarHBondContact O-N 3.15Å; D160-L162 VanDerWaalsContact C-N 3.33Å; D160-L162 PolarHBondContact O-N 3.11Å; L162-T164 PolarHBondContact O-N 2.92Å; L162-K165 PolarHBondContact O-N 3.01Å; L162-Y166 HydrophobicContact CB-CE2 4.31Å; L162-Y166 WeakPolarHBondContact O-CD2 3.12Å; L162-Y166 PolarHBondContact O-N 2.95Å
163	T	90.3	Very high	92.7	Very high	73 Å²	73	95.6 Å²	95.6	45%	0.448	49%	0.49	S	S	.	.	H	α-helix	trans	-62	-45.9	-179.6	-58.6	0	0	0	0	110.8	V159 D160 K165 Y166 V167	V159-T163 WeakPolarHBondContact O-CB 3.17Å; V159-T163 PolarHBondContact O-N 3.06Å; V159-T163 PolarHBondContact O-OG1 3.38Å; D160-T163 PolarHBondContact O-N 3.01Å; T163-K165 PolarHBondContact O-N 3.05Å; T163-Y166 PolarHBondContact O-N 3.4Å; T163-V167 WeakPolarHBondContact O-CG2 3.44Å; T163-V167 PolarHBondContact O-N 3.43Å
164	T	93.8	Very high	92.7	Very high	77 Å²	77	94.5 Å²	94.5	47%	0.472	48%	0.484	S	S	.	.	H	α-helix	trans	-56.7	-49.8	173.7	-53.2	0	0	0	0	111.4	D160 L162 Y166 V167 E168	D160-T164 WeakPolarHBondContact O-CB 3.43Å; D160-T164 PolarHBondContact O-N 3.4Å; D160-T164 PolarHBondContact O-OG1 3.35Å; L162-T164 PolarHBondContact O-N 2.92Å; T164-Y166 VanDerWaalsContact C-N 3.27Å; T164-Y166 PolarHBondContact O-N 2.97Å; T164-V167 PolarHBondContact O-N 3.06Å; T164-V167 VanDerWaalsContact O-N 3.11Å; T164-E168 HydrophobicContact CG2-CG 4.39Å; T164-E168 WeakPolarHBondContact O-CG 3.46Å; T164-E168 PolarHBondContact O-N 3.26Å
165	K	94.6	Very high	92.9	Very high	125 Å²	125	90.5 Å²	90.5	54%	0.543	48%	0.477	S	S	.	.	H	α-helix	trans	-60.5	-33	178	-73.8	168.1	-169.6	166	0	113.4	G161 L162 T163 T169	G161-K165 WeakPolarHBondContact O-CD 3.34Å; G161-K165 WeakPolarHBondContact O-CG 3.38Å; G161-K165 PolarHBondContact O-N 3Å; L162-K165 PolarHBondContact O-N 3.01Å; T163-K165 PolarHBondContact O-N 3.05Å; K165-T169 VanDerWaalsContact O-CB 3.23Å; K165-T169 WeakPolarHBondContact O-CB 3.39Å; K165-T169 PolarHBondContact O-N 3.47Å; K165-T169 VanDerWaalsContact O-N 3.16Å; K165-T169 PolarHBondContact O-OG1 3.44Å
166	Y	92.6	Very high	93	Very high	156 Å²	156	86.8 Å²	86.8	61%	0.612	46%	0.462	S	S	*	.	H	α-helix	trans	-72	-42.9	173.6	-73.1	-56.5	0	0	0	111.9	L162 T163 T164 T169 I170	L162-Y166 HydrophobicContact CB-CE2 4.31Å; L162-Y166 WeakPolarHBondContact O-CD2 3.12Å; L162-Y166 PolarHBondContact O-N 2.95Å; T163-Y166 PolarHBondContact O-N 3.4Å; T164-Y166 VanDerWaalsContact C-N 3.27Å; T164-Y166 PolarHBondContact O-N 2.97Å; Y166-T169 PolarHBondContact O-N 3.11Å; Y166-I170 VanDerWaalsContact O-CG1 3.29Å; Y166-I170 WeakPolarHBondContact O-CG1 3.38Å; Y166-I170 PolarHBondContact O-N 3.43Å
167	V	94.3	Very high	93	Very high	71 Å²	71	87.6 Å²	87.6	43%	0.43	46%	0.463	S	S	.	.	H	α-helix	trans	-60.5	-53.5	175.2	173.3	0	0	0	0	110.8	T163 T164 T169 I170 E171	T163-V167 WeakPolarHBondContact O-CG2 3.44Å; T163-V167 PolarHBondContact O-N 3.43Å; T164-V167 PolarHBondContact O-N 3.06Å; T164-V167 VanDerWaalsContact O-N 3.11Å; V167-T169 PolarHBondContact O-N 2.9Å; V167-T169 VanDerWaalsContact O-N 3.13Å; V167-I170 PolarHBondContact O-N 3.44Å; V167-E171 HydrophobicContact CG1-CG 4.4Å; V167-E171 WeakPolarHBondContact O-CG 3.35Å; V167-E171 PolarHBondContact O-N 2.99Å
168	E	93.9	Very high	93.1	Very high	93 Å²	93	87.1 Å²	87.1	44%	0.435	46%	0.46	S	S	.	.	H	α-helix	trans	-52.2	-37.9	174.8	-72.1	175.2	-173.2	0	0	112.5	T164 R172	T164-E168 HydrophobicContact CG2-CG 4.39Å; T164-E168 WeakPolarHBondContact O-CG 3.46Å; T164-E168 PolarHBondContact O-N 3.26Å; E168-R172 WeakPolarHBondContact O-CB 3.4Å; E168-R172 PolarHBondContact O-N 3.16Å; E168-R172 IonicContact OE2-NH2 3.72Å
169	T	94.3	Very high	93.1	Very high	50 Å²	50	91.4 Å²	91.4	31%	0.307	47%	0.467	S	S	.	.	H	α-helix	trans	-76.5	-34.8	-179.4	-61.7	0	0	0	0	112.1	K165 Y166 V167 R172 L173	K165-T169 VanDerWaalsContact O-CB 3.23Å; K165-T169 WeakPolarHBondContact O-CB 3.39Å; K165-T169 PolarHBondContact O-N 3.47Å; K165-T169 VanDerWaalsContact O-N 3.16Å; K165-T169 PolarHBondContact O-OG1 3.44Å; Y166-T169 PolarHBondContact O-N 3.11Å; V167-T169 PolarHBondContact O-N 2.9Å; V167-T169 VanDerWaalsContact O-N 3.13Å; T169-R172 PolarHBondContact OG1-NH1 2.79Å; T169-L173 HydrophobicContact CG2-CD1 4.09Å; T169-L173 WeakPolarHBondContact O-CB 3.42Å; T169-L173 WeakPolarHBondContact O-CD1 3.36Å; T169-L173 WeakPolarHBondContact O-CG 3.48Å; T169-L173 PolarHBondContact O-N 3.47Å
170	I	91.5	Very high	93.2	Very high	94 Å²	94	93 Å²	93	48%	0.482	47%	0.473	S	S	.	.	H	α-helix	trans	-66.1	-46.8	172.1	-70.8	164.1	0	0	0	110.1	Y166 V167 L173 Q174	Y166-I170 VanDerWaalsContact O-CG1 3.29Å; Y166-I170 WeakPolarHBondContact O-CG1 3.38Å; Y166-I170 PolarHBondContact O-N 3.43Å; V167-I170 PolarHBondContact O-N 3.44Å; I170-L173 PolarHBondContact O-N 2.79Å; I170-Q174 HydrophobicContact CG2-CG 4.41Å; I170-Q174 VanDerWaalsContact CG2-NE2 3.35Å; I170-Q174 WeakPolarHBondContact O-CB 3.33Å; I170-Q174 VanDerWaalsContact O-CG 3.3Å; I170-Q174 WeakPolarHBondContact O-CG 3.32Å; I170-Q174 PolarHBondContact O-N 2.89Å
171	E	94.4	Very high	93.1	Very high	123 Å²	123	93.7 Å²	93.7	58%	0.575	47%	0.474	S	S	*	.	H	α-helix	trans	-61	-45.1	177.1	-70	-179.8	165.4	0	0	111.8	V167 L173 Q174 G175	V167-E171 HydrophobicContact CG1-CG 4.4Å; V167-E171 WeakPolarHBondContact O-CG 3.35Å; V167-E171 PolarHBondContact O-N 2.99Å; E171-L173 PolarHBondContact O-N 2.82Å; E171-Q174 PolarHBondContact O-N 3.11Å; E171-G175 PolarHBondContact O-N 2.98Å
172	R	95.7	Very high	93.2	Very high	127 Å²	127	98 Å²	98	48%	0.479	49%	0.489	S	S	.	.	H	α-helix	trans	-57.6	-46.5	174.2	-168.3	-172.6	-48.5	115.4	9.5	111.7	E168 T169 G175 D176	E168-R172 WeakPolarHBondContact O-CB 3.4Å; E168-R172 PolarHBondContact O-N 3.16Å; E168-R172 IonicContact OE2-NH2 3.72Å; T169-R172 PolarHBondContact OG1-NH1 2.79Å; R172-G175 PolarHBondContact O-N 3.29Å; R172-D176 WeakPolarHBondContact O-CB 3.3Å; R172-D176 PolarHBondContact O-N 3.42Å
173	L	92.6	Very high	93.3	Very high	109 Å²	109	100.4 Å²	100.4	57%	0.571	50%	0.497	S	S	*	.	H	α-helix	trans	-68.4	-32.5	177.7	-72.7	170.3	0	0	0	113	T169 I170 E171 K177	T169-L173 HydrophobicContact CG2-CD1 4.09Å; T169-L173 WeakPolarHBondContact O-CB 3.42Å; T169-L173 WeakPolarHBondContact O-CD1 3.36Å; T169-L173 WeakPolarHBondContact O-CG 3.48Å; T169-L173 PolarHBondContact O-N 3.47Å; I170-L173 PolarHBondContact O-N 2.79Å; E171-L173 PolarHBondContact O-N 2.82Å; L173-K177 VanDerWaalsContact O-CB 3.26Å; L173-K177 WeakPolarHBondContact O-CB 3.45Å; L173-K177 PolarHBondContact O-N 3.42Å
174	Q	91.8	Very high	93.2	Very high	126 Å²	126	100.7 Å²	100.7	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-69.3	-42.9	173	-73.6	178.3	14.7	0	0	111.6	I170 E171 K177 A178	I170-Q174 HydrophobicContact CG2-CG 4.41Å; I170-Q174 VanDerWaalsContact CG2-NE2 3.35Å; I170-Q174 WeakPolarHBondContact O-CB 3.33Å; I170-Q174 VanDerWaalsContact O-CG 3.3Å; I170-Q174 WeakPolarHBondContact O-CG 3.32Å; I170-Q174 PolarHBondContact O-N 2.89Å; E171-Q174 PolarHBondContact O-N 3.11Å; Q174-K177 PolarHBondContact O-N 3.05Å; Q174-A178 WeakPolarHBondContact O-CB 3.29Å; Q174-A178 PolarHBondContact O-N 3.43Å
175	G	94.4	Very high	93.2	Very high	42 Å²	42	101.6 Å²	101.6	43%	0.433	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-43.5	173	0	0	0	0	0	112.5	E171 R172 A178 R179	E171-G175 PolarHBondContact O-N 2.98Å; R172-G175 PolarHBondContact O-N 3.29Å; G175-A178 PolarHBondContact O-N 2.77Å; G175-R179 WeakPolarHBondContact O-CB 3.49Å; G175-R179 PolarHBondContact O-N 2.61Å
176	D	93.3	Very high	93.1	Very high	51 Å²	51	98.2 Å²	98.2	27%	0.273	49%	0.487	S	S	.	.	H	α-helix	trans	-64	-41.8	174.3	-83.6	-31.4	0	0	0	112.6	R172 R179 L180	R172-D176 WeakPolarHBondContact O-CB 3.3Å; R172-D176 PolarHBondContact O-N 3.42Å; D176-R179 PolarHBondContact O-N 3.28Å; D176-R179 IonicContact OD1-CZ 2.95Å; D176-R179 IonicContact OD1-NE 2.71Å; D176-R179 PolarHBondContact OD1-NE 3.19Å; D176-R179 IonicContact OD1-NH2 2.69Å; D176-R179 PolarHBondContact OD1-NH2 3.14Å; D176-L180 WeakPolarHBondContact O-CB 3.38Å; D176-L180 VanDerWaalsContact O-CG 3.28Å; D176-L180 WeakPolarHBondContact O-CG 3.47Å; D176-L180 PolarHBondContact O-N 2.86Å
177	K	91.8	Very high	93	Very high	121 Å²	121	95.2 Å²	95.2	53%	0.526	48%	0.481	S	S	.	.	H	α-helix	trans	-58.3	-53.8	173.2	179.2	-172.7	164.6	-173.9	0	110.9	L173 Q174 R179 L180 E181	L173-K177 VanDerWaalsContact O-CB 3.26Å; L173-K177 WeakPolarHBondContact O-CB 3.45Å; L173-K177 PolarHBondContact O-N 3.42Å; Q174-K177 PolarHBondContact O-N 3.05Å; K177-R179 VanDerWaalsContact C-N 3.28Å; K177-R179 PolarHBondContact O-N 2.96Å; K177-L180 PolarHBondContact O-N 2.87Å; K177-L180 VanDerWaalsContact O-N 3.11Å; K177-E181 WeakPolarHBondContact CE-OE1 3.34Å; K177-E181 HydrophobicContact CG-CG 4.4Å; K177-E181 IonicContact NZ-OE1 2.76Å; K177-E181 WeakPolarHBondContact O-CG 3.33Å; K177-E181 PolarHBondContact O-N 3.48Å
178	A	93.6	Very high	92.8	Very high	54 Å²	54	96.4 Å²	96.4	45%	0.446	48%	0.482	S	S	.	.	H	α-helix	trans	-60.4	-38.3	-179.6	0	0	0	0	0	112.1	Q174 G175 E181 L182	Q174-A178 WeakPolarHBondContact O-CB 3.29Å; Q174-A178 PolarHBondContact O-N 3.43Å; G175-A178 PolarHBondContact O-N 2.77Å; A178-E181 PolarHBondContact O-N 3.09Å; A178-L182 WeakPolarHBondContact O-CB 3.34Å; A178-L182 PolarHBondContact O-N 3.04Å
179	R	94.7	Very high	92.8	Very high	169 Å²	169	97.9 Å²	97.9	64%	0.638	48%	0.484	S	S	*	.	H	α-helix	trans	-63.9	-39.9	174.4	-178.7	165.3	70.1	144.7	-2	112.5	G175 D176 K177 K183	G175-R179 WeakPolarHBondContact O-CB 3.49Å; G175-R179 PolarHBondContact O-N 2.61Å; D176-R179 PolarHBondContact O-N 3.28Å; D176-R179 IonicContact OD1-CZ 2.95Å; D176-R179 IonicContact OD1-NE 2.71Å; D176-R179 PolarHBondContact OD1-NE 3.19Å; D176-R179 IonicContact OD1-NH2 2.69Å; D176-R179 PolarHBondContact OD1-NH2 3.14Å; K177-R179 VanDerWaalsContact C-N 3.28Å; K177-R179 PolarHBondContact O-N 2.96Å; R179-K183 WeakPolarHBondContact O-CB 3.44Å; R179-K183 PolarHBondContact O-N 3.25Å
180	L	90.9	Very high	92.7	Very high	107 Å²	107	100.3 Å²	100.3	56%	0.56	49%	0.492	S	S	*	.	H	α-helix	trans	-73.3	-37.7	175.9	-72.2	170.4	0	0	0	112.5	D176 K177 K183 T184	D176-L180 WeakPolarHBondContact O-CB 3.38Å; D176-L180 VanDerWaalsContact O-CG 3.28Å; D176-L180 WeakPolarHBondContact O-CG 3.47Å; D176-L180 PolarHBondContact O-N 2.86Å; K177-L180 PolarHBondContact O-N 2.87Å; K177-L180 VanDerWaalsContact O-N 3.11Å; L180-K183 PolarHBondContact O-N 3.1Å; L180-T184 WeakPolarHBondContact O-CB 3.45Å; L180-T184 PolarHBondContact O-N 3.46Å; L180-T184 PolarHBondContact O-OG1 3.35Å
181	E	91	Very high	92.5	Very high	95 Å²	95	97.7 Å²	97.7	44%	0.444	48%	0.484	S	S	.	.	H	α-helix	trans	-63.1	-46.8	173.9	-74	175	152.9	0	0	110.9	K177 A178 K183 T184 Q185	K177-E181 WeakPolarHBondContact CE-OE1 3.34Å; K177-E181 HydrophobicContact CG-CG 4.4Å; K177-E181 IonicContact NZ-OE1 2.76Å; K177-E181 WeakPolarHBondContact O-CG 3.33Å; K177-E181 PolarHBondContact O-N 3.48Å; A178-E181 PolarHBondContact O-N 3.09Å; E181-K183 PolarHBondContact O-N 2.94Å; E181-T184 PolarHBondContact O-N 3.06Å; E181-Q185 WeakPolarHBondContact O-CG 3.41Å; E181-Q185 PolarHBondContact O-N 3.28Å
182	L	94.9	Very high	92.4	Very high	115 Å²	115	96.2 Å²	96.2	60%	0.602	48%	0.476	S	S	*	.	H	α-helix	trans	-57.2	-49.3	173.1	-170.9	89.9	0	0	0	111.4	A178 T184 Q185 T186	A178-L182 WeakPolarHBondContact O-CB 3.34Å; A178-L182 PolarHBondContact O-N 3.04Å; L182-T184 VanDerWaalsContact C-N 3.31Å; L182-T184 PolarHBondContact O-N 3.28Å; L182-Q185 PolarHBondContact O-N 2.86Å; L182-T186 PolarHBondContact O-N 3.02Å; L182-T186 PolarHBondContact O-OG1 2.83Å
183	K	94.9	Very high	92.3	Very high	131 Å²	131	94.5 Å²	94.5	57%	0.57	48%	0.476	S	S	*	.	H	α-helix	trans	-60.8	-39.7	179	-173.2	175.6	-178.9	179.9	0	112	R179 L180 E181 T186 L187	R179-K183 WeakPolarHBondContact O-CB 3.44Å; R179-K183 PolarHBondContact O-N 3.25Å; L180-K183 PolarHBondContact O-N 3.1Å; E181-K183 PolarHBondContact O-N 2.94Å; K183-T186 PolarHBondContact O-N 2.93Å; K183-L187 HydrophobicContact CG-CD1 4.13Å; K183-L187 WeakPolarHBondContact O-CG 3.33Å; K183-L187 PolarHBondContact O-N 3.11Å
184	T	88.2	Confident	92	Very high	79 Å²	79	92.2 Å²	92.2	49%	0.485	47%	0.469	S	S	.	.	H	α-helix	trans	-64.4	-46.9	177.3	-56.4	0	0	0	0	110.9	L180 E181 L182 T186 L187 E188	L180-T184 WeakPolarHBondContact O-CB 3.45Å; L180-T184 PolarHBondContact O-N 3.46Å; L180-T184 PolarHBondContact O-OG1 3.35Å; E181-T184 PolarHBondContact O-N 3.06Å; L182-T184 VanDerWaalsContact C-N 3.31Å; L182-T184 PolarHBondContact O-N 3.28Å; T184-T186 VanDerWaalsContact C-N 3.3Å; T184-T186 PolarHBondContact O-N 3.47Å; T184-L187 PolarHBondContact O-N 3.37Å; T184-E188 WeakPolarHBondContact O-CB 3.4Å; T184-E188 PolarHBondContact O-N 3.39Å
185	Q	93.9	Very high	91.9	Very high	96 Å²	96	92.5 Å²	92.5	45%	0.449	46%	0.464	S	S	.	.	H	α-helix	trans	-61.6	-36.2	175.5	-67.5	-177.4	20.7	0	0	112.9	E181 L182 E188 R189	E181-Q185 WeakPolarHBondContact O-CG 3.41Å; E181-Q185 PolarHBondContact O-N 3.28Å; L182-Q185 PolarHBondContact O-N 2.86Å; Q185-E188 WeakPolarHBondContact O-CB 3.46Å; Q185-E188 PolarHBondContact O-N 2.94Å; Q185-R189 WeakPolarHBondContact O-CG 3.48Å; Q185-R189 PolarHBondContact O-N 3.37Å; Q185-R189 VanDerWaalsContact O-N 3.11Å; Q185-R189 PolarHBondContact O-NH1 3.46Å
186	T	92.7	Very high	91.8	Very high	54 Å²	54	95.4 Å²	95.4	33%	0.331	47%	0.468	S	S	.	.	H	α-helix	trans	-67.4	-48.8	176.8	-61.9	0	0	0	0	111.2	L182 K183 T184 E188 R189 E190	L182-T186 PolarHBondContact O-N 3.02Å; L182-T186 PolarHBondContact O-OG1 2.83Å; K183-T186 PolarHBondContact O-N 2.93Å; T184-T186 VanDerWaalsContact C-N 3.3Å; T184-T186 PolarHBondContact O-N 3.47Å; T186-E188 PolarHBondContact O-N 2.88Å; T186-R189 WeakPolarHBondContact O-CB 3.45Å; T186-R189 PolarHBondContact O-N 3.38Å; T186-E190 WeakPolarHBondContact CG2-OE1 3.45Å; T186-E190 WeakPolarHBondContact O-CG 3.29Å; T186-E190 PolarHBondContact O-N 2.96Å
187	L	89.9	Confident	91.7	Very high	93 Å²	93	100 Å²	100	49%	0.487	48%	0.481	S	S	.	.	H	α-helix	trans	-60.3	-33.7	174.4	-69.5	169.8	0	0	0	112.3	K183 T184 A191	K183-L187 HydrophobicContact CG-CD1 4.13Å; K183-L187 WeakPolarHBondContact O-CG 3.33Å; K183-L187 PolarHBondContact O-N 3.11Å; T184-L187 PolarHBondContact O-N 3.37Å; L187-A191 WeakPolarHBondContact O-CB 3.23Å; L187-A191 PolarHBondContact O-N 2.94Å
188	E	89.7	Confident	91.4	Very high	96 Å²	96	98.7 Å²	98.7	45%	0.449	48%	0.484	S	S	.	.	H	α-helix	trans	-64.8	-38.9	172.4	-93.1	-164.4	-138.8	0	0	113.7	T184 Q185 T186 K192	T184-E188 WeakPolarHBondContact O-CB 3.4Å; T184-E188 PolarHBondContact O-N 3.39Å; Q185-E188 WeakPolarHBondContact O-CB 3.46Å; Q185-E188 PolarHBondContact O-N 2.94Å; T186-E188 PolarHBondContact O-N 2.88Å; E188-K192 VanDerWaalsContact O-CD 3.3Å; E188-K192 WeakPolarHBondContact O-CD 3.44Å; E188-K192 WeakPolarHBondContact O-CG 3.41Å; E188-K192 PolarHBondContact O-N 2.95Å; E188-K192 VanDerWaalsContact O-N 3.07Å; E188-K192 IonicContact OE2-NZ 2.67Å; E188-K192 PolarHBondContact OE2-NZ 2.97Å
189	R	94	Very high	91.3	Very high	124 Å²	124	100.9 Å²	100.9	47%	0.468	48%	0.484	S	S	.	.	H	α-helix	trans	-67.7	-51.7	175.6	-69.2	171.7	-166.1	105.8	4.7	109.6	Q185 T186 A191 K192 D193	Q185-R189 WeakPolarHBondContact O-CG 3.48Å; Q185-R189 PolarHBondContact O-N 3.37Å; Q185-R189 VanDerWaalsContact O-N 3.11Å; Q185-R189 PolarHBondContact O-NH1 3.46Å; T186-R189 WeakPolarHBondContact O-CB 3.45Å; T186-R189 PolarHBondContact O-N 3.38Å; R189-A191 VanDerWaalsContact C-N 3.27Å; R189-A191 PolarHBondContact O-N 2.91Å; R189-K192 WeakPolarHBondContact O-CA 3.22Å; R189-K192 WeakPolarHBondContact O-CB 3.42Å; R189-K192 PolarHBondContact O-N 3.39Å; R189-D193 VanDerWaalsContact O-CG 3.31Å; R189-D193 PolarHBondContact O-N 2.91Å
190	E	92.8	Very high	91.2	Very high	101 Å²	101	97.6 Å²	97.6	47%	0.472	48%	0.476	S	S	.	.	H	α-helix	trans	-54.7	-41.8	175.6	-68.9	171.5	-170.6	0	0	112.1	T186 D193 C194	T186-E190 WeakPolarHBondContact CG2-OE1 3.45Å; T186-E190 WeakPolarHBondContact O-CG 3.29Å; T186-E190 PolarHBondContact O-N 2.96Å; E190-D193 PolarHBondContact O-N 2.81Å; E190-C194 WeakPolarHBondContact O-CB 3.29Å; E190-C194 PolarHBondContact O-N 2.64Å; E190-C194 PolarHBondContact O-SG 3.19Å
191	A	86.3	Confident	91	Very high	38 Å²	38	96.2 Å²	96.2	31%	0.314	48%	0.475	S	S	.	.	H	α-helix	trans	-68.8	-31	176.3	0	0	0	0	0	113.6	L187 R189 R195	L187-A191 WeakPolarHBondContact O-CB 3.23Å; L187-A191 PolarHBondContact O-N 2.94Å; R189-A191 VanDerWaalsContact C-N 3.27Å; R189-A191 PolarHBondContact O-N 2.91Å; A191-R195 WeakPolarHBondContact O-CG 3.45Å; A191-R195 VanDerWaalsContact O-CZ 3.31Å; A191-R195 PolarHBondContact O-N 2.87Å; A191-R195 PolarHBondContact O-NH1 3.44Å
192	K	93.3	Very high	91	Very high	93 Å²	93	96.4 Å²	96.4	40%	0.404	48%	0.476	S	S	.	.	H	α-helix	trans	-68.2	-46.9	170.9	-71.9	158.7	-168.6	158.2	0	109.9	E188 R189 C194 R195 M196	E188-K192 VanDerWaalsContact O-CD 3.3Å; E188-K192 WeakPolarHBondContact O-CD 3.44Å; E188-K192 WeakPolarHBondContact O-CG 3.41Å; E188-K192 PolarHBondContact O-N 2.95Å; E188-K192 VanDerWaalsContact O-N 3.07Å; E188-K192 IonicContact OE2-NZ 2.67Å; E188-K192 PolarHBondContact OE2-NZ 2.97Å; R189-K192 WeakPolarHBondContact O-CA 3.22Å; R189-K192 WeakPolarHBondContact O-CB 3.42Å; R189-K192 PolarHBondContact O-N 3.39Å; K192-C194 VanDerWaalsContact C-N 3.35Å; K192-C194 PolarHBondContact O-N 2.78Å; K192-R195 VanDerWaalsContact CG-NH2 3.33Å; K192-R195 WeakPolarHBondContact O-CB 3.39Å; K192-R195 PolarHBondContact O-N 3.16Å; K192-R195 VanDerWaalsContact O-N 3.09Å; K192-M196 WeakPolarHBondContact O-CG 3.41Å; K192-M196 PolarHBondContact O-N 3.36Å
193	D	92.8	Very high	90.8	Very high	90 Å²	90	95.6 Å²	95.6	48%	0.481	47%	0.469	S	S	.	.	H	α-helix	trans	-68.3	-31.5	-179.3	-58.7	-22.1	0	0	0	112.8	R189 E190 R197	R189-D193 VanDerWaalsContact O-CG 3.31Å; R189-D193 PolarHBondContact O-N 2.91Å; E190-D193 PolarHBondContact O-N 2.81Å; D193-R197 WeakPolarHBondContact O-CB 3.31Å; D193-R197 WeakPolarHBondContact O-CG 3.47Å; D193-R197 PolarHBondContact O-N 2.71Å; D193-R197 VanDerWaalsContact O-N 3.16Å; D193-R197 PolarHBondContact O-NE 3.35Å
194	C	87.8	Confident	90.7	Very high	62 Å²	62	95 Å²	95	42%	0.419	47%	0.468	S	S	.	.	H	α-helix	trans	-66.6	-40.6	169.1	-76.1	0	0	0	0	112.2	E190 K192 R197 T198	E190-C194 WeakPolarHBondContact O-CB 3.29Å; E190-C194 PolarHBondContact O-N 2.64Å; E190-C194 PolarHBondContact O-SG 3.19Å; K192-C194 VanDerWaalsContact C-N 3.35Å; K192-C194 PolarHBondContact O-N 2.78Å; C194-R197 PolarHBondContact SG-NH2 2.88Å; C194-T198 WeakPolarHBondContact O-CB 3.29Å; C194-T198 PolarHBondContact O-N 2.88Å; C194-T198 PolarHBondContact O-OG1 3.22Å
195	R	89.8	Confident	90.7	Very high	132 Å²	132	95.6 Å²	95.6	50%	0.498	47%	0.468	S	S	.	.	H	α-helix	trans	-65.4	-49	174.9	-77.2	-172.8	-63.8	-86.2	2.9	111.7	A191 K192 R197 T198 E199	A191-R195 WeakPolarHBondContact O-CG 3.45Å; A191-R195 VanDerWaalsContact O-CZ 3.31Å; A191-R195 PolarHBondContact O-N 2.87Å; A191-R195 PolarHBondContact O-NH1 3.44Å; K192-R195 VanDerWaalsContact CG-NH2 3.33Å; K192-R195 WeakPolarHBondContact O-CB 3.39Å; K192-R195 PolarHBondContact O-N 3.16Å; K192-R195 VanDerWaalsContact O-N 3.09Å; R195-R197 PolarHBondContact O-N 2.98Å; R195-T198 WeakPolarHBondContact O-CA 3.32Å; R195-T198 WeakPolarHBondContact O-CB 3.36Å; R195-T198 PolarHBondContact O-N 3.3Å; R195-E199 WeakPolarHBondContact O-CG 3.3Å; R195-E199 PolarHBondContact O-N 3.35Å
196	M	91.7	Very high	90.6	Very high	102 Å²	102	97.9 Å²	97.9	50%	0.502	47%	0.472	S	S	.	.	H	α-helix	trans	-54	-50.5	177.3	-68.1	-55.5	-57	0	0	111.8	K192 T198 E199 E200	K192-M196 WeakPolarHBondContact O-CG 3.41Å; K192-M196 PolarHBondContact O-N 3.36Å; M196-T198 VanDerWaalsContact C-N 3.28Å; M196-T198 PolarHBondContact O-N 3.48Å; M196-E199 PolarHBondContact O-N 2.81Å; M196-E200 WeakPolarHBondContact O-CG 3.49Å; M196-E200 PolarHBondContact O-N 3.26Å
197	R	91.8	Very high	90.6	Very high	148 Å²	148	103 Å²	103	56%	0.558	49%	0.486	S	S	*	.	H	α-helix	trans	-62.7	-32.4	176.7	-72.6	178.3	-69.2	161.1	-4.4	113.3	D193 C194 R195 C201	D193-R197 WeakPolarHBondContact O-CB 3.31Å; D193-R197 WeakPolarHBondContact O-CG 3.47Å; D193-R197 PolarHBondContact O-N 2.71Å; D193-R197 VanDerWaalsContact O-N 3.16Å; D193-R197 PolarHBondContact O-NE 3.35Å; C194-R197 PolarHBondContact SG-NH2 2.88Å; R195-R197 PolarHBondContact O-N 2.98Å; R197-C201 WeakPolarHBondContact O-CB 3.35Å; R197-C201 PolarHBondContact O-N 2.69Å
198	T	84.8	Confident	90.6	Very high	94 Å²	94	102.5 Å²	102.5	58%	0.577	49%	0.489	S	S	*	.	H	α-helix	trans	-69.8	-41.9	175.3	-57.2	0	0	0	0	111.2	C194 R195 M196 C201 Q202	C194-T198 WeakPolarHBondContact O-CB 3.29Å; C194-T198 PolarHBondContact O-N 2.88Å; C194-T198 PolarHBondContact O-OG1 3.22Å; R195-T198 WeakPolarHBondContact O-CA 3.32Å; R195-T198 WeakPolarHBondContact O-CB 3.36Å; R195-T198 PolarHBondContact O-N 3.3Å; M196-T198 VanDerWaalsContact C-N 3.28Å; M196-T198 PolarHBondContact O-N 3.48Å; T198-C201 PolarHBondContact O-N 2.91Å; T198-Q202 WeakPolarHBondContact O-CB 3.45Å; T198-Q202 PolarHBondContact O-N 2.86Å
199	E	91.9	Very high	90.5	Very high	99 Å²	99	102.9 Å²	102.9	46%	0.463	49%	0.491	S	S	.	.	H	α-helix	trans	-67.1	-42.5	176.4	-70.8	174.4	-147.7	0	0	111.8	R195 M196 Q202 Q203	R195-E199 WeakPolarHBondContact O-CG 3.3Å; R195-E199 PolarHBondContact O-N 3.35Å; M196-E199 PolarHBondContact O-N 2.81Å; E199-Q202 PolarHBondContact O-N 3.18Å; E199-Q203 WeakPolarHBondContact O-CG 3.29Å; E199-Q203 PolarHBondContact O-N 2.84Å
200	E	91.9	Very high	90.3	Very high	100 Å²	100	100.7 Å²	100.7	47%	0.467	49%	0.494	S	S	.	.	H	α-helix	trans	-60.3	-48.4	172.6	-73.7	178.8	164.6	0	0	111.7	M196 Q202 Q203 Q204	M196-E200 WeakPolarHBondContact O-CG 3.49Å; M196-E200 PolarHBondContact O-N 3.26Å; E200-Q202 VanDerWaalsContact C-N 3.32Å; E200-Q202 PolarHBondContact O-N 3.5Å; E200-Q203 PolarHBondContact O-N 2.95Å; E200-Q204 WeakPolarHBondContact O-CG 3.32Å; E200-Q204 PolarHBondContact O-N 3.13Å
201	C	88.1	Confident	90.2	Very high	78 Å²	78	99.1 Å²	99.1	53%	0.527	49%	0.487	S	S	.	.	H	α-helix	trans	-59.3	-42.3	175.2	-176.9	0	0	0	0	111.4	R197 T198 Q203 Q204 L205	R197-C201 WeakPolarHBondContact O-CB 3.35Å; R197-C201 PolarHBondContact O-N 2.69Å; T198-C201 PolarHBondContact O-N 2.91Å; C201-Q203 PolarHBondContact O-N 3.08Å; C201-Q204 PolarHBondContact O-N 3.4Å; C201-L205 WeakPolarHBondContact O-CB 3.32Å; C201-L205 PolarHBondContact O-N 3.02Å
202	Q	89.7	Confident	90.3	Very high	100 Å²	100	102.3 Å²	102.3	47%	0.467	50%	0.498	S	S	.	.	H	α-helix	trans	-66.4	-37.4	176.4	-160.2	-171.1	41.7	0	0	112.2	T198 E199 E200 R206	T198-Q202 WeakPolarHBondContact O-CB 3.45Å; T198-Q202 PolarHBondContact O-N 2.86Å; E199-Q202 PolarHBondContact O-N 3.18Å; E200-Q202 VanDerWaalsContact C-N 3.32Å; E200-Q202 PolarHBondContact O-N 3.5Å; Q202-R206 VanDerWaalsContact CD-NH2 3.25Å; Q202-R206 WeakPolarHBondContact O-CB 3.46Å; Q202-R206 VanDerWaalsContact O-CG 3.26Å; Q202-R206 WeakPolarHBondContact O-CG 3.39Å; Q202-R206 PolarHBondContact O-N 3.46Å
203	Q	91.5	Very high	89.9	Confident	97 Å²	97	100.9 Å²	100.9	45%	0.453	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-43.7	173.2	-75	-173.8	47.6	0	0	112	E199 E200 C201 R206 R207	E199-Q203 WeakPolarHBondContact O-CG 3.29Å; E199-Q203 PolarHBondContact O-N 2.84Å; E200-Q203 PolarHBondContact O-N 2.95Å; C201-Q203 PolarHBondContact O-N 3.08Å; Q203-R206 PolarHBondContact O-N 2.88Å; Q203-R207 WeakPolarHBondContact O-CG 3.39Å; Q203-R207 PolarHBondContact O-N 3.12Å
204	Q	91.8	Very high	89.7	Confident	119 Å²	119	102.7 Å²	102.7	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-61.2	-46.1	174.9	-70.4	175.9	22.8	0	0	110.9	E200 C201 R206 R207 C208	E200-Q204 WeakPolarHBondContact O-CG 3.32Å; E200-Q204 PolarHBondContact O-N 3.13Å; C201-Q204 PolarHBondContact O-N 3.4Å; Q204-R206 PolarHBondContact O-N 3.16Å; Q204-R207 WeakPolarHBondContact O-CB 3.43Å; Q204-R207 PolarHBondContact O-N 2.8Å; Q204-R207 VanDerWaalsContact O-N 3.15Å; Q204-C208 PolarHBondContact O-N 3.38Å; Q204-C208 PolarHBondContact O-SG 2.93Å; Q204-C208 VanDerWaalsContact O-SG 3.34Å
205	L	89.7	Confident	89.7	Confident	92 Å²	92	104 Å²	104	48%	0.482	50%	0.5	S	S	.	.	H	α-helix	trans	-58.8	-44.6	175.4	-178.7	62	0	0	0	111.9	C201 R207 C208 Q209	C201-L205 WeakPolarHBondContact O-CB 3.32Å; C201-L205 PolarHBondContact O-N 3.02Å; L205-R207 PolarHBondContact O-N 3.12Å; L205-C208 PolarHBondContact O-N 3.1Å; L205-Q209 HydrophobicContact CD1-CG 4.23Å; L205-Q209 HydrophobicContact CG-CG 4.41Å; L205-Q209 VanDerWaalsContact O-CB 3.31Å; L205-Q209 WeakPolarHBondContact O-CB 3.3Å; L205-Q209 VanDerWaalsContact O-CG 3.25Å; L205-Q209 WeakPolarHBondContact O-CG 3.27Å; L205-Q209 PolarHBondContact O-N 3.29Å
206	R	91.9	Very high	89.5	Confident	144 Å²	144	101.4 Å²	101.4	54%	0.543	50%	0.499	S	S	.	.	H	α-helix	trans	-61.6	-41.2	174.8	-73	173.6	-167.1	-178.7	8.6	112	Q202 Q203 Q204 Q209 S210	Q202-R206 VanDerWaalsContact CD-NH2 3.25Å; Q202-R206 WeakPolarHBondContact O-CB 3.46Å; Q202-R206 VanDerWaalsContact O-CG 3.26Å; Q202-R206 WeakPolarHBondContact O-CG 3.39Å; Q202-R206 PolarHBondContact O-N 3.46Å; Q203-R206 PolarHBondContact O-N 2.88Å; Q204-R206 PolarHBondContact O-N 3.16Å; R206-Q209 PolarHBondContact O-N 2.97Å; R206-S210 WeakPolarHBondContact O-CB 3.49Å; R206-S210 PolarHBondContact O-N 2.91Å; R206-S210 PolarHBondContact O-OG 2.67Å
207	R	92.1	Very high	89.2	Confident	162 Å²	162	104 Å²	104	61%	0.611	51%	0.507	S	S	*	.	H	α-helix	trans	-61.9	-51.9	175	-69.8	173.2	-163.5	-172.2	8	110.5	Q203 Q204 L205 Q209 S210 E211	Q203-R207 WeakPolarHBondContact O-CG 3.39Å; Q203-R207 PolarHBondContact O-N 3.12Å; Q204-R207 WeakPolarHBondContact O-CB 3.43Å; Q204-R207 PolarHBondContact O-N 2.8Å; Q204-R207 VanDerWaalsContact O-N 3.15Å; L205-R207 PolarHBondContact O-N 3.12Å; R207-Q209 PolarHBondContact O-N 2.95Å; R207-S210 PolarHBondContact O-N 3.44Å; R207-S210 VanDerWaalsContact O-N 3.12Å; R207-S210 PolarHBondContact O-OG 2.88Å; R207-E211 PolarHBondContact O-N 2.98Å
208	C	89.9	Confident	88.6	Confident	82 Å²	82	102.1 Å²	102.1	55%	0.554	51%	0.505	S	S	*	.	H	α-helix	trans	-59.7	-41.8	177.3	-66.7	0	0	0	0	112.6	Q204 L205 E211 L212	Q204-C208 PolarHBondContact O-N 3.38Å; Q204-C208 PolarHBondContact O-SG 2.93Å; Q204-C208 VanDerWaalsContact O-SG 3.34Å; L205-C208 PolarHBondContact O-N 3.1Å; C208-E211 PolarHBondContact O-N 3.47Å; C208-L212 WeakPolarHBondContact O-CB 3.42Å; C208-L212 PolarHBondContact O-N 3.39Å
209	Q	87.4	Confident	88.2	Confident	104 Å²	104	100.7 Å²	100.7	49%	0.486	50%	0.499	S	S	.	.	H	α-helix	trans	-63.2	-40.4	173.9	-77	174.4	-15.3	0	0	112.2	L205 R206 R207 S213	L205-Q209 HydrophobicContact CD1-CG 4.23Å; L205-Q209 HydrophobicContact CG-CG 4.41Å; L205-Q209 VanDerWaalsContact O-CB 3.31Å; L205-Q209 WeakPolarHBondContact O-CB 3.3Å; L205-Q209 VanDerWaalsContact O-CG 3.25Å; L205-Q209 WeakPolarHBondContact O-CG 3.27Å; L205-Q209 PolarHBondContact O-N 3.29Å; R206-Q209 PolarHBondContact O-N 2.97Å; R207-Q209 PolarHBondContact O-N 2.95Å; Q209-S213 WeakPolarHBondContact O-CB 3.39Å; Q209-S213 PolarHBondContact O-N 2.87Å; Q209-S213 PolarHBondContact O-OG 3.4Å
210	S	89.1	Confident	87.5	Confident	77 Å²	77	98.7 Å²	98.7	54%	0.538	50%	0.495	S	S	.	.	H	α-helix	trans	-68	-41.1	178	72.2	0	0	0	0	112.4	R206 R207 S213 R214	R206-S210 WeakPolarHBondContact O-CB 3.49Å; R206-S210 PolarHBondContact O-N 2.91Å; R206-S210 PolarHBondContact O-OG 2.67Å; R207-S210 PolarHBondContact O-N 3.44Å; R207-S210 VanDerWaalsContact O-N 3.12Å; R207-S210 PolarHBondContact O-OG 2.88Å; S210-S213 PolarHBondContact O-N 2.73Å; S210-R214 WeakPolarHBondContact O-CB 3.4Å; S210-R214 PolarHBondContact O-N 3.24Å
211	E	91.5	Very high	86.6	Confident	69 Å²	69	97 Å²	97	32%	0.322	49%	0.494	S	S	.	.	H	α-helix	trans	-72	-43.5	178.1	177.1	54.6	-160.4	0	0	111.5	R207 C208 S213 R214 Q215	R207-E211 PolarHBondContact O-N 2.98Å; C208-E211 PolarHBondContact O-N 3.47Å; E211-S213 VanDerWaalsContact C-N 3.3Å; E211-S213 PolarHBondContact O-N 2.83Å; E211-R214 WeakPolarHBondContact O-CA 3.34Å; E211-R214 WeakPolarHBondContact O-CB 3.31Å; E211-R214 PolarHBondContact O-N 3.36Å; E211-R214 VanDerWaalsContact O-N 3.08Å; E211-R214 IonicContact OE1-CZ 2.67Å; E211-R214 IonicContact OE1-NE 3.47Å; E211-R214 IonicContact OE1-NH2 3.63Å; E211-R214 PolarHBondContact OE1-NH2 2.85Å; E211-R214 IonicContact OE2-CZ 2.86Å; E211-R214 IonicContact OE2-NE 2.76Å; E211-R214 PolarHBondContact OE2-NE 3.32Å; E211-R214 IonicContact OE2-NH2 2.74Å; E211-R214 PolarHBondContact OE2-NH2 3.44Å; E211-Q215 WeakPolarHBondContact O-CG 3.43Å; E211-Q215 PolarHBondContact O-N 2.85Å; E211-Q215 WeakPolarHBondContact OE1-CG 3.35Å; E211-Q215 PolarHBondContact OE1-NE2 3.39Å
212	L	87.5	Confident	85.6	Confident	105 Å²	105	95.5 Å²	95.5	55%	0.55	48%	0.483	S	S	.	.	H	α-helix	trans	-61.9	-39.7	172.7	-175	64	0	0	0	111	C208 R214 Q215 V216	C208-L212 WeakPolarHBondContact O-CB 3.42Å; C208-L212 PolarHBondContact O-N 3.39Å; L212-R214 VanDerWaalsContact C-N 3.3Å; L212-R214 PolarHBondContact O-N 2.98Å; L212-Q215 PolarHBondContact O-N 2.82Å; L212-V216 HydrophobicContact CD1-CG2 4.25Å; L212-V216 HydrophobicContact CG-CG2 4.32Å; L212-V216 VanDerWaalsContact O-CB 3.3Å; L212-V216 WeakPolarHBondContact O-CB 3.44Å; L212-V216 VanDerWaalsContact O-CG2 3.24Å; L212-V216 WeakPolarHBondContact O-CG2 3.17Å; L212-V216 PolarHBondContact O-N 3.38Å
213	S	85.5	Confident	84.6	Confident	63 Å²	63	95.6 Å²	95.6	44%	0.441	49%	0.486	S	S	.	.	H	α-helix	trans	-63.6	-35.3	173.1	-63.7	0	0	0	0	112.4	Q209 S210 E211 K217	Q209-S213 WeakPolarHBondContact O-CB 3.39Å; Q209-S213 PolarHBondContact O-N 2.87Å; Q209-S213 PolarHBondContact O-OG 3.4Å; S210-S213 PolarHBondContact O-N 2.73Å; E211-S213 VanDerWaalsContact C-N 3.3Å; E211-S213 PolarHBondContact O-N 2.83Å; S213-K217 VanDerWaalsContact O-CB 3.32Å; S213-K217 WeakPolarHBondContact O-CB 3.43Å; S213-K217 VanDerWaalsContact O-CG 3.24Å; S213-K217 WeakPolarHBondContact O-CG 3.12Å; S213-K217 PolarHBondContact O-N 3.37Å
214	R	88.8	Confident	83.4	Confident	127 Å²	127	99.3 Å²	99.3	48%	0.479	50%	0.503	S	S	.	.	H	α-helix	trans	-67	-48.3	174.6	-168.1	-174.1	71.3	75.7	2.7	110.7	S210 E211 L212 K217 Q218	S210-R214 WeakPolarHBondContact O-CB 3.4Å; S210-R214 PolarHBondContact O-N 3.24Å; E211-R214 WeakPolarHBondContact O-CA 3.34Å; E211-R214 WeakPolarHBondContact O-CB 3.31Å; E211-R214 PolarHBondContact O-N 3.36Å; E211-R214 VanDerWaalsContact O-N 3.08Å; E211-R214 IonicContact OE1-CZ 2.67Å; E211-R214 IonicContact OE1-NE 3.47Å; E211-R214 IonicContact OE1-NH2 3.63Å; E211-R214 PolarHBondContact OE1-NH2 2.85Å; E211-R214 IonicContact OE2-CZ 2.86Å; E211-R214 IonicContact OE2-NE 2.76Å; E211-R214 PolarHBondContact OE2-NE 3.32Å; E211-R214 IonicContact OE2-NH2 2.74Å; E211-R214 PolarHBondContact OE2-NH2 3.44Å; L212-R214 VanDerWaalsContact C-N 3.3Å; L212-R214 PolarHBondContact O-N 2.98Å; R214-K217 PolarHBondContact O-N 3.11Å; R214-Q218 VanDerWaalsContact O-CB 3.31Å; R214-Q218 WeakPolarHBondContact O-CB 3.2Å; R214-Q218 PolarHBondContact O-N 3.08Å
215	Q	88.1	Confident	81.8	Confident	90 Å²	90	96.6 Å²	96.6	42%	0.421	49%	0.49	S	S	.	.	H	α-helix	trans	-65	-41.4	178.2	-69	179.8	14.7	0	0	112.5	E211 L212 Q218 S219	E211-Q215 WeakPolarHBondContact O-CG 3.43Å; E211-Q215 PolarHBondContact O-N 2.85Å; E211-Q215 WeakPolarHBondContact OE1-CG 3.35Å; E211-Q215 PolarHBondContact OE1-NE2 3.39Å; L212-Q215 PolarHBondContact O-N 2.82Å; Q215-Q218 PolarHBondContact O-N 3.09Å; Q215-S219 VanDerWaalsContact O-CB 3.24Å; Q215-S219 WeakPolarHBondContact O-CB 3.38Å; Q215-S219 PolarHBondContact O-N 3.42Å; Q215-S219 PolarHBondContact O-OG 3.48Å
216	V	86.1	Confident	80.6	Confident	78 Å²	78	93.6 Å²	93.6	47%	0.473	47%	0.473	S	S	.	.	H	α-helix	trans	-65	-43.7	174.9	168.8	0	0	0	0	110.6	L212 S220	L212-V216 HydrophobicContact CD1-CG2 4.25Å; L212-V216 HydrophobicContact CG-CG2 4.32Å; L212-V216 VanDerWaalsContact O-CB 3.3Å; L212-V216 WeakPolarHBondContact O-CB 3.44Å; L212-V216 VanDerWaalsContact O-CG2 3.24Å; L212-V216 WeakPolarHBondContact O-CG2 3.17Å; L212-V216 PolarHBondContact O-N 3.38Å; V216-S220 WeakPolarHBondContact O-CB 3.43Å; V216-S220 PolarHBondContact O-N 3.02Å; V216-S220 PolarHBondContact O-OG 3.17Å
217	K	83.4	Confident	78.9	Confident	157 Å²	157	91.8 Å²	91.8	68%	0.683	48%	0.478	S	S	*	.	H	α-helix	trans	-63	-45.5	174	-77.1	175.5	178.7	-178	0	112.4	S213 R214 S220 S221	S213-K217 VanDerWaalsContact O-CB 3.32Å; S213-K217 WeakPolarHBondContact O-CB 3.43Å; S213-K217 VanDerWaalsContact O-CG 3.24Å; S213-K217 WeakPolarHBondContact O-CG 3.12Å; S213-K217 PolarHBondContact O-N 3.37Å; R214-K217 PolarHBondContact O-N 3.11Å; K217-S220 PolarHBondContact O-N 3.49Å; K217-S221 WeakPolarHBondContact O-CB 3.17Å; K217-S221 PolarHBondContact O-N 2.99Å
218	Q	80.1	Confident	76.9	Confident	108 Å²	108	90.4 Å²	90.4	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-60.7	-48.5	177.6	-177.2	175	-5.4	0	0	111.1	R214 Q215 S221 V222	R214-Q218 VanDerWaalsContact O-CB 3.31Å; R214-Q218 WeakPolarHBondContact O-CB 3.2Å; R214-Q218 PolarHBondContact O-N 3.08Å; Q215-Q218 PolarHBondContact O-N 3.09Å; Q218-S221 PolarHBondContact O-N 3.37Å; Q218-V222 WeakPolarHBondContact O-CG2 3.43Å; Q218-V222 PolarHBondContact O-N 2.79Å
219	S	76.5	Confident	75.1	Confident	64 Å²	64	92.8 Å²	92.8	45%	0.448	49%	0.491	S	S	.	.	H	α-helix	trans	-64.7	-41.6	178.2	-54.9	0	0	0	0	111.6	Q215 V222 I223	Q215-S219 VanDerWaalsContact O-CB 3.24Å; Q215-S219 WeakPolarHBondContact O-CB 3.38Å; Q215-S219 PolarHBondContact O-N 3.42Å; Q215-S219 PolarHBondContact O-OG 3.48Å; S219-V222 PolarHBondContact O-N 3.3Å; S219-I223 WeakPolarHBondContact O-CB 3.24Å; S219-I223 WeakPolarHBondContact O-CD1 3.43Å; S219-I223 WeakPolarHBondContact O-CG1 3.45Å; S219-I223 PolarHBondContact O-N 3.28Å
220	S	77.3	Confident	73.5	Confident	57 Å²	57	92.6 Å²	92.6	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-37.8	176.9	-57.9	0	0	0	0	111.7	V216 K217 I223 Q224	V216-S220 WeakPolarHBondContact O-CB 3.43Å; V216-S220 PolarHBondContact O-N 3.02Å; V216-S220 PolarHBondContact O-OG 3.17Å; K217-S220 PolarHBondContact O-N 3.49Å; S220-I223 PolarHBondContact O-N 2.72Å; S220-Q224 WeakPolarHBondContact O-CB 3.3Å; S220-Q224 PolarHBondContact O-N 2.91Å
221	S	73.7	Confident	72.1	Confident	63 Å²	63	89.6 Å²	89.6	44%	0.441	47%	0.471	S	S	.	.	H	α-helix	trans	-62.8	-50.9	173.5	-163.1	0	0	0	0	110.7	K217 Q218 I223 Q224 E225	K217-S221 WeakPolarHBondContact O-CB 3.17Å; K217-S221 PolarHBondContact O-N 2.99Å; Q218-S221 PolarHBondContact O-N 3.37Å; S221-I223 VanDerWaalsContact C-N 3.31Å; S221-I223 PolarHBondContact O-N 2.92Å; S221-Q224 PolarHBondContact O-N 3.36Å; S221-E225 WeakPolarHBondContact O-CB 3.49Å; S221-E225 PolarHBondContact O-N 3.41Å
222	V	67.2	Low	70.5	Confident	47 Å²	47	90.2 Å²	90.2	29%	0.285	48%	0.48	S	S	.	.	H	α-helix	trans	-58.7	-42.4	176.7	172.4	0	0	0	0	111.2	Q218 S219 K226	Q218-V222 WeakPolarHBondContact O-CG2 3.43Å; Q218-V222 PolarHBondContact O-N 2.79Å; S219-V222 PolarHBondContact O-N 3.3Å; V222-K226 WeakPolarHBondContact O-CA 3.37Å; V222-K226 WeakPolarHBondContact O-CB 3.46Å; V222-K226 PolarHBondContact O-N 3.15Å
223	I	68.6	Low	69.1	Low	103 Å²	103	94.2 Å²	94.2	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-65.2	-46.8	177.2	-72.4	165.6	0	0	0	111.1	S219 S220 S221 E225 V227	S219-I223 WeakPolarHBondContact O-CB 3.24Å; S219-I223 WeakPolarHBondContact O-CD1 3.43Å; S219-I223 WeakPolarHBondContact O-CG1 3.45Å; S219-I223 PolarHBondContact O-N 3.28Å; S220-I223 PolarHBondContact O-N 2.72Å; S221-I223 VanDerWaalsContact C-N 3.31Å; S221-I223 PolarHBondContact O-N 2.92Å; I223-E225 VanDerWaalsContact C-N 3.29Å; I223-E225 PolarHBondContact O-N 2.67Å; I223-V227 HydrophobicContact CB-CG2 4.43Å; I223-V227 HydrophobicContact CG2-CG2 3.82Å; I223-V227 WeakPolarHBondContact O-CB 3.31Å; I223-V227 WeakPolarHBondContact O-CG2 3.35Å; I223-V227 PolarHBondContact O-N 3.14Å; I223-V227 VanDerWaalsContact O-N 3.13Å
224	Q	65.1	Low	68.1	Low	175 Å²	175	97.1 Å²	97.1	82%	0.818	50%	0.498	S	S	*	.	H	α-helix	trans	-70	-24.4	-178.6	-170.7	171.5	11.5	0	0	113.1	S220 S221	S220-Q224 WeakPolarHBondContact O-CB 3.3Å; S220-Q224 PolarHBondContact O-N 2.91Å; S221-Q224 PolarHBondContact O-N 3.36Å
225	E	58.6	Low	66.9	Low	61 Å²	61	95 Å²	95	29%	0.285	50%	0.502	S	S	.	.	H	α-helix	trans	-92.6	-34.4	178.5	-168	-170.3	148.3	0	0	113.2	S221 I223 C505	S221-E225 WeakPolarHBondContact O-CB 3.49Å; S221-E225 PolarHBondContact O-N 3.41Å; I223-E225 VanDerWaalsContact C-N 3.29Å; I223-E225 PolarHBondContact O-N 2.67Å; E225-C505 VanDerWaalsContact OE1-CA 3.31Å; E225-C505 WeakPolarHBondContact OE1-CA 3.49Å; E225-C505 WeakPolarHBondContact OE1-CB 3.34Å; E225-C505 PolarHBondContact OE1-SG 3.45Å
226	K	63.8	Low	65.8	Low	29 Å²	29	96.5 Å²	96.5	13%	0.126	51%	0.514	C	S	.	.	H	α-helix	trans	-120.7	-3.2	-166.3	-62.7	-74.8	-163	149.8	0	116.7	V222 F229 D231 N238	V222-K226 WeakPolarHBondContact O-CA 3.37Å; V222-K226 WeakPolarHBondContact O-CB 3.46Å; V222-K226 PolarHBondContact O-N 3.15Å; K226-F229 CarbonylContact O-C 3.6Å; K226-F229 PolarHBondContact O-N 2.78Å; K226-D231 WeakPolarHBondContact CE-OD1 3.24Å; K226-D231 IonicContact NZ-OD1 2.74Å; K226-D231 PolarHBondContact NZ-OD1 2.95Å; K226-D231 IonicContact NZ-OD2 2.81Å; K226-D231 PolarHBondContact NZ-OD2 3.09Å; K226-N238 PolarHBondContact NZ-OD1 3.4Å
227	V	55.8	Low	65	Low	106 Å²	106	98.9 Å²	98.9	64%	0.642	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	120	172.2	164.3	0	0	0	0	109	I223	I223-V227 HydrophobicContact CB-CG2 4.43Å; I223-V227 HydrophobicContact CG2-CG2 3.82Å; I223-V227 WeakPolarHBondContact O-CB 3.31Å; I223-V227 WeakPolarHBondContact O-CG2 3.35Å; I223-V227 PolarHBondContact O-N 3.14Å; I223-V227 VanDerWaalsContact O-N 3.13Å
228	P	51.1	Low	64.2	Low	133 Å²	133	93.2 Å²	93.2	86%	0.864	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	cis	-110.8	3.5	30.4	10.7	11.9	0	0	0	116.8
229	F	52.2	Low	63.5	Low	132 Å²	132	89.4 Å²	89.4	58%	0.579	48%	0.478	S	S	*	.			trans	-133.5	106.9	-169.7	-166.4	-98.3	0	0	0	112.1	K226 D231 Y237	K226-F229 CarbonylContact O-C 3.6Å; K226-F229 PolarHBondContact O-N 2.78Å; F229-D231 HydrophobicContact CD1-CB 3.93Å; F229-D231 HydrophobicContact CE1-CB 3.99Å; F229-D231 PolarHBondContact O-N 3.09Å; F229-D231 VanDerWaalsContact O-N 3.11Å; F229-Y237 HydrophobicContact CE1-CD2 4.48Å
230	N	53	Low	63.3	Low	100 Å²	100	91.9 Å²	91.9	54%	0.535	49%	0.485	S	S	.	.			trans	-84	85.2	177.2	-172.1	-3.5	0	0	0	111	T232	N230-T232 VanDerWaalsContact C-N 3.29Å; N230-T232 PolarHBondContact O-N 2.7Å; N230-T232 WeakPolarHBondContact OD1-CB 3.4Å; N230-T232 WeakPolarHBondContact OD1-CG2 3.21Å; N230-T232 PolarHBondContact OD1-N 3.1Å; N230-T232 PolarHBondContact OD1-OG1 3.02Å
231	D	60.4	Low	63.1	Low	14 Å²	14	91.3 Å²	91.3	8%	0.075	48%	0.477	C	S	.	.			trans	-74.7	-3.7	175.9	57.6	-8.8	0	0	0	114.6	K226 F229 K233 F234 N238	K226-D231 WeakPolarHBondContact CE-OD1 3.24Å; K226-D231 IonicContact NZ-OD1 2.74Å; K226-D231 PolarHBondContact NZ-OD1 2.95Å; K226-D231 IonicContact NZ-OD2 2.81Å; K226-D231 PolarHBondContact NZ-OD2 3.09Å; F229-D231 HydrophobicContact CD1-CB 3.93Å; F229-D231 HydrophobicContact CE1-CB 3.99Å; F229-D231 PolarHBondContact O-N 3.09Å; F229-D231 VanDerWaalsContact O-N 3.11Å; D231-K233 PolarHBondContact O-N 3.39Å; D231-F234 CarbonylContact O-C 3.59Å; D231-F234 PolarHBondContact O-N 3.34Å; D231-F234 VanDerWaalsContact O-O 3.1Å; D231-N238 PolarHBondContact O-ND2 2.74Å; D231-N238 PolarHBondContact OD1-OD1 2.73Å; D231-N238 PolarHBondContact OD2-OD1 2.98Å
232	T	57.5	Low	63.3	Low	83 Å²	83	90.6 Å²	90.6	51%	0.509	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18	-170.9	59.4	0	0	0	0	115.5	N230 F234	N230-T232 VanDerWaalsContact C-N 3.29Å; N230-T232 PolarHBondContact O-N 2.7Å; N230-T232 WeakPolarHBondContact OD1-CB 3.4Å; N230-T232 WeakPolarHBondContact OD1-CG2 3.21Å; N230-T232 PolarHBondContact OD1-N 3.1Å; N230-T232 PolarHBondContact OD1-OG1 3.02Å; T232-F234 VanDerWaalsContact C-N 3.34Å
233	K	59.3	Low	63.9	Low	188 Å²	188	88.8 Å²	88.8	82%	0.817	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-14.2	171	-79.3	-168.8	172.9	-174.1	0	114.6	D231	D231-K233 PolarHBondContact O-N 3.39Å
234	F	64.8	Low	64.5	Low	125 Å²	125	88.8 Å²	88.8	55%	0.548	47%	0.469	S	S	.	.			trans	-129.6	95.5	-173.3	-64.2	-73.4	0	0	0	109.6	D231 T232 D236 Y237 N238	D231-F234 CarbonylContact O-C 3.59Å; D231-F234 PolarHBondContact O-N 3.34Å; D231-F234 VanDerWaalsContact O-O 3.1Å; T232-F234 VanDerWaalsContact C-N 3.34Å; F234-D236 PolarHBondContact O-N 3.43Å; F234-D236 VanDerWaalsContact O-N 3.14Å; F234-Y237 HydrophobicContact CB-CD2 3.62Å; F234-Y237 HydrophobicContact CB-CE2 4.22Å; F234-Y237 HydrophobicContact CD2-CD2 4.4Å; F234-Y237 HydrophobicContact CG-CD2 4.16Å; F234-Y237 HydrophobicContact CG-CE2 4.34Å; F234-Y237 PolarHBondContact O-N 3Å; F234-N238 PolarHBondContact O-ND2 2.84Å; F234-N238 VanDerWaalsContact O-ND2 3.1Å
235	S	62.9	Low	65.4	Low	82 Å²	82	83.1 Å²	83.1	57%	0.573	44%	0.442	S	S	*	.	H	α-helix	trans	-43.6	-46.8	177.4	171.6	0	0	0	0	112.4	Y237 N238 S239	S235-Y237 VanDerWaalsContact C-N 3.31Å; S235-Y237 PolarHBondContact O-N 3.42Å; S235-N238 WeakPolarHBondContact O-CA 3.47Å; S235-N238 WeakPolarHBondContact O-CB 3.17Å; S235-N238 PolarHBondContact O-N 3.46Å; S235-S239 PolarHBondContact O-N 3.36Å
236	D	65.4	Low	66.8	Low	122 Å²	122	83.1 Å²	83.1	65%	0.652	44%	0.444	S	S	*	.	H	α-helix	trans	-64.4	-32.7	-170.9	-45.9	-28.8	0	0	0	112.9	F234 S239	F234-D236 PolarHBondContact O-N 3.43Å; F234-D236 VanDerWaalsContact O-N 3.14Å; D236-S239 VanDerWaalsContact O-CB 3.31Å; D236-S239 WeakPolarHBondContact O-CB 3.41Å; D236-S239 PolarHBondContact O-N 2.8Å; D236-S239 PolarHBondContact O-OG 3.23Å
237	Y	68.6	Low	68	Low	127 Å²	127	88.4 Å²	88.4	50%	0.498	46%	0.463	S	S	.	.	H	α-helix	trans	-74.1	-28.7	174.5	-66.2	-48.4	0	0	0	112.5	F229 F234 S235 S239 L240	F229-Y237 HydrophobicContact CE1-CD2 4.48Å; F234-Y237 HydrophobicContact CB-CD2 3.62Å; F234-Y237 HydrophobicContact CB-CE2 4.22Å; F234-Y237 HydrophobicContact CD2-CD2 4.4Å; F234-Y237 HydrophobicContact CG-CD2 4.16Å; F234-Y237 HydrophobicContact CG-CE2 4.34Å; F234-Y237 PolarHBondContact O-N 3Å; S235-Y237 VanDerWaalsContact C-N 3.31Å; S235-Y237 PolarHBondContact O-N 3.42Å; Y237-S239 PolarHBondContact O-N 2.88Å; Y237-L240 HydrophobicContact CD1-CD1 4.16Å; Y237-L240 VanDerWaalsContact O-CB 3.29Å; Y237-L240 WeakPolarHBondContact O-CB 3.32Å; Y237-L240 PolarHBondContact O-N 2.82Å
238	N	66.1	Low	69.6	Low	38 Å²	38	93.7 Å²	93.7	20%	0.203	47%	0.472	C	S	.	.	H	α-helix	trans	-67.2	-20.4	172.2	-70.7	-95.7	0	0	0	112	K226 D231 F234 S235 L240 N241 Q513	K226-N238 PolarHBondContact NZ-OD1 3.4Å; D231-N238 PolarHBondContact O-ND2 2.74Å; D231-N238 PolarHBondContact OD1-OD1 2.73Å; D231-N238 PolarHBondContact OD2-OD1 2.98Å; F234-N238 PolarHBondContact O-ND2 2.84Å; F234-N238 VanDerWaalsContact O-ND2 3.1Å; S235-N238 WeakPolarHBondContact O-CA 3.47Å; S235-N238 WeakPolarHBondContact O-CB 3.17Å; S235-N238 PolarHBondContact O-N 3.46Å; N238-L240 PolarHBondContact O-N 2.97Å; N238-N241 WeakPolarHBondContact O-CB 3.14Å; N238-N241 PolarHBondContact O-N 3.14Å; N238-N241 VanDerWaalsContact O-N 3.12Å; N238-Q513 PolarHBondContact O-NE2 2.93Å
239	S	66.6	Low	71.5	Confident	29 Å²	29	88.6 Å²	88.6	20%	0.203	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-19.8	171.6	82.8	0	0	0	0	113.4	S235 D236 Y237 N241	S235-S239 PolarHBondContact O-N 3.36Å; D236-S239 VanDerWaalsContact O-CB 3.31Å; D236-S239 WeakPolarHBondContact O-CB 3.41Å; D236-S239 PolarHBondContact O-N 2.8Å; D236-S239 PolarHBondContact O-OG 3.23Å; Y237-S239 PolarHBondContact O-N 2.88Å; S239-N241 VanDerWaalsContact C-N 3.32Å
240	L	70.8	Confident	73.4	Confident	116 Å²	116	82.4 Å²	82.4	61%	0.607	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-14.5	175.3	-54.4	177.4	0	0	0	112.7	Y237 N238 V242	Y237-L240 HydrophobicContact CD1-CD1 4.16Å; Y237-L240 VanDerWaalsContact O-CB 3.29Å; Y237-L240 WeakPolarHBondContact O-CB 3.32Å; Y237-L240 PolarHBondContact O-N 2.82Å; N238-L240 PolarHBondContact O-N 2.97Å; L240-V242 PolarHBondContact O-N 2.96Å
241	N	74.6	Confident	75.3	Confident	44 Å²	44	80.4 Å²	80.4	24%	0.235	40%	0.398	C	S	.	.			trans	-78.3	63.4	174.8	-165.6	12	0	0	0	110.8	N238 S239 P502	N238-N241 WeakPolarHBondContact O-CB 3.14Å; N238-N241 PolarHBondContact O-N 3.14Å; N238-N241 VanDerWaalsContact O-N 3.12Å; S239-N241 VanDerWaalsContact C-N 3.32Å; N241-P502 HydrophobicContact CB-CB 4.42Å; N241-P502 WeakPolarHBondContact ND2-CB 3.42Å; N241-P502 WeakPolarHBondContact O-CB 3.03Å; N241-P502 WeakPolarHBondContact O-CG 3.38Å
242	V	78.1	Confident	76.9	Confident	48 Å²	48	83.6 Å²	83.6	29%	0.291	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-75.1	139.2	-176	-70.1	0	0	0	0	112.2	L240 Q513 S516 M517	L240-V242 PolarHBondContact O-N 2.96Å; V242-Q513 WeakPolarHBondContact CG1-O 3.43Å; V242-S516 WeakPolarHBondContact CG1-OG 3.42Å; V242-M517 HydrophobicContact CB-CB 4.08Å; V242-M517 HydrophobicContact CG1-CB 4.27Å
243	P	78.6	Confident	78.7	Confident	9 Å²	9	79.8 Å²	79.8	6%	0.058	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-70.2	165.1	174.1	33.9	-39.6	0	0	0	111.3	Y500 L509 M517	P243-Y500 HydrophobicContact CB-CD1 4.38Å; P243-Y500 HydrophobicContact CG-CD1 4.15Å; P243-L509 HydrophobicContact CB-CD1 4.44Å; P243-L509 HydrophobicContact CG-CD1 3.63Å; P243-M517 HydrophobicContact CG-CG 4.39Å; P243-M517 VanDerWaalsContact O-CG 3.24Å; P243-M517 WeakPolarHBondContact O-CG 3.46Å
244	S	81.1	Confident	80.4	Confident	104 Å²	104	75.3 Å²	75.3	73%	0.727	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-71.1	144.5	167.8	50.6	0	0	0	0	111.6	N246	S244-N246 PolarHBondContact O-N 3.05Å; S244-N246 VanDerWaalsContact O-N 3.15Å
245	H	84.5	Confident	81.8	Confident	56 Å²	56	73.6 Å²	73.6	26%	0.259	36%	0.363	S	S	.	.			trans	-71.3	108	178	-176.8	66.8	0	0	0	111.7	R247 M517 K521	H245-R247 PolarHBondContact O-N 3.29Å; H245-M517 HydrophobicContact CB-SD 3.58Å; H245-M517 VanDerWaalsContact CB-SD 3.58Å; H245-K521 PolarHBondContact CE1-NZ 2.91Å; H245-K521 WeakPolarHBondContact NE2-CE 3.37Å; H245-K521 PolarHBondContact NE2-NZ 3.05Å; H245-K521 VanDerWaalsContact NE2-NZ 3.12Å
246	N	87.4	Confident	83.4	Confident	61 Å²	61	70 Å²	70	33%	0.326	34%	0.337	S	S	.	.			trans	-92.7	74.2	-177.5	-167.2	-10.1	0	0	0	112.8	S244 R248 H249 Q250 G499 Y500	S244-N246 PolarHBondContact O-N 3.05Å; S244-N246 VanDerWaalsContact O-N 3.15Å; N246-R248 PolarHBondContact O-N 3.3Å; N246-R248 VanDerWaalsContact O-N 3.11Å; N246-H249 HydrophobicContact CB-CB 4.04Å; N246-H249 VanDerWaalsContact CG-CB 3.4Å; N246-H249 WeakPolarHBondContact ND2-CB 3.47Å; N246-H249 PolarHBondContact O-N 3.3Å; N246-H249 PolarHBondContact OD1-N 3.44Å; N246-H249 VanDerWaalsContact OD1-N 3.12Å; N246-Q250 PolarHBondContact O-N 3Å; N246-G499 PolarHBondContact ND2-O 3.16Å; N246-G499 VanDerWaalsContact ND2-O 3.07Å; N246-Y500 HydrophobicContact CB-CD1 4.44Å; N246-Y500 HydrophobicContact CB-CE1 3.98Å; N246-Y500 HydrophobicContact CB-CE2 4.5Å; N246-Y500 PolarHBondContact O-OH 2.72Å
247	R	89.3	Confident	84.9	Confident	140 Å²	140	65 Å²	65	53%	0.528	31%	0.311	S	S	.	.	H	α-helix	trans	-52.6	-34.9	179.6	-168.8	-175.6	-174.9	-145.1	-3.4	113	H245 Q250 L251 E328	H245-R247 PolarHBondContact O-N 3.29Å; R247-Q250 PolarHBondContact O-N 2.82Å; R247-L251 HydrophobicContact CG-CD1 4.13Å; R247-L251 HydrophobicContact CG-CG 4.4Å; R247-L251 WeakPolarHBondContact O-CB 3.41Å; R247-L251 WeakPolarHBondContact O-CG 3.22Å; R247-L251 PolarHBondContact O-N 2.67Å; R247-E328 IonicContact CZ-OE2 3.78Å; R247-E328 IonicContact NE-OE2 3.62Å; R247-E328 PolarHBondContact NE-OE2 2.67Å; R247-E328 VanDerWaalsContact NH2-CD 3.33Å; R247-E328 IonicContact NH2-OE1 2.83Å; R247-E328 PolarHBondContact NH2-OE1 3.41Å; R247-E328 VanDerWaalsContact NH2-OE1 3.14Å; R247-E328 IonicContact NH2-OE2 2.65Å; R247-E328 PolarHBondContact NH2-OE2 2.99Å
248	R	90.3	Very high	86.3	Confident	217 Å²	217	61.4 Å²	61.4	82%	0.819	31%	0.305	S	S	*	.	H	α-helix	trans	-67.4	-41.2	178.7	-173	-179.9	-178.9	-170.1	0.5	112.3	N246 K252	N246-R248 PolarHBondContact O-N 3.3Å; N246-R248 VanDerWaalsContact O-N 3.11Å; R248-K252 PolarHBondContact O-N 3.24Å; R248-K252 VanDerWaalsContact O-N 3.14Å
249	H	90.8	Very high	87.8	Confident	26 Å²	26	63.8 Å²	63.8	12%	0.12	32%	0.315	C	S	.	.	H	α-helix	trans	-66.3	-43.8	173.1	-178.1	96.2	0	0	0	110.9	N246 L251 K252 A253 F494 G499 Y500	N246-H249 HydrophobicContact CB-CB 4.04Å; N246-H249 VanDerWaalsContact CG-CB 3.4Å; N246-H249 WeakPolarHBondContact ND2-CB 3.47Å; N246-H249 PolarHBondContact O-N 3.3Å; N246-H249 PolarHBondContact OD1-N 3.44Å; N246-H249 VanDerWaalsContact OD1-N 3.12Å; H249-L251 PolarHBondContact O-N 2.85Å; H249-K252 PolarHBondContact O-N 3.37Å; H249-A253 WeakPolarHBondContact O-CB 3.31Å; H249-A253 PolarHBondContact O-N 3.27Å; H249-F494 AromaticContact CE1-CE2 3.3Å; H249-F494 WeakPolarHBondContact CE1-CE2 3.36Å; H249-F494 AromaticContact CE1-CZ 3.54Å; H249-F494 AromaticContact CG-CE2 3.97Å; H249-F494 AromaticContact ND1-CE2 3.32Å; H249-F494 VanDerWaalsContact ND1-CE2 3.32Å; H249-F494 WeakPolarHBondContact ND1-CE2 3.44Å; H249-F494 AromaticContact ND1-CZ 3.96Å; H249-F494 AromaticContact NE2-CE2 3.94Å; H249-F494 AromaticContact NE2-CZ 3.77Å; H249-G499 VanDerWaalsContact CE1-CA 3.4Å; H249-G499 WeakPolarHBondContact CE1-CA 3.37Å; H249-G499 VanDerWaalsContact ND1-CA 3.34Å; H249-G499 WeakPolarHBondContact ND1-CA 3.38Å; H249-Y500 AromaticContact CD2-CE2 3.82Å
250	Q	92	Very high	89.2	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.009	31%	0.311	C	S	.	.	H	α-helix	trans	-64.6	-37.9	-179	-167	59.1	16.4	0	0	113.3	N246 R247 A253 R254 T327 T330 T332	N246-Q250 PolarHBondContact O-N 3Å; R247-Q250 PolarHBondContact O-N 2.82Å; Q250-A253 PolarHBondContact O-N 3.27Å; Q250-R254 PolarHBondContact O-N 2.85Å; Q250-T327 VanDerWaalsContact CG-O 3.24Å; Q250-T327 WeakPolarHBondContact CG-O 3.25Å; Q250-T327 PolarHBondContact NE2-O 3.41Å; Q250-T330 PolarHBondContact NE2-O 3.34Å; Q250-T330 PolarHBondContact NE2-OG1 2.89Å; Q250-T332 PolarHBondContact NE2-OG1 2.81Å; Q250-T332 PolarHBondContact OE1-OG1 3.38Å
251	L	92.9	Very high	90.5	Very high	57 Å²	57	58.2 Å²	58.2	30%	0.298	29%	0.285	S	S	.	.	H	α-helix	trans	-64.5	-50.1	171.3	-72.4	170.8	0	0	0	111.1	R247 H249 A253 R254 D255 E328	R247-L251 HydrophobicContact CG-CD1 4.13Å; R247-L251 HydrophobicContact CG-CG 4.4Å; R247-L251 WeakPolarHBondContact O-CB 3.41Å; R247-L251 WeakPolarHBondContact O-CG 3.22Å; R247-L251 PolarHBondContact O-N 2.67Å; H249-L251 PolarHBondContact O-N 2.85Å; L251-A253 VanDerWaalsContact C-N 3.26Å; L251-A253 PolarHBondContact O-N 2.56Å; L251-R254 WeakPolarHBondContact O-CB 3.24Å; L251-R254 PolarHBondContact O-N 3.41Å; L251-D255 VanDerWaalsContact O-CG 3.24Å; L251-D255 PolarHBondContact O-N 3.21Å; L251-E328 HydrophobicContact CD2-CG 3.97Å
252	K	93.9	Very high	91.6	Very high	82 Å²	82	58.6 Å²	58.6	36%	0.357	29%	0.292	S	S	.	.	H	α-helix	trans	-58.8	-37	176.4	-178.8	169	174.9	175.6	0	112.2	R248 H249 R254 D255 V256 N491 F494	R248-K252 PolarHBondContact O-N 3.24Å; R248-K252 VanDerWaalsContact O-N 3.14Å; H249-K252 PolarHBondContact O-N 3.37Å; K252-R254 VanDerWaalsContact C-N 3.32Å; K252-R254 PolarHBondContact O-N 3.22Å; K252-D255 PolarHBondContact O-N 3.14Å; K252-V256 HydrophobicContact CG-CG2 3.87Å; K252-V256 VanDerWaalsContact O-CB 3.29Å; K252-V256 WeakPolarHBondContact O-CB 3.42Å; K252-V256 WeakPolarHBondContact O-CG2 3.23Å; K252-V256 PolarHBondContact O-N 2.7Å; K252-N491 WeakPolarHBondContact CE-OD1 3.48Å; K252-N491 PolarHBondContact NZ-OD1 2.89Å; K252-F494 HydrophobicContact CB-CD2 4.49Å; K252-F494 HydrophobicContact CB-CE2 3.86Å; K252-F494 HydrophobicContact CB-CZ 4.19Å; K252-F494 HydrophobicContact CD-CD2 3.5Å; K252-F494 VanDerWaalsContact CD-CD2 3.5Å; K252-F494 HydrophobicContact CD-CE2 3.78Å; K252-F494 HydrophobicContact CD-CG 3.97Å; K252-F494 HydrophobicContact CG-CD2 3.87Å; K252-F494 HydrophobicContact CG-CE1 4.41Å; K252-F494 HydrophobicContact CG-CE2 3.65Å; K252-F494 HydrophobicContact CG-CG 4.32Å; K252-F494 HydrophobicContact CG-CZ 3.96Å
253	A	94	Very high	92.6	Very high	3 Å²	3	58.2 Å²	58.2	3%	0.025	29%	0.286	C	S	.	.	H	α-helix	trans	-59.1	-44.3	175.6	0	0	0	0	0	111.6	H249 Q250 L251 T257 I326 T332 F494	H249-A253 WeakPolarHBondContact O-CB 3.31Å; H249-A253 PolarHBondContact O-N 3.27Å; Q250-A253 PolarHBondContact O-N 3.27Å; L251-A253 VanDerWaalsContact C-N 3.26Å; L251-A253 PolarHBondContact O-N 2.56Å; A253-T257 WeakPolarHBondContact O-CB 3.35Å; A253-T257 PolarHBondContact O-N 3.48Å; A253-T257 PolarHBondContact O-OG1 3.08Å; A253-I326 HydrophobicContact CB-CG2 4.45Å; A253-T332 HydrophobicContact CB-CG2 3.97Å; A253-F494 HydrophobicContact CB-CE1 4.39Å; A253-F494 HydrophobicContact CB-CZ 3.88Å
254	R	95.2	Very high	93.5	Very high	94 Å²	94	58.8 Å²	58.8	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-67.1	-43.9	176.3	-165.3	176.8	179.7	-163	-3.8	112.1	Q250 L251 K252 T257 S258 Y323 I326	Q250-R254 PolarHBondContact O-N 2.85Å; L251-R254 WeakPolarHBondContact O-CB 3.24Å; L251-R254 PolarHBondContact O-N 3.41Å; K252-R254 VanDerWaalsContact C-N 3.32Å; K252-R254 PolarHBondContact O-N 3.22Å; R254-T257 PolarHBondContact O-N 2.86Å; R254-S258 WeakPolarHBondContact O-CB 3.49Å; R254-S258 PolarHBondContact O-N 3Å; R254-Y323 HydrophobicContact CG-CE2 4Å; R254-I326 HydrophobicContact CB-CG2 3.88Å; R254-I326 WeakPolarHBondContact CD-O 3.39Å; R254-I326 HydrophobicContact CG-CG2 4.27Å
255	D	95.8	Very high	94.3	Very high	88 Å²	88	57.6 Å²	57.6	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-45	179.4	-60.7	-29.6	0	0	0	111.9	L251 K252 S258 Q259	L251-D255 VanDerWaalsContact O-CG 3.24Å; L251-D255 PolarHBondContact O-N 3.21Å; K252-D255 PolarHBondContact O-N 3.14Å; D255-S258 WeakPolarHBondContact O-CB 3.44Å; D255-S258 PolarHBondContact O-N 3.37Å; D255-Q259 WeakPolarHBondContact O-CG 3.39Å; D255-Q259 PolarHBondContact O-N 3.23Å; D255-Q259 VanDerWaalsContact O-N 3.1Å; D255-Q259 PolarHBondContact O-NE2 3.08Å
256	V	96.1	Very high	95	Very high	6 Å²	6	58 Å²	58	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-44.2	176.5	170	0	0	0	0	110.2	K252 S258 Q259 A260 F487 F494 F495	K252-V256 HydrophobicContact CG-CG2 3.87Å; K252-V256 VanDerWaalsContact O-CB 3.29Å; K252-V256 WeakPolarHBondContact O-CB 3.42Å; K252-V256 WeakPolarHBondContact O-CG2 3.23Å; K252-V256 PolarHBondContact O-N 2.7Å; V256-S258 VanDerWaalsContact C-N 3.32Å; V256-S258 PolarHBondContact O-N 2.69Å; V256-Q259 PolarHBondContact O-N 3.36Å; V256-A260 WeakPolarHBondContact O-CB 3.24Å; V256-A260 PolarHBondContact O-N 3.06Å; V256-F487 HydrophobicContact CG1-CE2 4.33Å; V256-F487 HydrophobicContact CG1-CZ 3.74Å; V256-F487 WeakPolarHBondContact O-CZ 3.18Å; V256-F494 HydrophobicContact CB-CE1 4.45Å; V256-F494 HydrophobicContact CG1-CD1 4.48Å; V256-F494 HydrophobicContact CG2-CD1 4.26Å; V256-F494 HydrophobicContact CG2-CE1 4.36Å; V256-F495 HydrophobicContact CG1-CE1 3.67Å; V256-F495 HydrophobicContact CG1-CZ 3.52Å
257	T	96.3	Very high	95.5	Very high	18 Å²	18	56 Å²	56	11%	0.11	27%	0.265	C	S	.	.	H	α-helix	trans	-66	-34.9	176.6	-49.6	0	0	0	0	111.9	A253 R254 Q259 A260 L261 F319 L322 Y323 I326	A253-T257 WeakPolarHBondContact O-CB 3.35Å; A253-T257 PolarHBondContact O-N 3.48Å; A253-T257 PolarHBondContact O-OG1 3.08Å; R254-T257 PolarHBondContact O-N 2.86Å; T257-Q259 PolarHBondContact O-N 2.74Å; T257-A260 PolarHBondContact O-N 3.02Å; T257-L261 WeakPolarHBondContact O-CB 3.3Å; T257-L261 PolarHBondContact O-N 3.29Å; T257-F319 HydrophobicContact CG2-CE1 3.76Å; T257-F319 HydrophobicContact CG2-CZ 4.13Å; T257-L322 HydrophobicContact CG2-CG 4.36Å; T257-Y323 HydrophobicContact CG2-CD2 4.27Å; T257-I326 HydrophobicContact CG2-CD1 4.06Å; T257-I326 WeakPolarHBondContact OG1-CD1 3.48Å
258	S	97.1	Very high	96	Very high	51 Å²	51	49.4 Å²	49.4	36%	0.357	24%	0.24	S	C	.	.	H	α-helix	trans	-63.2	-39.8	175.1	-155.2	0	0	0	0	112.4	R254 D255 V256 S262	R254-S258 WeakPolarHBondContact O-CB 3.49Å; R254-S258 PolarHBondContact O-N 3Å; D255-S258 WeakPolarHBondContact O-CB 3.44Å; D255-S258 PolarHBondContact O-N 3.37Å; V256-S258 VanDerWaalsContact C-N 3.32Å; V256-S258 PolarHBondContact O-N 2.69Å; S258-S262 PolarHBondContact O-N 2.9Å
259	Q	97.7	Very high	96.3	Very high	89 Å²	89	41.4 Å²	41.4	42%	0.416	22%	0.22	S	C	.	.	H	α-helix	trans	-68.8	-46.1	175.3	-71.5	167.7	49.8	0	0	110.9	D255 V256 T257 L261 S262 F263 F487	D255-Q259 WeakPolarHBondContact O-CG 3.39Å; D255-Q259 PolarHBondContact O-N 3.23Å; D255-Q259 VanDerWaalsContact O-N 3.1Å; D255-Q259 PolarHBondContact O-NE2 3.08Å; V256-Q259 PolarHBondContact O-N 3.36Å; T257-Q259 PolarHBondContact O-N 2.74Å; Q259-L261 VanDerWaalsContact C-N 3.3Å; Q259-L261 PolarHBondContact O-N 3.32Å; Q259-S262 PolarHBondContact O-N 2.72Å; Q259-S262 VanDerWaalsContact O-N 3.15Å; Q259-S262 PolarHBondContact O-OG 3.44Å; Q259-F263 HydrophobicContact CB-CE2 4.32Å; Q259-F263 WeakPolarHBondContact O-CD2 3.41Å; Q259-F263 PolarHBondContact O-N 3.45Å; Q259-F263 VanDerWaalsContact O-N 3.13Å; Q259-F487 HydrophobicContact CB-CD2 4.24Å; Q259-F487 HydrophobicContact CB-CE2 3.56Å; Q259-F487 HydrophobicContact CB-CZ 4.06Å; Q259-F487 HydrophobicContact CG-CE2 4.48Å
260	A	97.5	Very high	96.7	Very high	16 Å²	16	40.2 Å²	40.2	13%	0.132	22%	0.215	C	C	.	.	H	α-helix	trans	-57.7	-41.5	176	0	0	0	0	0	112.3	V256 T257 F263 I264 F319 F487	V256-A260 WeakPolarHBondContact O-CB 3.24Å; V256-A260 PolarHBondContact O-N 3.06Å; T257-A260 PolarHBondContact O-N 3.02Å; A260-F263 PolarHBondContact O-N 3.07Å; A260-I264 WeakPolarHBondContact O-CG1 3.27Å; A260-I264 PolarHBondContact O-N 3.4Å; A260-F319 HydrophobicContact CB-CE1 3.73Å; A260-F319 HydrophobicContact CB-CZ 3.6Å; A260-F487 HydrophobicContact CB-CE1 3.8Å; A260-F487 HydrophobicContact CB-CZ 3.98Å
261	L	97.9	Very high	97	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.063	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-50.9	174.2	174.2	61.6	0	0	0	111	T257 Q259 F263 I264 Q265 F319 L320 Y323	T257-L261 WeakPolarHBondContact O-CB 3.3Å; T257-L261 PolarHBondContact O-N 3.29Å; Q259-L261 VanDerWaalsContact C-N 3.3Å; Q259-L261 PolarHBondContact O-N 3.32Å; L261-F263 VanDerWaalsContact C-N 3.28Å; L261-F263 PolarHBondContact O-N 3.39Å; L261-I264 PolarHBondContact O-N 3.02Å; L261-Q265 HydrophobicContact CD1-CG 4.15Å; L261-Q265 WeakPolarHBondContact O-CG 3.2Å; L261-Q265 PolarHBondContact O-N 3.12Å; L261-F319 HydrophobicContact CB-CD1 3.84Å; L261-F319 HydrophobicContact CB-CE1 4.06Å; L261-F319 HydrophobicContact CD1-CB 4.43Å; L261-F319 HydrophobicContact CD1-CD1 4.03Å; L261-L320 HydrophobicContact CD1-CB 4.18Å; L261-L320 HydrophobicContact CD2-CD1 3.82Å; L261-Y323 HydrophobicContact CD2-CD1 3.97Å; L261-Y323 HydrophobicContact CD2-CG 3.93Å
262	S	98	Very high	97.3	Very high	52 Å²	52	38.6 Å²	38.6	36%	0.364	21%	0.206	S	C	.	.	H	α-helix	trans	-58.7	-38.5	-179.9	70.1	0	0	0	0	112.8	S258 Q259 Q265 D266	S258-S262 PolarHBondContact O-N 2.9Å; Q259-S262 PolarHBondContact O-N 2.72Å; Q259-S262 VanDerWaalsContact O-N 3.15Å; Q259-S262 PolarHBondContact O-OG 3.44Å; S262-Q265 PolarHBondContact O-N 3.12Å; S262-D266 WeakPolarHBondContact O-CB 3.47Å; S262-D266 PolarHBondContact O-N 3.11Å
263	F	98.3	Very high	97.5	Very high	40 Å²	40	38 Å²	38	18%	0.175	21%	0.207	C	C	.	.	H	α-helix	trans	-72.8	-27.3	175.6	-58.1	-47.6	0	0	0	113.5	Q259 A260 L261 D266 L267 V480 K483 I484 F487	Q259-F263 HydrophobicContact CB-CE2 4.32Å; Q259-F263 WeakPolarHBondContact O-CD2 3.41Å; Q259-F263 PolarHBondContact O-N 3.45Å; Q259-F263 VanDerWaalsContact O-N 3.13Å; A260-F263 PolarHBondContact O-N 3.07Å; L261-F263 VanDerWaalsContact C-N 3.28Å; L261-F263 PolarHBondContact O-N 3.39Å; F263-D266 WeakPolarHBondContact O-CB 3.33Å; F263-L267 VanDerWaalsContact O-CB 3.25Å; F263-L267 WeakPolarHBondContact O-CB 3.48Å; F263-L267 PolarHBondContact O-N 2.93Å; F263-V480 WeakPolarHBondContact O-CG1 3.34Å; F263-K483 HydrophobicContact CD1-CB 4Å; F263-K483 HydrophobicContact CD1-CD 3.92Å; F263-K483 HydrophobicContact CE1-CB 3.94Å; F263-K483 HydrophobicContact CE1-CD 3.81Å; F263-K483 HydrophobicContact CE1-CG 4.37Å; F263-K483 HydrophobicContact CZ-CB 4.47Å; F263-I484 HydrophobicContact CB-CD1 4.22Å; F263-I484 HydrophobicContact CB-CG1 3.56Å; F263-I484 HydrophobicContact CG-CG1 4.29Å; F263-F487 HydrophobicContact CD2-CB 4.23Å; F263-F487 HydrophobicContact CD2-CD1 4.1Å; F263-F487 HydrophobicContact CD2-CD2 4.44Å; F263-F487 AromaticContact CD2-CG 4Å; F263-F487 HydrophobicContact CD2-CG 4Å; F263-F487 HydrophobicContact CE2-CB 3.71Å; F263-F487 HydrophobicContact CE2-CD1 4.17Å; F263-F487 AromaticContact CE2-CD2 3.75Å; F263-F487 HydrophobicContact CE2-CD2 3.75Å; F263-F487 HydrophobicContact CE2-CE2 4.43Å; F263-F487 AromaticContact CE2-CG 3.59Å; F263-F487 HydrophobicContact CE2-CG 3.59Å
264	I	98.3	Very high	97.7	Very high	21 Å²	21	38.4 Å²	38.4	11%	0.108	21%	0.208	C	C	.	.	H	α-helix	trans	-75.2	-34.7	174.5	-74.8	168.1	0	0	0	111.2	A260 L261 L267 V268 F319 F343	A260-I264 WeakPolarHBondContact O-CG1 3.27Å; A260-I264 PolarHBondContact O-N 3.4Å; L261-I264 PolarHBondContact O-N 3.02Å; I264-L267 PolarHBondContact O-N 3.05Å; I264-V268 HydrophobicContact CG2-CG2 4.49Å; I264-V268 WeakPolarHBondContact O-CB 3.5Å; I264-V268 WeakPolarHBondContact O-CG2 3.17Å; I264-V268 PolarHBondContact O-N 3.09Å; I264-F319 HydrophobicContact CD1-CB 4.2Å; I264-F319 HydrophobicContact CD1-CD1 3.86Å; I264-F319 HydrophobicContact CD1-CD2 3.26Å; I264-F319 HydrophobicContact CD1-CE1 4.03Å; I264-F319 HydrophobicContact CD1-CE2 3.44Å; I264-F319 VanDerWaalsContact CD1-CE2 3.44Å; I264-F319 HydrophobicContact CD1-CG 3.48Å; I264-F319 VanDerWaalsContact CD1-CG 3.48Å; I264-F319 HydrophobicContact CD1-CZ 3.84Å; I264-F319 HydrophobicContact CG2-CB 4.19Å; I264-F343 HydrophobicContact CD1-CE2 4.12Å; I264-F343 HydrophobicContact CD1-CZ 3.95Å; I264-F343 HydrophobicContact CG2-CE2 4.47Å
265	Q	98.2	Very high	97.8	Very high	78 Å²	78	34 Å²	34	36%	0.364	19%	0.192	S	C	.	.	H	α-helix	trans	-65.6	-47.1	171.1	-63.5	-173.8	-79.8	0	0	111.4	L261 S262 L267 V268 A269 E316	L261-Q265 HydrophobicContact CD1-CG 4.15Å; L261-Q265 WeakPolarHBondContact O-CG 3.2Å; L261-Q265 PolarHBondContact O-N 3.12Å; S262-Q265 PolarHBondContact O-N 3.12Å; Q265-L267 PolarHBondContact O-N 3.25Å; Q265-V268 PolarHBondContact O-N 3.41Å; Q265-A269 WeakPolarHBondContact O-CB 3.31Å; Q265-A269 PolarHBondContact O-N 2.84Å; Q265-E316 HydrophobicContact CG-CG 4.11Å; Q265-E316 WeakPolarHBondContact CG-OE1 3.45Å; Q265-E316 PolarHBondContact NE2-OE1 3.47Å
266	D	98.3	Very high	97.9	Very high	65 Å²	65	32 Å²	32	35%	0.348	18%	0.183	S	C	.	.	H	α-helix	trans	-51.2	-43.4	169	-101.8	18.3	0	0	0	111.5	S262 F263 A270 V480 K483	S262-D266 WeakPolarHBondContact O-CB 3.47Å; S262-D266 PolarHBondContact O-N 3.11Å; F263-D266 WeakPolarHBondContact O-CB 3.33Å; D266-A270 WeakPolarHBondContact O-CB 3.37Å; D266-A270 PolarHBondContact O-N 3.47Å; D266-V480 HydrophobicContact CB-CB 4.42Å; D266-V480 HydrophobicContact CB-CG1 3.79Å; D266-V480 HydrophobicContact CB-CG2 3.68Å; D266-K483 IonicContact OD2-NZ 2.71Å; D266-K483 PolarHBondContact OD2-NZ 3.34Å
267	L	98.3	Very high	98	Very high	20 Å²	20	34.6 Å²	34.6	11%	0.105	19%	0.192	C	C	.	.	H	α-helix	trans	-71.5	-45.1	-178.3	178.1	62.9	0	0	0	112.1	F263 I264 Q265 A269 A270 L271 L477 V480 T481 I484	F263-L267 VanDerWaalsContact O-CB 3.25Å; F263-L267 WeakPolarHBondContact O-CB 3.48Å; F263-L267 PolarHBondContact O-N 2.93Å; I264-L267 PolarHBondContact O-N 3.05Å; Q265-L267 PolarHBondContact O-N 3.25Å; L267-A269 VanDerWaalsContact C-N 3.34Å; L267-A270 PolarHBondContact O-N 3.38Å; L267-L271 HydrophobicContact CD1-CD1 3.99Å; L267-L271 HydrophobicContact CD1-CG 4.08Å; L267-L271 HydrophobicContact CG-CD1 3.94Å; L267-L271 HydrophobicContact CG-CG 4.4Å; L267-L271 WeakPolarHBondContact O-CB 3.43Å; L267-L271 VanDerWaalsContact O-CG 3.31Å; L267-L271 WeakPolarHBondContact O-CG 3.42Å; L267-L271 PolarHBondContact O-N 3.12Å; L267-L477 HydrophobicContact CD1-CD1 3.53Å; L267-V480 HydrophobicContact CB-CG1 3.85Å; L267-V480 HydrophobicContact CD1-CG1 4.48Å; L267-T481 HydrophobicContact CD1-CG2 4.21Å; L267-I484 HydrophobicContact CB-CD1 4.2Å; L267-I484 HydrophobicContact CD2-CD1 3.9Å; L267-I484 HydrophobicContact CG-CD1 4.49Å
268	V	98.4	Very high	98.1	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-59.1	-46.6	176	157.9	0	0	0	0	110.1	I264 Q265 A270 L271 L272 V312 L315 E316	I264-V268 HydrophobicContact CG2-CG2 4.49Å; I264-V268 WeakPolarHBondContact O-CB 3.5Å; I264-V268 WeakPolarHBondContact O-CG2 3.17Å; I264-V268 PolarHBondContact O-N 3.09Å; Q265-V268 PolarHBondContact O-N 3.41Å; V268-A270 PolarHBondContact O-N 3.5Å; V268-L271 PolarHBondContact O-N 2.8Å; V268-L272 HydrophobicContact CG1-CD1 3.78Å; V268-L272 HydrophobicContact CG1-CG 4.4Å; V268-L272 WeakPolarHBondContact O-CB 3.31Å; V268-L272 WeakPolarHBondContact O-CG 3.35Å; V268-L272 PolarHBondContact O-N 3.24Å; V268-V312 HydrophobicContact CB-CG1 4.26Å; V268-V312 HydrophobicContact CG1-CG1 4.13Å; V268-V312 HydrophobicContact CG2-CG1 4.11Å; V268-V312 WeakPolarHBondContact CG2-O 3.4Å; V268-L315 HydrophobicContact CG2-CB 3.91Å; V268-E316 HydrophobicContact CB-CB 4.4Å; V268-E316 HydrophobicContact CG1-CB 4.17Å; V268-E316 HydrophobicContact CG2-CB 4.06Å
269	A	98.3	Very high	98	Very high	48 Å²	48	33.1 Å²	33.1	40%	0.397	18%	0.179	S	C	.	.	H	α-helix	trans	-60.6	-44.3	175.2	0	0	0	0	0	112.6	Q265 L267 N273	Q265-A269 WeakPolarHBondContact O-CB 3.31Å; Q265-A269 PolarHBondContact O-N 2.84Å; L267-A269 VanDerWaalsContact C-N 3.34Å; A269-N273 WeakPolarHBondContact O-CB 3.36Å; A269-N273 VanDerWaalsContact O-CG 3.25Å; A269-N273 PolarHBondContact O-N 3.1Å; A269-N273 VanDerWaalsContact O-N 3.12Å; A269-N273 PolarHBondContact O-ND2 3.22Å
270	A	98.3	Very high	97.9	Very high	2 Å²	2	32.7 Å²	32.7	2%	0.017	18%	0.177	C	C	.	.	H	α-helix	trans	-64.7	-40.6	177.9	0	0	0	0	0	112.9	D266 L267 V268 F274 L477	D266-A270 WeakPolarHBondContact O-CB 3.37Å; D266-A270 PolarHBondContact O-N 3.47Å; L267-A270 PolarHBondContact O-N 3.38Å; V268-A270 PolarHBondContact O-N 3.5Å; A270-F274 WeakPolarHBondContact O-CB 3.36Å; A270-F274 PolarHBondContact O-N 2.83Å; A270-L477 HydrophobicContact CB-CB 4.14Å; A270-L477 HydrophobicContact CB-CD1 3.92Å
271	L	98.3	Very high	97.8	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-70.4	-44.4	178.7	-72.5	175.5	0	0	0	112.6	L267 V268 N273 F274 H275 V312 Y350 L477	L267-L271 HydrophobicContact CD1-CD1 3.99Å; L267-L271 HydrophobicContact CD1-CG 4.08Å; L267-L271 HydrophobicContact CG-CD1 3.94Å; L267-L271 HydrophobicContact CG-CG 4.4Å; L267-L271 WeakPolarHBondContact O-CB 3.43Å; L267-L271 VanDerWaalsContact O-CG 3.31Å; L267-L271 WeakPolarHBondContact O-CG 3.42Å; L267-L271 PolarHBondContact O-N 3.12Å; V268-L271 PolarHBondContact O-N 2.8Å; L271-N273 VanDerWaalsContact C-N 3.31Å; L271-N273 PolarHBondContact O-N 2.72Å; L271-F274 PolarHBondContact O-N 2.93Å; L271-H275 PolarHBondContact O-CD2 3.05Å; L271-H275 PolarHBondContact O-N 3.3Å; L271-V312 HydrophobicContact CB-CG1 3.9Å; L271-Y350 HydrophobicContact CD1-CE1 3.91Å; L271-Y350 WeakPolarHBondContact CD2-OH 3.33Å; L271-L477 HydrophobicContact CD2-CD1 3.55Å; L271-L477 HydrophobicContact CD2-CD2 4.02Å; L271-L477 HydrophobicContact CD2-CG 4.46Å; L271-L477 HydrophobicContact CG-CD1 3.84Å
272	L	98.4	Very high	97.6	Very high	20 Å²	20	31.9 Å²	31.9	11%	0.105	17%	0.171	C	C	.	.	H	α-helix	trans	-56	-47.7	174.1	-71.8	167.8	0	0	0	110.8	V268 T276 N308 A309 V312 R313	V268-L272 HydrophobicContact CG1-CD1 3.78Å; V268-L272 HydrophobicContact CG1-CG 4.4Å; V268-L272 WeakPolarHBondContact O-CB 3.31Å; V268-L272 WeakPolarHBondContact O-CG 3.35Å; V268-L272 PolarHBondContact O-N 3.24Å; L272-T276 VanDerWaalsContact O-CB 3.28Å; L272-T276 WeakPolarHBondContact O-CB 3.29Å; L272-T276 PolarHBondContact O-N 3Å; L272-T276 PolarHBondContact O-OG1 3.07Å; L272-N308 WeakPolarHBondContact CD2-OD1 3.37Å; L272-A309 HydrophobicContact CD2-CB 4.1Å; L272-V312 HydrophobicContact CD2-CB 3.84Å; L272-V312 HydrophobicContact CD2-CG1 4.09Å; L272-V312 HydrophobicContact CG-CB 4.22Å; L272-V312 HydrophobicContact CG-CG1 3.89Å; L272-R313 HydrophobicContact CD1-CG 4.44Å
273	N	98.2	Very high	97.4	Very high	69 Å²	69	32.2 Å²	32.2	37%	0.369	17%	0.166	S	C	.	.	H	α-helix	trans	-61.7	-46.4	176.9	-75.3	-24.6	0	0	0	111.8	A269 L271 H275 T276 Y277	A269-N273 WeakPolarHBondContact O-CB 3.36Å; A269-N273 VanDerWaalsContact O-CG 3.25Å; A269-N273 PolarHBondContact O-N 3.1Å; A269-N273 VanDerWaalsContact O-N 3.12Å; A269-N273 PolarHBondContact O-ND2 3.22Å; L271-N273 VanDerWaalsContact C-N 3.31Å; L271-N273 PolarHBondContact O-N 2.72Å; N273-H275 PolarHBondContact O-N 3.45Å; N273-T276 PolarHBondContact O-N 2.98Å; N273-Y277 HydrophobicContact CB-CD2 4.19Å; N273-Y277 HydrophobicContact CB-CE2 3.88Å; N273-Y277 WeakPolarHBondContact O-CD2 3.26Å; N273-Y277 PolarHBondContact O-N 2.75Å
274	F	98.3	Very high	97.1	Very high	12 Å²	12	30.8 Å²	30.8	5%	0.053	16%	0.16	C	C	.	.	H	α-helix	trans	-59.8	-47.2	179.5	172	-105.3	0	0	0	112.8	A270 L271 T278 M389 L470 S473 L474	A270-F274 WeakPolarHBondContact O-CB 3.36Å; A270-F274 PolarHBondContact O-N 2.83Å; L271-F274 PolarHBondContact O-N 2.93Å; F274-T278 WeakPolarHBondContact O-CB 3.39Å; F274-T278 PolarHBondContact O-N 3.08Å; F274-T278 PolarHBondContact O-OG1 2.69Å; F274-M389 HydrophobicContact CZ-CE 4.04Å; F274-M389 HydrophobicContact CZ-SD 4.43Å; F274-L470 HydrophobicContact CD2-CD2 4.38Å; F274-L470 HydrophobicContact CE2-CD2 4.22Å; F274-S473 WeakPolarHBondContact CA-OG 3.31Å; F274-L474 HydrophobicContact CD2-CD2 3.62Å; F274-L474 HydrophobicContact CD2-CG 3.96Å; F274-L474 HydrophobicContact CE2-CD1 4.42Å; F274-L474 HydrophobicContact CE2-CD2 3.58Å; F274-L474 HydrophobicContact CE2-CG 4.07Å; F274-L474 HydrophobicContact CZ-CD2 4.46Å
275	H	98.3	Very high	96.6	Very high	3 Å²	3	30.3 Å²	30.3	1%	0.014	16%	0.157	C	C	.	.	H	α-helix	trans	-65.3	-41.6	177.2	-68.4	-54.9	0	0	0	111.7	L271 N273 T278 E279 L305 N308 Y350	L271-H275 PolarHBondContact O-CD2 3.05Å; L271-H275 PolarHBondContact O-N 3.3Å; N273-H275 PolarHBondContact O-N 3.45Å; H275-T278 PolarHBondContact O-N 2.92Å; H275-E279 PolarHBondContact O-N 3.4Å; H275-L305 HydrophobicContact CB-CD2 4.34Å; H275-N308 HydrophobicContact CB-CB 3.74Å; H275-Y350 AromaticContact NE2-CE2 3.71Å; H275-Y350 AromaticContact NE2-CZ 3.81Å; H275-Y350 PolarHBondContact NE2-OH 3.44Å
276	T	98	Very high	95.9	Very high	46 Å²	46	28.2 Å²	28.2	28%	0.282	15%	0.151	S	C	.	.	H	α-helix	trans	-65.7	-43.6	179.5	-55	0	0	0	0	112.6	L272 N273 T278 E279 Q280	L272-T276 VanDerWaalsContact O-CB 3.28Å; L272-T276 WeakPolarHBondContact O-CB 3.29Å; L272-T276 PolarHBondContact O-N 3Å; L272-T276 PolarHBondContact O-OG1 3.07Å; N273-T276 PolarHBondContact O-N 2.98Å; T276-T278 VanDerWaalsContact C-N 3.34Å; T276-E279 WeakPolarHBondContact O-CB 3.36Å; T276-E279 PolarHBondContact O-N 3.2Å; T276-Q280 WeakPolarHBondContact O-CG 3.49Å; T276-Q280 PolarHBondContact O-N 3.37Å
277	Y	98.2	Very high	95.2	Very high	59 Å²	59	29.6 Å²	29.6	23%	0.231	16%	0.158	C	C	.	.	H	α-helix	trans	-73.6	-26.8	176.4	-62.3	-53.2	0	0	0	112.4	N273 R281 C469	N273-Y277 HydrophobicContact CB-CD2 4.19Å; N273-Y277 HydrophobicContact CB-CE2 3.88Å; N273-Y277 WeakPolarHBondContact O-CD2 3.26Å; N273-Y277 PolarHBondContact O-N 2.75Å; Y277-R281 WeakPolarHBondContact O-CB 3.21Å; Y277-R281 PolarHBondContact O-N 3.23Å; Y277-C469 HydrophobicContact CD1-CB 3.62Å; Y277-C469 HydrophobicContact CD2-CB 3.87Å; Y277-C469 WeakPolarHBondContact CD2-O 3.34Å; Y277-C469 HydrophobicContact CE1-CB 3.55Å; Y277-C469 HydrophobicContact CE2-CB 3.8Å; Y277-C469 HydrophobicContact CG-CB 3.81Å
278	T	97.1	Very high	94.6	Very high	12 Å²	12	29.4 Å²	29.4	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-65.6	-45.6	168.5	-57.2	0	0	0	0	110.7	F274 H275 T276 Q280 R281 V282 F301 L305	F274-T278 WeakPolarHBondContact O-CB 3.39Å; F274-T278 PolarHBondContact O-N 3.08Å; F274-T278 PolarHBondContact O-OG1 2.69Å; H275-T278 PolarHBondContact O-N 2.92Å; T276-T278 VanDerWaalsContact C-N 3.34Å; T278-Q280 VanDerWaalsContact C-N 3.32Å; T278-Q280 PolarHBondContact O-N 3.42Å; T278-R281 PolarHBondContact O-N 3.44Å; T278-V282 HydrophobicContact CG2-CG2 4.48Å; T278-V282 VanDerWaalsContact O-CG2 3.25Å; T278-V282 WeakPolarHBondContact O-CG2 3.38Å; T278-V282 PolarHBondContact O-N 2.88Å; T278-F301 HydrophobicContact CG2-CE1 4.4Å; T278-F301 HydrophobicContact CG2-CZ 4.16Å; T278-L305 HydrophobicContact CG2-CD1 3.84Å
279	E	96.7	Very high	94	Very high	27 Å²	27	31.7 Å²	31.7	13%	0.126	17%	0.172	C	C	.	.	H	α-helix	trans	-56.5	-47	175.3	-171.4	-171.4	160.8	0	0	111	H275 T276 V282 H283 L305 H306	H275-E279 PolarHBondContact O-N 3.4Å; T276-E279 WeakPolarHBondContact O-CB 3.36Å; T276-E279 PolarHBondContact O-N 3.2Å; E279-V282 PolarHBondContact O-N 3.1Å; E279-H283 PolarHBondContact O-ND1 3.29Å; E279-L305 HydrophobicContact CB-CB 3.86Å; E279-L305 HydrophobicContact CB-CD1 4.12Å; E279-L305 HydrophobicContact CG-CB 4.09Å; E279-H306 IonicContact OE1-CE1 3.42Å; E279-H306 IonicContact OE1-CG 3.88Å; E279-H306 IonicContact OE1-ND1 2.81Å; E279-H306 PolarHBondContact OE1-ND1 3.14Å; E279-H306 WeakPolarHBondContact OE2-CA 3.36Å; E279-H306 IonicContact OE2-ND1 3.21Å
280	Q	95.6	Very high	93.4	Very high	80 Å²	80	34 Å²	34	37%	0.374	19%	0.186	S	C	.	.	H	α-helix	trans	-62.5	-45.4	176.9	-70	173.8	16.2	0	0	112.3	T276 T278 V282 H283 I284 T466	T276-Q280 WeakPolarHBondContact O-CG 3.49Å; T276-Q280 PolarHBondContact O-N 3.37Å; T278-Q280 VanDerWaalsContact C-N 3.32Å; T278-Q280 PolarHBondContact O-N 3.42Å; Q280-V282 VanDerWaalsContact C-N 3.3Å; Q280-V282 PolarHBondContact O-N 3.06Å; Q280-H283 WeakPolarHBondContact O-CB 3.22Å; Q280-H283 PolarHBondContact O-N 2.95Å; Q280-H283 VanDerWaalsContact O-N 3.07Å; Q280-I284 VanDerWaalsContact O-CD1 3.29Å; Q280-I284 WeakPolarHBondContact O-CD1 3.46Å; Q280-I284 WeakPolarHBondContact O-CG1 3.18Å; Q280-T466 HydrophobicContact CB-CG2 3.71Å
281	R	94.6	Very high	92.7	Very high	5 Å²	5	40.4 Å²	40.4	2%	0.019	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-34	-179.3	-168.4	179.6	163.2	-74	1.9	112.4	Y277 T278 H283 I284 Y285 E368 Y446 E453 L463 T466 L470	Y277-R281 WeakPolarHBondContact O-CB 3.21Å; Y277-R281 PolarHBondContact O-N 3.23Å; T278-R281 PolarHBondContact O-N 3.44Å; R281-H283 PolarHBondContact O-N 3.05Å; R281-I284 PolarHBondContact O-N 3.32Å; R281-Y285 PolarHBondContact O-N 3.07Å; R281-E368 IonicContact CZ-OE1 2.84Å; R281-E368 IonicContact CZ-OE2 3.72Å; R281-E368 IonicContact NH1-OE1 3.67Å; R281-E368 PolarHBondContact NH1-OE1 3.09Å; R281-E368 IonicContact NH1-OE2 3.77Å; R281-E368 PolarHBondContact NH1-OE2 3Å; R281-E368 IonicContact NH2-OE1 2.63Å; R281-E368 IonicContact NH2-OE2 3.63Å; R281-E368 PolarHBondContact NH2-OE2 3.02Å; R281-Y446 VanDerWaalsContact CD-OH 3.27Å; R281-Y446 WeakPolarHBondContact CD-OH 3.35Å; R281-Y446 PolarHBondContact NE-OH 3.29Å; R281-E453 IonicContact CZ-OE1 3.14Å; R281-E453 IonicContact CZ-OE2 3.59Å; R281-E453 IonicContact NE-OE2 2.61Å; R281-E453 VanDerWaalsContact NH2-CD 3.29Å; R281-E453 IonicContact NH2-OE1 3.53Å; R281-E453 PolarHBondContact NH2-OE1 3.15Å; R281-E453 IonicContact NH2-OE2 2.7Å; R281-E453 PolarHBondContact NH2-OE2 2.85Å; R281-E453 VanDerWaalsContact NH2-OE2 3.09Å; R281-L463 HydrophobicContact CG-CD1 3.89Å; R281-T466 HydrophobicContact CB-CG2 4.01Å; R281-L470 HydrophobicContact CB-CD1 4.49Å
282	V	94.3	Very high	92	Very high	6 Å²	6	45.1 Å²	45.1	4%	0.036	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-17.7	175	170.8	0	0	0	0	112.9	T278 E279 Q280 N298 F301	T278-V282 HydrophobicContact CG2-CG2 4.48Å; T278-V282 VanDerWaalsContact O-CG2 3.25Å; T278-V282 WeakPolarHBondContact O-CG2 3.38Å; T278-V282 PolarHBondContact O-N 2.88Å; E279-V282 PolarHBondContact O-N 3.1Å; Q280-V282 VanDerWaalsContact C-N 3.3Å; Q280-V282 PolarHBondContact O-N 3.06Å; V282-N298 HydrophobicContact CG1-CB 3.57Å; V282-N298 WeakPolarHBondContact CG1-O 3.3Å; V282-F301 HydrophobicContact CG1-CD1 4.18Å; V282-F301 HydrophobicContact CG2-CD1 3.78Å; V282-F301 HydrophobicContact CG2-CE1 3.73Å
283	H	93.3	Very high	91.4	Very high	58 Å²	58	49.9 Å²	49.9	27%	0.269	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	0.4	170.5	-69	83.1	0	0	0	114.2	E279 Q280 R281 S289 I294 S302	E279-H283 PolarHBondContact O-ND1 3.29Å; Q280-H283 WeakPolarHBondContact O-CB 3.22Å; Q280-H283 PolarHBondContact O-N 2.95Å; Q280-H283 VanDerWaalsContact O-N 3.07Å; R281-H283 PolarHBondContact O-N 3.05Å; H283-S289 VanDerWaalsContact O-CB 3.28Å; H283-S289 WeakPolarHBondContact O-CB 3.18Å; H283-S289 PolarHBondContact O-N 3.38Å; H283-S289 PolarHBondContact O-OG 3.4Å; H283-I294 HydrophobicContact CB-CD1 4.23Å; H283-I294 WeakPolarHBondContact CD2-CD1 3.32Å; H283-S302 PolarHBondContact CE1-OG 3.04Å
284	I	91.6	Very high	91	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.051	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-33.9	-170.7	-59	162.7	0	0	0	111.9	Q280 R281 L287 D288 K462 L463 T466	Q280-I284 VanDerWaalsContact O-CD1 3.29Å; Q280-I284 WeakPolarHBondContact O-CD1 3.46Å; Q280-I284 WeakPolarHBondContact O-CG1 3.18Å; R281-I284 PolarHBondContact O-N 3.32Å; I284-L287 CarbonylContact C-O 3.59Å; I284-L287 CarbonylContact O-C 3.59Å; I284-D288 PolarHBondContact O-N 3.1Å; I284-K462 HydrophobicContact CD1-CD 4.34Å; I284-K462 HydrophobicContact CD1-CG 3.84Å; I284-K462 HydrophobicContact CG1-CD 4.14Å; I284-K462 HydrophobicContact CG1-CG 4.17Å; I284-L463 HydrophobicContact CB-CD1 4.5Å; I284-L463 HydrophobicContact CG2-CB 3.62Å; I284-L463 HydrophobicContact CG2-CD1 3.94Å; I284-L463 HydrophobicContact CG2-CG 4.27Å; I284-T466 HydrophobicContact CD1-CG2 4.11Å; I284-T466 WeakPolarHBondContact CD1-OG1 3.34Å
285	Y	88.5	Confident	90.7	Very high	11 Å²	11	49.3 Å²	49.3	4%	0.043	27%	0.272	C	S	.	.	S	Bend	trans	-139.3	136.5	-176.2	-168.3	-93.7	0	0	0	109.8	R281 E368 L378 L456 L463	R281-Y285 PolarHBondContact O-N 3.07Å; Y285-E368 HydrophobicContact CD1-CG 3.73Å; Y285-E368 WeakPolarHBondContact CD1-OE2 3.47Å; Y285-E368 HydrophobicContact CE1-CB 4.11Å; Y285-E368 HydrophobicContact CE1-CG 3.69Å; Y285-E368 VanDerWaalsContact CE1-OE2 3.22Å; Y285-E368 WeakPolarHBondContact CE1-OE2 3.4Å; Y285-L378 WeakPolarHBondContact OH-CD2 3.48Å; Y285-L456 HydrophobicContact CE2-CD1 4.37Å; Y285-L463 HydrophobicContact CD2-CD2 3.67Å; Y285-L463 HydrophobicContact CE2-CD2 4.45Å; Y285-L463 HydrophobicContact CG-CD2 4.24Å
286	P	83.9	Confident	90.5	Very high	35 Å²	35	54.4 Å²	54.4	23%	0.227	31%	0.305	C	S	.	.	S	Bend	cis	-72.4	-22.5	10.7	-12.1	24.9	0	0	0	115.7	E368 A371	P286-E368 HydrophobicContact CG-CG 3.92Å; P286-A371 HydrophobicContact CB-CB 3.94Å
287	L	82.6	Confident	90.4	Very high	94 Å²	94	54.2 Å²	54.2	49%	0.492	30%	0.302	S	S	.	.	S	Bend	trans	-126.8	138.8	-177.1	-62.5	168	0	0	0	108.8	I284 E292	I284-L287 CarbonylContact C-O 3.59Å; I284-L287 CarbonylContact O-C 3.59Å; L287-E292 WeakPolarHBondContact CD1-OE2 3.19Å
288	D	85.2	Confident	90.2	Very high	15 Å²	15	51.6 Å²	51.6	8%	0.08	29%	0.292	C	S	.	.			trans	-81.8	123.9	177.9	-165.3	-61.2	0	0	0	110.7	I284 S290 I291 E292 K462	I284-D288 PolarHBondContact O-N 3.1Å; D288-S290 PolarHBondContact O-N 3.09Å; D288-S290 WeakPolarHBondContact OD1-CB 3.42Å; D288-S290 PolarHBondContact OD1-N 3.46Å; D288-S290 PolarHBondContact OD1-OG 3.29Å; D288-I291 HydrophobicContact CB-CD1 4.28Å; D288-I291 HydrophobicContact CB-CG1 4.36Å; D288-I291 PolarHBondContact O-N 3.36Å; D288-E292 PolarHBondContact O-N 2.81Å; D288-K462 IonicContact OD1-NZ 3.57Å; D288-K462 PolarHBondContact OD1-NZ 3.37Å; D288-K462 WeakPolarHBondContact OD2-CD 3.41Å; D288-K462 IonicContact OD2-NZ 2.72Å; D288-K462 PolarHBondContact OD2-NZ 3.33Å
289	S	86.4	Confident	90.1	Very high	49 Å²	49	56.1 Å²	56.1	34%	0.343	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-15.3	178	54.8	0	0	0	0	116.1	H283 I291 E292	H283-S289 VanDerWaalsContact O-CB 3.28Å; H283-S289 WeakPolarHBondContact O-CB 3.18Å; H283-S289 PolarHBondContact O-N 3.38Å; H283-S289 PolarHBondContact O-OG 3.4Å; S289-I291 VanDerWaalsContact C-N 3.34Å; S289-E292 WeakPolarHBondContact CA-O 3.34Å
290	S	86.1	Confident	90.1	Very high	97 Å²	97	58.7 Å²	58.7	68%	0.678	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-7.5	171.9	61.2	0	0	0	0	114.3	D288	D288-S290 PolarHBondContact O-N 3.09Å; D288-S290 WeakPolarHBondContact OD1-CB 3.42Å; D288-S290 PolarHBondContact OD1-N 3.46Å; D288-S290 PolarHBondContact OD1-OG 3.29Å
291	I	84.3	Confident	90.2	Very high	137 Å²	137	55 Å²	55	70%	0.703	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	-47.4	-178	-49.3	178.1	0	0	0	110.4	D288 S289	D288-I291 HydrophobicContact CB-CD1 4.28Å; D288-I291 HydrophobicContact CB-CG1 4.36Å; D288-I291 PolarHBondContact O-N 3.36Å; S289-I291 VanDerWaalsContact C-N 3.34Å
292	E	82.4	Confident	90.3	Very high	102 Å²	102	55.4 Å²	55.4	48%	0.477	31%	0.309	S	S	.	.	S	Bend	trans	-133.1	152.2	-177.6	-71	-170.6	-178.7	0	0	112.1	L287 D288 S289 I294	L287-E292 WeakPolarHBondContact CD1-OE2 3.19Å; D288-E292 PolarHBondContact O-N 2.81Å; S289-E292 WeakPolarHBondContact CA-O 3.34Å; E292-I294 PolarHBondContact O-N 3.05Å
293	P	86.1	Confident	90.5	Very high	120 Å²	120	60 Å²	60	78%	0.779	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-67.2	132.6	178.1	28	-34.7	0	0	0	111.9
294	I	90.1	Very high	90.7	Very high	40 Å²	40	59.5 Å²	59.5	21%	0.205	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-59.1	143.7	176.6	-54.2	175.2	0	0	0	110.5	H283 E292 N298 Q299	H283-I294 HydrophobicContact CB-CD1 4.23Å; H283-I294 WeakPolarHBondContact CD2-CD1 3.32Å; E292-I294 PolarHBondContact O-N 3.05Å; I294-N298 HydrophobicContact CG2-CB 3.42Å; I294-N298 VanDerWaalsContact CG2-CB 3.42Å; I294-Q299 HydrophobicContact CG2-CB 4.42Å
295	S	92.4	Very high	91	Very high	29 Å²	29	59 Å²	59	20%	0.203	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-56	145.3	174.1	74	0	0	0	0	111.7	L297 N298 Q299 E367	S295-L297 PolarHBondContact O-N 2.61Å; S295-L297 VanDerWaalsContact O-N 3.08Å; S295-N298 PolarHBondContact O-N 2.98Å; S295-N298 WeakPolarHBondContact OG-CB 3.24Å; S295-N298 PolarHBondContact OG-N 2.87Å; S295-N298 VanDerWaalsContact OG-N 3.13Å; S295-N298 PolarHBondContact OG-ND2 3.47Å; S295-Q299 PolarHBondContact O-N 3.39Å; S295-E367 WeakPolarHBondContact CB-OE2 3.46Å; S295-E367 PolarHBondContact OG-OE1 2.79Å; S295-E367 PolarHBondContact OG-OE2 3.27Å
296	P	93.6	Very high	91.3	Very high	111 Å²	111	64.8 Å²	64.8	72%	0.721	35%	0.351	S	S	*	.	H	α-helix	trans	-58.2	-24.8	177.6	-26.6	35.5	0	0	0	113.7	K300	P296-K300 WeakPolarHBondContact O-CB 3.5Å; P296-K300 PolarHBondContact O-N 3.28Å
297	L	95.1	Very high	91.9	Very high	41 Å²	41	66.3 Å²	66.3	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-66.8	-57.9	170.6	-179.7	84.5	0	0	0	111.1	S295 Q299 K300 F301 Y360 K363 E367	S295-L297 PolarHBondContact O-N 2.61Å; S295-L297 VanDerWaalsContact O-N 3.08Å; L297-Q299 VanDerWaalsContact C-N 3.32Å; L297-Q299 PolarHBondContact O-N 2.99Å; L297-K300 CarbonylContact O-C 3.41Å; L297-K300 PolarHBondContact O-N 2.91Å; L297-K300 VanDerWaalsContact O-N 3.11Å; L297-F301 PolarHBondContact O-N 3.4Å; L297-Y360 HydrophobicContact CD1-CD1 3.88Å; L297-Y360 HydrophobicContact CD1-CE1 4.44Å; L297-K363 HydrophobicContact CD1-CB 3.91Å; L297-K363 VanDerWaalsContact CD2-C 3.49Å; L297-K363 HydrophobicContact CD2-CB 3.49Å; L297-K363 VanDerWaalsContact CD2-CB 3.49Å; L297-K363 HydrophobicContact CG-CB 4.33Å; L297-E367 WeakPolarHBondContact CB-OE1 3.47Å; L297-E367 HydrophobicContact CD2-CG 4.19Å; L297-E367 WeakPolarHBondContact CD2-OE1 3.34Å
298	N	94.7	Very high	92.6	Very high	4 Å²	4	62.1 Å²	62.1	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-67.3	-33	-174.6	-76.7	-27.1	0	0	0	112.2	V282 I294 S295 K300 F301 S302 S364 E367	V282-N298 HydrophobicContact CG1-CB 3.57Å; V282-N298 WeakPolarHBondContact CG1-O 3.3Å; I294-N298 HydrophobicContact CG2-CB 3.42Å; I294-N298 VanDerWaalsContact CG2-CB 3.42Å; S295-N298 PolarHBondContact O-N 2.98Å; S295-N298 WeakPolarHBondContact OG-CB 3.24Å; S295-N298 PolarHBondContact OG-N 2.87Å; S295-N298 VanDerWaalsContact OG-N 3.13Å; S295-N298 PolarHBondContact OG-ND2 3.47Å; N298-K300 VanDerWaalsContact C-N 3.33Å; N298-K300 PolarHBondContact O-N 3.46Å; N298-F301 PolarHBondContact O-N 2.9Å; N298-S302 WeakPolarHBondContact O-CB 3.13Å; N298-S302 PolarHBondContact O-N 2.97Å; N298-S364 VanDerWaalsContact OD1-CB 3.22Å; N298-S364 WeakPolarHBondContact OD1-CB 3.49Å; N298-S364 PolarHBondContact OD1-OG 3.28Å; N298-E367 PolarHBondContact ND2-OE2 3.27Å
299	Q	95.4	Very high	93.2	Very high	107 Å²	107	63.6 Å²	63.6	50%	0.5	35%	0.348	S	S	.	.	H	α-helix	trans	-59.1	-44.6	170.5	-171.8	-177.8	41	0	0	111.4	I294 S295 L297 Q303	I294-Q299 HydrophobicContact CG2-CB 4.42Å; S295-Q299 PolarHBondContact O-N 3.39Å; L297-Q299 VanDerWaalsContact C-N 3.32Å; L297-Q299 PolarHBondContact O-N 2.99Å; Q299-Q303 WeakPolarHBondContact O-CG 3.38Å; Q299-Q303 PolarHBondContact O-N 3.19Å; Q299-Q303 VanDerWaalsContact O-N 3.08Å
300	K	96.6	Very high	93.7	Very high	82 Å²	82	64.8 Å²	64.8	36%	0.357	36%	0.361	S	S	.	.	H	α-helix	trans	-74.3	-31.4	178	-170.6	170.4	178.1	-167.7	0	112.9	P296 L297 N298 Q303 Y304 Y360	P296-K300 WeakPolarHBondContact O-CB 3.5Å; P296-K300 PolarHBondContact O-N 3.28Å; L297-K300 CarbonylContact O-C 3.41Å; L297-K300 PolarHBondContact O-N 2.91Å; L297-K300 VanDerWaalsContact O-N 3.11Å; N298-K300 VanDerWaalsContact C-N 3.33Å; N298-K300 PolarHBondContact O-N 3.46Å; K300-Q303 PolarHBondContact O-N 3.38Å; K300-Y304 WeakPolarHBondContact CE-OH 3.46Å; K300-Y304 HydrophobicContact CG-CE2 4.43Å; K300-Y304 PolarHBondContact O-N 3.03Å; K300-Y360 HydrophobicContact CB-CE1 4.33Å; K300-Y360 HydrophobicContact CD-CE1 3.84Å; K300-Y360 WeakPolarHBondContact CE-OH 3.44Å; K300-Y360 HydrophobicContact CG-CE1 3.98Å; K300-Y360 PolarHBondContact NZ-OH 2.9Å; K300-Y360 VanDerWaalsContact NZ-OH 3.14Å
301	F	97.8	Very high	94.3	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.009	34%	0.342	C	S	.	.	H	α-helix	trans	-63.8	-47.7	172.2	-174.8	-154.1	0	0	0	110.8	T278 V282 L297 N298 Q303 Y304 L305 I357 Q361	T278-F301 HydrophobicContact CG2-CE1 4.4Å; T278-F301 HydrophobicContact CG2-CZ 4.16Å; V282-F301 HydrophobicContact CG1-CD1 4.18Å; V282-F301 HydrophobicContact CG2-CD1 3.78Å; V282-F301 HydrophobicContact CG2-CE1 3.73Å; L297-F301 PolarHBondContact O-N 3.4Å; N298-F301 PolarHBondContact O-N 2.9Å; F301-Q303 PolarHBondContact O-N 2.97Å; F301-Y304 PolarHBondContact O-N 3.48Å; F301-L305 HydrophobicContact CD1-CD1 4.36Å; F301-L305 HydrophobicContact CD2-CD1 3.95Å; F301-L305 HydrophobicContact CD2-CG 3.95Å; F301-L305 HydrophobicContact CE1-CD1 4.08Å; F301-L305 HydrophobicContact CE2-CD1 3.64Å; F301-L305 HydrophobicContact CE2-CD2 3.89Å; F301-L305 HydrophobicContact CE2-CG 3.69Å; F301-L305 HydrophobicContact CG-CD1 4.28Å; F301-L305 HydrophobicContact CZ-CD1 3.69Å; F301-L305 HydrophobicContact CZ-CD2 4.34Å; F301-L305 HydrophobicContact CZ-CG 4.23Å; F301-L305 WeakPolarHBondContact O-CG 3.42Å; F301-L305 PolarHBondContact O-N 3.33Å; F301-I357 HydrophobicContact CE2-CB 4.19Å; F301-Q361 HydrophobicContact CE1-CB 4.12Å; F301-Q361 HydrophobicContact CE1-CG 4.28Å; F301-Q361 HydrophobicContact CE2-CB 3.88Å; F301-Q361 VanDerWaalsContact CZ-CA 3.5Å; F301-Q361 HydrophobicContact CZ-CB 3.45Å; F301-Q361 VanDerWaalsContact CZ-CB 3.45Å; F301-Q361 HydrophobicContact CZ-CG 3.68Å
302	S	97.1	Very high	94.9	Very high	13 Å²	13	57 Å²	57	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-55.2	-48.2	172.2	151.5	0	0	0	0	111.9	H283 N298 Y304 L305 H306	H283-S302 PolarHBondContact CE1-OG 3.04Å; N298-S302 WeakPolarHBondContact O-CB 3.13Å; N298-S302 PolarHBondContact O-N 2.97Å; S302-Y304 VanDerWaalsContact C-N 3.27Å; S302-Y304 PolarHBondContact O-N 2.81Å; S302-L305 CarbonylContact O-C 3.59Å; S302-L305 PolarHBondContact O-N 2.7Å; S302-H306 PolarHBondContact O-N 3.45Å
303	Q	96.6	Very high	95.6	Very high	104 Å²	104	58 Å²	58	49%	0.486	31%	0.307	S	S	.	.	H	α-helix	trans	-55.8	-42.1	179.3	-75.2	167.4	3.3	0	0	112.2	Q299 K300 F301 H306	Q299-Q303 WeakPolarHBondContact O-CG 3.38Å; Q299-Q303 PolarHBondContact O-N 3.19Å; Q299-Q303 VanDerWaalsContact O-N 3.08Å; K300-Q303 PolarHBondContact O-N 3.38Å; F301-Q303 PolarHBondContact O-N 2.97Å; Q303-H306 WeakPolarHBondContact O-CB 3.5Å; Q303-H306 PolarHBondContact O-N 3.25Å
304	Y	97.6	Very high	96.2	Very high	46 Å²	46	53.8 Å²	53.8	18%	0.18	28%	0.28	C	S	.	.	H	α-helix	trans	-73.1	-37	175.2	-64.3	-18.8	0	0	0	112.9	K300 F301 S302 H306 E307 F353 K356 Y360	K300-Y304 WeakPolarHBondContact CE-OH 3.46Å; K300-Y304 HydrophobicContact CG-CE2 4.43Å; K300-Y304 PolarHBondContact O-N 3.03Å; F301-Y304 PolarHBondContact O-N 3.48Å; S302-Y304 VanDerWaalsContact C-N 3.27Å; S302-Y304 PolarHBondContact O-N 2.81Å; Y304-H306 PolarHBondContact O-N 3.25Å; Y304-E307 WeakPolarHBondContact CD1-OE1 3.32Å; Y304-E307 WeakPolarHBondContact O-CB 3.44Å; Y304-E307 PolarHBondContact O-N 3.44Å; Y304-E307 VanDerWaalsContact O-N 3.17Å; Y304-F353 VanDerWaalsContact O-CE2 3.25Å; Y304-F353 WeakPolarHBondContact O-CE2 3.34Å; Y304-K356 HydrophobicContact CD2-CD 4.5Å; Y304-K356 HydrophobicContact CD2-CG 4.18Å; Y304-K356 HydrophobicContact CE2-CG 4.18Å; Y304-Y360 HydrophobicContact CD2-CD2 4.21Å; Y304-Y360 HydrophobicContact CD2-CE2 4.12Å; Y304-Y360 HydrophobicContact CE2-CD2 4.17Å; Y304-Y360 HydrophobicContact CE2-CE1 4.47Å; Y304-Y360 AromaticContact CE2-CE2 3.62Å; Y304-Y360 HydrophobicContact CE2-CE2 3.62Å; Y304-Y360 AromaticContact CE2-CZ 3.78Å
305	L	97.6	Very high	96.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-34.2	173.1	-71.1	171.6	0	0	0	111.7	H275 T278 E279 F301 S302 E307 N308 I357	H275-L305 HydrophobicContact CB-CD2 4.34Å; T278-L305 HydrophobicContact CG2-CD1 3.84Å; E279-L305 HydrophobicContact CB-CB 3.86Å; E279-L305 HydrophobicContact CB-CD1 4.12Å; E279-L305 HydrophobicContact CG-CB 4.09Å; F301-L305 HydrophobicContact CD1-CD1 4.36Å; F301-L305 HydrophobicContact CD2-CD1 3.95Å; F301-L305 HydrophobicContact CD2-CG 3.95Å; F301-L305 HydrophobicContact CE1-CD1 4.08Å; F301-L305 HydrophobicContact CE2-CD1 3.64Å; F301-L305 HydrophobicContact CE2-CD2 3.89Å; F301-L305 HydrophobicContact CE2-CG 3.69Å; F301-L305 HydrophobicContact CG-CD1 4.28Å; F301-L305 HydrophobicContact CZ-CD1 3.69Å; F301-L305 HydrophobicContact CZ-CD2 4.34Å; F301-L305 HydrophobicContact CZ-CG 4.23Å; F301-L305 WeakPolarHBondContact O-CG 3.42Å; F301-L305 PolarHBondContact O-N 3.33Å; S302-L305 CarbonylContact O-C 3.59Å; S302-L305 PolarHBondContact O-N 2.7Å; L305-E307 PolarHBondContact O-N 3.04Å; L305-N308 WeakPolarHBondContact O-CB 3.5Å; L305-N308 PolarHBondContact O-N 3.48Å; L305-N308 PolarHBondContact O-ND2 2.91Å; L305-I357 HydrophobicContact CD2-CD1 3.94Å
306	H	96.2	Very high	96.8	Very high	132 Å²	132	52.3 Å²	52.3	61%	0.611	27%	0.27	S	S	*	.	H	α-helix	trans	-61.3	-31.7	175.6	-156.6	80.5	0	0	0	112.7	E279 S302 Q303 Y304 N308	E279-H306 IonicContact OE1-CE1 3.42Å; E279-H306 IonicContact OE1-CG 3.88Å; E279-H306 IonicContact OE1-ND1 2.81Å; E279-H306 PolarHBondContact OE1-ND1 3.14Å; E279-H306 WeakPolarHBondContact OE2-CA 3.36Å; E279-H306 IonicContact OE2-ND1 3.21Å; S302-H306 PolarHBondContact O-N 3.45Å; Q303-H306 WeakPolarHBondContact O-CB 3.5Å; Q303-H306 PolarHBondContact O-N 3.25Å; Y304-H306 PolarHBondContact O-N 3.25Å; H306-N308 PolarHBondContact O-N 2.89Å
307	E	96.1	Very high	97	Very high	67 Å²	67	51 Å²	51	31%	0.313	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.7	175.1	-57.5	170.5	-165.6	0	0	113.5	Y304 L305 A309 A310 Y311 K356	Y304-E307 WeakPolarHBondContact CD1-OE1 3.32Å; Y304-E307 WeakPolarHBondContact O-CB 3.44Å; Y304-E307 PolarHBondContact O-N 3.44Å; Y304-E307 VanDerWaalsContact O-N 3.17Å; L305-E307 PolarHBondContact O-N 3.04Å; E307-A309 PolarHBondContact O-N 2.96Å; E307-A310 WeakPolarHBondContact O-CB 3.46Å; E307-A310 PolarHBondContact O-N 2.86Å; E307-Y311 HydrophobicContact CB-CD2 4.47Å; E307-Y311 HydrophobicContact CB-CE2 3.98Å; E307-K356 IonicContact OE1-NZ 2.81Å; E307-K356 PolarHBondContact OE1-NZ 3.19Å; E307-K356 IonicContact OE2-NZ 3.2Å; E307-K356 PolarHBondContact OE2-NZ 2.87Å
308	N	97.1	Very high	97.1	Very high	6 Å²	6	49.1 Å²	49.1	3%	0.032	25%	0.247	C	C	.	.	H	α-helix	trans	-52.4	-37.5	-166.4	79.8	91.9	0	0	0	114.1	L272 H275 L305 H306 A310 Y311 V312 F353	L272-N308 WeakPolarHBondContact CD2-OD1 3.37Å; H275-N308 HydrophobicContact CB-CB 3.74Å; L305-N308 WeakPolarHBondContact O-CB 3.5Å; L305-N308 PolarHBondContact O-N 3.48Å; L305-N308 PolarHBondContact O-ND2 2.91Å; H306-N308 PolarHBondContact O-N 2.89Å; N308-A310 PolarHBondContact O-N 3.43Å; N308-Y311 PolarHBondContact O-N 3.34Å; N308-V312 WeakPolarHBondContact O-CG2 3.28Å; N308-V312 PolarHBondContact O-N 3.15Å; N308-F353 HydrophobicContact CB-CE1 4.03Å; N308-F353 HydrophobicContact CB-CZ 3.73Å
309	A	97.1	Very high	97.2	Very high	47 Å²	47	50 Å²	50	39%	0.388	25%	0.25	S	S	.	.	H	α-helix	trans	-59.7	-33.8	-178.1	0	0	0	0	0	112.9	L272 E307 Y311 R313	L272-A309 HydrophobicContact CD2-CB 4.1Å; E307-A309 PolarHBondContact O-N 2.96Å; A309-Y311 PolarHBondContact O-N 2.85Å; A309-R313 VanDerWaalsContact O-CB 3.31Å; A309-R313 WeakPolarHBondContact O-CB 3.37Å; A309-R313 PolarHBondContact O-N 2.95Å; A309-R313 VanDerWaalsContact O-N 3.08Å
310	A	97.6	Very high	97.3	Very high	73 Å²	73	47.6 Å²	47.6	60%	0.603	24%	0.241	S	C	*	.	H	α-helix	trans	-68.7	-21	178.4	0	0	0	0	0	113.3	E307 N308 P314	E307-A310 WeakPolarHBondContact O-CB 3.46Å; E307-A310 PolarHBondContact O-N 2.86Å; N308-A310 PolarHBondContact O-N 3.43Å; A310-P314 WeakPolarHBondContact O-CD 3.34Å; A310-P314 WeakPolarHBondContact O-CG 3.41Å
311	Y	97.9	Very high	97.3	Very high	71 Å²	71	47.8 Å²	47.8	28%	0.278	24%	0.243	S	C	.	.	H	α-helix	trans	-101.5	-33.1	178.9	-61.3	-79.4	0	0	0	112.9	E307 N308 A309 F353	E307-Y311 HydrophobicContact CB-CD2 4.47Å; E307-Y311 HydrophobicContact CB-CE2 3.98Å; N308-Y311 PolarHBondContact O-N 3.34Å; A309-Y311 PolarHBondContact O-N 2.85Å; Y311-F353 HydrophobicContact CD1-CB 3.84Å; Y311-F353 HydrophobicContact CD1-CG 4.43Å; Y311-F353 HydrophobicContact CD2-CB 3.95Å; Y311-F353 HydrophobicContact CD2-CD1 4.45Å; Y311-F353 AromaticContact CD2-CD2 3.27Å; Y311-F353 HydrophobicContact CD2-CD2 3.27Å; Y311-F353 AromaticContact CD2-CE2 3.82Å; Y311-F353 HydrophobicContact CD2-CE2 3.82Å; Y311-F353 AromaticContact CD2-CG 3.64Å; Y311-F353 HydrophobicContact CD2-CG 3.64Å; Y311-F353 HydrophobicContact CE1-CB 4.25Å; Y311-F353 HydrophobicContact CE2-CB 4.34Å; Y311-F353 AromaticContact CE2-CD2 3.4Å; Y311-F353 HydrophobicContact CE2-CD2 3.4Å; Y311-F353 VanDerWaalsContact CE2-CD2 3.4Å; Y311-F353 HydrophobicContact CE2-CE2 4Å; Y311-F353 HydrophobicContact CE2-CG 4.13Å; Y311-F353 HydrophobicContact CG-CB 3.67Å; Y311-F353 AromaticContact CG-CD2 3.92Å; Y311-F353 HydrophobicContact CG-CD2 3.92Å; Y311-F353 AromaticContact CG-CG 3.8Å; Y311-F353 HydrophobicContact CG-CG 3.8Å
312	V	97.9	Very high	97.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-86	-39.2	-176.1	-175.2	0	0	0	0	112.2	V268 L271 L272 N308 L315 Y350	V268-V312 HydrophobicContact CB-CG1 4.26Å; V268-V312 HydrophobicContact CG1-CG1 4.13Å; V268-V312 HydrophobicContact CG2-CG1 4.11Å; V268-V312 WeakPolarHBondContact CG2-O 3.4Å; L271-V312 HydrophobicContact CB-CG1 3.9Å; L272-V312 HydrophobicContact CD2-CB 3.84Å; L272-V312 HydrophobicContact CD2-CG1 4.09Å; L272-V312 HydrophobicContact CG-CB 4.22Å; L272-V312 HydrophobicContact CG-CG1 3.89Å; N308-V312 WeakPolarHBondContact O-CG2 3.28Å; N308-V312 PolarHBondContact O-N 3.15Å; V312-L315 HydrophobicContact CG1-CD1 4.5Å; V312-L315 WeakPolarHBondContact O-CB 3.3Å; V312-L315 WeakPolarHBondContact O-CG 3.39Å; V312-L315 PolarHBondContact O-N 3.31Å; V312-Y350 HydrophobicContact CG2-CD2 3.69Å; V312-Y350 HydrophobicContact CG2-CE2 3.45Å; V312-Y350 VanDerWaalsContact CG2-CE2 3.45Å
313	R	97.8	Very high	97.2	Very high	122 Å²	122	49.9 Å²	49.9	46%	0.46	25%	0.25	S	C	.	.	H	α-helix	trans	-61.7	-42.5	-179.6	-76.1	-68.8	-171.3	177.5	2	114.6	L272 A309 L315 E316 D317	L272-R313 HydrophobicContact CD1-CG 4.44Å; A309-R313 VanDerWaalsContact O-CB 3.31Å; A309-R313 WeakPolarHBondContact O-CB 3.37Å; A309-R313 PolarHBondContact O-N 2.95Å; A309-R313 VanDerWaalsContact O-N 3.08Å; R313-L315 PolarHBondContact O-N 3.34Å; R313-E316 IonicContact CZ-OE2 3.92Å; R313-E316 IonicContact NH1-OE2 3.8Å; R313-E316 PolarHBondContact NH1-OE2 2.95Å; R313-E316 WeakPolarHBondContact O-CB 3.42Å; R313-E316 PolarHBondContact O-N 2.83Å; R313-D317 PolarHBondContact O-N 3.42Å
314	P	98.3	Very high	97.2	Very high	32 Å²	32	50.9 Å²	50.9	21%	0.208	25%	0.254	C	S	.	.	H	α-helix	trans	-58.6	-19.8	179.4	-27.7	37.1	0	0	0	114.8	A310 S318 N346	A310-P314 WeakPolarHBondContact O-CD 3.34Å; A310-P314 WeakPolarHBondContact O-CG 3.41Å; P314-S318 WeakPolarHBondContact O-CB 3.18Å; P314-S318 PolarHBondContact O-N 3.41Å; P314-S318 PolarHBondContact O-OG 2.91Å; P314-N346 HydrophobicContact CB-CB 4.07Å; P314-N346 VanDerWaalsContact CB-CG 3.49Å; P314-N346 PolarHBondContact O-ND2 2.88Å
315	L	97.9	Very high	97	Very high	8 Å²	8	50.6 Å²	50.6	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-64.3	-40.3	173.1	-53.2	176.5	0	0	0	111.9	V268 V312 R313 F319 F343 N346 F347 Y350	V268-L315 HydrophobicContact CG2-CB 3.91Å; V312-L315 HydrophobicContact CG1-CD1 4.5Å; V312-L315 WeakPolarHBondContact O-CB 3.3Å; V312-L315 WeakPolarHBondContact O-CG 3.39Å; V312-L315 PolarHBondContact O-N 3.31Å; R313-L315 PolarHBondContact O-N 3.34Å; L315-F319 WeakPolarHBondContact O-CB 3.32Å; L315-F319 PolarHBondContact O-N 2.87Å; L315-F343 HydrophobicContact CB-CE2 4.33Å; L315-N346 HydrophobicContact CD2-CB 4.01Å; L315-F347 HydrophobicContact CD2-CB 4.15Å; L315-F347 HydrophobicContact CD2-CD2 4.5Å; L315-Y350 HydrophobicContact CD1-CD1 4.1Å; L315-Y350 HydrophobicContact CD1-CG 4.1Å
316	E	97.1	Very high	96.8	Very high	31 Å²	31	50.9 Å²	50.9	15%	0.145	26%	0.261	C	S	.	.	H	α-helix	trans	-68.8	-52.5	174.5	166.6	170.4	-144	0	0	110.2	Q265 V268 R313 S318 F319 L320	Q265-E316 HydrophobicContact CG-CG 4.11Å; Q265-E316 WeakPolarHBondContact CG-OE1 3.45Å; Q265-E316 PolarHBondContact NE2-OE1 3.47Å; V268-E316 HydrophobicContact CB-CB 4.4Å; V268-E316 HydrophobicContact CG1-CB 4.17Å; V268-E316 HydrophobicContact CG2-CB 4.06Å; R313-E316 IonicContact CZ-OE2 3.92Å; R313-E316 IonicContact NH1-OE2 3.8Å; R313-E316 PolarHBondContact NH1-OE2 2.95Å; R313-E316 WeakPolarHBondContact O-CB 3.42Å; R313-E316 PolarHBondContact O-N 2.83Å; E316-S318 PolarHBondContact O-N 3.48Å; E316-F319 PolarHBondContact O-N 3.49Å; E316-L320 WeakPolarHBondContact O-CB 3.48Å; E316-L320 PolarHBondContact O-N 3.19Å
317	D	96.7	Very high	96.5	Very high	84 Å²	84	47.2 Å²	47.2	45%	0.449	25%	0.248	S	C	.	.	H	α-helix	trans	-60.9	-43.6	-175.9	-64.6	-50	0	0	0	112.9	R313 L320 Q321	R313-D317 PolarHBondContact O-N 3.42Å; D317-L320 PolarHBondContact O-N 3.33Å; D317-Q321 WeakPolarHBondContact O-CG 3.25Å; D317-Q321 PolarHBondContact O-N 2.95Å
318	S	97.4	Very high	96	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-74.9	-30.2	179.9	57.4	0	0	0	0	113.5	P314 E316 L322 F343 N346	P314-S318 WeakPolarHBondContact O-CB 3.18Å; P314-S318 PolarHBondContact O-N 3.41Å; P314-S318 PolarHBondContact O-OG 2.91Å; E316-S318 PolarHBondContact O-N 3.48Å; S318-L322 WeakPolarHBondContact O-CB 3.4Å; S318-L322 PolarHBondContact O-N 2.89Å; S318-F343 WeakPolarHBondContact OG-CA 3.33Å; S318-N346 VanDerWaalsContact CB-ND2 3.3Å; S318-N346 WeakPolarHBondContact CB-ND2 3.49Å; S318-N346 PolarHBondContact OG-ND2 3.38Å; S318-N346 VanDerWaalsContact OG-ND2 3.07Å
319	F	97.7	Very high	95.4	Very high	21 Å²	21	50.2 Å²	50.2	9%	0.092	26%	0.263	C	S	.	.	H	α-helix	trans	-75	-29.2	171.6	-153	-83.5	0	0	0	112.1	T257 A260 L261 I264 L315 E316 L322 Y323 F343	T257-F319 HydrophobicContact CG2-CE1 3.76Å; T257-F319 HydrophobicContact CG2-CZ 4.13Å; A260-F319 HydrophobicContact CB-CE1 3.73Å; A260-F319 HydrophobicContact CB-CZ 3.6Å; L261-F319 HydrophobicContact CB-CD1 3.84Å; L261-F319 HydrophobicContact CB-CE1 4.06Å; L261-F319 HydrophobicContact CD1-CB 4.43Å; L261-F319 HydrophobicContact CD1-CD1 4.03Å; I264-F319 HydrophobicContact CD1-CB 4.2Å; I264-F319 HydrophobicContact CD1-CD1 3.86Å; I264-F319 HydrophobicContact CD1-CD2 3.26Å; I264-F319 HydrophobicContact CD1-CE1 4.03Å; I264-F319 HydrophobicContact CD1-CE2 3.44Å; I264-F319 VanDerWaalsContact CD1-CE2 3.44Å; I264-F319 HydrophobicContact CD1-CG 3.48Å; I264-F319 VanDerWaalsContact CD1-CG 3.48Å; I264-F319 HydrophobicContact CD1-CZ 3.84Å; I264-F319 HydrophobicContact CG2-CB 4.19Å; L315-F319 WeakPolarHBondContact O-CB 3.32Å; L315-F319 PolarHBondContact O-N 2.87Å; E316-F319 PolarHBondContact O-N 3.49Å; F319-L322 HydrophobicContact CD2-CD2 3.82Å; F319-L322 HydrophobicContact CE2-CD2 3.61Å; F319-L322 HydrophobicContact CG-CD2 4.39Å; F319-L322 HydrophobicContact CZ-CD2 3.98Å; F319-L322 WeakPolarHBondContact O-CB 3.45Å; F319-L322 PolarHBondContact O-N 2.97Å; F319-Y323 PolarHBondContact O-N 3.07Å; F319-F343 HydrophobicContact CB-CD2 3.87Å; F319-F343 HydrophobicContact CB-CE2 4.1Å; F319-F343 HydrophobicContact CD2-CD1 4.15Å; F319-F343 AromaticContact CD2-CD2 3.74Å; F319-F343 HydrophobicContact CD2-CD2 3.74Å; F319-F343 HydrophobicContact CD2-CE1 4.2Å; F319-F343 AromaticContact CD2-CE2 3.79Å; F319-F343 HydrophobicContact CD2-CE2 3.79Å; F319-F343 AromaticContact CD2-CG 3.92Å; F319-F343 HydrophobicContact CD2-CG 3.92Å; F319-F343 HydrophobicContact CD2-CZ 4.02Å; F319-F343 HydrophobicContact CG-CD2 4.31Å; F319-F343 HydrophobicContact CG-CE2 4.37Å
320	L	97.4	Very high	95	Very high	57 Å²	57	49.9 Å²	49.9	30%	0.298	26%	0.257	S	S	.	.	H	α-helix	trans	-65.7	-43.5	170	178.4	62.3	0	0	0	111.4	L261 E316 D317 L322 Y323 Q324	L261-L320 HydrophobicContact CD1-CB 4.18Å; L261-L320 HydrophobicContact CD2-CD1 3.82Å; E316-L320 WeakPolarHBondContact O-CB 3.48Å; E316-L320 PolarHBondContact O-N 3.19Å; D317-L320 PolarHBondContact O-N 3.33Å; L320-L322 VanDerWaalsContact C-N 3.32Å; L320-L322 PolarHBondContact O-N 3.33Å; L320-Y323 PolarHBondContact O-N 3.47Å; L320-Q324 HydrophobicContact CD1-CG 4.39Å; L320-Q324 WeakPolarHBondContact O-CB 3.32Å; L320-Q324 VanDerWaalsContact O-CG 3.28Å; L320-Q324 WeakPolarHBondContact O-CG 3.32Å; L320-Q324 PolarHBondContact O-N 3.37Å
321	Q	96.3	Very high	94.5	Very high	87 Å²	87	46.9 Å²	46.9	41%	0.407	23%	0.231	S	C	.	.	H	α-helix	trans	-59.2	-42.4	171.8	-71.4	168.9	18.8	0	0	111.9	D317 Q324 S325 N342	D317-Q321 WeakPolarHBondContact O-CG 3.25Å; D317-Q321 PolarHBondContact O-N 2.95Å; Q321-Q324 PolarHBondContact O-N 2.94Å; Q321-S325 PolarHBondContact O-N 2.61Å; Q321-N342 PolarHBondContact OE1-ND2 2.75Å
322	L	96.2	Very high	94.1	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-58.7	-50.4	173.5	169.4	59.1	0	0	0	111.7	T257 S318 F319 L320 Q324 S325 I326 V337 M339 L340	T257-L322 HydrophobicContact CG2-CG 4.36Å; S318-L322 WeakPolarHBondContact O-CB 3.4Å; S318-L322 PolarHBondContact O-N 2.89Å; F319-L322 HydrophobicContact CD2-CD2 3.82Å; F319-L322 HydrophobicContact CE2-CD2 3.61Å; F319-L322 HydrophobicContact CG-CD2 4.39Å; F319-L322 HydrophobicContact CZ-CD2 3.98Å; F319-L322 WeakPolarHBondContact O-CB 3.45Å; F319-L322 PolarHBondContact O-N 2.97Å; L320-L322 VanDerWaalsContact C-N 3.32Å; L320-L322 PolarHBondContact O-N 3.33Å; L322-Q324 PolarHBondContact O-N 2.84Å; L322-S325 PolarHBondContact O-N 2.93Å; L322-S325 PolarHBondContact O-OG 3.01Å; L322-I326 HydrophobicContact CD1-CD1 4.29Å; L322-V337 HydrophobicContact CD1-CG1 3.19Å; L322-M339 HydrophobicContact CB-CB 4.1Å; L322-M339 HydrophobicContact CD1-CB 4.32Å; L322-L340 HydrophobicContact CD2-CD1 4.13Å
323	Y	96.7	Very high	93.7	Very high	51 Å²	51	45.5 Å²	45.5	20%	0.2	23%	0.23	C	C	.	.	H	α-helix	trans	-57.7	-46.3	175.3	170.9	-102.6	0	0	0	112.5	R254 T257 L261 F319 L320 S325 I326	R254-Y323 HydrophobicContact CG-CE2 4Å; T257-Y323 HydrophobicContact CG2-CD2 4.27Å; L261-Y323 HydrophobicContact CD2-CD1 3.97Å; L261-Y323 HydrophobicContact CD2-CG 3.93Å; F319-Y323 PolarHBondContact O-N 3.07Å; L320-Y323 PolarHBondContact O-N 3.47Å; Y323-S325 VanDerWaalsContact C-N 3.26Å; Y323-S325 PolarHBondContact O-N 2.83Å; Y323-I326 PolarHBondContact O-N 3.36Å; Y323-I326 VanDerWaalsContact O-N 3.12Å
324	Q	95.7	Very high	93.2	Very high	124 Å²	124	41.2 Å²	41.2	58%	0.579	22%	0.216	S	C	*	.	H	α-helix	trans	-63.4	-29.8	179.8	-72.4	174.1	4.5	0	0	112.9	L320 Q321 L322 I326	L320-Q324 HydrophobicContact CD1-CG 4.39Å; L320-Q324 WeakPolarHBondContact O-CB 3.32Å; L320-Q324 VanDerWaalsContact O-CG 3.28Å; L320-Q324 WeakPolarHBondContact O-CG 3.32Å; L320-Q324 PolarHBondContact O-N 3.37Å; Q321-Q324 PolarHBondContact O-N 2.94Å; L322-Q324 PolarHBondContact O-N 2.84Å; Q324-I326 VanDerWaalsContact C-N 3.26Å; Q324-I326 PolarHBondContact O-N 3.05Å
325	S	94.1	Very high	92.6	Very high	41 Å²	41	40.9 Å²	40.9	29%	0.287	21%	0.212	S	C	.	.	H	α-helix	trans	-69.6	-19.3	175.9	75.7	0	0	0	0	114.1	Q321 L322 Y323 T327	Q321-S325 PolarHBondContact O-N 2.61Å; L322-S325 PolarHBondContact O-N 2.93Å; L322-S325 PolarHBondContact O-OG 3.01Å; Y323-S325 VanDerWaalsContact C-N 3.26Å; Y323-S325 PolarHBondContact O-N 2.83Å; S325-T327 PolarHBondContact O-N 3.25Å
326	I	93.3	Very high	92	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.031	22%	0.221	C	C	.	.			trans	-94.1	103.1	-175.7	-63.4	174.1	0	0	0	110.3	A253 R254 T257 L322 Y323 Q324 T332	A253-I326 HydrophobicContact CB-CG2 4.45Å; R254-I326 HydrophobicContact CB-CG2 3.88Å; R254-I326 WeakPolarHBondContact CD-O 3.39Å; R254-I326 HydrophobicContact CG-CG2 4.27Å; T257-I326 HydrophobicContact CG2-CD1 4.06Å; T257-I326 WeakPolarHBondContact OG1-CD1 3.48Å; L322-I326 HydrophobicContact CD1-CD1 4.29Å; Y323-I326 PolarHBondContact O-N 3.36Å; Y323-I326 VanDerWaalsContact O-N 3.12Å; Q324-I326 VanDerWaalsContact C-N 3.26Å; Q324-I326 PolarHBondContact O-N 3.05Å; I326-T332 HydrophobicContact CD1-CG2 3.84Å; I326-T332 HydrophobicContact CG1-CG2 4.28Å
327	T	90.6	Very high	91.6	Very high	55 Å²	55	41.7 Å²	41.7	34%	0.337	22%	0.219	S	C	.	.			trans	-122.6	173.6	-178.5	72.6	0	0	0	0	111.9	Q250 S325 D329 T330	Q250-T327 VanDerWaalsContact CG-O 3.24Å; Q250-T327 WeakPolarHBondContact CG-O 3.25Å; Q250-T327 PolarHBondContact NE2-O 3.41Å; S325-T327 PolarHBondContact O-N 3.25Å; T327-D329 PolarHBondContact O-N 2.88Å; T327-D329 PolarHBondContact OG1-N 3.47Å; T327-T330 PolarHBondContact N-OG1 3.43Å; T327-T330 PolarHBondContact O-N 3.02Å; T327-T330 PolarHBondContact O-OG1 2.88Å; T327-T330 PolarHBondContact OG1-N 3.38Å; T327-T330 PolarHBondContact OG1-OG1 2.99Å
328	E	84.6	Confident	91.2	Very high	65 Å²	65	40.8 Å²	40.8	30%	0.304	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.8	175.3	-67.4	-157.8	-136.6	0	0	114.4	R247 L251 K521	R247-E328 IonicContact CZ-OE2 3.78Å; R247-E328 IonicContact NE-OE2 3.62Å; R247-E328 PolarHBondContact NE-OE2 2.67Å; R247-E328 VanDerWaalsContact NH2-CD 3.33Å; R247-E328 IonicContact NH2-OE1 2.83Å; R247-E328 PolarHBondContact NH2-OE1 3.41Å; R247-E328 VanDerWaalsContact NH2-OE1 3.14Å; R247-E328 IonicContact NH2-OE2 2.65Å; R247-E328 PolarHBondContact NH2-OE2 2.99Å; L251-E328 HydrophobicContact CD2-CG 3.97Å; E328-K521 PolarHBondContact O-NZ 3.08Å
329	D	84.9	Confident	91	Very high	70 Å²	70	44.1 Å²	44.1	37%	0.374	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	19.6	179.5	-85.9	-20.5	0	0	0	113	T327 L518 K521	T327-D329 PolarHBondContact O-N 2.88Å; T327-D329 PolarHBondContact OG1-N 3.47Å; D329-L518 WeakPolarHBondContact O-CD1 3.48Å; D329-L518 WeakPolarHBondContact O-CD2 3.31Å; D329-K521 WeakPolarHBondContact OD1-CE 3.26Å; D329-K521 IonicContact OD1-NZ 3.53Å; D329-K521 PolarHBondContact OD1-NZ 3.23Å
330	T	88.5	Confident	90.8	Very high	41 Å²	41	44.5 Å²	44.5	25%	0.252	24%	0.235	S	C	.	.	S	Bend	trans	-113.2	174.1	165.8	50.1	0	0	0	0	110.9	Q250 T327	Q250-T330 PolarHBondContact NE2-O 3.34Å; Q250-T330 PolarHBondContact NE2-OG1 2.89Å; T327-T330 PolarHBondContact N-OG1 3.43Å; T327-T330 PolarHBondContact O-N 3.02Å; T327-T330 PolarHBondContact O-OG1 2.88Å; T327-T330 PolarHBondContact OG1-N 3.38Å; T327-T330 PolarHBondContact OG1-OG1 2.99Å
331	V	88.1	Confident	90.7	Very high	10 Å²	10	45.9 Å²	45.9	6%	0.061	24%	0.237	C	C	.	.			trans	-114.4	137.8	167	169.5	0	0	0	0	107.1	V333 T336 Y500 L509 A514 M517 L518	V331-V333 HydrophobicContact CG1-CG1 4.13Å; V331-V333 HydrophobicContact CG1-CG2 4.19Å; V331-T336 PolarHBondContact O-OG1 3.23Å; V331-T336 VanDerWaalsContact O-OG1 3.06Å; V331-Y500 HydrophobicContact CG1-CD1 4.39Å; V331-Y500 HydrophobicContact CG1-CD2 3.75Å; V331-Y500 HydrophobicContact CG1-CE1 4.46Å; V331-Y500 HydrophobicContact CG1-CE2 3.85Å; V331-Y500 HydrophobicContact CG1-CG 4.04Å; V331-Y500 HydrophobicContact CG2-CE1 4.12Å; V331-L509 HydrophobicContact CG1-CD2 3.79Å; V331-A514 HydrophobicContact CB-CB 4.06Å; V331-A514 HydrophobicContact CG1-CB 4.28Å; V331-A514 HydrophobicContact CG2-CB 4.01Å; V331-M517 HydrophobicContact CG2-CE 3.16Å; V331-L518 HydrophobicContact CG2-CD1 4.12Å; V331-L518 HydrophobicContact CG2-CD2 4.45Å; V331-L518 HydrophobicContact CG2-CG 4.23Å
332	T	89.8	Confident	90.6	Very high	21 Å²	21	43.5 Å²	43.5	13%	0.129	23%	0.227	C	C	.	.			trans	-109.2	93	176.9	-41.1	0	0	0	0	110.1	Q250 A253 I326 V337	Q250-T332 PolarHBondContact NE2-OG1 2.81Å; Q250-T332 PolarHBondContact OE1-OG1 3.38Å; A253-T332 HydrophobicContact CB-CG2 3.97Å; I326-T332 HydrophobicContact CD1-CG2 3.84Å; I326-T332 HydrophobicContact CG1-CG2 4.28Å; T332-V337 HydrophobicContact CG2-CG2 3.55Å
333	V	88.3	Confident	90.7	Very high	21 Å²	21	44.1 Å²	44.1	13%	0.127	23%	0.229	C	C	.	.	S	Bend	trans	-136.7	158.4	166.4	-60	0	0	0	0	109.4	V331 E335 T336 V337 Y500 L509	V331-V333 HydrophobicContact CG1-CG1 4.13Å; V331-V333 HydrophobicContact CG1-CG2 4.19Å; V333-E335 WeakPolarHBondContact CB-OE2 3.24Å; V333-E335 HydrophobicContact CG2-CB 4.25Å; V333-E335 VanDerWaalsContact CG2-OE2 3.31Å; V333-E335 WeakPolarHBondContact CG2-OE2 3.4Å; V333-E335 PolarHBondContact O-N 3.3Å; V333-E335 VanDerWaalsContact O-N 3.08Å; V333-T336 HydrophobicContact CG2-CG2 3.75Å; V333-T336 VanDerWaalsContact CG2-OG1 3.29Å; V333-T336 WeakPolarHBondContact CG2-OG1 3.42Å; V333-T336 PolarHBondContact N-OG1 2.97Å; V333-T336 PolarHBondContact O-N 2.93Å; V333-T336 PolarHBondContact O-OG1 2.98Å; V333-V337 VanDerWaalsContact O-CG2 3.26Å; V333-V337 WeakPolarHBondContact O-CG2 3.48Å; V333-V337 PolarHBondContact O-N 3.39Å; V333-V337 VanDerWaalsContact O-N 3.08Å; V333-Y500 HydrophobicContact CG1-CD2 4.11Å; V333-L509 HydrophobicContact CG1-CD2 4.37Å; V333-L509 HydrophobicContact CG2-CB 4.35Å; V333-L509 HydrophobicContact CG2-CD2 3.98Å
334	L	87.3	Confident	90.7	Very high	32 Å²	32	41.7 Å²	41.7	17%	0.168	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.8	-172.5	-64.2	-179.5	0	0	0	113.3	T336 L340 L406 P409 S410 T421 F425	L334-T336 PolarHBondContact O-N 3.43Å; L334-L340 HydrophobicContact CD2-CD2 4.18Å; L334-L406 HydrophobicContact CD1-CD2 3.83Å; L334-P409 HydrophobicContact CB-CB 3.92Å; L334-P409 HydrophobicContact CB-CG 4Å; L334-P409 HydrophobicContact CD1-CG 4.39Å; L334-S410 WeakPolarHBondContact O-CB 3.42Å; L334-S410 PolarHBondContact O-N 2.83Å; L334-T421 HydrophobicContact CD1-CG2 3.58Å; L334-F425 HydrophobicContact CD1-CE2 4.21Å; L334-F425 HydrophobicContact CD1-CZ 4.39Å; L334-F425 HydrophobicContact CD2-CZ 4.13Å
335	E	85.8	Confident	90.8	Very high	25 Å²	25	40.2 Å²	40.2	12%	0.117	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.6	177.1	-55.7	91.3	148.3	0	0	113.5	V333 P409 S508 P511	V333-E335 WeakPolarHBondContact CB-OE2 3.24Å; V333-E335 HydrophobicContact CG2-CB 4.25Å; V333-E335 VanDerWaalsContact CG2-OE2 3.31Å; V333-E335 WeakPolarHBondContact CG2-OE2 3.4Å; V333-E335 PolarHBondContact O-N 3.3Å; V333-E335 VanDerWaalsContact O-N 3.08Å; E335-P409 HydrophobicContact CG-CB 4.14Å; E335-S508 WeakPolarHBondContact CG-OG 3.35Å; E335-S508 WeakPolarHBondContact OE1-CB 3.49Å; E335-S508 PolarHBondContact OE1-OG 3Å; E335-P511 HydrophobicContact CB-CG 4.22Å; E335-P511 WeakPolarHBondContact O-CG 3.44Å
336	T	86.4	Confident	91	Very high	38 Å²	38	40.3 Å²	40.3	23%	0.233	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-18.7	-175.1	55.2	0	0	0	0	113.8	V331 V333 L334 V338 P511 A514	V331-T336 PolarHBondContact O-OG1 3.23Å; V331-T336 VanDerWaalsContact O-OG1 3.06Å; V333-T336 HydrophobicContact CG2-CG2 3.75Å; V333-T336 VanDerWaalsContact CG2-OG1 3.29Å; V333-T336 WeakPolarHBondContact CG2-OG1 3.42Å; V333-T336 PolarHBondContact N-OG1 2.97Å; V333-T336 PolarHBondContact O-N 2.93Å; V333-T336 PolarHBondContact O-OG1 2.98Å; L334-T336 PolarHBondContact O-N 3.43Å; T336-V338 VanDerWaalsContact C-N 3.29Å; T336-V338 PolarHBondContact O-N 2.98Å; T336-P511 HydrophobicContact CG2-CB 4.41Å; T336-P511 HydrophobicContact CG2-CG 4.42Å; T336-A514 HydrophobicContact CG2-CB 4.01Å
337	V	87.8	Confident	91.2	Very high	17 Å²	17	40.5 Å²	40.5	10%	0.103	21%	0.211	C	C	.	.			trans	-88.8	66.9	-173.8	-178.5	0	0	0	0	110	L322 T332 V333 M339 L340	L322-V337 HydrophobicContact CD1-CG1 3.19Å; T332-V337 HydrophobicContact CG2-CG2 3.55Å; V333-V337 VanDerWaalsContact O-CG2 3.26Å; V333-V337 WeakPolarHBondContact O-CG2 3.48Å; V333-V337 PolarHBondContact O-N 3.39Å; V333-V337 VanDerWaalsContact O-N 3.08Å; V337-M339 PolarHBondContact O-N 2.98Å; V337-L340 HydrophobicContact CG1-CB 4.04Å; V337-L340 WeakPolarHBondContact O-CB 3.32Å; V337-L340 PolarHBondContact O-N 2.93Å; V337-L340 VanDerWaalsContact O-N 3.14Å
338	V	88.6	Confident	91.6	Very high	65 Å²	65	38.6 Å²	38.6	39%	0.394	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-34.4	-174.4	-175.7	0	0	0	0	112.8	T336 L340 R341	T336-V338 VanDerWaalsContact C-N 3.29Å; T336-V338 PolarHBondContact O-N 2.98Å; V338-L340 PolarHBondContact O-N 3.32Å; V338-R341 WeakPolarHBondContact O-CB 3.24Å; V338-R341 PolarHBondContact O-N 3.29Å; V338-R341 VanDerWaalsContact O-N 3.1Å
339	M	92.9	Very high	92.2	Very high	72 Å²	72	38.1 Å²	38.1	36%	0.355	20%	0.204	S	C	.	.	H	α-helix	trans	-68.1	-15.8	-178.7	-61.4	-55.8	170.2	0	0	114	L322 V337 R341 N342 F343	L322-M339 HydrophobicContact CB-CB 4.1Å; L322-M339 HydrophobicContact CD1-CB 4.32Å; V337-M339 PolarHBondContact O-N 2.98Å; M339-R341 PolarHBondContact O-N 3.32Å; M339-N342 PolarHBondContact O-N 2.77Å; M339-F343 PolarHBondContact O-N 3.21Å
340	L	94	Very high	92.9	Very high	28 Å²	28	35 Å²	35	15%	0.147	19%	0.187	C	C	.	.	H	α-helix	trans	-61.9	-28.5	171.6	180	61.2	0	0	0	111.6	L322 L334 V337 V338 F343 A344 L406 A407	L322-L340 HydrophobicContact CD2-CD1 4.13Å; L334-L340 HydrophobicContact CD2-CD2 4.18Å; V337-L340 HydrophobicContact CG1-CB 4.04Å; V337-L340 WeakPolarHBondContact O-CB 3.32Å; V337-L340 PolarHBondContact O-N 2.93Å; V337-L340 VanDerWaalsContact O-N 3.14Å; V338-L340 PolarHBondContact O-N 3.32Å; L340-F343 HydrophobicContact CD1-CD1 4.39Å; L340-F343 PolarHBondContact O-N 3.08Å; L340-A344 WeakPolarHBondContact O-CB 3.42Å; L340-A344 PolarHBondContact O-N 3.23Å; L340-L406 HydrophobicContact CD2-CB 4.39Å; L340-A407 HydrophobicContact CG-CB 4.28Å
341	R	93.9	Very high	93.4	Very high	86 Å²	86	33 Å²	33	33%	0.325	18%	0.175	S	C	.	.	H	α-helix	trans	-65.2	-43.8	176.7	-161.7	-169.9	70.8	-128.8	-10.5	112.2	V338 M339 F343 A344 E345 A407	V338-R341 WeakPolarHBondContact O-CB 3.24Å; V338-R341 PolarHBondContact O-N 3.29Å; V338-R341 VanDerWaalsContact O-N 3.1Å; M339-R341 PolarHBondContact O-N 3.32Å; R341-F343 VanDerWaalsContact C-N 3.26Å; R341-F343 PolarHBondContact O-N 3.01Å; R341-A344 WeakPolarHBondContact O-CB 3.41Å; R341-A344 PolarHBondContact O-N 2.93Å; R341-E345 VanDerWaalsContact CD-OE1 3.27Å; R341-E345 WeakPolarHBondContact CD-OE1 3.42Å; R341-E345 HydrophobicContact CG-CG 4.45Å; R341-E345 VanDerWaalsContact CG-OE1 3.31Å; R341-E345 WeakPolarHBondContact CG-OE1 3.31Å; R341-E345 IonicContact CZ-OE1 3.59Å; R341-E345 IonicContact NE-OE1 2.74Å; R341-E345 PolarHBondContact NE-OE1 3.15Å; R341-E345 WeakPolarHBondContact O-CB 3.42Å; R341-E345 WeakPolarHBondContact O-CG 3.26Å; R341-E345 PolarHBondContact O-N 2.8Å; R341-A407 HydrophobicContact CB-CB 4.38Å
342	N	95.6	Very high	93.9	Very high	38 Å²	38	38 Å²	38	20%	0.203	20%	0.197	C	C	.	.	H	α-helix	trans	-58.8	-40.7	177	-59.2	8	0	0	0	110.8	Q321 M339 N346	Q321-N342 PolarHBondContact OE1-ND2 2.75Å; M339-N342 PolarHBondContact O-N 2.77Å; N342-N346 WeakPolarHBondContact O-CB 3.44Å; N342-N346 PolarHBondContact O-N 3.12Å; N342-N346 PolarHBondContact O-ND2 2.95Å; N342-N346 VanDerWaalsContact O-ND2 3.15Å
343	F	97.4	Very high	94.3	Very high	20 Å²	20	37.1 Å²	37.1	9%	0.088	19%	0.191	C	C	.	.	H	α-helix	trans	-66.7	-40.3	174.3	179	-101	0	0	0	112.5	I264 L315 S318 F319 M339 L340 R341 N346 F347 I403	I264-F343 HydrophobicContact CD1-CE2 4.12Å; I264-F343 HydrophobicContact CD1-CZ 3.95Å; I264-F343 HydrophobicContact CG2-CE2 4.47Å; L315-F343 HydrophobicContact CB-CE2 4.33Å; S318-F343 WeakPolarHBondContact OG-CA 3.33Å; F319-F343 HydrophobicContact CB-CD2 3.87Å; F319-F343 HydrophobicContact CB-CE2 4.1Å; F319-F343 HydrophobicContact CD2-CD1 4.15Å; F319-F343 AromaticContact CD2-CD2 3.74Å; F319-F343 HydrophobicContact CD2-CD2 3.74Å; F319-F343 HydrophobicContact CD2-CE1 4.2Å; F319-F343 AromaticContact CD2-CE2 3.79Å; F319-F343 HydrophobicContact CD2-CE2 3.79Å; F319-F343 AromaticContact CD2-CG 3.92Å; F319-F343 HydrophobicContact CD2-CG 3.92Å; F319-F343 HydrophobicContact CD2-CZ 4.02Å; F319-F343 HydrophobicContact CG-CD2 4.31Å; F319-F343 HydrophobicContact CG-CE2 4.37Å; M339-F343 PolarHBondContact O-N 3.21Å; L340-F343 HydrophobicContact CD1-CD1 4.39Å; L340-F343 PolarHBondContact O-N 3.08Å; R341-F343 VanDerWaalsContact C-N 3.26Å; R341-F343 PolarHBondContact O-N 3.01Å; F343-N346 PolarHBondContact O-N 3.27Å; F343-F347 HydrophobicContact CE1-CD2 4.39Å; F343-F347 HydrophobicContact CZ-CD2 4.16Å; F343-F347 VanDerWaalsContact O-CB 3.26Å; F343-F347 WeakPolarHBondContact O-CB 3.45Å; F343-F347 PolarHBondContact O-N 3.43Å; F343-I403 HydrophobicContact CD1-CG2 4.25Å; F343-I403 HydrophobicContact CE1-CG2 4.35Å
344	A	97.4	Very high	94.7	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-37.5	177	0	0	0	0	0	113	L340 R341 S348 I403 N404 A407	L340-A344 WeakPolarHBondContact O-CB 3.42Å; L340-A344 PolarHBondContact O-N 3.23Å; R341-A344 WeakPolarHBondContact O-CB 3.41Å; R341-A344 PolarHBondContact O-N 2.93Å; A344-S348 VanDerWaalsContact O-CB 3.24Å; A344-S348 WeakPolarHBondContact O-CB 3.31Å; A344-S348 PolarHBondContact O-N 3.35Å; A344-S348 PolarHBondContact O-OG 3.49Å; A344-I403 HydrophobicContact CB-CG2 3.77Å; A344-N404 WeakPolarHBondContact CB-OD1 3.45Å; A344-N404 PolarHBondContact O-OD1 3.12Å; A344-A407 HydrophobicContact CB-CB 3.86Å
345	E	97.4	Very high	95.3	Very high	93 Å²	93	38.1 Å²	38.1	44%	0.435	20%	0.196	S	C	.	.	H	α-helix	trans	-66.3	-42.6	173.6	-71.6	164.9	-170.8	0	0	111.5	R341 S348 S349	R341-E345 VanDerWaalsContact CD-OE1 3.27Å; R341-E345 WeakPolarHBondContact CD-OE1 3.42Å; R341-E345 HydrophobicContact CG-CG 4.45Å; R341-E345 VanDerWaalsContact CG-OE1 3.31Å; R341-E345 WeakPolarHBondContact CG-OE1 3.31Å; R341-E345 IonicContact CZ-OE1 3.59Å; R341-E345 IonicContact NE-OE1 2.74Å; R341-E345 PolarHBondContact NE-OE1 3.15Å; R341-E345 WeakPolarHBondContact O-CB 3.42Å; R341-E345 WeakPolarHBondContact O-CG 3.26Å; R341-E345 PolarHBondContact O-N 2.8Å; E345-S348 WeakPolarHBondContact O-CB 3.34Å; E345-S348 PolarHBondContact O-N 3.24Å; E345-S349 PolarHBondContact O-N 3.1Å; E345-S349 PolarHBondContact O-OG 2.61Å
346	N	98.1	Very high	95.8	Very high	43 Å²	43	40 Å²	40	23%	0.23	20%	0.204	C	C	.	.	H	α-helix	trans	-70.1	-41.8	175.1	-72.3	-34.8	0	0	0	112.6	P314 L315 S318 N342 F343 S348 S349 Y350	P314-N346 HydrophobicContact CB-CB 4.07Å; P314-N346 VanDerWaalsContact CB-CG 3.49Å; P314-N346 PolarHBondContact O-ND2 2.88Å; L315-N346 HydrophobicContact CD2-CB 4.01Å; S318-N346 VanDerWaalsContact CB-ND2 3.3Å; S318-N346 WeakPolarHBondContact CB-ND2 3.49Å; S318-N346 PolarHBondContact OG-ND2 3.38Å; S318-N346 VanDerWaalsContact OG-ND2 3.07Å; N342-N346 WeakPolarHBondContact O-CB 3.44Å; N342-N346 PolarHBondContact O-N 3.12Å; N342-N346 PolarHBondContact O-ND2 2.95Å; N342-N346 VanDerWaalsContact O-ND2 3.15Å; F343-N346 PolarHBondContact O-N 3.27Å; N346-S348 VanDerWaalsContact C-N 3.29Å; N346-S348 PolarHBondContact O-N 2.91Å; N346-S349 WeakPolarHBondContact O-CB 3.35Å; N346-S349 PolarHBondContact O-N 3.38Å; N346-S349 VanDerWaalsContact O-N 3.07Å; N346-Y350 PolarHBondContact O-N 3.36Å
347	F	98.4	Very high	96.4	Very high	10 Å²	10	38.3 Å²	38.3	4%	0.044	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-38.3	174.2	-167.7	-79.9	0	0	0	111.5	L315 F343 T351 F396 M399 Q400 I403	L315-F347 HydrophobicContact CD2-CB 4.15Å; L315-F347 HydrophobicContact CD2-CD2 4.5Å; F343-F347 HydrophobicContact CE1-CD2 4.39Å; F343-F347 HydrophobicContact CZ-CD2 4.16Å; F343-F347 VanDerWaalsContact O-CB 3.26Å; F343-F347 WeakPolarHBondContact O-CB 3.45Å; F343-F347 PolarHBondContact O-N 3.43Å; F347-T351 WeakPolarHBondContact O-CB 3.48Å; F347-T351 PolarHBondContact O-N 3.38Å; F347-T351 PolarHBondContact O-OG1 3.1Å; F347-F396 HydrophobicContact CE1-CD1 4.11Å; F347-F396 HydrophobicContact CE2-CD1 4.22Å; F347-F396 HydrophobicContact CE2-CE1 4.2Å; F347-F396 AromaticContact CZ-CD1 3.52Å; F347-F396 HydrophobicContact CZ-CD1 3.52Å; F347-F396 AromaticContact CZ-CE1 3.92Å; F347-F396 HydrophobicContact CZ-CE1 3.92Å; F347-M399 HydrophobicContact CE1-CB 4.07Å; F347-M399 HydrophobicContact CE2-CE 4.26Å; F347-M399 HydrophobicContact CZ-CB 4.03Å; F347-M399 HydrophobicContact CZ-CE 3.84Å; F347-Q400 HydrophobicContact CD1-CB 4Å; F347-Q400 HydrophobicContact CD1-CG 4.45Å; F347-Q400 HydrophobicContact CE1-CB 4.03Å; F347-I403 HydrophobicContact CD1-CD1 3.84Å; F347-I403 HydrophobicContact CD2-CD1 3.96Å; F347-I403 HydrophobicContact CE1-CD1 3.82Å; F347-I403 HydrophobicContact CE2-CD1 3.93Å; F347-I403 HydrophobicContact CG-CD1 3.92Å; F347-I403 HydrophobicContact CZ-CD1 3.86Å
348	S	98.3	Very high	96.9	Very high	15 Å²	15	38.6 Å²	38.6	11%	0.105	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-46.5	169.4	-68.6	0	0	0	0	111.5	A344 E345 N346 Y350 T351 H352 Q400 N404	A344-S348 VanDerWaalsContact O-CB 3.24Å; A344-S348 WeakPolarHBondContact O-CB 3.31Å; A344-S348 PolarHBondContact O-N 3.35Å; A344-S348 PolarHBondContact O-OG 3.49Å; E345-S348 WeakPolarHBondContact O-CB 3.34Å; E345-S348 PolarHBondContact O-N 3.24Å; N346-S348 VanDerWaalsContact C-N 3.29Å; N346-S348 PolarHBondContact O-N 2.91Å; S348-Y350 PolarHBondContact O-N 2.84Å; S348-T351 PolarHBondContact O-N 2.72Å; S348-H352 PolarHBondContact O-N 3.36Å; S348-H352 PolarHBondContact O-ND1 3.34Å; S348-Q400 WeakPolarHBondContact OG-CG 3.35Å; S348-Q400 PolarHBondContact OG-NE2 3.35Å; S348-N404 PolarHBondContact OG-ND2 3.29Å; S348-N404 PolarHBondContact OG-OD1 2.91Å
349	S	98.3	Very high	97.3	Very high	55 Å²	55	39 Å²	39	39%	0.385	20%	0.198	S	C	.	.	H	α-helix	trans	-61.9	-42.3	179.4	-58.7	0	0	0	0	112.4	E345 N346 H352 F353	E345-S349 PolarHBondContact O-N 3.1Å; E345-S349 PolarHBondContact O-OG 2.61Å; N346-S349 WeakPolarHBondContact O-CB 3.35Å; N346-S349 PolarHBondContact O-N 3.38Å; N346-S349 VanDerWaalsContact O-N 3.07Å; S349-H352 PolarHBondContact O-N 3.07Å; S349-F353 PolarHBondContact O-N 3.27Å
350	Y	98.6	Very high	97.6	Very high	3 Å²	3	37.9 Å²	37.9	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-36.5	173.4	177.7	-114.4	0	0	0	113.2	L271 H275 V312 L315 N346 S348 F353 L354 F396	L271-Y350 HydrophobicContact CD1-CE1 3.91Å; L271-Y350 WeakPolarHBondContact CD2-OH 3.33Å; H275-Y350 AromaticContact NE2-CE2 3.71Å; H275-Y350 AromaticContact NE2-CZ 3.81Å; H275-Y350 PolarHBondContact NE2-OH 3.44Å; V312-Y350 HydrophobicContact CG2-CD2 3.69Å; V312-Y350 HydrophobicContact CG2-CE2 3.45Å; V312-Y350 VanDerWaalsContact CG2-CE2 3.45Å; L315-Y350 HydrophobicContact CD1-CD1 4.1Å; L315-Y350 HydrophobicContact CD1-CG 4.1Å; N346-Y350 PolarHBondContact O-N 3.36Å; S348-Y350 PolarHBondContact O-N 2.84Å; Y350-F353 AromaticContact CD2-CD1 3.97Å; Y350-F353 HydrophobicContact CD2-CD1 3.97Å; Y350-F353 AromaticContact CE2-CD1 3.87Å; Y350-F353 HydrophobicContact CE2-CD1 3.87Å; Y350-F353 HydrophobicContact CE2-CE1 4.34Å; Y350-F353 WeakPolarHBondContact O-CB 3.12Å; Y350-F353 PolarHBondContact O-N 2.75Å; Y350-L354 HydrophobicContact CD1-CD1 4.38Å; Y350-L354 HydrophobicContact CE1-CD1 3.71Å; Y350-L354 HydrophobicContact CE1-CG 4.1Å; Y350-L354 HydrophobicContact CE2-CD2 4.22Å; Y350-L354 HydrophobicContact CE2-CG 4.19Å; Y350-L354 PolarHBondContact O-N 3.04Å; Y350-F396 HydrophobicContact CD1-CD1 4.35Å; Y350-F396 HydrophobicContact CD1-CE1 4.19Å; Y350-F396 HydrophobicContact CE1-CD1 4.13Å; Y350-F396 AromaticContact CE1-CE1 3.71Å; Y350-F396 HydrophobicContact CE1-CE1 3.71Å; Y350-F396 AromaticContact CE1-CZ 3.99Å; Y350-F396 HydrophobicContact CE1-CZ 3.99Å
351	T	98.4	Very high	97.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68.4	-39.1	176.8	-54.8	0	0	0	0	111.7	F347 S348 F353 L354 L355 F396 E397 Q400	F347-T351 WeakPolarHBondContact O-CB 3.48Å; F347-T351 PolarHBondContact O-N 3.38Å; F347-T351 PolarHBondContact O-OG1 3.1Å; S348-T351 PolarHBondContact O-N 2.72Å; T351-F353 VanDerWaalsContact C-N 3.3Å; T351-F353 PolarHBondContact O-N 2.91Å; T351-L354 PolarHBondContact O-N 2.97Å; T351-L355 WeakPolarHBondContact O-CG 3.43Å; T351-L355 PolarHBondContact O-N 2.83Å; T351-F396 HydrophobicContact CG2-CB 4.01Å; T351-E397 HydrophobicContact CG2-CB 4.46Å; T351-E397 HydrophobicContact CG2-CG 4.02Å; T351-Q400 HydrophobicContact CG2-CB 4.39Å
352	H	98.3	Very high	97.9	Very high	115 Å²	115	34.3 Å²	34.3	53%	0.532	18%	0.177	S	C	.	.	H	α-helix	trans	-64.8	-32.8	170.7	-69.4	93.7	0	0	0	112.4	S348 S349 L355 K356	S348-H352 PolarHBondContact O-N 3.36Å; S348-H352 PolarHBondContact O-ND1 3.34Å; S349-H352 PolarHBondContact O-N 3.07Å; H352-L355 PolarHBondContact O-N 3.45Å; H352-K356 WeakPolarHBondContact O-CB 3.43Å; H352-K356 PolarHBondContact O-N 3.16Å
353	F	98.4	Very high	98	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-45.1	171.4	169.2	-99.6	0	0	0	112.1	Y304 N308 Y311 S349 Y350 T351 L355 K356 I357	Y304-F353 VanDerWaalsContact O-CE2 3.25Å; Y304-F353 WeakPolarHBondContact O-CE2 3.34Å; N308-F353 HydrophobicContact CB-CE1 4.03Å; N308-F353 HydrophobicContact CB-CZ 3.73Å; Y311-F353 HydrophobicContact CD1-CB 3.84Å; Y311-F353 HydrophobicContact CD1-CG 4.43Å; Y311-F353 HydrophobicContact CD2-CB 3.95Å; Y311-F353 HydrophobicContact CD2-CD1 4.45Å; Y311-F353 AromaticContact CD2-CD2 3.27Å; Y311-F353 HydrophobicContact CD2-CD2 3.27Å; Y311-F353 AromaticContact CD2-CE2 3.82Å; Y311-F353 HydrophobicContact CD2-CE2 3.82Å; Y311-F353 AromaticContact CD2-CG 3.64Å; Y311-F353 HydrophobicContact CD2-CG 3.64Å; Y311-F353 HydrophobicContact CE1-CB 4.25Å; Y311-F353 HydrophobicContact CE2-CB 4.34Å; Y311-F353 AromaticContact CE2-CD2 3.4Å; Y311-F353 HydrophobicContact CE2-CD2 3.4Å; Y311-F353 VanDerWaalsContact CE2-CD2 3.4Å; Y311-F353 HydrophobicContact CE2-CE2 4Å; Y311-F353 HydrophobicContact CE2-CG 4.13Å; Y311-F353 HydrophobicContact CG-CB 3.67Å; Y311-F353 AromaticContact CG-CD2 3.92Å; Y311-F353 HydrophobicContact CG-CD2 3.92Å; Y311-F353 AromaticContact CG-CG 3.8Å; Y311-F353 HydrophobicContact CG-CG 3.8Å; S349-F353 PolarHBondContact O-N 3.27Å; Y350-F353 AromaticContact CD2-CD1 3.97Å; Y350-F353 HydrophobicContact CD2-CD1 3.97Å; Y350-F353 AromaticContact CE2-CD1 3.87Å; Y350-F353 HydrophobicContact CE2-CD1 3.87Å; Y350-F353 HydrophobicContact CE2-CE1 4.34Å; Y350-F353 WeakPolarHBondContact O-CB 3.12Å; Y350-F353 PolarHBondContact O-N 2.75Å; T351-F353 VanDerWaalsContact C-N 3.3Å; T351-F353 PolarHBondContact O-N 2.91Å; F353-L355 VanDerWaalsContact C-N 3.32Å; F353-L355 PolarHBondContact O-N 3.19Å; F353-K356 WeakPolarHBondContact O-CB 3.43Å; F353-K356 PolarHBondContact O-N 3.25Å; F353-K356 VanDerWaalsContact O-N 3.12Å; F353-I357 HydrophobicContact CD2-CG2 4.35Å; F353-I357 HydrophobicContact CE1-CD1 3.9Å; F353-I357 HydrophobicContact CE2-CG2 3.86Å; F353-I357 HydrophobicContact CZ-CD1 4.14Å; F353-I357 HydrophobicContact CZ-CG2 3.97Å; F353-I357 PolarHBondContact O-N 3.32Å
354	L	98.3	Very high	97.9	Very high	12 Å²	12	36.7 Å²	36.7	6%	0.063	19%	0.186	C	C	.	.	H	α-helix	trans	-58	-43.7	173.5	-70.4	179.5	0	0	0	111.9	Y350 T351 K356 I357 L358 T393 F396	Y350-L354 HydrophobicContact CD1-CD1 4.38Å; Y350-L354 HydrophobicContact CE1-CD1 3.71Å; Y350-L354 HydrophobicContact CE1-CG 4.1Å; Y350-L354 HydrophobicContact CE2-CD2 4.22Å; Y350-L354 HydrophobicContact CE2-CG 4.19Å; Y350-L354 PolarHBondContact O-N 3.04Å; T351-L354 PolarHBondContact O-N 2.97Å; L354-K356 PolarHBondContact O-N 2.88Å; L354-I357 HydrophobicContact CD2-CD1 4.27Å; L354-I357 WeakPolarHBondContact O-CG1 3.47Å; L354-I357 PolarHBondContact O-N 2.7Å; L354-L358 WeakPolarHBondContact O-CB 3.4Å; L354-L358 PolarHBondContact O-N 3.41Å; L354-T393 HydrophobicContact CB-CG2 4.09Å; L354-F396 HydrophobicContact CD1-CB 3.96Å; L354-F396 HydrophobicContact CD1-CD1 4.17Å; L354-F396 HydrophobicContact CD1-CD2 3.43Å; L354-F396 VanDerWaalsContact CD1-CD2 3.43Å; L354-F396 HydrophobicContact CD1-CE2 3.91Å; L354-F396 HydrophobicContact CD1-CG 3.59Å; L354-F396 HydrophobicContact CD1-CZ 4.48Å
355	L	98	Very high	97.9	Very high	63 Å²	63	37.1 Å²	37.1	33%	0.33	19%	0.188	S	C	.	.	H	α-helix	trans	-64.2	-35.6	174.7	-71.1	168.1	0	0	0	113.2	T351 H352 F353 P359 T393 E397	T351-L355 WeakPolarHBondContact O-CG 3.43Å; T351-L355 PolarHBondContact O-N 2.83Å; H352-L355 PolarHBondContact O-N 3.45Å; F353-L355 VanDerWaalsContact C-N 3.32Å; F353-L355 PolarHBondContact O-N 3.19Å; L355-P359 VanDerWaalsContact O-CD 3.32Å; L355-P359 WeakPolarHBondContact O-CD 3.09Å; L355-T393 HydrophobicContact CD2-CG2 3.7Å; L355-T393 HydrophobicContact CG-CG2 4.07Å; L355-E397 HydrophobicContact CD1-CG 4.11Å; L355-E397 HydrophobicContact CD2-CG 4.28Å; L355-E397 HydrophobicContact CG-CG 4.43Å
356	K	97.7	Very high	97.8	Very high	65 Å²	65	35.7 Å²	35.7	28%	0.283	18%	0.181	S	C	.	.	H	α-helix	trans	-63.1	-40.4	174.6	174.5	-174	170.9	-175.7	0	111.8	Y304 E307 H352 F353 L354 Y360	Y304-K356 HydrophobicContact CD2-CD 4.5Å; Y304-K356 HydrophobicContact CD2-CG 4.18Å; Y304-K356 HydrophobicContact CE2-CG 4.18Å; E307-K356 IonicContact OE1-NZ 2.81Å; E307-K356 PolarHBondContact OE1-NZ 3.19Å; E307-K356 IonicContact OE2-NZ 3.2Å; E307-K356 PolarHBondContact OE2-NZ 2.87Å; H352-K356 WeakPolarHBondContact O-CB 3.43Å; H352-K356 PolarHBondContact O-N 3.16Å; F353-K356 WeakPolarHBondContact O-CB 3.43Å; F353-K356 PolarHBondContact O-N 3.25Å; F353-K356 VanDerWaalsContact O-N 3.12Å; L354-K356 PolarHBondContact O-N 2.88Å; K356-Y360 WeakPolarHBondContact O-CD2 3.4Å
357	I	97.9	Very high	97.6	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-88.8	-26.8	-176.6	68.4	172.7	0	0	0	114.2	F301 L305 F353 L354 Y360 Q361	F301-I357 HydrophobicContact CE2-CB 4.19Å; L305-I357 HydrophobicContact CD2-CD1 3.94Å; F353-I357 HydrophobicContact CD2-CG2 4.35Å; F353-I357 HydrophobicContact CE1-CD1 3.9Å; F353-I357 HydrophobicContact CE2-CG2 3.86Å; F353-I357 HydrophobicContact CZ-CD1 4.14Å; F353-I357 HydrophobicContact CZ-CG2 3.97Å; F353-I357 PolarHBondContact O-N 3.32Å; L354-I357 HydrophobicContact CD2-CD1 4.27Å; L354-I357 WeakPolarHBondContact O-CG1 3.47Å; L354-I357 PolarHBondContact O-N 2.7Å; I357-Y360 WeakPolarHBondContact O-CA 3.29Å; I357-Y360 WeakPolarHBondContact O-CB 3.33Å; I357-Y360 PolarHBondContact O-N 3.37Å; I357-Q361 PolarHBondContact O-N 2.89Å
358	L	98.3	Very high	97.3	Very high	23 Å²	23	36.1 Å²	36.1	12%	0.12	18%	0.182	C	C	.	.	H	α-helix	trans	-50.9	-45.5	-174.8	176.8	66.2	0	0	0	114	L354 Y360 Q361 L362 M389 K390 T393	L354-L358 WeakPolarHBondContact O-CB 3.4Å; L354-L358 PolarHBondContact O-N 3.41Å; L358-Y360 VanDerWaalsContact C-N 3.27Å; L358-Y360 PolarHBondContact O-N 2.85Å; L358-Q361 PolarHBondContact O-N 3Å; L358-L362 HydrophobicContact CD1-CD1 3.94Å; L358-L362 HydrophobicContact CD1-CD2 4.28Å; L358-L362 HydrophobicContact CD1-CG 3.89Å; L358-L362 HydrophobicContact CG-CD1 3.92Å; L358-L362 HydrophobicContact CG-CG 4.3Å; L358-L362 WeakPolarHBondContact O-CB 3.32Å; L358-L362 WeakPolarHBondContact O-CG 3.2Å; L358-L362 PolarHBondContact O-N 3.05Å; L358-M389 HydrophobicContact CD1-CB 4.02Å; L358-K390 HydrophobicContact CD1-CG 4.35Å; L358-K390 HydrophobicContact CD2-CG 4.42Å; L358-T393 HydrophobicContact CD2-CG2 4.05Å
359	P	98.2	Very high	97.2	Very high	74 Å²	74	36.1 Å²	36.1	48%	0.481	18%	0.182	S	C	.	.	H	α-helix	trans	-60.9	-35.1	178	-23.9	34.9	0	0	0	113.5	L355 K363	L355-P359 VanDerWaalsContact O-CD 3.32Å; L355-P359 WeakPolarHBondContact O-CD 3.09Å; P359-K363 WeakPolarHBondContact O-CB 3.4Å; P359-K363 WeakPolarHBondContact O-CG 3.36Å; P359-K363 PolarHBondContact O-N 3.4Å; P359-K363 VanDerWaalsContact O-N 3.11Å
360	Y	98.1	Very high	96.9	Very high	48 Å²	48	41.1 Å²	41.1	19%	0.188	20%	0.199	C	C	.	.	H	α-helix	trans	-74.2	-42.4	178.4	-63.7	-93.9	0	0	0	111	L297 K300 Y304 K356 I357 L358 L362 K363 S364	L297-Y360 HydrophobicContact CD1-CD1 3.88Å; L297-Y360 HydrophobicContact CD1-CE1 4.44Å; K300-Y360 HydrophobicContact CB-CE1 4.33Å; K300-Y360 HydrophobicContact CD-CE1 3.84Å; K300-Y360 WeakPolarHBondContact CE-OH 3.44Å; K300-Y360 HydrophobicContact CG-CE1 3.98Å; K300-Y360 PolarHBondContact NZ-OH 2.9Å; K300-Y360 VanDerWaalsContact NZ-OH 3.14Å; Y304-Y360 HydrophobicContact CD2-CD2 4.21Å; Y304-Y360 HydrophobicContact CD2-CE2 4.12Å; Y304-Y360 HydrophobicContact CE2-CD2 4.17Å; Y304-Y360 HydrophobicContact CE2-CE1 4.47Å; Y304-Y360 AromaticContact CE2-CE2 3.62Å; Y304-Y360 HydrophobicContact CE2-CE2 3.62Å; Y304-Y360 AromaticContact CE2-CZ 3.78Å; K356-Y360 WeakPolarHBondContact O-CD2 3.4Å; I357-Y360 WeakPolarHBondContact O-CA 3.29Å; I357-Y360 WeakPolarHBondContact O-CB 3.33Å; I357-Y360 PolarHBondContact O-N 3.37Å; L358-Y360 VanDerWaalsContact C-N 3.27Å; L358-Y360 PolarHBondContact O-N 2.85Å; Y360-L362 VanDerWaalsContact C-N 3.33Å; Y360-L362 PolarHBondContact O-N 2.72Å; Y360-K363 PolarHBondContact O-N 2.97Å; Y360-S364 VanDerWaalsContact O-CB 3.26Å; Y360-S364 WeakPolarHBondContact O-CB 3.45Å; Y360-S364 PolarHBondContact O-N 2.58Å
361	Q	96.9	Very high	96.4	Very high	17 Å²	17	41.8 Å²	41.8	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-39.9	175.6	-170.4	172.1	36.3	0	0	112.4	F301 I357 L358 L365 M389	F301-Q361 HydrophobicContact CE1-CB 4.12Å; F301-Q361 HydrophobicContact CE1-CG 4.28Å; F301-Q361 HydrophobicContact CE2-CB 3.88Å; F301-Q361 VanDerWaalsContact CZ-CA 3.5Å; F301-Q361 HydrophobicContact CZ-CB 3.45Å; F301-Q361 VanDerWaalsContact CZ-CB 3.45Å; F301-Q361 HydrophobicContact CZ-CG 3.68Å; I357-Q361 PolarHBondContact O-N 2.89Å; L358-Q361 PolarHBondContact O-N 3Å; Q361-L365 WeakPolarHBondContact O-CG 3.44Å; Q361-L365 PolarHBondContact O-N 3.5Å; Q361-M389 HydrophobicContact CG-CG 4.37Å; Q361-M389 PolarHBondContact NE2-SD 3.24Å
362	L	98.1	Very high	95.9	Very high	22 Å²	22	48.3 Å²	48.3	12%	0.115	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-48.6	174.9	-68.2	172.2	0	0	0	111.5	L358 Y360 S364 L365 E366 Q386 K390	L358-L362 HydrophobicContact CD1-CD1 3.94Å; L358-L362 HydrophobicContact CD1-CD2 4.28Å; L358-L362 HydrophobicContact CD1-CG 3.89Å; L358-L362 HydrophobicContact CG-CD1 3.92Å; L358-L362 HydrophobicContact CG-CG 4.3Å; L358-L362 WeakPolarHBondContact O-CB 3.32Å; L358-L362 WeakPolarHBondContact O-CG 3.2Å; L358-L362 PolarHBondContact O-N 3.05Å; Y360-L362 VanDerWaalsContact C-N 3.33Å; Y360-L362 PolarHBondContact O-N 2.72Å; L362-S364 VanDerWaalsContact C-N 3.34Å; L362-S364 PolarHBondContact O-N 2.95Å; L362-L365 WeakPolarHBondContact O-CB 3.47Å; L362-L365 PolarHBondContact O-N 2.99Å; L362-E366 PolarHBondContact O-N 3.45Å; L362-Q386 HydrophobicContact CD2-CB 3.66Å; L362-Q386 HydrophobicContact CD2-CG 3.78Å; L362-Q386 VanDerWaalsContact CD2-O 3.3Å; L362-Q386 WeakPolarHBondContact CD2-O 3.37Å; L362-Q386 PolarHBondContact O-NE2 2.72Å; L362-K390 HydrophobicContact CD1-CD 4.35Å; L362-K390 HydrophobicContact CD1-CG 4.08Å; L362-K390 HydrophobicContact CD2-CD 4.36Å; L362-K390 HydrophobicContact CD2-CG 4.16Å
363	K	96.9	Very high	95.3	Very high	105 Å²	105	46.6 Å²	46.6	46%	0.457	24%	0.242	S	C	.	.	H	α-helix	trans	-67.9	-31.6	179.3	-78.8	-74.7	175.1	-171.7	0	113.3	L297 P359 Y360 L365 E366 E367	L297-K363 HydrophobicContact CD1-CB 3.91Å; L297-K363 VanDerWaalsContact CD2-C 3.49Å; L297-K363 HydrophobicContact CD2-CB 3.49Å; L297-K363 VanDerWaalsContact CD2-CB 3.49Å; L297-K363 HydrophobicContact CG-CB 4.33Å; P359-K363 WeakPolarHBondContact O-CB 3.4Å; P359-K363 WeakPolarHBondContact O-CG 3.36Å; P359-K363 PolarHBondContact O-N 3.4Å; P359-K363 VanDerWaalsContact O-N 3.11Å; Y360-K363 PolarHBondContact O-N 2.97Å; K363-L365 VanDerWaalsContact C-N 3.34Å; K363-E366 WeakPolarHBondContact CE-OE2 3.33Å; K363-E366 IonicContact NZ-OE1 2.67Å; K363-E366 IonicContact NZ-OE2 3.99Å; K363-E366 PolarHBondContact NZ-OE2 3.19Å; K363-E366 CarbonylContact O-C 3.54Å; K363-E366 WeakPolarHBondContact O-CA 3.46Å; K363-E366 WeakPolarHBondContact O-CB 3.48Å; K363-E366 PolarHBondContact O-N 2.76Å; K363-E367 PolarHBondContact O-N 2.98Å
364	S	96.5	Very high	95	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-44.8	171.5	-169.3	0	0	0	0	110.6	N298 Y360 L362 E366 E367 E368	N298-S364 VanDerWaalsContact OD1-CB 3.22Å; N298-S364 WeakPolarHBondContact OD1-CB 3.49Å; N298-S364 PolarHBondContact OD1-OG 3.28Å; Y360-S364 VanDerWaalsContact O-CB 3.26Å; Y360-S364 WeakPolarHBondContact O-CB 3.45Å; Y360-S364 PolarHBondContact O-N 2.58Å; L362-S364 VanDerWaalsContact C-N 3.34Å; L362-S364 PolarHBondContact O-N 2.95Å; S364-E366 VanDerWaalsContact C-N 3.27Å; S364-E366 PolarHBondContact O-N 3.42Å; S364-E367 PolarHBondContact O-N 2.97Å; S364-E368 WeakPolarHBondContact O-CG 3.39Å; S364-E368 PolarHBondContact O-N 3.5Å
365	L	95.9	Very high	94.7	Very high	11 Å²	11	49.8 Å²	49.8	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-68.6	-19.6	172.2	-68.5	171.5	0	0	0	114	Q361 L362 K363 C369 L385 Q386 K449	Q361-L365 WeakPolarHBondContact O-CG 3.44Å; Q361-L365 PolarHBondContact O-N 3.5Å; L362-L365 WeakPolarHBondContact O-CB 3.47Å; L362-L365 PolarHBondContact O-N 2.99Å; K363-L365 VanDerWaalsContact C-N 3.34Å; L365-C369 PolarHBondContact O-N 3.2Å; L365-C369 PolarHBondContact O-SG 3Å; L365-L385 HydrophobicContact CD1-CB 4.08Å; L365-Q386 HydrophobicContact CB-CG 3.8Å; L365-Q386 HydrophobicContact CD1-CG 3.85Å; L365-K449 VanDerWaalsContact CD2-NZ 3.31Å
366	E	95.8	Very high	94.6	Very high	63 Å²	63	51 Å²	51	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-77.3	-42.9	169.7	-66.3	178.4	-141.5	0	0	111.1	L362 K363 S364 E368 C369 E370	L362-E366 PolarHBondContact O-N 3.45Å; K363-E366 WeakPolarHBondContact CE-OE2 3.33Å; K363-E366 IonicContact NZ-OE1 2.67Å; K363-E366 IonicContact NZ-OE2 3.99Å; K363-E366 PolarHBondContact NZ-OE2 3.19Å; K363-E366 CarbonylContact O-C 3.54Å; K363-E366 WeakPolarHBondContact O-CA 3.46Å; K363-E366 WeakPolarHBondContact O-CB 3.48Å; K363-E366 PolarHBondContact O-N 2.76Å; S364-E366 VanDerWaalsContact C-N 3.27Å; S364-E366 PolarHBondContact O-N 3.42Å; E366-E368 VanDerWaalsContact C-N 3.26Å; E366-E368 PolarHBondContact O-N 3.42Å; E366-C369 WeakPolarHBondContact O-CA 3.46Å; E366-C369 VanDerWaalsContact O-CB 3.29Å; E366-C369 WeakPolarHBondContact O-CB 3.46Å; E366-C369 PolarHBondContact O-N 2.97Å; E366-E370 PolarHBondContact O-N 2.95Å
367	E	93.8	Very high	94.4	Very high	57 Å²	57	50.4 Å²	50.4	27%	0.266	29%	0.29	S	S	.	.	H	α-helix	trans	-59.2	-37.1	171.2	-68.2	-176.3	175.3	0	0	111.5	S295 L297 N298 K363 S364 C369 E370 A371	S295-E367 WeakPolarHBondContact CB-OE2 3.46Å; S295-E367 PolarHBondContact OG-OE1 2.79Å; S295-E367 PolarHBondContact OG-OE2 3.27Å; L297-E367 WeakPolarHBondContact CB-OE1 3.47Å; L297-E367 HydrophobicContact CD2-CG 4.19Å; L297-E367 WeakPolarHBondContact CD2-OE1 3.34Å; N298-E367 PolarHBondContact ND2-OE2 3.27Å; K363-E367 PolarHBondContact O-N 2.98Å; S364-E367 PolarHBondContact O-N 2.97Å; E367-C369 VanDerWaalsContact C-N 3.27Å; E367-C369 PolarHBondContact O-N 3.47Å; E367-E370 PolarHBondContact O-N 2.8Å; E367-A371 PolarHBondContact O-N 2.84Å; E367-A371 VanDerWaalsContact O-N 3.12Å
368	E	93.3	Very high	94.2	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.019	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-23.4	170	-69.1	-171.2	-135.2	0	0	114.1	R281 Y285 P286 S364 E366 C374 N382 K449	R281-E368 IonicContact CZ-OE1 2.84Å; R281-E368 IonicContact CZ-OE2 3.72Å; R281-E368 IonicContact NH1-OE1 3.67Å; R281-E368 PolarHBondContact NH1-OE1 3.09Å; R281-E368 IonicContact NH1-OE2 3.77Å; R281-E368 PolarHBondContact NH1-OE2 3Å; R281-E368 IonicContact NH2-OE1 2.63Å; R281-E368 IonicContact NH2-OE2 3.63Å; R281-E368 PolarHBondContact NH2-OE2 3.02Å; Y285-E368 HydrophobicContact CD1-CG 3.73Å; Y285-E368 WeakPolarHBondContact CD1-OE2 3.47Å; Y285-E368 HydrophobicContact CE1-CB 4.11Å; Y285-E368 HydrophobicContact CE1-CG 3.69Å; Y285-E368 VanDerWaalsContact CE1-OE2 3.22Å; Y285-E368 WeakPolarHBondContact CE1-OE2 3.4Å; P286-E368 HydrophobicContact CG-CG 3.92Å; S364-E368 WeakPolarHBondContact O-CG 3.39Å; S364-E368 PolarHBondContact O-N 3.5Å; E366-E368 VanDerWaalsContact C-N 3.26Å; E366-E368 PolarHBondContact O-N 3.42Å; E368-C374 WeakPolarHBondContact O-CB 3.4Å; E368-C374 PolarHBondContact O-SG 3.45Å; E368-N382 WeakPolarHBondContact CB-ND2 3.33Å; E368-K449 IonicContact OE1-NZ 3.04Å; E368-K449 PolarHBondContact OE1-NZ 3.27Å; E368-K449 WeakPolarHBondContact OE2-CE 3.46Å; E368-K449 IonicContact OE2-NZ 2.62Å; E368-K449 PolarHBondContact OE2-NZ 3.28Å
369	C	94.6	Very high	94.1	Very high	16 Å²	16	51.8 Å²	51.8	11%	0.108	30%	0.296	C	S	.	.	H	α-helix	trans	-81.3	-27.6	172.7	-68	0	0	0	0	112.8	L365 E366 E367 M379 N382	L365-C369 PolarHBondContact O-N 3.2Å; L365-C369 PolarHBondContact O-SG 3Å; E366-C369 WeakPolarHBondContact O-CA 3.46Å; E366-C369 VanDerWaalsContact O-CB 3.29Å; E366-C369 WeakPolarHBondContact O-CB 3.46Å; E366-C369 PolarHBondContact O-N 2.97Å; E367-C369 VanDerWaalsContact C-N 3.27Å; E367-C369 PolarHBondContact O-N 3.47Å; C369-M379 HydrophobicContact CB-CE 4.42Å; C369-M379 HydrophobicContact CB-CG 4.08Å; C369-M379 WeakPolarHBondContact O-CE 3.5Å; C369-N382 WeakPolarHBondContact SG-CB 3.36Å
370	E	92.5	Very high	94.1	Very high	159 Å²	159	50.4 Å²	50.4	74%	0.743	29%	0.29	S	S	*	.	H	α-helix	trans	-87.8	-9.2	179.9	-67	178.3	-179.4	0	0	112.7	E366 E367	E366-E370 PolarHBondContact O-N 2.95Å; E367-E370 PolarHBondContact O-N 2.8Å
371	A	89.5	Confident	94.1	Very high	17 Å²	17	49.7 Å²	49.7	14%	0.14	29%	0.288	C	S	.	.	S	Bend	trans	-59.6	137.5	177.7	0	0	0	0	0	112.8	P286 E367 L373 C374	P286-A371 HydrophobicContact CB-CB 3.94Å; E367-A371 PolarHBondContact O-N 2.84Å; E367-A371 VanDerWaalsContact O-N 3.12Å; A371-L373 PolarHBondContact O-N 3.36Å; A371-C374 HydrophobicContact CB-CB 4.49Å; A371-C374 VanDerWaalsContact O-CB 3.29Å; A371-C374 WeakPolarHBondContact O-CB 3.44Å; A371-C374 PolarHBondContact O-N 2.88Å
372	P	86.2	Confident	94	Very high	137 Å²	137	48.9 Å²	48.9	89%	0.89	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.8	-171.9	-28	35.4	0	0	0	116.9
373	L	86.3	Confident	94	Very high	79 Å²	79	55.2 Å²	55.2	41%	0.414	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	9	179.6	-63.8	173.8	0	0	0	113	A371 T375 T458	A371-L373 PolarHBondContact O-N 3.36Å; L373-T375 PolarHBondContact O-N 3.32Å; L373-T375 VanDerWaalsContact O-N 3.14Å; L373-T458 HydrophobicContact CD1-CG2 3.37Å; L373-T458 WeakPolarHBondContact CD1-OG1 3.47Å
374	C	91.8	Very high	94.1	Very high	22 Å²	22	53.1 Å²	53.1	15%	0.149	30%	0.299	C	S	.	.			trans	-71.6	107.3	178.2	-166.9	0	0	0	0	111.1	E368 A371	E368-C374 WeakPolarHBondContact O-CB 3.4Å; E368-C374 PolarHBondContact O-SG 3.45Å; A371-C374 HydrophobicContact CB-CB 4.49Å; A371-C374 VanDerWaalsContact O-CB 3.29Å; A371-C374 WeakPolarHBondContact O-CB 3.44Å; A371-C374 PolarHBondContact O-N 2.88Å
375	T	93.3	Very high	94.1	Very high	60 Å²	60	53 Å²	53	37%	0.368	30%	0.298	S	S	.	.			trans	-70.1	157.8	175.2	70.9	0	0	0	0	110.9	L373 A377 L378 M379 L456	L373-T375 PolarHBondContact O-N 3.32Å; L373-T375 VanDerWaalsContact O-N 3.14Å; T375-A377 PolarHBondContact O-N 3.5Å; T375-A377 VanDerWaalsContact O-N 3.16Å; T375-L378 PolarHBondContact O-N 3.31Å; T375-L378 PolarHBondContact OG1-N 2.87Å; T375-L378 VanDerWaalsContact OG1-N 3.14Å; T375-M379 PolarHBondContact O-N 3.49Å; T375-L456 HydrophobicContact CG2-CD2 4.48Å
376	A	94.2	Very high	94.2	Very high	88 Å²	88	53.5 Å²	53.5	73%	0.727	30%	0.3	S	S	*	.	H	α-helix	trans	-58.2	-29.4	175.2	0	0	0	0	0	113	A380	A376-A380 PolarHBondContact O-N 2.95Å; A376-A380 VanDerWaalsContact O-N 3.11Å
377	A	95.1	Very high	94.3	Very high	53 Å²	53	54.1 Å²	54.1	44%	0.438	31%	0.311	S	S	.	.	H	α-helix	trans	-70.7	-43.9	173.8	0	0	0	0	0	112	T375 A380 K381 I452	T375-A377 PolarHBondContact O-N 3.5Å; T375-A377 VanDerWaalsContact O-N 3.16Å; A377-A380 WeakPolarHBondContact O-CB 3.37Å; A377-A380 PolarHBondContact O-N 2.78Å; A377-K381 PolarHBondContact O-N 3.47Å; A377-K381 VanDerWaalsContact O-N 3.1Å; A377-I452 HydrophobicContact CB-CD1 4.15Å
378	L	94.1	Very high	94.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-42.4	176.3	-172.9	59.4	0	0	0	111.6	Y285 T375 A380 K381 N382 K449 I452 E453 L456	Y285-L378 WeakPolarHBondContact OH-CD2 3.48Å; T375-L378 PolarHBondContact O-N 3.31Å; T375-L378 PolarHBondContact OG1-N 2.87Å; T375-L378 VanDerWaalsContact OG1-N 3.14Å; L378-A380 VanDerWaalsContact C-N 3.29Å; L378-A380 PolarHBondContact O-N 2.96Å; L378-K381 PolarHBondContact O-N 3.38Å; L378-K381 VanDerWaalsContact O-N 3.11Å; L378-N382 PolarHBondContact O-N 3.34Å; L378-K449 HydrophobicContact CD1-CG 3.81Å; L378-I452 HydrophobicContact CB-CG2 4.03Å; L378-I452 HydrophobicContact CD1-CG2 4.34Å; L378-E453 HydrophobicContact CD1-CG 3.79Å; L378-E453 HydrophobicContact CD2-CG 4.27Å; L378-L456 HydrophobicContact CD2-CD1 4.14Å
379	M	96	Very high	94.8	Very high	53 Å²	53	52.2 Å²	52.2	26%	0.261	30%	0.303	S	S	.	.	H	α-helix	trans	-59.4	-38.4	173.9	-173.4	-175.8	-69.8	0	0	112.1	C369 T375 R383	C369-M379 HydrophobicContact CB-CE 4.42Å; C369-M379 HydrophobicContact CB-CG 4.08Å; C369-M379 WeakPolarHBondContact O-CE 3.5Å; T375-M379 PolarHBondContact O-N 3.49Å; M379-R383 WeakPolarHBondContact O-CG 3.28Å; M379-R383 PolarHBondContact O-N 2.98Å; M379-R383 VanDerWaalsContact O-N 3.13Å; M379-R383 PolarHBondContact SD-NH2 2.99Å
380	A	97.3	Very high	94.9	Very high	44 Å²	44	56.1 Å²	56.1	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-63.6	-44.9	173.4	0	0	0	0	0	111.6	A376 A377 L378 N382 R383 E384	A376-A380 PolarHBondContact O-N 2.95Å; A376-A380 VanDerWaalsContact O-N 3.11Å; A377-A380 WeakPolarHBondContact O-CB 3.37Å; A377-A380 PolarHBondContact O-N 2.78Å; L378-A380 VanDerWaalsContact C-N 3.29Å; L378-A380 PolarHBondContact O-N 2.96Å; A380-N382 PolarHBondContact O-N 3.36Å; A380-R383 PolarHBondContact O-N 2.97Å; A380-E384 WeakPolarHBondContact O-CG 3.35Å; A380-E384 PolarHBondContact O-N 2.96Å
381	K	97.1	Very high	95.2	Very high	33 Å²	33	52.9 Å²	52.9	14%	0.143	30%	0.301	C	S	.	.	H	α-helix	trans	-67.3	-34	177.7	-63.5	-44.5	-172	-176.2	0	113.9	A377 L378 E384 L385 Q448 K449 I452	A377-K381 PolarHBondContact O-N 3.47Å; A377-K381 VanDerWaalsContact O-N 3.1Å; L378-K381 PolarHBondContact O-N 3.38Å; L378-K381 VanDerWaalsContact O-N 3.11Å; K381-E384 WeakPolarHBondContact CD-OE2 3.35Å; K381-E384 WeakPolarHBondContact CE-OE2 3.46Å; K381-E384 IonicContact NZ-OE1 2.75Å; K381-E384 PolarHBondContact NZ-OE1 2.83Å; K381-E384 IonicContact NZ-OE2 2.97Å; K381-E384 PolarHBondContact NZ-OE2 3.23Å; K381-E384 PolarHBondContact O-N 3.07Å; K381-L385 WeakPolarHBondContact O-CB 3.35Å; K381-L385 WeakPolarHBondContact O-CG 3.11Å; K381-L385 PolarHBondContact O-N 3.31Å; K381-Q448 HydrophobicContact CD-CB 4.47Å; K381-K449 HydrophobicContact CB-CB 4.06Å; K381-I452 HydrophobicContact CG-CD1 4Å
382	N	96.8	Very high	95.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-39.2	171.3	-77.4	-17.8	0	0	0	112.1	E368 C369 L378 A380 L385 Q386 K449	E368-N382 WeakPolarHBondContact CB-ND2 3.33Å; C369-N382 WeakPolarHBondContact SG-CB 3.36Å; L378-N382 PolarHBondContact O-N 3.34Å; A380-N382 PolarHBondContact O-N 3.36Å; N382-L385 PolarHBondContact O-N 3.28Å; N382-Q386 VanDerWaalsContact O-CG 3.31Å; N382-Q386 WeakPolarHBondContact O-CG 3.35Å; N382-Q386 PolarHBondContact O-N 3.46Å; N382-K449 WeakPolarHBondContact OD1-CD 3.38Å; N382-K449 WeakPolarHBondContact OD1-CE 3.46Å; N382-K449 PolarHBondContact OD1-NZ 3.29Å
383	R	97.3	Very high	96.2	Very high	155 Å²	155	46.4 Å²	46.4	59%	0.585	26%	0.257	S	S	*	.	H	α-helix	trans	-69.7	-36.7	175	-70.2	173.1	-177.3	176.4	3	113.3	M379 A380 Q386 S387	M379-R383 WeakPolarHBondContact O-CG 3.28Å; M379-R383 PolarHBondContact O-N 2.98Å; M379-R383 VanDerWaalsContact O-N 3.13Å; M379-R383 PolarHBondContact SD-NH2 2.99Å; A380-R383 PolarHBondContact O-N 2.97Å; R383-Q386 PolarHBondContact O-N 3.32Å; R383-S387 PolarHBondContact O-N 2.99Å
384	E	98.1	Very high	96.7	Very high	62 Å²	62	46.5 Å²	46.5	29%	0.29	26%	0.261	S	S	.	.	H	α-helix	trans	-60.3	-50.6	170.6	-72.3	172.3	-164.9	0	0	110.6	A380 K381 Q386 S387 D388 H445	A380-E384 WeakPolarHBondContact O-CG 3.35Å; A380-E384 PolarHBondContact O-N 2.96Å; K381-E384 WeakPolarHBondContact CD-OE2 3.35Å; K381-E384 WeakPolarHBondContact CE-OE2 3.46Å; K381-E384 IonicContact NZ-OE1 2.75Å; K381-E384 PolarHBondContact NZ-OE1 2.83Å; K381-E384 IonicContact NZ-OE2 2.97Å; K381-E384 PolarHBondContact NZ-OE2 3.23Å; K381-E384 PolarHBondContact O-N 3.07Å; E384-Q386 VanDerWaalsContact C-N 3.34Å; E384-Q386 PolarHBondContact O-N 3.13Å; E384-S387 WeakPolarHBondContact O-CA 3.39Å; E384-S387 WeakPolarHBondContact O-CB 3.25Å; E384-S387 PolarHBondContact O-N 3.43Å; E384-D388 PolarHBondContact O-N 3.1Å; E384-H445 HydrophobicContact CB-CB 4.39Å; E384-H445 IonicContact OE2-CD2 2.6Å; E384-H445 PolarHBondContact OE2-CD2 2.79Å; E384-H445 IonicContact OE2-CG 2.57Å; E384-H445 IonicContact OE2-ND1 2.75Å; E384-H445 IonicContact OE2-NE2 3.09Å
385	L	97.8	Very high	97.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-37.1	177.4	-74.1	172.6	0	0	0	113.3	L365 K381 N382 S387 D388 M389 M442 H445 Y446 K449	L365-L385 HydrophobicContact CD1-CB 4.08Å; K381-L385 WeakPolarHBondContact O-CB 3.35Å; K381-L385 WeakPolarHBondContact O-CG 3.11Å; K381-L385 PolarHBondContact O-N 3.31Å; N382-L385 PolarHBondContact O-N 3.28Å; L385-S387 PolarHBondContact O-N 3.19Å; L385-D388 PolarHBondContact O-N 3.2Å; L385-M389 VanDerWaalsContact O-CG 3.29Å; L385-M389 WeakPolarHBondContact O-CG 3.33Å; L385-M389 PolarHBondContact O-N 3.06Å; L385-M442 HydrophobicContact CD2-CG 4.08Å; L385-M442 WeakPolarHBondContact CD2-O 3.37Å; L385-H445 HydrophobicContact CD2-CB 4.03Å; L385-H445 HydrophobicContact CG-CB 4.27Å; L385-Y446 HydrophobicContact CD1-CD2 3.77Å; L385-Y446 HydrophobicContact CD1-CE2 4.18Å; L385-Y446 HydrophobicContact CD1-CG 4.25Å; L385-Y446 HydrophobicContact CD2-CD2 3.94Å; L385-Y446 HydrophobicContact CD2-CG 4.45Å; L385-K449 HydrophobicContact CD1-CB 4.37Å; L385-K449 HydrophobicContact CD1-CD 3.43Å; L385-K449 VanDerWaalsContact CD1-CD 3.43Å
386	Q	97.8	Very high	97.3	Very high	22 Å²	22	43.6 Å²	43.6	10%	0.103	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-32.1	171.6	-77	174.5	5	0	0	112.9	L362 L365 N382 R383 E384 K390	L362-Q386 HydrophobicContact CD2-CB 3.66Å; L362-Q386 HydrophobicContact CD2-CG 3.78Å; L362-Q386 VanDerWaalsContact CD2-O 3.3Å; L362-Q386 WeakPolarHBondContact CD2-O 3.37Å; L362-Q386 PolarHBondContact O-NE2 2.72Å; L365-Q386 HydrophobicContact CB-CG 3.8Å; L365-Q386 HydrophobicContact CD1-CG 3.85Å; N382-Q386 VanDerWaalsContact O-CG 3.31Å; N382-Q386 WeakPolarHBondContact O-CG 3.35Å; N382-Q386 PolarHBondContact O-N 3.46Å; R383-Q386 PolarHBondContact O-N 3.32Å; E384-Q386 VanDerWaalsContact C-N 3.34Å; E384-Q386 PolarHBondContact O-N 3.13Å; Q386-K390 VanDerWaalsContact O-CD 3.26Å; Q386-K390 WeakPolarHBondContact O-CD 3.49Å; Q386-K390 VanDerWaalsContact O-CG 3.29Å; Q386-K390 WeakPolarHBondContact O-CG 3.39Å
387	S	98.1	Very high	97.5	Very high	75 Å²	75	42.3 Å²	42.3	52%	0.524	22%	0.222	S	C	.	.	H	α-helix	trans	-72.3	-43.4	173.3	-166.2	0	0	0	0	111.1	R383 E384 L385 K390 K391	R383-S387 PolarHBondContact O-N 2.99Å; E384-S387 WeakPolarHBondContact O-CA 3.39Å; E384-S387 WeakPolarHBondContact O-CB 3.25Å; E384-S387 PolarHBondContact O-N 3.43Å; L385-S387 PolarHBondContact O-N 3.19Å; S387-K390 PolarHBondContact O-N 3.15Å; S387-K391 WeakPolarHBondContact O-CB 3.32Å; S387-K391 PolarHBondContact O-N 2.98Å
388	D	98.3	Very high	97.6	Very high	11 Å²	11	43.4 Å²	43.4	6%	0.059	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-42.6	-179.9	-70.3	-36.9	0	0	0	112.9	E384 L385 K390 K391 V392 M442 H445	E384-D388 PolarHBondContact O-N 3.1Å; L385-D388 PolarHBondContact O-N 3.2Å; D388-K390 VanDerWaalsContact C-N 3.31Å; D388-K390 PolarHBondContact O-N 3.43Å; D388-K391 WeakPolarHBondContact O-CB 3.4Å; D388-K391 PolarHBondContact O-N 3.45Å; D388-K391 VanDerWaalsContact O-N 3.12Å; D388-V392 WeakPolarHBondContact O-CG2 3.39Å; D388-V392 PolarHBondContact O-N 3.15Å; D388-M442 HydrophobicContact CB-CB 3.79Å; D388-M442 HydrophobicContact CB-CG 3.83Å; D388-M442 HydrophobicContact CB-SD 4.41Å; D388-M442 WeakPolarHBondContact OD2-CA 3.45Å; D388-H445 IonicContact OD2-CE1 3.34Å; D388-H445 IonicContact OD2-CG 3.33Å; D388-H445 IonicContact OD2-ND1 2.82Å; D388-H445 PolarHBondContact OD2-ND1 3.49Å
389	M	97.8	Very high	97.7	Very high	10 Å²	10	43.8 Å²	43.8	5%	0.049	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-38.4	177.2	-65	-63.1	167.8	0	0	112.1	F274 L358 Q361 L385 T393 M442	F274-M389 HydrophobicContact CZ-CE 4.04Å; F274-M389 HydrophobicContact CZ-SD 4.43Å; L358-M389 HydrophobicContact CD1-CB 4.02Å; Q361-M389 HydrophobicContact CG-CG 4.37Å; Q361-M389 PolarHBondContact NE2-SD 3.24Å; L385-M389 VanDerWaalsContact O-CG 3.29Å; L385-M389 WeakPolarHBondContact O-CG 3.33Å; L385-M389 PolarHBondContact O-N 3.06Å; M389-T393 WeakPolarHBondContact O-CB 3.29Å; M389-T393 PolarHBondContact O-N 3.39Å; M389-T393 VanDerWaalsContact O-N 3.08Å; M389-T393 PolarHBondContact O-OG1 2.92Å; M389-M442 HydrophobicContact CE-CE 4.37Å; M389-M442 HydrophobicContact CE-CG 3.9Å; M389-M442 HydrophobicContact CE-SD 3.48Å; M389-M442 WeakPolarHBondContact CE-SD 3.4Å; M389-M442 HydrophobicContact CG-SD 4.45Å; M389-M442 HydrophobicContact SD-CE 4.46Å; M389-M442 HydrophobicContact SD-CG 4.49Å; M389-M442 HydrophobicContact SD-SD 3.41Å
390	K	98.4	Very high	97.8	Very high	98 Å²	98	42.3 Å²	42.3	43%	0.426	21%	0.211	S	C	.	.	H	α-helix	trans	-62.2	-50.5	171.3	-69.6	164.5	-173.4	161.5	0	110.6	L358 L362 Q386 S387 D388 V392 T393 T394	L358-K390 HydrophobicContact CD1-CG 4.35Å; L358-K390 HydrophobicContact CD2-CG 4.42Å; L362-K390 HydrophobicContact CD1-CD 4.35Å; L362-K390 HydrophobicContact CD1-CG 4.08Å; L362-K390 HydrophobicContact CD2-CD 4.36Å; L362-K390 HydrophobicContact CD2-CG 4.16Å; Q386-K390 VanDerWaalsContact O-CD 3.26Å; Q386-K390 WeakPolarHBondContact O-CD 3.49Å; Q386-K390 VanDerWaalsContact O-CG 3.29Å; Q386-K390 WeakPolarHBondContact O-CG 3.39Å; S387-K390 PolarHBondContact O-N 3.15Å; D388-K390 VanDerWaalsContact C-N 3.31Å; D388-K390 PolarHBondContact O-N 3.43Å; K390-V392 PolarHBondContact O-N 3.03Å; K390-T393 PolarHBondContact O-N 3.4Å; K390-T394 PolarHBondContact O-N 2.89Å; K390-T394 PolarHBondContact O-OG1 2.95Å
391	K	98.2	Very high	97.7	Very high	91 Å²	91	44.7 Å²	44.7	40%	0.396	22%	0.217	S	C	.	.	H	α-helix	trans	-58.2	-46.3	-179.8	-175.5	-172.9	175	-168.9	0	112.1	S387 D388 T394 V395 A438	S387-K391 WeakPolarHBondContact O-CB 3.32Å; S387-K391 PolarHBondContact O-N 2.98Å; D388-K391 WeakPolarHBondContact O-CB 3.4Å; D388-K391 PolarHBondContact O-N 3.45Å; D388-K391 VanDerWaalsContact O-N 3.12Å; K391-T394 PolarHBondContact O-N 3.16Å; K391-V395 WeakPolarHBondContact O-CG2 3.18Å; K391-V395 PolarHBondContact O-N 2.95Å; K391-A438 HydrophobicContact CD-CB 3.9Å; K391-A438 HydrophobicContact CG-CB 3.94Å
392	V	98.3	Very high	97.7	Very high	13 Å²	13	45.6 Å²	45.6	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-48.1	176.7	171.5	0	0	0	0	110.6	D388 K390 T394 V395 F396 L435 A438 I439 M442	D388-V392 WeakPolarHBondContact O-CG2 3.39Å; D388-V392 PolarHBondContact O-N 3.15Å; K390-V392 PolarHBondContact O-N 3.03Å; V392-T394 PolarHBondContact O-N 2.89Å; V392-V395 PolarHBondContact O-N 3.24Å; V392-V395 VanDerWaalsContact O-N 3.15Å; V392-F396 HydrophobicContact CG1-CD2 3.94Å; V392-F396 HydrophobicContact CG1-CE2 3.84Å; V392-F396 WeakPolarHBondContact O-CD2 3.42Å; V392-F396 PolarHBondContact O-N 2.95Å; V392-L435 HydrophobicContact CG1-CD1 4.24Å; V392-A438 HydrophobicContact CG2-CB 3.65Å; V392-I439 HydrophobicContact CG1-CD1 4.44Å; V392-I439 HydrophobicContact CG1-CG1 4.18Å; V392-I439 HydrophobicContact CG2-CG1 3.84Å; V392-M442 HydrophobicContact CG2-CE 4.24Å; V392-M442 HydrophobicContact CG2-SD 3.79Å
393	T	98.1	Very high	97.7	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-46.7	179.2	-54	0	0	0	0	111.7	L354 L355 L358 M389 K390 V395 F396 E397	L354-T393 HydrophobicContact CB-CG2 4.09Å; L355-T393 HydrophobicContact CD2-CG2 3.7Å; L355-T393 HydrophobicContact CG-CG2 4.07Å; L358-T393 HydrophobicContact CD2-CG2 4.05Å; M389-T393 WeakPolarHBondContact O-CB 3.29Å; M389-T393 PolarHBondContact O-N 3.39Å; M389-T393 VanDerWaalsContact O-N 3.08Å; M389-T393 PolarHBondContact O-OG1 2.92Å; K390-T393 PolarHBondContact O-N 3.4Å; T393-V395 VanDerWaalsContact C-N 3.29Å; T393-V395 PolarHBondContact O-N 3.44Å; T393-F396 WeakPolarHBondContact O-CA 3.35Å; T393-F396 WeakPolarHBondContact O-CB 3.37Å; T393-F396 PolarHBondContact O-N 2.93Å; T393-E397 PolarHBondContact O-N 2.87Å
394	T	98	Very high	97.5	Very high	81 Å²	81	41.4 Å²	41.4	50%	0.497	21%	0.209	S	C	.	.	H	α-helix	trans	-68	-24.3	178.1	-63.6	0	0	0	0	113.9	K390 K391 V392 E397 K398	K390-T394 PolarHBondContact O-N 2.89Å; K390-T394 PolarHBondContact O-OG1 2.95Å; K391-T394 PolarHBondContact O-N 3.16Å; V392-T394 PolarHBondContact O-N 2.89Å; T394-E397 VanDerWaalsContact CA-OE2 3.25Å; T394-E397 WeakPolarHBondContact CA-OE2 3.25Å; T394-E397 PolarHBondContact OG1-OE2 3.35Å; T394-E397 VanDerWaalsContact OG1-OE2 3.08Å; T394-K398 WeakPolarHBondContact O-CB 3.47Å; T394-K398 PolarHBondContact O-N 3.35Å
395	V	98.3	Very high	97.3	Very high	16 Å²	16	41.6 Å²	41.6	10%	0.097	21%	0.212	C	C	.	.	H	α-helix	trans	-72.9	-36.3	168.5	178	0	0	0	0	111.6	K391 V392 T393 K398 M399 S431 L435	K391-V395 WeakPolarHBondContact O-CG2 3.18Å; K391-V395 PolarHBondContact O-N 2.95Å; V392-V395 PolarHBondContact O-N 3.24Å; V392-V395 VanDerWaalsContact O-N 3.15Å; T393-V395 VanDerWaalsContact C-N 3.29Å; T393-V395 PolarHBondContact O-N 3.44Å; V395-K398 PolarHBondContact O-N 2.93Å; V395-M399 HydrophobicContact CG1-CG 4.37Å; V395-M399 HydrophobicContact CG1-SD 4.16Å; V395-M399 WeakPolarHBondContact O-CB 3.45Å; V395-M399 WeakPolarHBondContact O-CG 3.47Å; V395-M399 PolarHBondContact O-N 3.07Å; V395-S431 VanDerWaalsContact CG1-O 3.32Å; V395-S431 WeakPolarHBondContact CG1-O 3.38Å; V395-L435 HydrophobicContact CB-CD1 4.39Å; V395-L435 HydrophobicContact CG1-CB 3.65Å; V395-L435 HydrophobicContact CG1-CD1 4.14Å; V395-L435 HydrophobicContact CG1-CG 4.45Å
396	F	98.4	Very high	97.1	Very high	5 Å²	5	42 Å²	42	2%	0.022	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-45.8	170.6	-84.9	-80.6	0	0	0	111.7	F347 Y350 T351 L354 V392 T393 K398 M399 Q400 L435	F347-F396 HydrophobicContact CE1-CD1 4.11Å; F347-F396 HydrophobicContact CE2-CD1 4.22Å; F347-F396 HydrophobicContact CE2-CE1 4.2Å; F347-F396 AromaticContact CZ-CD1 3.52Å; F347-F396 HydrophobicContact CZ-CD1 3.52Å; F347-F396 AromaticContact CZ-CE1 3.92Å; F347-F396 HydrophobicContact CZ-CE1 3.92Å; Y350-F396 HydrophobicContact CD1-CD1 4.35Å; Y350-F396 HydrophobicContact CD1-CE1 4.19Å; Y350-F396 HydrophobicContact CE1-CD1 4.13Å; Y350-F396 AromaticContact CE1-CE1 3.71Å; Y350-F396 HydrophobicContact CE1-CE1 3.71Å; Y350-F396 AromaticContact CE1-CZ 3.99Å; Y350-F396 HydrophobicContact CE1-CZ 3.99Å; T351-F396 HydrophobicContact CG2-CB 4.01Å; L354-F396 HydrophobicContact CD1-CB 3.96Å; L354-F396 HydrophobicContact CD1-CD1 4.17Å; L354-F396 HydrophobicContact CD1-CD2 3.43Å; L354-F396 VanDerWaalsContact CD1-CD2 3.43Å; L354-F396 HydrophobicContact CD1-CE2 3.91Å; L354-F396 HydrophobicContact CD1-CG 3.59Å; L354-F396 HydrophobicContact CD1-CZ 4.48Å; V392-F396 HydrophobicContact CG1-CD2 3.94Å; V392-F396 HydrophobicContact CG1-CE2 3.84Å; V392-F396 WeakPolarHBondContact O-CD2 3.42Å; V392-F396 PolarHBondContact O-N 2.95Å; T393-F396 WeakPolarHBondContact O-CA 3.35Å; T393-F396 WeakPolarHBondContact O-CB 3.37Å; T393-F396 PolarHBondContact O-N 2.93Å; F396-K398 VanDerWaalsContact C-N 3.32Å; F396-K398 PolarHBondContact O-N 3.09Å; F396-M399 PolarHBondContact O-N 3.22Å; F396-Q400 WeakPolarHBondContact O-CB 3.21Å; F396-Q400 PolarHBondContact O-N 3.2Å; F396-L435 HydrophobicContact CD2-CD1 3.97Å; F396-L435 HydrophobicContact CE1-CD2 4.4Å; F396-L435 HydrophobicContact CE2-CD1 3.63Å; F396-L435 HydrophobicContact CE2-CD2 4.36Å; F396-L435 HydrophobicContact CZ-CD1 4.16Å; F396-L435 HydrophobicContact CZ-CD2 4.05Å
397	E	97.5	Very high	96.9	Very high	62 Å²	62	41.2 Å²	41.2	29%	0.29	21%	0.211	S	C	.	.	H	α-helix	trans	-54.9	-46.5	171.9	-64.8	179.5	102.8	0	0	111.8	T351 L355 T393 T394 M399 Q400 N401	T351-E397 HydrophobicContact CG2-CB 4.46Å; T351-E397 HydrophobicContact CG2-CG 4.02Å; L355-E397 HydrophobicContact CD1-CG 4.11Å; L355-E397 HydrophobicContact CD2-CG 4.28Å; L355-E397 HydrophobicContact CG-CG 4.43Å; T393-E397 PolarHBondContact O-N 2.87Å; T394-E397 VanDerWaalsContact CA-OE2 3.25Å; T394-E397 WeakPolarHBondContact CA-OE2 3.25Å; T394-E397 PolarHBondContact OG1-OE2 3.35Å; T394-E397 VanDerWaalsContact OG1-OE2 3.08Å; E397-M399 PolarHBondContact O-N 3.05Å; E397-Q400 PolarHBondContact O-N 3.3Å; E397-N401 PolarHBondContact O-N 3.45Å; E397-N401 PolarHBondContact O-ND2 2.83Å
398	K	97.3	Very high	96.5	Very high	75 Å²	75	41.1 Å²	41.1	33%	0.326	20%	0.204	S	C	.	.	H	α-helix	trans	-64	-41.5	178.8	179.7	170.4	179.1	-177.1	0	112.1	T394 V395 F396 Y402 S431	T394-K398 WeakPolarHBondContact O-CB 3.47Å; T394-K398 PolarHBondContact O-N 3.35Å; V395-K398 PolarHBondContact O-N 2.93Å; F396-K398 VanDerWaalsContact C-N 3.32Å; F396-K398 PolarHBondContact O-N 3.09Å; K398-Y402 HydrophobicContact CD-CE2 4.33Å; K398-Y402 HydrophobicContact CG-CD2 4.4Å; K398-Y402 HydrophobicContact CG-CE2 3.58Å; K398-Y402 WeakPolarHBondContact O-CD2 3.27Å; K398-Y402 WeakPolarHBondContact O-CE2 3.24Å; K398-S431 WeakPolarHBondContact CE-OG 3.32Å
399	M	97.6	Very high	96	Very high	9 Å²	9	41 Å²	41	4%	0.044	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-43	176.4	-76.8	177.1	51.8	0	0	112.7	F347 V395 F396 E397 N401 Y402 I403 L428 L432 L435	F347-M399 HydrophobicContact CE1-CB 4.07Å; F347-M399 HydrophobicContact CE2-CE 4.26Å; F347-M399 HydrophobicContact CZ-CB 4.03Å; F347-M399 HydrophobicContact CZ-CE 3.84Å; V395-M399 HydrophobicContact CG1-CG 4.37Å; V395-M399 HydrophobicContact CG1-SD 4.16Å; V395-M399 WeakPolarHBondContact O-CB 3.45Å; V395-M399 WeakPolarHBondContact O-CG 3.47Å; V395-M399 PolarHBondContact O-N 3.07Å; F396-M399 PolarHBondContact O-N 3.22Å; E397-M399 PolarHBondContact O-N 3.05Å; M399-N401 PolarHBondContact O-N 3.49Å; M399-Y402 PolarHBondContact O-N 2.86Å; M399-Y402 VanDerWaalsContact O-N 3.09Å; M399-I403 HydrophobicContact CB-CD1 4.39Å; M399-I403 WeakPolarHBondContact O-CG1 3.48Å; M399-I403 PolarHBondContact O-N 3.32Å; M399-L428 HydrophobicContact CB-CD1 4.37Å; M399-L428 HydrophobicContact CG-CD1 4.16Å; M399-L432 HydrophobicContact CE-CD2 3.33Å; M399-L432 HydrophobicContact CE-CG 4.15Å; M399-L432 HydrophobicContact SD-CD2 3.96Å; M399-L432 HydrophobicContact SD-CG 4.44Å; M399-L435 HydrophobicContact CE-CD2 4.14Å; M399-L435 HydrophobicContact SD-CB 4.07Å; M399-L435 HydrophobicContact SD-CD2 3.65Å; M399-L435 HydrophobicContact SD-CG 4.4Å
400	Q	97.1	Very high	95.3	Very high	22 Å²	22	41.5 Å²	41.5	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	-51.8	-45	176.9	179.6	-167.4	-1.3	0	0	111	F347 S348 T351 F396 E397 Y402 I403 N404	F347-Q400 HydrophobicContact CD1-CB 4Å; F347-Q400 HydrophobicContact CD1-CG 4.45Å; F347-Q400 HydrophobicContact CE1-CB 4.03Å; S348-Q400 WeakPolarHBondContact OG-CG 3.35Å; S348-Q400 PolarHBondContact OG-NE2 3.35Å; T351-Q400 HydrophobicContact CG2-CB 4.39Å; F396-Q400 WeakPolarHBondContact O-CB 3.21Å; F396-Q400 PolarHBondContact O-N 3.2Å; E397-Q400 PolarHBondContact O-N 3.3Å; Q400-Y402 PolarHBondContact O-N 2.86Å; Q400-I403 PolarHBondContact O-N 3.39Å; Q400-N404 VanDerWaalsContact O-CB 3.32Å; Q400-N404 WeakPolarHBondContact O-CB 3.47Å; Q400-N404 VanDerWaalsContact O-CG 3.31Å; Q400-N404 PolarHBondContact O-N 2.92Å; Q400-N404 PolarHBondContact O-ND2 3.44Å
401	N	96	Very high	94.5	Very high	94 Å²	94	40.9 Å²	40.9	50%	0.503	21%	0.213	S	C	.	.	H	α-helix	trans	-60.2	-44.4	178.3	-77.8	-68.6	0	0	0	112.8	E397 M399 L405	E397-N401 PolarHBondContact O-N 3.45Å; E397-N401 PolarHBondContact O-ND2 2.83Å; M399-N401 PolarHBondContact O-N 3.49Å; N401-L405 WeakPolarHBondContact O-CB 3.43Å; N401-L405 VanDerWaalsContact O-CG 3.24Å; N401-L405 WeakPolarHBondContact O-CG 3.43Å; N401-L405 PolarHBondContact O-N 3.47Å
402	Y	96.8	Very high	93.6	Very high	52 Å²	52	45.5 Å²	45.5	20%	0.204	23%	0.228	C	C	.	.	H	α-helix	trans	-73.5	-34.5	178	-56.3	-55.7	0	0	0	113.3	K398 M399 Q400 L405 L406 V424 Q427	K398-Y402 HydrophobicContact CD-CE2 4.33Å; K398-Y402 HydrophobicContact CG-CD2 4.4Å; K398-Y402 HydrophobicContact CG-CE2 3.58Å; K398-Y402 WeakPolarHBondContact O-CD2 3.27Å; K398-Y402 WeakPolarHBondContact O-CE2 3.24Å; M399-Y402 PolarHBondContact O-N 2.86Å; M399-Y402 VanDerWaalsContact O-N 3.09Å; Q400-Y402 PolarHBondContact O-N 2.86Å; Y402-L405 HydrophobicContact CD1-CD1 4.13Å; Y402-L405 PolarHBondContact O-N 2.89Å; Y402-L406 VanDerWaalsContact O-CG 3.31Å; Y402-L406 WeakPolarHBondContact O-CG 3.4Å; Y402-L406 PolarHBondContact O-N 3.08Å; Y402-V424 HydrophobicContact CD1-CG1 4.2Å; Y402-Q427 HydrophobicContact CD2-CG 4.34Å; Y402-Q427 HydrophobicContact CE1-CB 4.34Å; Y402-Q427 HydrophobicContact CE1-CG 3.81Å; Y402-Q427 HydrophobicContact CE2-CB 4.44Å; Y402-Q427 HydrophobicContact CE2-CG 3.57Å; Y402-Q427 VanDerWaalsContact OH-CG 3.28Å; Y402-Q427 WeakPolarHBondContact OH-CG 3.48Å
403	I	96.3	Very high	92	Very high	15 Å²	15	48.8 Å²	48.8	8%	0.077	24%	0.242	C	C	.	.	H	α-helix	trans	-65.8	-44.7	175.5	-66.1	165.5	0	0	0	110.1	F343 A344 F347 M399 Q400 L406 A407 L428	F343-I403 HydrophobicContact CD1-CG2 4.25Å; F343-I403 HydrophobicContact CE1-CG2 4.35Å; A344-I403 HydrophobicContact CB-CG2 3.77Å; F347-I403 HydrophobicContact CD1-CD1 3.84Å; F347-I403 HydrophobicContact CD2-CD1 3.96Å; F347-I403 HydrophobicContact CE1-CD1 3.82Å; F347-I403 HydrophobicContact CE2-CD1 3.93Å; F347-I403 HydrophobicContact CG-CD1 3.92Å; F347-I403 HydrophobicContact CZ-CD1 3.86Å; M399-I403 HydrophobicContact CB-CD1 4.39Å; M399-I403 WeakPolarHBondContact O-CG1 3.48Å; M399-I403 PolarHBondContact O-N 3.32Å; Q400-I403 PolarHBondContact O-N 3.39Å; I403-L406 PolarHBondContact O-N 3.3Å; I403-A407 PolarHBondContact O-N 3.27Å; I403-A407 VanDerWaalsContact O-N 3.09Å; I403-L428 HydrophobicContact CG1-CD1 4.12Å; I403-L428 HydrophobicContact CG1-CD2 4.12Å
404	N	94.7	Very high	90.5	Very high	51 Å²	51	56.2 Å²	56.2	27%	0.273	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-45.8	173.5	-76.3	-22.2	0	0	0	111.7	A344 S348 Q400 L406 A407 L408	A344-N404 WeakPolarHBondContact CB-OD1 3.45Å; A344-N404 PolarHBondContact O-OD1 3.12Å; S348-N404 PolarHBondContact OG-ND2 3.29Å; S348-N404 PolarHBondContact OG-OD1 2.91Å; Q400-N404 VanDerWaalsContact O-CB 3.32Å; Q400-N404 WeakPolarHBondContact O-CB 3.47Å; Q400-N404 VanDerWaalsContact O-CG 3.31Å; Q400-N404 PolarHBondContact O-N 2.92Å; Q400-N404 PolarHBondContact O-ND2 3.44Å; N404-L406 VanDerWaalsContact C-N 3.33Å; N404-L406 PolarHBondContact O-N 2.93Å; N404-A407 PolarHBondContact O-N 3.14Å; N404-A407 VanDerWaalsContact O-N 3.1Å; N404-L408 PolarHBondContact O-N 3.21Å
405	L	93.7	Very high	89.2	Confident	67 Å²	67	54.4 Å²	54.4	35%	0.351	28%	0.275	S	S	.	.	H	α-helix	trans	-56.8	-44.2	175.6	-79	168.7	0	0	0	112.1	N401 Y402 A407 L408 M416 V424	N401-L405 WeakPolarHBondContact O-CB 3.43Å; N401-L405 VanDerWaalsContact O-CG 3.24Å; N401-L405 WeakPolarHBondContact O-CG 3.43Å; N401-L405 PolarHBondContact O-N 3.47Å; Y402-L405 HydrophobicContact CD1-CD1 4.13Å; Y402-L405 PolarHBondContact O-N 2.89Å; L405-A407 VanDerWaalsContact C-N 3.28Å; L405-A407 PolarHBondContact O-N 3.25Å; L405-L408 HydrophobicContact CD2-CD1 4.13Å; L405-L408 PolarHBondContact O-N 3.48Å; L405-M416 HydrophobicContact CB-CE 3.78Å; L405-M416 WeakPolarHBondContact O-CE 3.46Å; L405-V424 HydrophobicContact CB-CG1 4.26Å
406	L	92.8	Very high	88.2	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-68.7	-22.6	177.6	-69.5	169.9	0	0	0	113.6	L334 L340 Y402 I403 N404 P409 T421 V424 F425 L428	L334-L406 HydrophobicContact CD1-CD2 3.83Å; L340-L406 HydrophobicContact CD2-CB 4.39Å; Y402-L406 VanDerWaalsContact O-CG 3.31Å; Y402-L406 WeakPolarHBondContact O-CG 3.4Å; Y402-L406 PolarHBondContact O-N 3.08Å; I403-L406 PolarHBondContact O-N 3.3Å; N404-L406 VanDerWaalsContact C-N 3.33Å; N404-L406 PolarHBondContact O-N 2.93Å; L406-P409 WeakPolarHBondContact O-CD 3.31Å; L406-T421 HydrophobicContact CD2-CG2 4.46Å; L406-V424 HydrophobicContact CD1-CG1 4.25Å; L406-V424 HydrophobicContact CD2-CB 4.32Å; L406-V424 HydrophobicContact CD2-CG1 3.78Å; L406-V424 HydrophobicContact CG-CG1 3.69Å; L406-F425 HydrophobicContact CD1-CD1 3.76Å; L406-F425 HydrophobicContact CD1-CE1 3.61Å; L406-F425 HydrophobicContact CD1-CG 4.5Å; L406-F425 HydrophobicContact CD1-CZ 4.25Å; L406-F425 HydrophobicContact CD2-CD1 4.16Å; L406-F425 HydrophobicContact CD2-CD2 4.07Å; L406-F425 HydrophobicContact CD2-CE1 3.92Å; L406-F425 HydrophobicContact CD2-CE2 3.82Å; L406-F425 HydrophobicContact CD2-CG 4.23Å; L406-F425 HydrophobicContact CD2-CZ 3.75Å; L406-F425 HydrophobicContact CG-CE1 4.4Å; L406-L428 HydrophobicContact CD1-CD2 3.67Å
407	A	92.9	Very high	87	Confident	5 Å²	5	58.4 Å²	58.4	4%	0.041	30%	0.301	C	S	.	.	H	α-helix	trans	-81.1	-26.3	175.8	0	0	0	0	0	113.8	L340 R341 A344 I403 N404 L405 P409 S410	L340-A407 HydrophobicContact CG-CB 4.28Å; R341-A407 HydrophobicContact CB-CB 4.38Å; A344-A407 HydrophobicContact CB-CB 3.86Å; I403-A407 PolarHBondContact O-N 3.27Å; I403-A407 VanDerWaalsContact O-N 3.09Å; N404-A407 PolarHBondContact O-N 3.14Å; N404-A407 VanDerWaalsContact O-N 3.1Å; L405-A407 VanDerWaalsContact C-N 3.28Å; L405-A407 PolarHBondContact O-N 3.25Å; A407-P409 VanDerWaalsContact C-CD 3.43Å; A407-S410 PolarHBondContact O-N 3.07Å; A407-S410 PolarHBondContact O-OG 2.89Å
408	L	90.3	Very high	85.8	Confident	73 Å²	73	59 Å²	59	38%	0.382	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-54.2	-40.1	-176.4	-72.7	175.3	0	0	0	115.8	N404 L405 S410 V411 R412 A415	N404-L408 PolarHBondContact O-N 3.21Å; L405-L408 HydrophobicContact CD2-CD1 4.13Å; L405-L408 PolarHBondContact O-N 3.48Å; L408-S410 PolarHBondContact O-N 3.08Å; L408-S410 VanDerWaalsContact O-N 3.14Å; L408-V411 PolarHBondContact O-N 3.46Å; L408-R412 PolarHBondContact O-N 3.39Å; L408-A415 HydrophobicContact CB-CB 3.93Å; L408-A415 HydrophobicContact CD1-CB 4.47Å
409	P	87.1	Confident	84.8	Confident	9 Å²	9	60.6 Å²	60.6	6%	0.058	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-58.5	-28.5	-178.1	-26.5	36.6	0	0	0	113.9	L334 E335 L406 A407 V411 R412 M416	L334-P409 HydrophobicContact CB-CB 3.92Å; L334-P409 HydrophobicContact CB-CG 4Å; L334-P409 HydrophobicContact CD1-CG 4.39Å; E335-P409 HydrophobicContact CG-CB 4.14Å; L406-P409 WeakPolarHBondContact O-CD 3.31Å; A407-P409 VanDerWaalsContact C-CD 3.43Å; P409-V411 PolarHBondContact O-N 3.17Å; P409-R412 WeakPolarHBondContact CA-O 3.39Å; P409-M416 HydrophobicContact CG-CB 4.41Å
410	S	84.6	Confident	84.2	Confident	20 Å²	20	62 Å²	62	14%	0.14	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-68.3	-12.5	176	73	0	0	0	0	114.6	L334 A407 L408	L334-S410 WeakPolarHBondContact O-CB 3.42Å; L334-S410 PolarHBondContact O-N 2.83Å; A407-S410 PolarHBondContact O-N 3.07Å; A407-S410 PolarHBondContact O-OG 2.89Å; L408-S410 PolarHBondContact O-N 3.08Å; L408-S410 VanDerWaalsContact O-N 3.14Å
411	V	80.6	Confident	83.7	Confident	85 Å²	85	62 Å²	62	52%	0.515	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-32.6	179.2	-171.6	0	0	0	0	111.5	L408 P409	L408-V411 PolarHBondContact O-N 3.46Å; P409-V411 PolarHBondContact O-N 3.17Å
412	R	79.4	Confident	83.4	Confident	188 Å²	188	60.1 Å²	60.1	71%	0.709	33%	0.33	S	S	*	.			trans	-145.1	107.8	-179.1	-75.1	-178.5	175.7	174.8	-2	109.7	L408 P409 D414 A415	L408-R412 PolarHBondContact O-N 3.39Å; P409-R412 WeakPolarHBondContact CA-O 3.39Å; R412-D414 VanDerWaalsContact C-N 3.31Å; R412-D414 PolarHBondContact O-N 3.06Å; R412-A415 HydrophobicContact CB-CB 3.81Å; R412-A415 WeakPolarHBondContact O-CB 3.44Å; R412-A415 PolarHBondContact O-N 3.4Å
413	Q	65.8	Low	83.2	Confident	82 Å²	82	60.6 Å²	60.6	38%	0.383	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-56	-43.3	-176.2	-67.5	165.7	32.5	0	0	112.1	A415 N510	Q413-A415 VanDerWaalsContact C-N 3.28Å; Q413-A415 PolarHBondContact O-N 3.05Å; Q413-N510 PolarHBondContact OE1-ND2 3.23Å
414	D	66.6	Low	83.2	Confident	161 Å²	161	60.7 Å²	60.7	86%	0.861	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-80	4.4	180	-54.8	-64.5	0	0	0	115.1	R412 M416	R412-D414 VanDerWaalsContact C-N 3.31Å; R412-D414 PolarHBondContact O-N 3.06Å; D414-M416 VanDerWaalsContact C-N 3.27Å; D414-M416 PolarHBondContact O-N 3.32Å
415	A	70.6	Confident	83.2	Confident	44 Å²	44	59.1 Å²	59.1	36%	0.364	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-71.3	-17.6	-174	0	0	0	0	0	114.6	L408 R412 Q413	L408-A415 HydrophobicContact CB-CB 3.93Å; L408-A415 HydrophobicContact CD1-CB 4.47Å; R412-A415 HydrophobicContact CB-CB 3.81Å; R412-A415 WeakPolarHBondContact O-CB 3.44Å; R412-A415 PolarHBondContact O-N 3.4Å; Q413-A415 VanDerWaalsContact C-N 3.28Å; Q413-A415 PolarHBondContact O-N 3.05Å
416	M	76	Confident	83.3	Confident	20 Å²	20	59.1 Å²	59.1	10%	0.099	34%	0.34	C	S	.	.	S	Bend	trans	-142.3	120.5	177.5	-177.2	-175.6	-66	0	0	110.4	L405 P409 D414 Q418 S420 T421 V424	L405-M416 HydrophobicContact CB-CE 3.78Å; L405-M416 WeakPolarHBondContact O-CE 3.46Å; P409-M416 HydrophobicContact CG-CB 4.41Å; D414-M416 VanDerWaalsContact C-N 3.27Å; D414-M416 PolarHBondContact O-N 3.32Å; M416-Q418 PolarHBondContact O-N 2.92Å; M416-S420 WeakPolarHBondContact CG-OG 3.49Å; M416-T421 HydrophobicContact SD-CG2 4.27Å; M416-T421 PolarHBondContact SD-OG1 2.99Å; M416-T421 VanDerWaalsContact SD-OG1 3.36Å; M416-V424 HydrophobicContact CE-CB 4.47Å; M416-V424 HydrophobicContact CE-CG1 4.38Å; M416-V424 HydrophobicContact CE-CG2 3.99Å; M416-V424 HydrophobicContact SD-CG2 4.28Å
417	P	73.9	Confident	83.5	Confident	85 Å²	85	62 Å²	62	55%	0.552	35%	0.353	S	S	*	.			trans	-61.2	130.3	169.7	-22.6	33.9	0	0	0	110.7	S419 S420	P417-S419 PolarHBondContact O-N 3.27Å; P417-S420 WeakPolarHBondContact O-CA 3.17Å; P417-S420 WeakPolarHBondContact O-CB 3.46Å; P417-S420 PolarHBondContact O-N 2.97Å; P417-S420 PolarHBondContact O-OG 3.3Å
418	Q	71.6	Confident	83.8	Confident	74 Å²	74	62.2 Å²	62.2	35%	0.346	35%	0.354	S	S	.	.	H	α-helix	trans	-58	-25.5	-176.1	-162.7	174.4	11.6	0	0	113.6	M416 S420 T421 A506 V507 S508	M416-Q418 PolarHBondContact O-N 2.92Å; Q418-S420 VanDerWaalsContact C-N 3.26Å; Q418-S420 PolarHBondContact O-N 3.03Å; Q418-T421 PolarHBondContact O-N 2.82Å; Q418-T421 PolarHBondContact O-OG1 3.06Å; Q418-A506 PolarHBondContact OE1-O 3.26Å; Q418-V507 VanDerWaalsContact OE1-C 3.32Å; Q418-S508 VanDerWaalsContact OE1-N 3.16Å
419	S	75.9	Confident	84.1	Confident	108 Å²	108	58.9 Å²	58.9	76%	0.755	34%	0.337	S	S	*	.	H	α-helix	trans	-64.5	-24.8	171.5	53.1	0	0	0	0	114.2	P417	P417-S419 PolarHBondContact O-N 3.27Å
420	S	84.8	Confident	84.6	Confident	39 Å²	39	60.6 Å²	60.6	27%	0.273	35%	0.352	S	S	.	.	H	α-helix	trans	-90.7	-22.6	178.3	70.2	0	0	0	0	113.4	M416 P417 Q418 S422 A423 V424	M416-S420 WeakPolarHBondContact CG-OG 3.49Å; P417-S420 WeakPolarHBondContact O-CA 3.17Å; P417-S420 WeakPolarHBondContact O-CB 3.46Å; P417-S420 PolarHBondContact O-N 2.97Å; P417-S420 PolarHBondContact O-OG 3.3Å; Q418-S420 VanDerWaalsContact C-N 3.26Å; Q418-S420 PolarHBondContact O-N 3.03Å; S420-S422 VanDerWaalsContact C-N 3.27Å; S420-S422 PolarHBondContact O-N 3.33Å; S420-A423 WeakPolarHBondContact O-CA 3.5Å; S420-A423 WeakPolarHBondContact O-CB 3.44Å; S420-A423 PolarHBondContact O-N 2.99Å; S420-V424 PolarHBondContact O-N 3.38Å
421	T	87.1	Confident	85.3	Confident	23 Å²	23	59.7 Å²	59.7	14%	0.141	35%	0.345	C	S	.	.	H	α-helix	trans	-54.6	-41.4	-179.2	-50.7	0	0	0	0	112.5	L334 L406 M416 Q418 A423 V424 F425	L334-T421 HydrophobicContact CD1-CG2 3.58Å; L406-T421 HydrophobicContact CD2-CG2 4.46Å; M416-T421 HydrophobicContact SD-CG2 4.27Å; M416-T421 PolarHBondContact SD-OG1 2.99Å; M416-T421 VanDerWaalsContact SD-OG1 3.36Å; Q418-T421 PolarHBondContact O-N 2.82Å; Q418-T421 PolarHBondContact O-OG1 3.06Å; T421-A423 PolarHBondContact O-N 3.21Å; T421-V424 PolarHBondContact O-N 3.04Å; T421-F425 HydrophobicContact CG2-CD2 3.9Å; T421-F425 HydrophobicContact CG2-CE2 3.75Å; T421-F425 WeakPolarHBondContact O-CD2 3.4Å; T421-F425 PolarHBondContact O-N 2.75Å
422	S	90.2	Very high	86.1	Confident	53 Å²	53	56.3 Å²	56.3	37%	0.371	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-39.8	176.4	-178.8	0	0	0	0	113	S420 T426 T496	S420-S422 VanDerWaalsContact C-N 3.27Å; S420-S422 PolarHBondContact O-N 3.33Å; S422-T426 WeakPolarHBondContact O-CB 3.23Å; S422-T426 PolarHBondContact O-N 3.32Å; S422-T426 PolarHBondContact O-OG1 3.1Å; S422-T496 WeakPolarHBondContact OG-CG2 3.33Å
423	A	93.2	Very high	87	Confident	62 Å²	62	50.3 Å²	50.3	51%	0.512	30%	0.304	S	S	.	.	H	α-helix	trans	-68	-38.7	175.7	0	0	0	0	0	112	S420 T421 T426 Q427	S420-A423 WeakPolarHBondContact O-CA 3.5Å; S420-A423 WeakPolarHBondContact O-CB 3.44Å; S420-A423 PolarHBondContact O-N 2.99Å; T421-A423 PolarHBondContact O-N 3.21Å; A423-T426 PolarHBondContact O-N 2.85Å; A423-Q427 VanDerWaalsContact O-CB 3.29Å; A423-Q427 WeakPolarHBondContact O-CB 3.38Å; A423-Q427 PolarHBondContact O-N 2.68Å
424	V	95.1	Very high	88.6	Confident	17 Å²	17	48.6 Å²	48.6	10%	0.103	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-46.2	175.8	177	0	0	0	0	111.1	Y402 L405 L406 M416 S420 T421 T426 Q427 L428	Y402-V424 HydrophobicContact CD1-CG1 4.2Å; L405-V424 HydrophobicContact CB-CG1 4.26Å; L406-V424 HydrophobicContact CD1-CG1 4.25Å; L406-V424 HydrophobicContact CD2-CB 4.32Å; L406-V424 HydrophobicContact CD2-CG1 3.78Å; L406-V424 HydrophobicContact CG-CG1 3.69Å; M416-V424 HydrophobicContact CE-CB 4.47Å; M416-V424 HydrophobicContact CE-CG1 4.38Å; M416-V424 HydrophobicContact CE-CG2 3.99Å; M416-V424 HydrophobicContact SD-CG2 4.28Å; S420-V424 PolarHBondContact O-N 3.38Å; T421-V424 PolarHBondContact O-N 3.04Å; V424-T426 PolarHBondContact O-N 3.44Å; V424-Q427 PolarHBondContact O-N 2.69Å; V424-L428 WeakPolarHBondContact O-CB 3.29Å; V424-L428 PolarHBondContact O-N 3.26Å
425	F	95.6	Very high	90.1	Very high	18 Å²	18	41.1 Å²	41.1	8%	0.079	26%	0.261	C	S	.	.	H	α-helix	trans	-60.8	-44.3	174.2	-83.9	-60	0	0	0	112.6	L334 L406 T421 Q427 L428 A429 F488 L492 F495 T496	L334-F425 HydrophobicContact CD1-CE2 4.21Å; L334-F425 HydrophobicContact CD1-CZ 4.39Å; L334-F425 HydrophobicContact CD2-CZ 4.13Å; L406-F425 HydrophobicContact CD1-CD1 3.76Å; L406-F425 HydrophobicContact CD1-CE1 3.61Å; L406-F425 HydrophobicContact CD1-CG 4.5Å; L406-F425 HydrophobicContact CD1-CZ 4.25Å; L406-F425 HydrophobicContact CD2-CD1 4.16Å; L406-F425 HydrophobicContact CD2-CD2 4.07Å; L406-F425 HydrophobicContact CD2-CE1 3.92Å; L406-F425 HydrophobicContact CD2-CE2 3.82Å; L406-F425 HydrophobicContact CD2-CG 4.23Å; L406-F425 HydrophobicContact CD2-CZ 3.75Å; L406-F425 HydrophobicContact CG-CE1 4.4Å; T421-F425 HydrophobicContact CG2-CD2 3.9Å; T421-F425 HydrophobicContact CG2-CE2 3.75Å; T421-F425 WeakPolarHBondContact O-CD2 3.4Å; T421-F425 PolarHBondContact O-N 2.75Å; F425-Q427 VanDerWaalsContact C-N 3.32Å; F425-Q427 PolarHBondContact O-N 2.92Å; F425-L428 PolarHBondContact O-N 3.44Å; F425-A429 PolarHBondContact O-N 2.99Å; F425-F488 HydrophobicContact CD1-CE1 4.35Å; F425-F488 AromaticContact CD1-CZ 3.93Å; F425-F488 HydrophobicContact CD1-CZ 3.93Å; F425-F488 HydrophobicContact CE1-CZ 4.42Å; F425-L492 HydrophobicContact CB-CD1 3.87Å; F425-F495 HydrophobicContact CD1-CB 3.77Å; F425-F495 HydrophobicContact CD1-CG 4.31Å; F425-F495 HydrophobicContact CD2-CB 4.07Å; F425-F495 WeakPolarHBondContact CD2-O 3.39Å; F425-F495 HydrophobicContact CE1-CB 3.77Å; F425-F495 HydrophobicContact CE1-CD1 4.43Å; F425-F495 HydrophobicContact CE1-CG 4.14Å; F425-F495 HydrophobicContact CE2-CB 4.07Å; F425-F495 WeakPolarHBondContact CE2-O 3.37Å; F425-F495 HydrophobicContact CG-CB 3.92Å; F425-F495 HydrophobicContact CZ-CB 3.92Å; F425-T496 HydrophobicContact CB-CG2 3.87Å; F425-T496 HydrophobicContact CD2-CG2 4.39Å; F425-T496 HydrophobicContact CG-CG2 4.49Å
426	T	96.2	Very high	91.4	Very high	67 Å²	67	40.7 Å²	40.7	41%	0.411	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-41.4	177.3	-56.9	0	0	0	0	111.5	S422 A423 V424 A429 A430 L492	S422-T426 WeakPolarHBondContact O-CB 3.23Å; S422-T426 PolarHBondContact O-N 3.32Å; S422-T426 PolarHBondContact O-OG1 3.1Å; A423-T426 PolarHBondContact O-N 2.85Å; V424-T426 PolarHBondContact O-N 3.44Å; T426-A429 WeakPolarHBondContact O-CB 3.4Å; T426-A429 PolarHBondContact O-N 2.91Å; T426-A430 PolarHBondContact O-N 2.91Å; T426-L492 HydrophobicContact CG2-CD2 4.46Å
427	Q	96.8	Very high	92.5	Very high	68 Å²	68	43.5 Å²	43.5	32%	0.318	27%	0.267	S	S	.	.	H	α-helix	trans	-76.7	-28.1	-179.3	-172.7	56.7	85.8	0	0	112.9	Y402 A423 V424 F425 S431	Y402-Q427 HydrophobicContact CD2-CG 4.34Å; Y402-Q427 HydrophobicContact CE1-CB 4.34Å; Y402-Q427 HydrophobicContact CE1-CG 3.81Å; Y402-Q427 HydrophobicContact CE2-CB 4.44Å; Y402-Q427 HydrophobicContact CE2-CG 3.57Å; Y402-Q427 VanDerWaalsContact OH-CG 3.28Å; Y402-Q427 WeakPolarHBondContact OH-CG 3.48Å; A423-Q427 VanDerWaalsContact O-CB 3.29Å; A423-Q427 WeakPolarHBondContact O-CB 3.38Å; A423-Q427 PolarHBondContact O-N 2.68Å; V424-Q427 PolarHBondContact O-N 2.69Å; F425-Q427 VanDerWaalsContact C-N 3.32Å; F425-Q427 PolarHBondContact O-N 2.92Å; Q427-S431 WeakPolarHBondContact O-CB 3.45Å; Q427-S431 PolarHBondContact O-N 2.98Å; Q427-S431 PolarHBondContact O-OG 3.27Å
428	L	97.8	Very high	93.7	Very high	10 Å²	10	39.4 Å²	39.4	5%	0.052	24%	0.241	C	C	.	.	H	α-helix	trans	-65.6	-44.8	166.6	178.5	54	0	0	0	110.9	M399 I403 L406 V424 F425 A430 S431 L432 F488	M399-L428 HydrophobicContact CB-CD1 4.37Å; M399-L428 HydrophobicContact CG-CD1 4.16Å; I403-L428 HydrophobicContact CG1-CD1 4.12Å; I403-L428 HydrophobicContact CG1-CD2 4.12Å; L406-L428 HydrophobicContact CD1-CD2 3.67Å; V424-L428 WeakPolarHBondContact O-CB 3.29Å; V424-L428 PolarHBondContact O-N 3.26Å; F425-L428 PolarHBondContact O-N 3.44Å; L428-A430 PolarHBondContact O-N 3.33Å; L428-S431 CarbonylContact O-C 3.6Å; L428-S431 WeakPolarHBondContact O-CA 3.49Å; L428-S431 WeakPolarHBondContact O-CB 3.2Å; L428-S431 PolarHBondContact O-N 3.02Å; L428-L432 HydrophobicContact CG-CD1 4.48Å; L428-L432 PolarHBondContact O-N 3.37Å; L428-F488 HydrophobicContact CD2-CE2 4.24Å; L428-F488 HydrophobicContact CD2-CZ 3.76Å; L428-F488 HydrophobicContact CG-CE1 4.34Å; L428-F488 HydrophobicContact CG-CZ 4.01Å
429	A	97.8	Very high	94.9	Very high	4 Å²	4	36 Å²	36	3%	0.033	22%	0.224	C	C	.	.	H	α-helix	trans	-56.6	-47.9	174.7	0	0	0	0	0	111.9	F425 T426 S431 L432 H433 F488	F425-A429 PolarHBondContact O-N 2.99Å; T426-A429 WeakPolarHBondContact O-CB 3.4Å; T426-A429 PolarHBondContact O-N 2.91Å; A429-S431 VanDerWaalsContact C-N 3.26Å; A429-S431 PolarHBondContact O-N 3.42Å; A429-L432 WeakPolarHBondContact O-CB 3.4Å; A429-L432 PolarHBondContact O-N 3.18Å; A429-H433 PolarHBondContact O-CD2 3.18Å; A429-H433 VanDerWaalsContact O-CD2 3.27Å; A429-H433 PolarHBondContact O-N 3.29Å; A429-H433 VanDerWaalsContact O-N 3.14Å; A429-F488 HydrophobicContact CB-CD1 3.66Å; A429-F488 HydrophobicContact CB-CE1 4.04Å
430	A	97.8	Very high	96	Very high	45 Å²	45	35.6 Å²	35.6	37%	0.372	21%	0.209	S	C	.	.	H	α-helix	trans	-63.4	-29.5	175.4	0	0	0	0	0	113.3	T426 L428 S434	T426-A430 PolarHBondContact O-N 2.91Å; L428-A430 PolarHBondContact O-N 3.33Å; A430-S434 PolarHBondContact O-N 2.88Å; A430-S434 PolarHBondContact O-OG 3.26Å
431	S	98	Very high	96.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-74.8	-33.2	175.2	-52.8	0	0	0	0	112	V395 K398 Q427 L428 A429 S434 L435	V395-S431 VanDerWaalsContact CG1-O 3.32Å; V395-S431 WeakPolarHBondContact CG1-O 3.38Å; K398-S431 WeakPolarHBondContact CE-OG 3.32Å; Q427-S431 WeakPolarHBondContact O-CB 3.45Å; Q427-S431 PolarHBondContact O-N 2.98Å; Q427-S431 PolarHBondContact O-OG 3.27Å; L428-S431 CarbonylContact O-C 3.6Å; L428-S431 WeakPolarHBondContact O-CA 3.49Å; L428-S431 WeakPolarHBondContact O-CB 3.2Å; L428-S431 PolarHBondContact O-N 3.02Å; A429-S431 VanDerWaalsContact C-N 3.26Å; A429-S431 PolarHBondContact O-N 3.42Å; S431-S434 WeakPolarHBondContact O-CB 3.41Å; S431-S434 PolarHBondContact O-N 3.02Å; S431-L435 PolarHBondContact O-N 3.14Å
432	L	98.4	Very high	97.2	Very high	14 Å²	14	35.8 Å²	35.8	7%	0.073	20%	0.204	C	C	.	.	H	α-helix	trans	-65.4	-41.3	172.3	-74.4	165.8	0	0	0	112.5	M399 L428 A429 L435 H436 I484 A485 F488	M399-L432 HydrophobicContact CE-CD2 3.33Å; M399-L432 HydrophobicContact CE-CG 4.15Å; M399-L432 HydrophobicContact SD-CD2 3.96Å; M399-L432 HydrophobicContact SD-CG 4.44Å; L428-L432 HydrophobicContact CG-CD1 4.48Å; L428-L432 PolarHBondContact O-N 3.37Å; A429-L432 WeakPolarHBondContact O-CB 3.4Å; A429-L432 PolarHBondContact O-N 3.18Å; L432-L435 WeakPolarHBondContact O-CB 3.48Å; L432-L435 PolarHBondContact O-N 3.32Å; L432-H436 PolarHBondContact O-N 2.94Å; L432-H436 VanDerWaalsContact O-N 3.09Å; L432-I484 HydrophobicContact CD1-CG2 4.16Å; L432-I484 HydrophobicContact CD2-CG2 3.73Å; L432-A485 HydrophobicContact CB-CB 3.99Å; L432-F488 HydrophobicContact CD1-CB 3.73Å; L432-F488 HydrophobicContact CD1-CD1 4.03Å; L432-F488 HydrophobicContact CD1-CD2 3.71Å; L432-F488 HydrophobicContact CD1-CE2 4.29Å; L432-F488 HydrophobicContact CD1-CG 3.55Å
433	H	98.4	Very high	97.6	Very high	63 Å²	63	33.9 Å²	33.9	29%	0.292	19%	0.191	S	C	.	.	H	α-helix	trans	-63.8	-42.5	170.6	-73.9	-74.5	0	0	0	111.4	A429 L435 H436 D437 A485 S489	A429-H433 PolarHBondContact O-CD2 3.18Å; A429-H433 VanDerWaalsContact O-CD2 3.27Å; A429-H433 PolarHBondContact O-N 3.29Å; A429-H433 VanDerWaalsContact O-N 3.14Å; H433-L435 PolarHBondContact O-N 3.35Å; H433-H436 PolarHBondContact O-N 2.87Å; H433-D437 PolarHBondContact O-N 3.12Å; H433-A485 PolarHBondContact NE2-O 3.22Å; H433-S489 PolarHBondContact NE2-OG 2.87Å
434	S	98.3	Very high	97.8	Very high	45 Å²	45	34.9 Å²	34.9	32%	0.315	18%	0.184	S	C	.	.	H	α-helix	trans	-58.3	-33	174.3	-55.4	0	0	0	0	112.7	A430 S431 A438	A430-S434 PolarHBondContact O-N 2.88Å; A430-S434 PolarHBondContact O-OG 3.26Å; S431-S434 WeakPolarHBondContact O-CB 3.41Å; S431-S434 PolarHBondContact O-N 3.02Å; S434-A438 VanDerWaalsContact O-CB 3.32Å; S434-A438 WeakPolarHBondContact O-CB 3.5Å; S434-A438 PolarHBondContact O-N 3.06Å; S434-A438 VanDerWaalsContact O-N 3.07Å
435	L	98.5	Very high	97.9	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-71.3	-46.2	177.5	-177.6	59.6	0	0	0	111.1	V392 V395 F396 M399 S431 L432 H433 A438 I439 T481	V392-L435 HydrophobicContact CG1-CD1 4.24Å; V395-L435 HydrophobicContact CB-CD1 4.39Å; V395-L435 HydrophobicContact CG1-CB 3.65Å; V395-L435 HydrophobicContact CG1-CD1 4.14Å; V395-L435 HydrophobicContact CG1-CG 4.45Å; F396-L435 HydrophobicContact CD2-CD1 3.97Å; F396-L435 HydrophobicContact CE1-CD2 4.4Å; F396-L435 HydrophobicContact CE2-CD1 3.63Å; F396-L435 HydrophobicContact CE2-CD2 4.36Å; F396-L435 HydrophobicContact CZ-CD1 4.16Å; F396-L435 HydrophobicContact CZ-CD2 4.05Å; M399-L435 HydrophobicContact CE-CD2 4.14Å; M399-L435 HydrophobicContact SD-CB 4.07Å; M399-L435 HydrophobicContact SD-CD2 3.65Å; M399-L435 HydrophobicContact SD-CG 4.4Å; S431-L435 PolarHBondContact O-N 3.14Å; L432-L435 WeakPolarHBondContact O-CB 3.48Å; L432-L435 PolarHBondContact O-N 3.32Å; H433-L435 PolarHBondContact O-N 3.35Å; L435-A438 PolarHBondContact O-N 3.15Å; L435-I439 HydrophobicContact CD1-CD1 3.59Å; L435-I439 HydrophobicContact CD1-CG1 4.33Å; L435-I439 HydrophobicContact CG-CD1 3.82Å; L435-I439 WeakPolarHBondContact O-CB 3.32Å; L435-I439 PolarHBondContact O-N 2.88Å; L435-T481 HydrophobicContact CD2-CG2 4.16Å; L435-T481 HydrophobicContact CG-CG2 4.24Å
436	H	98.6	Very high	98	Very high	35 Å²	35	34.9 Å²	34.9	16%	0.162	18%	0.182	C	C	.	.	H	α-helix	trans	-57.7	-49.7	174.5	175.2	65.5	0	0	0	111.4	L432 H433 A438 I439 K440 T478 T481 G482	L432-H436 PolarHBondContact O-N 2.94Å; L432-H436 VanDerWaalsContact O-N 3.09Å; H433-H436 PolarHBondContact O-N 2.87Å; H436-A438 VanDerWaalsContact C-N 3.32Å; H436-A438 PolarHBondContact O-N 3.46Å; H436-I439 PolarHBondContact O-N 3.43Å; H436-K440 WeakPolarHBondContact O-CB 3.38Å; H436-K440 PolarHBondContact O-N 2.89Å; H436-T478 PolarHBondContact CE1-O 2.96Å; H436-T478 PolarHBondContact ND1-O 3.49Å; H436-T481 PolarHBondContact ND1-OG1 3.05Å; H436-G482 WeakPolarHBondContact ND1-CA 3.2Å; H436-G482 PolarHBondContact ND1-N 2.94Å
437	D	98.5	Very high	98	Very high	79 Å²	79	35 Å²	35	42%	0.422	18%	0.181	S	C	.	.	H	α-helix	trans	-64.9	-34.1	-179.7	-73.3	-29.2	0	0	0	112.9	H433 E441	H433-D437 PolarHBondContact O-N 3.12Å; D437-E441 WeakPolarHBondContact O-CG 3.42Å; D437-E441 PolarHBondContact O-N 3.39Å
438	A	98.5	Very high	98.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.9	-48	173.8	0	0	0	0	0	111.8	K391 V392 S434 L435 H436 K440 M442	K391-A438 HydrophobicContact CD-CB 3.9Å; K391-A438 HydrophobicContact CG-CB 3.94Å; V392-A438 HydrophobicContact CG2-CB 3.65Å; S434-A438 VanDerWaalsContact O-CB 3.32Å; S434-A438 WeakPolarHBondContact O-CB 3.5Å; S434-A438 PolarHBondContact O-N 3.06Å; S434-A438 VanDerWaalsContact O-N 3.07Å; L435-A438 PolarHBondContact O-N 3.15Å; H436-A438 VanDerWaalsContact C-N 3.32Å; H436-A438 PolarHBondContact O-N 3.46Å; A438-K440 PolarHBondContact O-N 2.73Å; A438-M442 VanDerWaalsContact O-CB 3.31Å; A438-M442 WeakPolarHBondContact O-CB 3.45Å; A438-M442 PolarHBondContact O-N 3.09Å
439	I	98.4	Very high	98	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-69.2	-33.3	-179.7	-73.8	163.7	0	0	0	112.1	V392 L435 H436 M442 S443 L477 T481	V392-I439 HydrophobicContact CG1-CD1 4.44Å; V392-I439 HydrophobicContact CG1-CG1 4.18Å; V392-I439 HydrophobicContact CG2-CG1 3.84Å; L435-I439 HydrophobicContact CD1-CD1 3.59Å; L435-I439 HydrophobicContact CD1-CG1 4.33Å; L435-I439 HydrophobicContact CG-CD1 3.82Å; L435-I439 WeakPolarHBondContact O-CB 3.32Å; L435-I439 PolarHBondContact O-N 2.88Å; H436-I439 PolarHBondContact O-N 3.43Å; I439-M442 HydrophobicContact CG1-CE 4.17Å; I439-M442 WeakPolarHBondContact O-CB 3.43Å; I439-M442 PolarHBondContact O-N 3.23Å; I439-S443 VanDerWaalsContact O-CB 3.25Å; I439-S443 WeakPolarHBondContact O-CB 3.25Å; I439-S443 PolarHBondContact O-N 3.32Å; I439-L477 HydrophobicContact CD1-CD2 3.89Å; I439-L477 HydrophobicContact CD1-CG 4.03Å; I439-L477 HydrophobicContact CG1-CD2 4.24Å; I439-L477 HydrophobicContact CG2-CB 4.2Å; I439-L477 HydrophobicContact CG2-CD2 3.9Å; I439-L477 HydrophobicContact CG2-CG 3.89Å; I439-T481 HydrophobicContact CD1-CG2 3.86Å
440	K	98.3	Very high	97.8	Very high	101 Å²	101	35.2 Å²	35.2	44%	0.439	18%	0.181	S	C	.	.	H	α-helix	trans	-66.1	-45.2	176.7	179.7	179	174.5	-175.8	0	112.4	H436 A438 S443 K444 T478	H436-K440 WeakPolarHBondContact O-CB 3.38Å; H436-K440 PolarHBondContact O-N 2.89Å; A438-K440 PolarHBondContact O-N 2.73Å; K440-S443 PolarHBondContact O-N 3.31Å; K440-K444 WeakPolarHBondContact O-CB 3.35Å; K440-K444 PolarHBondContact O-N 3.47Å; K440-T478 HydrophobicContact CB-CG2 3.9Å; K440-T478 HydrophobicContact CG-CG2 4.14Å
441	E	98.2	Very high	97.7	Very high	64 Å²	64	36.2 Å²	36.2	30%	0.299	19%	0.186	S	C	.	.	H	α-helix	trans	-67.8	-42.2	174.5	-72.8	-71.9	113.7	0	0	111	D437 S443 K444 H445	D437-E441 WeakPolarHBondContact O-CG 3.42Å; D437-E441 PolarHBondContact O-N 3.39Å; E441-S443 VanDerWaalsContact C-N 3.34Å; E441-S443 PolarHBondContact O-N 3.39Å; E441-K444 WeakPolarHBondContact O-CB 3.39Å; E441-K444 PolarHBondContact O-N 2.91Å; E441-K444 VanDerWaalsContact O-N 3.16Å; E441-K444 VanDerWaalsContact OE1-CD 3.23Å; E441-K444 WeakPolarHBondContact OE1-CD 3.33Å; E441-K444 IonicContact OE1-NZ 2.68Å; E441-K444 PolarHBondContact OE1-NZ 3.07Å; E441-K444 IonicContact OE2-NZ 2.98Å; E441-K444 PolarHBondContact OE2-NZ 2.88Å; E441-H445 PolarHBondContact O-N 3.06Å; E441-H445 PolarHBondContact O-ND1 2.66Å; E441-H445 IonicContact OE2-CE1 3.9Å; E441-H445 IonicContact OE2-NE2 2.83Å
442	M	98.1	Very high	97.5	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-54.9	-47.2	172.2	-167.1	171.8	75.7	0	0	112.2	L385 D388 M389 V392 A438 I439 H445 Y446 L474	L385-M442 HydrophobicContact CD2-CG 4.08Å; L385-M442 WeakPolarHBondContact CD2-O 3.37Å; D388-M442 HydrophobicContact CB-CB 3.79Å; D388-M442 HydrophobicContact CB-CG 3.83Å; D388-M442 HydrophobicContact CB-SD 4.41Å; D388-M442 WeakPolarHBondContact OD2-CA 3.45Å; M389-M442 HydrophobicContact CE-CE 4.37Å; M389-M442 HydrophobicContact CE-CG 3.9Å; M389-M442 HydrophobicContact CE-SD 3.48Å; M389-M442 WeakPolarHBondContact CE-SD 3.4Å; M389-M442 HydrophobicContact CG-SD 4.45Å; M389-M442 HydrophobicContact SD-CE 4.46Å; M389-M442 HydrophobicContact SD-CG 4.49Å; M389-M442 HydrophobicContact SD-SD 3.41Å; V392-M442 HydrophobicContact CG2-CE 4.24Å; V392-M442 HydrophobicContact CG2-SD 3.79Å; A438-M442 VanDerWaalsContact O-CB 3.31Å; A438-M442 WeakPolarHBondContact O-CB 3.45Å; A438-M442 PolarHBondContact O-N 3.09Å; I439-M442 HydrophobicContact CG1-CE 4.17Å; I439-M442 WeakPolarHBondContact O-CB 3.43Å; I439-M442 PolarHBondContact O-N 3.23Å; M442-H445 PolarHBondContact O-N 2.91Å; M442-Y446 WeakPolarHBondContact O-CB 3.46Å; M442-Y446 PolarHBondContact O-N 3.47Å; M442-L474 HydrophobicContact CE-CD2 3.66Å
443	S	98.2	Very high	97.1	Very high	13 Å²	13	37.4 Å²	37.4	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-45.1	176.3	-178.2	0	0	0	0	111.7	I439 K440 E441 Y446 N447	I439-S443 VanDerWaalsContact O-CB 3.25Å; I439-S443 WeakPolarHBondContact O-CB 3.25Å; I439-S443 PolarHBondContact O-N 3.32Å; K440-S443 PolarHBondContact O-N 3.31Å; E441-S443 VanDerWaalsContact C-N 3.34Å; E441-S443 PolarHBondContact O-N 3.39Å; S443-Y446 PolarHBondContact O-N 2.95Å; S443-N447 PolarHBondContact O-N 2.93Å; S443-N447 PolarHBondContact O-ND2 3.32Å
444	K	98	Very high	96.7	Very high	83 Å²	83	39.1 Å²	39.1	36%	0.361	20%	0.199	S	C	.	.	H	α-helix	trans	-60.8	-46.7	175.8	161.2	-165.7	163.2	-155.2	0	112.4	K440 E441 Y446 N447 Q448	K440-K444 WeakPolarHBondContact O-CB 3.35Å; K440-K444 PolarHBondContact O-N 3.47Å; E441-K444 WeakPolarHBondContact O-CB 3.39Å; E441-K444 PolarHBondContact O-N 2.91Å; E441-K444 VanDerWaalsContact O-N 3.16Å; E441-K444 VanDerWaalsContact OE1-CD 3.23Å; E441-K444 WeakPolarHBondContact OE1-CD 3.33Å; E441-K444 IonicContact OE1-NZ 2.68Å; E441-K444 PolarHBondContact OE1-NZ 3.07Å; E441-K444 IonicContact OE2-NZ 2.98Å; E441-K444 PolarHBondContact OE2-NZ 2.88Å; K444-Y446 VanDerWaalsContact C-N 3.34Å; K444-N447 PolarHBondContact O-N 3.48Å; K444-Q448 WeakPolarHBondContact O-CG 3.43Å; K444-Q448 PolarHBondContact O-N 3.32Å; K444-Q448 VanDerWaalsContact O-N 3.08Å
445	H	98.1	Very high	96.2	Very high	22 Å²	22	44.8 Å²	44.8	10%	0.102	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-33	177.7	-59.1	138.2	0	0	0	111.7	E384 L385 D388 E441 M442 Q448 K449	E384-H445 HydrophobicContact CB-CB 4.39Å; E384-H445 IonicContact OE2-CD2 2.6Å; E384-H445 PolarHBondContact OE2-CD2 2.79Å; E384-H445 IonicContact OE2-CG 2.57Å; E384-H445 IonicContact OE2-ND1 2.75Å; E384-H445 IonicContact OE2-NE2 3.09Å; L385-H445 HydrophobicContact CD2-CB 4.03Å; L385-H445 HydrophobicContact CG-CB 4.27Å; D388-H445 IonicContact OD2-CE1 3.34Å; D388-H445 IonicContact OD2-CG 3.33Å; D388-H445 IonicContact OD2-ND1 2.82Å; D388-H445 PolarHBondContact OD2-ND1 3.49Å; E441-H445 PolarHBondContact O-N 3.06Å; E441-H445 PolarHBondContact O-ND1 2.66Å; E441-H445 IonicContact OE2-CE1 3.9Å; E441-H445 IonicContact OE2-NE2 2.83Å; M442-H445 PolarHBondContact O-N 2.91Å; H445-Q448 PolarHBondContact O-N 3.06Å; H445-K449 WeakPolarHBondContact O-CB 3.4Å; H445-K449 PolarHBondContact O-N 3.34Å
446	Y	97.2	Very high	95.6	Very high	12 Å²	12	45.4 Å²	45.4	5%	0.047	22%	0.224	C	C	.	.	H	α-helix	trans	-68.3	-40.9	173.3	-144.1	-65	0	0	0	112.4	R281 L385 M442 S443 K444 Q448 K449 A450 T467 L470 L471 L474	R281-Y446 VanDerWaalsContact CD-OH 3.27Å; R281-Y446 WeakPolarHBondContact CD-OH 3.35Å; R281-Y446 PolarHBondContact NE-OH 3.29Å; L385-Y446 HydrophobicContact CD1-CD2 3.77Å; L385-Y446 HydrophobicContact CD1-CE2 4.18Å; L385-Y446 HydrophobicContact CD1-CG 4.25Å; L385-Y446 HydrophobicContact CD2-CD2 3.94Å; L385-Y446 HydrophobicContact CD2-CG 4.45Å; M442-Y446 WeakPolarHBondContact O-CB 3.46Å; M442-Y446 PolarHBondContact O-N 3.47Å; S443-Y446 PolarHBondContact O-N 2.95Å; K444-Y446 VanDerWaalsContact C-N 3.34Å; Y446-Q448 VanDerWaalsContact C-N 3.34Å; Y446-Q448 PolarHBondContact O-N 3.2Å; Y446-K449 WeakPolarHBondContact O-CB 3.32Å; Y446-K449 PolarHBondContact O-N 3Å; Y446-A450 WeakPolarHBondContact O-CB 3.28Å; Y446-A450 PolarHBondContact O-N 3.44Å; Y446-T467 HydrophobicContact CE1-CG2 4.46Å; Y446-L470 HydrophobicContact CD1-CD2 4.09Å; Y446-L470 HydrophobicContact CD2-CD2 4.18Å; Y446-L470 HydrophobicContact CE1-CD1 4.45Å; Y446-L470 HydrophobicContact CE1-CD2 3.81Å; Y446-L470 HydrophobicContact CE2-CD2 3.88Å; Y446-L470 HydrophobicContact CG-CD2 4.29Å; Y446-L471 HydrophobicContact CD1-CD2 3.74Å; Y446-L471 HydrophobicContact CG-CD2 4.27Å; Y446-L474 HydrophobicContact CD2-CD1 3.95Å; Y446-L474 HydrophobicContact CG-CD1 3.8Å
447	N	97.1	Very high	94.8	Very high	71 Å²	71	49.3 Å²	49.3	38%	0.38	25%	0.253	S	S	.	.	H	α-helix	trans	-59.5	-45.5	172.9	-84.1	-87.9	0	0	0	110.9	S443 K444 K449 A450 S451 L471	S443-N447 PolarHBondContact O-N 2.93Å; S443-N447 PolarHBondContact O-ND2 3.32Å; K444-N447 PolarHBondContact O-N 3.48Å; N447-K449 PolarHBondContact O-N 3.36Å; N447-A450 PolarHBondContact O-N 2.97Å; N447-S451 PolarHBondContact O-N 3.39Å; N447-S451 VanDerWaalsContact O-N 3.08Å; N447-S451 PolarHBondContact O-OG 2.86Å; N447-L471 HydrophobicContact CB-CD2 4.38Å
448	Q	97.4	Very high	94	Very high	81 Å²	81	49.5 Å²	49.5	38%	0.379	26%	0.257	S	S	.	.	H	α-helix	trans	-64.3	-39	177.5	-69.9	175.2	-0.4	0	0	112.5	K381 K444 H445 Y446 I452	K381-Q448 HydrophobicContact CD-CB 4.47Å; K444-Q448 WeakPolarHBondContact O-CG 3.43Å; K444-Q448 PolarHBondContact O-N 3.32Å; K444-Q448 VanDerWaalsContact O-N 3.08Å; H445-Q448 PolarHBondContact O-N 3.06Å; Y446-Q448 VanDerWaalsContact C-N 3.34Å; Y446-Q448 PolarHBondContact O-N 3.2Å; Q448-I452 WeakPolarHBondContact O-CD1 3.16Å; Q448-I452 WeakPolarHBondContact O-CG1 3.47Å; Q448-I452 PolarHBondContact O-N 2.65Å
449	K	95.5	Very high	93.4	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.7	-51.4	170.6	169.1	173.3	177.9	172.4	0	111.4	L365 E368 L378 K381 N382 L385 H445 Y446 N447 S451 I452 E453	L365-K449 VanDerWaalsContact CD2-NZ 3.31Å; E368-K449 IonicContact OE1-NZ 3.04Å; E368-K449 PolarHBondContact OE1-NZ 3.27Å; E368-K449 WeakPolarHBondContact OE2-CE 3.46Å; E368-K449 IonicContact OE2-NZ 2.62Å; E368-K449 PolarHBondContact OE2-NZ 3.28Å; L378-K449 HydrophobicContact CD1-CG 3.81Å; K381-K449 HydrophobicContact CB-CB 4.06Å; N382-K449 WeakPolarHBondContact OD1-CD 3.38Å; N382-K449 WeakPolarHBondContact OD1-CE 3.46Å; N382-K449 PolarHBondContact OD1-NZ 3.29Å; L385-K449 HydrophobicContact CD1-CB 4.37Å; L385-K449 HydrophobicContact CD1-CD 3.43Å; L385-K449 VanDerWaalsContact CD1-CD 3.43Å; H445-K449 WeakPolarHBondContact O-CB 3.4Å; H445-K449 PolarHBondContact O-N 3.34Å; Y446-K449 WeakPolarHBondContact O-CB 3.32Å; Y446-K449 PolarHBondContact O-N 3Å; N447-K449 PolarHBondContact O-N 3.36Å; K449-S451 VanDerWaalsContact C-N 3.32Å; K449-S451 PolarHBondContact O-N 3.35Å; K449-I452 PolarHBondContact O-N 2.99Å; K449-E453 WeakPolarHBondContact CE-OE1 3.45Å; K449-E453 HydrophobicContact CG-CG 4.3Å; K449-E453 IonicContact NZ-OE1 3.47Å; K449-E453 WeakPolarHBondContact O-CG 3.28Å; K449-E453 PolarHBondContact O-N 2.98Å
450	A	95	Very high	92.9	Very high	4 Å²	4	54.3 Å²	54.3	3%	0.033	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-38.8	-177.3	0	0	0	0	0	112.8	Y446 N447 I452 E453 Q454 T467 L471	Y446-A450 WeakPolarHBondContact O-CB 3.28Å; Y446-A450 PolarHBondContact O-N 3.44Å; N447-A450 PolarHBondContact O-N 2.97Å; A450-I452 VanDerWaalsContact C-N 3.34Å; A450-I452 PolarHBondContact O-N 3.27Å; A450-E453 PolarHBondContact O-N 3.38Å; A450-Q454 WeakPolarHBondContact O-CG 3.31Å; A450-Q454 PolarHBondContact O-N 2.82Å; A450-T467 HydrophobicContact CB-CG2 3.58Å; A450-L471 HydrophobicContact CB-CD1 3.78Å
451	S	94.6	Very high	92.6	Very high	67 Å²	67	57.3 Å²	57.3	47%	0.469	30%	0.302	S	S	.	.	H	α-helix	trans	-62	-40	173.2	-58.2	0	0	0	0	112.6	N447 K449 Q454	N447-S451 PolarHBondContact O-N 3.39Å; N447-S451 VanDerWaalsContact O-N 3.08Å; N447-S451 PolarHBondContact O-OG 2.86Å; K449-S451 VanDerWaalsContact C-N 3.32Å; K449-S451 PolarHBondContact O-N 3.35Å; S451-Q454 PolarHBondContact O-N 3.11Å
452	I	93.3	Very high	92.3	Very high	34 Å²	34	58.4 Å²	58.4	17%	0.174	31%	0.306	C	S	.	.	H	α-helix	trans	-70.3	-34.7	176.3	-61.7	162.9	0	0	0	110.9	A377 L378 K381 Q448 K449 A450 Q454 E455	A377-I452 HydrophobicContact CB-CD1 4.15Å; L378-I452 HydrophobicContact CB-CG2 4.03Å; L378-I452 HydrophobicContact CD1-CG2 4.34Å; K381-I452 HydrophobicContact CG-CD1 4Å; Q448-I452 WeakPolarHBondContact O-CD1 3.16Å; Q448-I452 WeakPolarHBondContact O-CG1 3.47Å; Q448-I452 PolarHBondContact O-N 2.65Å; K449-I452 PolarHBondContact O-N 2.99Å; A450-I452 VanDerWaalsContact C-N 3.34Å; A450-I452 PolarHBondContact O-N 3.27Å; I452-Q454 VanDerWaalsContact C-N 3.34Å; I452-E455 PolarHBondContact O-N 3.48Å
453	E	91.3	Very high	91.9	Very high	5 Å²	5	58.6 Å²	58.6	2%	0.023	31%	0.307	C	S	.	.	H	α-helix	trans	-68	-31.6	175.8	-71.2	-177.3	170.7	0	0	112.8	R281 L378 K449 A450 E455 L456	R281-E453 IonicContact CZ-OE1 3.14Å; R281-E453 IonicContact CZ-OE2 3.59Å; R281-E453 IonicContact NE-OE2 2.61Å; R281-E453 VanDerWaalsContact NH2-CD 3.29Å; R281-E453 IonicContact NH2-OE1 3.53Å; R281-E453 PolarHBondContact NH2-OE1 3.15Å; R281-E453 IonicContact NH2-OE2 2.7Å; R281-E453 PolarHBondContact NH2-OE2 2.85Å; R281-E453 VanDerWaalsContact NH2-OE2 3.09Å; L378-E453 HydrophobicContact CD1-CG 3.79Å; L378-E453 HydrophobicContact CD2-CG 4.27Å; K449-E453 WeakPolarHBondContact CE-OE1 3.45Å; K449-E453 HydrophobicContact CG-CG 4.3Å; K449-E453 IonicContact NZ-OE1 3.47Å; K449-E453 WeakPolarHBondContact O-CG 3.28Å; K449-E453 PolarHBondContact O-N 2.98Å; A450-E453 PolarHBondContact O-N 3.38Å; E453-E455 PolarHBondContact O-N 3.47Å; E453-L456 WeakPolarHBondContact O-CB 3.47Å; E453-L456 PolarHBondContact O-N 2.72Å
454	Q	89.2	Confident	91.7	Very high	98 Å²	98	59.4 Å²	59.4	46%	0.458	31%	0.312	S	S	.	.	H	α-helix	trans	-68.5	-19.9	174.6	-74.7	173.3	-10.3	0	0	113.6	A450 S451 I452 L456	A450-Q454 WeakPolarHBondContact O-CG 3.31Å; A450-Q454 PolarHBondContact O-N 2.82Å; S451-Q454 PolarHBondContact O-N 3.11Å; I452-Q454 VanDerWaalsContact C-N 3.34Å; Q454-L456 VanDerWaalsContact C-N 3.34Å
455	E	88.7	Confident	91.5	Very high	164 Å²	164	58.5 Å²	58.5	77%	0.766	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-5.6	174.7	-64.9	179.1	174.8	0	0	113	I452 E453	I452-E455 PolarHBondContact O-N 3.48Å; E453-E455 PolarHBondContact O-N 3.47Å
456	L	86.2	Confident	91.4	Very high	18 Å²	18	58 Å²	58	9%	0.094	31%	0.312	C	S	.	.	S	Bend	trans	-79	137.1	-178.8	-63.2	178	0	0	0	112.4	Y285 T375 L378 E453 Q454 T458 V459	Y285-L456 HydrophobicContact CE2-CD1 4.37Å; T375-L456 HydrophobicContact CG2-CD2 4.48Å; L378-L456 HydrophobicContact CD2-CD1 4.14Å; E453-L456 WeakPolarHBondContact O-CB 3.47Å; E453-L456 PolarHBondContact O-N 2.72Å; Q454-L456 VanDerWaalsContact C-N 3.34Å; L456-T458 PolarHBondContact O-N 2.88Å; L456-V459 WeakPolarHBondContact O-CG1 3.41Å; L456-V459 PolarHBondContact O-N 3.49Å; L456-V459 VanDerWaalsContact O-N 3.13Å
457	P	81.6	Confident	91.4	Very high	117 Å²	117	57.7 Å²	57.7	76%	0.76	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-7.6	-179.3	29.7	-36.8	0	0	0	114.3
458	T	80.6	Confident	91.3	Very high	82 Å²	82	59.8 Å²	59.8	50%	0.503	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	9.5	177.5	53.5	0	0	0	0	113.4	L373 L456 T460	L373-T458 HydrophobicContact CD1-CG2 3.37Å; L373-T458 WeakPolarHBondContact CD1-OG1 3.47Å; L456-T458 PolarHBondContact O-N 2.88Å; T458-T460 PolarHBondContact O-N 2.87Å
459	V	85.8	Confident	91.4	Very high	50 Å²	50	58.6 Å²	58.6	30%	0.303	32%	0.319	S	S	.	.			trans	-66.6	128.1	179	78.5	0	0	0	0	110.6	L456 L463 C464	L456-V459 WeakPolarHBondContact O-CG1 3.41Å; L456-V459 PolarHBondContact O-N 3.49Å; L456-V459 VanDerWaalsContact O-N 3.13Å; V459-L463 HydrophobicContact CG2-CD2 4.17Å; V459-L463 HydrophobicContact CG2-CG 4.46Å; V459-C464 VanDerWaalsContact CG2-SG 3.57Å
460	T	89.7	Confident	91.4	Very high	52 Å²	52	58.6 Å²	58.6	32%	0.319	32%	0.319	S	S	.	.			trans	-101.3	151.8	178.5	70	0	0	0	0	110.5	T458 K462 L463 C464	T458-T460 PolarHBondContact O-N 2.87Å; T460-K462 PolarHBondContact O-N 2.91Å; T460-L463 WeakPolarHBondContact O-CA 3.33Å; T460-L463 WeakPolarHBondContact O-CB 3.25Å; T460-L463 PolarHBondContact O-N 3.46Å; T460-L463 WeakPolarHBondContact OG1-CB 3.44Å; T460-L463 PolarHBondContact OG1-N 3.19Å; T460-C464 PolarHBondContact O-N 3.33Å
461	Q	90.5	Very high	91.6	Very high	165 Å²	165	59.9 Å²	59.9	77%	0.771	33%	0.325	S	S	*	.	H	α-helix	trans	-57.9	-34.1	174.3	-172	178.5	7	0	0	112.2	C464 T465	Q461-C464 PolarHBondContact O-N 3.13Å; Q461-T465 WeakPolarHBondContact O-CB 3.38Å; Q461-T465 WeakPolarHBondContact O-CG2 3.42Å; Q461-T465 PolarHBondContact O-N 2.94Å; Q461-T465 PolarHBondContact O-OG1 2.96Å
462	K	91.6	Very high	91.7	Very high	86 Å²	86	58.6 Å²	58.6	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-46.2	171.3	-171.7	-175.4	168.2	-150.4	0	111.5	I284 D288 T460 T465 T466	I284-K462 HydrophobicContact CD1-CD 4.34Å; I284-K462 HydrophobicContact CD1-CG 3.84Å; I284-K462 HydrophobicContact CG1-CD 4.14Å; I284-K462 HydrophobicContact CG1-CG 4.17Å; D288-K462 IonicContact OD1-NZ 3.57Å; D288-K462 PolarHBondContact OD1-NZ 3.37Å; D288-K462 WeakPolarHBondContact OD2-CD 3.41Å; D288-K462 IonicContact OD2-NZ 2.72Å; D288-K462 PolarHBondContact OD2-NZ 3.33Å; T460-K462 PolarHBondContact O-N 2.91Å; K462-T465 PolarHBondContact O-OG1 2.94Å; K462-T466 WeakPolarHBondContact O-CB 3.13Å; K462-T466 PolarHBondContact O-N 3.29Å; K462-T466 PolarHBondContact O-OG1 3.11Å; K462-T466 VanDerWaalsContact O-OG1 3.13Å
463	L	91.6	Very high	91.9	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-45.2	174.5	-176.7	53.4	0	0	0	112.7	R281 I284 Y285 V459 T460 T467	R281-L463 HydrophobicContact CG-CD1 3.89Å; I284-L463 HydrophobicContact CB-CD1 4.5Å; I284-L463 HydrophobicContact CG2-CB 3.62Å; I284-L463 HydrophobicContact CG2-CD1 3.94Å; I284-L463 HydrophobicContact CG2-CG 4.27Å; Y285-L463 HydrophobicContact CD2-CD2 3.67Å; Y285-L463 HydrophobicContact CE2-CD2 4.45Å; Y285-L463 HydrophobicContact CG-CD2 4.24Å; V459-L463 HydrophobicContact CG2-CD2 4.17Å; V459-L463 HydrophobicContact CG2-CG 4.46Å; T460-L463 WeakPolarHBondContact O-CA 3.33Å; T460-L463 WeakPolarHBondContact O-CB 3.25Å; T460-L463 PolarHBondContact O-N 3.46Å; T460-L463 WeakPolarHBondContact OG1-CB 3.44Å; T460-L463 PolarHBondContact OG1-N 3.19Å; L463-T467 WeakPolarHBondContact O-CB 3.42Å; L463-T467 PolarHBondContact O-N 2.98Å; L463-T467 PolarHBondContact O-OG1 2.87Å
464	C	92.6	Very high	92.3	Very high	30 Å²	30	57 Å²	57	20%	0.203	31%	0.314	C	S	.	.	H	α-helix	trans	-57.9	-53.6	177.3	-67.1	0	0	0	0	111.1	V459 T460 Q461 T467 E468	V459-C464 VanDerWaalsContact CG2-SG 3.57Å; T460-C464 PolarHBondContact O-N 3.33Å; Q461-C464 PolarHBondContact O-N 3.13Å; C464-T467 PolarHBondContact O-N 3.11Å; C464-E468 WeakPolarHBondContact O-CG 3.48Å; C464-E468 PolarHBondContact O-N 3.41Å
465	T	95	Very high	92.7	Very high	64 Å²	64	54 Å²	54	39%	0.393	31%	0.31	S	S	.	.	H	α-helix	trans	-64.4	-43.1	-178.3	47.3	0	0	0	0	113.1	Q461 K462 T467 E468 C469	Q461-T465 WeakPolarHBondContact O-CB 3.38Å; Q461-T465 WeakPolarHBondContact O-CG2 3.42Å; Q461-T465 PolarHBondContact O-N 2.94Å; Q461-T465 PolarHBondContact O-OG1 2.96Å; K462-T465 PolarHBondContact O-OG1 2.94Å; T465-T467 VanDerWaalsContact C-N 3.29Å; T465-T467 PolarHBondContact O-N 3.47Å; T465-E468 PolarHBondContact O-N 2.83Å; T465-C469 PolarHBondContact O-N 3.43Å; T465-C469 PolarHBondContact O-SG 3.3Å; T465-C469 VanDerWaalsContact O-SG 3.37Å
466	T	96.3	Very high	93.1	Very high	12 Å²	12	49 Å²	49	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-37.1	173.9	-61.7	0	0	0	0	111.7	Q280 R281 I284 K462 C469 L470	Q280-T466 HydrophobicContact CB-CG2 3.71Å; R281-T466 HydrophobicContact CB-CG2 4.01Å; I284-T466 HydrophobicContact CD1-CG2 4.11Å; I284-T466 WeakPolarHBondContact CD1-OG1 3.34Å; K462-T466 WeakPolarHBondContact O-CB 3.13Å; K462-T466 PolarHBondContact O-N 3.29Å; K462-T466 PolarHBondContact O-OG1 3.11Å; K462-T466 VanDerWaalsContact O-OG1 3.13Å; T466-C469 PolarHBondContact O-N 3.32Å; T466-L470 WeakPolarHBondContact O-CB 3.46Å; T466-L470 PolarHBondContact O-N 2.77Å
467	T	95.4	Very high	93.7	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-69.6	-39.9	177.6	-61.1	0	0	0	0	111.9	Y446 A450 L463 C464 T465 L470 L471	Y446-T467 HydrophobicContact CE1-CG2 4.46Å; A450-T467 HydrophobicContact CB-CG2 3.58Å; L463-T467 WeakPolarHBondContact O-CB 3.42Å; L463-T467 PolarHBondContact O-N 2.98Å; L463-T467 PolarHBondContact O-OG1 2.87Å; C464-T467 PolarHBondContact O-N 3.11Å; T465-T467 VanDerWaalsContact C-N 3.29Å; T465-T467 PolarHBondContact O-N 3.47Å; T467-L470 PolarHBondContact O-N 3.08Å; T467-L471 HydrophobicContact CG2-CD1 4.32Å; T467-L471 HydrophobicContact CG2-CG 4.36Å; T467-L471 WeakPolarHBondContact O-CB 3.31Å; T467-L471 VanDerWaalsContact O-CG 3.29Å; T467-L471 WeakPolarHBondContact O-CG 3.36Å; T467-L471 PolarHBondContact O-N 3.4Å
468	E	96.4	Very high	94.5	Very high	115 Å²	115	43.9 Å²	43.9	54%	0.537	26%	0.261	S	S	.	.	H	α-helix	trans	-59.8	-44.3	172	-75.8	171.6	-173.9	0	0	111.8	C464 T465 L471 G472	C464-E468 WeakPolarHBondContact O-CG 3.48Å; C464-E468 PolarHBondContact O-N 3.41Å; T465-E468 PolarHBondContact O-N 2.83Å; E468-L471 PolarHBondContact O-N 3.49Å; E468-G472 PolarHBondContact O-N 3.43Å
469	C	97.8	Very high	95.4	Very high	55 Å²	55	43 Å²	43	37%	0.372	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-40.7	173.9	-69.9	0	0	0	0	112.7	Y277 T465 T466 G472 S473	Y277-C469 HydrophobicContact CD1-CB 3.62Å; Y277-C469 HydrophobicContact CD2-CB 3.87Å; Y277-C469 WeakPolarHBondContact CD2-O 3.34Å; Y277-C469 HydrophobicContact CE1-CB 3.55Å; Y277-C469 HydrophobicContact CE2-CB 3.8Å; Y277-C469 HydrophobicContact CG-CB 3.81Å; T465-C469 PolarHBondContact O-N 3.43Å; T465-C469 PolarHBondContact O-SG 3.3Å; T465-C469 VanDerWaalsContact O-SG 3.37Å; T466-C469 PolarHBondContact O-N 3.32Å; C469-G472 PolarHBondContact O-N 2.96Å; C469-S473 PolarHBondContact O-N 3.06Å
470	L	97.4	Very high	96	Very high	0 Å²	0	41 Å²	41	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.7	-47.5	176.2	-164.9	160.6	0	0	0	111.1	F274 R281 Y446 T466 T467 G472 S473 L474	F274-L470 HydrophobicContact CD2-CD2 4.38Å; F274-L470 HydrophobicContact CE2-CD2 4.22Å; R281-L470 HydrophobicContact CB-CD1 4.49Å; Y446-L470 HydrophobicContact CD1-CD2 4.09Å; Y446-L470 HydrophobicContact CD2-CD2 4.18Å; Y446-L470 HydrophobicContact CE1-CD1 4.45Å; Y446-L470 HydrophobicContact CE1-CD2 3.81Å; Y446-L470 HydrophobicContact CE2-CD2 3.88Å; Y446-L470 HydrophobicContact CG-CD2 4.29Å; T466-L470 WeakPolarHBondContact O-CB 3.46Å; T466-L470 PolarHBondContact O-N 2.77Å; T467-L470 PolarHBondContact O-N 3.08Å; L470-G472 VanDerWaalsContact C-N 3.31Å; L470-G472 PolarHBondContact O-N 3.25Å; L470-S473 PolarHBondContact O-N 3.45Å; L470-S473 VanDerWaalsContact O-N 3.12Å; L470-S473 PolarHBondContact O-OG 2.79Å; L470-L474 HydrophobicContact CD2-CD1 3.56Å; L470-L474 HydrophobicContact CD2-CG 4.05Å; L470-L474 PolarHBondContact O-N 3.44Å
471	L	97.3	Very high	96.4	Very high	31 Å²	31	38.6 Å²	38.6	16%	0.162	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-39.6	174.3	-70.5	179.5	0	0	0	112	Y446 N447 A450 T467 E468 L474 G475	Y446-L471 HydrophobicContact CD1-CD2 3.74Å; Y446-L471 HydrophobicContact CG-CD2 4.27Å; N447-L471 HydrophobicContact CB-CD2 4.38Å; A450-L471 HydrophobicContact CB-CD1 3.78Å; T467-L471 HydrophobicContact CG2-CD1 4.32Å; T467-L471 HydrophobicContact CG2-CG 4.36Å; T467-L471 WeakPolarHBondContact O-CB 3.31Å; T467-L471 VanDerWaalsContact O-CG 3.29Å; T467-L471 WeakPolarHBondContact O-CG 3.36Å; T467-L471 PolarHBondContact O-N 3.4Å; E468-L471 PolarHBondContact O-N 3.49Å; L471-L474 PolarHBondContact O-N 2.87Å; L471-G475 PolarHBondContact O-N 2.95Å
472	G	97.9	Very high	96.8	Very high	40 Å²	40	31.4 Å²	31.4	41%	0.412	20%	0.201	S	C	.	.	H	α-helix	trans	-57.7	-47.5	171.4	0	0	0	0	0	112.1	E468 C469 L470 L474 G475 S476	E468-G472 PolarHBondContact O-N 3.43Å; C469-G472 PolarHBondContact O-N 2.96Å; L470-G472 VanDerWaalsContact C-N 3.31Å; L470-G472 PolarHBondContact O-N 3.25Å; G472-L474 PolarHBondContact O-N 3.35Å; G472-G475 PolarHBondContact O-N 3.23Å; G472-S476 PolarHBondContact O-N 3.41Å; G472-S476 PolarHBondContact O-OG 2.75Å
473	S	98.1	Very high	97.1	Very high	5 Å²	5	31.1 Å²	31.1	4%	0.035	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-38	176.7	77.2	0	0	0	0	113	F274 C469 L470 S476 L477	F274-S473 WeakPolarHBondContact CA-OG 3.31Å; C469-S473 PolarHBondContact O-N 3.06Å; L470-S473 PolarHBondContact O-N 3.45Å; L470-S473 VanDerWaalsContact O-N 3.12Å; L470-S473 PolarHBondContact O-OG 2.79Å; S473-S476 PolarHBondContact O-N 3.15Å; S473-L477 VanDerWaalsContact O-CB 3.28Å; S473-L477 WeakPolarHBondContact O-CB 3.41Å; S473-L477 PolarHBondContact O-N 3.02Å
474	L	97.9	Very high	97.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.6	-35.5	173.3	-74.2	175.4	0	0	0	112.3	F274 M442 Y446 L470 L471 G472 L477 T478	F274-L474 HydrophobicContact CD2-CD2 3.62Å; F274-L474 HydrophobicContact CD2-CG 3.96Å; F274-L474 HydrophobicContact CE2-CD1 4.42Å; F274-L474 HydrophobicContact CE2-CD2 3.58Å; F274-L474 HydrophobicContact CE2-CG 4.07Å; F274-L474 HydrophobicContact CZ-CD2 4.46Å; M442-L474 HydrophobicContact CE-CD2 3.66Å; Y446-L474 HydrophobicContact CD2-CD1 3.95Å; Y446-L474 HydrophobicContact CG-CD1 3.8Å; L470-L474 HydrophobicContact CD2-CD1 3.56Å; L470-L474 HydrophobicContact CD2-CG 4.05Å; L470-L474 PolarHBondContact O-N 3.44Å; L471-L474 PolarHBondContact O-N 2.87Å; G472-L474 PolarHBondContact O-N 3.35Å; L474-L477 PolarHBondContact O-N 2.72Å; L474-T478 VanDerWaalsContact O-CB 3.3Å; L474-T478 WeakPolarHBondContact O-CB 3.46Å; L474-T478 PolarHBondContact O-N 3.32Å; L474-T478 PolarHBondContact O-OG1 3.03Å
475	G	98.1	Very high	97.7	Very high	35 Å²	35	30.4 Å²	30.4	36%	0.361	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-48.6	171.8	0	0	0	0	0	112.1	L471 G472 T478 S479	L471-G475 PolarHBondContact O-N 2.95Å; G472-G475 PolarHBondContact O-N 3.23Å; G475-T478 PolarHBondContact O-N 2.99Å; G475-S479 WeakPolarHBondContact O-CB 3.38Å; G475-S479 PolarHBondContact O-N 3.35Å
476	S	98.3	Very high	97.8	Very high	60 Å²	60	30.8 Å²	30.8	42%	0.42	20%	0.196	S	C	.	.	H	α-helix	trans	-57.3	-49.2	171.8	-63.2	0	0	0	0	111.4	G472 S473 T478 S479 V480	G472-S476 PolarHBondContact O-N 3.41Å; G472-S476 PolarHBondContact O-OG 2.75Å; S473-S476 PolarHBondContact O-N 3.15Å; S476-T478 VanDerWaalsContact C-N 3.34Å; S476-T478 PolarHBondContact O-N 2.88Å; S476-S479 WeakPolarHBondContact O-CB 3.45Å; S476-S479 PolarHBondContact O-N 3.33Å; S476-S479 VanDerWaalsContact O-N 3.17Å; S476-V480 WeakPolarHBondContact O-CB 3.21Å; S476-V480 VanDerWaalsContact O-CG2 3.25Å; S476-V480 WeakPolarHBondContact O-CG2 3.36Å; S476-V480 PolarHBondContact O-N 2.81Å
477	L	98.3	Very high	97.9	Very high	4 Å²	4	31 Å²	31	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-40.1	-178.7	-168	67.8	0	0	0	112.3	L267 A270 L271 I439 S473 L474 T481	L267-L477 HydrophobicContact CD1-CD1 3.53Å; A270-L477 HydrophobicContact CB-CB 4.14Å; A270-L477 HydrophobicContact CB-CD1 3.92Å; L271-L477 HydrophobicContact CD2-CD1 3.55Å; L271-L477 HydrophobicContact CD2-CD2 4.02Å; L271-L477 HydrophobicContact CD2-CG 4.46Å; L271-L477 HydrophobicContact CG-CD1 3.84Å; I439-L477 HydrophobicContact CD1-CD2 3.89Å; I439-L477 HydrophobicContact CD1-CG 4.03Å; I439-L477 HydrophobicContact CG1-CD2 4.24Å; I439-L477 HydrophobicContact CG2-CB 4.2Å; I439-L477 HydrophobicContact CG2-CD2 3.9Å; I439-L477 HydrophobicContact CG2-CG 3.89Å; S473-L477 VanDerWaalsContact O-CB 3.28Å; S473-L477 WeakPolarHBondContact O-CB 3.41Å; S473-L477 PolarHBondContact O-N 3.02Å; L474-L477 PolarHBondContact O-N 2.72Å; L477-T481 WeakPolarHBondContact O-CB 3.49Å; L477-T481 WeakPolarHBondContact O-CG2 3.3Å; L477-T481 PolarHBondContact O-N 3.07Å; L477-T481 PolarHBondContact O-OG1 2.66Å
478	T	98.4	Very high	98	Very high	24 Å²	24	32 Å²	32	15%	0.147	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-45.9	173.6	-57.2	0	0	0	0	111	H436 K440 L474 G475 S476 T481 G482	H436-T478 PolarHBondContact CE1-O 2.96Å; H436-T478 PolarHBondContact ND1-O 3.49Å; K440-T478 HydrophobicContact CB-CG2 3.9Å; K440-T478 HydrophobicContact CG-CG2 4.14Å; L474-T478 VanDerWaalsContact O-CB 3.3Å; L474-T478 WeakPolarHBondContact O-CB 3.46Å; L474-T478 PolarHBondContact O-N 3.32Å; L474-T478 PolarHBondContact O-OG1 3.03Å; G475-T478 PolarHBondContact O-N 2.99Å; S476-T478 VanDerWaalsContact C-N 3.34Å; S476-T478 PolarHBondContact O-N 2.88Å; T478-T481 PolarHBondContact O-OG1 3.12Å; T478-G482 PolarHBondContact O-N 2.99Å
479	S	98.3	Very high	98	Very high	64 Å²	64	28.7 Å²	28.7	45%	0.448	19%	0.19	S	C	.	.	H	α-helix	trans	-61.4	-51.8	177.7	-175.4	0	0	0	0	111.4	G475 S476 G482 K483	G475-S479 WeakPolarHBondContact O-CB 3.38Å; G475-S479 PolarHBondContact O-N 3.35Å; S476-S479 WeakPolarHBondContact O-CB 3.45Å; S476-S479 PolarHBondContact O-N 3.33Å; S476-S479 VanDerWaalsContact O-N 3.17Å; S479-G482 PolarHBondContact O-N 2.85Å; S479-K483 WeakPolarHBondContact O-CG 3.5Å; S479-K483 PolarHBondContact O-N 3.19Å
480	V	98.4	Very high	98	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.036	21%	0.205	C	C	.	.	H	α-helix	trans	-66.7	-43.4	-174.2	174.5	0	0	0	0	111.9	F263 D266 L267 S476 G482 K483 I484	F263-V480 WeakPolarHBondContact O-CG1 3.34Å; D266-V480 HydrophobicContact CB-CB 4.42Å; D266-V480 HydrophobicContact CB-CG1 3.79Å; D266-V480 HydrophobicContact CB-CG2 3.68Å; L267-V480 HydrophobicContact CB-CG1 3.85Å; L267-V480 HydrophobicContact CD1-CG1 4.48Å; S476-V480 WeakPolarHBondContact O-CB 3.21Å; S476-V480 VanDerWaalsContact O-CG2 3.25Å; S476-V480 WeakPolarHBondContact O-CG2 3.36Å; S476-V480 PolarHBondContact O-N 2.81Å; V480-G482 VanDerWaalsContact C-N 3.26Å; V480-G482 PolarHBondContact O-N 3.09Å; V480-K483 WeakPolarHBondContact O-CB 3.35Å; V480-K483 PolarHBondContact O-N 3.23Å; V480-K483 VanDerWaalsContact O-N 3.15Å; V480-I484 HydrophobicContact CG1-CD1 3.89Å; V480-I484 HydrophobicContact CG1-CG1 4.38Å; V480-I484 WeakPolarHBondContact O-CG1 3.36Å; V480-I484 PolarHBondContact O-N 3.25Å
481	T	98.4	Very high	98	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-34.2	175.5	51.6	0	0	0	0	112.2	L267 L435 H436 I439 L477 T478 I484 A485	L267-T481 HydrophobicContact CD1-CG2 4.21Å; L435-T481 HydrophobicContact CD2-CG2 4.16Å; L435-T481 HydrophobicContact CG-CG2 4.24Å; H436-T481 PolarHBondContact ND1-OG1 3.05Å; I439-T481 HydrophobicContact CD1-CG2 3.86Å; L477-T481 WeakPolarHBondContact O-CB 3.49Å; L477-T481 WeakPolarHBondContact O-CG2 3.3Å; L477-T481 PolarHBondContact O-N 3.07Å; L477-T481 PolarHBondContact O-OG1 2.66Å; T478-T481 PolarHBondContact O-OG1 3.12Å; T481-I484 PolarHBondContact O-N 2.95Å; T481-A485 WeakPolarHBondContact O-CB 3.46Å; T481-A485 PolarHBondContact O-N 3.17Å
482	G	98.4	Very high	97.8	Very high	14 Å²	14	33.4 Å²	33.4	14%	0.144	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-42.7	171.2	0	0	0	0	0	113.1	H436 T478 S479 V480 T486	H436-G482 WeakPolarHBondContact ND1-CA 3.2Å; H436-G482 PolarHBondContact ND1-N 2.94Å; T478-G482 PolarHBondContact O-N 2.99Å; S479-G482 PolarHBondContact O-N 2.85Å; V480-G482 VanDerWaalsContact C-N 3.26Å; V480-G482 PolarHBondContact O-N 3.09Å; G482-T486 WeakPolarHBondContact O-CB 3.28Å; G482-T486 WeakPolarHBondContact O-CG2 3.44Å; G482-T486 PolarHBondContact O-N 2.86Å; G482-T486 PolarHBondContact O-OG1 3.46Å
483	K	98.4	Very high	97.5	Very high	79 Å²	79	38.1 Å²	38.1	34%	0.343	23%	0.227	S	C	.	.	H	α-helix	trans	-57.9	-48.9	172	-64.2	176.7	-162.3	175.5	0	110.8	F263 D266 S479 V480 T486 F487	F263-K483 HydrophobicContact CD1-CB 4Å; F263-K483 HydrophobicContact CD1-CD 3.92Å; F263-K483 HydrophobicContact CE1-CB 3.94Å; F263-K483 HydrophobicContact CE1-CD 3.81Å; F263-K483 HydrophobicContact CE1-CG 4.37Å; F263-K483 HydrophobicContact CZ-CB 4.47Å; D266-K483 IonicContact OD2-NZ 2.71Å; D266-K483 PolarHBondContact OD2-NZ 3.34Å; S479-K483 WeakPolarHBondContact O-CG 3.5Å; S479-K483 PolarHBondContact O-N 3.19Å; V480-K483 WeakPolarHBondContact O-CB 3.35Å; V480-K483 PolarHBondContact O-N 3.23Å; V480-K483 VanDerWaalsContact O-N 3.15Å; K483-T486 PolarHBondContact O-OG1 3.43Å; K483-T486 VanDerWaalsContact O-OG1 3.07Å; K483-F487 WeakPolarHBondContact O-CB 3.46Å; K483-F487 PolarHBondContact O-N 3.23Å
484	I	98.4	Very high	97.3	Very high	23 Å²	23	39.2 Å²	39.2	12%	0.118	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-49.3	-179	-64.8	166.7	0	0	0	110.8	F263 L267 L432 V480 T481 T486 F487 F488	F263-I484 HydrophobicContact CB-CD1 4.22Å; F263-I484 HydrophobicContact CB-CG1 3.56Å; F263-I484 HydrophobicContact CG-CG1 4.29Å; L267-I484 HydrophobicContact CB-CD1 4.2Å; L267-I484 HydrophobicContact CD2-CD1 3.9Å; L267-I484 HydrophobicContact CG-CD1 4.49Å; L432-I484 HydrophobicContact CD1-CG2 4.16Å; L432-I484 HydrophobicContact CD2-CG2 3.73Å; V480-I484 HydrophobicContact CG1-CD1 3.89Å; V480-I484 HydrophobicContact CG1-CG1 4.38Å; V480-I484 WeakPolarHBondContact O-CG1 3.36Å; V480-I484 PolarHBondContact O-N 3.25Å; T481-I484 PolarHBondContact O-N 2.95Å; I484-T486 PolarHBondContact O-N 2.74Å; I484-F487 PolarHBondContact O-N 3.47Å; I484-F488 VanDerWaalsContact O-CB 3.27Å; I484-F488 WeakPolarHBondContact O-CB 3.42Å; I484-F488 PolarHBondContact O-N 3.01Å
485	A	98.3	Very high	96.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-43.2	-177.4	0	0	0	0	0	112.2	L432 H433 T481 S489	L432-A485 HydrophobicContact CB-CB 3.99Å; H433-A485 PolarHBondContact NE2-O 3.22Å; T481-A485 WeakPolarHBondContact O-CB 3.46Å; T481-A485 PolarHBondContact O-N 3.17Å; A485-S489 PolarHBondContact O-N 3.42Å; A485-S489 VanDerWaalsContact O-N 3.09Å; A485-S489 PolarHBondContact O-OG 2.97Å
486	T	98	Very high	96.4	Very high	71 Å²	71	41.8 Å²	41.8	44%	0.436	24%	0.236	S	C	.	.	H	α-helix	trans	-68.7	-44.7	175.7	52.8	0	0	0	0	112.5	G482 K483 I484 F488 S489 N490	G482-T486 WeakPolarHBondContact O-CB 3.28Å; G482-T486 WeakPolarHBondContact O-CG2 3.44Å; G482-T486 PolarHBondContact O-N 2.86Å; G482-T486 PolarHBondContact O-OG1 3.46Å; K483-T486 PolarHBondContact O-OG1 3.43Å; K483-T486 VanDerWaalsContact O-OG1 3.07Å; I484-T486 PolarHBondContact O-N 2.74Å; T486-F488 VanDerWaalsContact C-N 3.32Å; T486-F488 PolarHBondContact O-N 3.45Å; T486-S489 PolarHBondContact O-N 2.9Å; T486-N490 VanDerWaalsContact O-CB 3.31Å; T486-N490 WeakPolarHBondContact O-CB 3.47Å; T486-N490 PolarHBondContact O-N 3.4Å; T486-N490 PolarHBondContact O-ND2 3.5Å; T486-N490 PolarHBondContact O-OD1 3.4Å
487	F	98.1	Very high	95.7	Very high	16 Å²	16	42.2 Å²	42.2	7%	0.07	24%	0.239	C	C	.	.	H	α-helix	trans	-56.2	-43.9	173.8	160.5	-98.4	0	0	0	112.7	V256 Q259 A260 F263 K483 I484 N490 N491	V256-F487 HydrophobicContact CG1-CE2 4.33Å; V256-F487 HydrophobicContact CG1-CZ 3.74Å; V256-F487 WeakPolarHBondContact O-CZ 3.18Å; Q259-F487 HydrophobicContact CB-CD2 4.24Å; Q259-F487 HydrophobicContact CB-CE2 3.56Å; Q259-F487 HydrophobicContact CB-CZ 4.06Å; Q259-F487 HydrophobicContact CG-CE2 4.48Å; A260-F487 HydrophobicContact CB-CE1 3.8Å; A260-F487 HydrophobicContact CB-CZ 3.98Å; F263-F487 HydrophobicContact CD2-CB 4.23Å; F263-F487 HydrophobicContact CD2-CD1 4.1Å; F263-F487 HydrophobicContact CD2-CD2 4.44Å; F263-F487 AromaticContact CD2-CG 4Å; F263-F487 HydrophobicContact CD2-CG 4Å; F263-F487 HydrophobicContact CE2-CB 3.71Å; F263-F487 HydrophobicContact CE2-CD1 4.17Å; F263-F487 AromaticContact CE2-CD2 3.75Å; F263-F487 HydrophobicContact CE2-CD2 3.75Å; F263-F487 HydrophobicContact CE2-CE2 4.43Å; F263-F487 AromaticContact CE2-CG 3.59Å; F263-F487 HydrophobicContact CE2-CG 3.59Å; K483-F487 WeakPolarHBondContact O-CB 3.46Å; K483-F487 PolarHBondContact O-N 3.23Å; I484-F487 PolarHBondContact O-N 3.47Å; F487-N490 PolarHBondContact O-N 3.22Å; F487-N491 WeakPolarHBondContact CE2-ND2 3.49Å; F487-N491 PolarHBondContact O-N 3.21Å; F487-N491 PolarHBondContact O-ND2 2.87Å
488	F	97.8	Very high	94.4	Very high	28 Å²	28	45.9 Å²	45.9	12%	0.123	26%	0.263	C	S	.	.	H	α-helix	trans	-70	-43.8	-177.3	-160.4	-81.1	0	0	0	111.2	F425 L428 A429 L432 I484 T486 N491 L492 F495	F425-F488 HydrophobicContact CD1-CE1 4.35Å; F425-F488 AromaticContact CD1-CZ 3.93Å; F425-F488 HydrophobicContact CD1-CZ 3.93Å; F425-F488 HydrophobicContact CE1-CZ 4.42Å; L428-F488 HydrophobicContact CD2-CE2 4.24Å; L428-F488 HydrophobicContact CD2-CZ 3.76Å; L428-F488 HydrophobicContact CG-CE1 4.34Å; L428-F488 HydrophobicContact CG-CZ 4.01Å; A429-F488 HydrophobicContact CB-CD1 3.66Å; A429-F488 HydrophobicContact CB-CE1 4.04Å; L432-F488 HydrophobicContact CD1-CB 3.73Å; L432-F488 HydrophobicContact CD1-CD1 4.03Å; L432-F488 HydrophobicContact CD1-CD2 3.71Å; L432-F488 HydrophobicContact CD1-CE2 4.29Å; L432-F488 HydrophobicContact CD1-CG 3.55Å; I484-F488 VanDerWaalsContact O-CB 3.27Å; I484-F488 WeakPolarHBondContact O-CB 3.42Å; I484-F488 PolarHBondContact O-N 3.01Å; T486-F488 VanDerWaalsContact C-N 3.32Å; T486-F488 PolarHBondContact O-N 3.45Å; F488-N491 CarbonylContact O-C 3.54Å; F488-N491 PolarHBondContact O-N 3.39Å; F488-L492 PolarHBondContact O-N 3.19Å; F488-L492 VanDerWaalsContact O-N 3.07Å; F488-F495 HydrophobicContact CD1-CD2 4.48Å; F488-F495 HydrophobicContact CD1-CE2 4.38Å; F488-F495 AromaticContact CD2-CE2 3.98Å; F488-F495 HydrophobicContact CD2-CE2 3.98Å; F488-F495 HydrophobicContact CE1-CD2 4.22Å; F488-F495 HydrophobicContact CE1-CE2 4.42Å; F488-F495 HydrophobicContact CE2-CD2 4.41Å; F488-F495 HydrophobicContact CE2-CE2 4.01Å; F488-F495 HydrophobicContact CE2-CZ 4.45Å; F488-F495 HydrophobicContact CG-CE2 4.18Å; F488-F495 HydrophobicContact CZ-CD2 4.18Å; F488-F495 HydrophobicContact CZ-CE2 4.24Å
489	S	96.8	Very high	93	Very high	45 Å²	45	45.3 Å²	45.3	32%	0.315	26%	0.261	S	S	.	.	H	α-helix	trans	-60.2	-44.4	171.7	-72	0	0	0	0	112.4	H433 A485 T486 N491 L492	H433-S489 PolarHBondContact NE2-OG 2.87Å; A485-S489 PolarHBondContact O-N 3.42Å; A485-S489 VanDerWaalsContact O-N 3.09Å; A485-S489 PolarHBondContact O-OG 2.97Å; T486-S489 PolarHBondContact O-N 2.9Å; S489-N491 PolarHBondContact O-N 3.5Å; S489-N491 VanDerWaalsContact O-N 3.15Å; S489-L492 WeakPolarHBondContact O-CB 3.22Å; S489-L492 PolarHBondContact O-N 3.33Å; S489-L492 VanDerWaalsContact O-N 3.1Å
490	N	97.1	Very high	92	Very high	132 Å²	132	42.7 Å²	42.7	71%	0.706	24%	0.242	S	C	*	.	H	α-helix	trans	-65.3	-16	179	-69.4	-13.4	0	0	0	113.6	T486 F487	T486-N490 VanDerWaalsContact O-CB 3.31Å; T486-N490 WeakPolarHBondContact O-CB 3.47Å; T486-N490 PolarHBondContact O-N 3.4Å; T486-N490 PolarHBondContact O-ND2 3.5Å; T486-N490 PolarHBondContact O-OD1 3.4Å; F487-N490 PolarHBondContact O-N 3.22Å
491	N	96.4	Very high	90.5	Very high	19 Å²	19	44.3 Å²	44.3	10%	0.102	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	9	175.4	-72.8	-76.4	0	0	0	113.6	K252 F487 F488 S489 D493 F494 F495	K252-N491 WeakPolarHBondContact CE-OD1 3.48Å; K252-N491 PolarHBondContact NZ-OD1 2.89Å; F487-N491 WeakPolarHBondContact CE2-ND2 3.49Å; F487-N491 PolarHBondContact O-N 3.21Å; F487-N491 PolarHBondContact O-ND2 2.87Å; F488-N491 CarbonylContact O-C 3.54Å; F488-N491 PolarHBondContact O-N 3.39Å; S489-N491 PolarHBondContact O-N 3.5Å; S489-N491 VanDerWaalsContact O-N 3.15Å; N491-D493 VanDerWaalsContact C-N 3.32Å; N491-D493 PolarHBondContact O-N 3.17Å; N491-F494 WeakPolarHBondContact O-CA 3.42Å; N491-F494 WeakPolarHBondContact O-CB 3.5Å; N491-F494 PolarHBondContact O-N 2.91Å; N491-F495 HydrophobicContact CB-CD2 4.24Å; N491-F495 HydrophobicContact CB-CE2 3.67Å; N491-F495 HydrophobicContact CB-CZ 4.07Å; N491-F495 VanDerWaalsContact O-CD2 3.24Å; N491-F495 WeakPolarHBondContact O-CD2 3.44Å; N491-F495 PolarHBondContact O-N 2.92Å; N491-F495 VanDerWaalsContact O-N 3.12Å
492	L	94.5	Very high	89	Confident	33 Å²	33	44.5 Å²	44.5	17%	0.173	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-40.9	-176.8	-173.5	62.1	0	0	0	112.4	F425 T426 F488 S489 F494 F495 T496	F425-L492 HydrophobicContact CB-CD1 3.87Å; T426-L492 HydrophobicContact CG2-CD2 4.46Å; F488-L492 PolarHBondContact O-N 3.19Å; F488-L492 VanDerWaalsContact O-N 3.07Å; S489-L492 WeakPolarHBondContact O-CB 3.22Å; S489-L492 PolarHBondContact O-N 3.33Å; S489-L492 VanDerWaalsContact O-N 3.1Å; L492-F494 PolarHBondContact O-N 2.86Å; L492-F495 PolarHBondContact O-N 2.95Å; L492-T496 HydrophobicContact CD1-CG2 3.87Å; L492-T496 HydrophobicContact CG-CG2 4.18Å; L492-T496 WeakPolarHBondContact O-CB 3.25Å; L492-T496 VanDerWaalsContact O-CG2 3.32Å; L492-T496 WeakPolarHBondContact O-CG2 3.4Å; L492-T496 PolarHBondContact O-N 2.77Å; L492-T496 PolarHBondContact O-OG1 3.28Å
493	D	91.8	Very high	87.1	Confident	140 Å²	140	55.1 Å²	55.1	75%	0.749	29%	0.291	S	S	*	.	H	α-helix	trans	-59.1	-28.5	174	-65.4	-15.6	0	0	0	113	N491 S497	N491-D493 VanDerWaalsContact C-N 3.32Å; N491-D493 PolarHBondContact O-N 3.17Å; D493-S497 WeakPolarHBondContact O-CB 3.32Å; D493-S497 PolarHBondContact O-N 2.94Å
494	F	92.7	Very high	85	Confident	27 Å²	27	54.4 Å²	54.4	12%	0.118	31%	0.305	C	S	.	.	H	α-helix	trans	-80.6	-39.7	177.8	175.1	-101.4	0	0	0	112.1	H249 K252 A253 V256 N491 L492 T496	H249-F494 AromaticContact CE1-CE2 3.3Å; H249-F494 WeakPolarHBondContact CE1-CE2 3.36Å; H249-F494 AromaticContact CE1-CZ 3.54Å; H249-F494 AromaticContact CG-CE2 3.97Å; H249-F494 AromaticContact ND1-CE2 3.32Å; H249-F494 VanDerWaalsContact ND1-CE2 3.32Å; H249-F494 WeakPolarHBondContact ND1-CE2 3.44Å; H249-F494 AromaticContact ND1-CZ 3.96Å; H249-F494 AromaticContact NE2-CE2 3.94Å; H249-F494 AromaticContact NE2-CZ 3.77Å; K252-F494 HydrophobicContact CB-CD2 4.49Å; K252-F494 HydrophobicContact CB-CE2 3.86Å; K252-F494 HydrophobicContact CB-CZ 4.19Å; K252-F494 HydrophobicContact CD-CD2 3.5Å; K252-F494 VanDerWaalsContact CD-CD2 3.5Å; K252-F494 HydrophobicContact CD-CE2 3.78Å; K252-F494 HydrophobicContact CD-CG 3.97Å; K252-F494 HydrophobicContact CG-CD2 3.87Å; K252-F494 HydrophobicContact CG-CE1 4.41Å; K252-F494 HydrophobicContact CG-CE2 3.65Å; K252-F494 HydrophobicContact CG-CG 4.32Å; K252-F494 HydrophobicContact CG-CZ 3.96Å; A253-F494 HydrophobicContact CB-CE1 4.39Å; A253-F494 HydrophobicContact CB-CZ 3.88Å; V256-F494 HydrophobicContact CB-CE1 4.45Å; V256-F494 HydrophobicContact CG1-CD1 4.48Å; V256-F494 HydrophobicContact CG2-CD1 4.26Å; V256-F494 HydrophobicContact CG2-CE1 4.36Å; N491-F494 WeakPolarHBondContact O-CA 3.42Å; N491-F494 WeakPolarHBondContact O-CB 3.5Å; N491-F494 PolarHBondContact O-N 2.91Å; L492-F494 PolarHBondContact O-N 2.86Å; F494-T496 VanDerWaalsContact C-N 3.34Å
495	F	90.7	Very high	82.9	Confident	48 Å²	48	54.5 Å²	54.5	21%	0.211	31%	0.308	C	S	.	.	H	α-helix	trans	-70.5	-30.6	176.2	-60	-51.9	0	0	0	112.9	V256 F425 F488 N491 L492	V256-F495 HydrophobicContact CG1-CE1 3.67Å; V256-F495 HydrophobicContact CG1-CZ 3.52Å; F425-F495 HydrophobicContact CD1-CB 3.77Å; F425-F495 HydrophobicContact CD1-CG 4.31Å; F425-F495 HydrophobicContact CD2-CB 4.07Å; F425-F495 WeakPolarHBondContact CD2-O 3.39Å; F425-F495 HydrophobicContact CE1-CB 3.77Å; F425-F495 HydrophobicContact CE1-CD1 4.43Å; F425-F495 HydrophobicContact CE1-CG 4.14Å; F425-F495 HydrophobicContact CE2-CB 4.07Å; F425-F495 WeakPolarHBondContact CE2-O 3.37Å; F425-F495 HydrophobicContact CG-CB 3.92Å; F425-F495 HydrophobicContact CZ-CB 3.92Å; F488-F495 HydrophobicContact CD1-CD2 4.48Å; F488-F495 HydrophobicContact CD1-CE2 4.38Å; F488-F495 AromaticContact CD2-CE2 3.98Å; F488-F495 HydrophobicContact CD2-CE2 3.98Å; F488-F495 HydrophobicContact CE1-CD2 4.22Å; F488-F495 HydrophobicContact CE1-CE2 4.42Å; F488-F495 HydrophobicContact CE2-CD2 4.41Å; F488-F495 HydrophobicContact CE2-CE2 4.01Å; F488-F495 HydrophobicContact CE2-CZ 4.45Å; F488-F495 HydrophobicContact CG-CE2 4.18Å; F488-F495 HydrophobicContact CZ-CD2 4.18Å; F488-F495 HydrophobicContact CZ-CE2 4.24Å; N491-F495 HydrophobicContact CB-CD2 4.24Å; N491-F495 HydrophobicContact CB-CE2 3.67Å; N491-F495 HydrophobicContact CB-CZ 4.07Å; N491-F495 VanDerWaalsContact O-CD2 3.24Å; N491-F495 WeakPolarHBondContact O-CD2 3.44Å; N491-F495 PolarHBondContact O-N 2.92Å; N491-F495 VanDerWaalsContact O-N 3.12Å; L492-F495 PolarHBondContact O-N 2.95Å
496	T	87.8	Confident	80.8	Confident	42 Å²	42	59 Å²	59	26%	0.258	35%	0.345	S	S	.	.	H	α-helix	trans	-92.2	-14.2	-178.1	59	0	0	0	0	114.3	S422 F425 L492 F494	S422-T496 WeakPolarHBondContact OG-CG2 3.33Å; F425-T496 HydrophobicContact CB-CG2 3.87Å; F425-T496 HydrophobicContact CD2-CG2 4.39Å; F425-T496 HydrophobicContact CG-CG2 4.49Å; L492-T496 HydrophobicContact CD1-CG2 3.87Å; L492-T496 HydrophobicContact CG-CG2 4.18Å; L492-T496 WeakPolarHBondContact O-CB 3.25Å; L492-T496 VanDerWaalsContact O-CG2 3.32Å; L492-T496 WeakPolarHBondContact O-CG2 3.4Å; L492-T496 PolarHBondContact O-N 2.77Å; L492-T496 PolarHBondContact O-OG1 3.28Å; F494-T496 VanDerWaalsContact C-N 3.34Å
497	S	82.9	Confident	79	Confident	68 Å²	68	60 Å²	60	48%	0.476	35%	0.35	S	S	.	.	S	Bend	trans	-84.6	131	176.7	-175.4	0	0	0	0	111.6	D493 G499	D493-S497 WeakPolarHBondContact O-CB 3.32Å; D493-S497 PolarHBondContact O-N 2.94Å; S497-G499 PolarHBondContact O-N 3.38Å
498	P	70.5	Confident	77.4	Confident	82 Å²	82	60.7 Å²	60.7	53%	0.532	36%	0.357	S	S	.	.			trans	-69.8	99.7	176.6	28.6	-34.1	0	0	0	110.7	Y500	P498-Y500 PolarHBondContact O-N 3Å
499	G	69.4	Low	76.2	Confident	11 Å²	11	59.4 Å²	59.4	11%	0.113	35%	0.352	C	S	.	.	S	Bend	trans	-64.4	-26.5	-176.9	0	0	0	0	0	115.3	N246 H249 S497	N246-G499 PolarHBondContact ND2-O 3.16Å; N246-G499 VanDerWaalsContact ND2-O 3.07Å; H249-G499 VanDerWaalsContact CE1-CA 3.4Å; H249-G499 WeakPolarHBondContact CE1-CA 3.37Å; H249-G499 VanDerWaalsContact ND1-CA 3.34Å; H249-G499 WeakPolarHBondContact ND1-CA 3.38Å; S497-G499 PolarHBondContact O-N 3.38Å
500	Y	76.6	Confident	75.2	Confident	9 Å²	9	59 Å²	59	4%	0.035	35%	0.346	C	S	.	.	S	Bend	trans	-139	128.3	177.8	-68.5	-96.1	0	0	0	108.9	P243 N246 H249 V331 V333 P498 L509 M517	P243-Y500 HydrophobicContact CB-CD1 4.38Å; P243-Y500 HydrophobicContact CG-CD1 4.15Å; N246-Y500 HydrophobicContact CB-CD1 4.44Å; N246-Y500 HydrophobicContact CB-CE1 3.98Å; N246-Y500 HydrophobicContact CB-CE2 4.5Å; N246-Y500 PolarHBondContact O-OH 2.72Å; H249-Y500 AromaticContact CD2-CE2 3.82Å; V331-Y500 HydrophobicContact CG1-CD1 4.39Å; V331-Y500 HydrophobicContact CG1-CD2 3.75Å; V331-Y500 HydrophobicContact CG1-CE1 4.46Å; V331-Y500 HydrophobicContact CG1-CE2 3.85Å; V331-Y500 HydrophobicContact CG1-CG 4.04Å; V331-Y500 HydrophobicContact CG2-CE1 4.12Å; V333-Y500 HydrophobicContact CG1-CD2 4.11Å; P498-Y500 PolarHBondContact O-N 3Å; Y500-L509 HydrophobicContact CG-CD2 4.5Å; Y500-M517 HydrophobicContact CD1-CE 4.49Å; Y500-M517 HydrophobicContact CE1-CE 3.94Å
501	S	68.1	Low	74.3	Confident	41 Å²	41	54.6 Å²	54.6	29%	0.287	33%	0.325	S	S	.	.			trans	-150.8	144.5	170.2	-56	0	0	0	0	109.9
502	P	66.6	Low	73.5	Confident	6 Å²	6	58.3 Å²	58.3	4%	0.039	34%	0.344	C	S	.	.			trans	-60.6	149.2	171.6	-21.2	33.3	0	0	0	111.7	N241 G504 C505	N241-P502 HydrophobicContact CB-CB 4.42Å; N241-P502 WeakPolarHBondContact ND2-CB 3.42Å; N241-P502 WeakPolarHBondContact O-CB 3.03Å; N241-P502 WeakPolarHBondContact O-CG 3.38Å; P502-G504 PolarHBondContact O-N 3.38Å; P502-G504 VanDerWaalsContact O-N 3.09Å; P502-C505 HydrophobicContact CB-CB 3.93Å; P502-C505 HydrophobicContact CG-CB 4.39Å; P502-C505 PolarHBondContact O-N 2.86Å; P502-C505 VanDerWaalsContact O-N 3.08Å
503	R	59.1	Low	72.9	Confident	238 Å²	238	57.6 Å²	57.6	90%	0.898	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	112.9	-169.5	-162.1	-178.4	-163.8	-174.4	5	111.2
504	G	53.6	Low	72.5	Confident	63 Å²	63	51.1 Å²	51.1	65%	0.649	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.1	-15.6	-177.5	0	0	0	0	0	114.2	P502	P502-G504 PolarHBondContact O-N 3.38Å; P502-G504 VanDerWaalsContact O-N 3.09Å
505	C	53.7	Low	72.1	Confident	26 Å²	26	56.1 Å²	56.1	18%	0.176	33%	0.33	C	S	.	.			trans	-93.6	133.8	-173.7	-151.9	0	0	0	0	111.8	E225 P502	E225-C505 VanDerWaalsContact OE1-CA 3.31Å; E225-C505 WeakPolarHBondContact OE1-CA 3.49Å; E225-C505 WeakPolarHBondContact OE1-CB 3.34Å; E225-C505 PolarHBondContact OE1-SG 3.45Å; P502-C505 HydrophobicContact CB-CB 3.93Å; P502-C505 HydrophobicContact CG-CB 4.39Å; P502-C505 PolarHBondContact O-N 2.86Å; P502-C505 VanDerWaalsContact O-N 3.08Å
506	A	54.3	Low	71.8	Confident	95 Å²	95	55.3 Å²	55.3	79%	0.785	33%	0.33	S	S	*	.			trans	-100.4	29.7	176.4	0	0	0	0	0	112.8	Q418	Q418-A506 PolarHBondContact OE1-O 3.26Å
507	V	60.3	Low	71.8	Confident	90 Å²	90	53.7 Å²	53.7	55%	0.545	32%	0.32	S	S	.	.	S	Bend	trans	-106.8	150.5	-176.9	-179.4	0	0	0	0	110.1	Q418	Q418-V507 VanDerWaalsContact OE1-C 3.32Å
508	S	64.2	Low	72	Confident	31 Å²	31	51.6 Å²	51.6	22%	0.217	30%	0.303	C	S	.	.			trans	-44.7	144.3	170.1	164.4	0	0	0	0	112.5	E335 Q418 N510	E335-S508 WeakPolarHBondContact CG-OG 3.35Å; E335-S508 WeakPolarHBondContact OE1-CB 3.49Å; E335-S508 PolarHBondContact OE1-OG 3Å; Q418-S508 VanDerWaalsContact OE1-N 3.16Å; S508-N510 PolarHBondContact O-N 2.87Å
509	L	73.5	Confident	72.8	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	29%	0.293	C	S	.	.			trans	-79.3	114.3	177.2	-177	75.1	0	0	0	109.6	P243 V331 V333 Y500 Q513 A514	P243-L509 HydrophobicContact CB-CD1 4.44Å; P243-L509 HydrophobicContact CG-CD1 3.63Å; V331-L509 HydrophobicContact CG1-CD2 3.79Å; V333-L509 HydrophobicContact CG1-CD2 4.37Å; V333-L509 HydrophobicContact CG2-CB 4.35Å; V333-L509 HydrophobicContact CG2-CD2 3.98Å; Y500-L509 HydrophobicContact CG-CD2 4.5Å; L509-Q513 HydrophobicContact CD1-CB 3.96Å; L509-A514 HydrophobicContact CD2-CB 3.99Å
510	N	75.1	Confident	73.7	Confident	36 Å²	36	52.3 Å²	52.3	19%	0.193	31%	0.305	C	S	.	.			trans	-67.6	132.1	174.7	-172.4	-49.4	0	0	0	109.7	Q413 S508 L512 Q513 A514	Q413-N510 PolarHBondContact OE1-ND2 3.23Å; S508-N510 PolarHBondContact O-N 2.87Å; N510-L512 PolarHBondContact O-N 3.39Å; N510-L512 VanDerWaalsContact O-N 3.08Å; N510-L512 WeakPolarHBondContact OD1-CB 3.44Å; N510-L512 PolarHBondContact OD1-N 2.92Å; N510-Q513 HydrophobicContact CB-CG 4.15Å; N510-Q513 VanDerWaalsContact N-OE1 3.08Å; N510-Q513 WeakPolarHBondContact O-CA 3.28Å; N510-Q513 VanDerWaalsContact O-CB 3.31Å; N510-Q513 WeakPolarHBondContact O-CB 3.35Å; N510-Q513 PolarHBondContact O-N 3.43Å; N510-A514 PolarHBondContact O-N 2.97Å; N510-A514 VanDerWaalsContact O-N 3.17Å
511	P	79.4	Confident	74.2	Confident	40 Å²	40	54.5 Å²	54.5	26%	0.26	32%	0.315	S	S	.	.	H	α-helix	trans	-50.2	-31.9	174.5	-31.2	37.8	0	0	0	114.8	E335 T336 Q513 A514 E515	E335-P511 HydrophobicContact CB-CG 4.22Å; E335-P511 WeakPolarHBondContact O-CG 3.44Å; T336-P511 HydrophobicContact CG2-CB 4.41Å; T336-P511 HydrophobicContact CG2-CG 4.42Å; P511-Q513 PolarHBondContact O-N 3.45Å; P511-A514 WeakPolarHBondContact O-CB 3.4Å; P511-A514 PolarHBondContact O-N 2.94Å; P511-E515 PolarHBondContact O-N 3.33Å
512	L	79.1	Confident	75.2	Confident	97 Å²	97	57.8 Å²	57.8	51%	0.508	32%	0.324	S	S	.	.	H	α-helix	trans	-67	-33	174.2	-62.5	172.6	0	0	0	112.6	N510 S516	N510-L512 PolarHBondContact O-N 3.39Å; N510-L512 VanDerWaalsContact O-N 3.08Å; N510-L512 WeakPolarHBondContact OD1-CB 3.44Å; N510-L512 PolarHBondContact OD1-N 2.92Å; L512-S516 WeakPolarHBondContact O-CB 3.47Å; L512-S516 PolarHBondContact O-N 2.92Å
513	Q	81	Confident	76.4	Confident	18 Å²	18	64 Å²	64	8%	0.084	35%	0.351	C	S	.	.	H	α-helix	trans	-69.6	-37.8	171.1	-66.2	165.4	-25.4	0	0	110.7	N238 V242 L509 N510 P511 M517	N238-Q513 PolarHBondContact O-NE2 2.93Å; V242-Q513 WeakPolarHBondContact CG1-O 3.43Å; L509-Q513 HydrophobicContact CD1-CB 3.96Å; N510-Q513 HydrophobicContact CB-CG 4.15Å; N510-Q513 VanDerWaalsContact N-OE1 3.08Å; N510-Q513 WeakPolarHBondContact O-CA 3.28Å; N510-Q513 VanDerWaalsContact O-CB 3.31Å; N510-Q513 WeakPolarHBondContact O-CB 3.35Å; N510-Q513 PolarHBondContact O-N 3.43Å; P511-Q513 PolarHBondContact O-N 3.45Å; Q513-M517 WeakPolarHBondContact O-CB 3.4Å; Q513-M517 PolarHBondContact O-N 3.06Å
514	A	83.9	Confident	77.8	Confident	4 Å²	4	55.3 Å²	55.3	3%	0.033	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-46.2	175.4	0	0	0	0	0	111.7	V331 T336 L509 N510 P511 M517 L518	V331-A514 HydrophobicContact CB-CB 4.06Å; V331-A514 HydrophobicContact CG1-CB 4.28Å; V331-A514 HydrophobicContact CG2-CB 4.01Å; T336-A514 HydrophobicContact CG2-CB 4.01Å; L509-A514 HydrophobicContact CD2-CB 3.99Å; N510-A514 PolarHBondContact O-N 2.97Å; N510-A514 VanDerWaalsContact O-N 3.17Å; P511-A514 WeakPolarHBondContact O-CB 3.4Å; P511-A514 PolarHBondContact O-N 2.94Å; A514-M517 PolarHBondContact O-N 3.11Å; A514-L518 VanDerWaalsContact O-CG 3.3Å; A514-L518 WeakPolarHBondContact O-CG 3.4Å; A514-L518 PolarHBondContact O-N 2.84Å
515	E	83.9	Confident	79.4	Confident	132 Å²	132	55 Å²	55	62%	0.617	32%	0.321	S	S	*	.	H	α-helix	trans	-63.5	-48.8	175.7	-175.2	177.7	-169.6	0	0	111.7	P511 M517 L518 A519	P511-E515 PolarHBondContact O-N 3.33Å; E515-M517 VanDerWaalsContact C-N 3.32Å; E515-M517 PolarHBondContact O-N 3.36Å; E515-L518 PolarHBondContact O-N 2.89Å; E515-L518 VanDerWaalsContact O-N 3.16Å; E515-A519 WeakPolarHBondContact O-CB 3.31Å; E515-A519 PolarHBondContact O-N 2.9Å
516	S	85.3	Confident	81.3	Confident	30 Å²	30	56.8 Å²	56.8	21%	0.21	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-42.9	176.5	-179.4	0	0	0	0	111.9	V242 L512 A519 N520	V242-S516 WeakPolarHBondContact CG1-OG 3.42Å; L512-S516 WeakPolarHBondContact O-CB 3.47Å; L512-S516 PolarHBondContact O-N 2.92Å; S516-A519 PolarHBondContact O-N 2.96Å; S516-N520 VanDerWaalsContact O-CB 3.32Å; S516-N520 WeakPolarHBondContact O-CB 3.34Å; S516-N520 PolarHBondContact O-N 3.45Å; S516-N520 PolarHBondContact O-ND2 3.42Å
517	M	87.1	Confident	83.1	Confident	9 Å²	9	59.7 Å²	59.7	4%	0.044	33%	0.329	C	S	.	.	H	α-helix	trans	-60.1	-47.4	174.5	-177.2	-79.7	-66.6	0	0	111.8	V242 P243 H245 V331 Y500 Q513 A514 E515 N520 K521	V242-M517 HydrophobicContact CB-CB 4.08Å; V242-M517 HydrophobicContact CG1-CB 4.27Å; P243-M517 HydrophobicContact CG-CG 4.39Å; P243-M517 VanDerWaalsContact O-CG 3.24Å; P243-M517 WeakPolarHBondContact O-CG 3.46Å; H245-M517 HydrophobicContact CB-SD 3.58Å; H245-M517 VanDerWaalsContact CB-SD 3.58Å; V331-M517 HydrophobicContact CG2-CE 3.16Å; Y500-M517 HydrophobicContact CD1-CE 4.49Å; Y500-M517 HydrophobicContact CE1-CE 3.94Å; Q513-M517 WeakPolarHBondContact O-CB 3.4Å; Q513-M517 PolarHBondContact O-N 3.06Å; A514-M517 PolarHBondContact O-N 3.11Å; E515-M517 VanDerWaalsContact C-N 3.32Å; E515-M517 PolarHBondContact O-N 3.36Å; M517-N520 PolarHBondContact O-N 3.45Å; M517-K521 WeakPolarHBondContact O-CB 3.36Å; M517-K521 PolarHBondContact O-N 2.9Å
518	L	87.7	Confident	84.5	Confident	24 Å²	24	59.4 Å²	59.4	13%	0.126	32%	0.323	C	S	.	.	H	α-helix	trans	-68.5	-38.8	179.4	-69.9	168.3	0	0	0	112.6	D329 V331 A514 E515 N520 K521 K522	D329-L518 WeakPolarHBondContact O-CD1 3.48Å; D329-L518 WeakPolarHBondContact O-CD2 3.31Å; V331-L518 HydrophobicContact CG2-CD1 4.12Å; V331-L518 HydrophobicContact CG2-CD2 4.45Å; V331-L518 HydrophobicContact CG2-CG 4.23Å; A514-L518 VanDerWaalsContact O-CG 3.3Å; A514-L518 WeakPolarHBondContact O-CG 3.4Å; A514-L518 PolarHBondContact O-N 2.84Å; E515-L518 PolarHBondContact O-N 2.89Å; E515-L518 VanDerWaalsContact O-N 3.16Å; L518-N520 VanDerWaalsContact C-N 3.33Å; L518-K521 HydrophobicContact CD2-CD 4.35Å; L518-K521 WeakPolarHBondContact O-CB 3.48Å; L518-K521 PolarHBondContact O-N 2.64Å; L518-K522 WeakPolarHBondContact O-CG 3.43Å; L518-K522 PolarHBondContact O-N 2.86Å
519	A	87.6	Confident	85.8	Confident	40 Å²	40	62.7 Å²	62.7	33%	0.331	34%	0.339	S	S	.	.	H	α-helix	trans	-62.6	-41.6	174	0	0	0	0	0	111.2	E515 S516 K522 K523	E515-A519 WeakPolarHBondContact O-CB 3.31Å; E515-A519 PolarHBondContact O-N 2.9Å; S516-A519 PolarHBondContact O-N 2.96Å; A519-K522 PolarHBondContact O-N 3.26Å; A519-K523 VanDerWaalsContact O-CG 3.29Å; A519-K523 WeakPolarHBondContact O-CG 3.41Å; A519-K523 PolarHBondContact O-N 2.92Å
520	N	87.1	Confident	86.5	Confident	68 Å²	68	65.8 Å²	65.8	36%	0.364	36%	0.364	S	S	.	.	H	α-helix	trans	-73	-34.8	177.1	-66.7	-31.1	0	0	0	112.3	S516 M517 L518 K523 A524	S516-N520 VanDerWaalsContact O-CB 3.32Å; S516-N520 WeakPolarHBondContact O-CB 3.34Å; S516-N520 PolarHBondContact O-N 3.45Å; S516-N520 PolarHBondContact O-ND2 3.42Å; M517-N520 PolarHBondContact O-N 3.45Å; L518-N520 VanDerWaalsContact C-N 3.33Å; N520-K523 PolarHBondContact O-N 2.78Å; N520-K523 PolarHBondContact OD1-NZ 3.23Å; N520-A524 VanDerWaalsContact O-CB 3.29Å; N520-A524 WeakPolarHBondContact O-CB 3.18Å; N520-A524 PolarHBondContact O-N 2.8Å
521	K	88.1	Confident	87.1	Confident	55 Å²	55	69.1 Å²	69.1	24%	0.239	38%	0.381	C	S	.	.	H	α-helix	trans	-55.1	-50	167	179.3	-163.2	177.2	-170	0	110.7	H245 E328 D329 M517 L518 A524 A525	H245-K521 PolarHBondContact CE1-NZ 2.91Å; H245-K521 WeakPolarHBondContact NE2-CE 3.37Å; H245-K521 PolarHBondContact NE2-NZ 3.05Å; H245-K521 VanDerWaalsContact NE2-NZ 3.12Å; E328-K521 PolarHBondContact O-NZ 3.08Å; D329-K521 WeakPolarHBondContact OD1-CE 3.26Å; D329-K521 IonicContact OD1-NZ 3.53Å; D329-K521 PolarHBondContact OD1-NZ 3.23Å; M517-K521 WeakPolarHBondContact O-CB 3.36Å; M517-K521 PolarHBondContact O-N 2.9Å; L518-K521 HydrophobicContact CD2-CD 4.35Å; L518-K521 WeakPolarHBondContact O-CB 3.48Å; L518-K521 PolarHBondContact O-N 2.64Å; K521-A524 PolarHBondContact O-N 3.48Å; K521-A525 WeakPolarHBondContact O-CB 3.46Å; K521-A525 PolarHBondContact O-N 3.44Å
522	K	89.5	Confident	87.5	Confident	110 Å²	110	74.6 Å²	74.6	48%	0.478	40%	0.401	S	S	.	.	H	α-helix	trans	-65	-44	-179.7	-73.2	176.7	179.2	179.1	0	112.4	L518 A519 A525 A526	L518-K522 WeakPolarHBondContact O-CG 3.43Å; L518-K522 PolarHBondContact O-N 2.86Å; A519-K522 PolarHBondContact O-N 3.26Å; K522-A525 PolarHBondContact O-N 3.31Å; K522-A526 WeakPolarHBondContact O-CB 3.42Å; K522-A526 PolarHBondContact O-N 2.63Å
523	K	90.2	Very high	87.6	Confident	137 Å²	137	73.8 Å²	73.8	60%	0.596	40%	0.4	S	S	*	.	H	α-helix	trans	-59.4	-45.8	173.3	-71	167.8	-170.6	168.8	0	112.2	A519 N520 A526 Y527	A519-K523 VanDerWaalsContact O-CG 3.29Å; A519-K523 WeakPolarHBondContact O-CG 3.41Å; A519-K523 PolarHBondContact O-N 2.92Å; N520-K523 PolarHBondContact O-N 2.78Å; N520-K523 PolarHBondContact OD1-NZ 3.23Å; K523-A526 PolarHBondContact O-N 3.24Å; K523-Y527 WeakPolarHBondContact O-CB 3.3Å; K523-Y527 PolarHBondContact O-N 3.13Å
524	A	88.3	Confident	87.3	Confident	54 Å²	54	77.4 Å²	77.4	45%	0.446	43%	0.433	S	S	.	.	H	α-helix	trans	-65.7	-40.2	178.7	0	0	0	0	0	112.2	N520 K521 Y527 I528	N520-A524 VanDerWaalsContact O-CB 3.29Å; N520-A524 WeakPolarHBondContact O-CB 3.18Å; N520-A524 PolarHBondContact O-N 2.8Å; K521-A524 PolarHBondContact O-N 3.48Å; A524-Y527 PolarHBondContact O-N 3.21Å; A524-I528 VanDerWaalsContact O-CG1 3.32Å; A524-I528 WeakPolarHBondContact O-CG1 3.26Å; A524-I528 PolarHBondContact O-N 3.12Å
525	A	89	Confident	86.5	Confident	58 Å²	58	88.4 Å²	88.4	48%	0.479	47%	0.474	S	S	.	.	H	α-helix	trans	-61.1	-49.9	174.2	0	0	0	0	0	111.5	K521 K522 Y527 I528 D529	K521-A525 WeakPolarHBondContact O-CB 3.46Å; K521-A525 PolarHBondContact O-N 3.44Å; K522-A525 PolarHBondContact O-N 3.31Å; A525-Y527 VanDerWaalsContact C-N 3.33Å; A525-Y527 PolarHBondContact O-N 3.37Å; A525-I528 PolarHBondContact O-N 2.87Å; A525-D529 WeakPolarHBondContact O-CB 3.49Å; A525-D529 PolarHBondContact O-N 3.11Å
526	A	91.9	Very high	85.9	Confident	62 Å²	62	87.7 Å²	87.7	51%	0.512	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-36.7	177.8	0	0	0	0	0	113	K522 K523 D529 A530	K522-A526 WeakPolarHBondContact O-CB 3.42Å; K522-A526 PolarHBondContact O-N 2.63Å; K523-A526 PolarHBondContact O-N 3.24Å; A526-D529 PolarHBondContact O-N 3.49Å; A526-A530 WeakPolarHBondContact O-CB 3.43Å; A526-A530 PolarHBondContact O-N 2.72Å
527	Y	91.9	Very high	85.3	Confident	157 Å²	157	96.2 Å²	96.2	62%	0.616	52%	0.517	S	S	*	.	H	α-helix	trans	-66.8	-43.4	174.7	176.6	-107.6	0	0	0	112.6	K523 A524 A525 D529 A530 I531	K523-Y527 WeakPolarHBondContact O-CB 3.3Å; K523-Y527 PolarHBondContact O-N 3.13Å; A524-Y527 PolarHBondContact O-N 3.21Å; A525-Y527 VanDerWaalsContact C-N 3.33Å; A525-Y527 PolarHBondContact O-N 3.37Å; Y527-D529 VanDerWaalsContact C-N 3.31Å; Y527-A530 PolarHBondContact O-N 3.4Å; Y527-I531 HydrophobicContact CD1-CD1 3.95Å; Y527-I531 HydrophobicContact CE1-CD1 3.47Å; Y527-I531 VanDerWaalsContact CE1-CD1 3.47Å; Y527-I531 HydrophobicContact CE2-CD1 4.15Å; Y527-I531 HydrophobicContact CG-CD1 4.49Å; Y527-I531 WeakPolarHBondContact O-CG1 3.41Å; Y527-I531 PolarHBondContact O-N 2.97Å; Y527-I531 VanDerWaalsContact O-N 3.11Å
528	I	90.9	Very high	84.7	Confident	83 Å²	83	100.9 Å²	100.9	43%	0.426	55%	0.551	S	S	.	*	H	α-helix	trans	-67	-34.8	175.4	-68.7	-66.3	0	0	0	111.3	A524 A525 I531 K532	A524-I528 VanDerWaalsContact O-CG1 3.32Å; A524-I528 WeakPolarHBondContact O-CG1 3.26Å; A524-I528 PolarHBondContact O-N 3.12Å; A525-I528 PolarHBondContact O-N 2.87Å; I528-I531 PolarHBondContact O-N 2.59Å; I528-K532 HydrophobicContact CG2-CD 4.07Å; I528-K532 VanDerWaalsContact O-CG 3.29Å; I528-K532 WeakPolarHBondContact O-CG 3.28Å; I528-K532 PolarHBondContact O-N 2.7Å; I528-K532 VanDerWaalsContact O-N 3.11Å
529	D	90.9	Very high	84.4	Confident	101 Å²	101	103.2 Å²	103.2	54%	0.54	57%	0.565	S	S	.	*	H	α-helix	trans	-66.8	-46.8	174.5	-159.2	57	0	0	0	111.2	A525 A526 Y527 I531 K532 T533	A525-D529 WeakPolarHBondContact O-CB 3.49Å; A525-D529 PolarHBondContact O-N 3.11Å; A526-D529 PolarHBondContact O-N 3.49Å; Y527-D529 VanDerWaalsContact C-N 3.31Å; D529-I531 PolarHBondContact O-N 2.81Å; D529-I531 VanDerWaalsContact O-N 3.16Å; D529-K532 CarbonylContact O-C 3.59Å; D529-K532 WeakPolarHBondContact O-CA 3.43Å; D529-K532 PolarHBondContact O-N 2.95Å; D529-T533 PolarHBondContact O-N 3.02Å; D529-T533 PolarHBondContact O-OG1 2.91Å
530	A	88.1	Confident	84.2	Confident	66 Å²	66	105.1 Å²	105.1	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-62.3	-20.9	174.9	0	0	0	0	0	114.6	A526 Y527 T533	A526-A530 WeakPolarHBondContact O-CB 3.43Å; A526-A530 PolarHBondContact O-N 2.72Å; Y527-A530 PolarHBondContact O-N 3.4Å; A530-T533 WeakPolarHBondContact CA-OG1 3.42Å; A530-T533 PolarHBondContact O-OG1 3.21Å; A530-T533 VanDerWaalsContact O-OG1 3.06Å
531	I	87.1	Confident	84	Confident	106 Å²	106	110.5 Å²	110.5	54%	0.544	59%	0.591	S	S	.	*	H	α-helix	trans	-80	-35.9	169	-71.9	167.1	0	0	0	111.5	Y527 I528 D529	Y527-I531 HydrophobicContact CD1-CD1 3.95Å; Y527-I531 HydrophobicContact CE1-CD1 3.47Å; Y527-I531 VanDerWaalsContact CE1-CD1 3.47Å; Y527-I531 HydrophobicContact CE2-CD1 4.15Å; Y527-I531 HydrophobicContact CG-CD1 4.49Å; Y527-I531 WeakPolarHBondContact O-CG1 3.41Å; Y527-I531 PolarHBondContact O-N 2.97Å; Y527-I531 VanDerWaalsContact O-N 3.11Å; I528-I531 PolarHBondContact O-N 2.59Å; D529-I531 PolarHBondContact O-N 2.81Å; D529-I531 VanDerWaalsContact O-N 3.16Å
532	K	88.1	Confident	83.8	Confident	155 Å²	155	118.6 Å²	118.6	67%	0.674	62%	0.62	S	S	*	*	H	α-helix	trans	-80.9	-29.8	-178.2	-74.6	172	177.7	179.3	0	113.4	I528 D529 A534	I528-K532 HydrophobicContact CG2-CD 4.07Å; I528-K532 VanDerWaalsContact O-CG 3.29Å; I528-K532 WeakPolarHBondContact O-CG 3.28Å; I528-K532 PolarHBondContact O-N 2.7Å; I528-K532 VanDerWaalsContact O-N 3.11Å; D529-K532 CarbonylContact O-C 3.59Å; D529-K532 WeakPolarHBondContact O-CA 3.43Å; D529-K532 PolarHBondContact O-N 2.95Å; K532-A534 PolarHBondContact O-N 3.07Å; K532-A534 VanDerWaalsContact O-N 3.11Å
533	T	82.4	Confident	83.6	Confident	80 Å²	80	118.2 Å²	118.2	49%	0.491	62%	0.62	S	S	.	*	S	Bend	trans	-56.3	117.4	170.8	46.9	0	0	0	0	108.5	D529 A530 R535	D529-T533 PolarHBondContact O-N 3.02Å; D529-T533 PolarHBondContact O-OG1 2.91Å; A530-T533 WeakPolarHBondContact CA-OG1 3.42Å; A530-T533 PolarHBondContact O-OG1 3.21Å; A530-T533 VanDerWaalsContact O-OG1 3.06Å; T533-R535 PolarHBondContact O-N 3.37Å
534	A	75	Confident	83.4	Confident	95 Å²	95	113.7 Å²	113.7	79%	0.785	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-54.4	127.9	178	0	0	0	0	0	109.2	K532	K532-A534 PolarHBondContact O-N 3.07Å; K532-A534 VanDerWaalsContact O-N 3.11Å
535	R	66.5	Low	83.3	Confident	234 Å²	234	114.3 Å²	114.3	88%	0.883	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-54.9	135.5	176.7	-72.5	-177.2	174.7	-178.1	-2.1	108.8	T533 Q537	T533-R535 PolarHBondContact O-N 3.37Å; R535-Q537 PolarHBondContact O-N 2.95Å
536	P	71.8	Confident	83.2	Confident	117 Å²	117	114.2 Å²	114.2	76%	0.76	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-49.3	140.5	171.8	-27.3	34.9	0	0	0	110.5	S538	P536-S538 PolarHBondContact O-N 2.74Å
537	Q	72.8	Confident	83	Confident	210 Å²	210	114.4 Å²	114.4	98%	0.981	59%	0.592	S	S	*	*			trans	-57.9	111.1	-178.5	-69.1	-174.5	-0.1	0	0	109.3	R535	R535-Q537 PolarHBondContact O-N 2.95Å
538	S	74.1	Confident	82.8	Confident	107 Å²	107	115.2 Å²	115.2	75%	0.748	59%	0.594	S	S	*	*			trans	-118	126.4	-173.7	-175.3	0	0	0	0	108.9	P536	P536-S538 PolarHBondContact O-N 2.74Å
539	V	80.1	Confident	82.6	Confident	72 Å²	72	120.4 Å²	120.4	44%	0.436	61%	0.608	S	S	.	*			trans	-61.4	128	178.9	-179.2	0	0	0	0	108.8	Y541 E543 A544	V539-Y541 PolarHBondContact O-N 2.96Å; V539-E543 HydrophobicContact CG1-CB 3.76Å; V539-E543 HydrophobicContact CG1-CG 3.66Å; V539-A544 HydrophobicContact CB-CB 4.4Å; V539-A544 HydrophobicContact CG1-CB 4.2Å
540	P	85.4	Confident	82.5	Confident	80 Å²	80	120.2 Å²	120.2	52%	0.519	61%	0.606	S	S	.	*			trans	-49.7	135.8	178	-28.6	34.4	0	0	0	112	R542 E543 A544	P540-R542 PolarHBondContact O-N 3.5Å; P540-E543 HydrophobicContact CB-CB 4.37Å; P540-E543 WeakPolarHBondContact CD-OE2 3.43Å; P540-E543 CarbonylContact O-C 3.51Å; P540-E543 WeakPolarHBondContact O-CA 3.3Å; P540-E543 WeakPolarHBondContact O-CB 3.31Å; P540-E543 PolarHBondContact O-N 3.49Å; P540-A544 PolarHBondContact O-N 2.82Å
541	Y	81.2	Confident	82.4	Confident	182 Å²	182	122.6 Å²	122.6	71%	0.714	61%	0.609	S	S	*	*	H	α-helix	trans	-53.3	-36	-169.9	-179.4	-113.4	0	0	0	114.5	V539 A544 L545	V539-Y541 PolarHBondContact O-N 2.96Å; Y541-A544 PolarHBondContact O-N 2.84Å; Y541-L545 HydrophobicContact CD1-CD1 4.05Å; Y541-L545 HydrophobicContact CE1-CD1 3.53Å; Y541-L545 HydrophobicContact CE1-CG 4.21Å; Y541-L545 HydrophobicContact CE2-CD1 4.34Å; Y541-L545 HydrophobicContact CE2-CD2 4.38Å; Y541-L545 HydrophobicContact CE2-CG 4.16Å; Y541-L545 WeakPolarHBondContact O-CB 3.27Å; Y541-L545 WeakPolarHBondContact O-CG 3.36Å; Y541-L545 PolarHBondContact O-N 3.3Å
542	R	84.8	Confident	82.3	Confident	225 Å²	225	120.1 Å²	120.1	85%	0.849	60%	0.599	S	S	*	*	H	α-helix	trans	-64.1	-39.5	174.6	-175	-179.9	-177.9	-178.7	1.3	112.7	P540 S546	P540-R542 PolarHBondContact O-N 3.5Å; R542-S546 PolarHBondContact O-N 3.4Å
543	E	85.6	Confident	82.2	Confident	101 Å²	101	115.8 Å²	115.8	47%	0.472	59%	0.588	S	S	.	*	H	α-helix	trans	-75.9	-38.6	177.3	-174.7	177.6	-176	0	0	110.8	V539 P540 L545 S546 N547	V539-E543 HydrophobicContact CG1-CB 3.76Å; V539-E543 HydrophobicContact CG1-CG 3.66Å; P540-E543 HydrophobicContact CB-CB 4.37Å; P540-E543 WeakPolarHBondContact CD-OE2 3.43Å; P540-E543 CarbonylContact O-C 3.51Å; P540-E543 WeakPolarHBondContact O-CA 3.3Å; P540-E543 WeakPolarHBondContact O-CB 3.31Å; P540-E543 PolarHBondContact O-N 3.49Å; E543-L545 VanDerWaalsContact C-N 3.31Å; E543-L545 PolarHBondContact O-N 3Å; E543-S546 CarbonylContact O-C 3.52Å; E543-S546 WeakPolarHBondContact O-CA 3.44Å; E543-S546 WeakPolarHBondContact O-CB 3.49Å; E543-S546 PolarHBondContact O-N 3.24Å; E543-S546 VanDerWaalsContact O-N 3.07Å; E543-N547 WeakPolarHBondContact O-CB 3.49Å; E543-N547 PolarHBondContact O-N 2.89Å; E543-N547 PolarHBondContact O-OD1 2.89Å
544	A	86.3	Confident	82.2	Confident	42 Å²	42	115.4 Å²	115.4	35%	0.347	59%	0.588	S	S	.	*	H	α-helix	trans	-60.3	-39.3	170.9	0	0	0	0	0	112.2	V539 P540 Y541 R548	V539-A544 HydrophobicContact CB-CB 4.4Å; V539-A544 HydrophobicContact CG1-CB 4.2Å; P540-A544 PolarHBondContact O-N 2.82Å; Y541-A544 PolarHBondContact O-N 2.84Å; A544-R548 WeakPolarHBondContact O-CB 3.38Å; A544-R548 PolarHBondContact O-N 3.39Å
545	L	84.8	Confident	82.6	Confident	67 Å²	67	113.6 Å²	113.6	35%	0.351	57%	0.568	S	S	.	*	H	α-helix	trans	-67.5	-37.1	171	-75.4	177.8	0	0	0	112.9	Y541 E543 R549	Y541-L545 HydrophobicContact CD1-CD1 4.05Å; Y541-L545 HydrophobicContact CE1-CD1 3.53Å; Y541-L545 HydrophobicContact CE1-CG 4.21Å; Y541-L545 HydrophobicContact CE2-CD1 4.34Å; Y541-L545 HydrophobicContact CE2-CD2 4.38Å; Y541-L545 HydrophobicContact CE2-CG 4.16Å; Y541-L545 WeakPolarHBondContact O-CB 3.27Å; Y541-L545 WeakPolarHBondContact O-CG 3.36Å; Y541-L545 PolarHBondContact O-N 3.3Å; E543-L545 VanDerWaalsContact C-N 3.31Å; E543-L545 PolarHBondContact O-N 3Å; L545-R549 WeakPolarHBondContact O-CG 3.37Å; L545-R549 PolarHBondContact O-N 2.75Å
546	S	87.1	Confident	83.4	Confident	57 Å²	57	108.2 Å²	108.2	40%	0.399	55%	0.553	S	S	.	*	H	α-helix	trans	-64.4	-49.7	174.8	-165.4	0	0	0	0	110.9	R542 E543 R548 R549 I550	R542-S546 PolarHBondContact O-N 3.4Å; E543-S546 CarbonylContact O-C 3.52Å; E543-S546 WeakPolarHBondContact O-CA 3.44Å; E543-S546 WeakPolarHBondContact O-CB 3.49Å; E543-S546 PolarHBondContact O-N 3.24Å; E543-S546 VanDerWaalsContact O-N 3.07Å; S546-R548 VanDerWaalsContact C-N 3.33Å; S546-R548 PolarHBondContact O-N 3.13Å; S546-R549 WeakPolarHBondContact O-CB 3.4Å; S546-R549 PolarHBondContact O-N 3.37Å; S546-R549 VanDerWaalsContact O-N 3.07Å; S546-I550 WeakPolarHBondContact O-CG1 3.32Å; S546-I550 PolarHBondContact O-N 3.41Å
547	N	87.6	Confident	84	Confident	65 Å²	65	106 Å²	106	35%	0.348	54%	0.54	S	S	.	.	H	α-helix	trans	-63.5	-38.7	178.6	-64.3	-5	0	0	0	110.8	E543 I550 L551	E543-N547 WeakPolarHBondContact O-CB 3.49Å; E543-N547 PolarHBondContact O-N 2.89Å; E543-N547 PolarHBondContact O-OD1 2.89Å; N547-I550 PolarHBondContact O-N 3.32Å; N547-L551 VanDerWaalsContact O-CB 3.3Å; N547-L551 WeakPolarHBondContact O-CB 3.44Å; N547-L551 WeakPolarHBondContact O-CG 3.3Å; N547-L551 PolarHBondContact O-N 3.03Å
548	R	87.5	Confident	84.7	Confident	175 Å²	175	102.6 Å²	102.6	66%	0.66	52%	0.518	S	S	*	.	H	α-helix	trans	-58.5	-48.9	169.3	176.4	178.8	163.4	159.5	-1.8	111.7	A544 S546 I550 L551 T552	A544-R548 WeakPolarHBondContact O-CB 3.38Å; A544-R548 PolarHBondContact O-N 3.39Å; S546-R548 VanDerWaalsContact C-N 3.33Å; S546-R548 PolarHBondContact O-N 3.13Å; R548-I550 PolarHBondContact O-N 3.01Å; R548-L551 PolarHBondContact O-N 3.18Å; R548-T552 WeakPolarHBondContact O-CB 3.26Å; R548-T552 PolarHBondContact O-N 2.93Å; R548-T552 PolarHBondContact O-OG1 2.93Å; R548-T552 VanDerWaalsContact O-OG1 3.07Å
549	R	88.1	Confident	85.3	Confident	192 Å²	192	101.6 Å²	101.6	73%	0.725	50%	0.502	S	S	*	.	H	α-helix	trans	-61	-44.3	178.8	-74.2	175.1	-178	-170.8	-0.2	111.8	L545 S546 T552 S553	L545-R549 WeakPolarHBondContact O-CG 3.37Å; L545-R549 PolarHBondContact O-N 2.75Å; S546-R549 WeakPolarHBondContact O-CB 3.4Å; S546-R549 PolarHBondContact O-N 3.37Å; S546-R549 VanDerWaalsContact O-N 3.07Å; R549-T552 PolarHBondContact O-N 3.24Å; R549-S553 WeakPolarHBondContact O-CB 3.29Å; R549-S553 PolarHBondContact O-N 3.45Å; R549-S553 PolarHBondContact O-OG 2.86Å
550	I	87.7	Confident	85.6	Confident	96 Å²	96	99.9 Å²	99.9	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-60.1	-49.8	176.6	-67.3	163.3	0	0	0	109.9	S546 N547 R548 T552 S553 S554	S546-I550 WeakPolarHBondContact O-CG1 3.32Å; S546-I550 PolarHBondContact O-N 3.41Å; N547-I550 PolarHBondContact O-N 3.32Å; R548-I550 PolarHBondContact O-N 3.01Å; I550-T552 PolarHBondContact O-N 3.37Å; I550-S553 PolarHBondContact O-N 3.41Å; I550-S553 PolarHBondContact O-OG 2.85Å; I550-S554 VanDerWaalsContact O-CB 3.25Å; I550-S554 WeakPolarHBondContact O-CB 3.4Å; I550-S554 PolarHBondContact O-N 2.82Å
551	L	85.8	Confident	85.7	Confident	117 Å²	117	100.8 Å²	100.8	61%	0.613	50%	0.499	S	S	*	.	H	α-helix	trans	-59.2	-46	176.7	-73.9	168.5	0	0	0	112.1	N547 R548 S554 T555	N547-L551 VanDerWaalsContact O-CB 3.3Å; N547-L551 WeakPolarHBondContact O-CB 3.44Å; N547-L551 WeakPolarHBondContact O-CG 3.3Å; N547-L551 PolarHBondContact O-N 3.03Å; R548-L551 PolarHBondContact O-N 3.18Å; L551-S554 CarbonylContact O-C 3.35Å; L551-S554 WeakPolarHBondContact O-CB 3.26Å; L551-S554 PolarHBondContact O-N 3.37Å; L551-T555 PolarHBondContact O-N 3.03Å; L551-T555 PolarHBondContact O-OG1 2.69Å; L551-T555 VanDerWaalsContact O-OG1 3.13Å
552	T	86	Confident	86	Confident	54 Å²	54	95.4 Å²	95.4	33%	0.331	49%	0.485	S	S	.	.	H	α-helix	trans	-60.5	-47.9	176.4	-62.5	0	0	0	0	111.6	R548 R549 I550 S554 T555 E556	R548-T552 WeakPolarHBondContact O-CB 3.26Å; R548-T552 PolarHBondContact O-N 2.93Å; R548-T552 PolarHBondContact O-OG1 2.93Å; R548-T552 VanDerWaalsContact O-OG1 3.07Å; R549-T552 PolarHBondContact O-N 3.24Å; I550-T552 PolarHBondContact O-N 3.37Å; T552-S554 PolarHBondContact O-N 3.43Å; T552-T555 WeakPolarHBondContact CA-OG1 3.33Å; T552-T555 PolarHBondContact O-N 3.3Å; T552-T555 PolarHBondContact O-OG1 3.12Å; T552-E556 HydrophobicContact CG2-CG 4.44Å; T552-E556 VanDerWaalsContact CG2-OE1 3.32Å; T552-E556 WeakPolarHBondContact CG2-OE1 3.45Å; T552-E556 WeakPolarHBondContact O-CB 3.22Å; T552-E556 VanDerWaalsContact O-CG 3.25Å; T552-E556 WeakPolarHBondContact O-CG 3.49Å; T552-E556 PolarHBondContact O-N 3.03Å
553	S	85.3	Confident	86.2	Confident	63 Å²	63	90.4 Å²	90.4	44%	0.441	47%	0.471	S	S	.	.	H	α-helix	trans	-65.2	-28.4	176.1	65.7	0	0	0	0	113.3	R549 I550 S557	R549-S553 WeakPolarHBondContact O-CB 3.29Å; R549-S553 PolarHBondContact O-N 3.45Å; R549-S553 PolarHBondContact O-OG 2.86Å; I550-S553 PolarHBondContact O-N 3.41Å; I550-S553 PolarHBondContact O-OG 2.85Å; S553-S557 WeakPolarHBondContact O-CB 3.45Å; S553-S557 PolarHBondContact O-N 3.44Å
554	S	83.6	Confident	86.3	Confident	72 Å²	72	91.7 Å²	91.7	50%	0.503	48%	0.477	S	S	.	.	H	α-helix	trans	-75	-39.1	175.2	-171.9	0	0	0	0	111.5	I550 L551 T552 R558	I550-S554 VanDerWaalsContact O-CB 3.25Å; I550-S554 WeakPolarHBondContact O-CB 3.4Å; I550-S554 PolarHBondContact O-N 2.82Å; L551-S554 CarbonylContact O-C 3.35Å; L551-S554 WeakPolarHBondContact O-CB 3.26Å; L551-S554 PolarHBondContact O-N 3.37Å; T552-S554 PolarHBondContact O-N 3.43Å; S554-R558 WeakPolarHBondContact O-CB 3.28Å; S554-R558 PolarHBondContact O-N 3.37Å
555	T	83.1	Confident	86.5	Confident	58 Å²	58	93.1 Å²	93.1	36%	0.356	48%	0.482	S	S	.	.	H	α-helix	trans	-67.2	-43.5	172.1	46.5	0	0	0	0	111.8	L551 T552 S557 R558 E559	L551-T555 PolarHBondContact O-N 3.03Å; L551-T555 PolarHBondContact O-OG1 2.69Å; L551-T555 VanDerWaalsContact O-OG1 3.13Å; T552-T555 WeakPolarHBondContact CA-OG1 3.33Å; T552-T555 PolarHBondContact O-N 3.3Å; T552-T555 PolarHBondContact O-OG1 3.12Å; T555-S557 PolarHBondContact O-N 3.44Å; T555-R558 PolarHBondContact O-N 3.17Å; T555-E559 WeakPolarHBondContact O-CB 3.43Å; T555-E559 WeakPolarHBondContact O-CG 3.48Å; T555-E559 PolarHBondContact O-N 3.02Å
556	E	83.4	Confident	86.7	Confident	120 Å²	120	95 Å²	95	56%	0.561	49%	0.489	S	S	*	.	H	α-helix	trans	-59.9	-45.9	174.7	-71.6	164.2	173.7	0	0	111.4	T552 E559 G560	T552-E556 HydrophobicContact CG2-CG 4.44Å; T552-E556 VanDerWaalsContact CG2-OE1 3.32Å; T552-E556 WeakPolarHBondContact CG2-OE1 3.45Å; T552-E556 WeakPolarHBondContact O-CB 3.22Å; T552-E556 VanDerWaalsContact O-CG 3.25Å; T552-E556 WeakPolarHBondContact O-CG 3.49Å; T552-E556 PolarHBondContact O-N 3.03Å; E556-E559 PolarHBondContact O-N 2.8Å; E556-G560 PolarHBondContact O-N 2.88Å
557	S	84.1	Confident	86.9	Confident	71 Å²	71	98.2 Å²	98.2	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-63.4	-44.7	175.6	-178.6	0	0	0	0	112.5	S553 T555 E559 G560 L561	S553-S557 WeakPolarHBondContact O-CB 3.45Å; S553-S557 PolarHBondContact O-N 3.44Å; T555-S557 PolarHBondContact O-N 3.44Å; S557-E559 VanDerWaalsContact C-N 3.34Å; S557-E559 PolarHBondContact O-N 2.87Å; S557-G560 PolarHBondContact O-N 3.11Å; S557-L561 WeakPolarHBondContact O-CB 3.32Å; S557-L561 WeakPolarHBondContact O-CG 3.36Å; S557-L561 PolarHBondContact O-N 3.27Å
558	R	87.6	Confident	86.8	Confident	138 Å²	138	97.9 Å²	97.9	52%	0.521	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-39.4	175.6	-178	-164.4	67.8	93.3	6.2	111.8	S554 T555 T562	S554-R558 WeakPolarHBondContact O-CB 3.28Å; S554-R558 PolarHBondContact O-N 3.37Å; T555-R558 PolarHBondContact O-N 3.17Å; R558-T562 WeakPolarHBondContact O-CB 3.4Å; R558-T562 PolarHBondContact O-N 2.96Å; R558-T562 PolarHBondContact O-OG1 3.18Å
559	E	85.8	Confident	86.9	Confident	87 Å²	87	95.1 Å²	95.1	41%	0.407	49%	0.494	S	S	.	.	H	α-helix	trans	-70.7	-41	177.5	-80	152.9	-143	0	0	111.6	T555 E556 S557 T562 Q563	T555-E559 WeakPolarHBondContact O-CB 3.43Å; T555-E559 WeakPolarHBondContact O-CG 3.48Å; T555-E559 PolarHBondContact O-N 3.02Å; E556-E559 PolarHBondContact O-N 2.8Å; S557-E559 VanDerWaalsContact C-N 3.34Å; S557-E559 PolarHBondContact O-N 2.87Å; E559-T562 PolarHBondContact O-N 3.03Å; E559-Q563 WeakPolarHBondContact O-CG 3.33Å; E559-Q563 PolarHBondContact O-N 3.13Å
560	G	86.7	Confident	87.1	Confident	36 Å²	36	89.9 Å²	89.9	37%	0.371	48%	0.478	S	S	.	.	H	α-helix	trans	-59.8	-44.5	170.4	0	0	0	0	0	112.8	E556 S557 Q563 Q564	E556-G560 PolarHBondContact O-N 2.88Å; S557-G560 PolarHBondContact O-N 3.11Å; G560-Q563 PolarHBondContact O-N 2.71Å; G560-Q564 WeakPolarHBondContact O-CB 3.29Å; G560-Q564 PolarHBondContact O-N 3.16Å
561	L	87.2	Confident	87.4	Confident	98 Å²	98	92.1 Å²	92.1	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-62	-40.5	172.7	-80.6	163.4	0	0	0	112.1	S557 Q564 V565	S557-L561 WeakPolarHBondContact O-CB 3.32Å; S557-L561 WeakPolarHBondContact O-CG 3.36Å; S557-L561 PolarHBondContact O-N 3.27Å; L561-Q564 PolarHBondContact O-N 3.41Å; L561-V565 WeakPolarHBondContact O-CG2 3.39Å; L561-V565 PolarHBondContact O-N 3.47Å
562	T	87.1	Confident	87.6	Confident	70 Å²	70	90.8 Å²	90.8	43%	0.429	48%	0.477	S	S	.	.	H	α-helix	trans	-65.1	-43.8	177.6	-55.4	0	0	0	0	111	R558 E559 Q564 V565 Q566	R558-T562 WeakPolarHBondContact O-CB 3.4Å; R558-T562 PolarHBondContact O-N 2.96Å; R558-T562 PolarHBondContact O-OG1 3.18Å; E559-T562 PolarHBondContact O-N 3.03Å; T562-Q564 PolarHBondContact O-N 3.26Å; T562-V565 PolarHBondContact O-N 2.84Å; T562-Q566 WeakPolarHBondContact O-CB 3.48Å; T562-Q566 PolarHBondContact O-N 3.47Å
563	Q	89.1	Confident	87.8	Confident	120 Å²	120	90.7 Å²	90.7	56%	0.561	48%	0.482	S	S	*	.	H	α-helix	trans	-62.9	-40.3	173.9	-71.1	177.2	16.3	0	0	111.9	E559 G560 Q566 Q567	E559-Q563 WeakPolarHBondContact O-CG 3.33Å; E559-Q563 PolarHBondContact O-N 3.13Å; G560-Q563 PolarHBondContact O-N 2.71Å; Q563-Q566 PolarHBondContact O-N 2.94Å; Q563-Q567 WeakPolarHBondContact O-CB 3.31Å; Q563-Q567 VanDerWaalsContact O-CG 3.25Å; Q563-Q567 WeakPolarHBondContact O-CG 3.25Å; Q563-Q567 PolarHBondContact O-N 2.83Å
564	Q	89.1	Confident	88.2	Confident	127 Å²	127	94.5 Å²	94.5	59%	0.593	49%	0.486	S	S	*	.	H	α-helix	trans	-65.4	-40.3	176.3	-170.6	178.3	10.7	0	0	112	G560 L561 T562 S568	G560-Q564 WeakPolarHBondContact O-CB 3.29Å; G560-Q564 PolarHBondContact O-N 3.16Å; L561-Q564 PolarHBondContact O-N 3.41Å; T562-Q564 PolarHBondContact O-N 3.26Å; Q564-S568 WeakPolarHBondContact O-CB 3.37Å; Q564-S568 PolarHBondContact O-N 2.87Å
565	V	89.1	Confident	88.5	Confident	73 Å²	73	95.4 Å²	95.4	44%	0.442	49%	0.485	S	S	.	.	H	α-helix	trans	-62.6	-48.5	172.9	168.2	0	0	0	0	110.3	L561 T562 Q567 S568 Q569	L561-V565 WeakPolarHBondContact O-CG2 3.39Å; L561-V565 PolarHBondContact O-N 3.47Å; T562-V565 PolarHBondContact O-N 2.84Å; V565-Q567 PolarHBondContact O-N 2.88Å; V565-S568 CarbonylContact O-C 3.5Å; V565-S568 WeakPolarHBondContact O-CA 3.48Å; V565-S568 WeakPolarHBondContact O-CB 3.48Å; V565-S568 PolarHBondContact O-N 3.25Å; V565-S568 PolarHBondContact O-OG 2.67Å; V565-Q569 HydrophobicContact CG1-CG 4.36Å; V565-Q569 WeakPolarHBondContact O-CG 3.36Å; V565-Q569 PolarHBondContact O-N 3.34Å
566	Q	90.4	Very high	88.8	Confident	107 Å²	107	97.7 Å²	97.7	50%	0.5	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-43.9	179.5	-172.8	170.1	-4	0	0	112.1	T562 Q563 S568 Q569 E570	T562-Q566 WeakPolarHBondContact O-CB 3.48Å; T562-Q566 PolarHBondContact O-N 3.47Å; Q563-Q566 PolarHBondContact O-N 2.94Å; Q566-S568 VanDerWaalsContact C-N 3.28Å; Q566-S568 PolarHBondContact O-N 3.37Å; Q566-Q569 PolarHBondContact O-N 2.9Å; Q566-E570 PolarHBondContact O-N 2.87Å
567	Q	90.7	Very high	89.2	Confident	124 Å²	124	98.5 Å²	98.5	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-60.8	-35.8	172.6	-73	172.7	16.6	0	0	112.5	Q563 V565 K571	Q563-Q567 WeakPolarHBondContact O-CB 3.31Å; Q563-Q567 VanDerWaalsContact O-CG 3.25Å; Q563-Q567 WeakPolarHBondContact O-CG 3.25Å; Q563-Q567 PolarHBondContact O-N 2.83Å; V565-Q567 PolarHBondContact O-N 2.88Å; Q567-K571 WeakPolarHBondContact O-CB 3.41Å; Q567-K571 PolarHBondContact O-N 3.35Å
568	S	85	Confident	89.6	Confident	57 Å²	57	100.1 Å²	100.1	40%	0.399	50%	0.495	S	S	.	.	H	α-helix	trans	-70	-38.3	174.9	79.9	0	0	0	0	112.3	Q564 V565 Q566 K571 I572	Q564-S568 WeakPolarHBondContact O-CB 3.37Å; Q564-S568 PolarHBondContact O-N 2.87Å; V565-S568 CarbonylContact O-C 3.5Å; V565-S568 WeakPolarHBondContact O-CA 3.48Å; V565-S568 WeakPolarHBondContact O-CB 3.48Å; V565-S568 PolarHBondContact O-N 3.25Å; V565-S568 PolarHBondContact O-OG 2.67Å; Q566-S568 VanDerWaalsContact C-N 3.28Å; Q566-S568 PolarHBondContact O-N 3.37Å; S568-K571 PolarHBondContact O-N 3.44Å; S568-I572 VanDerWaalsContact O-CG1 3.28Å; S568-I572 WeakPolarHBondContact O-CG1 3.13Å; S568-I572 PolarHBondContact O-N 2.65Å
569	Q	90.9	Very high	89.8	Confident	117 Å²	117	100.4 Å²	100.4	55%	0.547	50%	0.5	S	S	.	.	H	α-helix	trans	-67.5	-44.8	176.3	-72.6	170.5	-33.8	0	0	111.5	V565 Q566 K571 I572 A573	V565-Q569 HydrophobicContact CG1-CG 4.36Å; V565-Q569 WeakPolarHBondContact O-CG 3.36Å; V565-Q569 PolarHBondContact O-N 3.34Å; Q566-Q569 PolarHBondContact O-N 2.9Å; Q569-K571 VanDerWaalsContact C-N 3.28Å; Q569-K571 PolarHBondContact O-N 3.09Å; Q569-I572 PolarHBondContact O-N 2.9Å; Q569-A573 WeakPolarHBondContact O-CB 3.48Å; Q569-A573 PolarHBondContact O-N 3.27Å
570	E	92.6	Very high	90	Very high	82 Å²	82	102.4 Å²	102.4	38%	0.383	51%	0.51	S	S	.	.	H	α-helix	trans	-58.2	-40.6	171.5	-76.6	-177.7	-139.9	0	0	112.1	Q566 A573 R574	Q566-E570 PolarHBondContact O-N 2.87Å; E570-A573 PolarHBondContact O-N 3.03Å; E570-R574 VanDerWaalsContact O-CG 3.26Å; E570-R574 WeakPolarHBondContact O-CG 3.41Å; E570-R574 PolarHBondContact O-N 3.35Å; E570-R574 IonicContact OE2-CZ 3.27Å; E570-R574 IonicContact OE2-NH2 3.68Å; E570-R574 PolarHBondContact OE2-NH2 3.33Å
571	K	92.9	Very high	90.2	Very high	143 Å²	143	106 Å²	106	62%	0.622	52%	0.516	S	S	*	.	H	α-helix	trans	-67	-38.5	177.4	-173.6	176.2	179.6	-179.7	0	111.7	Q567 S568 Q569 L575	Q567-K571 WeakPolarHBondContact O-CB 3.41Å; Q567-K571 PolarHBondContact O-N 3.35Å; S568-K571 PolarHBondContact O-N 3.44Å; Q569-K571 VanDerWaalsContact C-N 3.28Å; Q569-K571 PolarHBondContact O-N 3.09Å; K571-L575 HydrophobicContact CG-CD1 4.24Å; K571-L575 VanDerWaalsContact O-CG 3.27Å; K571-L575 WeakPolarHBondContact O-CG 3.28Å; K571-L575 PolarHBondContact O-N 3.22Å; K571-L575 VanDerWaalsContact O-N 3.09Å
572	I	90.3	Very high	90.4	Very high	89 Å²	89	109.3 Å²	109.3	46%	0.456	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-50.8	173.3	-70.4	162.1	0	0	0	109.8	S568 Q569 R574 L575 E576	S568-I572 VanDerWaalsContact O-CG1 3.28Å; S568-I572 WeakPolarHBondContact O-CG1 3.13Å; S568-I572 PolarHBondContact O-N 2.65Å; Q569-I572 PolarHBondContact O-N 2.9Å; I572-R574 VanDerWaalsContact C-N 3.3Å; I572-R574 PolarHBondContact O-N 3.05Å; I572-L575 CarbonylContact O-C 2.93Å; I572-L575 WeakPolarHBondContact O-CA 3.33Å; I572-L575 WeakPolarHBondContact O-CB 3.43Å; I572-L575 PolarHBondContact O-N 3.07Å; I572-E576 HydrophobicContact CG2-CG 4.27Å; I572-E576 WeakPolarHBondContact O-CG 3.3Å; I572-E576 PolarHBondContact O-N 3Å
573	A	91.1	Very high	90.6	Very high	53 Å²	53	110.5 Å²	110.5	44%	0.438	53%	0.526	S	S	.	.	H	α-helix	trans	-58.9	-37.8	179.5	0	0	0	0	0	113	Q569 E570 E576 Q577	Q569-A573 WeakPolarHBondContact O-CB 3.48Å; Q569-A573 PolarHBondContact O-N 3.27Å; E570-A573 PolarHBondContact O-N 3.03Å; A573-E576 PolarHBondContact O-N 3.13Å; A573-Q577 WeakPolarHBondContact O-CB 3.39Å; A573-Q577 PolarHBondContact O-N 2.94Å
574	R	92	Very high	90.7	Very high	142 Å²	142	110 Å²	110	54%	0.536	53%	0.526	S	S	.	.	H	α-helix	trans	-65.9	-43.2	172.7	-69.8	175.4	-138	-176.9	3.4	112.2	E570 I572 E576 Q577 E578	E570-R574 VanDerWaalsContact O-CG 3.26Å; E570-R574 WeakPolarHBondContact O-CG 3.41Å; E570-R574 PolarHBondContact O-N 3.35Å; E570-R574 IonicContact OE2-CZ 3.27Å; E570-R574 IonicContact OE2-NH2 3.68Å; E570-R574 PolarHBondContact OE2-NH2 3.33Å; I572-R574 VanDerWaalsContact C-N 3.3Å; I572-R574 PolarHBondContact O-N 3.05Å; R574-E576 VanDerWaalsContact C-N 3.29Å; R574-E576 PolarHBondContact O-N 3.35Å; R574-Q577 PolarHBondContact O-N 3.21Å; R574-E578 WeakPolarHBondContact O-CB 3.17Å; R574-E578 WeakPolarHBondContact O-CG 3.23Å; R574-E578 PolarHBondContact O-N 3.36Å
575	L	90.1	Very high	90.8	Very high	92 Å²	92	108.4 Å²	108.4	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-66.7	-30.3	175.5	-70.9	167.5	0	0	0	112.4	K571 I572 K579	K571-L575 HydrophobicContact CG-CD1 4.24Å; K571-L575 VanDerWaalsContact O-CG 3.27Å; K571-L575 WeakPolarHBondContact O-CG 3.28Å; K571-L575 PolarHBondContact O-N 3.22Å; K571-L575 VanDerWaalsContact O-N 3.09Å; I572-L575 CarbonylContact O-C 2.93Å; I572-L575 WeakPolarHBondContact O-CA 3.33Å; I572-L575 WeakPolarHBondContact O-CB 3.43Å; I572-L575 PolarHBondContact O-N 3.07Å; L575-K579 VanDerWaalsContact O-CB 3.22Å; L575-K579 WeakPolarHBondContact O-CB 3.21Å; L575-K579 PolarHBondContact O-N 3.48Å
576	E	90.3	Very high	90.8	Very high	105 Å²	105	108 Å²	108	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-71.8	-42.3	172.4	-71.7	177.7	142.6	0	0	111.4	I572 A573 R574 K579 E580	I572-E576 HydrophobicContact CG2-CG 4.27Å; I572-E576 WeakPolarHBondContact O-CG 3.3Å; I572-E576 PolarHBondContact O-N 3Å; A573-E576 PolarHBondContact O-N 3.13Å; R574-E576 VanDerWaalsContact C-N 3.29Å; R574-E576 PolarHBondContact O-N 3.35Å; E576-K579 WeakPolarHBondContact O-CB 3.47Å; E576-K579 PolarHBondContact O-N 3.33Å; E576-E580 WeakPolarHBondContact O-CG 3.3Å; E576-E580 PolarHBondContact O-N 2.93Å
577	Q	92	Very high	90.7	Very high	138 Å²	138	107.9 Å²	107.9	65%	0.645	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-41	172.3	-171	-178.6	14.1	0	0	112.2	A573 R574 E580 H581	A573-Q577 WeakPolarHBondContact O-CB 3.39Å; A573-Q577 PolarHBondContact O-N 2.94Å; R574-Q577 PolarHBondContact O-N 3.21Å; Q577-E580 PolarHBondContact O-N 2.88Å; Q577-H581 WeakPolarHBondContact O-CB 3.48Å; Q577-H581 PolarHBondContact O-N 3.45Å
578	E	91.1	Very high	90.7	Very high	104 Å²	104	106.3 Å²	106.3	49%	0.486	52%	0.518	S	S	.	.	H	α-helix	trans	-62.7	-44	172.9	-76	172.8	-162.6	0	0	111.2	R574 E580 H581 W582	R574-E578 WeakPolarHBondContact O-CB 3.17Å; R574-E578 WeakPolarHBondContact O-CG 3.23Å; R574-E578 PolarHBondContact O-N 3.36Å; E578-E580 PolarHBondContact O-N 3.19Å; E578-H581 WeakPolarHBondContact O-CB 3.48Å; E578-H581 PolarHBondContact O-N 2.85Å; E578-W582 PolarHBondContact O-N 3.47Å
579	K	91.7	Very high	90.8	Very high	144 Å²	144	105.2 Å²	105.2	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-60.4	-41.9	174.4	170.4	-165.7	167.2	-156.9	0	111.9	L575 E576 L583	L575-K579 VanDerWaalsContact O-CB 3.22Å; L575-K579 WeakPolarHBondContact O-CB 3.21Å; L575-K579 PolarHBondContact O-N 3.48Å; E576-K579 WeakPolarHBondContact O-CB 3.47Å; E576-K579 PolarHBondContact O-N 3.33Å; K579-L583 VanDerWaalsContact O-CB 3.26Å; K579-L583 WeakPolarHBondContact O-CB 3.19Å; K579-L583 PolarHBondContact O-N 2.67Å
580	E	91.3	Very high	90.6	Very high	130 Å²	130	105.5 Å²	105.5	61%	0.607	52%	0.515	S	S	*	.	H	α-helix	trans	-68	-40.7	175	-74.2	-170.8	165.5	0	0	112.1	E576 Q577 E578 L583 L584	E576-E580 WeakPolarHBondContact O-CG 3.3Å; E576-E580 PolarHBondContact O-N 2.93Å; Q577-E580 PolarHBondContact O-N 2.88Å; E578-E580 PolarHBondContact O-N 3.19Å; E580-L583 PolarHBondContact O-N 2.98Å; E580-L584 WeakPolarHBondContact O-CB 3.35Å; E580-L584 WeakPolarHBondContact O-CG 3.29Å; E580-L584 PolarHBondContact O-N 2.74Å
581	H	91.3	Very high	90.4	Very high	110 Å²	110	104.8 Å²	104.8	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-57.6	-52.2	173.1	-179	-78.5	0	0	0	111.3	Q577 E578 L583 L584 E585	Q577-H581 WeakPolarHBondContact O-CB 3.48Å; Q577-H581 PolarHBondContact O-N 3.45Å; E578-H581 WeakPolarHBondContact O-CB 3.48Å; E578-H581 PolarHBondContact O-N 2.85Å; H581-L583 VanDerWaalsContact C-N 3.31Å; H581-L583 PolarHBondContact O-N 3.38Å; H581-L584 PolarHBondContact O-N 2.83Å; H581-E585 IonicContact CE1-OE2 3.92Å; H581-E585 PolarHBondContact CE1-OE2 2.74Å; H581-E585 VanDerWaalsContact CE1-OE2 3.27Å; H581-E585 IonicContact ND1-OE2 3.6Å; H581-E585 WeakPolarHBondContact O-CB 2.8Å; H581-E585 PolarHBondContact O-N 2.71Å
582	W	90.8	Very high	90.2	Very high	168 Å²	168	105.5 Å²	105.5	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-64.9	-32.3	178	-71.3	118.8	0	0	0	113	E578 E585 A586	E578-W582 PolarHBondContact O-N 3.47Å; W582-E585 VanDerWaalsContact CZ3-OE2 3.27Å; W582-E585 WeakPolarHBondContact CZ3-OE2 3.2Å; W582-A586 WeakPolarHBondContact O-CB 3.37Å; W582-A586 PolarHBondContact O-N 2.97Å
583	L	90.9	Very high	90	Very high	96 Å²	96	106.3 Å²	106.3	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-67.9	-44	173.5	-178.8	62.8	0	0	0	111.7	K579 E580 H581 A586 Q587	K579-L583 VanDerWaalsContact O-CB 3.26Å; K579-L583 WeakPolarHBondContact O-CB 3.19Å; K579-L583 PolarHBondContact O-N 2.67Å; E580-L583 PolarHBondContact O-N 2.98Å; H581-L583 VanDerWaalsContact C-N 3.31Å; H581-L583 PolarHBondContact O-N 3.38Å; L583-A586 PolarHBondContact O-N 2.76Å; L583-Q587 WeakPolarHBondContact O-CB 3.43Å; L583-Q587 VanDerWaalsContact O-CG 3.29Å; L583-Q587 WeakPolarHBondContact O-CG 3.49Å; L583-Q587 PolarHBondContact O-N 3.19Å
584	L	92.4	Very high	89.7	Confident	109 Å²	109	108.2 Å²	108.2	57%	0.571	52%	0.519	S	S	*	.	H	α-helix	trans	-67	-39.4	175.6	-73.1	171.8	0	0	0	111.7	E580 H581 Q587 L588	E580-L584 WeakPolarHBondContact O-CB 3.35Å; E580-L584 WeakPolarHBondContact O-CG 3.29Å; E580-L584 PolarHBondContact O-N 2.74Å; H581-L584 PolarHBondContact O-N 2.83Å; L584-Q587 PolarHBondContact O-N 3.5Å; L584-L588 VanDerWaalsContact O-CB 3.31Å; L584-L588 WeakPolarHBondContact O-CB 3.3Å; L584-L588 PolarHBondContact O-N 2.91Å
585	E	90.7	Very high	89.5	Confident	93 Å²	93	107.9 Å²	107.9	44%	0.435	52%	0.522	S	S	.	.	H	α-helix	trans	-68.7	-37.2	176.1	-172.8	162.4	-154.3	0	0	111.7	H581 W582 L588 G589	H581-E585 IonicContact CE1-OE2 3.92Å; H581-E585 PolarHBondContact CE1-OE2 2.74Å; H581-E585 VanDerWaalsContact CE1-OE2 3.27Å; H581-E585 IonicContact ND1-OE2 3.6Å; H581-E585 WeakPolarHBondContact O-CB 2.8Å; H581-E585 PolarHBondContact O-N 2.71Å; W582-E585 VanDerWaalsContact CZ3-OE2 3.27Å; W582-E585 WeakPolarHBondContact CZ3-OE2 3.2Å; E585-L588 PolarHBondContact O-N 3.09Å; E585-G589 PolarHBondContact O-N 3.49Å
586	A	88.3	Confident	89.2	Confident	65 Å²	65	107.7 Å²	107.7	54%	0.537	52%	0.518	S	S	.	.	H	α-helix	trans	-65.6	-39.1	170.5	0	0	0	0	0	112.5	W582 L583 G589 K590	W582-A586 WeakPolarHBondContact O-CB 3.37Å; W582-A586 PolarHBondContact O-N 2.97Å; L583-A586 PolarHBondContact O-N 2.76Å; A586-G589 PolarHBondContact O-N 3.33Å; A586-K590 WeakPolarHBondContact O-CB 3.45Å; A586-K590 PolarHBondContact O-N 2.83Å
587	Q	89.4	Confident	88.9	Confident	105 Å²	105	106.8 Å²	106.8	49%	0.491	52%	0.517	S	S	.	.	H	α-helix	trans	-66.7	-43.6	173.2	-74.5	176.9	22.3	0	0	112	L583 L584 G589 K590 V591	L583-Q587 WeakPolarHBondContact O-CB 3.43Å; L583-Q587 VanDerWaalsContact O-CG 3.29Å; L583-Q587 WeakPolarHBondContact O-CG 3.49Å; L583-Q587 PolarHBondContact O-N 3.19Å; L584-Q587 PolarHBondContact O-N 3.5Å; Q587-G589 VanDerWaalsContact C-N 3.31Å; Q587-G589 PolarHBondContact O-N 2.9Å; Q587-K590 WeakPolarHBondContact O-CB 3.45Å; Q587-K590 PolarHBondContact O-N 3.32Å; Q587-V591 WeakPolarHBondContact O-CG2 3.41Å; Q587-V591 PolarHBondContact O-N 3.07Å
588	L	89.1	Confident	88.4	Confident	91 Å²	91	105.6 Å²	105.6	48%	0.476	51%	0.512	S	S	.	.	H	α-helix	trans	-65.3	-37.7	176.1	-162.2	86.1	0	0	0	111	L584 E585 V591 R592	L584-L588 VanDerWaalsContact O-CB 3.31Å; L584-L588 WeakPolarHBondContact O-CB 3.3Å; L584-L588 PolarHBondContact O-N 2.91Å; E585-L588 PolarHBondContact O-N 3.09Å; L588-V591 PolarHBondContact O-N 3.47Å; L588-R592 WeakPolarHBondContact O-CB 3.45Å; L588-R592 VanDerWaalsContact O-CG 3.28Å; L588-R592 WeakPolarHBondContact O-CG 3.41Å; L588-R592 PolarHBondContact O-N 3.03Å
589	G	87.1	Confident	88.1	Confident	34 Å²	34	107.4 Å²	107.4	35%	0.351	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-44.3	170.5	0	0	0	0	0	112	E585 A586 Q587 R592 L593	E585-G589 PolarHBondContact O-N 3.49Å; A586-G589 PolarHBondContact O-N 3.33Å; Q587-G589 VanDerWaalsContact C-N 3.31Å; Q587-G589 PolarHBondContact O-N 2.9Å; G589-R592 PolarHBondContact O-N 2.99Å; G589-L593 WeakPolarHBondContact O-CB 3.5Å; G589-L593 PolarHBondContact O-N 2.78Å
590	K	87.3	Confident	87.6	Confident	123 Å²	123	104.4 Å²	104.4	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-63.3	-43.2	173.9	-174.7	172.3	-178.7	-71.9	0	112.2	A586 Q587 L593 E594	A586-K590 WeakPolarHBondContact O-CB 3.45Å; A586-K590 PolarHBondContact O-N 2.83Å; Q587-K590 WeakPolarHBondContact O-CB 3.45Å; Q587-K590 PolarHBondContact O-N 3.32Å; K590-L593 PolarHBondContact O-N 3.39Å; K590-E594 IonicContact NZ-OE1 3.63Å; K590-E594 PolarHBondContact NZ-OE1 3.31Å; K590-E594 WeakPolarHBondContact O-CB 3.5Å; K590-E594 VanDerWaalsContact O-CG 3.28Å; K590-E594 WeakPolarHBondContact O-CG 3.49Å; K590-E594 PolarHBondContact O-N 2.87Å
591	V	88.8	Confident	87.1	Confident	67 Å²	67	100.3 Å²	100.3	41%	0.406	49%	0.492	S	S	.	.	H	α-helix	trans	-68.9	-33.1	176.1	171.9	0	0	0	0	112	Q587 L588 K595	Q587-V591 WeakPolarHBondContact O-CG2 3.41Å; Q587-V591 PolarHBondContact O-N 3.07Å; L588-V591 PolarHBondContact O-N 3.47Å; V591-K595 HydrophobicContact CG1-CD 4.41Å; V591-K595 WeakPolarHBondContact O-CB 3.41Å; V591-K595 VanDerWaalsContact O-CG 3.31Å; V591-K595 WeakPolarHBondContact O-CG 3.31Å; V591-K595 PolarHBondContact O-N 3.48Å
592	R	88.6	Confident	86.4	Confident	157 Å²	157	98.5 Å²	98.5	59%	0.592	49%	0.486	S	S	*	.	H	α-helix	trans	-66.9	-44.4	170.1	-77.6	172.8	178.1	169.2	0.7	111.1	L588 G589 K595 E596	L588-R592 WeakPolarHBondContact O-CB 3.45Å; L588-R592 VanDerWaalsContact O-CG 3.28Å; L588-R592 WeakPolarHBondContact O-CG 3.41Å; L588-R592 PolarHBondContact O-N 3.03Å; G589-R592 PolarHBondContact O-N 2.99Å; R592-K595 PolarHBondContact O-N 2.9Å; R592-E596 PolarHBondContact O-N 3.41Å
593	L	85.4	Confident	85.7	Confident	107 Å²	107	95.2 Å²	95.2	56%	0.56	48%	0.48	S	S	*	.	H	α-helix	trans	-62.4	-42	175.2	-169.5	79.2	0	0	0	111.2	G589 K590 E596 N597	G589-L593 WeakPolarHBondContact O-CB 3.5Å; G589-L593 PolarHBondContact O-N 2.78Å; K590-L593 PolarHBondContact O-N 3.39Å; L593-E596 PolarHBondContact O-N 2.87Å; L593-N597 WeakPolarHBondContact O-CB 3.29Å; L593-N597 PolarHBondContact O-N 3.16Å; L593-N597 PolarHBondContact O-ND2 3.4Å; L593-N597 PolarHBondContact O-OD1 2.87Å
594	E	86	Confident	84.9	Confident	93 Å²	93	96.6 Å²	96.6	44%	0.435	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-40.2	174.3	-75.5	165.6	174.9	0	0	111.6	K590 Q598	K590-E594 IonicContact NZ-OE1 3.63Å; K590-E594 PolarHBondContact NZ-OE1 3.31Å; K590-E594 WeakPolarHBondContact O-CB 3.5Å; K590-E594 VanDerWaalsContact O-CG 3.28Å; K590-E594 WeakPolarHBondContact O-CG 3.49Å; K590-E594 PolarHBondContact O-N 2.87Å; E594-Q598 WeakPolarHBondContact O-CB 3.2Å; E594-Q598 PolarHBondContact O-N 3.38Å
595	K	87.3	Confident	83.8	Confident	135 Å²	135	94.3 Å²	94.3	59%	0.587	48%	0.481	S	S	*	.	H	α-helix	trans	-70.3	-37.3	175.2	-78.5	179.3	178	-176.4	0	113.8	V591 R592 Q598 R599	V591-K595 HydrophobicContact CG1-CD 4.41Å; V591-K595 WeakPolarHBondContact O-CB 3.41Å; V591-K595 VanDerWaalsContact O-CG 3.31Å; V591-K595 WeakPolarHBondContact O-CG 3.31Å; V591-K595 PolarHBondContact O-N 3.48Å; R592-K595 PolarHBondContact O-N 2.9Å; K595-Q598 PolarHBondContact O-N 3.33Å; K595-R599 WeakPolarHBondContact O-CB 3.4Å; K595-R599 WeakPolarHBondContact O-CG 3.34Å; K595-R599 PolarHBondContact O-N 3.47Å
596	E	83.1	Confident	82.6	Confident	87 Å²	87	95.9 Å²	95.9	41%	0.407	49%	0.489	S	S	.	.	H	α-helix	trans	-76.8	-32	174.8	-65	-50.2	138.1	0	0	111.4	R592 L593 Q598 R599 I600	R592-E596 PolarHBondContact O-N 3.41Å; L593-E596 PolarHBondContact O-N 2.87Å; E596-Q598 VanDerWaalsContact C-N 3.35Å; E596-R599 CarbonylContact O-C 3.48Å; E596-R599 PolarHBondContact O-N 2.62Å; E596-R599 WeakPolarHBondContact OE1-CD 2.78Å; E596-R599 IonicContact OE1-CZ 3.51Å; E596-R599 IonicContact OE1-NE 3.83Å; E596-R599 IonicContact OE1-NH1 2.66Å; E596-R599 PolarHBondContact OE1-NH1 3.07Å; E596-R599 WeakPolarHBondContact OE2-CD 3.17Å; E596-R599 IonicContact OE2-NH1 3.31Å; E596-R599 PolarHBondContact OE2-NH1 3.48Å; E596-I600 WeakPolarHBondContact O-CB 3.22Å; E596-I600 WeakPolarHBondContact O-CD1 3.49Å; E596-I600 WeakPolarHBondContact O-CG1 3.4Å; E596-I600 PolarHBondContact O-N 3.23Å
597	N	84.6	Confident	81	Confident	86 Å²	86	96.4 Å²	96.4	46%	0.46	48%	0.482	S	S	.	.	H	α-helix	trans	-66.1	-37.7	167.7	-72.4	-11.2	0	0	0	111.4	L593 I600 A601	L593-N597 WeakPolarHBondContact O-CB 3.29Å; L593-N597 PolarHBondContact O-N 3.16Å; L593-N597 PolarHBondContact O-ND2 3.4Å; L593-N597 PolarHBondContact O-OD1 2.87Å; N597-I600 PolarHBondContact O-N 3.02Å; N597-A601 WeakPolarHBondContact O-CB 3.48Å; N597-A601 PolarHBondContact O-N 3.46Å
598	Q	82.3	Confident	79.5	Confident	114 Å²	114	94.9 Å²	94.9	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-65.6	-42.9	172.6	-169.5	68.1	55.7	0	0	110.6	E594 K595 E596 A601 D602	E594-Q598 WeakPolarHBondContact O-CB 3.2Å; E594-Q598 PolarHBondContact O-N 3.38Å; K595-Q598 PolarHBondContact O-N 3.33Å; E596-Q598 VanDerWaalsContact C-N 3.35Å; Q598-A601 CarbonylContact O-C 3.52Å; Q598-A601 PolarHBondContact O-N 2.94Å; Q598-D602 PolarHBondContact NE2-OD1 2.92Å; Q598-D602 WeakPolarHBondContact O-CB 3.34Å; Q598-D602 PolarHBondContact O-N 2.84Å
599	R	84.4	Confident	77.8	Confident	142 Å²	142	94.7 Å²	94.7	54%	0.536	50%	0.499	S	S	.	.	H	α-helix	trans	-64.8	-37	172.5	-80.4	171	160.7	-176.2	0.1	113.1	K595 E596 D602 L603	K595-R599 WeakPolarHBondContact O-CB 3.4Å; K595-R599 WeakPolarHBondContact O-CG 3.34Å; K595-R599 PolarHBondContact O-N 3.47Å; E596-R599 CarbonylContact O-C 3.48Å; E596-R599 PolarHBondContact O-N 2.62Å; E596-R599 WeakPolarHBondContact OE1-CD 2.78Å; E596-R599 IonicContact OE1-CZ 3.51Å; E596-R599 IonicContact OE1-NE 3.83Å; E596-R599 IonicContact OE1-NH1 2.66Å; E596-R599 PolarHBondContact OE1-NH1 3.07Å; E596-R599 WeakPolarHBondContact OE2-CD 3.17Å; E596-R599 IonicContact OE2-NH1 3.31Å; E596-R599 PolarHBondContact OE2-NH1 3.48Å; R599-D602 PolarHBondContact O-N 2.84Å; R599-L603 WeakPolarHBondContact O-CA 3.24Å; R599-L603 WeakPolarHBondContact O-CB 3.36Å; R599-L603 WeakPolarHBondContact O-CG 3.42Å; R599-L603 PolarHBondContact O-N 3.19Å
600	I	81.3	Confident	75.7	Confident	80 Å²	80	95.2 Å²	95.2	41%	0.41	50%	0.5	S	S	.	.	H	α-helix	trans	-66.3	-44.2	174.4	-73.1	162.4	0	0	0	108.7	E596 N597 D602 L603 E604	E596-I600 WeakPolarHBondContact O-CB 3.22Å; E596-I600 WeakPolarHBondContact O-CD1 3.49Å; E596-I600 WeakPolarHBondContact O-CG1 3.4Å; E596-I600 PolarHBondContact O-N 3.23Å; N597-I600 PolarHBondContact O-N 3.02Å; I600-D602 PolarHBondContact O-N 2.96Å; I600-L603 CarbonylContact O-C 3.58Å; I600-L603 PolarHBondContact O-N 2.79Å; I600-E604 HydrophobicContact CG2-CG 4.2Å; I600-E604 WeakPolarHBondContact O-CA 3.43Å; I600-E604 WeakPolarHBondContact O-CB 3.42Å; I600-E604 WeakPolarHBondContact O-CG 3.45Å; I600-E604 PolarHBondContact O-N 2.9Å
601	A	80.1	Confident	73.7	Confident	44 Å²	44	93.4 Å²	93.4	36%	0.364	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-39.6	173.8	0	0	0	0	0	112.8	N597 Q598 E604 A605	N597-A601 WeakPolarHBondContact O-CB 3.48Å; N597-A601 PolarHBondContact O-N 3.46Å; Q598-A601 CarbonylContact O-C 3.52Å; Q598-A601 PolarHBondContact O-N 2.94Å; A601-E604 PolarHBondContact O-N 3.43Å; A601-A605 VanDerWaalsContact O-CB 3.22Å; A601-A605 WeakPolarHBondContact O-CB 3.49Å; A601-A605 PolarHBondContact O-N 2.9Å
602	D	77.8	Confident	71.5	Confident	72 Å²	72	94.4 Å²	94.4	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-69.4	-36.1	176.3	-66.5	-18.7	0	0	0	111.1	Q598 R599 I600 Q606	Q598-D602 PolarHBondContact NE2-OD1 2.92Å; Q598-D602 WeakPolarHBondContact O-CB 3.34Å; Q598-D602 PolarHBondContact O-N 2.84Å; R599-D602 PolarHBondContact O-N 2.84Å; I600-D602 PolarHBondContact O-N 2.96Å; D602-Q606 VanDerWaalsContact O-CB 3.24Å; D602-Q606 WeakPolarHBondContact O-CB 3.27Å; D602-Q606 WeakPolarHBondContact O-CG 3.45Å; D602-Q606 PolarHBondContact O-N 3.19Å; D602-Q606 PolarHBondContact O-NE2 2.88Å
603	L	75.3	Confident	69.2	Low	99 Å²	99	90.3 Å²	90.3	52%	0.518	53%	0.526	S	S	.	.	H	α-helix	trans	-77.9	-28.1	174.5	-74.9	169.6	0	0	0	112.3	R599 I600 L607	R599-L603 WeakPolarHBondContact O-CA 3.24Å; R599-L603 WeakPolarHBondContact O-CB 3.36Å; R599-L603 WeakPolarHBondContact O-CG 3.42Å; R599-L603 PolarHBondContact O-N 3.19Å; I600-L603 CarbonylContact O-C 3.58Å; I600-L603 PolarHBondContact O-N 2.79Å; L603-L607 WeakPolarHBondContact O-CA 3.4Å; L603-L607 WeakPolarHBondContact O-CB 3.38Å; L603-L607 WeakPolarHBondContact O-CD1 3.48Å; L603-L607 WeakPolarHBondContact O-CG 3.48Å; L603-L607 PolarHBondContact O-N 3.28Å
604	E	73.8	Confident	66.7	Low	126 Å²	126	88 Å²	88	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-75.8	-33.3	170.9	-79.3	177.2	169.8	0	0	110.6	I600 A601 A608	I600-E604 HydrophobicContact CG2-CG 4.2Å; I600-E604 WeakPolarHBondContact O-CA 3.43Å; I600-E604 WeakPolarHBondContact O-CB 3.42Å; I600-E604 WeakPolarHBondContact O-CG 3.45Å; I600-E604 PolarHBondContact O-N 2.9Å; A601-E604 PolarHBondContact O-N 3.43Å; E604-A608 WeakPolarHBondContact O-CB 3.41Å; E604-A608 PolarHBondContact O-N 3.44Å
605	A	69.9	Low	63.9	Low	61 Å²	61	91.2 Å²	91.2	50%	0.504	53%	0.534	S	S	.	.	H	α-helix	trans	-72	-41.5	170.2	0	0	0	0	0	111.6	A601 A608 A609	A601-A605 VanDerWaalsContact O-CB 3.22Å; A601-A605 WeakPolarHBondContact O-CB 3.49Å; A601-A605 PolarHBondContact O-N 2.9Å; A605-A608 PolarHBondContact O-N 2.9Å; A605-A609 WeakPolarHBondContact O-CB 3.19Å; A605-A609 PolarHBondContact O-N 2.78Å
606	Q	64.1	Low	61	Low	126 Å²	126	89.1 Å²	89.1	59%	0.589	54%	0.537	S	S	*	.	H	α-helix	trans	-71.8	-32.1	173.3	-74.6	167.9	69.1	0	0	112.2	D602 A609 A610	D602-Q606 VanDerWaalsContact O-CB 3.24Å; D602-Q606 WeakPolarHBondContact O-CB 3.27Å; D602-Q606 WeakPolarHBondContact O-CG 3.45Å; D602-Q606 PolarHBondContact O-N 3.19Å; D602-Q606 PolarHBondContact O-NE2 2.88Å; Q606-A609 PolarHBondContact O-N 2.86Å; Q606-A610 WeakPolarHBondContact O-CB 3.29Å; Q606-A610 PolarHBondContact O-N 3.07Å
607	L	55.7	Low	58.4	Low	76 Å²	76	91 Å²	91	40%	0.398	56%	0.56	S	S	.	*	H	α-helix	trans	-71.8	-36.2	168.3	-83.3	161.6	0	0	0	111	L603 A609 A610 L611	L603-L607 WeakPolarHBondContact O-CA 3.4Å; L603-L607 WeakPolarHBondContact O-CB 3.38Å; L603-L607 WeakPolarHBondContact O-CD1 3.48Å; L603-L607 WeakPolarHBondContact O-CG 3.48Å; L603-L607 PolarHBondContact O-N 3.28Å; L607-A609 VanDerWaalsContact C-N 3.29Å; L607-A609 PolarHBondContact O-N 3.33Å; L607-A610 CarbonylContact O-C 3.56Å; L607-A610 PolarHBondContact O-N 2.99Å; L607-A610 VanDerWaalsContact O-N 3.08Å; L607-L611 HydrophobicContact CB-CD1 4.01Å; L607-L611 HydrophobicContact CB-CG 4.48Å; L607-L611 HydrophobicContact CD2-CG 4.5Å; L607-L611 WeakPolarHBondContact O-CA 3.31Å; L607-L611 WeakPolarHBondContact O-CB 3.41Å; L607-L611 WeakPolarHBondContact O-CD1 3.23Å; L607-L611 WeakPolarHBondContact O-CG 3.41Å; L607-L611 PolarHBondContact O-N 2.89Å
608	A	58	Low	55.7	Low	72 Å²	72	94.8 Å²	94.8	60%	0.595	57%	0.574	S	S	*	*	H	α-helix	trans	-62.1	-39.5	171.3	0	0	0	0	0	111.1	E604 A605 A610	E604-A608 WeakPolarHBondContact O-CB 3.41Å; E604-A608 PolarHBondContact O-N 3.44Å; A605-A608 PolarHBondContact O-N 2.9Å; A608-A610 VanDerWaalsContact C-N 3.35Å
609	A	52.8	Low	53	Low	88 Å²	88	95.7 Å²	95.7	73%	0.727	59%	0.588	S	S	*	*	H	α-helix	trans	-67	-32.8	171	0	0	0	0	0	113	A605 Q606 L607	A605-A609 WeakPolarHBondContact O-CB 3.19Å; A605-A609 PolarHBondContact O-N 2.78Å; Q606-A609 PolarHBondContact O-N 2.86Å; L607-A609 VanDerWaalsContact C-N 3.29Å; L607-A609 PolarHBondContact O-N 3.33Å
610	A	42.8	Very low	50.2	Low	44 Å²	44	92.7 Å²	92.7	36%	0.364	59%	0.593	S	S	.	*	H	α-helix	trans	-91.9	-8.9	179.3	0	0	0	0	0	114.6	Q606 L607 A608 G612 G613 S614	Q606-A610 WeakPolarHBondContact O-CB 3.29Å; Q606-A610 PolarHBondContact O-N 3.07Å; L607-A610 CarbonylContact O-C 3.56Å; L607-A610 PolarHBondContact O-N 2.99Å; L607-A610 VanDerWaalsContact O-N 3.08Å; A608-A610 VanDerWaalsContact C-N 3.35Å; A610-G612 PolarHBondContact O-N 3.32Å; A610-G613 CarbonylContact O-C 3.55Å; A610-G613 VanDerWaalsContact O-CA 3.25Å; A610-G613 WeakPolarHBondContact O-CA 3.35Å; A610-G613 PolarHBondContact O-N 3.35Å; A610-S614 WeakPolarHBondContact O-CB 3.44Å; A610-S614 PolarHBondContact O-N 2.93Å
611	L	45.9	Very low	47.6	Very low	85 Å²	85	95.1 Å²	95.1	45%	0.445	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.3	11	-177.6	-79.7	163.4	0	0	0	113	L607 Q615	L607-L611 HydrophobicContact CB-CD1 4.01Å; L607-L611 HydrophobicContact CB-CG 4.48Å; L607-L611 HydrophobicContact CD2-CG 4.5Å; L607-L611 WeakPolarHBondContact O-CA 3.31Å; L607-L611 WeakPolarHBondContact O-CB 3.41Å; L607-L611 WeakPolarHBondContact O-CD1 3.23Å; L607-L611 WeakPolarHBondContact O-CG 3.41Å; L607-L611 PolarHBondContact O-N 2.89Å; L611-Q615 HydrophobicContact CD2-CG 3.53Å
612	G	42.8	Very low	45	Very low	88 Å²	88	101 Å²	101	91%	0.907	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	4.5	145.9	0	0	0	0	0	114	A610	A610-G612 PolarHBondContact O-N 3.32Å
613	G	40.4	Very low	42.7	Very low	72 Å²	72	101 Å²	101	74%	0.742	66%	0.655	S	S	*	*	S	Bend	trans	-173.1	44.4	-174	0	0	0	0	0	113.5	A610	A610-G613 CarbonylContact O-C 3.55Å; A610-G613 VanDerWaalsContact O-CA 3.25Å; A610-G613 WeakPolarHBondContact O-CA 3.35Å; A610-G613 PolarHBondContact O-N 3.35Å
614	S	32.1	Very low	40.5	Very low	58 Å²	58	107 Å²	107	41%	0.406	67%	0.671	S	S	.	*			trans	-152.6	-177.7	-178.3	-176.9	0	0	0	0	110.3	A610	A610-S614 WeakPolarHBondContact O-CB 3.44Å; A610-S614 PolarHBondContact O-N 2.93Å
615	Q	27.8	Very low	38.3	Very low	160 Å²	160	107.4 Å²	107.4	75%	0.748	68%	0.676	S	S	*	*			trans	73.7	145.9	-153.1	-54.1	-175.3	5.7	0	0	113.7	L611	L611-Q615 HydrophobicContact CD2-CG 3.53Å
616	S	26.9	Very low	36.1	Very low	92 Å²	92	110.1 Å²	110.1	64%	0.643	69%	0.686	S	S	*	*			cis	-169.7	156.1	-28.8	56.5	0	0	0	0	106.1
617	S	27	Very low	34.4	Very low	127 Å²	127	112.1 Å²	112.1	89%	0.888	70%	0.696	S	S	*	*			trans	-142.1	132.1	161.5	-75.5	0	0	0	0	109.1
618	Q	28.7	Very low	32.9	Very low	164 Å²	164	113.8 Å²	113.8	77%	0.766	71%	0.713	S	S	*	*			trans	-101.1	176.4	-177.7	-64.3	-178.8	-21.3	0	0	110.5
619	T	25.3	Very low	31.3	Very low	133 Å²	133	116 Å²	116	82%	0.816	72%	0.716	S	S	*	*			trans	79.9	145.8	155.2	67.7	0	0	0	0	120
620	A	25.2	Very low	30	Very low	79 Å²	79	119.4 Å²	119.4	65%	0.653	72%	0.716	S	S	*	*			trans	93.2	103.1	149	0	0	0	0	0	119.9
621	T	26.4	Very low	29.2	Very low	131 Å²	131	125.7 Å²	125.7	80%	0.804	74%	0.738	S	S	*	*				71.1	160.5	129.2	51.8	0	0	0	0	121.6
622	D	27.3	Very low	28.3	Very low	167 Å²	167	125.3 Å²	125.3	89%	0.893	75%	0.747	S	S	*	*			trans	64.8	159	173.8	-73.8	-28.3	0	0	0	118.3
623	G	29	Very low	27.5	Very low	73 Å²	73	129.8 Å²	129.8	75%	0.753	75%	0.745	S	S	*	*			cis	-147	176.5	5.4	0	0	0	0	0	114.7
624	R	28.5	Very low	26.8	Very low	226 Å²	226	132.7 Å²	132.7	85%	0.853	75%	0.748	S	S	*	*			trans	-133.9	138.9	-170.6	171.6	-176.6	177.3	-163.7	0.6	111.7
625	L	27.1	Very low	26.5	Very low	133 Å²	133	134 Å²	134	70%	0.696	76%	0.763	S	S	*	*			trans	72.7	167.7	163.4	-81.3	167.8	0	0	0	119.5
626	T	24.7	Very low	26.4	Very low	119 Å²	119	133.7 Å²	133.7	73%	0.73	76%	0.761	S	S	*	*			trans	67.6	154.3	173.7	58.2	0	0	0	0	117.7
627	Q	27.6	Very low	26.3	Very low	168 Å²	168	138 Å²	138	79%	0.785	77%	0.768	S	S	*	*			cis	162.7	124.8	-37.2	-107.4	-176.1	-60.5	0	0	107.3
628	S	24.1	Very low	26.2	Very low	110 Å²	110	136 Å²	136	77%	0.769	76%	0.76	S	S	*	*			trans	-159.9	136.8	157.1	-29.3	0	0	0	0	105.3
629	N	24	Very low	26.1	Very low	120 Å²	120	133.6 Å²	133.6	64%	0.642	77%	0.768	S	S	*	*				61.6	133.8	52.7	-68.5	42.1	0	0	0	111.7
630	E	26.7	Very low	26.1	Very low	159 Å²	159	130.5 Å²	130.5	74%	0.743	76%	0.762	S	S	*	*			cis	-150.8	174.4	-7.1	-109.7	148.1	160	0	0	105
631	E	26.6	Very low	26.3	Very low	176 Å²	176	134.9 Å²	134.9	82%	0.822	77%	0.767	S	S	*	*			cis	177.2	161.3	49.3	-142.1	161.7	-148.3	0	0	109.7
632	A	25.6	Very low	26.3	Very low	77 Å²	77	135.6 Å²	135.6	64%	0.636	76%	0.761	S	S	*	*			trans	42.6	125.8	137.2	0	0	0	0	0	122.7
633	E	27.1	Very low	26.2	Very low	182 Å²	182	135 Å²	135	85%	0.85	76%	0.755	S	S	*	*				69.9	148.4	80.1	-68.1	-166.8	174.8	0	0	115.4
634	T	24.2	Very low	26.1	Very low	133 Å²	133	137.6 Å²	137.6	82%	0.816	76%	0.756	S	S	*	*			cis	-145.2	177.7	18.9	-14.4	0	0	0	0	113.2
635	A	26.2	Very low	26.1	Very low	86 Å²	86	134.2 Å²	134.2	71%	0.711	75%	0.754	S	S	*	*			trans	-88.5	165.5	-175.6	0	0	0	0	0	116.2
636	Q	26.5	Very low	26	Very low	153 Å²	153	133.7 Å²	133.7	72%	0.715	76%	0.76	S	S	*	*				177	135	118	-99.4	-179.2	64.9	0	0	116.2
637	K	25.2	Very low	26.4	Very low	181 Å²	181	134.9 Å²	134.9	79%	0.787	77%	0.767	S	S	*	*			trans	60.4	165.7	145.2	-67.7	170.7	-178.5	154.4	0	119.7
638	A	24.2	Very low	27	Very low	86 Å²	86	132 Å²	132	71%	0.711	77%	0.765	S	S	*	*			cis	-170.8	148	-37.3	0	0	0	0	0	109.3
639	A	25.8	Very low	27.7	Very low	114 Å²	114	135.3 Å²	135.3	94%	0.942	77%	0.774	S	S	*	*			trans	62.6	156.4	-179.1	0	0	0	0	0	115.5
640	G	26.1	Very low	28.5	Very low	67 Å²	67	135.7 Å²	135.7	69%	0.691	78%	0.78	S	S	*	*			cis	162.9	155.8	-9	0	0	0	0	0	111.9
641	K	29.8	Very low	29.1	Very low	172 Å²	172	131.8 Å²	131.8	75%	0.748	78%	0.782	S	S	*	*			trans	68.7	137.9	-176.5	-74.8	-174.2	168	-74.2	0	115.6
642	E	26.1	Very low	29.3	Very low	146 Å²	146	131.8 Å²	131.8	68%	0.682	78%	0.784	S	S	*	*			cis	-155.8	169.2	-11.7	-148.6	139.9	-136.4	0	0	112.8
643	M	25.6	Very low	29.5	Very low	155 Å²	155	135.8 Å²	135.8	76%	0.764	79%	0.794	S	S	*	*			trans	-35.4	150.4	172.8	-114.3	55.7	83.8	0	0	114.9
644	T	26.4	Very low	29.7	Very low	126 Å²	126	132.1 Å²	132.1	77%	0.773	79%	0.787	S	S	*	*				-152.2	123.9	59.8	-56.4	0	0	0	0	114.6
645	L	29.5	Very low	30.3	Very low	156 Å²	156	132.1 Å²	132.1	82%	0.817	79%	0.787	S	S	*	*			trans	-88.5	134.6	157.9	-83.8	160.6	0	0	0	109.5
646	C	25	Very low	30.5	Very low	122 Å²	122	134.2 Å²	134.2	82%	0.824	79%	0.792	S	S	*	*			trans	-141	105.2	159.8	-112.5	0	0	0	0	109.7	S648	C646-S648 PolarHBondContact O-N 2.96Å
647	T	31.5	Very low	31.6	Very low	144 Å²	144	133 Å²	133	88%	0.883	80%	0.797	S	S	*	*			trans	-68.3	120	172.8	46.7	0	0	0	0	110.5
648	S	39.9	Very low	31.8	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	80%	0.798	S	S	*	*			trans	-136.1	125.4	166.2	-170.9	0	0	0	0	109.1	C646 V650	C646-S648 PolarHBondContact O-N 2.96Å; S648-V650 PolarHBondContact O-N 3.5Å; S648-V650 VanDerWaalsContact O-N 3.14Å
649	L	40.6	Very low	32.5	Very low	181 Å²	181	133.9 Å²	133.9	95%	0.948	80%	0.803	S	S	*	*			trans	-92.1	68.1	-166.7	-161.7	78.3	0	0	0	111.9
650	V	39.1	Very low	33.5	Very low	128 Å²	128	136.7 Å²	136.7	78%	0.776	80%	0.797	S	S	*	*	S	Bend	trans	-128.4	133.9	165.2	-179.4	0	0	0	0	107.7	S648	S648-V650 PolarHBondContact O-N 3.5Å; S648-V650 VanDerWaalsContact O-N 3.14Å
651	G	39.2	Very low	34.4	Very low	76 Å²	76	142.4 Å²	142.4	78%	0.784	81%	0.805	S	S	*	*			trans	-64.5	138.5	-164.7	0	0	0	0	0	114.7
652	M	31.2	Very low	35.4	Very low	177 Å²	177	140.3 Å²	140.3	87%	0.872	81%	0.807	S	S	*	*			trans	-73.4	134	167.1	-65.2	-175.6	-65.9	0	0	110.2
653	L	31	Very low	36.7	Very low	160 Å²	160	135.6 Å²	135.6	84%	0.838	80%	0.797	S	S	*	*			trans	-96.4	102.7	171	-152.1	161.1	0	0	0	107.7
654	C	30.5	Very low	38.3	Very low	105 Å²	105	134.5 Å²	134.5	71%	0.709	79%	0.794	S	S	*	*			trans	-80.9	127.1	174.5	-68.8	0	0	0	0	109.4
655	T	35.8	Very low	39.7	Very low	133 Å²	133	134.3 Å²	134.3	82%	0.816	79%	0.785	S	S	*	*			trans	-78	129.3	176.4	45.8	0	0	0	0	111.1
656	T	32.3	Very low	41.1	Very low	131 Å²	131	132.8 Å²	132.8	80%	0.804	77%	0.773	S	S	*	*			trans	-125.9	141.3	160.4	46.8	0	0	0	0	108.9
657	P	48	Very low	43.2	Very low	128 Å²	128	130.1 Å²	130.1	83%	0.831	76%	0.756	S	S	*	*			trans	-93.6	128.4	-160.5	34	-34.1	0	0	0	113.5
658	T	29.6	Very low	45.4	Very low	131 Å²	131	129.3 Å²	129.3	80%	0.804	74%	0.737	S	S	*	*			trans	-133.1	123	156.9	46.6	0	0	0	0	110.1
659	N	38.9	Very low	47.2	Very low	153 Å²	153	128.8 Å²	128.8	82%	0.818	72%	0.723	S	S	*	*			trans	-47.6	142.1	154.1	-86.5	3.5	0	0	0	109.5
660	E	46.6	Very low	49	Very low	173 Å²	173	125.8 Å²	125.8	81%	0.808	70%	0.704	S	S	*	*	S	Bend	cis	-136.4	179.9	15.9	-61.5	-178.4	139.9	0	0	112.3
661	H	46.5	Very low	51	Low	188 Å²	188	125.8 Å²	125.8	87%	0.87	70%	0.699	S	S	*	*			trans	75.3	33.6	166.2	-119.6	-42.6	0	0	0	119.3
662	V	50.6	Low	53.1	Low	128 Å²	128	125.5 Å²	125.5	78%	0.776	68%	0.678	S	S	*	*			trans	-69.5	128.6	164.8	-179.3	0	0	0	0	110.7
663	G	53.6	Low	55.7	Low	46 Å²	46	122 Å²	122	47%	0.474	66%	0.659	S	S	.	*	S	Bend	trans	168.8	-72.2	176.4	0	0	0	0	0	113.5	S667	G663-S667 WeakPolarHBondContact O-CB 3.38Å
664	D	59	Low	58.3	Low	133 Å²	133	118.4 Å²	118.4	71%	0.711	64%	0.643	S	S	*	*	H	α-helix	trans	-76.3	-35	-171.9	-80	-34.1	0	0	0	114.3	S667 R668	D664-S667 PolarHBondContact O-N 3.38Å; D664-R668 WeakPolarHBondContact O-CB 3.48Å; D664-R668 PolarHBondContact O-N 2.99Å
665	E	55.7	Low	61.1	Low	122 Å²	122	119 Å²	119	57%	0.57	64%	0.635	S	S	*	*	H	α-helix	trans	-65.5	-48.8	-173.6	-79.9	-69.6	88.8	0	0	113.4	R668 E669	E665-R668 PolarHBondContact O-N 2.82Å; E665-R668 IonicContact OE1-CZ 2.75Å; E665-R668 IonicContact OE1-NE 3.15Å; E665-R668 PolarHBondContact OE1-NE 2.84Å; E665-R668 IonicContact OE1-NH2 3.94Å; E665-R668 PolarHBondContact OE1-NH2 3.12Å; E665-R668 IonicContact OE2-CZ 2.69Å; E665-R668 IonicContact OE2-NH2 2.72Å; E665-R668 PolarHBondContact OE2-NH2 3.24Å; E665-E669 PolarHBondContact O-N 3.04Å
666	E	57.9	Low	63.7	Low	123 Å²	123	119.7 Å²	119.7	58%	0.575	62%	0.624	S	S	*	*	H	α-helix	trans	-67.5	-40.3	177.8	-65.3	-167.7	137.8	0	0	111.4	R668 E669 Q670	E666-R668 PolarHBondContact O-N 3.46Å; E666-E669 PolarHBondContact O-N 3.41Å; E666-Q670 WeakPolarHBondContact O-CB 3.07Å; E666-Q670 WeakPolarHBondContact O-CG 3.46Å; E666-Q670 PolarHBondContact O-N 2.87Å
667	S	68.8	Low	66.3	Low	67 Å²	67	120.4 Å²	120.4	47%	0.469	62%	0.62	S	S	.	*	H	α-helix	trans	-57.4	-48	173.6	-179.5	0	0	0	0	111	G663 D664 E669 Q670 L671	G663-S667 WeakPolarHBondContact O-CB 3.38Å; D664-S667 PolarHBondContact O-N 3.38Å; S667-E669 PolarHBondContact O-N 3.38Å; S667-Q670 PolarHBondContact O-N 3.43Å; S667-L671 VanDerWaalsContact O-CB 3.32Å; S667-L671 WeakPolarHBondContact O-CB 3.37Å; S667-L671 PolarHBondContact O-N 2.87Å
668	R	78.1	Confident	68.3	Low	126 Å²	126	117.9 Å²	117.9	48%	0.475	60%	0.602	S	S	.	*	H	α-helix	trans	-60.2	-45.5	176.2	-177.1	178.8	69.2	73.8	-3.3	111.9	D664 E665 E666 L671 I672	D664-R668 WeakPolarHBondContact O-CB 3.48Å; D664-R668 PolarHBondContact O-N 2.99Å; E665-R668 PolarHBondContact O-N 2.82Å; E665-R668 IonicContact OE1-CZ 2.75Å; E665-R668 IonicContact OE1-NE 3.15Å; E665-R668 PolarHBondContact OE1-NE 2.84Å; E665-R668 IonicContact OE1-NH2 3.94Å; E665-R668 PolarHBondContact OE1-NH2 3.12Å; E665-R668 IonicContact OE2-CZ 2.69Å; E665-R668 IonicContact OE2-NH2 2.72Å; E665-R668 PolarHBondContact OE2-NH2 3.24Å; E666-R668 PolarHBondContact O-N 3.46Å; R668-L671 PolarHBondContact O-N 3.24Å; R668-I672 HydrophobicContact CG-CD1 4Å; R668-I672 WeakPolarHBondContact O-CB 3.25Å; R668-I672 WeakPolarHBondContact O-CD1 3.3Å; R668-I672 WeakPolarHBondContact O-CG1 3.36Å; R668-I672 PolarHBondContact O-N 3.32Å
669	E	78.7	Confident	71.2	Confident	96 Å²	96	116.8 Å²	116.8	45%	0.449	58%	0.583	S	S	.	*	H	α-helix	trans	-68.9	-39.1	179.4	-151.7	-153.1	170.6	0	0	112.3	E665 E666 S667 I672 K673	E665-E669 PolarHBondContact O-N 3.04Å; E666-E669 PolarHBondContact O-N 3.41Å; S667-E669 PolarHBondContact O-N 3.38Å; E669-I672 PolarHBondContact O-N 2.87Å; E669-K673 VanDerWaalsContact CD-CE 3.42Å; E669-K673 WeakPolarHBondContact O-CB 3.49Å; E669-K673 WeakPolarHBondContact O-CG 3.45Å; E669-K673 PolarHBondContact O-N 3.35Å; E669-K673 WeakPolarHBondContact OE1-CE 3.33Å; E669-K673 IonicContact OE1-NZ 3.83Å; E669-K673 PolarHBondContact OE1-NZ 2.95Å; E669-K673 IonicContact OE2-NZ 2.61Å; E669-K673 PolarHBondContact OE2-NZ 3.43Å
670	Q	78.3	Confident	73.7	Confident	118 Å²	118	113.8 Å²	113.8	55%	0.551	57%	0.57	S	S	*	*	H	α-helix	trans	-65.7	-38.5	174.6	-71.4	171.5	17.9	0	0	111.8	E666 S667 K673 T674	E666-Q670 WeakPolarHBondContact O-CB 3.07Å; E666-Q670 WeakPolarHBondContact O-CG 3.46Å; E666-Q670 PolarHBondContact O-N 2.87Å; S667-Q670 PolarHBondContact O-N 3.43Å; Q670-K673 PolarHBondContact O-N 3.46Å; Q670-T674 VanDerWaalsContact O-CB 3.27Å; Q670-T674 WeakPolarHBondContact O-CB 3.36Å; Q670-T674 PolarHBondContact O-N 2.85Å; Q670-T674 PolarHBondContact O-OG1 3.48Å
671	L	81.4	Confident	75.7	Confident	127 Å²	127	107.2 Å²	107.2	67%	0.665	55%	0.549	S	S	*	.	H	α-helix	trans	-66	-40.5	174.6	-154.7	75.8	0	0	0	111.4	S667 R668 T674 H675	S667-L671 VanDerWaalsContact O-CB 3.32Å; S667-L671 WeakPolarHBondContact O-CB 3.37Å; S667-L671 PolarHBondContact O-N 2.87Å; R668-L671 PolarHBondContact O-N 3.24Å; L671-T674 PolarHBondContact O-N 3.21Å; L671-H675 WeakPolarHBondContact O-CB 3.36Å; L671-H675 PolarHBondContact O-N 3.44Å
672	I	83.2	Confident	77.8	Confident	70 Å²	70	102 Å²	102	36%	0.359	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-47	174.4	-72.4	166.3	0	0	0	111.3	R668 E669 T674 H675 Y676	R668-I672 HydrophobicContact CG-CD1 4Å; R668-I672 WeakPolarHBondContact O-CB 3.25Å; R668-I672 WeakPolarHBondContact O-CD1 3.3Å; R668-I672 WeakPolarHBondContact O-CG1 3.36Å; R668-I672 PolarHBondContact O-N 3.32Å; E669-I672 PolarHBondContact O-N 2.87Å; I672-T674 PolarHBondContact O-N 3.5Å; I672-H675 PolarHBondContact O-N 2.95Å; I672-Y676 HydrophobicContact CG2-CD2 3.71Å; I672-Y676 HydrophobicContact CG2-CE2 3.72Å; I672-Y676 VanDerWaalsContact O-CD2 3.29Å; I672-Y676 WeakPolarHBondContact O-CD2 3.48Å; I672-Y676 PolarHBondContact O-N 2.94Å
673	K	85.8	Confident	79.8	Confident	105 Å²	105	100 Å²	100	46%	0.457	51%	0.51	S	S	.	.	H	α-helix	trans	-59.1	-45.8	175	-75.8	166	179.8	163.3	0	111.1	E669 Q670 Y676 M677	E669-K673 VanDerWaalsContact CD-CE 3.42Å; E669-K673 WeakPolarHBondContact O-CB 3.49Å; E669-K673 WeakPolarHBondContact O-CG 3.45Å; E669-K673 PolarHBondContact O-N 3.35Å; E669-K673 WeakPolarHBondContact OE1-CE 3.33Å; E669-K673 IonicContact OE1-NZ 3.83Å; E669-K673 PolarHBondContact OE1-NZ 2.95Å; E669-K673 IonicContact OE2-NZ 2.61Å; E669-K673 PolarHBondContact OE2-NZ 3.43Å; Q670-K673 PolarHBondContact O-N 3.46Å; K673-Y676 PolarHBondContact O-N 3.22Å; K673-M677 WeakPolarHBondContact O-CB 3.38Å; K673-M677 WeakPolarHBondContact O-CG 3.48Å; K673-M677 PolarHBondContact O-N 3.13Å
674	T	85.8	Confident	81.5	Confident	83 Å²	83	101.1 Å²	101.1	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-43.7	177.8	-58.8	0	0	0	0	112	Q670 L671 I672 T678	Q670-T674 VanDerWaalsContact O-CB 3.27Å; Q670-T674 WeakPolarHBondContact O-CB 3.36Å; Q670-T674 PolarHBondContact O-N 2.85Å; Q670-T674 PolarHBondContact O-OG1 3.48Å; L671-T674 PolarHBondContact O-N 3.21Å; I672-T674 PolarHBondContact O-N 3.5Å; T674-T678 VanDerWaalsContact O-CB 3.3Å; T674-T678 WeakPolarHBondContact O-CB 3.37Å; T674-T678 PolarHBondContact O-N 3.31Å; T674-T678 PolarHBondContact O-OG1 2.9Å
675	H	87.9	Confident	83	Confident	117 Å²	117	98.4 Å²	98.4	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-61.6	-47.6	175.3	172.5	-97.5	0	0	0	111.7	L671 I672 T678 R679	L671-H675 WeakPolarHBondContact O-CB 3.36Å; L671-H675 PolarHBondContact O-N 3.44Å; I672-H675 PolarHBondContact O-N 2.95Å; H675-T678 PolarHBondContact O-N 3.35Å; H675-R679 VanDerWaalsContact O-CB 3.31Å; H675-R679 WeakPolarHBondContact O-CB 3.44Å; H675-R679 PolarHBondContact O-N 3.36Å
676	Y	90.8	Very high	84.7	Confident	149 Å²	149	98 Å²	98	58%	0.584	49%	0.493	S	S	*	.	H	α-helix	trans	-69.7	-36.9	178.9	-77	-58.8	0	0	0	113.2	I672 K673 R679 V680	I672-Y676 HydrophobicContact CG2-CD2 3.71Å; I672-Y676 HydrophobicContact CG2-CE2 3.72Å; I672-Y676 VanDerWaalsContact O-CD2 3.29Å; I672-Y676 WeakPolarHBondContact O-CD2 3.48Å; I672-Y676 PolarHBondContact O-N 2.94Å; K673-Y676 PolarHBondContact O-N 3.22Å; Y676-R679 PolarHBondContact O-N 2.87Å; Y676-V680 WeakPolarHBondContact O-CB 3.35Å; Y676-V680 VanDerWaalsContact O-CG2 3.3Å; Y676-V680 WeakPolarHBondContact O-CG2 3.44Å; Y676-V680 PolarHBondContact O-N 3.04Å
677	M	88.3	Confident	86.3	Confident	146 Å²	146	97.9 Å²	97.9	72%	0.719	50%	0.496	S	S	*	.	H	α-helix	trans	-63.8	-44.3	172.6	-76.4	-178.4	66.3	0	0	111.7	K673 R679 V680 G681	K673-M677 WeakPolarHBondContact O-CB 3.38Å; K673-M677 WeakPolarHBondContact O-CG 3.48Å; K673-M677 PolarHBondContact O-N 3.13Å; M677-R679 VanDerWaalsContact C-N 3.34Å; M677-R679 PolarHBondContact O-N 3.11Å; M677-V680 PolarHBondContact O-N 2.83Å; M677-G681 PolarHBondContact O-N 3.09Å
678	T	89.9	Confident	87.3	Confident	75 Å²	75	100.6 Å²	100.6	46%	0.46	50%	0.502	S	S	.	.	H	α-helix	trans	-58.4	-47.8	173.5	-56.4	0	0	0	0	110.4	T674 H675 V680 G681 E682	T674-T678 VanDerWaalsContact O-CB 3.3Å; T674-T678 WeakPolarHBondContact O-CB 3.37Å; T674-T678 PolarHBondContact O-N 3.31Å; T674-T678 PolarHBondContact O-OG1 2.9Å; H675-T678 PolarHBondContact O-N 3.35Å; T678-V680 VanDerWaalsContact C-N 3.34Å; T678-V680 PolarHBondContact O-N 2.97Å; T678-G681 CarbonylContact O-C 3.6Å; T678-G681 WeakPolarHBondContact O-CA 3.45Å; T678-G681 PolarHBondContact O-N 2.98Å; T678-G681 VanDerWaalsContact O-N 3.09Å; T678-E682 WeakPolarHBondContact O-CG 3.29Å; T678-E682 PolarHBondContact O-N 3.44Å
679	R	90.4	Very high	87.9	Confident	108 Å²	108	98.1 Å²	98.1	41%	0.408	50%	0.5	S	S	.	.	H	α-helix	trans	-66.1	-33.1	-179.7	-172.3	54.3	175.5	-178.6	0.9	113.3	H675 Y676 M677 E682 L683	H675-R679 VanDerWaalsContact O-CB 3.31Å; H675-R679 WeakPolarHBondContact O-CB 3.44Å; H675-R679 PolarHBondContact O-N 3.36Å; Y676-R679 PolarHBondContact O-N 2.87Å; M677-R679 VanDerWaalsContact C-N 3.34Å; M677-R679 PolarHBondContact O-N 3.11Å; R679-E682 WeakPolarHBondContact CD-OE2 3.35Å; R679-E682 IonicContact CZ-OE2 2.73Å; R679-E682 IonicContact NE-OE2 2.82Å; R679-E682 IonicContact NH1-OE2 3.49Å; R679-E682 PolarHBondContact NH1-OE2 3.22Å; R679-L683 HydrophobicContact CG-CD1 4.25Å; R679-L683 WeakPolarHBondContact O-CB 3.38Å; R679-L683 VanDerWaalsContact O-CG 3.24Å; R679-L683 WeakPolarHBondContact O-CG 3.36Å; R679-L683 PolarHBondContact O-N 2.63Å
680	V	90.2	Very high	88.2	Confident	89 Å²	89	97 Å²	97	54%	0.539	50%	0.503	S	S	.	.	H	α-helix	trans	-66.4	-43.6	170.6	167.9	0	0	0	0	110.1	Y676 M677 T678 E682 L683 T684	Y676-V680 WeakPolarHBondContact O-CB 3.35Å; Y676-V680 VanDerWaalsContact O-CG2 3.3Å; Y676-V680 WeakPolarHBondContact O-CG2 3.44Å; Y676-V680 PolarHBondContact O-N 3.04Å; M677-V680 PolarHBondContact O-N 2.83Å; T678-V680 VanDerWaalsContact C-N 3.34Å; T678-V680 PolarHBondContact O-N 2.97Å; V680-E682 PolarHBondContact O-N 3.13Å; V680-L683 PolarHBondContact O-N 3.1Å; V680-T684 WeakPolarHBondContact O-CB 3.03Å; V680-T684 PolarHBondContact O-N 3.44Å; V680-T684 PolarHBondContact O-OG1 3.27Å
681	G	90.2	Very high	88.7	Confident	35 Å²	35	96.4 Å²	96.4	36%	0.361	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-43.8	173.9	0	0	0	0	0	113.7	M677 T678 T684 T685	M677-G681 PolarHBondContact O-N 3.09Å; T678-G681 CarbonylContact O-C 3.6Å; T678-G681 WeakPolarHBondContact O-CA 3.45Å; T678-G681 PolarHBondContact O-N 2.98Å; T678-G681 VanDerWaalsContact O-N 3.09Å; G681-T684 PolarHBondContact O-N 3.01Å; G681-T685 WeakPolarHBondContact O-CB 3.43Å; G681-T685 WeakPolarHBondContact O-CG2 3.41Å; G681-T685 PolarHBondContact O-N 2.68Å; G681-T685 PolarHBondContact O-OG1 3.38Å
682	E	90.6	Very high	89.1	Confident	79 Å²	79	93.6 Å²	93.6	37%	0.369	49%	0.494	S	S	.	.	H	α-helix	trans	-58.8	-47.2	172.6	-71.8	176.6	173.9	0	0	111.9	T678 R679 V680 T685 Q686	T678-E682 WeakPolarHBondContact O-CG 3.29Å; T678-E682 PolarHBondContact O-N 3.44Å; R679-E682 WeakPolarHBondContact CD-OE2 3.35Å; R679-E682 IonicContact CZ-OE2 2.73Å; R679-E682 IonicContact NE-OE2 2.82Å; R679-E682 IonicContact NH1-OE2 3.49Å; R679-E682 PolarHBondContact NH1-OE2 3.22Å; V680-E682 PolarHBondContact O-N 3.13Å; E682-T685 WeakPolarHBondContact CA-OG1 3.48Å; E682-T685 PolarHBondContact O-N 2.9Å; E682-T685 PolarHBondContact O-OG1 3.34Å; E682-Q686 VanDerWaalsContact O-CB 3.31Å; E682-Q686 WeakPolarHBondContact O-CB 3.2Å; E682-Q686 VanDerWaalsContact O-CG 3.22Å; E682-Q686 WeakPolarHBondContact O-CG 3.49Å; E682-Q686 PolarHBondContact O-N 3.49Å
683	L	91.1	Very high	89.6	Confident	87 Å²	87	95.8 Å²	95.8	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-69.1	-36.5	-179.7	-71.1	170.1	0	0	0	112	R679 V680 L687	R679-L683 HydrophobicContact CG-CD1 4.25Å; R679-L683 WeakPolarHBondContact O-CB 3.38Å; R679-L683 VanDerWaalsContact O-CG 3.24Å; R679-L683 WeakPolarHBondContact O-CG 3.36Å; R679-L683 PolarHBondContact O-N 2.63Å; V680-L683 PolarHBondContact O-N 3.1Å; L683-L687 VanDerWaalsContact O-CB 3.28Å; L683-L687 WeakPolarHBondContact O-CB 3.43Å; L683-L687 PolarHBondContact O-N 3.39Å
684	T	89.4	Confident	89.8	Confident	68 Å²	68	93.4 Å²	93.4	42%	0.417	50%	0.502	S	S	.	.	H	α-helix	trans	-65.9	-44.6	174.5	-61.4	0	0	0	0	111.7	V680 G681 L687 Q688	V680-T684 WeakPolarHBondContact O-CB 3.03Å; V680-T684 PolarHBondContact O-N 3.44Å; V680-T684 PolarHBondContact O-OG1 3.27Å; G681-T684 PolarHBondContact O-N 3.01Å; T684-L687 PolarHBondContact O-N 2.89Å; T684-Q688 WeakPolarHBondContact O-CG 3.38Å; T684-Q688 PolarHBondContact O-N 3.08Å
685	T	91	Very high	90	Very high	76 Å²	76	93.9 Å²	93.9	47%	0.466	50%	0.504	S	S	.	.	H	α-helix	trans	-68.6	-39.4	177.2	49.8	0	0	0	0	112	G681 E682 L687 Q688 V689	G681-T685 WeakPolarHBondContact O-CB 3.43Å; G681-T685 WeakPolarHBondContact O-CG2 3.41Å; G681-T685 PolarHBondContact O-N 2.68Å; G681-T685 PolarHBondContact O-OG1 3.38Å; E682-T685 WeakPolarHBondContact CA-OG1 3.48Å; E682-T685 PolarHBondContact O-N 2.9Å; E682-T685 PolarHBondContact O-OG1 3.34Å; T685-L687 VanDerWaalsContact C-N 3.34Å; T685-L687 PolarHBondContact O-N 3.27Å; T685-Q688 PolarHBondContact O-N 3.04Å; T685-V689 WeakPolarHBondContact O-CB 3.38Å; T685-V689 VanDerWaalsContact O-CG2 3.3Å; T685-V689 WeakPolarHBondContact O-CG2 3.41Å; T685-V689 PolarHBondContact O-N 2.78Å
686	Q	91.3	Very high	90.1	Very high	113 Å²	113	93.2 Å²	93.2	53%	0.528	50%	0.501	S	S	.	.	H	α-helix	trans	-61.4	-40.2	171.5	-75	176.8	18.7	0	0	112.2	E682 V689 S690	E682-Q686 VanDerWaalsContact O-CB 3.31Å; E682-Q686 WeakPolarHBondContact O-CB 3.2Å; E682-Q686 VanDerWaalsContact O-CG 3.22Å; E682-Q686 WeakPolarHBondContact O-CG 3.49Å; E682-Q686 PolarHBondContact O-N 3.49Å; Q686-V689 PolarHBondContact O-N 3.39Å; Q686-S690 WeakPolarHBondContact O-CB 3.41Å; Q686-S690 PolarHBondContact O-N 2.88Å
687	L	91.5	Very high	90	Very high	122 Å²	122	92.1 Å²	92.1	64%	0.639	50%	0.499	S	S	*	.	H	α-helix	trans	-64.1	-46.6	175.8	-176.8	62.6	0	0	0	111.5	L683 T684 T685 V689 S690 D691	L683-L687 VanDerWaalsContact O-CB 3.28Å; L683-L687 WeakPolarHBondContact O-CB 3.43Å; L683-L687 PolarHBondContact O-N 3.39Å; T684-L687 PolarHBondContact O-N 2.89Å; T685-L687 VanDerWaalsContact C-N 3.34Å; T685-L687 PolarHBondContact O-N 3.27Å; L687-V689 VanDerWaalsContact C-N 3.35Å; L687-V689 PolarHBondContact O-N 2.93Å; L687-S690 WeakPolarHBondContact O-CB 3.48Å; L687-S690 PolarHBondContact O-N 3.35Å; L687-S690 VanDerWaalsContact O-N 3.14Å; L687-D691 WeakPolarHBondContact O-CB 3.39Å; L687-D691 PolarHBondContact O-N 3.42Å
688	Q	90.3	Very high	90.1	Very high	124 Å²	124	90.5 Å²	90.5	58%	0.579	49%	0.49	S	S	*	.	H	α-helix	trans	-61.6	-39.6	175.6	-72.8	173.5	-17.4	0	0	112.7	T684 T685 S690 S692	T684-Q688 WeakPolarHBondContact O-CG 3.38Å; T684-Q688 PolarHBondContact O-N 3.08Å; T685-Q688 PolarHBondContact O-N 3.04Å; Q688-S690 VanDerWaalsContact C-N 3.33Å; Q688-S692 WeakPolarHBondContact O-CB 3.46Å; Q688-S692 PolarHBondContact O-N 3.27Å; Q688-S692 PolarHBondContact O-OG 3.08Å
689	V	89	Confident	89.9	Confident	74 Å²	74	89.9 Å²	89.9	45%	0.448	49%	0.489	S	S	.	.	H	α-helix	trans	-69.2	-30.8	174.5	170.3	0	0	0	0	111.8	T685 Q686 L687 S692 K693	T685-V689 WeakPolarHBondContact O-CB 3.38Å; T685-V689 VanDerWaalsContact O-CG2 3.3Å; T685-V689 WeakPolarHBondContact O-CG2 3.41Å; T685-V689 PolarHBondContact O-N 2.78Å; Q686-V689 PolarHBondContact O-N 3.39Å; L687-V689 VanDerWaalsContact C-N 3.35Å; L687-V689 PolarHBondContact O-N 2.93Å; V689-S692 WeakPolarHBondContact CA-OG 3.36Å; V689-S692 PolarHBondContact O-OG 2.97Å; V689-K693 HydrophobicContact CG1-CD 4.28Å; V689-K693 WeakPolarHBondContact O-CB 3.36Å; V689-K693 VanDerWaalsContact O-CD 3.31Å; V689-K693 WeakPolarHBondContact O-CD 3.05Å; V689-K693 WeakPolarHBondContact O-CG 2.92Å; V689-K693 PolarHBondContact O-N 3.43Å
690	S	87	Confident	90	Very high	73 Å²	73	88.6 Å²	88.6	51%	0.51	49%	0.487	S	S	.	.	H	α-helix	trans	-73.4	-43.1	174.2	-169.1	0	0	0	0	112.1	Q686 L687 Q688 K693 A694	Q686-S690 WeakPolarHBondContact O-CB 3.41Å; Q686-S690 PolarHBondContact O-N 2.88Å; L687-S690 WeakPolarHBondContact O-CB 3.48Å; L687-S690 PolarHBondContact O-N 3.35Å; L687-S690 VanDerWaalsContact O-N 3.14Å; Q688-S690 VanDerWaalsContact C-N 3.33Å; S690-K693 PolarHBondContact O-N 3.09Å; S690-A694 PolarHBondContact O-N 3.22Å
691	D	88.5	Confident	89.8	Confident	104 Å²	104	88.3 Å²	88.3	56%	0.556	49%	0.488	S	S	*	.	H	α-helix	trans	-69.6	-45.2	-178.1	-168	46.4	0	0	0	111.5	L687 K693 A694 V695	L687-D691 WeakPolarHBondContact O-CB 3.39Å; L687-D691 PolarHBondContact O-N 3.42Å; D691-K693 VanDerWaalsContact C-N 3.29Å; D691-K693 PolarHBondContact O-N 2.6Å; D691-A694 WeakPolarHBondContact O-CB 3.21Å; D691-A694 PolarHBondContact O-N 3.49Å; D691-V695 WeakPolarHBondContact O-CG2 3.22Å; D691-V695 PolarHBondContact O-N 3.46Å
692	S	89.6	Confident	89.8	Confident	68 Å²	68	93.7 Å²	93.7	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-59.3	-36.1	172.5	54	0	0	0	0	113.2	Q688 V689 H696	Q688-S692 WeakPolarHBondContact O-CB 3.46Å; Q688-S692 PolarHBondContact O-N 3.27Å; Q688-S692 PolarHBondContact O-OG 3.08Å; V689-S692 WeakPolarHBondContact CA-OG 3.36Å; V689-S692 PolarHBondContact O-OG 2.97Å; S692-H696 WeakPolarHBondContact O-CB 3.13Å; S692-H696 PolarHBondContact O-N 3.05Å
693	K	94.1	Very high	89.6	Confident	116 Å²	116	92 Å²	92	50%	0.504	50%	0.497	S	S	.	.	H	α-helix	trans	-67	-41	171.1	-76.3	171.6	-176.2	174.7	0	112.5	V689 S690 D691 H696 F697	V689-K693 HydrophobicContact CG1-CD 4.28Å; V689-K693 WeakPolarHBondContact O-CB 3.36Å; V689-K693 VanDerWaalsContact O-CD 3.31Å; V689-K693 WeakPolarHBondContact O-CD 3.05Å; V689-K693 WeakPolarHBondContact O-CG 2.92Å; V689-K693 PolarHBondContact O-N 3.43Å; S690-K693 PolarHBondContact O-N 3.09Å; D691-K693 VanDerWaalsContact C-N 3.29Å; D691-K693 PolarHBondContact O-N 2.6Å; K693-H696 WeakPolarHBondContact O-CB 3.42Å; K693-H696 PolarHBondContact O-N 2.78Å; K693-F697 HydrophobicContact CB-CE2 4.24Å; K693-F697 WeakPolarHBondContact O-CD2 3.3Å; K693-F697 WeakPolarHBondContact O-CG 3.43Å; K693-F697 PolarHBondContact O-N 2.94Å
694	A	88.4	Confident	89.3	Confident	56 Å²	56	92.8 Å²	92.8	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-42.2	176.1	0	0	0	0	0	111.7	S690 D691 H698	S690-A694 PolarHBondContact O-N 3.22Å; D691-A694 WeakPolarHBondContact O-CB 3.21Å; D691-A694 PolarHBondContact O-N 3.49Å; A694-H698 WeakPolarHBondContact O-CB 3.3Å; A694-H698 PolarHBondContact O-N 3Å
695	V	91.3	Very high	89.2	Confident	92 Å²	92	92.1 Å²	92.1	56%	0.558	50%	0.502	S	S	*	.	H	α-helix	trans	-63.4	-43.1	173.3	174.2	0	0	0	0	111.4	D691 H698 S699	D691-V695 WeakPolarHBondContact O-CG2 3.22Å; D691-V695 PolarHBondContact O-N 3.46Å; V695-H698 PolarHBondContact O-N 3.07Å; V695-S699 PolarHBondContact O-N 3.2Å
696	H	88.9	Confident	89.1	Confident	103 Å²	103	95.4 Å²	95.4	48%	0.477	51%	0.51	S	S	.	.	H	α-helix	trans	-57.7	-56.7	175.6	-169.9	-82.2	0	0	0	111.4	S692 K693 H698 S699 E700	S692-H696 WeakPolarHBondContact O-CB 3.13Å; S692-H696 PolarHBondContact O-N 3.05Å; K693-H696 WeakPolarHBondContact O-CB 3.42Å; K693-H696 PolarHBondContact O-N 2.78Å; H696-H698 VanDerWaalsContact C-N 3.29Å; H696-H698 PolarHBondContact O-N 3.12Å; H696-S699 WeakPolarHBondContact O-CA 3.28Å; H696-S699 WeakPolarHBondContact O-CB 3.41Å; H696-S699 PolarHBondContact O-N 3.35Å; H696-S699 PolarHBondContact O-OG 2.95Å; H696-E700 IonicContact CE1-OE1 3.37Å; H696-E700 PolarHBondContact CE1-OE1 3.5Å; H696-E700 IonicContact CE1-OE2 2.66Å; H696-E700 PolarHBondContact CE1-OE2 3.24Å; H696-E700 VanDerWaalsContact ND1-CD 3.27Å; H696-E700 IonicContact ND1-OE1 2.65Å; H696-E700 IonicContact ND1-OE2 3.32Å; H696-E700 PolarHBondContact ND1-OE2 2.57Å; H696-E700 PolarHBondContact O-N 2.89Å
697	F	88.9	Confident	88.9	Confident	126 Å²	126	98.6 Å²	98.6	55%	0.553	52%	0.518	S	S	*	.	H	α-helix	trans	-60.9	-36.1	179.5	-65	-47.2	0	0	0	112.4	K693 S699 E700 C701	K693-F697 HydrophobicContact CB-CE2 4.24Å; K693-F697 WeakPolarHBondContact O-CD2 3.3Å; K693-F697 WeakPolarHBondContact O-CG 3.43Å; K693-F697 PolarHBondContact O-N 2.94Å; F697-S699 VanDerWaalsContact C-N 3.33Å; F697-S699 PolarHBondContact O-N 3.43Å; F697-E700 WeakPolarHBondContact CD1-OE2 3.43Å; F697-E700 PolarHBondContact O-N 3.44Å; F697-C701 WeakPolarHBondContact O-CB 3.43Å; F697-C701 PolarHBondContact O-N 3.09Å; F697-C701 PolarHBondContact O-SG 3.45Å
698	H	89.6	Confident	88.6	Confident	112 Å²	112	97.6 Å²	97.6	52%	0.519	51%	0.512	S	S	.	.	H	α-helix	trans	-63.4	-38.6	173.4	-175.1	75.8	0	0	0	112.3	A694 V695 H696 R702	A694-H698 WeakPolarHBondContact O-CB 3.3Å; A694-H698 PolarHBondContact O-N 3Å; V695-H698 PolarHBondContact O-N 3.07Å; H696-H698 VanDerWaalsContact C-N 3.29Å; H696-H698 PolarHBondContact O-N 3.12Å; H698-R702 PolarHBondContact NE2-NH2 3.49Å; H698-R702 VanDerWaalsContact O-CB 3.29Å; H698-R702 WeakPolarHBondContact O-CB 3.33Å; H698-R702 PolarHBondContact O-N 3.38Å; H698-R702 VanDerWaalsContact O-N 3.07Å
699	S	87.1	Confident	88.5	Confident	63 Å²	63	95 Å²	95	44%	0.441	51%	0.505	S	S	.	.	H	α-helix	trans	-68.1	-40.2	175.8	82.1	0	0	0	0	112.3	V695 H696 F697 R702 A703	V695-S699 PolarHBondContact O-N 3.2Å; H696-S699 WeakPolarHBondContact O-CA 3.28Å; H696-S699 WeakPolarHBondContact O-CB 3.41Å; H696-S699 PolarHBondContact O-N 3.35Å; H696-S699 PolarHBondContact O-OG 2.95Å; F697-S699 VanDerWaalsContact C-N 3.33Å; F697-S699 PolarHBondContact O-N 3.43Å; S699-R702 PolarHBondContact O-N 3.37Å; S699-A703 WeakPolarHBondContact O-CB 3.33Å; S699-A703 PolarHBondContact O-N 3.04Å
700	E	91.3	Very high	88.6	Confident	81 Å²	81	97.3 Å²	97.3	38%	0.379	51%	0.514	S	S	.	.	H	α-helix	trans	-66.7	-48.2	176.4	-70.7	-178.3	115.2	0	0	111.8	H696 F697 R702 A703 L704	H696-E700 IonicContact CE1-OE1 3.37Å; H696-E700 PolarHBondContact CE1-OE1 3.5Å; H696-E700 IonicContact CE1-OE2 2.66Å; H696-E700 PolarHBondContact CE1-OE2 3.24Å; H696-E700 VanDerWaalsContact ND1-CD 3.27Å; H696-E700 IonicContact ND1-OE1 2.65Å; H696-E700 IonicContact ND1-OE2 3.32Å; H696-E700 PolarHBondContact ND1-OE2 2.57Å; H696-E700 PolarHBondContact O-N 2.89Å; F697-E700 WeakPolarHBondContact CD1-OE2 3.43Å; F697-E700 PolarHBondContact O-N 3.44Å; E700-R702 PolarHBondContact O-N 3.47Å; E700-A703 PolarHBondContact O-N 3.03Å; E700-L704 WeakPolarHBondContact O-CB 3.41Å; E700-L704 WeakPolarHBondContact O-CG 3.47Å; E700-L704 PolarHBondContact O-N 2.94Å
701	C	87.1	Confident	88.3	Confident	82 Å²	82	96.6 Å²	96.6	55%	0.554	51%	0.512	S	S	*	.	H	α-helix	trans	-56.8	-39.8	174.3	-74.1	0	0	0	0	111.7	F697 A705	F697-C701 WeakPolarHBondContact O-CB 3.43Å; F697-C701 PolarHBondContact O-N 3.09Å; F697-C701 PolarHBondContact O-SG 3.45Å; C701-A705 VanDerWaalsContact O-CB 3.3Å; C701-A705 WeakPolarHBondContact O-CB 3.29Å; C701-A705 PolarHBondContact O-N 3.45Å
702	R	90.4	Very high	88.2	Confident	149 Å²	149	95.4 Å²	95.4	56%	0.562	50%	0.503	S	S	*	.	H	α-helix	trans	-68.2	-36.1	175.5	-173.6	179.5	-67.3	-113.8	1.5	112.6	H698 S699 E700 K706	H698-R702 PolarHBondContact NE2-NH2 3.49Å; H698-R702 VanDerWaalsContact O-CB 3.29Å; H698-R702 WeakPolarHBondContact O-CB 3.33Å; H698-R702 PolarHBondContact O-N 3.38Å; H698-R702 VanDerWaalsContact O-N 3.07Å; S699-R702 PolarHBondContact O-N 3.37Å; E700-R702 PolarHBondContact O-N 3.47Å; R702-K706 WeakPolarHBondContact O-CG 3.38Å; R702-K706 PolarHBondContact O-N 2.98Å
703	A	85.7	Confident	88.4	Confident	43 Å²	43	98.7 Å²	98.7	36%	0.355	51%	0.509	S	S	.	.	H	α-helix	trans	-71.6	-41.3	175.3	0	0	0	0	0	112.2	S699 E700 K706 R707	S699-A703 WeakPolarHBondContact O-CB 3.33Å; S699-A703 PolarHBondContact O-N 3.04Å; E700-A703 PolarHBondContact O-N 3.03Å; A703-K706 PolarHBondContact O-N 3Å; A703-R707 WeakPolarHBondContact O-CG 3.5Å; A703-R707 PolarHBondContact O-N 3.17Å
704	L	85.1	Confident	88.1	Confident	104 Å²	104	95.8 Å²	95.8	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-45.7	175.1	-73.6	167.4	0	0	0	111.5	E700 K706 R707 L708	E700-L704 WeakPolarHBondContact O-CB 3.41Å; E700-L704 WeakPolarHBondContact O-CG 3.47Å; E700-L704 PolarHBondContact O-N 2.94Å; L704-K706 VanDerWaalsContact C-N 3.34Å; L704-K706 PolarHBondContact O-N 3.12Å; L704-R707 PolarHBondContact O-N 2.9Å; L704-R707 VanDerWaalsContact O-N 3.14Å; L704-L708 WeakPolarHBondContact O-CB 3.49Å; L704-L708 PolarHBondContact O-N 2.98Å
705	A	86.6	Confident	88.2	Confident	53 Å²	53	99.8 Å²	99.8	44%	0.438	51%	0.51	S	S	.	.	H	α-helix	trans	-57.8	-44.7	175.1	0	0	0	0	0	112	C701 R707 L708 T709	C701-A705 VanDerWaalsContact O-CB 3.3Å; C701-A705 WeakPolarHBondContact O-CB 3.29Å; C701-A705 PolarHBondContact O-N 3.45Å; A705-R707 PolarHBondContact O-N 3.47Å; A705-L708 PolarHBondContact O-N 3.3Å; A705-T709 PolarHBondContact O-N 3.19Å; A705-T709 PolarHBondContact O-OG1 3.45Å
706	K	89.6	Confident	88.2	Confident	146 Å²	146	99.9 Å²	99.9	64%	0.635	50%	0.504	S	S	*	.	H	α-helix	trans	-60.8	-42.5	174.3	-76.8	-177.1	174.9	-171.6	0	112.7	R702 A703 L704 I710	R702-K706 WeakPolarHBondContact O-CG 3.38Å; R702-K706 PolarHBondContact O-N 2.98Å; A703-K706 PolarHBondContact O-N 3Å; L704-K706 VanDerWaalsContact C-N 3.34Å; L704-K706 PolarHBondContact O-N 3.12Å; K706-I710 WeakPolarHBondContact O-CD1 3.46Å; K706-I710 WeakPolarHBondContact O-CG1 3.29Å; K706-I710 PolarHBondContact O-N 3.47Å
707	R	87.1	Confident	88.3	Confident	180 Å²	180	98.5 Å²	98.5	68%	0.679	50%	0.503	S	S	*	.	H	α-helix	trans	-64.7	-40.4	176.6	-74.1	175.3	177.9	169.8	0.5	111.7	A703 L704 A705 I710 A711	A703-R707 WeakPolarHBondContact O-CG 3.5Å; A703-R707 PolarHBondContact O-N 3.17Å; L704-R707 PolarHBondContact O-N 2.9Å; L704-R707 VanDerWaalsContact O-N 3.14Å; A705-R707 PolarHBondContact O-N 3.47Å; R707-I710 PolarHBondContact O-N 3.15Å; R707-A711 PolarHBondContact O-N 2.99Å
708	L	84.3	Confident	88.2	Confident	100 Å²	100	97.6 Å²	97.6	52%	0.524	50%	0.504	S	S	.	.	H	α-helix	trans	-60	-51.9	176.3	-176.3	65	0	0	0	110.8	L704 A705 I710 A711 E712	L704-L708 WeakPolarHBondContact O-CB 3.49Å; L704-L708 PolarHBondContact O-N 2.98Å; A705-L708 PolarHBondContact O-N 3.3Å; L708-I710 PolarHBondContact O-N 2.91Å; L708-A711 CarbonylContact O-C 3.57Å; L708-A711 WeakPolarHBondContact O-CA 3.5Å; L708-A711 PolarHBondContact O-N 3.47Å; L708-E712 HydrophobicContact CD1-CG 4.35Å; L708-E712 HydrophobicContact CG-CG 4.3Å; L708-E712 WeakPolarHBondContact O-CG 3.26Å; L708-E712 PolarHBondContact O-N 2.99Å
709	T	90.1	Very high	88.2	Confident	70 Å²	70	94.8 Å²	94.8	43%	0.429	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-28.6	179.2	-53.5	0	0	0	0	113.7	A705 E712 K713	A705-T709 PolarHBondContact O-N 3.19Å; A705-T709 PolarHBondContact O-OG1 3.45Å; T709-E712 WeakPolarHBondContact CA-OE2 3.49Å; T709-K713 WeakPolarHBondContact O-CG 3.23Å; T709-K713 PolarHBondContact O-N 2.98Å
710	I	89.3	Confident	88.5	Confident	123 Å²	123	97.3 Å²	97.3	63%	0.631	50%	0.501	S	S	*	.	H	α-helix	trans	-71.7	-43.7	172.2	-67.6	165.3	0	0	0	110.6	K706 R707 L708 K713 A714	K706-I710 WeakPolarHBondContact O-CD1 3.46Å; K706-I710 WeakPolarHBondContact O-CG1 3.29Å; K706-I710 PolarHBondContact O-N 3.47Å; R707-I710 PolarHBondContact O-N 3.15Å; L708-I710 PolarHBondContact O-N 2.91Å; I710-K713 PolarHBondContact O-N 3.33Å; I710-A714 PolarHBondContact O-N 2.96Å
711	A	81.4	Confident	88.5	Confident	58 Å²	58	99 Å²	99	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-67.3	-35.4	177.3	0	0	0	0	0	112.9	R707 L708 A714 R715	R707-A711 PolarHBondContact O-N 2.99Å; L708-A711 CarbonylContact O-C 3.57Å; L708-A711 WeakPolarHBondContact O-CA 3.5Å; L708-A711 PolarHBondContact O-N 3.47Å; A711-A714 PolarHBondContact O-N 2.96Å; A711-R715 WeakPolarHBondContact O-CB 3.37Å; A711-R715 PolarHBondContact O-N 3.28Å
712	E	86.6	Confident	88.6	Confident	78 Å²	78	98.9 Å²	98.9	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-46.3	174.9	-73.7	169.2	148	0	0	111.3	L708 T709 R715 E716	L708-E712 HydrophobicContact CD1-CG 4.35Å; L708-E712 HydrophobicContact CG-CG 4.3Å; L708-E712 WeakPolarHBondContact O-CG 3.26Å; L708-E712 PolarHBondContact O-N 2.99Å; T709-E712 WeakPolarHBondContact CA-OE2 3.49Å; E712-R715 WeakPolarHBondContact O-CB 3.49Å; E712-R715 PolarHBondContact O-N 3.37Å; E712-E716 WeakPolarHBondContact O-CG 3.4Å; E712-E716 PolarHBondContact O-N 3.37Å
713	K	93.4	Very high	88.7	Confident	137 Å²	137	97.3 Å²	97.3	60%	0.596	50%	0.503	S	S	*	.	H	α-helix	trans	-63.4	-42.5	174.9	-72.8	-178.6	177.1	-167	0	112.6	T709 I710 R715 E716 T717	T709-K713 WeakPolarHBondContact O-CG 3.23Å; T709-K713 PolarHBondContact O-N 2.98Å; I710-K713 PolarHBondContact O-N 3.33Å; K713-R715 VanDerWaalsContact C-N 3.32Å; K713-R715 PolarHBondContact O-N 2.88Å; K713-E716 PolarHBondContact O-N 2.94Å; K713-E716 VanDerWaalsContact O-N 3.15Å; K713-T717 PolarHBondContact O-N 3.16Å; K713-T717 PolarHBondContact O-OG1 3.48Å
714	A	88.3	Confident	89	Confident	56 Å²	56	99.8 Å²	99.8	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-34.8	176.3	0	0	0	0	0	112.5	I710 A711 E716 T717 L718	I710-A714 PolarHBondContact O-N 2.96Å; A711-A714 PolarHBondContact O-N 2.96Å; A714-E716 VanDerWaalsContact C-N 3.33Å; A714-T717 PolarHBondContact O-OG1 3.14Å; A714-L718 VanDerWaalsContact O-CB 3.29Å; A714-L718 WeakPolarHBondContact O-CB 3.12Å; A714-L718 PolarHBondContact O-N 3.11Å; A714-L718 VanDerWaalsContact O-N 3.12Å
715	R	90.2	Very high	89.2	Confident	139 Å²	139	97.2 Å²	97.2	53%	0.525	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-36.2	171.5	-179.5	-163.9	57.6	62.6	5	111.4	A711 E712 K713 S719	A711-R715 WeakPolarHBondContact O-CB 3.37Å; A711-R715 PolarHBondContact O-N 3.28Å; E712-R715 WeakPolarHBondContact O-CB 3.49Å; E712-R715 PolarHBondContact O-N 3.37Å; K713-R715 VanDerWaalsContact C-N 3.32Å; K713-R715 PolarHBondContact O-N 2.88Å; R715-S719 WeakPolarHBondContact O-CB 3.49Å; R715-S719 PolarHBondContact O-N 3.05Å
716	E	91.5	Very high	89.3	Confident	94 Å²	94	99 Å²	99	44%	0.439	51%	0.506	S	S	.	.	H	α-helix	trans	-69.4	-50.5	178.2	-78.9	160.7	-173.1	0	0	111.9	E712 K713 A714 L718 S719 E720	E712-E716 WeakPolarHBondContact O-CG 3.4Å; E712-E716 PolarHBondContact O-N 3.37Å; K713-E716 PolarHBondContact O-N 2.94Å; K713-E716 VanDerWaalsContact O-N 3.15Å; A714-E716 VanDerWaalsContact C-N 3.33Å; E716-L718 VanDerWaalsContact C-N 3.35Å; E716-L718 PolarHBondContact O-N 2.8Å; E716-S719 CarbonylContact O-C 3.59Å; E716-S719 WeakPolarHBondContact O-CA 3.07Å; E716-S719 WeakPolarHBondContact O-CB 3.31Å; E716-S719 PolarHBondContact O-N 3.39Å; E716-E720 PolarHBondContact O-N 2.89Å
717	T	91.4	Very high	89.5	Confident	75 Å²	75	97.5 Å²	97.5	46%	0.46	50%	0.501	S	S	.	.	H	α-helix	trans	-59.8	-44.5	176.5	57.2	0	0	0	0	111.7	K713 A714 S719 E720 E721	K713-T717 PolarHBondContact O-N 3.16Å; K713-T717 PolarHBondContact O-OG1 3.48Å; A714-T717 PolarHBondContact O-OG1 3.14Å; T717-S719 VanDerWaalsContact C-N 3.26Å; T717-S719 PolarHBondContact O-N 3.14Å; T717-E720 PolarHBondContact O-N 3.05Å; T717-E721 WeakPolarHBondContact O-CG 3.4Å; T717-E721 PolarHBondContact O-N 3.3Å
718	L	86.6	Confident	89.8	Confident	107 Å²	107	92.6 Å²	92.6	56%	0.56	49%	0.488	S	S	*	.	H	α-helix	trans	-64.4	-31.4	176.7	-155	81.8	0	0	0	112.1	A714 E716 E720 V722	A714-L718 VanDerWaalsContact O-CB 3.29Å; A714-L718 WeakPolarHBondContact O-CB 3.12Å; A714-L718 PolarHBondContact O-N 3.11Å; A714-L718 VanDerWaalsContact O-N 3.12Å; E716-L718 VanDerWaalsContact C-N 3.35Å; E716-L718 PolarHBondContact O-N 2.8Å; L718-E720 VanDerWaalsContact C-N 3.33Å; L718-V722 WeakPolarHBondContact O-CB 3.21Å; L718-V722 VanDerWaalsContact O-CG2 3.23Å; L718-V722 WeakPolarHBondContact O-CG2 3.33Å; L718-V722 PolarHBondContact O-N 2.67Å
719	S	88.6	Confident	90.1	Very high	52 Å²	52	91.7 Å²	91.7	36%	0.364	48%	0.483	S	S	.	.	H	α-helix	trans	-73.7	-22.3	174.4	-175.7	0	0	0	0	113.4	R715 E716 T717 K723	R715-S719 WeakPolarHBondContact O-CB 3.49Å; R715-S719 PolarHBondContact O-N 3.05Å; E716-S719 CarbonylContact O-C 3.59Å; E716-S719 WeakPolarHBondContact O-CA 3.07Å; E716-S719 WeakPolarHBondContact O-CB 3.31Å; E716-S719 PolarHBondContact O-N 3.39Å; T717-S719 VanDerWaalsContact C-N 3.26Å; T717-S719 PolarHBondContact O-N 3.14Å; S719-K723 WeakPolarHBondContact O-CG 3.4Å; S719-K723 PolarHBondContact O-N 2.89Å
720	E	94.2	Very high	90.2	Very high	117 Å²	117	91.8 Å²	91.8	55%	0.547	48%	0.484	S	S	.	.	H	α-helix	trans	-83	-43.5	173.1	-69.4	179.2	159.3	0	0	110.8	E716 T717 L718 V722 K723 L724	E716-E720 PolarHBondContact O-N 2.89Å; T717-E720 PolarHBondContact O-N 3.05Å; L718-E720 VanDerWaalsContact C-N 3.33Å; E720-V722 VanDerWaalsContact C-N 3.29Å; E720-V722 PolarHBondContact O-N 2.73Å; E720-K723 WeakPolarHBondContact O-CB 3.1Å; E720-K723 PolarHBondContact O-N 3.42Å; E720-L724 WeakPolarHBondContact O-CG 3.29Å; E720-L724 PolarHBondContact O-N 2.8Å
721	E	91.6	Very high	90.4	Very high	116 Å²	116	92.3 Å²	92.3	54%	0.542	48%	0.477	S	S	.	.	H	α-helix	trans	-54.5	-44.1	170.4	-71.4	171.7	-166.9	0	0	111.8	T717 K723 L724 A725	T717-E721 WeakPolarHBondContact O-CG 3.4Å; T717-E721 PolarHBondContact O-N 3.3Å; E721-K723 PolarHBondContact O-N 2.86Å; E721-L724 PolarHBondContact O-N 3.47Å; E721-A725 VanDerWaalsContact O-CB 3.3Å; E721-A725 WeakPolarHBondContact O-CB 3.44Å; E721-A725 PolarHBondContact O-N 3.31Å
722	V	88.4	Confident	90.9	Very high	80 Å²	80	94.1 Å²	94.1	49%	0.485	48%	0.479	S	S	.	.	H	α-helix	trans	-66.7	-32.7	176.4	167.8	0	0	0	0	112.6	L718 E720 N726	L718-V722 WeakPolarHBondContact O-CB 3.21Å; L718-V722 VanDerWaalsContact O-CG2 3.23Å; L718-V722 WeakPolarHBondContact O-CG2 3.33Å; L718-V722 PolarHBondContact O-N 2.67Å; E720-V722 VanDerWaalsContact C-N 3.29Å; E720-V722 PolarHBondContact O-N 2.73Å; V722-N726 PolarHBondContact O-N 3.28Å; V722-N726 VanDerWaalsContact O-N 3.09Å; V722-N726 PolarHBondContact O-ND2 2.97Å
723	K	92.3	Very high	91.2	Very high	115 Å²	115	95.6 Å²	95.6	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-66.6	-51.8	173	-73.8	166.7	-174.5	171.3	0	110.7	S719 E720 E721 A725 N726 E727	S719-K723 WeakPolarHBondContact O-CG 3.4Å; S719-K723 PolarHBondContact O-N 2.89Å; E720-K723 WeakPolarHBondContact O-CB 3.1Å; E720-K723 PolarHBondContact O-N 3.42Å; E721-K723 PolarHBondContact O-N 2.86Å; K723-A725 VanDerWaalsContact C-N 3.26Å; K723-A725 PolarHBondContact O-N 3.4Å; K723-N726 PolarHBondContact O-N 3.3Å; K723-E727 WeakPolarHBondContact O-CG 3.38Å; K723-E727 PolarHBondContact O-N 3.07Å
724	L	93.4	Very high	91.3	Very high	96 Å²	96	94.1 Å²	94.1	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-58.9	-37.5	178.2	-67	169.5	0	0	0	111.9	E720 E721 N728	E720-L724 WeakPolarHBondContact O-CG 3.29Å; E720-L724 PolarHBondContact O-N 2.8Å; E721-L724 PolarHBondContact O-N 3.47Å; L724-N728 WeakPolarHBondContact O-CB 3.47Å; L724-N728 PolarHBondContact O-N 3.37Å; L724-N728 PolarHBondContact O-ND2 3.46Å
725	A	88.3	Confident	91.5	Very high	49 Å²	49	95.4 Å²	95.4	41%	0.405	48%	0.481	S	S	.	.	H	α-helix	trans	-64.6	-44.6	174	0	0	0	0	0	112.1	E721 K723 N728 I729	E721-A725 VanDerWaalsContact O-CB 3.3Å; E721-A725 WeakPolarHBondContact O-CB 3.44Å; E721-A725 PolarHBondContact O-N 3.31Å; K723-A725 VanDerWaalsContact C-N 3.26Å; K723-A725 PolarHBondContact O-N 3.4Å; A725-N728 PolarHBondContact O-N 2.99Å; A725-I729 VanDerWaalsContact O-CG1 3.27Å; A725-I729 WeakPolarHBondContact O-CG1 3.37Å; A725-I729 PolarHBondContact O-N 3.33Å
726	N	87.9	Confident	91.6	Very high	92 Å²	92	94.4 Å²	94.4	49%	0.492	49%	0.485	S	S	.	.	H	α-helix	trans	-65.2	-41.4	176.2	-78	-61.4	0	0	0	112.3	V722 K723 N728 I729 T730	V722-N726 PolarHBondContact O-N 3.28Å; V722-N726 VanDerWaalsContact O-N 3.09Å; V722-N726 PolarHBondContact O-ND2 2.97Å; K723-N726 PolarHBondContact O-N 3.3Å; N726-N728 PolarHBondContact O-N 3.19Å; N726-I729 WeakPolarHBondContact O-CB 3.27Å; N726-I729 PolarHBondContact O-N 3.35Å; N726-I729 VanDerWaalsContact O-N 3.16Å; N726-T730 PolarHBondContact O-N 3.22Å; N726-T730 PolarHBondContact O-OG1 2.73Å
727	E	94.1	Very high	91.6	Very high	114 Å²	114	93.3 Å²	93.3	53%	0.533	49%	0.485	S	S	.	.	H	α-helix	trans	-60	-44.2	175.9	-72.7	165.7	-162	0	0	111.5	K723 T730 R731	K723-E727 WeakPolarHBondContact O-CG 3.38Å; K723-E727 PolarHBondContact O-N 3.07Å; E727-T730 WeakPolarHBondContact CA-OG1 3.17Å; E727-T730 PolarHBondContact O-N 3.09Å; E727-T730 PolarHBondContact O-OG1 3.02Å; E727-R731 PolarHBondContact O-N 3.41Å
728	N	94	Very high	91.7	Very high	76 Å²	76	93.4 Å²	93.4	41%	0.406	49%	0.485	S	S	.	.	H	α-helix	trans	-64.3	-39.3	173.2	-78.9	-67.1	0	0	0	112.5	L724 A725 N726 R731 L732	L724-N728 WeakPolarHBondContact O-CB 3.47Å; L724-N728 PolarHBondContact O-N 3.37Å; L724-N728 PolarHBondContact O-ND2 3.46Å; A725-N728 PolarHBondContact O-N 2.99Å; N726-N728 PolarHBondContact O-N 3.19Å; N728-R731 PolarHBondContact O-N 3.43Å; N728-R731 PolarHBondContact OD1-NH1 3.44Å; N728-L732 WeakPolarHBondContact O-CB 3.23Å; N728-L732 VanDerWaalsContact O-CG 3.3Å; N728-L732 WeakPolarHBondContact O-CG 3.36Å; N728-L732 PolarHBondContact O-N 3.49Å
729	I	90.8	Very high	92	Very high	81 Å²	81	91.6 Å²	91.6	42%	0.415	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-44.6	174.5	-72.3	164	0	0	0	110.8	A725 N726 L732 Q733	A725-I729 VanDerWaalsContact O-CG1 3.27Å; A725-I729 WeakPolarHBondContact O-CG1 3.37Å; A725-I729 PolarHBondContact O-N 3.33Å; N726-I729 WeakPolarHBondContact O-CB 3.27Å; N726-I729 PolarHBondContact O-N 3.35Å; N726-I729 VanDerWaalsContact O-N 3.16Å; I729-L732 PolarHBondContact O-N 2.7Å; I729-Q733 VanDerWaalsContact O-CG 3.31Å; I729-Q733 WeakPolarHBondContact O-CG 3.38Å; I729-Q733 PolarHBondContact O-N 2.85Å
730	T	91.3	Very high	92.2	Very high	73 Å²	73	94.4 Å²	94.4	45%	0.448	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-43	176.3	44.2	0	0	0	0	111.9	N726 E727 L732 Q733 D734	N726-T730 PolarHBondContact O-N 3.22Å; N726-T730 PolarHBondContact O-OG1 2.73Å; E727-T730 WeakPolarHBondContact CA-OG1 3.17Å; E727-T730 PolarHBondContact O-N 3.09Å; E727-T730 PolarHBondContact O-OG1 3.02Å; T730-L732 VanDerWaalsContact C-N 3.35Å; T730-L732 PolarHBondContact O-N 3.22Å; T730-Q733 WeakPolarHBondContact O-CB 3.39Å; T730-Q733 PolarHBondContact O-N 3.47Å; T730-Q733 VanDerWaalsContact O-N 3.1Å; T730-D734 PolarHBondContact O-N 2.95Å
731	R	94.5	Very high	92.2	Very high	133 Å²	133	95.6 Å²	95.6	50%	0.502	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-42.8	177.6	-150.5	-165.3	82.2	-137.5	-3	112.1	E727 N728 Q733 D734 E735	E727-R731 PolarHBondContact O-N 3.41Å; N728-R731 PolarHBondContact O-N 3.43Å; N728-R731 PolarHBondContact OD1-NH1 3.44Å; R731-Q733 VanDerWaalsContact C-N 3.32Å; R731-Q733 PolarHBondContact O-N 3.32Å; R731-D734 PolarHBondContact O-N 3.34Å; R731-E735 IonicContact CZ-OE1 2.82Å; R731-E735 IonicContact NE-OE1 2.64Å; R731-E735 PolarHBondContact NE-OE1 3.34Å; R731-E735 IonicContact NH2-OE1 3.9Å; R731-E735 PolarHBondContact NH2-OE1 3.31Å; R731-E735 IonicContact NH2-OE2 2.67Å; R731-E735 WeakPolarHBondContact O-CG 3.43Å; R731-E735 PolarHBondContact O-N 3.1Å
732	L	91.9	Very high	92.2	Very high	97 Å²	97	92.8 Å²	92.8	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-67.8	-29.1	176	-70.6	169.6	0	0	0	112.7	N728 I729 T730 L736	N728-L732 WeakPolarHBondContact O-CB 3.23Å; N728-L732 VanDerWaalsContact O-CG 3.3Å; N728-L732 WeakPolarHBondContact O-CG 3.36Å; N728-L732 PolarHBondContact O-N 3.49Å; I729-L732 PolarHBondContact O-N 2.7Å; T730-L732 VanDerWaalsContact C-N 3.35Å; T730-L732 PolarHBondContact O-N 3.22Å; L732-L736 VanDerWaalsContact O-CB 3.23Å; L732-L736 WeakPolarHBondContact O-CB 3.49Å; L732-L736 PolarHBondContact O-N 3.25Å
733	Q	92.7	Very high	92.5	Very high	109 Å²	109	96.4 Å²	96.4	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-71.9	-37.1	172.5	-73.4	172.5	3.4	0	0	112.1	I729 T730 R731 L736 T737	I729-Q733 VanDerWaalsContact O-CG 3.31Å; I729-Q733 WeakPolarHBondContact O-CG 3.38Å; I729-Q733 PolarHBondContact O-N 2.85Å; T730-Q733 WeakPolarHBondContact O-CB 3.39Å; T730-Q733 PolarHBondContact O-N 3.47Å; T730-Q733 VanDerWaalsContact O-N 3.1Å; R731-Q733 VanDerWaalsContact C-N 3.32Å; R731-Q733 PolarHBondContact O-N 3.32Å; Q733-L736 PolarHBondContact O-N 2.9Å; Q733-T737 WeakPolarHBondContact O-CB 3.32Å; Q733-T737 WeakPolarHBondContact O-CG2 3.32Å; Q733-T737 PolarHBondContact O-N 3.07Å; Q733-T737 PolarHBondContact O-OG1 3.41Å
734	D	94.4	Very high	92.6	Very high	106 Å²	106	95.7 Å²	95.7	57%	0.567	48%	0.482	S	S	*	.	H	α-helix	trans	-68.8	-42	173.6	-69.6	-27.9	0	0	0	111.6	T730 R731 L736 T737 T738	T730-D734 PolarHBondContact O-N 2.95Å; R731-D734 PolarHBondContact O-N 3.34Å; D734-L736 VanDerWaalsContact C-N 3.34Å; D734-L736 PolarHBondContact O-N 2.89Å; D734-T737 PolarHBondContact O-N 3.17Å; D734-T737 PolarHBondContact O-OG1 3.04Å; D734-T738 WeakPolarHBondContact O-CB 3.45Å; D734-T738 WeakPolarHBondContact O-CG2 3.46Å; D734-T738 PolarHBondContact O-N 3.41Å; D734-T738 PolarHBondContact O-OG1 3.04Å
735	E	94.2	Very high	92.5	Very high	83 Å²	83	95.1 Å²	95.1	39%	0.388	48%	0.48	S	S	.	.	H	α-helix	trans	-59.1	-41.9	170.7	-72.2	170.7	-148.8	0	0	111.8	R731 T738 T739	R731-E735 IonicContact CZ-OE1 2.82Å; R731-E735 IonicContact NE-OE1 2.64Å; R731-E735 PolarHBondContact NE-OE1 3.34Å; R731-E735 IonicContact NH2-OE1 3.9Å; R731-E735 PolarHBondContact NH2-OE1 3.31Å; R731-E735 IonicContact NH2-OE2 2.67Å; R731-E735 WeakPolarHBondContact O-CG 3.43Å; R731-E735 PolarHBondContact O-N 3.1Å; E735-T738 PolarHBondContact O-OG1 2.92Å; E735-T738 VanDerWaalsContact O-OG1 3.09Å; E735-T739 WeakPolarHBondContact O-CB 3.4Å; E735-T739 WeakPolarHBondContact O-CG2 3.39Å; E735-T739 PolarHBondContact O-N 3.11Å; E735-T739 VanDerWaalsContact O-N 3.1Å; E735-T739 PolarHBondContact O-OG1 3.03Å
736	L	91.7	Very high	92.8	Very high	118 Å²	118	97.1 Å²	97.1	62%	0.618	48%	0.48	S	S	*	.	H	α-helix	trans	-71.1	-38.4	178.3	-177.6	61.6	0	0	0	113.1	L732 Q733 D734 T739 K740	L732-L736 VanDerWaalsContact O-CB 3.23Å; L732-L736 WeakPolarHBondContact O-CB 3.49Å; L732-L736 PolarHBondContact O-N 3.25Å; Q733-L736 PolarHBondContact O-N 2.9Å; D734-L736 VanDerWaalsContact C-N 3.34Å; D734-L736 PolarHBondContact O-N 2.89Å; L736-T739 WeakPolarHBondContact CA-OG1 3.47Å; L736-T739 PolarHBondContact O-OG1 3.05Å; L736-T739 VanDerWaalsContact O-OG1 3.09Å; L736-K740 WeakPolarHBondContact O-CB 3.47Å; L736-K740 PolarHBondContact O-N 2.87Å
737	T	91.1	Very high	93	Very high	71 Å²	71	97.9 Å²	97.9	44%	0.436	48%	0.484	S	S	.	.	H	α-helix	trans	-75.6	-33.4	179.6	54.1	0	0	0	0	112.6	Q733 D734 R741	Q733-T737 WeakPolarHBondContact O-CB 3.32Å; Q733-T737 WeakPolarHBondContact O-CG2 3.32Å; Q733-T737 PolarHBondContact O-N 3.07Å; Q733-T737 PolarHBondContact O-OG1 3.41Å; D734-T737 PolarHBondContact O-N 3.17Å; D734-T737 PolarHBondContact O-OG1 3.04Å; T737-R741 WeakPolarHBondContact O-CB 3.5Å; T737-R741 PolarHBondContact O-N 2.86Å
738	T	93.2	Very high	92.9	Very high	76 Å²	76	95.4 Å²	95.4	47%	0.466	48%	0.479	S	S	.	.	H	α-helix	trans	-69.5	-45	173.6	49.7	0	0	0	0	112	D734 E735 R741 S742	D734-T738 WeakPolarHBondContact O-CB 3.45Å; D734-T738 WeakPolarHBondContact O-CG2 3.46Å; D734-T738 PolarHBondContact O-N 3.41Å; D734-T738 PolarHBondContact O-OG1 3.04Å; E735-T738 PolarHBondContact O-OG1 2.92Å; E735-T738 VanDerWaalsContact O-OG1 3.09Å; T738-R741 PolarHBondContact O-N 3.34Å; T738-S742 PolarHBondContact O-N 3.46Å
739	T	93.1	Very high	92.7	Very high	69 Å²	69	97.5 Å²	97.5	42%	0.423	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-44.5	173.5	49.2	0	0	0	0	112.1	E735 L736 R741 S742 Y743	E735-T739 WeakPolarHBondContact O-CB 3.4Å; E735-T739 WeakPolarHBondContact O-CG2 3.39Å; E735-T739 PolarHBondContact O-N 3.11Å; E735-T739 VanDerWaalsContact O-N 3.1Å; E735-T739 PolarHBondContact O-OG1 3.03Å; L736-T739 WeakPolarHBondContact CA-OG1 3.47Å; L736-T739 PolarHBondContact O-OG1 3.05Å; L736-T739 VanDerWaalsContact O-OG1 3.09Å; T739-R741 PolarHBondContact O-N 2.92Å; T739-S742 PolarHBondContact O-N 3.16Å; T739-Y743 WeakPolarHBondContact O-CD2 3.49Å; T739-Y743 PolarHBondContact O-N 2.99Å; T739-Y743 VanDerWaalsContact O-N 3.1Å
740	K	93	Very high	92.6	Very high	111 Å²	111	99.4 Å²	99.4	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-56.6	-48	174.4	-179.5	176.4	175.7	-71	0	112	L736 S742 Y743 E744	L736-K740 WeakPolarHBondContact O-CB 3.47Å; L736-K740 PolarHBondContact O-N 2.87Å; K740-S742 VanDerWaalsContact C-N 3.34Å; K740-S742 PolarHBondContact O-N 3.19Å; K740-Y743 PolarHBondContact O-N 2.98Å; K740-E744 IonicContact NZ-OE1 3.5Å; K740-E744 PolarHBondContact NZ-OE1 3.45Å; K740-E744 IonicContact NZ-OE2 3.76Å; K740-E744 PolarHBondContact NZ-OE2 2.87Å; K740-E744 WeakPolarHBondContact O-CG 3.5Å; K740-E744 PolarHBondContact O-N 3.38Å
741	R	93.4	Very high	92.5	Very high	142 Å²	142	99.2 Å²	99.2	54%	0.536	50%	0.498	S	S	.	.	H	α-helix	trans	-59.1	-45.1	177.2	-175.6	179.9	-65.3	115	2.8	111.4	T737 T738 T739 Y743 E744 D745	T737-R741 WeakPolarHBondContact O-CB 3.5Å; T737-R741 PolarHBondContact O-N 2.86Å; T738-R741 PolarHBondContact O-N 3.34Å; T739-R741 PolarHBondContact O-N 2.92Å; R741-Y743 VanDerWaalsContact C-N 3.28Å; R741-Y743 PolarHBondContact O-N 2.81Å; R741-E744 CarbonylContact O-C 3.57Å; R741-E744 PolarHBondContact O-N 3.21Å; R741-D745 PolarHBondContact O-N 3.43Å
742	S	93.3	Very high	92.4	Very high	58 Å²	58	97.6 Å²	97.6	41%	0.406	50%	0.5	S	S	.	.	H	α-helix	trans	-60.3	-36.1	178.9	-171.8	0	0	0	0	113.1	T738 T739 K740 Q746	T738-S742 PolarHBondContact O-N 3.46Å; T739-S742 PolarHBondContact O-N 3.16Å; K740-S742 VanDerWaalsContact C-N 3.34Å; K740-S742 PolarHBondContact O-N 3.19Å; S742-Q746 WeakPolarHBondContact O-CB 3.41Å; S742-Q746 WeakPolarHBondContact O-CG 3.3Å; S742-Q746 PolarHBondContact O-N 3.48Å; S742-Q746 VanDerWaalsContact O-N 3.07Å; S742-Q746 PolarHBondContact O-NE2 3.44Å; S742-Q746 VanDerWaalsContact O-NE2 3.09Å; S742-Q746 PolarHBondContact OG-NE2 2.86Å
743	Y	94	Very high	92.4	Very high	155 Å²	155	99.3 Å²	99.3	61%	0.608	51%	0.505	S	S	*	.	H	α-helix	trans	-72.5	-35.5	172.7	-72.8	-61.5	0	0	0	112.9	T739 K740 R741 Q746 L747	T739-Y743 WeakPolarHBondContact O-CD2 3.49Å; T739-Y743 PolarHBondContact O-N 2.99Å; T739-Y743 VanDerWaalsContact O-N 3.1Å; K740-Y743 PolarHBondContact O-N 2.98Å; R741-Y743 VanDerWaalsContact C-N 3.28Å; R741-Y743 PolarHBondContact O-N 2.81Å; Y743-Q746 PolarHBondContact O-N 3.02Å; Y743-L747 WeakPolarHBondContact O-CB 3.43Å; Y743-L747 VanDerWaalsContact O-CG 3.25Å; Y743-L747 WeakPolarHBondContact O-CG 3.39Å; Y743-L747 PolarHBondContact O-N 3.25Å
744	E	93.7	Very high	92.2	Very high	100 Å²	100	98.2 Å²	98.2	47%	0.467	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-42.3	173.3	-71.2	176	137.3	0	0	111.6	K740 R741 L747 S748	K740-E744 IonicContact NZ-OE1 3.5Å; K740-E744 PolarHBondContact NZ-OE1 3.45Å; K740-E744 IonicContact NZ-OE2 3.76Å; K740-E744 PolarHBondContact NZ-OE2 2.87Å; K740-E744 WeakPolarHBondContact O-CG 3.5Å; K740-E744 PolarHBondContact O-N 3.38Å; R741-E744 CarbonylContact O-C 3.57Å; R741-E744 PolarHBondContact O-N 3.21Å; E744-L747 PolarHBondContact O-N 3.07Å; E744-S748 PolarHBondContact O-N 2.97Å
745	D	92.7	Very high	91.8	Very high	85 Å²	85	96.6 Å²	96.6	46%	0.455	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-43.3	175.1	-62	-30.2	0	0	0	111.5	R741 S748 M749	R741-D745 PolarHBondContact O-N 3.43Å; D745-S748 PolarHBondContact O-N 2.8Å; D745-M749 WeakPolarHBondContact O-CG 3.33Å; D745-M749 PolarHBondContact O-N 3.09Å
746	Q	93.6	Very high	91.6	Very high	91 Å²	91	96 Å²	96	43%	0.425	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-43.2	174.8	-76.2	169.2	60.5	0	0	112.2	S742 Y743 S748 M749 M750	S742-Q746 WeakPolarHBondContact O-CB 3.41Å; S742-Q746 WeakPolarHBondContact O-CG 3.3Å; S742-Q746 PolarHBondContact O-N 3.48Å; S742-Q746 VanDerWaalsContact O-N 3.07Å; S742-Q746 PolarHBondContact O-NE2 3.44Å; S742-Q746 VanDerWaalsContact O-NE2 3.09Å; S742-Q746 PolarHBondContact OG-NE2 2.86Å; Y743-Q746 PolarHBondContact O-N 3.02Å; Q746-S748 VanDerWaalsContact C-N 3.35Å; Q746-M749 HydrophobicContact CG-CE 4.48Å; Q746-M749 PolarHBondContact O-N 3.37Å; Q746-M750 WeakPolarHBondContact O-CG 3.22Å; Q746-M750 PolarHBondContact O-N 2.97Å
747	L	91.4	Very high	91.4	Very high	108 Å²	108	94.2 Å²	94.2	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-67.6	-33.8	176.7	-73.4	168.7	0	0	0	112.3	Y743 E744 S751	Y743-L747 WeakPolarHBondContact O-CB 3.43Å; Y743-L747 VanDerWaalsContact O-CG 3.25Å; Y743-L747 WeakPolarHBondContact O-CG 3.39Å; Y743-L747 PolarHBondContact O-N 3.25Å; E744-L747 PolarHBondContact O-N 3.07Å; L747-S751 WeakPolarHBondContact O-CB 3.18Å; L747-S751 PolarHBondContact O-N 3.4Å; L747-S751 PolarHBondContact O-OG 3.27Å
748	S	92.1	Very high	91.3	Very high	61 Å²	61	95.9 Å²	95.9	43%	0.427	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-53.4	171.1	-163.6	0	0	0	0	110.6	E744 D745 Q746 M750 S751 D752	E744-S748 PolarHBondContact O-N 2.97Å; D745-S748 PolarHBondContact O-N 2.8Å; Q746-S748 VanDerWaalsContact C-N 3.35Å; S748-M750 VanDerWaalsContact C-N 3.28Å; S748-M750 PolarHBondContact O-N 3.28Å; S748-S751 CarbonylContact O-C 3.59Å; S748-S751 WeakPolarHBondContact O-CA 3.29Å; S748-S751 WeakPolarHBondContact O-CB 3.28Å; S748-S751 PolarHBondContact O-N 3.1Å; S748-D752 PolarHBondContact O-N 3.46Å; S748-D752 VanDerWaalsContact O-OD2 3.1Å; S748-D752 PolarHBondContact OG-OD2 3.38Å
749	M	90.9	Very high	91.1	Very high	121 Å²	121	97.1 Å²	97.1	60%	0.596	50%	0.499	S	S	*	.	H	α-helix	trans	-58.3	-37.7	178.9	-72.1	-174.7	-73.2	0	0	112.9	D745 Q746 H753	D745-M749 WeakPolarHBondContact O-CG 3.33Å; D745-M749 PolarHBondContact O-N 3.09Å; Q746-M749 HydrophobicContact CG-CE 4.48Å; Q746-M749 PolarHBondContact O-N 3.37Å; M749-H753 VanDerWaalsContact O-CB 3.28Å; M749-H753 WeakPolarHBondContact O-CB 3.45Å; M749-H753 PolarHBondContact O-N 2.93Å
750	M	87.9	Confident	91	Very high	120 Å²	120	97 Å²	97	59%	0.591	50%	0.498	S	S	*	.	H	α-helix	trans	-65.5	-39.6	171.5	-76.3	-172.4	67.8	0	0	112.6	Q746 S748 H753 L754	Q746-M750 WeakPolarHBondContact O-CG 3.22Å; Q746-M750 PolarHBondContact O-N 2.97Å; S748-M750 VanDerWaalsContact C-N 3.28Å; S748-M750 PolarHBondContact O-N 3.28Å; M750-H753 PolarHBondContact O-N 3.24Å; M750-L754 WeakPolarHBondContact O-CB 3.36Å; M750-L754 VanDerWaalsContact O-CG 3.23Å; M750-L754 WeakPolarHBondContact O-CG 3.36Å; M750-L754 PolarHBondContact O-N 2.96Å
751	S	89.5	Confident	90.7	Very high	70 Å²	70	95.9 Å²	95.9	49%	0.49	50%	0.497	S	S	.	.	H	α-helix	trans	-67.3	-42.7	178.2	-59	0	0	0	0	111.9	L747 S748 L754 C755	L747-S751 WeakPolarHBondContact O-CB 3.18Å; L747-S751 PolarHBondContact O-N 3.4Å; L747-S751 PolarHBondContact O-OG 3.27Å; S748-S751 CarbonylContact O-C 3.59Å; S748-S751 WeakPolarHBondContact O-CA 3.29Å; S748-S751 WeakPolarHBondContact O-CB 3.28Å; S748-S751 PolarHBondContact O-N 3.1Å; S751-L754 PolarHBondContact O-N 2.64Å; S751-C755 WeakPolarHBondContact O-CB 3.37Å; S751-C755 PolarHBondContact O-N 3.23Å
752	D	91.9	Very high	90.3	Very high	99 Å²	99	91.7 Å²	91.7	53%	0.529	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-42	175.8	-64	-42.3	0	0	0	111.1	S748 C755 S756	S748-D752 PolarHBondContact O-N 3.46Å; S748-D752 VanDerWaalsContact O-OD2 3.1Å; S748-D752 PolarHBondContact OG-OD2 3.38Å; D752-C755 WeakPolarHBondContact O-CB 3.45Å; D752-C755 PolarHBondContact O-N 3.43Å; D752-S756 WeakPolarHBondContact O-CB 3.22Å; D752-S756 PolarHBondContact O-N 2.76Å
753	H	92.3	Very high	90.1	Very high	133 Å²	133	94.2 Å²	94.2	62%	0.616	49%	0.493	S	S	*	.	H	α-helix	trans	-64	-42.5	173.6	-174.5	-77.5	0	0	0	112.3	M749 M750 C755 S756 M757	M749-H753 VanDerWaalsContact O-CB 3.28Å; M749-H753 WeakPolarHBondContact O-CB 3.45Å; M749-H753 PolarHBondContact O-N 2.93Å; M750-H753 PolarHBondContact O-N 3.24Å; H753-C755 VanDerWaalsContact C-N 3.31Å; H753-C755 PolarHBondContact O-N 3.47Å; H753-S756 PolarHBondContact O-N 3.07Å; H753-M757 VanDerWaalsContact O-CB 3.29Å; H753-M757 WeakPolarHBondContact O-CB 3.45Å; H753-M757 PolarHBondContact O-N 3.22Å
754	L	89.1	Confident	89.7	Confident	86 Å²	86	92 Å²	92	45%	0.45	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-34.6	174.6	-74.8	172.1	0	0	0	112.2	M750 S751 M757 N758	M750-L754 WeakPolarHBondContact O-CB 3.36Å; M750-L754 VanDerWaalsContact O-CG 3.23Å; M750-L754 WeakPolarHBondContact O-CG 3.36Å; M750-L754 PolarHBondContact O-N 2.96Å; S751-L754 PolarHBondContact O-N 2.64Å; L754-M757 HydrophobicContact CD2-CE 3.82Å; L754-N758 WeakPolarHBondContact O-CB 3.45Å; L754-N758 PolarHBondContact O-N 2.84Å
755	C	86	Confident	89.4	Confident	72 Å²	72	95.5 Å²	95.5	49%	0.486	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-51.3	174.2	-165.8	0	0	0	0	111.1	S751 D752 H753 M757 N758 E759	S751-C755 WeakPolarHBondContact O-CB 3.37Å; S751-C755 PolarHBondContact O-N 3.23Å; D752-C755 WeakPolarHBondContact O-CB 3.45Å; D752-C755 PolarHBondContact O-N 3.43Å; H753-C755 VanDerWaalsContact C-N 3.31Å; H753-C755 PolarHBondContact O-N 3.47Å; C755-M757 VanDerWaalsContact C-N 3.32Å; C755-M757 PolarHBondContact O-N 2.84Å; C755-N758 PolarHBondContact O-N 3.49Å; C755-N758 VanDerWaalsContact O-N 3.13Å; C755-E759 PolarHBondContact O-N 3.05Å
756	S	89.1	Confident	89.1	Confident	70 Å²	70	96.8 Å²	96.8	49%	0.49	50%	0.501	S	S	.	.	H	α-helix	trans	-59.8	-39.7	175.6	-174.9	0	0	0	0	112.6	D752 H753 E759 T760	D752-S756 WeakPolarHBondContact O-CB 3.22Å; D752-S756 PolarHBondContact O-N 2.76Å; H753-S756 PolarHBondContact O-N 3.07Å; S756-E759 WeakPolarHBondContact O-CB 3.22Å; S756-E759 PolarHBondContact O-N 3.32Å; S756-T760 PolarHBondContact O-N 3.01Å; S756-T760 PolarHBondContact O-OG1 2.79Å
757	M	88.2	Confident	88.6	Confident	81 Å²	81	97.9 Å²	97.9	40%	0.399	51%	0.506	S	S	.	.	H	α-helix	trans	-64.8	-42.6	173.9	-167.5	178.5	73.8	0	0	111.7	H753 L754 C755 E759 T760 L761	H753-M757 VanDerWaalsContact O-CB 3.29Å; H753-M757 WeakPolarHBondContact O-CB 3.45Å; H753-M757 PolarHBondContact O-N 3.22Å; L754-M757 HydrophobicContact CD2-CE 3.82Å; C755-M757 VanDerWaalsContact C-N 3.32Å; C755-M757 PolarHBondContact O-N 2.84Å; M757-E759 PolarHBondContact O-N 3.29Å; M757-T760 WeakPolarHBondContact CA-OG1 3.31Å; M757-T760 PolarHBondContact O-N 3.48Å; M757-T760 PolarHBondContact O-OG1 3.07Å; M757-L761 HydrophobicContact CG-CD1 4.23Å; M757-L761 WeakPolarHBondContact O-CB 3.42Å; M757-L761 VanDerWaalsContact O-CG 3.28Å; M757-L761 WeakPolarHBondContact O-CG 3.34Å; M757-L761 PolarHBondContact O-N 3.22Å
758	N	88.4	Confident	88.1	Confident	106 Å²	106	96.9 Å²	96.9	57%	0.567	50%	0.5	S	S	*	.	H	α-helix	trans	-64.3	-37.5	173.7	-82.7	-23	0	0	0	112.6	L754 C755 L761 S762	L754-N758 WeakPolarHBondContact O-CB 3.45Å; L754-N758 PolarHBondContact O-N 2.84Å; C755-N758 PolarHBondContact O-N 3.49Å; C755-N758 VanDerWaalsContact O-N 3.13Å; N758-L761 PolarHBondContact O-N 3.31Å; N758-S762 WeakPolarHBondContact O-CB 3.5Å; N758-S762 PolarHBondContact O-N 3.09Å
759	E	90.3	Very high	87.5	Confident	101 Å²	101	96.9 Å²	96.9	47%	0.472	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-46	172.9	-83.2	-163.9	-154.1	0	0	112.1	C755 S756 M757 S762 K763	C755-E759 PolarHBondContact O-N 3.05Å; S756-E759 WeakPolarHBondContact O-CB 3.22Å; S756-E759 PolarHBondContact O-N 3.32Å; M757-E759 PolarHBondContact O-N 3.29Å; E759-S762 PolarHBondContact O-N 2.93Å; E759-K763 WeakPolarHBondContact O-CB 3.24Å; E759-K763 WeakPolarHBondContact O-CD 3.43Å; E759-K763 VanDerWaalsContact O-CG 3.27Å; E759-K763 WeakPolarHBondContact O-CG 3.48Å; E759-K763 PolarHBondContact O-N 3.46Å; E759-K763 IonicContact OE2-NZ 3.85Å; E759-K763 PolarHBondContact OE2-NZ 3.46Å
760	T	89.8	Confident	86.8	Confident	66 Å²	66	97.2 Å²	97.2	41%	0.405	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-38.5	178.9	51.9	0	0	0	0	111.9	S756 M757 K763 Q764	S756-T760 PolarHBondContact O-N 3.01Å; S756-T760 PolarHBondContact O-OG1 2.79Å; M757-T760 WeakPolarHBondContact CA-OG1 3.31Å; M757-T760 PolarHBondContact O-N 3.48Å; M757-T760 PolarHBondContact O-OG1 3.07Å; T760-K763 PolarHBondContact O-N 2.79Å; T760-Q764 WeakPolarHBondContact O-CB 3.35Å; T760-Q764 VanDerWaalsContact O-CG 3.31Å; T760-Q764 WeakPolarHBondContact O-CG 3.22Å; T760-Q764 PolarHBondContact O-N 2.89Å
761	L	86.4	Confident	86.3	Confident	88 Å²	88	97.3 Å²	97.3	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-36.1	171.5	-70.3	169.6	0	0	0	112.6	M757 N758 R765	M757-L761 HydrophobicContact CG-CD1 4.23Å; M757-L761 WeakPolarHBondContact O-CB 3.42Å; M757-L761 VanDerWaalsContact O-CG 3.28Å; M757-L761 WeakPolarHBondContact O-CG 3.34Å; M757-L761 PolarHBondContact O-N 3.22Å; N758-L761 PolarHBondContact O-N 3.31Å; L761-R765 VanDerWaalsContact O-CB 3.3Å; L761-R765 WeakPolarHBondContact O-CB 3.33Å; L761-R765 PolarHBondContact O-N 2.82Å
762	S	87	Confident	85.4	Confident	54 Å²	54	99.6 Å²	99.6	38%	0.378	50%	0.5	S	S	.	.	H	α-helix	trans	-67.6	-46.3	174.3	-162.4	0	0	0	0	111.4	N758 E759 Q764 R765 E766	N758-S762 WeakPolarHBondContact O-CB 3.5Å; N758-S762 PolarHBondContact O-N 3.09Å; E759-S762 PolarHBondContact O-N 2.93Å; S762-Q764 PolarHBondContact O-N 3.31Å; S762-R765 CarbonylContact O-C 3.36Å; S762-R765 WeakPolarHBondContact O-CA 3.49Å; S762-R765 WeakPolarHBondContact O-CB 3.27Å; S762-R765 PolarHBondContact O-N 3.49Å; S762-E766 WeakPolarHBondContact O-CG 3.47Å; S762-E766 PolarHBondContact O-N 3.39Å; S762-E766 PolarHBondContact OG-OE1 3.37Å; S762-E766 VanDerWaalsContact OG-OE1 3.09Å
763	K	87.8	Confident	84.3	Confident	112 Å²	112	100.6 Å²	100.6	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-59.8	-44.5	176.4	-70.2	160.3	-168.9	164.8	0	111.6	E759 T760 R765 E766 E767	E759-K763 WeakPolarHBondContact O-CB 3.24Å; E759-K763 WeakPolarHBondContact O-CD 3.43Å; E759-K763 VanDerWaalsContact O-CG 3.27Å; E759-K763 WeakPolarHBondContact O-CG 3.48Å; E759-K763 PolarHBondContact O-N 3.46Å; E759-K763 IonicContact OE2-NZ 3.85Å; E759-K763 PolarHBondContact OE2-NZ 3.46Å; T760-K763 PolarHBondContact O-N 2.79Å; K763-R765 VanDerWaalsContact C-N 3.32Å; K763-R765 PolarHBondContact O-N 3.2Å; K763-E766 PolarHBondContact O-N 2.83Å; K763-E767 WeakPolarHBondContact O-CB 3.48Å; K763-E767 PolarHBondContact O-N 2.87Å
764	Q	86.3	Confident	82.8	Confident	107 Å²	107	96 Å²	96	50%	0.5	49%	0.493	S	S	.	.	H	α-helix	trans	-62.4	-37.3	172.9	-75.3	176.7	-10.1	0	0	112.5	T760 S762 E767 I768	T760-Q764 WeakPolarHBondContact O-CB 3.35Å; T760-Q764 VanDerWaalsContact O-CG 3.31Å; T760-Q764 WeakPolarHBondContact O-CG 3.22Å; T760-Q764 PolarHBondContact O-N 2.89Å; S762-Q764 PolarHBondContact O-N 3.31Å; Q764-E767 PolarHBondContact O-N 3Å; Q764-I768 WeakPolarHBondContact O-CB 3.46Å; Q764-I768 WeakPolarHBondContact O-CD1 3.28Å; Q764-I768 WeakPolarHBondContact O-CG1 3.33Å; Q764-I768 PolarHBondContact O-N 3.35Å
765	R	87.4	Confident	81.4	Confident	175 Å²	175	93.8 Å²	93.8	66%	0.66	49%	0.492	S	S	*	.	H	α-helix	trans	-69.1	-41.2	176.8	-176.4	175.7	178.3	171	0.6	112.3	L761 S762 K763 E767 I768 D769	L761-R765 VanDerWaalsContact O-CB 3.3Å; L761-R765 WeakPolarHBondContact O-CB 3.33Å; L761-R765 PolarHBondContact O-N 2.82Å; S762-R765 CarbonylContact O-C 3.36Å; S762-R765 WeakPolarHBondContact O-CA 3.49Å; S762-R765 WeakPolarHBondContact O-CB 3.27Å; S762-R765 PolarHBondContact O-N 3.49Å; K763-R765 VanDerWaalsContact C-N 3.32Å; K763-R765 PolarHBondContact O-N 3.2Å; R765-E767 VanDerWaalsContact C-N 3.35Å; R765-I768 PolarHBondContact O-N 2.82Å; R765-D769 WeakPolarHBondContact O-CB 3.21Å; R765-D769 PolarHBondContact O-N 2.99Å
766	E	85.4	Confident	80	Confident	111 Å²	111	97.9 Å²	97.9	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-61.2	-43.2	173.1	-73.3	161.9	-141.9	0	0	111	S762 K763 D769 M770	S762-E766 WeakPolarHBondContact O-CG 3.47Å; S762-E766 PolarHBondContact O-N 3.39Å; S762-E766 PolarHBondContact OG-OE1 3.37Å; S762-E766 VanDerWaalsContact OG-OE1 3.09Å; K763-E766 PolarHBondContact O-N 2.83Å; E766-D769 PolarHBondContact O-N 2.86Å; E766-M770 WeakPolarHBondContact O-CB 3.38Å; E766-M770 WeakPolarHBondContact O-CG 3.38Å; E766-M770 PolarHBondContact O-N 3.24Å
767	E	83.7	Confident	78.3	Confident	115 Å²	115	97.4 Å²	97.4	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-62.3	-45.1	173.7	-173.8	172	-151.9	0	0	112.3	K763 Q764 R765 D769 M770 L771	K763-E767 WeakPolarHBondContact O-CB 3.48Å; K763-E767 PolarHBondContact O-N 2.87Å; Q764-E767 PolarHBondContact O-N 3Å; R765-E767 VanDerWaalsContact C-N 3.35Å; E767-D769 VanDerWaalsContact C-N 3.35Å; E767-D769 PolarHBondContact O-N 3.39Å; E767-M770 PolarHBondContact O-N 2.85Å; E767-L771 HydrophobicContact CG-CD1 4.36Å; E767-L771 WeakPolarHBondContact O-CB 3.43Å; E767-L771 VanDerWaalsContact O-CG 3.3Å; E767-L771 WeakPolarHBondContact O-CG 3.39Å; E767-L771 PolarHBondContact O-N 2.66Å
768	I	80.4	Confident	76.6	Confident	87 Å²	87	98.8 Å²	98.8	45%	0.446	51%	0.51	S	S	.	.	H	α-helix	trans	-60	-42.1	174.1	-75.7	165.3	0	0	0	111.7	Q764 R765 L771 K772	Q764-I768 WeakPolarHBondContact O-CB 3.46Å; Q764-I768 WeakPolarHBondContact O-CD1 3.28Å; Q764-I768 WeakPolarHBondContact O-CG1 3.33Å; Q764-I768 PolarHBondContact O-N 3.35Å; R765-I768 PolarHBondContact O-N 2.82Å; I768-L771 PolarHBondContact O-N 2.64Å; I768-K772 HydrophobicContact CG2-CD 4.47Å; I768-K772 VanDerWaalsContact CG2-CE 3.43Å; I768-K772 WeakPolarHBondContact O-CG 3.19Å; I768-K772 PolarHBondContact O-N 3.16Å
769	D	78.9	Confident	75	Confident	60 Å²	60	97.1 Å²	97.1	32%	0.321	51%	0.511	S	S	.	.	H	α-helix	trans	-76.2	-30.9	-179.7	-73.2	-24.2	0	0	0	112	R765 E766 E767 K772 L773	R765-D769 WeakPolarHBondContact O-CB 3.21Å; R765-D769 PolarHBondContact O-N 2.99Å; E766-D769 PolarHBondContact O-N 2.86Å; E767-D769 VanDerWaalsContact C-N 3.35Å; E767-D769 PolarHBondContact O-N 3.39Å; D769-K772 PolarHBondContact O-N 2.97Å; D769-K772 WeakPolarHBondContact OD1-CD 3.37Å; D769-K772 WeakPolarHBondContact OD1-CE 3.37Å; D769-K772 IonicContact OD1-NZ 3.11Å; D769-K772 PolarHBondContact OD1-NZ 2.84Å; D769-L773 WeakPolarHBondContact O-CG 3.42Å; D769-L773 PolarHBondContact O-N 3.36Å
770	M	78	Confident	73.2	Confident	128 Å²	128	101 Å²	101	63%	0.631	53%	0.527	S	S	*	.	H	α-helix	trans	-61.3	-44.6	164.9	-77	-163.5	-65.3	0	0	111.9	E766 E767 K772 L773 G774	E766-M770 WeakPolarHBondContact O-CB 3.38Å; E766-M770 WeakPolarHBondContact O-CG 3.38Å; E766-M770 PolarHBondContact O-N 3.24Å; E767-M770 PolarHBondContact O-N 2.85Å; M770-K772 VanDerWaalsContact C-N 3.34Å; M770-K772 PolarHBondContact O-N 3.17Å; M770-L773 PolarHBondContact O-N 2.87Å; M770-L773 VanDerWaalsContact O-N 3.17Å; M770-G774 PolarHBondContact O-N 3.41Å
771	L	75.9	Confident	71.4	Confident	123 Å²	123	105.5 Å²	105.5	64%	0.644	54%	0.541	S	S	*	.	H	α-helix	trans	-63.2	-38.4	176.6	-73	168.1	0	0	0	111.9	E767 I768 G774 G775	E767-L771 HydrophobicContact CG-CD1 4.36Å; E767-L771 WeakPolarHBondContact O-CB 3.43Å; E767-L771 VanDerWaalsContact O-CG 3.3Å; E767-L771 WeakPolarHBondContact O-CG 3.39Å; E767-L771 PolarHBondContact O-N 2.66Å; I768-L771 PolarHBondContact O-N 2.64Å; L771-G774 PolarHBondContact O-N 2.88Å; L771-G775 PolarHBondContact O-N 3.49Å
772	K	71.1	Confident	69.7	Low	118 Å²	118	108.5 Å²	108.5	51%	0.513	56%	0.557	S	S	.	*	H	α-helix	trans	-64.5	-38.6	171.9	-70	170.4	-160.5	157.4	0	112.6	I768 D769 M770 K776	I768-K772 HydrophobicContact CG2-CD 4.47Å; I768-K772 VanDerWaalsContact CG2-CE 3.43Å; I768-K772 WeakPolarHBondContact O-CG 3.19Å; I768-K772 PolarHBondContact O-N 3.16Å; D769-K772 PolarHBondContact O-N 2.97Å; D769-K772 WeakPolarHBondContact OD1-CD 3.37Å; D769-K772 WeakPolarHBondContact OD1-CE 3.37Å; D769-K772 IonicContact OD1-NZ 3.11Å; D769-K772 PolarHBondContact OD1-NZ 2.84Å; M770-K772 VanDerWaalsContact C-N 3.34Å; M770-K772 PolarHBondContact O-N 3.17Å; K772-K776 WeakPolarHBondContact O-CG 3.39Å; K772-K776 PolarHBondContact O-N 3.27Å; K772-K776 VanDerWaalsContact O-N 3.09Å
773	L	68.5	Low	67.9	Low	119 Å²	119	115.3 Å²	115.3	62%	0.623	58%	0.58	S	S	*	*	H	α-helix	trans	-67.2	-43.1	175.4	-74.7	164.3	0	0	0	111.4	D769 M770 K776 A777	D769-L773 WeakPolarHBondContact O-CG 3.42Å; D769-L773 PolarHBondContact O-N 3.36Å; M770-L773 PolarHBondContact O-N 2.87Å; M770-L773 VanDerWaalsContact O-N 3.17Å; L773-K776 PolarHBondContact O-N 2.98Å; L773-A777 PolarHBondContact O-N 3.49Å
774	G	61.2	Low	66	Low	36 Å²	36	115.1 Å²	115.1	37%	0.371	59%	0.593	S	S	.	*	H	α-helix	trans	-61.4	-41.2	172.7	0	0	0	0	0	113	M770 L771 K776 A777 N778	M770-G774 PolarHBondContact O-N 3.41Å; L771-G774 PolarHBondContact O-N 2.88Å; G774-K776 VanDerWaalsContact C-N 3.35Å; G774-K776 PolarHBondContact O-N 2.82Å; G774-A777 WeakPolarHBondContact O-CB 3.39Å; G774-A777 PolarHBondContact O-N 3.1Å; G774-A777 VanDerWaalsContact O-N 3.12Å; G774-N778 PolarHBondContact O-N 2.81Å
775	G	59.2	Low	63.7	Low	41 Å²	41	124.8 Å²	124.8	42%	0.423	63%	0.625	S	S	.	*	H	α-helix	trans	-58.5	-43.7	172.5	0	0	0	0	0	112.7	L771 A777 N778 A779	L771-G775 PolarHBondContact O-N 3.49Å; G775-A777 VanDerWaalsContact C-N 3.32Å; G775-A777 PolarHBondContact O-N 3.39Å; G775-N778 PolarHBondContact O-N 2.97Å; G775-A779 WeakPolarHBondContact O-CB 3.26Å; G775-A779 PolarHBondContact O-N 3.16Å
776	K	56.1	Low	62.5	Low	158 Å²	158	122.3 Å²	122.3	69%	0.687	62%	0.623	S	S	*	*	H	α-helix	trans	-66	-30.3	174.2	-73.3	177.6	178.6	179.3	0	113.2	K772 L773 G774	K772-K776 WeakPolarHBondContact O-CG 3.39Å; K772-K776 PolarHBondContact O-N 3.27Å; K772-K776 VanDerWaalsContact O-N 3.09Å; L773-K776 PolarHBondContact O-N 2.98Å; G774-K776 VanDerWaalsContact C-N 3.35Å; G774-K776 PolarHBondContact O-N 2.82Å
777	A	54.3	Low	61.3	Low	59 Å²	59	122.9 Å²	122.9	49%	0.488	63%	0.628	S	S	.	*	H	α-helix	trans	-69.9	-45.4	173.6	0	0	0	0	0	112	L773 G774 G775 A779 K780	L773-A777 PolarHBondContact O-N 3.49Å; G774-A777 WeakPolarHBondContact O-CB 3.39Å; G774-A777 PolarHBondContact O-N 3.1Å; G774-A777 VanDerWaalsContact O-N 3.12Å; G775-A777 VanDerWaalsContact C-N 3.32Å; G775-A777 PolarHBondContact O-N 3.39Å; A777-A779 PolarHBondContact O-N 2.83Å; A777-K780 PolarHBondContact O-N 3.05Å
778	N	53.1	Low	60.1	Low	110 Å²	110	123.3 Å²	123.3	59%	0.588	63%	0.633	S	S	*	*	H	α-helix	trans	-65.7	-36.4	176.6	-82.5	-18.1	0	0	0	112.7	G774 G775 K780 K781 N782	G774-N778 PolarHBondContact O-N 2.81Å; G775-N778 PolarHBondContact O-N 2.97Å; N778-K780 PolarHBondContact O-N 3.04Å; N778-K780 VanDerWaalsContact O-N 3.16Å; N778-K781 PolarHBondContact O-N 3.01Å; N778-N782 PolarHBondContact O-N 3Å
779	A	54.3	Low	58.9	Low	71 Å²	71	125.5 Å²	125.5	59%	0.587	64%	0.644	S	S	*	*	H	α-helix	trans	-58.7	-25.8	174.1	0	0	0	0	0	113.6	G775 A777	G775-A779 WeakPolarHBondContact O-CB 3.26Å; G775-A779 PolarHBondContact O-N 3.16Å; A777-A779 PolarHBondContact O-N 2.83Å
780	K	52.4	Low	57.6	Low	183 Å²	183	129.6 Å²	129.6	80%	0.796	67%	0.665	S	S	*	*	H	α-helix	trans	-80.9	-21.4	173.3	-90.3	-171.5	172.7	-176.1	0	114.5	A777 N778	A777-K780 PolarHBondContact O-N 3.05Å; N778-K780 PolarHBondContact O-N 3.04Å; N778-K780 VanDerWaalsContact O-N 3.16Å
781	K	52.8	Low	56.3	Low	161 Å²	161	129.7 Å²	129.7	70%	0.7	67%	0.667	S	S	*	*	H	α-helix	trans	-78	-35.9	176.7	-88.8	-174.1	172.4	179.8	0	112.9	N778 K783 S784	N778-K781 PolarHBondContact O-N 3.01Å; K781-K783 PolarHBondContact O-N 3.01Å; K781-K783 VanDerWaalsContact O-N 3.07Å; K781-S784 PolarHBondContact O-N 2.71Å
782	N	50.3	Low	54.9	Low	151 Å²	151	130.1 Å²	130.1	81%	0.807	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	17.2	-178.6	-77.2	10.7	0	0	0	114.8	N778	N778-N782 PolarHBondContact O-N 3Å
783	K	49.3	Very low	53.6	Low	197 Å²	197	131.1 Å²	131.1	86%	0.857	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	21.6	173.1	-136.5	174.3	-173	178.6	0	113.1	K781	K781-K783 PolarHBondContact O-N 3.01Å; K781-K783 VanDerWaalsContact O-N 3.07Å
784	S	47	Very low	52.4	Low	107 Å²	107	132.1 Å²	132.1	75%	0.748	69%	0.685	S	S	*	*			trans	-138.5	48.3	-179.9	-179.6	0	0	0	0	110.7	K781	K781-S784 PolarHBondContact O-N 2.71Å
785	R	38.9	Very low	51.6	Low	311 Å²	311	140.8 Å²	140.8	100%	1.174	71%	0.714	S	S	*	*			trans	-153.8	0	171.7	-150.5	176.7	-164.8	-175.2	3.6	110.3

Retrieved 785 of 785 residues in 156.6 ms (Link to these results)

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