A0A5K4FBE3_SCHMA Loading...

Centrosomal protein of 95 kDa

AlphaFold DB , UniProt , Accession A0A5K4FBE3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 530 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.1	Very low	60.1	Low	244 Å²	244	119.5 Å²	119.5	100%	1.202	65%	0.65	S	S	*	*				0	107.5	0	-73	-161.2	162.8	0	0	108.9	M3	M1-M3 PolarHBondContact O-N 3.34Å
2	S	37.2	Very low	62.4	Low	116 Å²	116	109.8 Å²	109.8	81%	0.811	60%	0.597	S	S	*	*			trans	-73.2	121.9	-178.9	-163.7	0	0	0	0	109.1	R4	S2-R4 PolarHBondContact O-N 3.26Å
3	M	39.2	Very low	64.4	Low	189 Å²	189	104.4 Å²	104.4	93%	0.931	57%	0.567	S	S	*	*			trans	-60.1	99.2	172.9	-80.5	-157.9	164.4	0	0	108.9	M1 R5	M1-M3 PolarHBondContact O-N 3.34Å; M3-R5 PolarHBondContact O-N 3.38Å; M3-R5 VanDerWaalsContact O-N 3.14Å
4	R	51.7	Low	66.2	Low	139 Å²	139	102.1 Å²	102.1	53%	0.525	56%	0.562	S	S	.	*			trans	-66.3	110.3	175.8	-72.5	179.6	178.9	-173.7	-0.3	107.3	S2 R7 E97	S2-R4 PolarHBondContact O-N 3.26Å; R4-R7 VanDerWaalsContact NH1-NH2 3.15Å; R4-E97 IonicContact CZ-OE1 3.2Å; R4-E97 IonicContact CZ-OE2 2.61Å; R4-E97 IonicContact NH1-OE1 3.72Å; R4-E97 IonicContact NH1-OE2 3.66Å; R4-E97 PolarHBondContact NH1-OE2 3.35Å; R4-E97 IonicContact NH2-OE1 3.02Å; R4-E97 PolarHBondContact NH2-OE1 3.45Å; R4-E97 IonicContact NH2-OE2 3.67Å
5	R	51.2	Low	67.9	Low	233 Å²	233	97 Å²	97	88%	0.879	53%	0.532	S	S	*	.			trans	-49.5	142.3	169.7	-69.9	178.6	-172.1	-177.8	1.8	109.2	M3 R7	M3-R5 PolarHBondContact O-N 3.38Å; M3-R5 VanDerWaalsContact O-N 3.14Å; R5-R7 PolarHBondContact O-N 2.71Å
6	G	54.2	Low	69.3	Low	70 Å²	70	90.9 Å²	90.9	72%	0.722	50%	0.499	S	S	*	.			trans	-46.5	115.1	-178.3	0	0	0	0	0	111.4
7	R	64.9	Low	70.6	Confident	71 Å²	71	88.5 Å²	88.5	27%	0.268	49%	0.488	S	S	.	.			trans	-73.9	142.2	179.5	-72	-178.1	-172.7	-127	15.5	109.2	R4 R5 Y93	R4-R7 VanDerWaalsContact NH1-NH2 3.15Å; R5-R7 PolarHBondContact O-N 2.71Å; R7-Y93 VanDerWaalsContact NH1-CE2 3.29Å; R7-Y93 PolarHBondContact NH1-OH 3.25Å
8	A	76	Confident	71.7	Confident	58 Å²	58	89.5 Å²	89.5	48%	0.479	49%	0.488	S	S	.	.			trans	-69.3	146.8	177.1	0	0	0	0	0	109.2	G10 D11	A8-G10 PolarHBondContact O-N 3Å; A8-G10 VanDerWaalsContact O-N 3.11Å; A8-D11 PolarHBondContact N-OD2 3.08Å; A8-D11 WeakPolarHBondContact O-CB 3.37Å; A8-D11 PolarHBondContact O-N 3.04Å
9	V	79.2	Confident	72.6	Confident	73 Å²	73	84.8 Å²	84.8	44%	0.442	46%	0.462	S	S	.	.	H	α-helix	trans	-53.2	-32	176	170.3	0	0	0	0	111.9	D11 V12 L13 I31 P89	V9-D11 PolarHBondContact O-N 3.49Å; V9-V12 PolarHBondContact O-N 3.23Å; V9-L13 PolarHBondContact O-N 3.38Å; V9-I31 HydrophobicContact CG1-CD1 3.14Å; V9-I31 HydrophobicContact CG1-CG1 3.54Å; V9-P89 HydrophobicContact CG2-CG 3.88Å
10	G	82	Confident	73.5	Confident	47 Å²	47	80.6 Å²	80.6	49%	0.485	44%	0.439	S	S	.	.	H	α-helix	trans	-66.1	-29.1	174.9	0	0	0	0	0	115	A8 V12 L13 S14	A8-G10 PolarHBondContact O-N 3Å; A8-G10 VanDerWaalsContact O-N 3.11Å; G10-V12 VanDerWaalsContact C-N 3.29Å; G10-V12 PolarHBondContact O-N 3.35Å; G10-L13 PolarHBondContact O-N 3.06Å; G10-S14 PolarHBondContact O-N 3.08Å; G10-S14 VanDerWaalsContact O-N 3.17Å; G10-S14 PolarHBondContact O-OG 3.23Å
11	D	86.1	Confident	74.3	Confident	75 Å²	75	80.8 Å²	80.8	40%	0.401	45%	0.447	S	S	.	.	H	α-helix	trans	-70.1	-30.8	177.3	-59.9	-28.8	0	0	0	111.2	A8 V9 S14 F15	A8-D11 PolarHBondContact N-OD2 3.08Å; A8-D11 WeakPolarHBondContact O-CB 3.37Å; A8-D11 PolarHBondContact O-N 3.04Å; V9-D11 PolarHBondContact O-N 3.49Å; D11-S14 PolarHBondContact O-OG 3.45Å; D11-S14 VanDerWaalsContact O-OG 3.1Å; D11-F15 VanDerWaalsContact O-CB 3.27Å; D11-F15 WeakPolarHBondContact O-CB 3.13Å; D11-F15 PolarHBondContact O-N 3.19Å
12	V	87.6	Confident	76.5	Confident	3 Å²	3	71.7 Å²	71.7	2%	0.018	41%	0.405	C	S	.	.	H	α-helix	trans	-72.5	-41.8	178.4	-174.5	0	0	0	0	110.5	V9 G10 F15 A16 I34 P89 L92 Y93 L96	V9-V12 PolarHBondContact O-N 3.23Å; G10-V12 VanDerWaalsContact C-N 3.29Å; G10-V12 PolarHBondContact O-N 3.35Å; V12-F15 PolarHBondContact O-N 3.09Å; V12-A16 VanDerWaalsContact O-CB 3.29Å; V12-A16 WeakPolarHBondContact O-CB 3.12Å; V12-A16 PolarHBondContact O-N 3.01Å; V12-I34 HydrophobicContact CG1-CD1 4.3Å; V12-P89 HydrophobicContact CG2-CB 3.9Å; V12-P89 WeakPolarHBondContact CG2-O 3.43Å; V12-L92 HydrophobicContact CG1-CB 4.22Å; V12-Y93 HydrophobicContact CG2-CD2 4.39Å; V12-L96 HydrophobicContact CG1-CD1 4.03Å
13	L	89.4	Confident	78.8	Confident	39 Å²	39	67.2 Å²	67.2	20%	0.204	37%	0.373	C	S	.	.	H	α-helix	trans	-66.9	-43.6	179.9	-172.4	68.1	0	0	0	112.2	V9 G10 F15 A16 T17 P28 I31 I34	V9-L13 PolarHBondContact O-N 3.38Å; G10-L13 PolarHBondContact O-N 3.06Å; L13-F15 VanDerWaalsContact C-N 3.33Å; L13-F15 PolarHBondContact O-N 3.45Å; L13-A16 PolarHBondContact O-N 3.02Å; L13-T17 WeakPolarHBondContact O-CB 3.5Å; L13-T17 PolarHBondContact O-N 3.23Å; L13-T17 PolarHBondContact O-OG1 3.39Å; L13-P28 HydrophobicContact CD1-CB 4.31Å; L13-P28 HydrophobicContact CD1-CG 4.33Å; L13-I31 HydrophobicContact CB-CD1 4.43Å; L13-I31 HydrophobicContact CD2-CD1 4.46Å; L13-I34 HydrophobicContact CD1-CD1 4.17Å
14	S	89.3	Confident	81	Confident	72 Å²	72	61.1 Å²	61.1	50%	0.503	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-41.1	176.6	61.8	0	0	0	0	111.5	G10 D11 T17 Q18	G10-S14 PolarHBondContact O-N 3.08Å; G10-S14 VanDerWaalsContact O-N 3.17Å; G10-S14 PolarHBondContact O-OG 3.23Å; D11-S14 PolarHBondContact O-OG 3.45Å; D11-S14 VanDerWaalsContact O-OG 3.1Å; S14-T17 WeakPolarHBondContact O-CB 3.41Å; S14-T17 PolarHBondContact O-N 3.08Å; S14-Q18 PolarHBondContact O-N 2.99Å
15	F	91.3	Very high	82.8	Confident	26 Å²	26	56.6 Å²	56.6	11%	0.114	34%	0.344	C	S	.	.	H	α-helix	trans	-68.6	-42.4	176.7	-168.2	-117.2	0	0	0	112.3	D11 V12 L13 T17 Q18 V19 Y93 L96 E97 N100	D11-F15 VanDerWaalsContact O-CB 3.27Å; D11-F15 WeakPolarHBondContact O-CB 3.13Å; D11-F15 PolarHBondContact O-N 3.19Å; V12-F15 PolarHBondContact O-N 3.09Å; L13-F15 VanDerWaalsContact C-N 3.33Å; L13-F15 PolarHBondContact O-N 3.45Å; F15-T17 VanDerWaalsContact C-N 3.27Å; F15-T17 PolarHBondContact O-N 3.21Å; F15-Q18 WeakPolarHBondContact O-CB 3.46Å; F15-Q18 PolarHBondContact O-N 3.26Å; F15-Q18 VanDerWaalsContact O-N 3.16Å; F15-V19 HydrophobicContact CD1-CG2 4.35Å; F15-V19 HydrophobicContact CE1-CG2 4.06Å; F15-V19 HydrophobicContact CE2-CG2 4.35Å; F15-V19 HydrophobicContact CZ-CG2 4.05Å; F15-V19 WeakPolarHBondContact O-CG2 3.32Å; F15-V19 PolarHBondContact O-N 3.43Å; F15-Y93 HydrophobicContact CB-CD2 4.43Å; F15-Y93 HydrophobicContact CB-CE2 3.94Å; F15-Y93 HydrophobicContact CD1-CD2 4.06Å; F15-Y93 AromaticContact CD1-CE2 3.7Å; F15-Y93 HydrophobicContact CD1-CE2 3.7Å; F15-Y93 HydrophobicContact CD2-CE2 4.46Å; F15-Y93 HydrophobicContact CE1-CE2 4.32Å; F15-Y93 HydrophobicContact CG-CD2 4.44Å; F15-Y93 AromaticContact CG-CE2 3.78Å; F15-Y93 HydrophobicContact CG-CE2 3.78Å; F15-L96 HydrophobicContact CD1-CB 3.7Å; F15-L96 HydrophobicContact CD1-CD1 4.26Å; F15-L96 HydrophobicContact CE1-CB 3.67Å; F15-E97 HydrophobicContact CE1-CB 4.37Å; F15-N100 HydrophobicContact CZ-CB 4.22Å
16	A	90.4	Very high	84.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.8	-39.1	174.8	0	0	0	0	0	112	V12 L13 V19 A20 P28 I34 F38 L96	V12-A16 VanDerWaalsContact O-CB 3.29Å; V12-A16 WeakPolarHBondContact O-CB 3.12Å; V12-A16 PolarHBondContact O-N 3.01Å; L13-A16 PolarHBondContact O-N 3.02Å; A16-V19 PolarHBondContact O-N 3.12Å; A16-A20 VanDerWaalsContact O-CB 3.31Å; A16-A20 WeakPolarHBondContact O-CB 3.45Å; A16-A20 PolarHBondContact O-N 3.46Å; A16-P28 HydrophobicContact CB-CG 3.95Å; A16-I34 HydrophobicContact CB-CD1 3.62Å; A16-I34 HydrophobicContact CB-CG1 4.2Å; A16-F38 HydrophobicContact CB-CE1 4.36Å; A16-F38 HydrophobicContact CB-CZ 4.39Å; A16-L96 HydrophobicContact CB-CD1 3.79Å; A16-L96 HydrophobicContact CB-CD2 4.27Å
17	T	91.3	Very high	86.1	Confident	50 Å²	50	49.4 Å²	49.4	31%	0.307	32%	0.322	S	S	.	.	H	α-helix	trans	-63	-43.9	174.7	-59.1	0	0	0	0	111.7	L13 S14 F15 A20 S21 A27	L13-T17 WeakPolarHBondContact O-CB 3.5Å; L13-T17 PolarHBondContact O-N 3.23Å; L13-T17 PolarHBondContact O-OG1 3.39Å; S14-T17 WeakPolarHBondContact O-CB 3.41Å; S14-T17 PolarHBondContact O-N 3.08Å; F15-T17 VanDerWaalsContact C-N 3.27Å; F15-T17 PolarHBondContact O-N 3.21Å; T17-A20 PolarHBondContact O-N 3.43Å; T17-S21 PolarHBondContact O-N 2.94Å; T17-A27 HydrophobicContact CG2-CB 3.72Å
18	Q	90.8	Very high	87.1	Confident	106 Å²	106	46.4 Å²	46.4	50%	0.495	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-46.6	175.9	-175	-178	-1	0	0	111.3	S14 F15 S21 T22	S14-Q18 PolarHBondContact O-N 2.99Å; F15-Q18 WeakPolarHBondContact O-CB 3.46Å; F15-Q18 PolarHBondContact O-N 3.26Å; F15-Q18 VanDerWaalsContact O-N 3.16Å; Q18-S21 PolarHBondContact O-N 3.44Å; Q18-S21 PolarHBondContact O-OG 2.87Å; Q18-T22 PolarHBondContact O-N 3.32Å; Q18-T22 VanDerWaalsContact O-N 3.17Å
19	V	89.2	Confident	87.5	Confident	0 Å²	0	50 Å²	50	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.9	-36.6	179.5	-178.3	0	0	0	0	111.8	F15 A16 S21 T22 V23 M42 I99 N100	F15-V19 HydrophobicContact CD1-CG2 4.35Å; F15-V19 HydrophobicContact CE1-CG2 4.06Å; F15-V19 HydrophobicContact CE2-CG2 4.35Å; F15-V19 HydrophobicContact CZ-CG2 4.05Å; F15-V19 WeakPolarHBondContact O-CG2 3.32Å; F15-V19 PolarHBondContact O-N 3.43Å; A16-V19 PolarHBondContact O-N 3.12Å; V19-S21 VanDerWaalsContact C-N 3.29Å; V19-S21 PolarHBondContact O-N 3.27Å; V19-T22 WeakPolarHBondContact CA-OG1 3.43Å; V19-T22 PolarHBondContact O-N 2.93Å; V19-T22 PolarHBondContact O-OG1 3.06Å; V19-V23 WeakPolarHBondContact O-CG2 3.3Å; V19-V23 PolarHBondContact O-N 3.36Å; V19-M42 HydrophobicContact CB-CE 4.19Å; V19-M42 HydrophobicContact CG1-CE 3.9Å; V19-M42 HydrophobicContact CG1-SD 4.19Å; V19-I99 HydrophobicContact CG1-CG2 4.26Å; V19-N100 HydrophobicContact CG1-CB 4.31Å; V19-N100 HydrophobicContact CG2-CB 3.73Å
20	A	90.2	Very high	87.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.9	-40.7	173.2	0	0	0	0	0	111.3	A16 T17 T22 V23 G24 L25 F38 M42	A16-A20 VanDerWaalsContact O-CB 3.31Å; A16-A20 WeakPolarHBondContact O-CB 3.45Å; A16-A20 PolarHBondContact O-N 3.46Å; T17-A20 PolarHBondContact O-N 3.43Å; A20-T22 VanDerWaalsContact C-N 3.35Å; A20-T22 PolarHBondContact O-N 2.92Å; A20-V23 PolarHBondContact O-N 3.27Å; A20-G24 PolarHBondContact O-N 2.87Å; A20-L25 HydrophobicContact CB-CB 4.31Å; A20-L25 PolarHBondContact O-N 3.48Å; A20-F38 HydrophobicContact CB-CE2 4.18Å; A20-F38 HydrophobicContact CB-CZ 4.09Å; A20-M42 HydrophobicContact CB-CE 4.05Å
21	S	89.5	Confident	87.8	Confident	85 Å²	85	51.6 Å²	51.6	59%	0.594	32%	0.316	S	S	*	.	H	α-helix	trans	-66.2	-33.4	178.2	74.8	0	0	0	0	113.5	T17 Q18 V19	T17-S21 PolarHBondContact O-N 2.94Å; Q18-S21 PolarHBondContact O-N 3.44Å; Q18-S21 PolarHBondContact O-OG 2.87Å; V19-S21 VanDerWaalsContact C-N 3.29Å; V19-S21 PolarHBondContact O-N 3.27Å
22	T	86.8	Confident	87.6	Confident	54 Å²	54	52.5 Å²	52.5	33%	0.331	33%	0.328	S	S	.	.	H	α-helix	trans	-73.4	-30	177.3	54.3	0	0	0	0	112.3	Q18 V19 A20	Q18-T22 PolarHBondContact O-N 3.32Å; Q18-T22 VanDerWaalsContact O-N 3.17Å; V19-T22 WeakPolarHBondContact CA-OG1 3.43Å; V19-T22 PolarHBondContact O-N 2.93Å; V19-T22 PolarHBondContact O-OG1 3.06Å; A20-T22 VanDerWaalsContact C-N 3.35Å; A20-T22 PolarHBondContact O-N 2.92Å
23	V	85.3	Confident	87.5	Confident	22 Å²	22	55.6 Å²	55.6	13%	0.133	34%	0.344	C	S	.	.	H	α-helix	trans	-90.1	-13.2	179.3	-177.4	0	0	0	0	112.4	V19 A20 L25 K45 I46 A103	V19-V23 WeakPolarHBondContact O-CG2 3.3Å; V19-V23 PolarHBondContact O-N 3.36Å; A20-V23 PolarHBondContact O-N 3.27Å; V23-L25 HydrophobicContact CG1-CD1 4.33Å; V23-L25 HydrophobicContact CG1-CG 4.4Å; V23-K45 HydrophobicContact CG1-CB 3.38Å; V23-K45 HydrophobicContact CG1-CG 4.01Å; V23-I46 HydrophobicContact CG1-CG1 4.24Å; V23-I46 HydrophobicContact CG2-CD1 4Å; V23-I46 HydrophobicContact CG2-CG1 4.26Å; V23-A103 HydrophobicContact CG2-CB 3.81Å
24	G	85.4	Confident	87.3	Confident	61 Å²	61	53.7 Å²	53.7	63%	0.629	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	31.7	180	0	0	0	0	0	114.4	A20	A20-G24 PolarHBondContact O-N 2.87Å
25	L	88	Confident	87.1	Confident	43 Å²	43	52.4 Å²	52.4	23%	0.225	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-103	161.1	175.4	-67.3	174.1	0	0	0	111.6	A20 V23 M42 K45	A20-L25 HydrophobicContact CB-CB 4.31Å; A20-L25 PolarHBondContact O-N 3.48Å; V23-L25 HydrophobicContact CG1-CD1 4.33Å; V23-L25 HydrophobicContact CG1-CG 4.4Å; L25-M42 HydrophobicContact CD1-CB 4.23Å; L25-M42 HydrophobicContact CD1-CG 3.55Å; L25-K45 HydrophobicContact CD2-CG 4.32Å
26	S	88.2	Confident	86.9	Confident	105 Å²	105	51.4 Å²	51.4	73%	0.734	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-65.1	135.3	173.3	53.5	0	0	0	0	111.1
27	A	86.6	Confident	86.7	Confident	48 Å²	48	56.2 Å²	56.2	40%	0.397	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-64.8	131.5	179.5	0	0	0	0	0	111.8	T17	T17-A27 HydrophobicContact CG2-CB 3.72Å
28	P	87.2	Confident	86.6	Confident	7 Å²	7	54.8 Å²	54.8	5%	0.045	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-69.6	133.4	172.6	28.2	-31.6	0	0	0	110.1	L13 A16 D33 I34 F38	L13-P28 HydrophobicContact CD1-CB 4.31Å; L13-P28 HydrophobicContact CD1-CG 4.33Å; A16-P28 HydrophobicContact CB-CG 3.95Å; P28-D33 HydrophobicContact CB-CB 3.75Å; P28-I34 HydrophobicContact CB-CG1 4.09Å; P28-I34 HydrophobicContact CG-CG1 4.18Å; P28-F38 HydrophobicContact CB-CE2 4.4Å; P28-F38 HydrophobicContact CG-CE2 4.01Å; P28-F38 HydrophobicContact CG-CZ 3.85Å
29	N	84.4	Confident	86.5	Confident	134 Å²	134	49.8 Å²	49.8	72%	0.717	31%	0.306	S	S	*	.	S	Bend	trans	-93.5	-28.7	-179.4	-70.6	-41.4	0	0	0	111.9	D33	N29-D33 PolarHBondContact N-OD2 3.39Å
30	I	86.1	Confident	86.4	Confident	101 Å²	101	51 Å²	51	52%	0.518	31%	0.312	S	S	.	.	S	Bend	trans	-128.4	150.7	-177	-50.3	176.1	0	0	0	108.2	S32 D33	I30-S32 PolarHBondContact O-N 3.28Å; I30-D33 PolarHBondContact N-OD2 2.93Å; I30-D33 VanDerWaalsContact O-CB 3.24Å; I30-D33 WeakPolarHBondContact O-CB 3.31Å; I30-D33 PolarHBondContact O-N 3.04Å
31	I	80.9	Confident	86.3	Confident	53 Å²	53	53.1 Å²	53.1	27%	0.272	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-58	-30.3	175.6	-76.1	98.3	0	0	0	112.4	V9 L13 D33 I34	V9-I31 HydrophobicContact CG1-CD1 3.14Å; V9-I31 HydrophobicContact CG1-CG1 3.54Å; L13-I31 HydrophobicContact CB-CD1 4.43Å; L13-I31 HydrophobicContact CD2-CD1 4.46Å; I31-D33 PolarHBondContact O-N 2.71Å; I31-I34 WeakPolarHBondContact O-CB 3.5Å; I31-I34 PolarHBondContact O-N 3.49Å
32	S	82.1	Confident	86.2	Confident	93 Å²	93	49.1 Å²	49.1	65%	0.65	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-61.7	-24.2	174.7	-55.7	0	0	0	0	113.3	I30 I34	I30-S32 PolarHBondContact O-N 3.28Å; S32-I34 VanDerWaalsContact C-N 3.25Å; S32-I34 PolarHBondContact O-N 3.35Å
33	D	85	Confident	86.1	Confident	68 Å²	68	46.5 Å²	46.5	36%	0.364	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-74.8	-19.4	175.8	-52.9	-21.6	0	0	0	111.2	P28 N29 I30 I31 N35 F38	P28-D33 HydrophobicContact CB-CB 3.75Å; N29-D33 PolarHBondContact N-OD2 3.39Å; I30-D33 PolarHBondContact N-OD2 2.93Å; I30-D33 VanDerWaalsContact O-CB 3.24Å; I30-D33 WeakPolarHBondContact O-CB 3.31Å; I30-D33 PolarHBondContact O-N 3.04Å; I31-D33 PolarHBondContact O-N 2.71Å; D33-N35 PolarHBondContact O-N 3.1Å; D33-F38 WeakPolarHBondContact O-CB 3.48Å
34	I	85.3	Confident	86.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.304	C	S	.	.	S	Bend	trans	-81.4	61.5	173.6	-47.9	174.4	0	0	0	108.7	V12 L13 A16 P28 I31 S32 F38 F39	V12-I34 HydrophobicContact CG1-CD1 4.3Å; L13-I34 HydrophobicContact CD1-CD1 4.17Å; A16-I34 HydrophobicContact CB-CD1 3.62Å; A16-I34 HydrophobicContact CB-CG1 4.2Å; P28-I34 HydrophobicContact CB-CG1 4.09Å; P28-I34 HydrophobicContact CG-CG1 4.18Å; I31-I34 WeakPolarHBondContact O-CB 3.5Å; I31-I34 PolarHBondContact O-N 3.49Å; S32-I34 VanDerWaalsContact C-N 3.25Å; S32-I34 PolarHBondContact O-N 3.35Å; I34-F38 HydrophobicContact CG2-CD1 4.05Å; I34-F38 HydrophobicContact CG2-CE1 4.29Å; I34-F39 HydrophobicContact CG2-CE2 3.7Å; I34-F39 HydrophobicContact CG2-CZ 3.81Å
35	N	86.3	Confident	86.2	Confident	44 Å²	44	55 Å²	55	24%	0.235	30%	0.303	C	S	.	.	S	Bend	trans	-93.8	-177.2	177.7	73.6	5.3	0	0	0	110.9	D33 E37 F38 F39	D33-N35 PolarHBondContact O-N 3.1Å; N35-E37 VanDerWaalsContact C-N 3.26Å; N35-E37 PolarHBondContact ND2-OE2 3.22Å; N35-E37 PolarHBondContact O-N 3.47Å; N35-E37 WeakPolarHBondContact OD1-CA 3.24Å; N35-E37 VanDerWaalsContact OD1-CB 3.31Å; N35-E37 WeakPolarHBondContact OD1-CB 3.39Å; N35-E37 PolarHBondContact OD1-N 2.98Å; N35-F38 WeakPolarHBondContact O-CB 3.49Å; N35-F38 PolarHBondContact O-N 2.96Å; N35-F38 PolarHBondContact OD1-N 2.93Å; N35-F39 VanDerWaalsContact O-CD2 3.24Å; N35-F39 WeakPolarHBondContact O-CD2 3.37Å
36	I	85.4	Confident	85.8	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-62.9	-33.4	177.9	-168.4	167	0	0	0	112.8	F38 F39 E40 R60 W61 L64	I36-F38 VanDerWaalsContact C-N 3.31Å; I36-F38 PolarHBondContact O-N 3.21Å; I36-F39 PolarHBondContact O-N 3.46Å; I36-E40 HydrophobicContact CG1-CG 4.38Å; I36-E40 WeakPolarHBondContact O-CG 3.46Å; I36-E40 PolarHBondContact O-N 3.42Å; I36-R60 HydrophobicContact CD1-CB 3.22Å; I36-R60 HydrophobicContact CD1-CG 4.43Å; I36-R60 HydrophobicContact CG1-CB 4.42Å; I36-W61 HydrophobicContact CB-CH2 4.46Å; I36-W61 HydrophobicContact CB-CZ2 3.91Å; I36-W61 HydrophobicContact CD1-CB 4.39Å; I36-W61 HydrophobicContact CD1-CD2 3.76Å; I36-W61 HydrophobicContact CD1-CE3 4.34Å; I36-W61 HydrophobicContact CD1-CG 3.74Å; I36-W61 HydrophobicContact CG1-CD2 4.07Å; I36-W61 HydrophobicContact CG1-CE3 4.33Å; I36-W61 HydrophobicContact CG1-CZ2 4.22Å; I36-L64 HydrophobicContact CG1-CD1 4.38Å
37	E	86.4	Confident	85.5	Confident	102 Å²	102	50.3 Å²	50.3	48%	0.477	27%	0.272	S	S	.	.	H	α-helix	trans	-67.2	-34.6	-179.2	-58.2	168.2	165.2	0	0	111.2	N35 E40 S41	N35-E37 VanDerWaalsContact C-N 3.26Å; N35-E37 PolarHBondContact ND2-OE2 3.22Å; N35-E37 PolarHBondContact O-N 3.47Å; N35-E37 WeakPolarHBondContact OD1-CA 3.24Å; N35-E37 VanDerWaalsContact OD1-CB 3.31Å; N35-E37 WeakPolarHBondContact OD1-CB 3.39Å; N35-E37 PolarHBondContact OD1-N 2.98Å; E37-E40 PolarHBondContact O-N 2.82Å; E37-S41 VanDerWaalsContact O-CB 3.3Å; E37-S41 WeakPolarHBondContact O-CB 3.4Å; E37-S41 PolarHBondContact O-N 2.94Å; E37-S41 PolarHBondContact O-OG 2.85Å
38	F	89.3	Confident	84.9	Confident	20 Å²	20	56.1 Å²	56.1	9%	0.088	30%	0.296	C	S	.	.	H	α-helix	trans	-61.1	-44.1	172.8	178.6	-104	0	0	0	111.9	A16 A20 P28 D33 I34 N35 I36 S41 M42 L96	A16-F38 HydrophobicContact CB-CE1 4.36Å; A16-F38 HydrophobicContact CB-CZ 4.39Å; A20-F38 HydrophobicContact CB-CE2 4.18Å; A20-F38 HydrophobicContact CB-CZ 4.09Å; P28-F38 HydrophobicContact CB-CE2 4.4Å; P28-F38 HydrophobicContact CG-CE2 4.01Å; P28-F38 HydrophobicContact CG-CZ 3.85Å; D33-F38 WeakPolarHBondContact O-CB 3.48Å; I34-F38 HydrophobicContact CG2-CD1 4.05Å; I34-F38 HydrophobicContact CG2-CE1 4.29Å; N35-F38 WeakPolarHBondContact O-CB 3.49Å; N35-F38 PolarHBondContact O-N 2.96Å; N35-F38 PolarHBondContact OD1-N 2.93Å; I36-F38 VanDerWaalsContact C-N 3.31Å; I36-F38 PolarHBondContact O-N 3.21Å; F38-S41 PolarHBondContact O-N 3.14Å; F38-M42 HydrophobicContact CD1-CE 4.14Å; F38-M42 HydrophobicContact CD1-SD 4.22Å; F38-M42 HydrophobicContact CE1-CE 3.21Å; F38-M42 HydrophobicContact CE1-SD 3.75Å; F38-M42 HydrophobicContact CE2-CE 3.89Å; F38-M42 HydrophobicContact CZ-CE 3.07Å; F38-M42 HydrophobicContact CZ-SD 4.18Å; F38-M42 WeakPolarHBondContact O-CG 3.45Å; F38-M42 PolarHBondContact O-N 3.36Å; F38-L96 HydrophobicContact CE1-CD2 4.29Å
39	F	88.3	Confident	84.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-72	-36.7	177.4	-70.5	-73.5	0	0	0	113.1	I34 N35 I36 S41 M42 L43 W61 L64 L92 L95 L96 I99	I34-F39 HydrophobicContact CG2-CE2 3.7Å; I34-F39 HydrophobicContact CG2-CZ 3.81Å; N35-F39 VanDerWaalsContact O-CD2 3.24Å; N35-F39 WeakPolarHBondContact O-CD2 3.37Å; I36-F39 PolarHBondContact O-N 3.46Å; F39-S41 VanDerWaalsContact C-N 3.33Å; F39-M42 PolarHBondContact O-N 3.04Å; F39-L43 PolarHBondContact O-N 2.98Å; F39-W61 AromaticContact CD2-CH2 3.44Å; F39-W61 HydrophobicContact CD2-CH2 3.44Å; F39-W61 VanDerWaalsContact CD2-CH2 3.44Å; F39-W61 HydrophobicContact CD2-CZ2 4.48Å; F39-W61 AromaticContact CD2-CZ3 3.98Å; F39-W61 HydrophobicContact CD2-CZ3 3.98Å; F39-W61 AromaticContact CE2-CH2 3.75Å; F39-W61 HydrophobicContact CE2-CH2 3.75Å; F39-W61 HydrophobicContact CE2-CZ3 4.47Å; F39-W61 HydrophobicContact CG-CH2 4.31Å; F39-W61 HydrophobicContact CG-CZ3 4.44Å; F39-L64 HydrophobicContact CB-CD1 3.65Å; F39-L92 HydrophobicContact CE2-CD2 3.81Å; F39-L92 HydrophobicContact CZ-CD2 4.03Å; F39-L95 HydrophobicContact CD1-CD2 3.82Å; F39-L95 HydrophobicContact CD1-CG 4.35Å; F39-L95 HydrophobicContact CD2-CD2 4.28Å; F39-L95 HydrophobicContact CE1-CB 4.35Å; F39-L95 HydrophobicContact CE1-CD2 3.69Å; F39-L95 HydrophobicContact CE1-CG 4.06Å; F39-L95 HydrophobicContact CE2-CD2 4.18Å; F39-L95 HydrophobicContact CG-CD2 4.1Å; F39-L95 HydrophobicContact CZ-CD2 3.87Å; F39-L96 HydrophobicContact CE1-CD2 3.67Å; F39-L96 HydrophobicContact CE1-CG 3.92Å; F39-L96 HydrophobicContact CZ-CD2 4.17Å; F39-L96 HydrophobicContact CZ-CG 4.15Å; F39-I99 HydrophobicContact CD1-CD1 3.43Å; F39-I99 VanDerWaalsContact CD1-CD1 3.43Å; F39-I99 HydrophobicContact CE1-CD1 3.95Å
40	E	87.9	Confident	84.1	Confident	25 Å²	25	58.3 Å²	58.3	12%	0.117	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-42.8	172.7	-69.4	-180	164.9	0	0	110.6	I36 E37 M42 L43 E44 F49 N51 R60 L64	I36-E40 HydrophobicContact CG1-CG 4.38Å; I36-E40 WeakPolarHBondContact O-CG 3.46Å; I36-E40 PolarHBondContact O-N 3.42Å; E37-E40 PolarHBondContact O-N 2.82Å; E40-M42 VanDerWaalsContact C-N 3.34Å; E40-M42 PolarHBondContact O-N 3.08Å; E40-L43 PolarHBondContact O-N 3.26Å; E40-L43 VanDerWaalsContact O-N 3.17Å; E40-E44 WeakPolarHBondContact O-CB 3.38Å; E40-E44 PolarHBondContact O-N 3.37Å; E40-F49 HydrophobicContact CB-CE1 4.16Å; E40-F49 HydrophobicContact CG-CE1 3.85Å; E40-F49 HydrophobicContact CG-CZ 4.49Å; E40-N51 PolarHBondContact OE1-ND2 3.36Å; E40-R60 VanDerWaalsContact CD-NH2 3.34Å; E40-R60 IonicContact OE1-CZ 2.86Å; E40-R60 IonicContact OE1-NE 3.91Å; E40-R60 PolarHBondContact OE1-NE 3.3Å; E40-R60 IonicContact OE1-NH2 3.14Å; E40-R60 PolarHBondContact OE1-NH2 3.11Å; E40-R60 IonicContact OE2-CZ 2.63Å; E40-R60 IonicContact OE2-NE 2.68Å; E40-R60 IonicContact OE2-NH2 3.93Å; E40-R60 PolarHBondContact OE2-NH2 3.5Å; E40-L64 HydrophobicContact CG-CD1 4.09Å
41	S	87.8	Confident	83.5	Confident	46 Å²	46	55.6 Å²	55.6	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-62.4	-39.1	175.5	-58.3	0	0	0	0	112.4	E37 F38 F39 K45	E37-S41 VanDerWaalsContact O-CB 3.3Å; E37-S41 WeakPolarHBondContact O-CB 3.4Å; E37-S41 PolarHBondContact O-N 2.94Å; E37-S41 PolarHBondContact O-OG 2.85Å; F38-S41 PolarHBondContact O-N 3.14Å; F39-S41 VanDerWaalsContact C-N 3.33Å; S41-K45 PolarHBondContact O-N 2.81Å
42	M	87.6	Confident	83	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.9	-44.4	173.2	-79.7	-178	167.9	0	0	111.7	V19 A20 L25 F38 F39 E40 K45 I46 L96 I99	V19-M42 HydrophobicContact CB-CE 4.19Å; V19-M42 HydrophobicContact CG1-CE 3.9Å; V19-M42 HydrophobicContact CG1-SD 4.19Å; A20-M42 HydrophobicContact CB-CE 4.05Å; L25-M42 HydrophobicContact CD1-CB 4.23Å; L25-M42 HydrophobicContact CD1-CG 3.55Å; F38-M42 HydrophobicContact CD1-CE 4.14Å; F38-M42 HydrophobicContact CD1-SD 4.22Å; F38-M42 HydrophobicContact CE1-CE 3.21Å; F38-M42 HydrophobicContact CE1-SD 3.75Å; F38-M42 HydrophobicContact CE2-CE 3.89Å; F38-M42 HydrophobicContact CZ-CE 3.07Å; F38-M42 HydrophobicContact CZ-SD 4.18Å; F38-M42 WeakPolarHBondContact O-CG 3.45Å; F38-M42 PolarHBondContact O-N 3.36Å; F39-M42 PolarHBondContact O-N 3.04Å; E40-M42 VanDerWaalsContact C-N 3.34Å; E40-M42 PolarHBondContact O-N 3.08Å; M42-K45 PolarHBondContact O-N 2.84Å; M42-I46 WeakPolarHBondContact O-CG1 3.45Å; M42-I46 PolarHBondContact O-N 3.08Å; M42-L96 HydrophobicContact CE-CD2 4.41Å; M42-L96 HydrophobicContact SD-CD2 4.27Å; M42-I99 HydrophobicContact CB-CG2 4.29Å; M42-I99 HydrophobicContact SD-CG2 4.09Å
43	L	85.7	Confident	82.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-72.3	-32.9	-178.4	-77.6	166.1	0	0	0	113	F39 E40 K45 I46 S47 F49 L64 L68 L71	F39-L43 PolarHBondContact O-N 2.98Å; E40-L43 PolarHBondContact O-N 3.26Å; E40-L43 VanDerWaalsContact O-N 3.17Å; L43-K45 PolarHBondContact O-N 3.18Å; L43-I46 PolarHBondContact O-N 3.02Å; L43-S47 CarbonylContact O-C 3.57Å; L43-S47 WeakPolarHBondContact O-CA 3.36Å; L43-S47 PolarHBondContact O-N 2.82Å; L43-S47 PolarHBondContact O-OG 3.19Å; L43-F49 HydrophobicContact CB-CB 4.05Å; L43-F49 HydrophobicContact CB-CD1 4.23Å; L43-F49 HydrophobicContact CB-CG 4.13Å; L43-L64 HydrophobicContact CD1-CD1 4.19Å; L43-L64 HydrophobicContact CD1-CD2 3.77Å; L43-L64 HydrophobicContact CD1-CG 3.63Å; L43-L68 HydrophobicContact CD1-CD2 4.21Å; L43-L68 HydrophobicContact CD1-CG 4.09Å; L43-L68 HydrophobicContact CD2-CD2 3.56Å; L43-L68 HydrophobicContact CD2-CG 4.3Å; L43-L68 HydrophobicContact CG-CD2 4.44Å; L43-L71 HydrophobicContact CD2-CD1 4.34Å
44	E	87	Confident	81.9	Confident	120 Å²	120	61.4 Å²	61.4	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-62.8	-28.5	173.8	-172.8	176.3	-166.2	0	0	112.2	E40 S47	E40-E44 WeakPolarHBondContact O-CB 3.38Å; E40-E44 PolarHBondContact O-N 3.37Å; E44-S47 CarbonylContact C-O 3.26Å; E44-S47 VanDerWaalsContact C-O 3.26Å; E44-S47 VanDerWaalsContact CA-O 3.32Å; E44-S47 WeakPolarHBondContact CA-O 3.28Å
45	K	84.2	Confident	81.4	Confident	142 Å²	142	63.9 Å²	63.9	62%	0.617	34%	0.342	S	S	*	.	H	α-helix	trans	-81.2	-35.1	174.3	-73.7	-68.6	-174.2	-178.7	0	113.6	V23 L25 S41 M42 L43	V23-K45 HydrophobicContact CG1-CB 3.38Å; V23-K45 HydrophobicContact CG1-CG 4.01Å; L25-K45 HydrophobicContact CD2-CG 4.32Å; S41-K45 PolarHBondContact O-N 2.81Å; M42-K45 PolarHBondContact O-N 2.84Å; L43-K45 PolarHBondContact O-N 3.18Å
46	I	81.1	Confident	81.3	Confident	23 Å²	23	66.4 Å²	66.4	12%	0.118	36%	0.356	C	S	.	.	H	α-helix	trans	-84.4	-28.9	-177.5	-64.7	167.2	0	0	0	111.1	V23 M42 L43 I99 L102 A103 T106	V23-I46 HydrophobicContact CG1-CG1 4.24Å; V23-I46 HydrophobicContact CG2-CD1 4Å; V23-I46 HydrophobicContact CG2-CG1 4.26Å; M42-I46 WeakPolarHBondContact O-CG1 3.45Å; M42-I46 PolarHBondContact O-N 3.08Å; L43-I46 PolarHBondContact O-N 3.02Å; I46-I99 HydrophobicContact CD1-CG2 3.62Å; I46-L102 HydrophobicContact CG2-CB 4.15Å; I46-A103 HydrophobicContact CD1-CB 3.87Å; I46-A103 HydrophobicContact CG1-CB 4.3Å; I46-T106 HydrophobicContact CG2-CG2 3.84Å
47	S	80.2	Confident	81.1	Confident	26 Å²	26	71.5 Å²	71.5	18%	0.182	38%	0.379	C	S	.	.	S	Bend	trans	-147.7	158.6	-172.4	63.5	0	0	0	0	110.4	L43 E44 F49	L43-S47 CarbonylContact O-C 3.57Å; L43-S47 WeakPolarHBondContact O-CA 3.36Å; L43-S47 PolarHBondContact O-N 2.82Å; L43-S47 PolarHBondContact O-OG 3.19Å; E44-S47 CarbonylContact C-O 3.26Å; E44-S47 VanDerWaalsContact C-O 3.26Å; E44-S47 VanDerWaalsContact CA-O 3.32Å; E44-S47 WeakPolarHBondContact CA-O 3.28Å; S47-F49 PolarHBondContact O-N 3.34Å
48	D	75.9	Confident	81	Confident	169 Å²	169	71.9 Å²	71.9	90%	0.904	38%	0.379	S	S	*	.			trans	-71.7	41.9	174.2	-62.6	-42.1	0	0	0	112.9	K50	D48-K50 PolarHBondContact O-N 3.11Å
49	F	77.6	Confident	80.8	Confident	16 Å²	16	76.4 Å²	76.4	7%	0.07	40%	0.401	C	S	.	.			trans	-72.6	114.6	179.6	-179.8	-90.8	0	0	0	109.3	E40 L43 S47 N51 F63 S67	E40-F49 HydrophobicContact CB-CE1 4.16Å; E40-F49 HydrophobicContact CG-CE1 3.85Å; E40-F49 HydrophobicContact CG-CZ 4.49Å; L43-F49 HydrophobicContact CB-CB 4.05Å; L43-F49 HydrophobicContact CB-CD1 4.23Å; L43-F49 HydrophobicContact CB-CG 4.13Å; S47-F49 PolarHBondContact O-N 3.34Å; F49-N51 HydrophobicContact CE1-CB 3.7Å; F49-N51 HydrophobicContact CZ-CB 3.87Å; F49-F63 HydrophobicContact CD2-CE1 4.27Å; F49-F63 AromaticContact CE2-CD1 3.52Å; F49-F63 HydrophobicContact CE2-CD1 3.52Å; F49-F63 AromaticContact CE2-CE1 3.44Å; F49-F63 HydrophobicContact CE2-CE1 3.44Å; F49-F63 VanDerWaalsContact CE2-CE1 3.44Å; F49-F63 AromaticContact CZ-CD1 3.58Å; F49-F63 HydrophobicContact CZ-CD1 3.58Å; F49-F63 AromaticContact CZ-CE1 3.77Å; F49-F63 HydrophobicContact CZ-CE1 3.77Å; F49-S67 WeakPolarHBondContact CE2-OG 3.38Å
50	K	75.8	Confident	80.7	Confident	171 Å²	171	77.2 Å²	77.2	74%	0.743	40%	0.404	S	S	*	.			trans	-120.4	131	170	-68	-174.8	179.1	-178.3	0	108.5	D48	D48-K50 PolarHBondContact O-N 3.11Å
51	N	74.4	Confident	80.7	Confident	44 Å²	44	76.3 Å²	76.3	24%	0.235	40%	0.399	C	S	.	.			trans	-127.5	143.6	176.6	-167.1	19.3	0	0	0	109.8	E40 F49 A53 F63	E40-N51 PolarHBondContact OE1-ND2 3.36Å; F49-N51 HydrophobicContact CE1-CB 3.7Å; F49-N51 HydrophobicContact CZ-CB 3.87Å; N51-A53 PolarHBondContact O-N 3.22Å; N51-F63 HydrophobicContact CB-CD1 4.33Å; N51-F63 HydrophobicContact CB-CE1 4.32Å
52	D	70.8	Confident	80.6	Confident	125 Å²	125	77.6 Å²	77.6	67%	0.668	40%	0.403	S	S	*	.			trans	-78.9	115.6	174.3	-76.1	-25.4	0	0	0	109.2	T54 S55	D52-T54 PolarHBondContact O-N 3.45Å; D52-S55 PolarHBondContact O-N 2.88Å
53	A	69.6	Low	80.5	Confident	80 Å²	80	81.3 Å²	81.3	66%	0.661	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-5.9	-175.9	0	0	0	0	0	114.8	N51 S55	N51-A53 PolarHBondContact O-N 3.22Å; A53-S55 VanDerWaalsContact C-N 3.33Å; A53-S55 PolarHBondContact O-N 3.46Å
54	T	73.7	Confident	80.5	Confident	132 Å²	132	81.3 Å²	81.3	81%	0.81	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-6.9	-175.4	54.4	0	0	0	0	114.2	D52	D52-T54 PolarHBondContact O-N 3.45Å
55	S	75.3	Confident	80.5	Confident	51 Å²	51	76.4 Å²	76.4	36%	0.357	40%	0.396	S	S	.	.	S	Bend	trans	-84.1	146.8	-175.7	-63	0	0	0	0	113.4	D52 A53 R60	D52-S55 PolarHBondContact O-N 2.88Å; A53-S55 VanDerWaalsContact C-N 3.33Å; A53-S55 PolarHBondContact O-N 3.46Å; S55-R60 VanDerWaalsContact O-CD 3.27Å; S55-R60 WeakPolarHBondContact O-CD 3.28Å
56	D	83.3	Confident	80.6	Confident	98 Å²	98	76.2 Å²	76.2	52%	0.524	40%	0.398	S	S	.	.			trans	-53.5	143.1	172.5	174.6	36.8	0	0	0	111.8	K58 H59 R60	D56-K58 PolarHBondContact O-N 3.02Å; D56-H59 WeakPolarHBondContact O-CA 3.49Å; D56-H59 WeakPolarHBondContact O-CB 3.41Å; D56-H59 PolarHBondContact O-N 2.97Å; D56-H59 IonicContact OD2-ND1 3.81Å; D56-R60 PolarHBondContact O-N 3.45Å
57	H	81.4	Confident	80.8	Confident	111 Å²	111	76.4 Å²	76.4	51%	0.514	40%	0.401	S	S	.	.	H	α-helix	trans	-53.8	-35.4	-173.6	-78.8	-74.2	0	0	0	113	R60 W61	H57-R60 PolarHBondContact O-N 2.87Å; H57-W61 VanDerWaalsContact O-CD1 3.23Å; H57-W61 PolarHBondContact O-N 3.35Å; H57-W61 VanDerWaalsContact O-N 3.08Å
58	K	83.9	Confident	81	Confident	110 Å²	110	75.1 Å²	75.1	48%	0.478	39%	0.392	S	S	.	.	H	α-helix	trans	-66.6	-37.9	177.3	-172.5	-178.1	175.7	-168.7	0	112.3	D56 N62	D56-K58 PolarHBondContact O-N 3.02Å; K58-N62 PolarHBondContact O-N 2.95Å; K58-N62 VanDerWaalsContact O-N 3.16Å; K58-N62 PolarHBondContact O-ND2 3.36Å
59	H	84.4	Confident	81.6	Confident	116 Å²	116	68.6 Å²	68.6	54%	0.537	36%	0.36	S	S	.	.	H	α-helix	trans	-69.6	-43.6	177.3	-73.4	82.9	0	0	0	110.9	D56 W61 N62 F63	D56-H59 WeakPolarHBondContact O-CA 3.49Å; D56-H59 WeakPolarHBondContact O-CB 3.41Å; D56-H59 PolarHBondContact O-N 2.97Å; D56-H59 IonicContact OD2-ND1 3.81Å; H59-W61 PolarHBondContact O-N 3.19Å; H59-N62 PolarHBondContact O-N 3.43Å; H59-F63 WeakPolarHBondContact O-CB 3.31Å; H59-F63 PolarHBondContact O-N 3.48Å
60	R	87.3	Confident	82	Confident	16 Å²	16	78.6 Å²	78.6	6%	0.06	40%	0.397	C	S	.	.	H	α-helix	trans	-58.7	-44.3	175.7	-66.2	175.4	61.9	-175.4	4	112	I36 E40 S55 D56 H57 N62 F63 L64	I36-R60 HydrophobicContact CD1-CB 3.22Å; I36-R60 HydrophobicContact CD1-CG 4.43Å; I36-R60 HydrophobicContact CG1-CB 4.42Å; E40-R60 VanDerWaalsContact CD-NH2 3.34Å; E40-R60 IonicContact OE1-CZ 2.86Å; E40-R60 IonicContact OE1-NE 3.91Å; E40-R60 PolarHBondContact OE1-NE 3.3Å; E40-R60 IonicContact OE1-NH2 3.14Å; E40-R60 PolarHBondContact OE1-NH2 3.11Å; E40-R60 IonicContact OE2-CZ 2.63Å; E40-R60 IonicContact OE2-NE 2.68Å; E40-R60 IonicContact OE2-NH2 3.93Å; E40-R60 PolarHBondContact OE2-NH2 3.5Å; S55-R60 VanDerWaalsContact O-CD 3.27Å; S55-R60 WeakPolarHBondContact O-CD 3.28Å; D56-R60 PolarHBondContact O-N 3.45Å; H57-R60 PolarHBondContact O-N 2.87Å; R60-N62 PolarHBondContact O-N 3.27Å; R60-F63 PolarHBondContact O-N 2.86Å; R60-L64 WeakPolarHBondContact O-CB 3.49Å; R60-L64 PolarHBondContact O-N 2.92Å
61	W	87.3	Confident	82.3	Confident	6 Å²	6	74.2 Å²	74.2	2%	0.023	38%	0.381	C	S	.	.	H	α-helix	trans	-63.8	-41	176.2	-83.6	121.3	0	0	0	113.4	I36 F39 H57 H59 F63 L64 L65 T81 L84 L95	I36-W61 HydrophobicContact CB-CH2 4.46Å; I36-W61 HydrophobicContact CB-CZ2 3.91Å; I36-W61 HydrophobicContact CD1-CB 4.39Å; I36-W61 HydrophobicContact CD1-CD2 3.76Å; I36-W61 HydrophobicContact CD1-CE3 4.34Å; I36-W61 HydrophobicContact CD1-CG 3.74Å; I36-W61 HydrophobicContact CG1-CD2 4.07Å; I36-W61 HydrophobicContact CG1-CE3 4.33Å; I36-W61 HydrophobicContact CG1-CZ2 4.22Å; F39-W61 AromaticContact CD2-CH2 3.44Å; F39-W61 HydrophobicContact CD2-CH2 3.44Å; F39-W61 VanDerWaalsContact CD2-CH2 3.44Å; F39-W61 HydrophobicContact CD2-CZ2 4.48Å; F39-W61 AromaticContact CD2-CZ3 3.98Å; F39-W61 HydrophobicContact CD2-CZ3 3.98Å; F39-W61 AromaticContact CE2-CH2 3.75Å; F39-W61 HydrophobicContact CE2-CH2 3.75Å; F39-W61 HydrophobicContact CE2-CZ3 4.47Å; F39-W61 HydrophobicContact CG-CH2 4.31Å; F39-W61 HydrophobicContact CG-CZ3 4.44Å; H57-W61 VanDerWaalsContact O-CD1 3.23Å; H57-W61 PolarHBondContact O-N 3.35Å; H57-W61 VanDerWaalsContact O-N 3.08Å; H59-W61 PolarHBondContact O-N 3.19Å; W61-F63 VanDerWaalsContact C-N 3.35Å; W61-L64 HydrophobicContact CE3-CD1 4.3Å; W61-L64 HydrophobicContact CZ3-CD1 4.19Å; W61-L64 PolarHBondContact O-N 2.87Å; W61-L65 WeakPolarHBondContact O-CG 3.41Å; W61-L65 PolarHBondContact O-N 3.44Å; W61-T81 HydrophobicContact CB-CG2 4.11Å; W61-L84 HydrophobicContact CD2-CB 4.06Å; W61-L84 HydrophobicContact CD2-CD1 4.08Å; W61-L84 HydrophobicContact CE3-CB 4.41Å; W61-L84 HydrophobicContact CE3-CD1 3.73Å; W61-L84 HydrophobicContact CE3-CD2 4.44Å; W61-L84 HydrophobicContact CE3-CG 4.44Å; W61-L84 HydrophobicContact CG-CB 4.36Å; W61-L84 HydrophobicContact CH2-CD2 4.21Å; W61-L84 HydrophobicContact CZ2-CB 4.45Å; W61-L84 HydrophobicContact CZ3-CD1 4.18Å; W61-L84 HydrophobicContact CZ3-CD2 4.12Å; W61-L95 HydrophobicContact CH2-CD2 4.3Å; W61-L95 HydrophobicContact CZ3-CD2 3.71Å
62	N	85.6	Confident	82.8	Confident	73 Å²	73	75 Å²	75	39%	0.39	39%	0.385	S	S	.	.	H	α-helix	trans	-61.9	-44.6	175.3	-83.3	-32.4	0	0	0	111.2	K58 H59 R60 L65 Q66 T81	K58-N62 PolarHBondContact O-N 2.95Å; K58-N62 VanDerWaalsContact O-N 3.16Å; K58-N62 PolarHBondContact O-ND2 3.36Å; H59-N62 PolarHBondContact O-N 3.43Å; R60-N62 PolarHBondContact O-N 3.27Å; N62-L65 PolarHBondContact O-N 2.79Å; N62-Q66 WeakPolarHBondContact O-CB 3.37Å; N62-Q66 PolarHBondContact O-N 2.68Å; N62-T81 WeakPolarHBondContact OD1-CG2 3.44Å
63	F	86	Confident	83.4	Confident	79 Å²	79	72.3 Å²	72.3	35%	0.346	39%	0.387	S	S	.	.	H	α-helix	trans	-63.3	-42.9	178.8	-170.7	-105.6	0	0	0	111.6	F49 N51 H59 R60 W61 Q66 S67	F49-F63 HydrophobicContact CD2-CE1 4.27Å; F49-F63 AromaticContact CE2-CD1 3.52Å; F49-F63 HydrophobicContact CE2-CD1 3.52Å; F49-F63 AromaticContact CE2-CE1 3.44Å; F49-F63 HydrophobicContact CE2-CE1 3.44Å; F49-F63 VanDerWaalsContact CE2-CE1 3.44Å; F49-F63 AromaticContact CZ-CD1 3.58Å; F49-F63 HydrophobicContact CZ-CD1 3.58Å; F49-F63 AromaticContact CZ-CE1 3.77Å; F49-F63 HydrophobicContact CZ-CE1 3.77Å; N51-F63 HydrophobicContact CB-CD1 4.33Å; N51-F63 HydrophobicContact CB-CE1 4.32Å; H59-F63 WeakPolarHBondContact O-CB 3.31Å; H59-F63 PolarHBondContact O-N 3.48Å; R60-F63 PolarHBondContact O-N 2.86Å; W61-F63 VanDerWaalsContact C-N 3.35Å; F63-Q66 PolarHBondContact O-N 3.4Å; F63-S67 PolarHBondContact O-N 3.39Å; F63-S67 PolarHBondContact O-OG 3.43Å
64	L	86.5	Confident	84	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-59.2	-48.9	175.5	-166	156.6	0	0	0	111.8	I36 F39 E40 L43 R60 W61 Q66 S67 L68 L95	I36-L64 HydrophobicContact CG1-CD1 4.38Å; F39-L64 HydrophobicContact CB-CD1 3.65Å; E40-L64 HydrophobicContact CG-CD1 4.09Å; L43-L64 HydrophobicContact CD1-CD1 4.19Å; L43-L64 HydrophobicContact CD1-CD2 3.77Å; L43-L64 HydrophobicContact CD1-CG 3.63Å; R60-L64 WeakPolarHBondContact O-CB 3.49Å; R60-L64 PolarHBondContact O-N 2.92Å; W61-L64 HydrophobicContact CE3-CD1 4.3Å; W61-L64 HydrophobicContact CZ3-CD1 4.19Å; W61-L64 PolarHBondContact O-N 2.87Å; L64-Q66 VanDerWaalsContact C-N 3.32Å; L64-Q66 PolarHBondContact O-N 3.35Å; L64-S67 PolarHBondContact O-N 3.29Å; L64-L68 HydrophobicContact CD2-CD1 3.53Å; L64-L68 HydrophobicContact CD2-CG 4.14Å; L64-L68 PolarHBondContact O-N 2.83Å; L64-L95 HydrophobicContact CD2-CD2 4.46Å
65	L	86.5	Confident	84.5	Confident	16 Å²	16	70.3 Å²	70.3	8%	0.084	37%	0.373	C	S	.	.	H	α-helix	trans	-64.4	-36.1	177.6	-72.4	175.7	0	0	0	112.6	W61 N62 S69 L76 I79 T81 L84 L95	W61-L65 WeakPolarHBondContact O-CG 3.41Å; W61-L65 PolarHBondContact O-N 3.44Å; N62-L65 PolarHBondContact O-N 2.79Å; L65-S69 VanDerWaalsContact O-CB 3.23Å; L65-S69 WeakPolarHBondContact O-CB 3.4Å; L65-S69 PolarHBondContact O-N 3.12Å; L65-L76 HydrophobicContact CD2-CD1 4.27Å; L65-I79 HydrophobicContact CD1-CB 4.46Å; L65-I79 HydrophobicContact CD1-CG2 4.17Å; L65-I79 HydrophobicContact CD2-CB 4.25Å; L65-I79 HydrophobicContact CD2-CD1 4.26Å; L65-I79 HydrophobicContact CD2-CG2 4.06Å; L65-T81 HydrophobicContact CD1-CG2 3.86Å; L65-L84 HydrophobicContact CD1-CD1 3.82Å; L65-L84 HydrophobicContact CD2-CD1 4.32Å; L65-L84 HydrophobicContact CG-CD1 4.23Å; L65-L95 HydrophobicContact CD2-CD1 3.97Å
66	Q	86	Confident	84.8	Confident	138 Å²	138	68.6 Å²	68.6	65%	0.645	36%	0.36	S	S	*	.	H	α-helix	trans	-67.1	-41.9	176.8	-171.9	175.5	6	0	0	111.4	N62 F63 L64 S69 R70	N62-Q66 WeakPolarHBondContact O-CB 3.37Å; N62-Q66 PolarHBondContact O-N 2.68Å; F63-Q66 PolarHBondContact O-N 3.4Å; L64-Q66 VanDerWaalsContact C-N 3.32Å; L64-Q66 PolarHBondContact O-N 3.35Å; Q66-S69 PolarHBondContact O-N 3.15Å; Q66-R70 PolarHBondContact O-N 2.85Å
67	S	84.8	Confident	84.4	Confident	27 Å²	27	67.2 Å²	67.2	19%	0.189	37%	0.369	C	S	.	.	H	α-helix	trans	-64.9	-44.6	175.3	-68.7	0	0	0	0	111.9	F49 F63 L64 S69 R70 L71	F49-S67 WeakPolarHBondContact CE2-OG 3.38Å; F63-S67 PolarHBondContact O-N 3.39Å; F63-S67 PolarHBondContact O-OG 3.43Å; L64-S67 PolarHBondContact O-N 3.29Å; S67-S69 VanDerWaalsContact C-N 3.34Å; S67-S69 PolarHBondContact O-N 3.45Å; S67-R70 PolarHBondContact O-N 3.34Å; S67-L71 PolarHBondContact O-N 2.95Å
68	L	85.7	Confident	84.4	Confident	0 Å²	0	69 Å²	69	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-60.5	-42.6	172.6	-79	176.7	0	0	0	112.3	L43 L64 R70 L71 I72 L76 L95 I99 L102	L43-L68 HydrophobicContact CD1-CD2 4.21Å; L43-L68 HydrophobicContact CD1-CG 4.09Å; L43-L68 HydrophobicContact CD2-CD2 3.56Å; L43-L68 HydrophobicContact CD2-CG 4.3Å; L43-L68 HydrophobicContact CG-CD2 4.44Å; L64-L68 HydrophobicContact CD2-CD1 3.53Å; L64-L68 HydrophobicContact CD2-CG 4.14Å; L64-L68 PolarHBondContact O-N 2.83Å; L68-R70 VanDerWaalsContact C-N 3.28Å; L68-R70 PolarHBondContact O-N 3.25Å; L68-L71 PolarHBondContact O-N 2.85Å; L68-I72 HydrophobicContact CB-CD1 4.4Å; L68-I72 VanDerWaalsContact O-CD1 3.27Å; L68-I72 WeakPolarHBondContact O-CD1 3.43Å; L68-I72 VanDerWaalsContact O-CG1 3.23Å; L68-I72 WeakPolarHBondContact O-CG1 3.47Å; L68-I72 PolarHBondContact O-N 3.19Å; L68-L76 HydrophobicContact CB-CD1 3.56Å; L68-L76 HydrophobicContact CD1-CD1 4.36Å; L68-L95 HydrophobicContact CD1-CD1 3.49Å; L68-L95 VanDerWaalsContact CD1-CD1 3.49Å; L68-L95 HydrophobicContact CD1-CG 4.41Å; L68-I99 HydrophobicContact CD1-CG1 4.49Å; L68-I99 HydrophobicContact CD2-CG1 4.16Å; L68-L102 HydrophobicContact CD2-CD1 3.55Å
69	S	87.2	Confident	84.3	Confident	31 Å²	31	64.2 Å²	64.2	22%	0.217	35%	0.352	C	S	.	.	H	α-helix	trans	-61.6	-38.5	177.3	-175.2	0	0	0	0	111.8	L65 Q66 S67 G73 S74 S75	L65-S69 VanDerWaalsContact O-CB 3.23Å; L65-S69 WeakPolarHBondContact O-CB 3.4Å; L65-S69 PolarHBondContact O-N 3.12Å; Q66-S69 PolarHBondContact O-N 3.15Å; S67-S69 VanDerWaalsContact C-N 3.34Å; S67-S69 PolarHBondContact O-N 3.45Å; S69-G73 WeakPolarHBondContact O-CA 3.35Å; S69-G73 PolarHBondContact O-N 2.78Å; S69-S74 WeakPolarHBondContact CA-O 3.33Å; S69-S74 WeakPolarHBondContact CB-O 3.38Å; S69-S74 PolarHBondContact O-N 3.14Å; S69-S74 PolarHBondContact OG-O 2.98Å; S69-S75 WeakPolarHBondContact OG-CA 3.45Å
70	R	86.4	Confident	84.2	Confident	227 Å²	227	61.1 Å²	61.1	86%	0.857	34%	0.343	S	S	*	.	H	α-helix	trans	-67.5	-39.3	174.2	-176.4	176.9	169.5	175.4	-3.8	112.5	Q66 S67 L68	Q66-R70 PolarHBondContact O-N 2.85Å; S67-R70 PolarHBondContact O-N 3.34Å; L68-R70 VanDerWaalsContact C-N 3.28Å; L68-R70 PolarHBondContact O-N 3.25Å
71	L	83	Confident	83.9	Confident	78 Å²	78	61.4 Å²	61.4	41%	0.408	35%	0.346	S	S	.	.	H	α-helix	trans	-65.9	-40.7	176.5	-87.8	148.5	0	0	0	112.7	L43 S67 L68 L102	L43-L71 HydrophobicContact CD2-CD1 4.34Å; S67-L71 PolarHBondContact O-N 2.95Å; L68-L71 PolarHBondContact O-N 2.85Å; L71-L102 HydrophobicContact CB-CD1 4.43Å
72	I	83.7	Confident	83.6	Confident	61 Å²	61	70.5 Å²	70.5	31%	0.313	38%	0.381	S	S	.	.	H	α-helix	trans	-85.9	-19.5	-176.9	-57.7	155.9	0	0	0	111.4	L68 S74 L76 I98 L102	L68-I72 HydrophobicContact CB-CD1 4.4Å; L68-I72 VanDerWaalsContact O-CD1 3.27Å; L68-I72 WeakPolarHBondContact O-CD1 3.43Å; L68-I72 VanDerWaalsContact O-CG1 3.23Å; L68-I72 WeakPolarHBondContact O-CG1 3.47Å; L68-I72 PolarHBondContact O-N 3.19Å; I72-S74 PolarHBondContact O-N 2.84Å; I72-L76 HydrophobicContact CD1-CD1 4.15Å; I72-L76 HydrophobicContact CD1-CD2 4.39Å; I72-I98 HydrophobicContact CD1-CG2 3.22Å; I72-I98 HydrophobicContact CG1-CG2 4.25Å; I72-L102 HydrophobicContact CD1-CD1 4.49Å; I72-L102 HydrophobicContact CG1-CD1 4.18Å; I72-L102 HydrophobicContact CG1-CD2 4.08Å; I72-L102 HydrophobicContact CG1-CG 4.42Å
73	G	83.1	Confident	83.3	Confident	69 Å²	69	70.9 Å²	70.9	71%	0.711	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	14.2	-172.4	0	0	0	0	0	113.6	S69	S69-G73 WeakPolarHBondContact O-CA 3.35Å; S69-G73 PolarHBondContact O-N 2.78Å
74	S	83.8	Confident	83	Confident	69 Å²	69	67.1 Å²	67.1	48%	0.483	36%	0.364	S	S	.	.	S	Bend	trans	-127.4	143.1	-178.8	-64.5	0	0	0	0	110.9	S69 I72 L76	S69-S74 WeakPolarHBondContact CA-O 3.33Å; S69-S74 WeakPolarHBondContact CB-O 3.38Å; S69-S74 PolarHBondContact O-N 3.14Å; S69-S74 PolarHBondContact OG-O 2.98Å; I72-S74 PolarHBondContact O-N 2.84Å; S74-L76 PolarHBondContact O-N 3.37Å
75	S	82.6	Confident	82.6	Confident	100 Å²	100	70 Å²	70	70%	0.699	38%	0.383	S	S	*	.			trans	-72.6	123.5	179.2	63	0	0	0	0	111.2	S69 G77	S69-S75 WeakPolarHBondContact OG-CA 3.45Å; S75-G77 PolarHBondContact O-N 3.28Å
76	L	81.7	Confident	82.3	Confident	16 Å²	16	77.2 Å²	77.2	8%	0.084	41%	0.414	C	S	.	.			trans	-87.9	33.4	176.4	-67.4	175.7	0	0	0	112.5	L65 L68 I72 S74 Y78 I79 I98	L65-L76 HydrophobicContact CD2-CD1 4.27Å; L68-L76 HydrophobicContact CB-CD1 3.56Å; L68-L76 HydrophobicContact CD1-CD1 4.36Å; I72-L76 HydrophobicContact CD1-CD1 4.15Å; I72-L76 HydrophobicContact CD1-CD2 4.39Å; S74-L76 PolarHBondContact O-N 3.37Å; L76-Y78 HydrophobicContact CD2-CE1 3.79Å; L76-Y78 WeakPolarHBondContact CD2-OH 3.22Å; L76-Y78 PolarHBondContact O-N 2.98Å; L76-I79 HydrophobicContact CD2-CD1 4.5Å; L76-I79 PolarHBondContact O-N 3.24Å; L76-I79 VanDerWaalsContact O-N 3.1Å; L76-I98 HydrophobicContact CD2-CD1 3.8Å
77	G	76.3	Confident	82	Confident	69 Å²	69	74.9 Å²	74.9	71%	0.711	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-14.9	-173.6	0	0	0	0	0	115	S75 I79	S75-G77 PolarHBondContact O-N 3.28Å; G77-I79 VanDerWaalsContact C-N 3.33Å
78	Y	81	Confident	81.9	Confident	149 Å²	149	76 Å²	76	58%	0.584	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-15.9	176.8	62.3	-88.7	0	0	0	113.4	L76 S80 I98	L76-Y78 HydrophobicContact CD2-CE1 3.79Å; L76-Y78 WeakPolarHBondContact CD2-OH 3.22Å; L76-Y78 PolarHBondContact O-N 2.98Å; Y78-S80 PolarHBondContact O-N 3.38Å; Y78-I98 WeakPolarHBondContact OH-CD1 3.3Å
79	I	82.2	Confident	81.7	Confident	9 Å²	9	77.7 Å²	77.7	5%	0.046	42%	0.417	C	S	.	.	S	Bend	trans	-93.4	100	177	-58.3	175.7	0	0	0	108.3	L65 L76 G77 L84 I91 L95 I98	L65-I79 HydrophobicContact CD1-CB 4.46Å; L65-I79 HydrophobicContact CD1-CG2 4.17Å; L65-I79 HydrophobicContact CD2-CB 4.25Å; L65-I79 HydrophobicContact CD2-CD1 4.26Å; L65-I79 HydrophobicContact CD2-CG2 4.06Å; L76-I79 HydrophobicContact CD2-CD1 4.5Å; L76-I79 PolarHBondContact O-N 3.24Å; L76-I79 VanDerWaalsContact O-N 3.1Å; G77-I79 VanDerWaalsContact C-N 3.33Å; I79-L84 HydrophobicContact CG2-CD1 3.62Å; I79-L84 HydrophobicContact CG2-CD2 4.31Å; I79-L84 HydrophobicContact CG2-CG 3.9Å; I79-I91 HydrophobicContact CG2-CG2 3.65Å; I79-L95 HydrophobicContact CD1-CD1 4.23Å; I79-I98 HydrophobicContact CD1-CD1 4.09Å
80	S	82.4	Confident	81.5	Confident	51 Å²	51	79.2 Å²	79.2	36%	0.357	42%	0.422	S	S	.	.			trans	-77	129.9	176.6	-27	0	0	0	0	110.7	Y78 R82 H83 L84	Y78-S80 PolarHBondContact O-N 3.38Å; S80-R82 PolarHBondContact O-N 3.47Å; S80-R82 VanDerWaalsContact O-N 3.11Å; S80-H83 VanDerWaalsContact CB-ND1 3.33Å; S80-H83 WeakPolarHBondContact CB-ND1 3.42Å; S80-H83 PolarHBondContact O-N 2.91Å; S80-H83 PolarHBondContact OG-ND1 2.93Å; S80-L84 PolarHBondContact O-N 3.45Å
81	T	80.6	Confident	81.4	Confident	21 Å²	21	69.8 Å²	69.8	13%	0.129	39%	0.389	C	S	.	.	H	α-helix	trans	-56.6	-28.8	174.4	47.2	0	0	0	0	113.7	W61 N62 L65 H83 L84 C85	W61-T81 HydrophobicContact CB-CG2 4.11Å; N62-T81 WeakPolarHBondContact OD1-CG2 3.44Å; L65-T81 HydrophobicContact CD1-CG2 3.86Å; T81-H83 PolarHBondContact O-N 3.43Å; T81-L84 PolarHBondContact O-N 3.38Å; T81-C85 PolarHBondContact O-N 3.21Å; T81-C85 PolarHBondContact O-SG 2.74Å; T81-C85 VanDerWaalsContact O-SG 3.32Å
82	R	80.9	Confident	81.6	Confident	198 Å²	198	66.1 Å²	66.1	75%	0.747	37%	0.37	S	S	*	.	H	α-helix	trans	-58.5	-34.3	172.5	-67.7	-175.2	-176.2	170.1	1.3	113.4	S80 K86	S80-R82 PolarHBondContact O-N 3.47Å; S80-R82 VanDerWaalsContact O-N 3.11Å; R82-K86 WeakPolarHBondContact O-CG 3.39Å
83	H	79.1	Confident	81.8	Confident	80 Å²	80	64.5 Å²	64.5	37%	0.37	36%	0.36	S	S	.	.	H	α-helix	trans	-84.8	-30.2	-179.6	-63.1	105.7	0	0	0	112.2	S80 T81 K86 F87 D88 I91	S80-H83 VanDerWaalsContact CB-ND1 3.33Å; S80-H83 WeakPolarHBondContact CB-ND1 3.42Å; S80-H83 PolarHBondContact O-N 2.91Å; S80-H83 PolarHBondContact OG-ND1 2.93Å; T81-H83 PolarHBondContact O-N 3.43Å; H83-K86 CarbonylContact O-C 3.44Å; H83-K86 PolarHBondContact O-N 2.85Å; H83-F87 PolarHBondContact O-N 2.86Å; H83-D88 PolarHBondContact O-N 2.89Å; H83-I91 HydrophobicContact CB-CD1 3.2Å
84	L	80	Confident	81.9	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.4	-42.5	170.2	-72.9	169	0	0	0	111.4	W61 L65 I79 S80 T81 K86 F87 I91 L92 L95	W61-L84 HydrophobicContact CD2-CB 4.06Å; W61-L84 HydrophobicContact CD2-CD1 4.08Å; W61-L84 HydrophobicContact CE3-CB 4.41Å; W61-L84 HydrophobicContact CE3-CD1 3.73Å; W61-L84 HydrophobicContact CE3-CD2 4.44Å; W61-L84 HydrophobicContact CE3-CG 4.44Å; W61-L84 HydrophobicContact CG-CB 4.36Å; W61-L84 HydrophobicContact CH2-CD2 4.21Å; W61-L84 HydrophobicContact CZ2-CB 4.45Å; W61-L84 HydrophobicContact CZ3-CD1 4.18Å; W61-L84 HydrophobicContact CZ3-CD2 4.12Å; L65-L84 HydrophobicContact CD1-CD1 3.82Å; L65-L84 HydrophobicContact CD2-CD1 4.32Å; L65-L84 HydrophobicContact CG-CD1 4.23Å; I79-L84 HydrophobicContact CG2-CD1 3.62Å; I79-L84 HydrophobicContact CG2-CD2 4.31Å; I79-L84 HydrophobicContact CG2-CG 3.9Å; S80-L84 PolarHBondContact O-N 3.45Å; T81-L84 PolarHBondContact O-N 3.38Å; L84-K86 PolarHBondContact O-N 2.91Å; L84-F87 PolarHBondContact O-N 2.89Å; L84-I91 HydrophobicContact CD2-CG2 3.69Å; L84-I91 HydrophobicContact CG-CG2 4.04Å; L84-L92 HydrophobicContact CD2-CD2 4.29Å; L84-L95 HydrophobicContact CD2-CD2 4.29Å
85	C	78.2	Confident	82.1	Confident	62 Å²	62	59.8 Å²	59.8	42%	0.419	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.7	173	-67.6	0	0	0	0	113.4	T81	T81-C85 PolarHBondContact O-N 3.21Å; T81-C85 PolarHBondContact O-SG 2.74Å; T81-C85 VanDerWaalsContact O-SG 3.32Å
86	K	80.4	Confident	82.4	Confident	166 Å²	166	55 Å²	55	72%	0.722	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	1.7	176.7	-73	-176.8	178.7	-172.6	0	113.4	R82 H83 L84 D88	R82-K86 WeakPolarHBondContact O-CG 3.39Å; H83-K86 CarbonylContact O-C 3.44Å; H83-K86 PolarHBondContact O-N 2.85Å; L84-K86 PolarHBondContact O-N 2.91Å; K86-D88 VanDerWaalsContact C-N 3.29Å; K86-D88 PolarHBondContact O-N 3.49Å
87	F	79.2	Confident	82.8	Confident	90 Å²	90	57 Å²	57	40%	0.395	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	43.8	-178.2	-66.1	-92.2	0	0	0	113.2	H83 L84 P89 L92	H83-F87 PolarHBondContact O-N 2.86Å; L84-F87 PolarHBondContact O-N 2.89Å; F87-P89 VanDerWaalsContact O-CD 3.31Å; F87-P89 WeakPolarHBondContact O-CD 3.06Å; F87-L92 HydrophobicContact CB-CD1 4.3Å; F87-L92 HydrophobicContact CD1-CD1 4.25Å
88	D	82	Confident	83.3	Confident	49 Å²	49	54.7 Å²	54.7	26%	0.262	26%	0.262	S	S	.	.			trans	-64.4	119	176.5	-170.9	-29.4	0	0	0	110.2	H83 K86 N90 I91 L92	H83-D88 PolarHBondContact O-N 2.89Å; K86-D88 VanDerWaalsContact C-N 3.29Å; K86-D88 PolarHBondContact O-N 3.49Å; D88-N90 PolarHBondContact O-N 3.32Å; D88-N90 VanDerWaalsContact O-N 3.14Å; D88-N90 PolarHBondContact OD1-N 3.48Å; D88-N90 VanDerWaalsContact OD1-N 3.1Å; D88-N90 PolarHBondContact OD1-ND2 2.86Å; D88-I91 HydrophobicContact CB-CB 4.35Å; D88-I91 HydrophobicContact CB-CD1 4.2Å; D88-I91 HydrophobicContact CB-CG1 4.49Å; D88-I91 PolarHBondContact O-N 2.98Å; D88-I91 VanDerWaalsContact O-N 3.09Å; D88-L92 PolarHBondContact O-N 2.91Å
89	P	81.5	Confident	83.6	Confident	36 Å²	36	47.6 Å²	47.6	23%	0.234	24%	0.235	C	C	.	.	H	α-helix	trans	-55.7	-34.4	-176.2	-25.7	33.8	0	0	0	113.6	V9 V12 F87 I91 Y93	V9-P89 HydrophobicContact CG2-CG 3.88Å; V12-P89 HydrophobicContact CG2-CB 3.9Å; V12-P89 WeakPolarHBondContact CG2-O 3.43Å; F87-P89 VanDerWaalsContact O-CD 3.31Å; F87-P89 WeakPolarHBondContact O-CD 3.06Å; P89-I91 VanDerWaalsContact C-N 3.32Å; P89-I91 PolarHBondContact O-N 3.35Å; P89-Y93 VanDerWaalsContact O-CB 3.3Å; P89-Y93 WeakPolarHBondContact O-CB 3.35Å; P89-Y93 PolarHBondContact O-N 3.42Å
90	N	82.9	Confident	83.9	Confident	63 Å²	63	48 Å²	48	34%	0.337	24%	0.237	S	C	.	.	H	α-helix	trans	-70.9	-33.3	-177	-61.4	-62.6	0	0	0	112	D88 S94	D88-N90 PolarHBondContact O-N 3.32Å; D88-N90 VanDerWaalsContact O-N 3.14Å; D88-N90 PolarHBondContact OD1-N 3.48Å; D88-N90 VanDerWaalsContact OD1-N 3.1Å; D88-N90 PolarHBondContact OD1-ND2 2.86Å; N90-S94 PolarHBondContact O-N 2.83Å; N90-S94 VanDerWaalsContact O-N 3.12Å; N90-S94 PolarHBondContact O-OG 3.45Å
91	I	85.4	Confident	84.1	Confident	29 Å²	29	50.4 Å²	50.4	15%	0.149	25%	0.245	C	C	.	.	H	α-helix	trans	-82	-40.8	-177.6	-70	169.3	0	0	0	110.1	I79 H83 L84 D88 P89 Y93 S94 L95	I79-I91 HydrophobicContact CG2-CG2 3.65Å; H83-I91 HydrophobicContact CB-CD1 3.2Å; L84-I91 HydrophobicContact CD2-CG2 3.69Å; L84-I91 HydrophobicContact CG-CG2 4.04Å; D88-I91 HydrophobicContact CB-CB 4.35Å; D88-I91 HydrophobicContact CB-CD1 4.2Å; D88-I91 HydrophobicContact CB-CG1 4.49Å; D88-I91 PolarHBondContact O-N 2.98Å; D88-I91 VanDerWaalsContact O-N 3.09Å; P89-I91 VanDerWaalsContact C-N 3.32Å; P89-I91 PolarHBondContact O-N 3.35Å; I91-Y93 VanDerWaalsContact C-N 3.29Å; I91-Y93 PolarHBondContact O-N 3.27Å; I91-S94 PolarHBondContact O-N 2.83Å; I91-S94 VanDerWaalsContact O-N 3.17Å; I91-L95 PolarHBondContact O-N 3.46Å
92	L	86.1	Confident	84.3	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-57.3	-44.3	170.1	-68.9	174.4	0	0	0	111.3	V12 F39 L84 F87 D88 S94 L95 L96	V12-L92 HydrophobicContact CG1-CB 4.22Å; F39-L92 HydrophobicContact CE2-CD2 3.81Å; F39-L92 HydrophobicContact CZ-CD2 4.03Å; L84-L92 HydrophobicContact CD2-CD2 4.29Å; F87-L92 HydrophobicContact CB-CD1 4.3Å; F87-L92 HydrophobicContact CD1-CD1 4.25Å; D88-L92 PolarHBondContact O-N 2.91Å; L92-S94 VanDerWaalsContact C-N 3.34Å; L92-S94 PolarHBondContact O-N 3.4Å; L92-L95 PolarHBondContact O-N 2.79Å; L92-L96 WeakPolarHBondContact O-CG 3.46Å; L92-L96 PolarHBondContact O-N 3.16Å
93	Y	88	Confident	84.4	Confident	27 Å²	27	41.1 Å²	41.1	11%	0.106	21%	0.21	C	C	.	.	H	α-helix	trans	-59.8	-44.6	175.5	-172.3	-81	0	0	0	112	R7 V12 F15 P89 I91 L95 L96 E97	R7-Y93 VanDerWaalsContact NH1-CE2 3.29Å; R7-Y93 PolarHBondContact NH1-OH 3.25Å; V12-Y93 HydrophobicContact CG2-CD2 4.39Å; F15-Y93 HydrophobicContact CB-CD2 4.43Å; F15-Y93 HydrophobicContact CB-CE2 3.94Å; F15-Y93 HydrophobicContact CD1-CD2 4.06Å; F15-Y93 AromaticContact CD1-CE2 3.7Å; F15-Y93 HydrophobicContact CD1-CE2 3.7Å; F15-Y93 HydrophobicContact CD2-CE2 4.46Å; F15-Y93 HydrophobicContact CE1-CE2 4.32Å; F15-Y93 HydrophobicContact CG-CD2 4.44Å; F15-Y93 AromaticContact CG-CE2 3.78Å; F15-Y93 HydrophobicContact CG-CE2 3.78Å; P89-Y93 VanDerWaalsContact O-CB 3.3Å; P89-Y93 WeakPolarHBondContact O-CB 3.35Å; P89-Y93 PolarHBondContact O-N 3.42Å; I91-Y93 VanDerWaalsContact C-N 3.29Å; I91-Y93 PolarHBondContact O-N 3.27Å; Y93-L95 VanDerWaalsContact C-N 3.3Å; Y93-L95 PolarHBondContact O-N 2.91Å; Y93-L96 PolarHBondContact O-N 3.42Å; Y93-E97 HydrophobicContact CE1-CB 4.4Å; Y93-E97 WeakPolarHBondContact O-CB 3.27Å; Y93-E97 PolarHBondContact O-N 3.02Å
94	S	86.5	Confident	84.6	Confident	38 Å²	38	41.6 Å²	41.6	27%	0.266	21%	0.212	S	C	.	.	H	α-helix	trans	-63.1	-38.8	179.2	-56.8	0	0	0	0	111.4	N90 I91 L92 E97 I98	N90-S94 PolarHBondContact O-N 2.83Å; N90-S94 VanDerWaalsContact O-N 3.12Å; N90-S94 PolarHBondContact O-OG 3.45Å; I91-S94 PolarHBondContact O-N 2.83Å; I91-S94 VanDerWaalsContact O-N 3.17Å; L92-S94 VanDerWaalsContact C-N 3.34Å; L92-S94 PolarHBondContact O-N 3.4Å; S94-E97 PolarHBondContact O-N 3.01Å; S94-I98 WeakPolarHBondContact O-CD1 3.3Å; S94-I98 VanDerWaalsContact O-CG1 3.28Å; S94-I98 WeakPolarHBondContact O-CG1 3.5Å; S94-I98 PolarHBondContact O-N 2.89Å; S94-I98 VanDerWaalsContact O-N 3.17Å
95	L	87.4	Confident	84.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-42.9	175.5	-165.1	69.5	0	0	0	111.9	F39 W61 L64 L65 L68 I79 L84 I91 L92 Y93 E97 I98 I99	F39-L95 HydrophobicContact CD1-CD2 3.82Å; F39-L95 HydrophobicContact CD1-CG 4.35Å; F39-L95 HydrophobicContact CD2-CD2 4.28Å; F39-L95 HydrophobicContact CE1-CB 4.35Å; F39-L95 HydrophobicContact CE1-CD2 3.69Å; F39-L95 HydrophobicContact CE1-CG 4.06Å; F39-L95 HydrophobicContact CE2-CD2 4.18Å; F39-L95 HydrophobicContact CG-CD2 4.1Å; F39-L95 HydrophobicContact CZ-CD2 3.87Å; W61-L95 HydrophobicContact CH2-CD2 4.3Å; W61-L95 HydrophobicContact CZ3-CD2 3.71Å; L64-L95 HydrophobicContact CD2-CD2 4.46Å; L65-L95 HydrophobicContact CD2-CD1 3.97Å; L68-L95 HydrophobicContact CD1-CD1 3.49Å; L68-L95 VanDerWaalsContact CD1-CD1 3.49Å; L68-L95 HydrophobicContact CD1-CG 4.41Å; I79-L95 HydrophobicContact CD1-CD1 4.23Å; L84-L95 HydrophobicContact CD2-CD2 4.29Å; I91-L95 PolarHBondContact O-N 3.46Å; L92-L95 PolarHBondContact O-N 2.79Å; Y93-L95 VanDerWaalsContact C-N 3.3Å; Y93-L95 PolarHBondContact O-N 2.91Å; L95-E97 VanDerWaalsContact C-N 3.32Å; L95-E97 PolarHBondContact O-N 2.93Å; L95-I98 PolarHBondContact O-N 3.46Å; L95-I99 HydrophobicContact CG-CD1 4.25Å; L95-I99 WeakPolarHBondContact O-CG1 3.46Å; L95-I99 PolarHBondContact O-N 3.34Å
96	L	89.3	Confident	84.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.4	-38	173.9	-72	166.2	0	0	0	112.1	V12 F15 A16 F38 F39 M42 L92 Y93 I98 I99 N100	V12-L96 HydrophobicContact CG1-CD1 4.03Å; F15-L96 HydrophobicContact CD1-CB 3.7Å; F15-L96 HydrophobicContact CD1-CD1 4.26Å; F15-L96 HydrophobicContact CE1-CB 3.67Å; A16-L96 HydrophobicContact CB-CD1 3.79Å; A16-L96 HydrophobicContact CB-CD2 4.27Å; F38-L96 HydrophobicContact CE1-CD2 4.29Å; F39-L96 HydrophobicContact CE1-CD2 3.67Å; F39-L96 HydrophobicContact CE1-CG 3.92Å; F39-L96 HydrophobicContact CZ-CD2 4.17Å; F39-L96 HydrophobicContact CZ-CG 4.15Å; M42-L96 HydrophobicContact CE-CD2 4.41Å; M42-L96 HydrophobicContact SD-CD2 4.27Å; L92-L96 WeakPolarHBondContact O-CG 3.46Å; L92-L96 PolarHBondContact O-N 3.16Å; Y93-L96 PolarHBondContact O-N 3.42Å; L96-I98 VanDerWaalsContact C-N 3.3Å; L96-I98 PolarHBondContact O-N 3.47Å; L96-I99 PolarHBondContact O-N 3.14Å; L96-N100 VanDerWaalsContact O-CB 3.25Å; L96-N100 WeakPolarHBondContact O-CB 3.45Å; L96-N100 PolarHBondContact O-N 3.46Å
97	E	89.2	Confident	84	Confident	59 Å²	59	41 Å²	41	28%	0.276	21%	0.213	S	C	.	.	H	α-helix	trans	-63.4	-40.6	178.9	-168.7	170.6	-168.3	0	0	110.4	R4 F15 Y93 S94 L95 L101	R4-E97 IonicContact CZ-OE1 3.2Å; R4-E97 IonicContact CZ-OE2 2.61Å; R4-E97 IonicContact NH1-OE1 3.72Å; R4-E97 IonicContact NH1-OE2 3.66Å; R4-E97 PolarHBondContact NH1-OE2 3.35Å; R4-E97 IonicContact NH2-OE1 3.02Å; R4-E97 PolarHBondContact NH2-OE1 3.45Å; R4-E97 IonicContact NH2-OE2 3.67Å; F15-E97 HydrophobicContact CE1-CB 4.37Å; Y93-E97 HydrophobicContact CE1-CB 4.4Å; Y93-E97 WeakPolarHBondContact O-CB 3.27Å; Y93-E97 PolarHBondContact O-N 3.02Å; S94-E97 PolarHBondContact O-N 3.01Å; L95-E97 VanDerWaalsContact C-N 3.32Å; L95-E97 PolarHBondContact O-N 2.93Å; E97-L101 WeakPolarHBondContact O-CG 3.32Å; E97-L101 PolarHBondContact O-N 3.2Å; E97-L101 VanDerWaalsContact O-N 3.15Å
98	I	87.5	Confident	83.3	Confident	20 Å²	20	40.6 Å²	40.6	10%	0.103	22%	0.215	C	C	.	.	H	α-helix	trans	-65.6	-48.2	175.2	-66.6	162.1	0	0	0	111.5	I72 L76 Y78 I79 S94 L95 L96 N100 L101 L102	I72-I98 HydrophobicContact CD1-CG2 3.22Å; I72-I98 HydrophobicContact CG1-CG2 4.25Å; L76-I98 HydrophobicContact CD2-CD1 3.8Å; Y78-I98 WeakPolarHBondContact OH-CD1 3.3Å; I79-I98 HydrophobicContact CD1-CD1 4.09Å; S94-I98 WeakPolarHBondContact O-CD1 3.3Å; S94-I98 VanDerWaalsContact O-CG1 3.28Å; S94-I98 WeakPolarHBondContact O-CG1 3.5Å; S94-I98 PolarHBondContact O-N 2.89Å; S94-I98 VanDerWaalsContact O-N 3.17Å; L95-I98 PolarHBondContact O-N 3.46Å; L96-I98 VanDerWaalsContact C-N 3.3Å; L96-I98 PolarHBondContact O-N 3.47Å; I98-N100 VanDerWaalsContact C-N 3.31Å; I98-N100 PolarHBondContact O-N 3.13Å; I98-L101 WeakPolarHBondContact O-CB 3.4Å; I98-L101 PolarHBondContact O-N 2.95Å; I98-L102 HydrophobicContact CG2-CD1 4.47Å; I98-L102 PolarHBondContact O-N 2.84Å; I98-L102 VanDerWaalsContact O-N 3.07Å
99	I	86.9	Confident	82.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-38.7	-179.5	-70.6	170.2	0	0	0	110.8	V19 F39 M42 I46 L68 L95 L96 L101 L102 A103	V19-I99 HydrophobicContact CG1-CG2 4.26Å; F39-I99 HydrophobicContact CD1-CD1 3.43Å; F39-I99 VanDerWaalsContact CD1-CD1 3.43Å; F39-I99 HydrophobicContact CE1-CD1 3.95Å; M42-I99 HydrophobicContact CB-CG2 4.29Å; M42-I99 HydrophobicContact SD-CG2 4.09Å; I46-I99 HydrophobicContact CD1-CG2 3.62Å; L68-I99 HydrophobicContact CD1-CG1 4.49Å; L68-I99 HydrophobicContact CD2-CG1 4.16Å; L95-I99 HydrophobicContact CG-CD1 4.25Å; L95-I99 WeakPolarHBondContact O-CG1 3.46Å; L95-I99 PolarHBondContact O-N 3.34Å; L96-I99 PolarHBondContact O-N 3.14Å; I99-L101 VanDerWaalsContact C-N 3.33Å; I99-L101 PolarHBondContact O-N 3.19Å; I99-L102 WeakPolarHBondContact O-CB 3.37Å; I99-L102 PolarHBondContact O-N 3.49Å; I99-L102 VanDerWaalsContact O-N 3.16Å; I99-A103 WeakPolarHBondContact O-CB 3.47Å; I99-A103 PolarHBondContact O-N 3.03Å
100	N	88.5	Confident	81.6	Confident	18 Å²	18	49.3 Å²	49.3	10%	0.096	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-40.8	175.1	-175.1	50.1	0	0	0	112.1	F15 V19 L96 I98 L102 A103 Q104	F15-N100 HydrophobicContact CZ-CB 4.22Å; V19-N100 HydrophobicContact CG1-CB 4.31Å; V19-N100 HydrophobicContact CG2-CB 3.73Å; L96-N100 VanDerWaalsContact O-CB 3.25Å; L96-N100 WeakPolarHBondContact O-CB 3.45Å; L96-N100 PolarHBondContact O-N 3.46Å; I98-N100 VanDerWaalsContact C-N 3.31Å; I98-N100 PolarHBondContact O-N 3.13Å; N100-L102 VanDerWaalsContact C-N 3.31Å; N100-L102 PolarHBondContact O-N 3.19Å; N100-A103 PolarHBondContact O-N 2.61Å; N100-Q104 PolarHBondContact ND2-NE2 2.88Å; N100-Q104 WeakPolarHBondContact O-CB 3.33Å; N100-Q104 VanDerWaalsContact O-CG 3.28Å; N100-Q104 WeakPolarHBondContact O-CG 3.37Å; N100-Q104 PolarHBondContact O-N 3.41Å
101	L	86.6	Confident	80.6	Confident	101 Å²	101	51 Å²	51	53%	0.529	26%	0.259	S	S	.	.	H	α-helix	trans	-62.7	-39.5	174.3	-72.4	168.9	0	0	0	111.7	E97 I98 I99 N105	E97-L101 WeakPolarHBondContact O-CG 3.32Å; E97-L101 PolarHBondContact O-N 3.2Å; E97-L101 VanDerWaalsContact O-N 3.15Å; I98-L101 WeakPolarHBondContact O-CB 3.4Å; I98-L101 PolarHBondContact O-N 2.95Å; I99-L101 VanDerWaalsContact C-N 3.33Å; I99-L101 PolarHBondContact O-N 3.19Å; L101-N105 PolarHBondContact O-N 3.41Å; L101-N105 VanDerWaalsContact O-N 3.17Å; L101-N105 PolarHBondContact O-ND2 3.4Å
102	L	84.5	Confident	79.2	Confident	23 Å²	23	56.4 Å²	56.4	12%	0.12	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-46.2	175.1	-68.7	173.4	0	0	0	111.7	I46 L68 L71 I72 I98 I99 N100 Q104 N105 T106	I46-L102 HydrophobicContact CG2-CB 4.15Å; L68-L102 HydrophobicContact CD2-CD1 3.55Å; L71-L102 HydrophobicContact CB-CD1 4.43Å; I72-L102 HydrophobicContact CD1-CD1 4.49Å; I72-L102 HydrophobicContact CG1-CD1 4.18Å; I72-L102 HydrophobicContact CG1-CD2 4.08Å; I72-L102 HydrophobicContact CG1-CG 4.42Å; I98-L102 HydrophobicContact CG2-CD1 4.47Å; I98-L102 PolarHBondContact O-N 2.84Å; I98-L102 VanDerWaalsContact O-N 3.07Å; I99-L102 WeakPolarHBondContact O-CB 3.37Å; I99-L102 PolarHBondContact O-N 3.49Å; I99-L102 VanDerWaalsContact O-N 3.16Å; N100-L102 VanDerWaalsContact C-N 3.31Å; N100-L102 PolarHBondContact O-N 3.19Å; L102-Q104 VanDerWaalsContact C-N 3.33Å; L102-Q104 PolarHBondContact O-N 2.87Å; L102-N105 PolarHBondContact O-N 3.35Å; L102-N105 VanDerWaalsContact O-N 3.17Å; L102-T106 PolarHBondContact O-N 3.32Å; L102-T106 PolarHBondContact O-OG1 2.92Å
103	A	83.4	Confident	78	Confident	1 Å²	1	65 Å²	65	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-39.7	178.1	0	0	0	0	0	112.4	V23 I46 I99 N100 N105 T106 I107	V23-A103 HydrophobicContact CG2-CB 3.81Å; I46-A103 HydrophobicContact CD1-CB 3.87Å; I46-A103 HydrophobicContact CG1-CB 4.3Å; I99-A103 WeakPolarHBondContact O-CB 3.47Å; I99-A103 PolarHBondContact O-N 3.03Å; N100-A103 PolarHBondContact O-N 2.61Å; A103-N105 VanDerWaalsContact C-N 3.35Å; A103-T106 WeakPolarHBondContact CA-OG1 3.38Å; A103-T106 PolarHBondContact O-N 3.2Å; A103-T106 PolarHBondContact O-OG1 2.87Å; A103-I107 WeakPolarHBondContact O-CD1 3.32Å; A103-I107 VanDerWaalsContact O-CG1 3.23Å; A103-I107 WeakPolarHBondContact O-CG1 3.33Å; A103-I107 PolarHBondContact O-N 3.11Å
104	Q	83.3	Confident	76.7	Confident	90 Å²	90	67.3 Å²	67.3	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-40.2	175.7	-73.3	178.3	4.2	0	0	111.6	N100 L102 I108	N100-Q104 PolarHBondContact ND2-NE2 2.88Å; N100-Q104 WeakPolarHBondContact O-CB 3.33Å; N100-Q104 VanDerWaalsContact O-CG 3.28Å; N100-Q104 WeakPolarHBondContact O-CG 3.37Å; N100-Q104 PolarHBondContact O-N 3.41Å; L102-Q104 VanDerWaalsContact C-N 3.33Å; L102-Q104 PolarHBondContact O-N 2.87Å; Q104-I108 WeakPolarHBondContact O-CD1 3.4Å; Q104-I108 WeakPolarHBondContact O-CG1 3.41Å; Q104-I108 PolarHBondContact O-N 3.15Å
105	N	78.7	Confident	75.2	Confident	98 Å²	98	68.1 Å²	68.1	52%	0.524	34%	0.341	S	S	.	.	H	α-helix	trans	-67.1	-37.9	177.1	-77.8	-23.7	0	0	0	112.8	L101 L102 A103 I108 Q109	L101-N105 PolarHBondContact O-N 3.41Å; L101-N105 VanDerWaalsContact O-N 3.17Å; L101-N105 PolarHBondContact O-ND2 3.4Å; L102-N105 PolarHBondContact O-N 3.35Å; L102-N105 VanDerWaalsContact O-N 3.17Å; A103-N105 VanDerWaalsContact C-N 3.35Å; N105-I108 PolarHBondContact O-N 3.11Å; N105-Q109 PolarHBondContact O-N 3.43Å
106	T	74.7	Confident	73.8	Confident	46 Å²	46	74.1 Å²	74.1	28%	0.282	37%	0.369	S	S	.	.	H	α-helix	trans	-69.1	-42.6	177	53.9	0	0	0	0	111.9	I46 L102 A103 I108 Q109 E110	I46-T106 HydrophobicContact CG2-CG2 3.84Å; L102-T106 PolarHBondContact O-N 3.32Å; L102-T106 PolarHBondContact O-OG1 2.92Å; A103-T106 WeakPolarHBondContact CA-OG1 3.38Å; A103-T106 PolarHBondContact O-N 3.2Å; A103-T106 PolarHBondContact O-OG1 2.87Å; T106-I108 VanDerWaalsContact C-N 3.28Å; T106-I108 PolarHBondContact O-N 3.3Å; T106-Q109 PolarHBondContact O-N 2.84Å; T106-Q109 VanDerWaalsContact O-N 3.12Å; T106-E110 PolarHBondContact O-N 2.91Å
107	I	72.8	Confident	72.3	Confident	70 Å²	70	80.9 Å²	80.9	36%	0.359	40%	0.395	S	S	.	.	H	α-helix	trans	-59.3	-41.4	174.5	-67.5	165	0	0	0	110.7	A103 E110 N111	A103-I107 WeakPolarHBondContact O-CD1 3.32Å; A103-I107 VanDerWaalsContact O-CG1 3.23Å; A103-I107 WeakPolarHBondContact O-CG1 3.33Å; A103-I107 PolarHBondContact O-N 3.11Å; I107-E110 PolarHBondContact O-N 2.92Å; I107-N111 WeakPolarHBondContact O-CB 3.34Å; I107-N111 PolarHBondContact O-N 2.86Å; I107-N111 PolarHBondContact O-ND2 2.96Å
108	I	64.3	Low	70.9	Confident	83 Å²	83	82.9 Å²	82.9	43%	0.426	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-45.9	175.9	-69.4	164.6	0	0	0	110.4	Q104 N105 T106 N111 F112	Q104-I108 WeakPolarHBondContact O-CD1 3.4Å; Q104-I108 WeakPolarHBondContact O-CG1 3.41Å; Q104-I108 PolarHBondContact O-N 3.15Å; N105-I108 PolarHBondContact O-N 3.11Å; T106-I108 VanDerWaalsContact C-N 3.28Å; T106-I108 PolarHBondContact O-N 3.3Å; I108-N111 PolarHBondContact O-N 2.95Å; I108-F112 HydrophobicContact CG2-CD2 3.66Å; I108-F112 HydrophobicContact CG2-CE2 3.57Å; I108-F112 WeakPolarHBondContact O-CD2 3.44Å; I108-F112 PolarHBondContact O-N 3.41Å
109	Q	63.8	Low	69.2	Low	127 Å²	127	87.9 Å²	87.9	59%	0.593	43%	0.429	S	S	*	.	H	α-helix	trans	-64.1	-39.7	177.7	-77.4	-169.6	-2	0	0	113.5	N105 T106 N111 F112 R113	N105-Q109 PolarHBondContact O-N 3.43Å; T106-Q109 PolarHBondContact O-N 2.84Å; T106-Q109 VanDerWaalsContact O-N 3.12Å; Q109-N111 VanDerWaalsContact C-N 3.35Å; Q109-F112 PolarHBondContact O-N 2.97Å; Q109-R113 PolarHBondContact O-N 3.43Å
110	E	64.5	Low	67.7	Low	141 Å²	141	93.1 Å²	93.1	66%	0.659	46%	0.457	S	S	*	.	H	α-helix	trans	-65.6	-39.3	175.4	-71.7	-144.9	152.9	0	0	111.8	T106 I107 F112 R113 T114	T106-E110 PolarHBondContact O-N 2.91Å; I107-E110 PolarHBondContact O-N 2.92Å; E110-F112 VanDerWaalsContact C-N 3.31Å; E110-F112 PolarHBondContact O-N 3.34Å; E110-R113 PolarHBondContact O-N 2.85Å; E110-T114 WeakPolarHBondContact O-CB 3.5Å; E110-T114 PolarHBondContact O-N 2.82Å; E110-T114 PolarHBondContact O-OG1 3.31Å
111	N	62.1	Low	66	Low	97 Å²	97	98.9 Å²	98.9	52%	0.519	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-38	173.9	-72.3	-25.1	0	0	0	111.8	I107 I108 Q109 T114 A115	I107-N111 WeakPolarHBondContact O-CB 3.34Å; I107-N111 PolarHBondContact O-N 2.86Å; I107-N111 PolarHBondContact O-ND2 2.96Å; I108-N111 PolarHBondContact O-N 2.95Å; Q109-N111 VanDerWaalsContact C-N 3.35Å; N111-T114 WeakPolarHBondContact CA-OG1 3.31Å; N111-T114 PolarHBondContact O-OG1 3.45Å; N111-A115 WeakPolarHBondContact O-CB 3.39Å; N111-A115 PolarHBondContact O-N 3.38Å
112	F	55.5	Low	64.2	Low	143 Å²	143	104.4 Å²	104.4	63%	0.627	50%	0.495	S	S	*	.	H	α-helix	trans	-67.6	-43.5	173.4	-86.7	-72.6	0	0	0	112.2	I108 Q109 E110 A115 E116	I108-F112 HydrophobicContact CG2-CD2 3.66Å; I108-F112 HydrophobicContact CG2-CE2 3.57Å; I108-F112 WeakPolarHBondContact O-CD2 3.44Å; I108-F112 PolarHBondContact O-N 3.41Å; Q109-F112 PolarHBondContact O-N 2.97Å; E110-F112 VanDerWaalsContact C-N 3.31Å; E110-F112 PolarHBondContact O-N 3.34Å; F112-A115 PolarHBondContact O-N 2.94Å; F112-E116 PolarHBondContact O-N 2.99Å
113	R	60	Low	62.4	Low	184 Å²	184	108.4 Å²	108.4	69%	0.694	52%	0.516	S	S	*	.	H	α-helix	trans	-66.6	-37.7	177	-77.3	-174.8	175.7	-175.4	0.9	112.8	Q109 E110 E116 Y117	Q109-R113 PolarHBondContact O-N 3.43Å; E110-R113 PolarHBondContact O-N 2.85Å; R113-E116 PolarHBondContact O-N 3.32Å; R113-Y117 VanDerWaalsContact O-CB 3.27Å; R113-Y117 WeakPolarHBondContact O-CB 3.35Å; R113-Y117 PolarHBondContact O-N 3.44Å
114	T	61	Low	60.4	Low	74 Å²	74	114.2 Å²	114.2	45%	0.454	55%	0.547	S	S	.	.	H	α-helix	trans	-70.3	-36.6	173.6	38.2	0	0	0	0	111.5	E110 N111 Y117 I118	E110-T114 WeakPolarHBondContact O-CB 3.5Å; E110-T114 PolarHBondContact O-N 2.82Å; E110-T114 PolarHBondContact O-OG1 3.31Å; N111-T114 WeakPolarHBondContact CA-OG1 3.31Å; N111-T114 PolarHBondContact O-OG1 3.45Å; T114-Y117 PolarHBondContact O-N 3Å; T114-I118 WeakPolarHBondContact O-CB 3.33Å; T114-I118 WeakPolarHBondContact O-CD1 3.41Å; T114-I118 WeakPolarHBondContact O-CG1 3.27Å; T114-I118 PolarHBondContact O-N 3.31Å
115	A	56.4	Low	58.6	Low	56 Å²	56	114.9 Å²	114.9	46%	0.463	56%	0.559	S	S	.	*	H	α-helix	trans	-64.1	-43.4	171.6	0	0	0	0	0	112	N111 F112 I118 H119	N111-A115 WeakPolarHBondContact O-CB 3.39Å; N111-A115 PolarHBondContact O-N 3.38Å; F112-A115 PolarHBondContact O-N 2.94Å; A115-I118 PolarHBondContact O-N 3.27Å; A115-H119 VanDerWaalsContact O-CB 3.24Å; A115-H119 WeakPolarHBondContact O-CB 3.39Å; A115-H119 PolarHBondContact O-N 2.88Å
116	E	57.6	Low	57.3	Low	126 Å²	126	116.9 Å²	116.9	59%	0.589	57%	0.57	S	S	*	*	H	α-helix	trans	-63.6	-42.3	172.8	-81.9	-172.5	152.2	0	0	111.8	F112 R113 H119 N120	F112-E116 PolarHBondContact O-N 2.99Å; R113-E116 PolarHBondContact O-N 3.32Å; E116-H119 PolarHBondContact O-N 3.27Å; E116-N120 VanDerWaalsContact O-CB 3.25Å; E116-N120 WeakPolarHBondContact O-CB 3.35Å; E116-N120 PolarHBondContact O-N 3.48Å; E116-N120 PolarHBondContact O-ND2 3.39Å; E116-N120 VanDerWaalsContact O-ND2 3.14Å
117	Y	58.2	Low	56.1	Low	141 Å²	141	123.2 Å²	123.2	55%	0.553	60%	0.596	S	S	*	*	H	α-helix	trans	-65.8	-41.5	177.6	-173.2	-102.7	0	0	0	111.7	R113 T114 H119 N120 K121	R113-Y117 VanDerWaalsContact O-CB 3.27Å; R113-Y117 WeakPolarHBondContact O-CB 3.35Å; R113-Y117 PolarHBondContact O-N 3.44Å; T114-Y117 PolarHBondContact O-N 3Å; Y117-H119 VanDerWaalsContact C-N 3.33Å; Y117-N120 PolarHBondContact O-N 2.94Å; Y117-K121 HydrophobicContact CD1-CD 4.4Å; Y117-K121 HydrophobicContact CE1-CD 3.61Å; Y117-K121 VanDerWaalsContact O-CB 3.31Å; Y117-K121 WeakPolarHBondContact O-CB 3.37Å; Y117-K121 PolarHBondContact O-N 2.87Å; Y117-K121 VanDerWaalsContact OH-CE 3.25Å; Y117-K121 WeakPolarHBondContact OH-CE 3.42Å; Y117-K121 PolarHBondContact OH-NZ 3.49Å
118	I	58.3	Low	54.7	Low	101 Å²	101	127.9 Å²	127.9	52%	0.518	62%	0.621	S	S	.	*	H	α-helix	trans	-66	-37.9	174.9	-69.1	165.2	0	0	0	110.8	T114 A115 R122	T114-I118 WeakPolarHBondContact O-CB 3.33Å; T114-I118 WeakPolarHBondContact O-CD1 3.41Å; T114-I118 WeakPolarHBondContact O-CG1 3.27Å; T114-I118 PolarHBondContact O-N 3.31Å; A115-I118 PolarHBondContact O-N 3.27Å; I118-R122 WeakPolarHBondContact O-CB 3.48Å; I118-R122 PolarHBondContact O-N 2.9Å; I118-R122 VanDerWaalsContact O-N 3.1Å
119	H	52.9	Low	53.6	Low	126 Å²	126	130.7 Å²	130.7	58%	0.583	65%	0.646	S	S	*	*	H	α-helix	trans	-69.2	-35.9	176.9	-157.5	-36.3	0	0	0	112.1	A115 E116 Y117	A115-H119 VanDerWaalsContact O-CB 3.24Å; A115-H119 WeakPolarHBondContact O-CB 3.39Å; A115-H119 PolarHBondContact O-N 2.88Å; E116-H119 PolarHBondContact O-N 3.27Å; Y117-H119 VanDerWaalsContact C-N 3.33Å
120	N	54	Low	52.4	Low	109 Å²	109	127.5 Å²	127.5	58%	0.583	65%	0.647	S	S	*	*	H	α-helix	trans	-79.7	-29.4	177.5	-68.7	-26.2	0	0	0	112.4	E116 Y117 L123	E116-N120 VanDerWaalsContact O-CB 3.25Å; E116-N120 WeakPolarHBondContact O-CB 3.35Å; E116-N120 PolarHBondContact O-N 3.48Å; E116-N120 PolarHBondContact O-ND2 3.39Å; E116-N120 VanDerWaalsContact O-ND2 3.14Å; Y117-N120 PolarHBondContact O-N 2.94Å; N120-L123 CarbonylContact O-C 3.52Å; N120-L123 PolarHBondContact O-N 3.14Å
121	K	53.5	Low	51.3	Low	139 Å²	139	128.7 Å²	128.7	60%	0.604	66%	0.658	S	S	*	*	H	α-helix	trans	-78	-22.3	174.1	-129.4	177.4	-176	169.2	0	113.5	Y117 L123	Y117-K121 HydrophobicContact CD1-CD 4.4Å; Y117-K121 HydrophobicContact CE1-CD 3.61Å; Y117-K121 VanDerWaalsContact O-CB 3.31Å; Y117-K121 WeakPolarHBondContact O-CB 3.37Å; Y117-K121 PolarHBondContact O-N 2.87Å; Y117-K121 VanDerWaalsContact OH-CE 3.25Å; Y117-K121 WeakPolarHBondContact OH-CE 3.42Å; Y117-K121 PolarHBondContact OH-NZ 3.49Å; K121-L123 VanDerWaalsContact C-N 3.32Å
122	R	48.1	Very low	50.4	Low	218 Å²	218	129.8 Å²	129.8	82%	0.823	67%	0.668	S	S	*	*	S	Bend	trans	-80.8	-11.5	170.6	-91.5	-176.1	173.5	176	-0.9	113.7	I118	I118-R122 WeakPolarHBondContact O-CB 3.48Å; I118-R122 PolarHBondContact O-N 2.9Å; I118-R122 VanDerWaalsContact O-N 3.1Å
123	L	46.6	Very low	49.8	Very low	107 Å²	107	128.8 Å²	128.8	56%	0.56	68%	0.679	S	S	*	*			trans	-111.9	70.7	172.6	-74.4	163.2	0	0	0	108.1	N120 K121 P125	N120-L123 CarbonylContact O-C 3.52Å; N120-L123 PolarHBondContact O-N 3.14Å; K121-L123 VanDerWaalsContact C-N 3.32Å; L123-P125 WeakPolarHBondContact O-CD 3.41Å; L123-P125 WeakPolarHBondContact O-CG 3.08Å
124	N	42.5	Very low	49.3	Very low	123 Å²	123	125.4 Å²	125.4	66%	0.658	68%	0.683	S	S	*	*			trans	-79.3	106.3	170.3	-146.6	5.3	0	0	0	107.4	D126	N124-D126 VanDerWaalsContact C-N 3.33Å
125	P	45.9	Very low	48.9	Very low	103 Å²	103	129.4 Å²	129.4	67%	0.669	69%	0.694	S	S	*	*			trans	-89.7	1.3	-173.4	1.3	21.1	0	0	0	112.8	L123	L123-P125 WeakPolarHBondContact O-CD 3.41Å; L123-P125 WeakPolarHBondContact O-CG 3.08Å
126	D	49.9	Very low	48.5	Very low	141 Å²	141	134.1 Å²	134.1	75%	0.754	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	8.1	-162	-70.2	-18.5	0	0	0	115.4	N124	N124-D126 VanDerWaalsContact C-N 3.33Å
127	E	50	Low	48	Very low	178 Å²	178	135 Å²	135	83%	0.832	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	5.7	179	-80.5	-172.8	166.7	0	0	116
128	L	43.7	Very low	47.6	Very low	169 Å²	169	133.6 Å²	133.6	89%	0.885	72%	0.717	S	S	*	*	S	Bend	trans	-131.4	84.3	172.3	-81.1	164.2	0	0	0	111.7
129	C	41	Very low	47.2	Very low	141 Å²	141	133.1 Å²	133.1	95%	0.953	72%	0.718	S	S	*	*			trans	-29.1	135.9	160.5	-100.1	0	0	0	0	115.4
130	G	37.9	Very low	46.9	Very low	60 Å²	60	136.2 Å²	136.2	62%	0.619	73%	0.725	S	S	*	*			trans	126.3	90.6	136.7	0	0	0	0	0	117.3
131	N	43	Very low	46.6	Very low	166 Å²	166	135.7 Å²	135.7	89%	0.888	72%	0.722	S	S	*	*			trans	60.4	67.9	143.1	-62	-15.9	0	0	0	119.3
132	V	43.4	Very low	46.2	Very low	120 Å²	120	132.8 Å²	132.8	73%	0.727	72%	0.719	S	S	*	*			trans	-144.1	57.7	154.2	-161.1	0	0	0	0	111.8	C134	V132-C134 VanDerWaalsContact C-N 3.34Å; V132-C134 PolarHBondContact O-N 2.98Å
133	S	41.5	Very low	46.1	Very low	122 Å²	122	130 Å²	130	85%	0.853	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	19.9	-177.1	-164.4	0	0	0	0	115.4
134	C	50	Low	46.1	Very low	114 Å²	114	129.7 Å²	129.7	77%	0.77	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.6	16.7	-172.8	-61.7	0	0	0	0	117	V132	V132-C134 VanDerWaalsContact C-N 3.34Å; V132-C134 PolarHBondContact O-N 2.98Å
135	K	52.7	Low	46.1	Very low	157 Å²	157	131.6 Å²	131.6	68%	0.683	72%	0.721	S	S	*	*	S	Bend	trans	-133	-3.6	-178.8	-69	-172	179.4	-179.8	0	117.1
136	L	47.1	Very low	45.8	Very low	155 Å²	155	134.7 Å²	134.7	81%	0.812	73%	0.727	S	S	*	*	H	α-helix	trans	-80.4	-23.6	-179.2	-118.3	116.9	0	0	0	113.9	N138 R140	L136-N138 VanDerWaalsContact C-N 3.32Å; L136-N138 PolarHBondContact O-N 2.95Å; L136-R140 PolarHBondContact O-N 3.35Å
137	E	47	Very low	45.3	Very low	146 Å²	146	135.3 Å²	135.3	68%	0.682	73%	0.73	S	S	*	*	H	α-helix	trans	-67.1	-31.5	176.1	-134.9	95.2	-142	0	0	112.5	N141	E137-N141 PolarHBondContact O-N 3.39Å; E137-N141 PolarHBondContact O-ND2 3.41Å
138	N	50.3	Low	44.5	Very low	111 Å²	111	131.8 Å²	131.8	59%	0.594	73%	0.725	S	S	*	*	H	α-helix	trans	-78.5	-29.3	-177.3	-73.8	-15.2	0	0	0	112.9	L136 S142	L136-N138 VanDerWaalsContact C-N 3.32Å; L136-N138 PolarHBondContact O-N 2.95Å; N138-S142 PolarHBondContact O-N 3.36Å; N138-S142 PolarHBondContact O-OG 2.83Å
139	V	51	Low	44	Very low	90 Å²	90	130.8 Å²	130.8	55%	0.545	72%	0.72	S	S	.	*	H	α-helix	trans	-75.8	-31	175.9	-178.2	0	0	0	0	111	Y143	V139-Y143 PolarHBondContact O-N 3.33Å
140	R	45.8	Very low	43.4	Very low	192 Å²	192	129.1 Å²	129.1	73%	0.725	71%	0.707	S	S	*	*	H	α-helix	trans	-68.7	-35.1	174.8	-156.3	174.8	-161.1	167.2	5	112.3	L136	L136-R140 PolarHBondContact O-N 3.35Å
141	N	47.8	Very low	43.2	Very low	98 Å²	98	133.1 Å²	133.1	52%	0.524	71%	0.713	S	S	.	*	H	α-helix	trans	-78.2	-24.5	178.4	-71.5	-21.4	0	0	0	113.6	E137	E137-N141 PolarHBondContact O-N 3.39Å; E137-N141 PolarHBondContact O-ND2 3.41Å
142	S	44.3	Very low	42.6	Very low	78 Å²	78	132.5 Å²	132.5	55%	0.545	71%	0.709	S	S	.	*	H	α-helix	trans	-74.5	-23.9	172.7	-54	0	0	0	0	113.6	N138	N138-S142 PolarHBondContact O-N 3.36Å; N138-S142 PolarHBondContact O-OG 2.83Å
143	Y	46.8	Very low	42.1	Very low	159 Å²	159	134.4 Å²	134.4	62%	0.624	71%	0.714	S	S	*	*	H	α-helix	trans	-82.3	-18	176	-95.9	-86.4	0	0	0	114	V139	V139-Y143 PolarHBondContact O-N 3.33Å
144	S	46.6	Very low	41.6	Very low	100 Å²	100	135.5 Å²	135.5	70%	0.699	71%	0.706	S	S	*	*	S	Bend	trans	-88.5	-8.2	177.7	-74	0	0	0	0	114.5
145	Q	42.1	Very low	40.7	Very low	163 Å²	163	136.6 Å²	136.6	76%	0.762	70%	0.699	S	S	*	*	S	Bend	trans	-105.6	4.3	-176.6	-76.9	-172.8	-13.6	0	0	115.5
146	Q	40.2	Very low	39.9	Very low	169 Å²	169	135.1 Å²	135.1	79%	0.79	71%	0.708	S	S	*	*	S	Bend	trans	-114.9	6.1	176.7	-72.7	-165.9	-16	0	0	115.6
147	N	38.2	Very low	39.4	Very low	153 Å²	153	135.5 Å²	135.5	82%	0.818	71%	0.706	S	S	*	*			trans	-108.7	28.4	175.4	-77.9	-11.9	0	0	0	113.8
148	S	33.4	Very low	39	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	70%	0.704	S	S	*	*			trans	-98.3	64.9	167.6	62.6	0	0	0	0	110.5
149	L	33.1	Very low	38.4	Very low	148 Å²	148	135.3 Å²	135.3	78%	0.775	71%	0.71	S	S	*	*			trans	-114.7	118.9	158.4	-86.9	164.6	0	0	0	106.9	I151	L149-I151 PolarHBondContact O-N 3.16Å
150	P	29.9	Very low	37.9	Very low	106 Å²	106	138.1 Å²	138.1	69%	0.688	72%	0.715	S	S	*	*			trans	-68.8	104	174.8	28.2	-28.6	0	0	0	106.8	L152	P150-L152 PolarHBondContact O-N 3.4Å
151	I	33.8	Very low	37.7	Very low	145 Å²	145	136.7 Å²	136.7	74%	0.744	72%	0.716	S	S	*	*			trans	-66.3	91.8	160.3	-63.1	175.9	0	0	0	105.2	L149 L153	L149-I151 PolarHBondContact O-N 3.16Å; I151-L153 HydrophobicContact CG2-CB 4.47Å; I151-L153 HydrophobicContact CG2-CD1 4Å; I151-L153 HydrophobicContact CG2-CG 4.11Å; I151-L153 PolarHBondContact O-N 3.12Å
152	L	30.3	Very low	37.6	Very low	152 Å²	152	135.9 Å²	135.9	80%	0.796	72%	0.715	S	S	*	*			trans	-56.1	85.1	160.3	-85.7	160.5	0	0	0	108.1	P150	P150-L152 PolarHBondContact O-N 3.4Å
153	L	32.1	Very low	37.6	Very low	160 Å²	160	142.3 Å²	142.3	84%	0.838	73%	0.727	S	S	*	*			trans	-110.8	59.1	153.4	-88	166.4	0	0	0	107.1	I151	I151-L153 HydrophobicContact CG2-CB 4.47Å; I151-L153 HydrophobicContact CG2-CD1 4Å; I151-L153 HydrophobicContact CG2-CG 4.11Å; I151-L153 PolarHBondContact O-N 3.12Å
154	H	32	Very low	37.7	Very low	146 Å²	146	137.1 Å²	137.1	68%	0.676	71%	0.714	S	S	*	*			trans	-100	120.1	165.2	-126.5	-88.5	0	0	0	107.9
155	E	30.8	Very low	37.7	Very low	137 Å²	137	138.1 Å²	138.1	64%	0.64	71%	0.708	S	S	*	*			trans	69.9	80.6	153.3	-68.2	166.2	-159.9	0	0	118.8
156	S	35.9	Very low	38.1	Very low	125 Å²	125	135.1 Å²	135.1	87%	0.874	70%	0.697	S	S	*	*			trans	-116.8	49.3	137	80.1	0	0	0	0	110.5
157	Q	36.1	Very low	38.9	Very low	164 Å²	164	131.6 Å²	131.6	77%	0.766	68%	0.684	S	S	*	*			trans	-96	-1.1	177.3	-117.1	169.7	-16.5	0	0	113.7
158	N	38.1	Very low	39.5	Very low	117 Å²	117	128.6 Å²	128.6	63%	0.626	67%	0.666	S	S	*	*	S	Bend	trans	-114.6	8	-168.3	-73.6	-15.5	0	0	0	117.5	T162	N158-T162 PolarHBondContact O-OG1 3.36Å
159	N	38	Very low	40.6	Very low	136 Å²	136	128.2 Å²	128.2	73%	0.727	65%	0.652	S	S	*	*	S	Bend	trans	-118.5	1.1	-174.1	-74	-24.3	0	0	0	116.6
160	F	40.2	Very low	41.9	Very low	149 Å²	149	123.4 Å²	123.4	65%	0.654	63%	0.632	S	S	*	*	S	Bend	trans	-111.1	-22.4	178.6	-122.2	-90.9	0	0	0	114.3
161	E	41.8	Very low	43.1	Very low	161 Å²	161	124 Å²	124	75%	0.752	62%	0.623	S	S	*	*	S	Bend	trans	-85.7	-31.6	-179.9	-72.6	-174.1	157.9	0	0	113.3	H165	E161-H165 PolarHBondContact O-N 2.9Å
162	T	45.7	Very low	43.9	Very low	81 Å²	81	122.8 Å²	122.8	50%	0.497	62%	0.617	S	S	.	*	H	α-helix	trans	-71.8	-40.6	-179.5	36.3	0	0	0	0	112.9	N158 S164 H165 D166	N158-T162 PolarHBondContact O-OG1 3.36Å; T162-S164 PolarHBondContact O-N 3.24Å; T162-H165 PolarHBondContact O-N 3.42Å; T162-D166 VanDerWaalsContact O-CG 3.27Å; T162-D166 PolarHBondContact O-N 3.48Å
163	R	44	Very low	45.1	Very low	213 Å²	213	121.1 Å²	121.1	80%	0.804	61%	0.606	S	S	*	*	H	α-helix	trans	-71.9	-23.5	-177.8	-111.4	179	-178.7	-178	1.3	115.1
164	S	49.5	Very low	46.1	Very low	50 Å²	50	117.9 Å²	117.9	35%	0.35	59%	0.589	S	S	.	*	H	α-helix	trans	-84.5	-29.4	175.6	-172.6	0	0	0	0	112	T162 M168	T162-S164 PolarHBondContact O-N 3.24Å; S164-M168 PolarHBondContact O-N 2.87Å
165	H	47	Very low	46.6	Very low	122 Å²	122	115.1 Å²	115.1	57%	0.565	58%	0.577	S	S	*	*	H	α-helix	trans	-71.9	-45	178.5	-140.4	-86.9	0	0	0	110.9	E161 T162 N167 M168 E169	E161-H165 PolarHBondContact O-N 2.9Å; T162-H165 PolarHBondContact O-N 3.42Å; H165-N167 VanDerWaalsContact C-N 3.27Å; H165-N167 PolarHBondContact O-N 3.41Å; H165-M168 PolarHBondContact O-N 2.88Å; H165-M168 VanDerWaalsContact O-N 3.11Å; H165-E169 IonicContact ND1-OE2 3.19Å; H165-E169 WeakPolarHBondContact O-CB 3.38Å; H165-E169 PolarHBondContact O-N 2.95Å
166	D	50.8	Low	47.4	Very low	100 Å²	100	113.6 Å²	113.6	54%	0.535	57%	0.574	S	S	.	*	H	α-helix	trans	-62.5	-31	180	-63.1	-19.5	0	0	0	113.2	T162 S170	T162-D166 VanDerWaalsContact O-CG 3.27Å; T162-D166 PolarHBondContact O-N 3.48Å; D166-S170 VanDerWaalsContact O-CB 3.31Å; D166-S170 WeakPolarHBondContact O-CB 3.34Å; D166-S170 PolarHBondContact O-N 3.47Å; D166-S170 VanDerWaalsContact O-N 3.08Å; D166-S170 PolarHBondContact O-OG 2.84Å
167	N	55.9	Low	48.1	Very low	95 Å²	95	115.8 Å²	115.8	51%	0.508	56%	0.563	S	S	.	*	H	α-helix	trans	-78.5	-29	178.3	-164.9	-1.3	0	0	0	112.7	H165 S170 K171	H165-N167 VanDerWaalsContact C-N 3.27Å; H165-N167 PolarHBondContact O-N 3.41Å; N167-S170 WeakPolarHBondContact CA-OG 3.5Å; N167-S170 PolarHBondContact O-OG 2.94Å; N167-K171 WeakPolarHBondContact O-CG 3.34Å; N167-K171 PolarHBondContact O-N 3.44Å
168	M	51.4	Low	48.8	Very low	90 Å²	90	112 Å²	112	44%	0.443	55%	0.551	S	S	.	*	H	α-helix	trans	-79.6	-37.4	172.7	-73.1	-137.4	-70.6	0	0	111.9	S164 H165 K171 L172 F406	S164-M168 PolarHBondContact O-N 2.87Å; H165-M168 PolarHBondContact O-N 2.88Å; H165-M168 VanDerWaalsContact O-N 3.11Å; M168-K171 PolarHBondContact O-N 3.06Å; M168-L172 WeakPolarHBondContact O-CG 3.06Å; M168-L172 PolarHBondContact O-N 3.08Å; M168-F406 HydrophobicContact SD-CE1 3.65Å; M168-F406 HydrophobicContact SD-CZ 3.8Å
169	E	55.9	Low	49.6	Very low	95 Å²	95	109.6 Å²	109.6	44%	0.444	54%	0.541	S	S	.	.	H	α-helix	trans	-68.5	-40	179	-164	154.2	-175.3	0	0	112	H165 K171 L172 Q173	H165-E169 IonicContact ND1-OE2 3.19Å; H165-E169 WeakPolarHBondContact O-CB 3.38Å; H165-E169 PolarHBondContact O-N 2.95Å; E169-K171 VanDerWaalsContact C-N 3.34Å; E169-K171 PolarHBondContact O-N 3.14Å; E169-L172 PolarHBondContact O-N 2.9Å; E169-Q173 WeakPolarHBondContact O-CG 3.28Å; E169-Q173 PolarHBondContact O-N 3.27Å
170	S	60.1	Low	50.4	Low	48 Å²	48	109.7 Å²	109.7	34%	0.336	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-28.7	170.9	53.5	0	0	0	0	113.7	D166 N167 N174	D166-S170 VanDerWaalsContact O-CB 3.31Å; D166-S170 WeakPolarHBondContact O-CB 3.34Å; D166-S170 PolarHBondContact O-N 3.47Å; D166-S170 VanDerWaalsContact O-N 3.08Å; D166-S170 PolarHBondContact O-OG 2.84Å; N167-S170 WeakPolarHBondContact CA-OG 3.5Å; N167-S170 PolarHBondContact O-OG 2.94Å; S170-N174 WeakPolarHBondContact O-CB 3.49Å; S170-N174 PolarHBondContact O-N 3.4Å; S170-N174 PolarHBondContact O-ND2 3.46Å
171	K	56.9	Low	51	Low	119 Å²	119	106.5 Å²	106.5	52%	0.517	53%	0.533	S	S	.	.	H	α-helix	trans	-74.7	-31.8	171.2	-84.8	-179.5	178.5	-179.8	0	113.1	N167 M168 E169 M175	N167-K171 WeakPolarHBondContact O-CG 3.34Å; N167-K171 PolarHBondContact O-N 3.44Å; M168-K171 PolarHBondContact O-N 3.06Å; E169-K171 VanDerWaalsContact C-N 3.34Å; E169-K171 PolarHBondContact O-N 3.14Å; K171-M175 PolarHBondContact O-N 3.47Å
172	L	48.8	Very low	52	Low	118 Å²	118	101.4 Å²	101.4	62%	0.618	52%	0.515	S	S	*	.	H	α-helix	trans	-71.4	-44.8	173.6	-75.5	165.8	0	0	0	111.4	M168 E169 N174 M175 D176	M168-L172 WeakPolarHBondContact O-CG 3.06Å; M168-L172 PolarHBondContact O-N 3.08Å; E169-L172 PolarHBondContact O-N 2.9Å; L172-N174 VanDerWaalsContact C-N 3.29Å; L172-N174 PolarHBondContact O-N 3.24Å; L172-M175 WeakPolarHBondContact O-CB 3.3Å; L172-M175 PolarHBondContact O-N 3.11Å; L172-D176 PolarHBondContact O-N 2.9Å; L172-D176 VanDerWaalsContact O-N 3.17Å
173	Q	55.9	Low	53.2	Low	118 Å²	118	102 Å²	102	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-63.1	-32.6	175.5	-72.9	-179.3	-1.3	0	0	113.1	E169 M175 D176 R177	E169-Q173 WeakPolarHBondContact O-CG 3.28Å; E169-Q173 PolarHBondContact O-N 3.27Å; Q173-M175 VanDerWaalsContact C-N 3.34Å; Q173-D176 PolarHBondContact O-N 2.93Å; Q173-R177 PolarHBondContact O-N 3.25Å
174	N	54.1	Low	54.6	Low	91 Å²	91	95 Å²	95	49%	0.487	51%	0.506	S	S	.	.	H	α-helix	trans	-74.7	-21.3	173.7	-78.4	-45.6	0	0	0	113.3	S170 L172	S170-N174 WeakPolarHBondContact O-CB 3.49Å; S170-N174 PolarHBondContact O-N 3.4Å; S170-N174 PolarHBondContact O-ND2 3.46Å; L172-N174 VanDerWaalsContact C-N 3.29Å; L172-N174 PolarHBondContact O-N 3.24Å
175	M	43	Very low	55.5	Low	88 Å²	88	101 Å²	101	43%	0.433	52%	0.521	S	S	.	.	H	α-helix	trans	-73.4	-37.7	168.9	-85.5	-141.6	56.1	0	0	111.9	K171 L172 Q173 R177 T178 T179 K398	K171-M175 PolarHBondContact O-N 3.47Å; L172-M175 WeakPolarHBondContact O-CB 3.3Å; L172-M175 PolarHBondContact O-N 3.11Å; Q173-M175 VanDerWaalsContact C-N 3.34Å; M175-R177 VanDerWaalsContact C-N 3.32Å; M175-R177 PolarHBondContact O-N 3.43Å; M175-T178 PolarHBondContact O-N 2.96Å; M175-T178 VanDerWaalsContact O-N 3.08Å; M175-T178 PolarHBondContact O-OG1 2.96Å; M175-T179 PolarHBondContact O-N 3.33Å; M175-K398 PolarHBondContact SD-NZ 3.28Å
176	D	46.4	Very low	56.4	Low	106 Å²	106	100.3 Å²	100.3	57%	0.567	52%	0.521	S	S	*	.	H	α-helix	trans	-66.9	-31.5	177.5	-78.1	-21.4	0	0	0	113	L172 Q173 T178 T179 E180	L172-D176 PolarHBondContact O-N 2.9Å; L172-D176 VanDerWaalsContact O-N 3.17Å; Q173-D176 PolarHBondContact O-N 2.93Å; D176-T178 VanDerWaalsContact C-N 3.27Å; D176-T178 PolarHBondContact O-N 3.46Å; D176-T179 VanDerWaalsContact C-OG1 3.26Å; D176-T179 VanDerWaalsContact CA-OG1 3.24Å; D176-T179 WeakPolarHBondContact CA-OG1 3.32Å; D176-T179 PolarHBondContact O-N 2.84Å; D176-T179 VanDerWaalsContact O-N 3.14Å; D176-T179 PolarHBondContact O-OG1 3.4Å; D176-E180 PolarHBondContact O-N 3.27Å
177	R	51.1	Low	57.7	Low	170 Å²	170	97.8 Å²	97.8	64%	0.642	51%	0.514	S	S	*	.	H	α-helix	trans	-65.8	-27.3	171.3	-72.2	-178.2	174.9	171.3	-1	113.6	Q173 M175	Q173-R177 PolarHBondContact O-N 3.25Å; M175-R177 VanDerWaalsContact C-N 3.32Å; M175-R177 PolarHBondContact O-N 3.43Å
178	T	51.5	Low	58.8	Low	85 Å²	85	100 Å²	100	52%	0.521	52%	0.517	S	S	.	.	H	α-helix	trans	-77	-24.6	173.8	62.3	0	0	0	0	112.8	M175 D176 S182	M175-T178 PolarHBondContact O-N 2.96Å; M175-T178 VanDerWaalsContact O-N 3.08Å; M175-T178 PolarHBondContact O-OG1 2.96Å; D176-T178 VanDerWaalsContact C-N 3.27Å; D176-T178 PolarHBondContact O-N 3.46Å; T178-S182 PolarHBondContact O-N 2.96Å
179	T	53.3	Low	59.7	Low	66 Å²	66	100.3 Å²	100.3	41%	0.405	52%	0.519	S	S	.	.	H	α-helix	trans	-72.2	-36.7	172	32.1	0	0	0	0	112.4	M175 D176 S181 S182 V183	M175-T179 PolarHBondContact O-N 3.33Å; D176-T179 VanDerWaalsContact C-OG1 3.26Å; D176-T179 VanDerWaalsContact CA-OG1 3.24Å; D176-T179 WeakPolarHBondContact CA-OG1 3.32Å; D176-T179 PolarHBondContact O-N 2.84Å; D176-T179 VanDerWaalsContact O-N 3.14Å; D176-T179 PolarHBondContact O-OG1 3.4Å; T179-S181 VanDerWaalsContact C-N 3.34Å; T179-S181 PolarHBondContact O-N 3.29Å; T179-S182 WeakPolarHBondContact CA-OG 3.46Å; T179-S182 CarbonylContact O-C 3.59Å; T179-S182 WeakPolarHBondContact O-CA 3.17Å; T179-S182 WeakPolarHBondContact O-CB 3.41Å; T179-S182 PolarHBondContact O-N 3.45Å; T179-S182 PolarHBondContact O-OG 3.48Å; T179-V183 WeakPolarHBondContact O-CG2 3.38Å; T179-V183 PolarHBondContact O-N 3.26Å
180	E	54.6	Low	60.5	Low	138 Å²	138	102.2 Å²	102.2	65%	0.645	53%	0.528	S	S	*	.	H	α-helix	trans	-60.7	-41.7	174.8	-70.5	179.4	164.8	0	0	112.4	D176 S182 V183 A184	D176-E180 PolarHBondContact O-N 3.27Å; E180-S182 VanDerWaalsContact C-N 3.28Å; E180-S182 PolarHBondContact O-N 2.87Å; E180-V183 PolarHBondContact O-N 3.27Å; E180-A184 PolarHBondContact O-N 2.75Å
181	S	54.3	Low	61.4	Low	82 Å²	82	105.6 Å²	105.6	57%	0.573	54%	0.539	S	S	*	.	H	α-helix	trans	-63.3	-34	173.5	-173.8	0	0	0	0	112.4	T179 R185	T179-S181 VanDerWaalsContact C-N 3.34Å; T179-S181 PolarHBondContact O-N 3.29Å; S181-R185 WeakPolarHBondContact O-CB 3.48Å; S181-R185 PolarHBondContact O-N 3.44Å
182	S	61.5	Low	62.2	Low	54 Å²	54	104.2 Å²	104.2	38%	0.378	53%	0.533	S	S	.	.	H	α-helix	trans	-73.7	-33.7	175.9	77.3	0	0	0	0	113.2	T178 T179 E180 R185 L186	T178-S182 PolarHBondContact O-N 2.96Å; T179-S182 WeakPolarHBondContact CA-OG 3.46Å; T179-S182 CarbonylContact O-C 3.59Å; T179-S182 WeakPolarHBondContact O-CA 3.17Å; T179-S182 WeakPolarHBondContact O-CB 3.41Å; T179-S182 PolarHBondContact O-N 3.45Å; T179-S182 PolarHBondContact O-OG 3.48Å; E180-S182 VanDerWaalsContact C-N 3.28Å; E180-S182 PolarHBondContact O-N 2.87Å; S182-R185 PolarHBondContact O-N 3.35Å; S182-L186 WeakPolarHBondContact O-CB 3.32Å; S182-L186 PolarHBondContact O-N 2.92Å
183	V	72.1	Confident	63.1	Low	94 Å²	94	103.7 Å²	103.7	57%	0.57	53%	0.53	S	S	*	.	H	α-helix	trans	-69.2	-44.8	175.6	172.9	0	0	0	0	110.4	T179 E180 R185 L186 A187	T179-V183 WeakPolarHBondContact O-CG2 3.38Å; T179-V183 PolarHBondContact O-N 3.26Å; E180-V183 PolarHBondContact O-N 3.27Å; V183-R185 VanDerWaalsContact C-N 3.29Å; V183-R185 PolarHBondContact O-N 2.93Å; V183-L186 PolarHBondContact O-N 3.34Å; V183-A187 WeakPolarHBondContact O-CB 3.36Å; V183-A187 PolarHBondContact O-N 2.92Å
184	A	73.6	Confident	63.9	Low	65 Å²	65	105.6 Å²	105.6	54%	0.537	54%	0.537	S	S	.	.	H	α-helix	trans	-61.1	-38.6	175.1	0	0	0	0	0	112.2	E180 A187 Y188	E180-A184 PolarHBondContact O-N 2.75Å; A184-A187 PolarHBondContact O-N 2.98Å; A184-Y188 WeakPolarHBondContact O-CB 3.44Å; A184-Y188 PolarHBondContact O-N 2.91Å
185	R	66.9	Low	64.8	Low	177 Å²	177	106 Å²	106	67%	0.668	54%	0.542	S	S	*	.	H	α-helix	trans	-71.3	-34.4	177.6	-156.7	171	179	-178.4	-0.4	112.6	S181 S182 V183 L189	S181-R185 WeakPolarHBondContact O-CB 3.48Å; S181-R185 PolarHBondContact O-N 3.44Å; S182-R185 PolarHBondContact O-N 3.35Å; V183-R185 VanDerWaalsContact C-N 3.29Å; V183-R185 PolarHBondContact O-N 2.93Å; R185-L189 VanDerWaalsContact O-CG 3.31Å; R185-L189 WeakPolarHBondContact O-CG 3.49Å; R185-L189 PolarHBondContact O-N 3.33Å; R185-L189 VanDerWaalsContact O-N 3.08Å
186	L	67.7	Low	65.4	Low	107 Å²	107	109.1 Å²	109.1	56%	0.56	55%	0.554	S	S	*	*	H	α-helix	trans	-69.2	-41.7	171.9	-86.2	166.6	0	0	0	112.2	S182 V183 L189 Q190	S182-L186 WeakPolarHBondContact O-CB 3.32Å; S182-L186 PolarHBondContact O-N 2.92Å; V183-L186 PolarHBondContact O-N 3.34Å; L186-L189 PolarHBondContact O-N 3.47Å; L186-Q190 PolarHBondContact O-N 3.28Å
187	A	76.2	Confident	65.4	Low	48 Å²	48	110 Å²	110	40%	0.397	56%	0.558	S	S	.	*	H	α-helix	trans	-62	-43.9	174.9	0	0	0	0	0	111.5	V183 A184 L189 Q190 E191	V183-A187 WeakPolarHBondContact O-CB 3.36Å; V183-A187 PolarHBondContact O-N 2.92Å; A184-A187 PolarHBondContact O-N 2.98Å; A187-L189 PolarHBondContact O-N 2.96Å; A187-Q190 PolarHBondContact O-N 3.26Å; A187-E191 PolarHBondContact O-N 2.89Å
188	Y	79.2	Confident	65.3	Low	142 Å²	142	107.4 Å²	107.4	56%	0.557	56%	0.563	S	S	*	*	H	α-helix	trans	-59.9	-42.6	173.6	177.9	-96.2	0	0	0	112.7	A184 E191 K192	A184-Y188 WeakPolarHBondContact O-CB 3.44Å; A184-Y188 PolarHBondContact O-N 2.91Å; Y188-E191 PolarHBondContact O-N 3.38Å; Y188-K192 HydrophobicContact CE1-CG 3.99Å; Y188-K192 WeakPolarHBondContact O-CB 3.45Å; Y188-K192 PolarHBondContact O-N 3.04Å; Y188-K192 WeakPolarHBondContact OH-CE 3.37Å
189	L	70.7	Confident	65	Low	95 Å²	95	108.9 Å²	108.9	50%	0.497	58%	0.577	S	S	.	*	H	α-helix	trans	-67.3	-36.1	176.4	-75.5	169.6	0	0	0	112.4	R185 L186 A187 L193	R185-L189 VanDerWaalsContact O-CG 3.31Å; R185-L189 WeakPolarHBondContact O-CG 3.49Å; R185-L189 PolarHBondContact O-N 3.33Å; R185-L189 VanDerWaalsContact O-N 3.08Å; L186-L189 PolarHBondContact O-N 3.47Å; A187-L189 PolarHBondContact O-N 2.96Å; L189-L193 WeakPolarHBondContact O-CB 3.25Å; L189-L193 VanDerWaalsContact O-CG 3.28Å; L189-L193 WeakPolarHBondContact O-CG 3.04Å; L189-L193 PolarHBondContact O-N 3.24Å
190	Q	73.3	Confident	64.4	Low	135 Å²	135	112.5 Å²	112.5	63%	0.631	59%	0.592	S	S	*	*	H	α-helix	trans	-66.1	-42.3	173.8	-81.7	-178	-23.6	0	0	112.5	L186 A187 L193 K194	L186-Q190 PolarHBondContact O-N 3.28Å; A187-Q190 PolarHBondContact O-N 3.26Å; Q190-L193 PolarHBondContact O-N 3.48Å; Q190-K194 PolarHBondContact O-N 3.38Å
191	E	77.5	Confident	63.7	Low	119 Å²	119	111.5 Å²	111.5	56%	0.556	60%	0.598	S	S	*	*	H	α-helix	trans	-61.3	-45.5	173.4	-101.5	-75.8	124.8	0	0	111.9	A187 Y188 L193 K194 T195	A187-E191 PolarHBondContact O-N 2.89Å; Y188-E191 PolarHBondContact O-N 3.38Å; E191-L193 VanDerWaalsContact C-N 3.33Å; E191-L193 PolarHBondContact O-N 2.88Å; E191-K194 PolarHBondContact O-N 2.99Å; E191-T195 PolarHBondContact O-N 3.44Å; E191-T195 VanDerWaalsContact O-N 3.11Å; E191-T195 PolarHBondContact O-OG1 3.32Å; E191-T195 VanDerWaalsContact O-OG1 3.12Å
192	K	74.5	Confident	63.2	Low	90 Å²	90	115.1 Å²	115.1	39%	0.391	61%	0.609	S	S	.	*	H	α-helix	trans	-60.9	-39.8	172.7	-87.6	-83.4	-178.7	-178.8	0	111.9	Y188 T195 F196	Y188-K192 HydrophobicContact CE1-CG 3.99Å; Y188-K192 WeakPolarHBondContact O-CB 3.45Å; Y188-K192 PolarHBondContact O-N 3.04Å; Y188-K192 WeakPolarHBondContact OH-CE 3.37Å; K192-T195 WeakPolarHBondContact CA-OG1 3.46Å; K192-T195 PolarHBondContact O-N 3.17Å; K192-T195 PolarHBondContact O-OG1 3.41Å; K192-F196 HydrophobicContact CD-CE2 3.95Å; K192-F196 WeakPolarHBondContact O-CD2 3.37Å; K192-F196 PolarHBondContact O-N 3.47Å
193	L	67.6	Low	62.2	Low	108 Å²	108	119.7 Å²	119.7	57%	0.565	63%	0.629	S	S	*	*	H	α-helix	trans	-68.6	-35.9	176.9	-77.3	167.6	0	0	0	112.7	L189 Q190 E191 T195 F196 L197	L189-L193 WeakPolarHBondContact O-CB 3.25Å; L189-L193 VanDerWaalsContact O-CG 3.28Å; L189-L193 WeakPolarHBondContact O-CG 3.04Å; L189-L193 PolarHBondContact O-N 3.24Å; Q190-L193 PolarHBondContact O-N 3.48Å; E191-L193 VanDerWaalsContact C-N 3.33Å; E191-L193 PolarHBondContact O-N 2.88Å; L193-T195 VanDerWaalsContact C-N 3.31Å; L193-T195 PolarHBondContact O-N 3.36Å; L193-F196 PolarHBondContact O-N 3.44Å; L193-L197 PolarHBondContact O-N 3.38Å
194	K	73.1	Confident	60.7	Low	158 Å²	158	118.3 Å²	118.3	69%	0.687	63%	0.634	S	S	*	*	H	α-helix	trans	-62.8	-35.5	172.9	-87	-179.4	174.5	179.4	0	112.8	Q190 E191	Q190-K194 PolarHBondContact O-N 3.38Å; E191-K194 PolarHBondContact O-N 2.99Å
195	T	72.3	Confident	59.2	Low	99 Å²	99	122.5 Å²	122.5	61%	0.607	65%	0.647	S	S	*	*	H	α-helix	trans	-75.8	-20.9	178.8	42.6	0	0	0	0	113.9	E191 K192 L193	E191-T195 PolarHBondContact O-N 3.44Å; E191-T195 VanDerWaalsContact O-N 3.11Å; E191-T195 PolarHBondContact O-OG1 3.32Å; E191-T195 VanDerWaalsContact O-OG1 3.12Å; K192-T195 WeakPolarHBondContact CA-OG1 3.46Å; K192-T195 PolarHBondContact O-N 3.17Å; K192-T195 PolarHBondContact O-OG1 3.41Å; L193-T195 VanDerWaalsContact C-N 3.31Å; L193-T195 PolarHBondContact O-N 3.36Å
196	F	55.9	Low	58.1	Low	153 Å²	153	121.7 Å²	121.7	67%	0.671	66%	0.656	S	S	*	*	H	α-helix	trans	-95.2	-3.5	177.8	-74.8	-64.9	0	0	0	114.8	K192 L193 P198	K192-F196 HydrophobicContact CD-CE2 3.95Å; K192-F196 WeakPolarHBondContact O-CD2 3.37Å; K192-F196 PolarHBondContact O-N 3.47Å; L193-F196 PolarHBondContact O-N 3.44Å; F196-P198 WeakPolarHBondContact O-CD 3.34Å
197	L	46	Very low	56.8	Low	124 Å²	124	121.2 Å²	121.2	65%	0.649	66%	0.659	S	S	*	*	S	Bend	trans	-107.6	101.1	174	-81.7	155.6	0	0	0	108.3	L193 S199	L193-L197 PolarHBondContact O-N 3.38Å; L197-S199 PolarHBondContact O-N 3.12Å; L197-S199 VanDerWaalsContact O-N 3.16Å
198	P	49.1	Very low	55.2	Low	116 Å²	116	128.3 Å²	128.3	75%	0.753	68%	0.681	S	S	*	*			trans	-58.1	124	167.8	-14.3	28	0	0	0	107.5	F196 I200	F196-P198 WeakPolarHBondContact O-CD 3.34Å; P198-I200 PolarHBondContact O-N 3.03Å
199	S	45.5	Very low	53.5	Low	117 Å²	117	127.4 Å²	127.4	82%	0.818	70%	0.696	S	S	*	*			trans	-46.4	104.1	174.4	15.2	0	0	0	0	110.2	L197 P201	L197-S199 PolarHBondContact O-N 3.12Å; L197-S199 VanDerWaalsContact O-N 3.16Å; S199-P201 WeakPolarHBondContact O-CD 3.4Å
200	I	41.2	Very low	51.8	Low	142 Å²	142	127.1 Å²	127.1	73%	0.728	72%	0.715	S	S	*	*			trans	-69.2	116.7	163.4	-61.2	172.8	0	0	0	105.4	P198 I202	P198-I200 PolarHBondContact O-N 3.03Å; I200-I202 HydrophobicContact CG2-CG1 4.34Å; I200-I202 PolarHBondContact O-N 3.43Å
201	P	39.5	Very low	50.1	Low	116 Å²	116	123.9 Å²	123.9	75%	0.753	72%	0.718	S	S	*	*			trans	-72.3	105.3	172.2	30.1	-27.8	0	0	0	106.6	S199 D203	S199-P201 WeakPolarHBondContact O-CD 3.4Å; P201-D203 PolarHBondContact O-N 3.02Å; P201-D203 VanDerWaalsContact O-N 3.14Å
202	I	44.7	Very low	48.1	Very low	158 Å²	158	124 Å²	124	81%	0.81	73%	0.727	S	S	*	*			trans	-82.9	80.8	164.8	-57.5	176	0	0	0	105.3	I200	I200-I202 HydrophobicContact CG2-CG1 4.34Å; I200-I202 PolarHBondContact O-N 3.43Å
203	D	38.7	Very low	46.4	Very low	151 Å²	151	129.4 Å²	129.4	81%	0.807	75%	0.751	S	S	*	*			trans	-86.1	110.2	165.9	-145.9	-1	0	0	0	106.7	P201	P201-D203 PolarHBondContact O-N 3.02Å; P201-D203 VanDerWaalsContact O-N 3.14Å
204	G	41.2	Very low	45	Very low	64 Å²	64	130.6 Å²	130.6	66%	0.66	76%	0.756	S	S	*	*			trans	-135.1	63.2	-165.9	0	0	0	0	0	111.3
205	N	42.5	Very low	43.4	Very low	154 Å²	154	131.2 Å²	131.2	82%	0.824	77%	0.766	S	S	*	*			trans	-84.3	120.8	163.1	-83.2	-32.2	0	0	0	110.4
206	N	44.5	Very low	41.7	Very low	159 Å²	159	132 Å²	132	85%	0.85	77%	0.771	S	S	*	*			trans	99.3	134.4	156.3	-87.9	-25.1	0	0	0	121
207	P	40	Very low	40.7	Very low	97 Å²	97	135.1 Å²	135.1	63%	0.63	78%	0.778	S	S	*	*			trans	-99	177.4	-163.5	39.8	-31.3	0	0	0	111.8
208	K	41.6	Very low	40.3	Very low	198 Å²	198	134.4 Å²	134.4	86%	0.861	78%	0.784	S	S	*	*			trans	100	86.6	168	-55.3	171.1	-177.1	-178.6	0	114.5
209	S	44.9	Very low	39.6	Very low	123 Å²	123	134.8 Å²	134.8	86%	0.86	78%	0.78	S	S	*	*				-171.9	131	115.4	51	0	0	0	0	109.3
210	G	34.5	Very low	39.2	Very low	88 Å²	88	134.3 Å²	134.3	91%	0.907	78%	0.776	S	S	*	*			trans	-71.7	133.5	-175.4	0	0	0	0	0	112.2
211	G	38	Very low	39.1	Very low	67 Å²	67	136.7 Å²	136.7	69%	0.691	78%	0.781	S	S	*	*			trans	-153.9	88.3	169.6	0	0	0	0	0	108.6	F213	G211-F213 PolarHBondContact O-N 3.35Å
212	V	35	Very low	39	Very low	123 Å²	123	141.2 Å²	141.2	75%	0.745	78%	0.783	S	S	*	*			trans	-70.5	114.6	179.8	172.6	0	0	0	0	109.3	I214	V212-I214 HydrophobicContact CG1-CD1 4.11Å; V212-I214 HydrophobicContact CG1-CG1 3.82Å
213	F	38.8	Very low	38.5	Very low	203 Å²	203	140 Å²	140	89%	0.89	78%	0.784	S	S	*	*			trans	-118.5	102.7	158.6	-87.4	-80.2	0	0	0	109.2	G211 L215	G211-F213 PolarHBondContact O-N 3.35Å; F213-L215 PolarHBondContact O-N 3.31Å
214	I	38.9	Very low	38.7	Very low	133 Å²	133	139.9 Å²	139.9	68%	0.682	78%	0.778	S	S	*	*			trans	-75.4	111.2	169.7	-65.1	168	0	0	0	107.3	V212 T216	V212-I214 HydrophobicContact CG1-CD1 4.11Å; V212-I214 HydrophobicContact CG1-CG1 3.82Å; I214-T216 HydrophobicContact CG2-CG2 4.34Å; I214-T216 PolarHBondContact O-N 2.95Å
215	L	38.7	Very low	38.4	Very low	170 Å²	170	145.9 Å²	145.9	89%	0.89	79%	0.789	S	S	*	*			trans	-91.2	90.7	164.1	-94.4	159.7	0	0	0	108.6	F213 R217	F213-L215 PolarHBondContact O-N 3.31Å; L215-R217 PolarHBondContact O-N 3.34Å
216	T	37.3	Very low	38.3	Very low	116 Å²	116	146.3 Å²	146.3	71%	0.712	79%	0.791	S	S	*	*			trans	-64.9	115	170.2	4.4	0	0	0	0	109.8	I214 S218	I214-T216 HydrophobicContact CG2-CG2 4.34Å; I214-T216 PolarHBondContact O-N 2.95Å; T216-S218 PolarHBondContact O-N 2.81Å
217	R	34.3	Very low	38.1	Very low	218 Å²	218	148.5 Å²	148.5	82%	0.823	79%	0.792	S	S	*	*			trans	-83.5	92.5	172.7	-174.8	-179.8	-176.9	-179.6	2	109.4	L215 N219	L215-R217 PolarHBondContact O-N 3.34Å; R217-N219 PolarHBondContact O-N 2.92Å
218	S	36.3	Very low	37.9	Very low	109 Å²	109	155.5 Å²	155.5	76%	0.762	81%	0.806	S	S	*	*			trans	-84.1	99.7	173.4	-9.6	0	0	0	0	110.1	T216	T216-S218 PolarHBondContact O-N 2.81Å
219	N	36.1	Very low	37.8	Very low	125 Å²	125	151.6 Å²	151.6	67%	0.668	80%	0.802	S	S	*	*			trans	-83.1	105.4	160.8	-77.4	-21.7	0	0	0	108.1	R217	R217-N219 PolarHBondContact O-N 2.92Å
220	S	36.8	Very low	37.8	Very low	106 Å²	106	151.2 Å²	151.2	74%	0.741	80%	0.799	S	S	*	*			trans	-114	99.5	165.7	-179.6	0	0	0	0	108.3
221	F	38.5	Very low	38.1	Very low	192 Å²	192	154.8 Å²	154.8	84%	0.842	80%	0.797	S	S	*	*			trans	-90.7	100.5	164.1	-94.1	-86.1	0	0	0	107.5	T223	F221-T223 PolarHBondContact O-N 3.5Å
222	R	37	Very low	38.3	Very low	211 Å²	211	159.8 Å²	159.8	80%	0.796	81%	0.808	S	S	*	*			trans	-72.7	116.9	162.1	-103.1	-174	175.6	-159.2	2.9	108.5	E224	R222-E224 IonicContact NH1-OE1 3.69Å
223	T	35.8	Very low	38.8	Very low	133 Å²	133	159.8 Å²	159.8	82%	0.816	81%	0.812	S	S	*	*			trans	-88.3	98.7	168.5	-24.1	0	0	0	0	107.1	F221	F221-T223 PolarHBondContact O-N 3.5Å
224	E	41.6	Very low	38.9	Very low	149 Å²	149	158.8 Å²	158.8	70%	0.696	81%	0.81	S	S	*	*			trans	-87.7	115.8	167.5	-90	177	-173.8	0	0	109.3	R222	R222-E224 IonicContact NH1-OE1 3.69Å
225	Q	35	Very low	39.8	Very low	189 Å²	189	157.2 Å²	157.2	88%	0.883	81%	0.809	S	S	*	*			trans	-67.3	123.1	168.6	-62.4	-167.3	11	0	0	109.1
226	L	39.8	Very low	39.9	Very low	164 Å²	164	155.6 Å²	155.6	86%	0.859	80%	0.802	S	S	*	*			trans	-121.2	126.3	158.1	-111.9	95.7	0	0	0	110.8
227	K	40.4	Very low	40.4	Very low	204 Å²	204	155.6 Å²	155.6	89%	0.887	81%	0.805	S	S	*	*			trans	-53.1	139.2	-178.3	-73.6	161.1	167.9	173.9	0	113
228	R	36.1	Very low	40.7	Very low	244 Å²	244	154.8 Å²	154.8	92%	0.921	81%	0.807	S	S	*	*			trans	-71.8	147.4	158.9	-71.3	179.1	176	167.5	-1.8	110.1
229	P	39.8	Very low	41.2	Very low	117 Å²	117	154.3 Å²	154.3	76%	0.76	80%	0.804	S	S	*	*			trans	-122.3	135.6	137.6	29.9	-16.7	0	0	0	112.1
230	S	45.2	Very low	41.3	Very low	115 Å²	115	154.7 Å²	154.7	80%	0.804	81%	0.811	S	S	*	*			trans	8.7	120.6	160.1	58.6	0	0	0	0	120.1
231	N	40.7	Very low	41.5	Very low	163 Å²	163	155.5 Å²	155.5	87%	0.872	81%	0.811	S	S	*	*			trans	-71	126.3	160.8	-65.2	-25.5	0	0	0	110.7
232	N	42.4	Very low	41.6	Very low	171 Å²	171	154.7 Å²	154.7	91%	0.914	81%	0.807	S	S	*	*			trans	-157.2	86.3	150.1	-126.3	15	0	0	0	108.8
233	C	45.8	Very low	42	Very low	123 Å²	123	152.1 Å²	152.1	83%	0.831	81%	0.808	S	S	*	*			trans	-165.3	118.3	156.7	177.4	0	0	0	0	109.5
234	H	40.5	Very low	42.1	Very low	183 Å²	183	153.4 Å²	153.4	85%	0.847	81%	0.805	S	S	*	*			trans	-96.2	114.7	179.5	-162.8	49.3	0	0	0	107.2
235	C	58	Low	42	Very low	99 Å²	99	151.1 Å²	151.1	67%	0.669	81%	0.811	S	S	*	*			trans	-158.9	115.4	166.9	174	0	0	0	0	109.6
236	D	40	Very low	42.8	Very low	137 Å²	137	151.3 Å²	151.3	73%	0.733	81%	0.809	S	S	*	*			trans	-70.7	119.3	172.6	-81.7	-50.1	0	0	0	111
237	C	49.1	Very low	42.8	Very low	115 Å²	115	149.2 Å²	149.2	78%	0.777	81%	0.806	S	S	*	*			trans	-134.7	84.7	164	-69.6	0	0	0	0	108.8
238	K	39.7	Very low	42.9	Very low	201 Å²	201	147.5 Å²	147.5	87%	0.874	81%	0.805	S	S	*	*			trans	-83.8	103.1	164.3	-73.4	178.2	-178.1	170.8	0	108.8
239	S	47	Very low	43.4	Very low	100 Å²	100	141.9 Å²	141.9	70%	0.699	80%	0.798	S	S	*	*			trans	-162.4	108.8	147.8	56.5	0	0	0	0	111.7
240	V	37.6	Very low	43.5	Very low	133 Å²	133	143.6 Å²	143.6	81%	0.806	80%	0.8	S	S	*	*			trans	45.8	101.3	132.5	-168.6	0	0	0	0	116.9
241	V	41.4	Very low	43.3	Very low	122 Å²	122	143.2 Å²	143.2	74%	0.739	80%	0.795	S	S	*	*			trans	-122.6	89	152.5	-179.1	0	0	0	0	108.4	L243	V241-L243 HydrophobicContact CG1-CB 4.47Å; V241-L243 HydrophobicContact CG1-CD1 3.62Å; V241-L243 HydrophobicContact CG1-CG 3.59Å; V241-L243 PolarHBondContact O-N 3.23Å
242	K	41.4	Very low	43.1	Very low	176 Å²	176	143.7 Å²	143.7	77%	0.765	80%	0.797	S	S	*	*			trans	-74.5	103.7	155.9	-103.5	179.3	175	176.9	0	106.6
243	L	43.9	Very low	43.2	Very low	157 Å²	157	144.2 Å²	144.2	82%	0.822	79%	0.794	S	S	*	*			trans	-96.3	99.4	166.3	-85.5	161.3	0	0	0	109	V241	V241-L243 HydrophobicContact CG1-CB 4.47Å; V241-L243 HydrophobicContact CG1-CD1 3.62Å; V241-L243 HydrophobicContact CG1-CG 3.59Å; V241-L243 PolarHBondContact O-N 3.23Å
244	H	38.9	Very low	42.9	Very low	159 Å²	159	145.2 Å²	145.2	74%	0.736	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.9	121.4	160.3	-85.5	-89.7	0	0	0	108.8	K246	H244-K246 PolarHBondContact O-N 3.4Å
245	A	40.4	Very low	42.8	Very low	102 Å²	102	148 Å²	148	84%	0.843	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-69.9	117.3	168.8	0	0	0	0	0	109.7
246	K	50.7	Low	42	Very low	193 Å²	193	148.6 Å²	148.6	84%	0.839	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-83.7	141.2	167	-73.4	-178.9	175.5	178.9	0	109.8	H244	H244-K246 PolarHBondContact O-N 3.4Å
247	P	39.2	Very low	41.8	Very low	120 Å²	120	149.8 Å²	149.8	78%	0.779	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-83.1	128.6	169.9	32.6	-28.6	0	0	0	110.1
248	L	44	Very low	41.5	Very low	168 Å²	168	153.7 Å²	153.7	88%	0.88	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-85.2	116.6	167.7	-100.6	129	0	0	0	108.9
249	V	46.5	Very low	41.3	Very low	126 Å²	126	152.9 Å²	152.9	76%	0.764	81%	0.808	S	S	*	*			trans	-111.5	132	164.2	176.1	0	0	0	0	106.5
250	D	40.7	Very low	40.8	Very low	152 Å²	152	153.5 Å²	153.5	81%	0.813	81%	0.812	S	S	*	*			trans	-127.5	125.7	178.4	-138.9	6.1	0	0	0	107.3
251	P	41.5	Very low	40.7	Very low	108 Å²	108	153.5 Å²	153.5	70%	0.701	81%	0.813	S	S	*	*			trans	-117.3	112.1	164.4	14.6	6.4	0	0	0	112.1
252	L	37.2	Very low	40.8	Very low	173 Å²	173	154.5 Å²	154.5	91%	0.906	81%	0.813	S	S	*	*			trans	14.3	120.5	141.8	-72.5	157.1	0	0	0	117.9
253	H	44	Very low	40.5	Very low	182 Å²	182	151.8 Å²	151.8	84%	0.843	81%	0.813	S	S	*	*			trans	-154	148.1	152.4	-124.2	-72.1	0	0	0	111.8
254	I	38.7	Very low	40.2	Very low	144 Å²	144	150.1 Å²	150.1	74%	0.738	81%	0.813	S	S	*	*			trans	104.4	87.6	161.3	-48.7	153	0	0	0	115.9
255	Y	39.6	Very low	40.1	Very low	241 Å²	241	148.7 Å²	148.7	95%	0.945	82%	0.818	S	S	*	*			trans	-123.4	119.3	135.5	-99.6	-89.7	0	0	0	106.8
256	S	41.3	Very low	39.8	Very low	112 Å²	112	151.8 Å²	151.8	78%	0.783	82%	0.819	S	S	*	*			trans	-138.8	112.3	168.8	-62.1	0	0	0	0	108.4
257	N	34.7	Very low	39.4	Very low	161 Å²	161	148.1 Å²	148.1	86%	0.861	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-88.2	127.8	-178.2	-142.7	1.9	0	0	0	108.3
258	K	42.9	Very low	39.3	Very low	198 Å²	198	146.7 Å²	146.7	86%	0.861	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-101.6	124.3	176.3	-72.3	-176.1	177.9	-178.7	0	109.7
259	H	35.6	Very low	39	Very low	184 Å²	184	145.6 Å²	145.6	85%	0.852	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-73.6	137.3	167.5	-72.7	-87.5	0	0	0	110.4
260	S	36.5	Very low	38.8	Very low	112 Å²	112	147 Å²	147	78%	0.783	81%	0.809	S	S	*	*			trans	-126.1	112.1	170.1	-179.8	0	0	0	0	108.1
261	T	36.3	Very low	39.1	Very low	134 Å²	134	148.3 Å²	148.3	82%	0.822	81%	0.81	S	S	*	*			trans	-105.5	126	173.6	-56.7	0	0	0	0	108.2
262	I	42.2	Very low	39.5	Very low	142 Å²	142	150.8 Å²	150.8	73%	0.728	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-95.6	134.3	177.1	-63	167	0	0	0	108.3
263	P	36.7	Very low	40.3	Very low	120 Å²	120	147 Å²	147	78%	0.779	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-94.6	138.1	170.8	20.7	-5.7	0	0	0	112.5
264	C	36.1	Very low	40.7	Very low	121 Å²	121	143 Å²	143	82%	0.818	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-94.3	150.2	171.6	-75.5	0	0	0	0	111.9
265	P	38.3	Very low	41.4	Very low	129 Å²	129	143.4 Å²	143.4	84%	0.838	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-92	157.5	-177.8	24.9	-10.3	0	0	0	114
266	I	33	Very low	42.3	Very low	168 Å²	168	133 Å²	133	86%	0.862	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-84.3	142.2	179.5	-63.3	160.4	0	0	0	110.1
267	S	41.4	Very low	43.3	Very low	116 Å²	116	129.1 Å²	129.1	81%	0.811	72%	0.719	S	S	*	*			trans	-136	131	154.9	62.2	0	0	0	0	110.6
268	S	37.4	Very low	44.8	Very low	90 Å²	90	127.3 Å²	127.3	63%	0.629	71%	0.705	S	S	*	*			trans	-63.9	146.1	-171.4	47	0	0	0	0	116.8
269	T	38.4	Very low	46	Very low	145 Å²	145	120.8 Å²	120.8	89%	0.89	69%	0.685	S	S	*	*			trans	-148.3	73	144.6	-20.8	0	0	0	0	107.5
270	E	42.9	Very low	47.9	Very low	156 Å²	156	113 Å²	113	73%	0.729	65%	0.649	S	S	*	*			trans	-82.4	118	178.3	-62	179.3	161.9	0	0	107.8
271	E	46.5	Very low	49.7	Very low	178 Å²	178	112.5 Å²	112.5	83%	0.832	63%	0.63	S	S	*	*	S	Bend	trans	-174.1	-28.7	151.4	-103.6	163.8	-151.8	0	0	111.2
272	N	49.9	Very low	51.6	Low	161 Å²	161	113.3 Å²	113.3	86%	0.861	62%	0.623	S	S	*	*	S	Bend	trans	-96.5	-4.7	176.9	-72.5	-45.6	0	0	0	115.3
273	E	53.4	Low	53	Low	93 Å²	93	112.4 Å²	112.4	44%	0.435	62%	0.618	S	S	.	*	S	Bend	trans	-84.2	-21.6	-177.8	-96	-169.9	169.3	0	0	114	L275 S276 N277 R301	E273-L275 PolarHBondContact O-N 3.19Å; E273-S276 PolarHBondContact O-N 2.67Å; E273-N277 PolarHBondContact O-N 3.28Å; E273-N277 PolarHBondContact O-ND2 2.62Å; E273-N277 PolarHBondContact O-OD1 3.34Å; E273-R301 IonicContact OE2-NH2 3.73Å
274	V	53.4	Low	54.9	Low	97 Å²	97	108.6 Å²	108.6	59%	0.588	59%	0.591	S	S	*	*	H	α-helix	trans	-66.7	-36.2	-167.5	-175.7	0	0	0	0	112.5
275	L	52.9	Low	56.7	Low	154 Å²	154	109.2 Å²	109.2	81%	0.806	59%	0.586	S	S	*	*	H	α-helix	trans	-74.9	-33.2	176.2	-113.7	86.5	0	0	0	112.9	E273	E273-L275 PolarHBondContact O-N 3.19Å
276	S	59.3	Low	58.5	Low	23 Å²	23	105.5 Å²	105.5	16%	0.161	57%	0.572	C	S	.	*	H	α-helix	trans	-77.3	-26.1	-178.5	-168.6	0	0	0	0	112.8	E273 F280 L305	E273-S276 PolarHBondContact O-N 2.67Å; S276-F280 PolarHBondContact O-N 3Å; S276-L305 WeakPolarHBondContact OG-CD2 3.26Å
277	N	62.4	Low	60.4	Low	29 Å²	29	103.8 Å²	103.8	16%	0.155	56%	0.559	C	S	.	*	H	α-helix	trans	-71.3	-36.3	-180	-67.1	-22.4	0	0	0	112.1	E273 S279 F280 Y281 R301	E273-N277 PolarHBondContact O-N 3.28Å; E273-N277 PolarHBondContact O-ND2 2.62Å; E273-N277 PolarHBondContact O-OD1 3.34Å; N277-S279 VanDerWaalsContact C-N 3.29Å; N277-S279 PolarHBondContact O-N 3.42Å; N277-F280 PolarHBondContact O-N 3.25Å; N277-Y281 HydrophobicContact CB-CD2 4.45Å; N277-Y281 HydrophobicContact CB-CE2 4.34Å; N277-Y281 WeakPolarHBondContact O-CD2 3.24Å; N277-Y281 PolarHBondContact O-N 2.63Å; N277-Y281 VanDerWaalsContact O-N 3.08Å; N277-R301 PolarHBondContact ND2-NH2 3.14Å; N277-R301 VanDerWaalsContact OD1-CZ 3.32Å; N277-R301 PolarHBondContact OD1-NE 2.66Å; N277-R301 PolarHBondContact OD1-NH2 3.35Å
278	Q	65.3	Low	61.6	Low	123 Å²	123	104.1 Å²	104.1	58%	0.575	56%	0.558	S	S	*	*	H	α-helix	trans	-62	-36.6	177.1	-74.1	-171.3	8.2	0	0	112.7	K282	Q278-K282 WeakPolarHBondContact O-CB 3.44Å; Q278-K282 WeakPolarHBondContact O-CG 3.32Å; Q278-K282 PolarHBondContact O-N 3.08Å; Q278-K282 VanDerWaalsContact O-N 3.08Å
279	S	67.5	Low	63.2	Low	62 Å²	62	109.1 Å²	109.1	43%	0.434	57%	0.568	S	S	.	*	H	α-helix	trans	-66.3	-38.8	177.7	-44.4	0	0	0	0	112	N277 L283	N277-S279 VanDerWaalsContact C-N 3.29Å; N277-S279 PolarHBondContact O-N 3.42Å; S279-L283 PolarHBondContact O-N 3.29Å
280	F	76.1	Confident	64.8	Low	21 Å²	21	107 Å²	107	9%	0.092	55%	0.551	C	S	.	*	H	α-helix	trans	-69.5	-46.5	178.9	179.4	-106.7	0	0	0	112.1	S276 N277 K282 L283 L284 E297 L300 R301 A304	S276-F280 PolarHBondContact O-N 3Å; N277-F280 PolarHBondContact O-N 3.25Å; F280-K282 VanDerWaalsContact C-N 3.34Å; F280-K282 PolarHBondContact O-N 2.93Å; F280-L283 WeakPolarHBondContact O-CB 3.32Å; F280-L283 PolarHBondContact O-N 3.27Å; F280-L283 VanDerWaalsContact O-N 3.09Å; F280-L284 HydrophobicContact CD1-CD1 3.81Å; F280-L284 HydrophobicContact CE1-CD1 3.28Å; F280-L284 HydrophobicContact CE1-CG 4.3Å; F280-L284 HydrophobicContact CE2-CD1 4.37Å; F280-L284 HydrophobicContact CZ-CD1 3.6Å; F280-L284 HydrophobicContact CZ-CG 4.25Å; F280-L284 PolarHBondContact O-N 2.87Å; F280-E297 HydrophobicContact CE1-CG 3.87Å; F280-E297 HydrophobicContact CZ-CG 4.09Å; F280-L300 HydrophobicContact CE2-CB 4.19Å; F280-L300 HydrophobicContact CZ-CB 4.17Å; F280-R301 HydrophobicContact CD1-CB 4.38Å; F280-R301 HydrophobicContact CD1-CG 4.16Å; F280-R301 HydrophobicContact CD2-CB 4.48Å; F280-R301 HydrophobicContact CE1-CB 3.87Å; F280-R301 HydrophobicContact CE1-CG 4.13Å; F280-R301 HydrophobicContact CE2-CB 4.01Å; F280-R301 HydrophobicContact CG-CG 4.38Å; F280-R301 HydrophobicContact CZ-CB 3.67Å; F280-R301 HydrophobicContact CZ-CG 4.34Å; F280-A304 HydrophobicContact CD2-CB 4.06Å; F280-A304 HydrophobicContact CE2-CB 4.36Å
281	Y	74.8	Confident	66.4	Low	100 Å²	100	107.4 Å²	107.4	39%	0.392	56%	0.558	S	S	.	*	H	α-helix	trans	-67.4	-32.4	177.7	-71.9	-65.7	0	0	0	112.8	N277 L283 L284 N285 E297	N277-Y281 HydrophobicContact CB-CD2 4.45Å; N277-Y281 HydrophobicContact CB-CE2 4.34Å; N277-Y281 WeakPolarHBondContact O-CD2 3.24Å; N277-Y281 PolarHBondContact O-N 2.63Å; N277-Y281 VanDerWaalsContact O-N 3.08Å; Y281-L283 VanDerWaalsContact C-N 3.3Å; Y281-L283 PolarHBondContact O-N 3.41Å; Y281-L284 HydrophobicContact CD1-CD1 4.22Å; Y281-L284 HydrophobicContact CE1-CD1 4.43Å; Y281-L284 PolarHBondContact O-N 2.86Å; Y281-N285 WeakPolarHBondContact O-CB 3.44Å; Y281-N285 VanDerWaalsContact O-CG 3.24Å; Y281-N285 PolarHBondContact O-N 3.31Å; Y281-E297 VanDerWaalsContact CE1-OE1 3.24Å; Y281-E297 WeakPolarHBondContact CE1-OE1 3.35Å; Y281-E297 PolarHBondContact OH-OE1 3.23Å; Y281-E297 VanDerWaalsContact OH-OE1 3.06Å
282	K	76.3	Confident	67.7	Low	152 Å²	152	101.1 Å²	101.1	66%	0.661	53%	0.53	S	S	*	.	H	α-helix	trans	-63	-35	169.8	-79.6	176.8	-179.5	175.9	0	112.8	Q278 F280	Q278-K282 WeakPolarHBondContact O-CB 3.44Å; Q278-K282 WeakPolarHBondContact O-CG 3.32Å; Q278-K282 PolarHBondContact O-N 3.08Å; Q278-K282 VanDerWaalsContact O-N 3.08Å; F280-K282 VanDerWaalsContact C-N 3.34Å; F280-K282 PolarHBondContact O-N 2.93Å
283	L	72	Confident	69.2	Low	122 Å²	122	98.5 Å²	98.5	64%	0.639	52%	0.516	S	S	*	.	H	α-helix	trans	-73.4	-39	178.2	-151.5	109	0	0	0	111.8	S279 F280 Y281 G286 F287	S279-L283 PolarHBondContact O-N 3.29Å; F280-L283 WeakPolarHBondContact O-CB 3.32Å; F280-L283 PolarHBondContact O-N 3.27Å; F280-L283 VanDerWaalsContact O-N 3.09Å; Y281-L283 VanDerWaalsContact C-N 3.3Å; Y281-L283 PolarHBondContact O-N 3.41Å; L283-G286 PolarHBondContact O-N 2.94Å; L283-F287 WeakPolarHBondContact O-CD2 3.28Å
284	L	75.7	Confident	70.5	Confident	40 Å²	40	100.3 Å²	100.3	21%	0.209	52%	0.524	C	S	.	.	H	α-helix	trans	-65	-38.2	174.1	-80.3	168.2	0	0	0	112.4	F280 Y281 G286 F287 L292 E297	F280-L284 HydrophobicContact CD1-CD1 3.81Å; F280-L284 HydrophobicContact CE1-CD1 3.28Å; F280-L284 HydrophobicContact CE1-CG 4.3Å; F280-L284 HydrophobicContact CE2-CD1 4.37Å; F280-L284 HydrophobicContact CZ-CD1 3.6Å; F280-L284 HydrophobicContact CZ-CG 4.25Å; F280-L284 PolarHBondContact O-N 2.87Å; Y281-L284 HydrophobicContact CD1-CD1 4.22Å; Y281-L284 HydrophobicContact CE1-CD1 4.43Å; Y281-L284 PolarHBondContact O-N 2.86Å; L284-G286 PolarHBondContact O-N 2.84Å; L284-G286 VanDerWaalsContact O-N 3.12Å; L284-F287 PolarHBondContact O-N 3.47Å; L284-L292 HydrophobicContact CD2-CD1 3.51Å; L284-E297 HydrophobicContact CD1-CG 4.23Å
285	N	73.8	Confident	71.8	Confident	134 Å²	134	101.1 Å²	101.1	72%	0.717	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.9	174.8	-74	-10.9	0	0	0	113.7	Y281 F287	Y281-N285 WeakPolarHBondContact O-CB 3.44Å; Y281-N285 VanDerWaalsContact O-CG 3.24Å; Y281-N285 PolarHBondContact O-N 3.31Å; N285-F287 VanDerWaalsContact C-N 3.32Å
286	G	76.4	Confident	73.2	Confident	52 Å²	52	98.3 Å²	98.3	54%	0.536	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.8	174	0	0	0	0	0	114.7	L283 L284 P288	L283-G286 PolarHBondContact O-N 2.94Å; L284-G286 PolarHBondContact O-N 2.84Å; L284-G286 VanDerWaalsContact O-N 3.12Å; G286-P288 WeakPolarHBondContact O-CD 3.32Å
287	F	72	Confident	74.3	Confident	132 Å²	132	99.8 Å²	99.8	58%	0.579	51%	0.509	S	S	*	.			trans	-126.6	73.8	-176.9	-64.2	-79.7	0	0	0	111.7	L283 L284 N285 K289 L290	L283-F287 WeakPolarHBondContact O-CD2 3.28Å; L284-F287 PolarHBondContact O-N 3.47Å; N285-F287 VanDerWaalsContact C-N 3.32Å; F287-K289 PolarHBondContact O-N 2.83Å; F287-L290 HydrophobicContact CB-CB 4.31Å; F287-L290 PolarHBondContact O-N 3.22Å
288	P	68.5	Low	75.2	Confident	122 Å²	122	104 Å²	104	79%	0.792	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	5.8	-174	27	-34.7	0	0	0	115.5	G286	G286-P288 WeakPolarHBondContact O-CD 3.32Å
289	K	70	Confident	76.1	Confident	195 Å²	195	100.8 Å²	100.8	85%	0.848	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	10.8	179.2	-63.4	-174.9	179.8	-178.7	0	113.3	F287	F287-K289 PolarHBondContact O-N 2.83Å
290	L	72.4	Confident	76.9	Confident	101 Å²	101	101.1 Å²	101.1	53%	0.529	51%	0.508	S	S	.	.			trans	-101.7	90.6	-176.6	-147.5	79.6	0	0	0	109	F287 L292	F287-L290 HydrophobicContact CB-CB 4.31Å; F287-L290 PolarHBondContact O-N 3.22Å; L290-L292 VanDerWaalsContact C-N 3.35Å; L290-L292 HydrophobicContact CD2-CD1 3.84Å; L290-L292 HydrophobicContact CD2-CD2 3.79Å; L290-L292 HydrophobicContact CD2-CG 3.83Å; L290-L292 HydrophobicContact CG-CD2 4.05Å; L290-L292 HydrophobicContact CG-CG 4.03Å; L290-L292 PolarHBondContact O-N 3.38Å
291	D	75.2	Confident	77.1	Confident	164 Å²	164	103 Å²	103	88%	0.877	51%	0.514	S	S	*	.			trans	-75	88.9	172.3	-67.3	-26.3	0	0	0	108.6
292	L	73.9	Confident	77.5	Confident	46 Å²	46	105.1 Å²	105.1	24%	0.241	53%	0.525	C	S	.	.			trans	-88.6	130.4	178.1	-66.9	171	0	0	0	110.4	L284 L290 E296 L300	L284-L292 HydrophobicContact CD2-CD1 3.51Å; L290-L292 VanDerWaalsContact C-N 3.35Å; L290-L292 HydrophobicContact CD2-CD1 3.84Å; L290-L292 HydrophobicContact CD2-CD2 3.79Å; L290-L292 HydrophobicContact CD2-CG 3.83Å; L290-L292 HydrophobicContact CG-CD2 4.05Å; L290-L292 HydrophobicContact CG-CG 4.03Å; L290-L292 PolarHBondContact O-N 3.38Å; L292-E296 WeakPolarHBondContact CA-OE2 3.31Å; L292-E296 HydrophobicContact CB-CB 4.28Å; L292-E296 HydrophobicContact CD2-CB 3.97Å; L292-L300 HydrophobicContact CD1-CD1 3.43Å; L292-L300 VanDerWaalsContact CD1-CD1 3.43Å; L292-L300 HydrophobicContact CD2-CD1 3.59Å; L292-L300 HydrophobicContact CG-CD1 4.17Å
293	D	81.8	Confident	77.8	Confident	107 Å²	107	104.2 Å²	104.2	57%	0.572	52%	0.522	S	S	*	.			trans	-65.8	154.8	167.2	-173.6	19.3	0	0	0	110.2	H295 E296 E297	D293-H295 PolarHBondContact O-N 2.86Å; D293-H295 VanDerWaalsContact O-N 3.08Å; D293-E296 HydrophobicContact CB-CG 4.13Å; D293-E296 PolarHBondContact N-OE2 3.26Å; D293-E296 WeakPolarHBondContact O-CA 3.36Å; D293-E296 WeakPolarHBondContact O-CB 3.41Å; D293-E296 PolarHBondContact O-N 2.88Å; D293-E297 PolarHBondContact O-N 3.4Å
294	E	80.8	Confident	78.1	Confident	130 Å²	130	100 Å²	100	61%	0.607	50%	0.504	S	S	*	.	H	α-helix	trans	-56.5	-33	-178.2	-164.3	-163.2	151.9	0	0	111.2	R298	E294-R298 VanDerWaalsContact CD-NH2 3.34Å; E294-R298 WeakPolarHBondContact O-CB 3.34Å; E294-R298 PolarHBondContact O-N 2.92Å; E294-R298 VanDerWaalsContact O-N 3.14Å; E294-R298 IonicContact OE1-CZ 2.71Å; E294-R298 IonicContact OE1-NH2 3.68Å; E294-R298 PolarHBondContact OE1-NH2 3.41Å
295	H	80.2	Confident	78.3	Confident	115 Å²	115	100.8 Å²	100.8	53%	0.532	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-43.8	173	-172.9	74.1	0	0	0	112.4	D293 R298 V299	D293-H295 PolarHBondContact O-N 2.86Å; D293-H295 VanDerWaalsContact O-N 3.08Å; H295-R298 PolarHBondContact O-N 3.32Å; H295-V299 VanDerWaalsContact O-CG2 3.28Å; H295-V299 WeakPolarHBondContact O-CG2 3.41Å; H295-V299 PolarHBondContact O-N 2.68Å
296	E	82	Confident	78.4	Confident	95 Å²	95	97.3 Å²	97.3	44%	0.444	50%	0.495	S	S	.	.	H	α-helix	trans	-67.9	-41.3	-179.5	-62.7	-178	151.8	0	0	111.4	L292 D293 R298 V299 L300	L292-E296 WeakPolarHBondContact CA-OE2 3.31Å; L292-E296 HydrophobicContact CB-CB 4.28Å; L292-E296 HydrophobicContact CD2-CB 3.97Å; D293-E296 HydrophobicContact CB-CG 4.13Å; D293-E296 PolarHBondContact N-OE2 3.26Å; D293-E296 WeakPolarHBondContact O-CA 3.36Å; D293-E296 WeakPolarHBondContact O-CB 3.41Å; D293-E296 PolarHBondContact O-N 2.88Å; E296-R298 VanDerWaalsContact C-N 3.33Å; E296-R298 PolarHBondContact O-N 3.17Å; E296-V299 PolarHBondContact O-N 3.21Å; E296-L300 WeakPolarHBondContact O-CB 3.38Å; E296-L300 PolarHBondContact O-N 2.99Å
297	E	82.3	Confident	78.5	Confident	53 Å²	53	99.6 Å²	99.6	25%	0.248	49%	0.494	C	S	.	.	H	α-helix	trans	-59	-45.8	173.5	-169.3	-170.4	156.6	0	0	110.7	F280 Y281 L284 D293 V299 L300 R301	F280-E297 HydrophobicContact CE1-CG 3.87Å; F280-E297 HydrophobicContact CZ-CG 4.09Å; Y281-E297 VanDerWaalsContact CE1-OE1 3.24Å; Y281-E297 WeakPolarHBondContact CE1-OE1 3.35Å; Y281-E297 PolarHBondContact OH-OE1 3.23Å; Y281-E297 VanDerWaalsContact OH-OE1 3.06Å; L284-E297 HydrophobicContact CD1-CG 4.23Å; D293-E297 PolarHBondContact O-N 3.4Å; E297-V299 VanDerWaalsContact C-N 3.34Å; E297-V299 PolarHBondContact O-N 3.25Å; E297-L300 PolarHBondContact O-N 2.94Å; E297-R301 VanDerWaalsContact O-CB 3.28Å; E297-R301 WeakPolarHBondContact O-CB 3.43Å; E297-R301 PolarHBondContact O-N 3.44Å
298	R	82.6	Confident	78.3	Confident	117 Å²	117	97.7 Å²	97.7	44%	0.442	49%	0.488	S	S	.	.	H	α-helix	trans	-64	-37.9	178.7	-161.2	-177.3	-58.4	133.8	-0.9	112.3	E294 H295 E296 K302	E294-R298 VanDerWaalsContact CD-NH2 3.34Å; E294-R298 WeakPolarHBondContact O-CB 3.34Å; E294-R298 PolarHBondContact O-N 2.92Å; E294-R298 VanDerWaalsContact O-N 3.14Å; E294-R298 IonicContact OE1-CZ 2.71Å; E294-R298 IonicContact OE1-NH2 3.68Å; E294-R298 PolarHBondContact OE1-NH2 3.41Å; H295-R298 PolarHBondContact O-N 3.32Å; E296-R298 VanDerWaalsContact C-N 3.33Å; E296-R298 PolarHBondContact O-N 3.17Å; R298-K302 WeakPolarHBondContact O-CG 3.43Å; R298-K302 PolarHBondContact O-N 3.43Å; R298-K302 VanDerWaalsContact O-N 3.1Å
299	V	84.3	Confident	78.3	Confident	56 Å²	56	101.5 Å²	101.5	34%	0.339	49%	0.487	S	S	.	.	H	α-helix	trans	-68.8	-43.8	175.7	170.8	0	0	0	0	110.9	H295 E296 E297 K302 K303	H295-V299 VanDerWaalsContact O-CG2 3.28Å; H295-V299 WeakPolarHBondContact O-CG2 3.41Å; H295-V299 PolarHBondContact O-N 2.68Å; E296-V299 PolarHBondContact O-N 3.21Å; E297-V299 VanDerWaalsContact C-N 3.34Å; E297-V299 PolarHBondContact O-N 3.25Å; V299-K302 PolarHBondContact O-N 2.92Å; V299-K303 HydrophobicContact CG1-CD 4.47Å; V299-K303 PolarHBondContact O-N 3.46Å
300	L	83	Confident	78.2	Confident	70 Å²	70	98.2 Å²	98.2	37%	0.366	47%	0.474	S	S	.	.	H	α-helix	trans	-62	-43.6	175.8	-87.1	159.2	0	0	0	111.7	F280 L292 E296 E297 K302 K303 A304	F280-L300 HydrophobicContact CE2-CB 4.19Å; F280-L300 HydrophobicContact CZ-CB 4.17Å; L292-L300 HydrophobicContact CD1-CD1 3.43Å; L292-L300 VanDerWaalsContact CD1-CD1 3.43Å; L292-L300 HydrophobicContact CD2-CD1 3.59Å; L292-L300 HydrophobicContact CG-CD1 4.17Å; E296-L300 WeakPolarHBondContact O-CB 3.38Å; E296-L300 PolarHBondContact O-N 2.99Å; E297-L300 PolarHBondContact O-N 2.94Å; L300-K302 PolarHBondContact O-N 3.25Å; L300-K303 PolarHBondContact O-N 3.34Å; L300-A304 WeakPolarHBondContact O-CB 3.34Å; L300-A304 PolarHBondContact O-N 2.94Å
301	R	81.3	Confident	77.8	Confident	61 Å²	61	100 Å²	100	23%	0.23	48%	0.484	C	S	.	.	H	α-helix	trans	-59.9	-46.3	176.2	-169.5	169.7	176.5	-164	-11.7	111.7	E273 N277 F280 E297 K303 A304 L305	E273-R301 IonicContact OE2-NH2 3.73Å; N277-R301 PolarHBondContact ND2-NH2 3.14Å; N277-R301 VanDerWaalsContact OD1-CZ 3.32Å; N277-R301 PolarHBondContact OD1-NE 2.66Å; N277-R301 PolarHBondContact OD1-NH2 3.35Å; F280-R301 HydrophobicContact CD1-CB 4.38Å; F280-R301 HydrophobicContact CD1-CG 4.16Å; F280-R301 HydrophobicContact CD2-CB 4.48Å; F280-R301 HydrophobicContact CE1-CB 3.87Å; F280-R301 HydrophobicContact CE1-CG 4.13Å; F280-R301 HydrophobicContact CE2-CB 4.01Å; F280-R301 HydrophobicContact CG-CG 4.38Å; F280-R301 HydrophobicContact CZ-CB 3.67Å; F280-R301 HydrophobicContact CZ-CG 4.34Å; E297-R301 VanDerWaalsContact O-CB 3.28Å; E297-R301 WeakPolarHBondContact O-CB 3.43Å; E297-R301 PolarHBondContact O-N 3.44Å; R301-K303 PolarHBondContact O-N 3.44Å; R301-A304 PolarHBondContact O-N 3.31Å; R301-L305 HydrophobicContact CG-CD1 4.3Å; R301-L305 WeakPolarHBondContact O-CB 3.46Å; R301-L305 VanDerWaalsContact O-CG 3.3Å; R301-L305 WeakPolarHBondContact O-CG 3.49Å; R301-L305 PolarHBondContact O-N 2.89Å
302	K	82.6	Confident	77	Confident	143 Å²	143	96.8 Å²	96.8	62%	0.622	47%	0.474	S	S	*	.	H	α-helix	trans	-61.6	-41.6	174.9	-76.2	-179.2	179.9	-175.9	0	112.3	R298 V299 L300 S306	R298-K302 WeakPolarHBondContact O-CG 3.43Å; R298-K302 PolarHBondContact O-N 3.43Å; R298-K302 VanDerWaalsContact O-N 3.1Å; V299-K302 PolarHBondContact O-N 2.92Å; L300-K302 PolarHBondContact O-N 3.25Å; K302-S306 WeakPolarHBondContact O-CB 3.48Å; K302-S306 PolarHBondContact O-N 3.43Å
303	K	82.5	Confident	75.8	Confident	134 Å²	134	98.3 Å²	98.3	58%	0.583	49%	0.488	S	S	*	.	H	α-helix	trans	-65.3	-44.5	175.9	-79.5	-179.6	177.7	176.2	0	112	V299 L300 R301 S306 L307	V299-K303 HydrophobicContact CG1-CD 4.47Å; V299-K303 PolarHBondContact O-N 3.46Å; L300-K303 PolarHBondContact O-N 3.34Å; R301-K303 PolarHBondContact O-N 3.44Å; K303-S306 WeakPolarHBondContact O-CB 3.46Å; K303-S306 PolarHBondContact O-N 3.22Å; K303-L307 WeakPolarHBondContact O-CG 3.46Å; K303-L307 PolarHBondContact O-N 2.94Å
304	A	79.7	Confident	74	Confident	34 Å²	34	99.9 Å²	99.9	28%	0.281	50%	0.497	S	S	.	.	H	α-helix	trans	-61.5	-45.4	177.8	0	0	0	0	0	111.5	F280 L300 R301 S306 L307 M308	F280-A304 HydrophobicContact CD2-CB 4.06Å; F280-A304 HydrophobicContact CE2-CB 4.36Å; L300-A304 WeakPolarHBondContact O-CB 3.34Å; L300-A304 PolarHBondContact O-N 2.94Å; R301-A304 PolarHBondContact O-N 3.31Å; A304-S306 VanDerWaalsContact C-N 3.33Å; A304-S306 PolarHBondContact O-N 3.4Å; A304-L307 PolarHBondContact O-N 2.9Å; A304-M308 WeakPolarHBondContact O-CB 3.44Å; A304-M308 WeakPolarHBondContact O-CG 3.36Å; A304-M308 PolarHBondContact O-N 3.33Å
305	L	78.2	Confident	72.3	Confident	56 Å²	56	99.3 Å²	99.3	29%	0.293	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-39	174.3	-72.6	171	0	0	0	112.3	S276 R301 M308 R309	S276-L305 WeakPolarHBondContact OG-CD2 3.26Å; R301-L305 HydrophobicContact CG-CD1 4.3Å; R301-L305 WeakPolarHBondContact O-CB 3.46Å; R301-L305 VanDerWaalsContact O-CG 3.3Å; R301-L305 WeakPolarHBondContact O-CG 3.49Å; R301-L305 PolarHBondContact O-N 2.89Å; L305-M308 PolarHBondContact O-N 3.11Å; L305-R309 WeakPolarHBondContact O-CB 3.48Å; L305-R309 PolarHBondContact O-N 3.08Å
306	S	77.5	Confident	70.5	Confident	61 Å²	61	99.4 Å²	99.4	43%	0.427	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-41.8	175.8	-172.5	0	0	0	0	112.1	K302 K303 A304 R309 Q310	K302-S306 WeakPolarHBondContact O-CB 3.48Å; K302-S306 PolarHBondContact O-N 3.43Å; K303-S306 WeakPolarHBondContact O-CB 3.46Å; K303-S306 PolarHBondContact O-N 3.22Å; A304-S306 VanDerWaalsContact C-N 3.33Å; A304-S306 PolarHBondContact O-N 3.4Å; S306-R309 PolarHBondContact O-N 3.21Å; S306-Q310 WeakPolarHBondContact O-CG 3.32Å; S306-Q310 PolarHBondContact O-N 3.46Å; S306-Q310 VanDerWaalsContact O-N 3.08Å
307	L	77.2	Confident	68.5	Low	100 Å²	100	101.1 Å²	101.1	52%	0.524	54%	0.541	S	S	.	.	H	α-helix	trans	-67.9	-42.5	176.5	-72	173.1	0	0	0	111.4	K303 A304 R309 Q310 L311	K303-L307 WeakPolarHBondContact O-CG 3.46Å; K303-L307 PolarHBondContact O-N 2.94Å; A304-L307 PolarHBondContact O-N 2.9Å; L307-R309 VanDerWaalsContact C-N 3.31Å; L307-R309 PolarHBondContact O-N 3.29Å; L307-Q310 PolarHBondContact O-N 3.33Å; L307-L311 WeakPolarHBondContact O-CB 3.28Å; L307-L311 VanDerWaalsContact O-CG 3.31Å; L307-L311 WeakPolarHBondContact O-CG 3.38Å; L307-L311 PolarHBondContact O-N 2.92Å
308	M	68.4	Low	66.4	Low	91 Å²	91	101.3 Å²	101.3	45%	0.448	56%	0.557	S	S	.	*	H	α-helix	trans	-62.1	-39	175	-77	-176.6	59.8	0	0	112	A304 L305 L311 S312	A304-M308 WeakPolarHBondContact O-CB 3.44Å; A304-M308 WeakPolarHBondContact O-CG 3.36Å; A304-M308 PolarHBondContact O-N 3.33Å; L305-M308 PolarHBondContact O-N 3.11Å; M308-L311 PolarHBondContact O-N 3.35Å; M308-S312 WeakPolarHBondContact O-CB 3.42Å; M308-S312 PolarHBondContact O-N 2.93Å; M308-S312 PolarHBondContact O-OG 3.43Å
309	R	69.3	Low	64.4	Low	203 Å²	203	104.3 Å²	104.3	77%	0.766	58%	0.58	S	S	*	*	H	α-helix	trans	-60.5	-47	173.1	-110.8	179.8	-178.5	151.5	2	111.6	L305 S306 L307 L311 S312 S313	L305-R309 WeakPolarHBondContact O-CB 3.48Å; L305-R309 PolarHBondContact O-N 3.08Å; S306-R309 PolarHBondContact O-N 3.21Å; L307-R309 VanDerWaalsContact C-N 3.31Å; L307-R309 PolarHBondContact O-N 3.29Å; R309-L311 VanDerWaalsContact C-N 3.28Å; R309-L311 PolarHBondContact O-N 2.94Å; R309-S312 PolarHBondContact O-N 3.18Å; R309-S312 PolarHBondContact O-OG 2.94Å; R309-S313 PolarHBondContact O-N 2.95Å; R309-S313 PolarHBondContact O-OG 2.94Å
310	Q	67.2	Low	62.3	Low	125 Å²	125	106.8 Å²	106.8	58%	0.584	60%	0.6	S	S	*	*	H	α-helix	trans	-63.7	-31.9	178.3	-73.7	178.9	-16.1	0	0	113	S306 L307 S313	S306-Q310 WeakPolarHBondContact O-CG 3.32Å; S306-Q310 PolarHBondContact O-N 3.46Å; S306-Q310 VanDerWaalsContact O-N 3.08Å; L307-Q310 PolarHBondContact O-N 3.33Å; Q310-S313 PolarHBondContact O-OG 3.4Å
311	L	63.5	Low	60.3	Low	140 Å²	140	109.2 Å²	109.2	73%	0.733	62%	0.62	S	S	*	*	H	α-helix	trans	-84	-27.6	178.4	-67.9	169.1	0	0	0	113.3	L307 M308 R309	L307-L311 WeakPolarHBondContact O-CB 3.28Å; L307-L311 VanDerWaalsContact O-CG 3.31Å; L307-L311 WeakPolarHBondContact O-CG 3.38Å; L307-L311 PolarHBondContact O-N 2.92Å; M308-L311 PolarHBondContact O-N 3.35Å; R309-L311 VanDerWaalsContact C-N 3.28Å; R309-L311 PolarHBondContact O-N 2.94Å
312	S	59	Low	58.2	Low	95 Å²	95	112.4 Å²	112.4	66%	0.664	65%	0.647	S	S	*	*	H	α-helix	trans	-81.9	-13.6	177.3	77.4	0	0	0	0	113.9	M308 R309 N314	M308-S312 WeakPolarHBondContact O-CB 3.42Å; M308-S312 PolarHBondContact O-N 2.93Å; M308-S312 PolarHBondContact O-OG 3.43Å; R309-S312 PolarHBondContact O-N 3.18Å; R309-S312 PolarHBondContact O-OG 2.94Å; S312-N314 PolarHBondContact O-N 2.91Å
313	S	48.5	Very low	56.3	Low	79 Å²	79	114 Å²	114	55%	0.552	66%	0.656	S	S	*	*	S	Bend	trans	-94.5	76.4	174.7	51.6	0	0	0	0	111.2	R309 Q310	R309-S313 PolarHBondContact O-N 2.95Å; R309-S313 PolarHBondContact O-OG 2.94Å; Q310-S313 PolarHBondContact O-OG 3.4Å
314	N	43.6	Very low	54.3	Low	140 Å²	140	113.8 Å²	113.8	75%	0.749	67%	0.666	S	S	*	*			trans	-150.9	144.7	160	-86.5	-31.3	0	0	0	105.3	S312	S312-N314 PolarHBondContact O-N 2.91Å
315	P	45	Very low	52.7	Low	117 Å²	117	116.4 Å²	116.4	76%	0.76	68%	0.68	S	S	*	*				-154.4	-176.3	52.6	38.1	-15.2	0	0	0	115.9
316	S	42.4	Very low	51.5	Low	118 Å²	118	121.2 Å²	121.2	83%	0.825	70%	0.701	S	S	*	*			trans	108.6	114.9	148.5	74.3	0	0	0	0	118.2
317	S	40.2	Very low	50.5	Low	131 Å²	131	122.1 Å²	122.1	92%	0.916	71%	0.707	S	S	*	*			trans	106.7	109.6	160.3	-158.8	0	0	0	0	113.9
318	G	38.1	Very low	49.8	Very low	57 Å²	57	123.7 Å²	123.7	59%	0.588	71%	0.712	S	S	*	*			cis	148.7	119.2	6.7	0	0	0	0	0	107.5
319	L	41.2	Very low	49.7	Very low	179 Å²	179	123.3 Å²	123.3	94%	0.937	72%	0.718	S	S	*	*			trans	64.5	133.1	158.3	-51.8	162.6	0	0	0	114.7
320	S	40.6	Very low	49.9	Very low	108 Å²	108	119.5 Å²	119.5	76%	0.755	71%	0.708	S	S	*	*			cis	-170.1	163.9	25.8	40.1	0	0	0	0	108.2
321	P	41.2	Very low	50.4	Low	121 Å²	121	116.8 Å²	116.8	79%	0.786	70%	0.703	S	S	*	*			trans	-97.6	117.4	-158.3	33.6	-26.5	0	0	0	113.1
322	T	36.7	Very low	51.2	Low	129 Å²	129	113.8 Å²	113.8	79%	0.791	69%	0.687	S	S	*	*			trans	-163.2	133.2	159.8	-25.3	0	0	0	0	112.1
323	H	43	Very low	52.4	Low	175 Å²	175	113.1 Å²	113.1	81%	0.81	67%	0.673	S	S	*	*			trans	77.1	107.3	161.7	-102.5	-79.6	0	0	0	120.6
324	V	39.8	Very low	54.1	Low	130 Å²	130	113.1 Å²	113.1	79%	0.788	66%	0.664	S	S	*	*			trans	-62	134.5	160.9	179.5	0	0	0	0	110.4
325	P	45.1	Very low	56	Low	89 Å²	89	113.8 Å²	113.8	58%	0.578	66%	0.656	S	S	*	*			trans	-112	129.3	156.1	28	-13.1	0	0	0	110.6	S327 H328	P325-S327 PolarHBondContact O-N 3.43Å; P325-H328 PolarHBondContact O-N 3.32Å
326	E	53.2	Low	58.1	Low	158 Å²	158	113.5 Å²	113.5	74%	0.738	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	-10.6	177.2	-71.3	171.3	132.3	0	0	115	H328 S329 Q330	E326-H328 PolarHBondContact O-N 3.48Å; E326-S329 PolarHBondContact O-N 3.24Å; E326-Q330 PolarHBondContact O-N 3.06Å
327	S	58.1	Low	60.4	Low	80 Å²	80	114.6 Å²	114.6	56%	0.559	63%	0.631	S	S	*	*	H	α-helix	trans	-68.7	-25.9	179.4	-49.2	0	0	0	0	114.9	P325 C331	P325-S327 PolarHBondContact O-N 3.43Å; S327-C331 WeakPolarHBondContact O-CB 3.34Å; S327-C331 PolarHBondContact O-N 2.88Å; S327-C331 VanDerWaalsContact O-N 3.11Å
328	H	61.6	Low	62.7	Low	133 Å²	133	115.9 Å²	115.9	62%	0.616	62%	0.616	S	S	*	*	H	α-helix	trans	-76.6	-36.5	176.6	-163.2	63.3	0	0	0	111.9	P325 E326 C331 I332	P325-H328 PolarHBondContact O-N 3.32Å; E326-H328 PolarHBondContact O-N 3.48Å; H328-C331 PolarHBondContact O-N 3.48Å; H328-I332 WeakPolarHBondContact O-CG1 3.45Å; H328-I332 PolarHBondContact O-N 3Å; H328-I332 VanDerWaalsContact O-N 3.08Å
329	S	65.7	Low	65.2	Low	82 Å²	82	120.5 Å²	120.5	57%	0.573	62%	0.615	S	S	*	*	H	α-helix	trans	-62.9	-47.1	173.5	-173	0	0	0	0	110.9	E326 C331 I332 E333	E326-S329 PolarHBondContact O-N 3.24Å; S329-C331 VanDerWaalsContact C-N 3.31Å; S329-C331 PolarHBondContact O-N 3.23Å; S329-I332 PolarHBondContact O-N 3.33Å; S329-E333 WeakPolarHBondContact O-CB 3.24Å; S329-E333 PolarHBondContact O-N 3.37Å
330	Q	73.9	Confident	67.6	Low	123 Å²	123	117 Å²	117	58%	0.575	60%	0.597	S	S	*	*	H	α-helix	trans	-61.3	-36.8	175.6	-72.6	-179.8	-1.6	0	0	112.9	E326 E333 E334	E326-Q330 PolarHBondContact O-N 3.06Å; Q330-E333 PolarHBondContact O-N 3.14Å; Q330-E334 WeakPolarHBondContact O-CB 3.4Å; Q330-E334 PolarHBondContact O-N 3.4Å
331	C	78.9	Confident	70.1	Confident	69 Å²	69	114.9 Å²	114.9	47%	0.466	59%	0.586	S	S	.	*	H	α-helix	trans	-66.5	-38.9	176.4	-171.5	0	0	0	0	112.4	S327 H328 S329 R335	S327-C331 WeakPolarHBondContact O-CB 3.34Å; S327-C331 PolarHBondContact O-N 2.88Å; S327-C331 VanDerWaalsContact O-N 3.11Å; H328-C331 PolarHBondContact O-N 3.48Å; S329-C331 VanDerWaalsContact C-N 3.31Å; S329-C331 PolarHBondContact O-N 3.23Å; C331-R335 VanDerWaalsContact O-CB 3.31Å; C331-R335 WeakPolarHBondContact O-CB 3.24Å; C331-R335 PolarHBondContact O-N 3.45Å
332	I	80.2	Confident	72.5	Confident	76 Å²	76	114.6 Å²	114.6	39%	0.39	57%	0.574	S	S	.	*	H	α-helix	trans	-67.5	-45.2	174.9	-67.1	168	0	0	0	110.2	H328 S329 R335 Q336	H328-I332 WeakPolarHBondContact O-CG1 3.45Å; H328-I332 PolarHBondContact O-N 3Å; H328-I332 VanDerWaalsContact O-N 3.08Å; S329-I332 PolarHBondContact O-N 3.33Å; I332-R335 WeakPolarHBondContact O-CB 3.34Å; I332-R335 PolarHBondContact O-N 3.26Å; I332-Q336 HydrophobicContact CG2-CG 4.5Å; I332-Q336 WeakPolarHBondContact O-CG 3.1Å; I332-Q336 PolarHBondContact O-N 2.89Å
333	E	83.4	Confident	75.2	Confident	82 Å²	82	113.2 Å²	113.2	38%	0.383	56%	0.561	S	S	.	*	H	α-helix	trans	-62.2	-45.4	178.8	-164.2	-171.7	163.7	0	0	111.3	S329 Q330 R335 Q336 R337	S329-E333 WeakPolarHBondContact O-CB 3.24Å; S329-E333 PolarHBondContact O-N 3.37Å; Q330-E333 PolarHBondContact O-N 3.14Å; E333-R335 VanDerWaalsContact C-N 3.34Å; E333-R335 PolarHBondContact O-N 3.11Å; E333-Q336 CarbonylContact O-C 3.6Å; E333-Q336 WeakPolarHBondContact O-CB 3.39Å; E333-Q336 PolarHBondContact O-N 3.1Å; E333-Q336 VanDerWaalsContact O-N 3.12Å; E333-R337 WeakPolarHBondContact O-CG 3.23Å; E333-R337 PolarHBondContact O-N 3.27Å; E333-R337 IonicContact OE1-CZ 2.73Å; E333-R337 IonicContact OE1-NE 2.94Å; E333-R337 PolarHBondContact OE1-NE 3.06Å; E333-R337 IonicContact OE1-NH2 3.53Å; E333-R337 PolarHBondContact OE1-NH2 2.93Å
334	E	84	Confident	77.5	Confident	79 Å²	79	109.5 Å²	109.5	37%	0.369	55%	0.551	S	S	.	*	H	α-helix	trans	-63.3	-39.3	176.3	179.8	57.9	-159.8	0	0	111.6	Q330 Q336 R337 R338	Q330-E334 WeakPolarHBondContact O-CB 3.4Å; Q330-E334 PolarHBondContact O-N 3.4Å; E334-Q336 VanDerWaalsContact C-N 3.33Å; E334-Q336 PolarHBondContact O-N 3.4Å; E334-R337 PolarHBondContact O-N 2.9Å; E334-R338 WeakPolarHBondContact O-CG 3.02Å; E334-R338 PolarHBondContact O-N 3.17Å; E334-R338 IonicContact OE1-CZ 3.93Å; E334-R338 IonicContact OE1-NE 3.35Å; E334-R338 PolarHBondContact OE1-NE 3.46Å; E334-R338 IonicContact OE1-NH2 3.64Å; E334-R338 PolarHBondContact OE1-NH2 2.92Å
335	R	84.4	Confident	80	Confident	154 Å²	154	108.2 Å²	108.2	58%	0.581	54%	0.536	S	S	*	.	H	α-helix	trans	-63.1	-39.9	172.7	-177.5	-175.9	-71	-167.1	-2.9	111.6	C331 I332 E333 R339	C331-R335 VanDerWaalsContact O-CB 3.31Å; C331-R335 WeakPolarHBondContact O-CB 3.24Å; C331-R335 PolarHBondContact O-N 3.45Å; I332-R335 WeakPolarHBondContact O-CB 3.34Å; I332-R335 PolarHBondContact O-N 3.26Å; E333-R335 VanDerWaalsContact C-N 3.34Å; E333-R335 PolarHBondContact O-N 3.11Å; R335-R339 WeakPolarHBondContact O-CG 3.47Å; R335-R339 PolarHBondContact O-N 3.48Å; R335-R339 VanDerWaalsContact O-N 3.11Å
336	Q	89.3	Confident	82.3	Confident	110 Å²	110	110.4 Å²	110.4	51%	0.514	53%	0.534	S	S	.	.	H	α-helix	trans	-67.5	-42.7	175.6	-73.5	176.6	-7.9	0	0	111.4	I332 E333 E334 R338 R339 L340	I332-Q336 HydrophobicContact CG2-CG 4.5Å; I332-Q336 WeakPolarHBondContact O-CG 3.1Å; I332-Q336 PolarHBondContact O-N 2.89Å; E333-Q336 CarbonylContact O-C 3.6Å; E333-Q336 WeakPolarHBondContact O-CB 3.39Å; E333-Q336 PolarHBondContact O-N 3.1Å; E333-Q336 VanDerWaalsContact O-N 3.12Å; E334-Q336 VanDerWaalsContact C-N 3.33Å; E334-Q336 PolarHBondContact O-N 3.4Å; Q336-R338 PolarHBondContact O-N 3.47Å; Q336-R339 PolarHBondContact O-N 3.41Å; Q336-L340 WeakPolarHBondContact O-CG 3.47Å; Q336-L340 PolarHBondContact O-N 2.73Å
337	R	89.2	Confident	84.2	Confident	142 Å²	142	107.5 Å²	107.5	54%	0.536	52%	0.523	S	S	.	.	H	α-helix	trans	-58.2	-44.5	174.2	-73.9	178.6	-174.4	179.4	0.6	111.9	E333 E334 R339 L340 A341	E333-R337 WeakPolarHBondContact O-CG 3.23Å; E333-R337 PolarHBondContact O-N 3.27Å; E333-R337 IonicContact OE1-CZ 2.73Å; E333-R337 IonicContact OE1-NE 2.94Å; E333-R337 PolarHBondContact OE1-NE 3.06Å; E333-R337 IonicContact OE1-NH2 3.53Å; E333-R337 PolarHBondContact OE1-NH2 2.93Å; E334-R337 PolarHBondContact O-N 2.9Å; R337-R339 PolarHBondContact O-N 2.92Å; R337-L340 PolarHBondContact O-N 2.84Å; R337-A341 WeakPolarHBondContact O-CB 3.41Å; R337-A341 PolarHBondContact O-N 3.22Å
338	R	89.5	Confident	85.9	Confident	157 Å²	157	112.1 Å²	112.1	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-63.5	-40.5	175.6	-70.8	179.7	-167.7	-169	2.6	112.8	E334 Q336 A341 Q342	E334-R338 WeakPolarHBondContact O-CG 3.02Å; E334-R338 PolarHBondContact O-N 3.17Å; E334-R338 IonicContact OE1-CZ 3.93Å; E334-R338 IonicContact OE1-NE 3.35Å; E334-R338 PolarHBondContact OE1-NE 3.46Å; E334-R338 IonicContact OE1-NH2 3.64Å; E334-R338 PolarHBondContact OE1-NH2 2.92Å; Q336-R338 PolarHBondContact O-N 3.47Å; R338-A341 PolarHBondContact O-N 3.32Å; R338-Q342 WeakPolarHBondContact O-CG 3.5Å; R338-Q342 PolarHBondContact O-N 3.2Å
339	R	89.3	Confident	87.5	Confident	154 Å²	154	110 Å²	110	58%	0.581	52%	0.518	S	S	*	.	H	α-helix	trans	-64.7	-43.7	175	-75.7	177.9	178.8	-178.9	-0.9	111.9	R335 Q336 R337 Q342 L343	R335-R339 WeakPolarHBondContact O-CG 3.47Å; R335-R339 PolarHBondContact O-N 3.48Å; R335-R339 VanDerWaalsContact O-N 3.11Å; Q336-R339 PolarHBondContact O-N 3.41Å; R337-R339 PolarHBondContact O-N 2.92Å; R339-Q342 PolarHBondContact O-N 2.99Å; R339-L343 WeakPolarHBondContact O-CG 3.31Å; R339-L343 PolarHBondContact O-N 3.28Å
340	L	93	Very high	88.8	Confident	107 Å²	107	109.6 Å²	109.6	56%	0.56	51%	0.509	S	S	*	.	H	α-helix	trans	-63.7	-42.8	175.5	-71.8	171.7	0	0	0	111.4	Q336 R337 Q342 L343 V344	Q336-L340 WeakPolarHBondContact O-CG 3.47Å; Q336-L340 PolarHBondContact O-N 2.73Å; R337-L340 PolarHBondContact O-N 2.84Å; L340-Q342 VanDerWaalsContact C-N 3.29Å; L340-Q342 PolarHBondContact O-N 2.91Å; L340-L343 PolarHBondContact O-N 3.41Å; L340-V344 VanDerWaalsContact O-CG2 3.32Å; L340-V344 WeakPolarHBondContact O-CG2 3.4Å; L340-V344 PolarHBondContact O-N 3.27Å
341	A	92.8	Very high	89.7	Confident	62 Å²	62	108.4 Å²	108.4	51%	0.512	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-39.2	175.2	0	0	0	0	0	112	R337 R338 H345	R337-A341 WeakPolarHBondContact O-CB 3.41Å; R337-A341 PolarHBondContact O-N 3.22Å; R338-A341 PolarHBondContact O-N 3.32Å; A341-H345 VanDerWaalsContact O-CB 3.3Å; A341-H345 WeakPolarHBondContact O-CB 3.45Å; A341-H345 PolarHBondContact O-N 2.98Å
342	Q	91.9	Very high	90.4	Very high	115 Å²	115	109.2 Å²	109.2	54%	0.537	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-44.5	173.1	-75.1	174.7	-5.6	0	0	112.1	R338 R339 L340 H345 Y346	R338-Q342 WeakPolarHBondContact O-CG 3.5Å; R338-Q342 PolarHBondContact O-N 3.2Å; R339-Q342 PolarHBondContact O-N 2.99Å; L340-Q342 VanDerWaalsContact C-N 3.29Å; L340-Q342 PolarHBondContact O-N 2.91Å; Q342-H345 WeakPolarHBondContact O-CB 3.36Å; Q342-H345 PolarHBondContact O-N 3.38Å; Q342-Y346 HydrophobicContact CB-CE2 4.44Å; Q342-Y346 WeakPolarHBondContact O-CD2 3.44Å; Q342-Y346 PolarHBondContact O-N 3.43Å
343	L	92.3	Very high	91.1	Very high	100 Å²	100	109.7 Å²	109.7	52%	0.524	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-46.9	176.2	-72.7	172	0	0	0	111.6	R339 L340 H345 Y346 D347	R339-L343 WeakPolarHBondContact O-CG 3.31Å; R339-L343 PolarHBondContact O-N 3.28Å; L340-L343 PolarHBondContact O-N 3.41Å; L343-H345 VanDerWaalsContact C-N 3.27Å; L343-H345 PolarHBondContact O-N 3.15Å; L343-Y346 CarbonylContact O-C 3.6Å; L343-Y346 PolarHBondContact O-N 2.93Å; L343-Y346 VanDerWaalsContact O-N 3.14Å; L343-D347 WeakPolarHBondContact O-CB 3.42Å; L343-D347 PolarHBondContact O-N 3.05Å
344	V	92.5	Very high	91.6	Very high	98 Å²	98	112.6 Å²	112.6	59%	0.594	51%	0.514	S	S	*	.	H	α-helix	trans	-60.1	-38.9	175.5	172	0	0	0	0	111.3	L340 R348	L340-V344 VanDerWaalsContact O-CG2 3.32Å; L340-V344 WeakPolarHBondContact O-CG2 3.4Å; L340-V344 PolarHBondContact O-N 3.27Å; V344-R348 WeakPolarHBondContact O-CB 3.43Å; V344-R348 PolarHBondContact O-N 3.16Å
345	H	92.6	Very high	92.2	Very high	103 Å²	103	114.3 Å²	114.3	48%	0.477	52%	0.522	S	S	.	.	H	α-helix	trans	-66.4	-43.4	175.1	179.5	-94.1	0	0	0	112.1	A341 Q342 L343 R348 Q349	A341-H345 VanDerWaalsContact O-CB 3.3Å; A341-H345 WeakPolarHBondContact O-CB 3.45Å; A341-H345 PolarHBondContact O-N 2.98Å; Q342-H345 WeakPolarHBondContact O-CB 3.36Å; Q342-H345 PolarHBondContact O-N 3.38Å; L343-H345 VanDerWaalsContact C-N 3.27Å; L343-H345 PolarHBondContact O-N 3.15Å; H345-R348 PolarHBondContact O-N 3.41Å; H345-Q349 PolarHBondContact CE1-NE2 3.06Å; H345-Q349 WeakPolarHBondContact O-CG 3.4Å; H345-Q349 PolarHBondContact O-N 2.83Å
346	Y	93.3	Very high	92.7	Very high	134 Å²	134	113 Å²	113	53%	0.525	52%	0.522	S	S	.	.	H	α-helix	trans	-64	-42.7	174.4	-77.5	-60.3	0	0	0	112	Q342 L343 R348 Q349 I350	Q342-Y346 HydrophobicContact CB-CE2 4.44Å; Q342-Y346 WeakPolarHBondContact O-CD2 3.44Å; Q342-Y346 PolarHBondContact O-N 3.43Å; L343-Y346 CarbonylContact O-C 3.6Å; L343-Y346 PolarHBondContact O-N 2.93Å; L343-Y346 VanDerWaalsContact O-N 3.14Å; Y346-R348 VanDerWaalsContact C-N 3.33Å; Y346-R348 PolarHBondContact O-N 2.91Å; Y346-Q349 WeakPolarHBondContact O-CB 3.27Å; Y346-Q349 PolarHBondContact O-N 2.91Å; Y346-Q349 VanDerWaalsContact O-N 3.15Å; Y346-I350 VanDerWaalsContact O-CG1 3.27Å; Y346-I350 WeakPolarHBondContact O-CG1 3.43Å; Y346-I350 PolarHBondContact O-N 2.86Å
347	D	92.9	Very high	92.9	Very high	97 Å²	97	115.5 Å²	115.5	52%	0.519	53%	0.527	S	S	.	.	H	α-helix	trans	-61.5	-42.3	175.2	-74.1	-21.5	0	0	0	111	L343 Q349 I350 E351	L343-D347 WeakPolarHBondContact O-CB 3.42Å; L343-D347 PolarHBondContact O-N 3.05Å; D347-Q349 VanDerWaalsContact C-N 3.35Å; D347-Q349 PolarHBondContact O-N 3.48Å; D347-I350 PolarHBondContact O-N 3.09Å; D347-E351 PolarHBondContact O-N 3.14Å
348	R	93.9	Very high	93.2	Very high	178 Å²	178	111 Å²	111	67%	0.672	52%	0.52	S	S	*	.	H	α-helix	trans	-62.7	-40	173.5	-173	177.9	-177.9	-179	0.6	112.2	V344 H345 Y346 E351 N352	V344-R348 WeakPolarHBondContact O-CB 3.43Å; V344-R348 PolarHBondContact O-N 3.16Å; H345-R348 PolarHBondContact O-N 3.41Å; Y346-R348 VanDerWaalsContact C-N 3.33Å; Y346-R348 PolarHBondContact O-N 2.91Å; R348-E351 PolarHBondContact O-N 3.36Å; R348-N352 WeakPolarHBondContact O-CB 3.44Å; R348-N352 PolarHBondContact O-N 2.96Å; R348-N352 PolarHBondContact O-ND2 3.4Å
349	Q	93.8	Very high	93.4	Very high	87 Å²	87	108.1 Å²	108.1	41%	0.407	52%	0.517	S	S	.	.	H	α-helix	trans	-65.1	-41.5	174.3	-75.4	-172.9	-9.3	0	0	111.9	H345 Y346 D347 E351 N352 L353	H345-Q349 PolarHBondContact CE1-NE2 3.06Å; H345-Q349 WeakPolarHBondContact O-CG 3.4Å; H345-Q349 PolarHBondContact O-N 2.83Å; Y346-Q349 WeakPolarHBondContact O-CB 3.27Å; Y346-Q349 PolarHBondContact O-N 2.91Å; Y346-Q349 VanDerWaalsContact O-N 3.15Å; D347-Q349 VanDerWaalsContact C-N 3.35Å; D347-Q349 PolarHBondContact O-N 3.48Å; Q349-E351 VanDerWaalsContact C-N 3.35Å; Q349-N352 PolarHBondContact O-N 3.44Å; Q349-L353 WeakPolarHBondContact O-CG 3.44Å; Q349-L353 PolarHBondContact O-N 2.93Å
350	I	93.7	Very high	93.7	Very high	75 Å²	75	105 Å²	105	39%	0.385	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-44	175.9	-69.5	165.3	0	0	0	110.1	Y346 D347 L353 R354	Y346-I350 VanDerWaalsContact O-CG1 3.27Å; Y346-I350 WeakPolarHBondContact O-CG1 3.43Å; Y346-I350 PolarHBondContact O-N 2.86Å; D347-I350 PolarHBondContact O-N 3.09Å; I350-L353 PolarHBondContact O-N 3.44Å; I350-R354 WeakPolarHBondContact O-CG 3.36Å; I350-R354 PolarHBondContact O-N 3.12Å
351	E	93	Very high	93.8	Very high	97 Å²	97	103.3 Å²	103.3	45%	0.453	50%	0.503	S	S	.	.	H	α-helix	trans	-66.8	-40	177	-75.5	-52.5	152.8	0	0	113	D347 R348 Q349 L353 R354 Q355	D347-E351 PolarHBondContact O-N 3.14Å; R348-E351 PolarHBondContact O-N 3.36Å; Q349-E351 VanDerWaalsContact C-N 3.35Å; E351-L353 VanDerWaalsContact C-N 3.3Å; E351-L353 PolarHBondContact O-N 3.17Å; E351-R354 PolarHBondContact O-N 3.28Å; E351-R354 IonicContact OE1-CZ 3.02Å; E351-R354 IonicContact OE1-NH1 3.54Å; E351-R354 PolarHBondContact OE1-NH1 3.33Å; E351-R354 WeakPolarHBondContact OE2-CD 3.37Å; E351-Q355 WeakPolarHBondContact O-CB 3.44Å; E351-Q355 PolarHBondContact O-N 3.43Å
352	N	93.5	Very high	93.9	Very high	87 Å²	87	104.2 Å²	104.2	47%	0.465	50%	0.502	S	S	.	.	H	α-helix	trans	-59.2	-41.5	172.3	-72.2	-16.9	0	0	0	111.6	R348 Q349 Q355 Q356	R348-N352 WeakPolarHBondContact O-CB 3.44Å; R348-N352 PolarHBondContact O-N 2.96Å; R348-N352 PolarHBondContact O-ND2 3.4Å; Q349-N352 PolarHBondContact O-N 3.44Å; N352-Q355 PolarHBondContact O-N 3.32Å; N352-Q356 WeakPolarHBondContact O-CB 3.48Å; N352-Q356 PolarHBondContact O-N 2.98Å
353	L	94.7	Very high	94.1	Very high	85 Å²	85	103 Å²	103	45%	0.445	50%	0.496	S	S	.	.	H	α-helix	trans	-67.6	-38.9	176.2	-72.6	170.7	0	0	0	112.3	Q349 I350 E351 Q356 R357	Q349-L353 WeakPolarHBondContact O-CG 3.44Å; Q349-L353 PolarHBondContact O-N 2.93Å; I350-L353 PolarHBondContact O-N 3.44Å; E351-L353 VanDerWaalsContact C-N 3.3Å; E351-L353 PolarHBondContact O-N 3.17Å; L353-Q356 PolarHBondContact O-N 3.43Å; L353-R357 VanDerWaalsContact O-CG 3.3Å; L353-R357 WeakPolarHBondContact O-CG 3.45Å; L353-R357 PolarHBondContact O-N 3.25Å
354	R	94.8	Very high	94.2	Very high	143 Å²	143	103.8 Å²	103.8	54%	0.54	49%	0.492	S	S	.	.	H	α-helix	trans	-62.7	-46.2	173.8	-74.8	173.9	176.5	177	-1.1	111	I350 E351 R357 A358	I350-R354 WeakPolarHBondContact O-CG 3.36Å; I350-R354 PolarHBondContact O-N 3.12Å; E351-R354 PolarHBondContact O-N 3.28Å; E351-R354 IonicContact OE1-CZ 3.02Å; E351-R354 IonicContact OE1-NH1 3.54Å; E351-R354 PolarHBondContact OE1-NH1 3.33Å; E351-R354 WeakPolarHBondContact OE2-CD 3.37Å; R354-R357 PolarHBondContact O-N 2.94Å; R354-A358 WeakPolarHBondContact O-CB 3.49Å; R354-A358 PolarHBondContact O-N 3.2Å
355	Q	95.1	Very high	94.3	Very high	115 Å²	115	107.3 Å²	107.3	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-64	-41.3	177	-168.7	176.5	15.1	0	0	111.6	E351 N352 R357 A358 N359	E351-Q355 WeakPolarHBondContact O-CB 3.44Å; E351-Q355 PolarHBondContact O-N 3.43Å; N352-Q355 PolarHBondContact O-N 3.32Å; Q355-R357 PolarHBondContact O-N 3.14Å; Q355-A358 PolarHBondContact O-N 3.45Å; Q355-N359 WeakPolarHBondContact O-CB 3.45Å; Q355-N359 PolarHBondContact O-N 2.88Å
356	Q	94.7	Very high	94.5	Very high	127 Å²	127	107.2 Å²	107.2	59%	0.593	50%	0.497	S	S	*	.	H	α-helix	trans	-61	-45.5	175.3	-173.2	179	1.5	0	0	111.5	N352 L353 A358 N359 E360	N352-Q356 WeakPolarHBondContact O-CB 3.48Å; N352-Q356 PolarHBondContact O-N 2.98Å; L353-Q356 PolarHBondContact O-N 3.43Å; Q356-A358 VanDerWaalsContact C-N 3.35Å; Q356-A358 PolarHBondContact O-N 3.47Å; Q356-N359 PolarHBondContact O-N 2.79Å; Q356-E360 WeakPolarHBondContact O-CB 3.49Å; Q356-E360 PolarHBondContact O-N 3.1Å
357	R	95.4	Very high	94.6	Very high	162 Å²	162	107 Å²	107	61%	0.611	50%	0.495	S	S	*	.	H	α-helix	trans	-63	-39.7	175.6	-70.9	175.4	-167.8	169.3	4.9	112.1	L353 R354 Q355 E360 T361	L353-R357 VanDerWaalsContact O-CG 3.3Å; L353-R357 WeakPolarHBondContact O-CG 3.45Å; L353-R357 PolarHBondContact O-N 3.25Å; R354-R357 PolarHBondContact O-N 2.94Å; Q355-R357 PolarHBondContact O-N 3.14Å; R357-E360 PolarHBondContact O-N 2.86Å; R357-T361 WeakPolarHBondContact O-CG2 3.39Å; R357-T361 PolarHBondContact O-N 3.38Å; R357-T361 PolarHBondContact O-OG1 2.93Å
358	A	94.5	Very high	94.7	Very high	47 Å²	47	103.8 Å²	103.8	39%	0.388	49%	0.485	S	S	.	.	H	α-helix	trans	-67.2	-40	176.7	0	0	0	0	0	112.3	R354 Q355 Q356 E360 T361 V362	R354-A358 WeakPolarHBondContact O-CB 3.49Å; R354-A358 PolarHBondContact O-N 3.2Å; Q355-A358 PolarHBondContact O-N 3.45Å; Q356-A358 VanDerWaalsContact C-N 3.35Å; Q356-A358 PolarHBondContact O-N 3.47Å; A358-E360 VanDerWaalsContact C-N 3.35Å; A358-T361 PolarHBondContact O-N 3.27Å; A358-T361 PolarHBondContact O-OG1 3.36Å; A358-V362 WeakPolarHBondContact O-CG2 3.39Å; A358-V362 PolarHBondContact O-N 2.87Å; A358-V362 VanDerWaalsContact O-N 3.14Å
359	N	94.7	Very high	94.8	Very high	98 Å²	98	99.5 Å²	99.5	52%	0.524	47%	0.472	S	S	.	.	H	α-helix	trans	-65.8	-40.5	174.4	-70.2	-13.5	0	0	0	111	Q355 Q356 T361 V362 E363	Q355-N359 WeakPolarHBondContact O-CB 3.45Å; Q355-N359 PolarHBondContact O-N 2.88Å; Q356-N359 PolarHBondContact O-N 2.79Å; N359-T361 PolarHBondContact O-N 2.94Å; N359-V362 PolarHBondContact O-N 2.83Å; N359-E363 WeakPolarHBondContact O-CB 3.44Å; N359-E363 PolarHBondContact O-N 2.81Å
360	E	95.1	Very high	94.9	Very high	89 Å²	89	98.1 Å²	98.1	42%	0.416	48%	0.475	S	S	.	.	H	α-helix	trans	-66	-36.9	178.5	-158.5	-154.9	133.8	0	0	112.3	Q356 R357 A358 E363 R364	Q356-E360 WeakPolarHBondContact O-CB 3.49Å; Q356-E360 PolarHBondContact O-N 3.1Å; R357-E360 PolarHBondContact O-N 2.86Å; A358-E360 VanDerWaalsContact C-N 3.35Å; E360-E363 PolarHBondContact O-N 2.93Å; E360-R364 WeakPolarHBondContact O-CB 3.15Å; E360-R364 VanDerWaalsContact O-CG 3.31Å; E360-R364 WeakPolarHBondContact O-CG 3.27Å; E360-R364 PolarHBondContact O-N 2.93Å; E360-R364 IonicContact OE1-CZ 3.5Å; E360-R364 VanDerWaalsContact OE1-CZ 3.32Å; E360-R364 IonicContact OE1-NE 3.35Å; E360-R364 PolarHBondContact OE1-NE 3.26Å; E360-R364 IonicContact OE1-NH2 2.66Å; E360-R364 PolarHBondContact OE1-NH2 3.36Å; E360-R364 IonicContact OE2-NH2 2.65Å
361	T	95.1	Very high	95	Very high	70 Å²	70	101.9 Å²	101.9	43%	0.429	49%	0.485	S	S	.	.	H	α-helix	trans	-66.9	-41.7	174.6	56.1	0	0	0	0	111.8	R357 A358 N359 R364 R365	R357-T361 WeakPolarHBondContact O-CG2 3.39Å; R357-T361 PolarHBondContact O-N 3.38Å; R357-T361 PolarHBondContact O-OG1 2.93Å; A358-T361 PolarHBondContact O-N 3.27Å; A358-T361 PolarHBondContact O-OG1 3.36Å; N359-T361 PolarHBondContact O-N 2.94Å; T361-R364 PolarHBondContact O-N 3.18Å; T361-R365 PolarHBondContact O-N 2.64Å
362	V	94.7	Very high	95.1	Very high	82 Å²	82	101.2 Å²	101.2	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-62.7	-45.7	174	172.3	0	0	0	0	110.7	A358 N359 R364 R365 I366	A358-V362 WeakPolarHBondContact O-CG2 3.39Å; A358-V362 PolarHBondContact O-N 2.87Å; A358-V362 VanDerWaalsContact O-N 3.14Å; N359-V362 PolarHBondContact O-N 2.83Å; V362-R364 PolarHBondContact O-N 3.49Å; V362-R365 WeakPolarHBondContact O-CB 3.34Å; V362-R365 PolarHBondContact O-N 3.27Å; V362-R365 VanDerWaalsContact O-N 3.16Å; V362-I366 HydrophobicContact CG1-CD1 3.8Å; V362-I366 HydrophobicContact CG1-CG1 4.41Å; V362-I366 WeakPolarHBondContact O-CG1 3.42Å; V362-I366 PolarHBondContact O-N 3.01Å
363	E	94.9	Very high	95.2	Very high	89 Å²	89	103.7 Å²	103.7	42%	0.416	49%	0.488	S	S	.	.	H	α-helix	trans	-63.9	-41.8	178.8	-163.5	-173.4	-178	0	0	111.7	N359 E360 R365 I366 R367	N359-E363 WeakPolarHBondContact O-CB 3.44Å; N359-E363 PolarHBondContact O-N 2.81Å; E360-E363 PolarHBondContact O-N 2.93Å; E363-R365 VanDerWaalsContact C-N 3.3Å; E363-R365 PolarHBondContact O-N 3.41Å; E363-I366 PolarHBondContact O-N 2.91Å; E363-R367 VanDerWaalsContact CD-CZ 3.47Å; E363-R367 HydrophobicContact CG-CG 4.48Å; E363-R367 WeakPolarHBondContact O-CB 3.47Å; E363-R367 VanDerWaalsContact O-CG 3.27Å; E363-R367 WeakPolarHBondContact O-CG 3.41Å; E363-R367 PolarHBondContact O-N 3.46Å; E363-R367 IonicContact OE1-CZ 3.4Å; E363-R367 IonicContact OE1-NE 2.86Å; E363-R367 PolarHBondContact OE1-NE 3.39Å; E363-R367 IonicContact OE1-NH2 2.74Å; E363-R367 PolarHBondContact OE1-NH2 3.04Å; E363-R367 IonicContact OE2-CZ 2.68Å; E363-R367 IonicContact OE2-NH2 3.74Å; E363-R367 PolarHBondContact OE2-NH2 3.2Å
364	R	95.2	Very high	95.3	Very high	116 Å²	116	106.4 Å²	106.4	44%	0.438	50%	0.497	S	S	.	.	H	α-helix	trans	-59.1	-40.7	173.2	-80.1	-173.1	-102.6	110.9	-4.5	111.9	E360 T361 V362 G368	E360-R364 WeakPolarHBondContact O-CB 3.15Å; E360-R364 VanDerWaalsContact O-CG 3.31Å; E360-R364 WeakPolarHBondContact O-CG 3.27Å; E360-R364 PolarHBondContact O-N 2.93Å; E360-R364 IonicContact OE1-CZ 3.5Å; E360-R364 VanDerWaalsContact OE1-CZ 3.32Å; E360-R364 IonicContact OE1-NE 3.35Å; E360-R364 PolarHBondContact OE1-NE 3.26Å; E360-R364 IonicContact OE1-NH2 2.66Å; E360-R364 PolarHBondContact OE1-NH2 3.36Å; E360-R364 IonicContact OE2-NH2 2.65Å; T361-R364 PolarHBondContact O-N 3.18Å; V362-R364 PolarHBondContact O-N 3.49Å; R364-G368 PolarHBondContact O-N 3Å
365	R	95.5	Very high	95.4	Very high	173 Å²	173	105.3 Å²	105.3	65%	0.653	50%	0.496	S	S	*	.	H	α-helix	trans	-64	-49.8	175.2	-177.3	-178.8	172.7	173.9	3.8	111.6	T361 V362 E363 R367 G368 E369	T361-R365 PolarHBondContact O-N 2.64Å; V362-R365 WeakPolarHBondContact O-CB 3.34Å; V362-R365 PolarHBondContact O-N 3.27Å; V362-R365 VanDerWaalsContact O-N 3.16Å; E363-R365 VanDerWaalsContact C-N 3.3Å; E363-R365 PolarHBondContact O-N 3.41Å; R365-R367 VanDerWaalsContact C-N 3.35Å; R365-R367 PolarHBondContact O-N 3.42Å; R365-G368 WeakPolarHBondContact O-CA 3.47Å; R365-G368 PolarHBondContact O-N 3.28Å; R365-E369 WeakPolarHBondContact CG-OE1 3.38Å; R365-E369 IonicContact CZ-OE1 3.56Å; R365-E369 IonicContact NE-OE1 3.67Å; R365-E369 PolarHBondContact NE-OE1 2.93Å; R365-E369 IonicContact NH2-OE1 3.46Å; R365-E369 WeakPolarHBondContact O-CG 3.43Å; R365-E369 PolarHBondContact O-N 3.2Å
366	I	95.2	Very high	95.4	Very high	101 Å²	101	104.6 Å²	104.6	52%	0.518	49%	0.493	S	S	.	.	H	α-helix	trans	-59.8	-44.5	178.4	-66	168.2	0	0	0	110.8	V362 E363 G368 E369 A370	V362-I366 HydrophobicContact CG1-CD1 3.8Å; V362-I366 HydrophobicContact CG1-CG1 4.41Å; V362-I366 WeakPolarHBondContact O-CG1 3.42Å; V362-I366 PolarHBondContact O-N 3.01Å; E363-I366 PolarHBondContact O-N 2.91Å; I366-G368 VanDerWaalsContact C-N 3.28Å; I366-G368 PolarHBondContact O-N 3.18Å; I366-E369 PolarHBondContact O-N 2.93Å; I366-A370 WeakPolarHBondContact O-CB 3.35Å; I366-A370 PolarHBondContact O-N 3.31Å
367	R	95.6	Very high	95.5	Very high	130 Å²	130	103.9 Å²	103.9	49%	0.491	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-32.5	174.8	-69.7	176.3	-171.4	170.8	-0.5	112.3	E363 R365 R371	E363-R367 VanDerWaalsContact CD-CZ 3.47Å; E363-R367 HydrophobicContact CG-CG 4.48Å; E363-R367 WeakPolarHBondContact O-CB 3.47Å; E363-R367 VanDerWaalsContact O-CG 3.27Å; E363-R367 WeakPolarHBondContact O-CG 3.41Å; E363-R367 PolarHBondContact O-N 3.46Å; E363-R367 IonicContact OE1-CZ 3.4Å; E363-R367 IonicContact OE1-NE 2.86Å; E363-R367 PolarHBondContact OE1-NE 3.39Å; E363-R367 IonicContact OE1-NH2 2.74Å; E363-R367 PolarHBondContact OE1-NH2 3.04Å; E363-R367 IonicContact OE2-CZ 2.68Å; E363-R367 IonicContact OE2-NH2 3.74Å; E363-R367 PolarHBondContact OE2-NH2 3.2Å; R365-R367 VanDerWaalsContact C-N 3.35Å; R365-R367 PolarHBondContact O-N 3.42Å; R367-R371 WeakPolarHBondContact O-CG 3.49Å; R367-R371 PolarHBondContact O-N 2.83Å; R367-R371 PolarHBondContact O-NE 3.25Å; R367-R371 VanDerWaalsContact O-NE 3.13Å
368	G	95.6	Very high	95.6	Very high	29 Å²	29	100.5 Å²	100.5	30%	0.299	49%	0.485	S	S	.	.	H	α-helix	trans	-65.9	-51.6	173	0	0	0	0	0	111.8	R364 R365 I366 A370 R371 E372	R364-G368 PolarHBondContact O-N 3Å; R365-G368 WeakPolarHBondContact O-CA 3.47Å; R365-G368 PolarHBondContact O-N 3.28Å; I366-G368 VanDerWaalsContact C-N 3.28Å; I366-G368 PolarHBondContact O-N 3.18Å; G368-A370 VanDerWaalsContact C-N 3.34Å; G368-A370 PolarHBondContact O-N 2.83Å; G368-R371 PolarHBondContact O-N 3.17Å; G368-E372 PolarHBondContact O-N 3.3Å
369	E	96.1	Very high	95.7	Very high	87 Å²	87	104.6 Å²	104.6	41%	0.407	49%	0.491	S	S	.	.	H	α-helix	trans	-61.8	-38.9	177.9	-68.9	175.8	-169.9	0	0	112.1	R365 I366 E372 K373	R365-E369 WeakPolarHBondContact CG-OE1 3.38Å; R365-E369 IonicContact CZ-OE1 3.56Å; R365-E369 IonicContact NE-OE1 3.67Å; R365-E369 PolarHBondContact NE-OE1 2.93Å; R365-E369 IonicContact NH2-OE1 3.46Å; R365-E369 WeakPolarHBondContact O-CG 3.43Å; R365-E369 PolarHBondContact O-N 3.2Å; I366-E369 PolarHBondContact O-N 2.93Å; E369-E372 PolarHBondContact O-N 2.95Å; E369-K373 WeakPolarHBondContact O-CB 3.33Å; E369-K373 WeakPolarHBondContact O-CG 3.49Å; E369-K373 PolarHBondContact O-N 3.29Å
370	A	95	Very high	95.7	Very high	58 Å²	58	102.6 Å²	102.6	48%	0.479	49%	0.488	S	S	.	.	H	α-helix	trans	-64.5	-40	175.2	0	0	0	0	0	112.7	I366 G368 K374	I366-A370 WeakPolarHBondContact O-CB 3.35Å; I366-A370 PolarHBondContact O-N 3.31Å; G368-A370 VanDerWaalsContact C-N 3.34Å; G368-A370 PolarHBondContact O-N 2.83Å; A370-K374 PolarHBondContact O-N 3.24Å; A370-K374 VanDerWaalsContact O-N 3.11Å
371	R	96.4	Very high	95.8	Very high	155 Å²	155	106.9 Å²	106.9	59%	0.585	50%	0.501	S	S	*	.	H	α-helix	trans	-66	-45	174.9	-78.7	-178	-79.8	-179.6	-3	111.4	R367 G368 K374 F375	R367-R371 WeakPolarHBondContact O-CG 3.49Å; R367-R371 PolarHBondContact O-N 2.83Å; R367-R371 PolarHBondContact O-NE 3.25Å; R367-R371 VanDerWaalsContact O-NE 3.13Å; G368-R371 PolarHBondContact O-N 3.17Å; R371-K374 WeakPolarHBondContact O-CB 3.47Å; R371-K374 PolarHBondContact O-N 2.9Å; R371-K374 VanDerWaalsContact O-N 3.15Å; R371-F375 HydrophobicContact CB-CE2 4.29Å; R371-F375 WeakPolarHBondContact O-CD2 3.48Å; R371-F375 PolarHBondContact O-N 2.93Å
372	E	95.4	Very high	95.9	Very high	83 Å²	83	109.7 Å²	109.7	39%	0.388	51%	0.507	S	S	.	.	H	α-helix	trans	-60.6	-46.5	177.8	179.6	53.5	-150.7	0	0	111.4	G368 E369 K374 F375 Q376	G368-E372 PolarHBondContact O-N 3.3Å; E369-E372 PolarHBondContact O-N 2.95Å; E372-K374 VanDerWaalsContact C-N 3.29Å; E372-K374 PolarHBondContact O-N 3.3Å; E372-F375 PolarHBondContact O-N 3.42Å; E372-F375 VanDerWaalsContact O-N 3.11Å; E372-Q376 WeakPolarHBondContact O-CG 3.31Å; E372-Q376 PolarHBondContact O-N 3.22Å; E372-Q376 WeakPolarHBondContact OE1-CG 3.45Å; E372-Q376 PolarHBondContact OE1-NE2 3.36Å
373	K	95.9	Very high	96	Very high	138 Å²	138	112.7 Å²	112.7	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-57.1	-40.9	173.7	-74.2	176.9	-178.7	177.4	0	112.3	E369 Q376 L377	E369-K373 WeakPolarHBondContact O-CB 3.33Å; E369-K373 WeakPolarHBondContact O-CG 3.49Å; E369-K373 PolarHBondContact O-N 3.29Å; K373-Q376 PolarHBondContact O-N 3.15Å; K373-L377 WeakPolarHBondContact O-CG 3.36Å; K373-L377 PolarHBondContact O-N 3.38Å
374	K	95.6	Very high	96	Very high	143 Å²	143	114.8 Å²	114.8	62%	0.622	52%	0.518	S	S	*	.	H	α-helix	trans	-63.3	-45.1	175.2	-176.8	178.9	178.5	-179.8	0	111.6	A370 R371 E372 L377 I378	A370-K374 PolarHBondContact O-N 3.24Å; A370-K374 VanDerWaalsContact O-N 3.11Å; R371-K374 WeakPolarHBondContact O-CB 3.47Å; R371-K374 PolarHBondContact O-N 2.9Å; R371-K374 VanDerWaalsContact O-N 3.15Å; E372-K374 VanDerWaalsContact C-N 3.29Å; E372-K374 PolarHBondContact O-N 3.3Å; K374-L377 PolarHBondContact O-N 3.11Å; K374-I378 HydrophobicContact CG-CD1 4.03Å; K374-I378 VanDerWaalsContact O-CG1 3.3Å; K374-I378 WeakPolarHBondContact O-CG1 3.45Å; K374-I378 PolarHBondContact O-N 3.45Å
375	F	96.6	Very high	96.1	Very high	119 Å²	119	114.2 Å²	114.2	52%	0.522	52%	0.524	S	S	.	.	H	α-helix	trans	-65.3	-38.1	177.2	-72.4	-60.1	0	0	0	112.5	R371 E372 I378 R379	R371-F375 HydrophobicContact CB-CE2 4.29Å; R371-F375 WeakPolarHBondContact O-CD2 3.48Å; R371-F375 PolarHBondContact O-N 2.93Å; E372-F375 PolarHBondContact O-N 3.42Å; E372-F375 VanDerWaalsContact O-N 3.11Å; F375-I378 PolarHBondContact O-N 2.85Å; F375-R379 VanDerWaalsContact O-CB 3.28Å; F375-R379 WeakPolarHBondContact O-CB 3.29Å; F375-R379 PolarHBondContact O-N 3.44Å
376	Q	96.5	Very high	96.1	Very high	101 Å²	101	109.3 Å²	109.3	47%	0.472	51%	0.508	S	S	.	.	H	α-helix	trans	-61.8	-44	173.4	-71.2	177.4	12.5	0	0	111.9	E372 K373 R379 A380	E372-Q376 WeakPolarHBondContact O-CG 3.31Å; E372-Q376 PolarHBondContact O-N 3.22Å; E372-Q376 WeakPolarHBondContact OE1-CG 3.45Å; E372-Q376 PolarHBondContact OE1-NE2 3.36Å; K373-Q376 PolarHBondContact O-N 3.15Å; Q376-R379 PolarHBondContact O-N 3.07Å; Q376-A380 WeakPolarHBondContact O-CB 3.07Å; Q376-A380 PolarHBondContact O-N 3.32Å
377	L	96.5	Very high	96.2	Very high	112 Å²	112	110.3 Å²	110.3	59%	0.586	51%	0.509	S	S	*	.	H	α-helix	trans	-62.9	-42.7	175	-75.1	172.1	0	0	0	112.3	K373 K374 R379 A380 R381	K373-L377 WeakPolarHBondContact O-CG 3.36Å; K373-L377 PolarHBondContact O-N 3.38Å; K374-L377 PolarHBondContact O-N 3.11Å; L377-R379 VanDerWaalsContact C-N 3.34Å; L377-A380 PolarHBondContact O-N 3.17Å; L377-R381 WeakPolarHBondContact O-CB 3.43Å; L377-R381 VanDerWaalsContact O-CG 3.32Å; L377-R381 WeakPolarHBondContact O-CG 3.44Å; L377-R381 PolarHBondContact O-N 3.48Å
378	I	96.4	Very high	96.2	Very high	90 Å²	90	106 Å²	106	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-43.8	176	-68.4	166.1	0	0	0	110.4	K374 F375 R381 K382	K374-I378 HydrophobicContact CG-CD1 4.03Å; K374-I378 VanDerWaalsContact O-CG1 3.3Å; K374-I378 WeakPolarHBondContact O-CG1 3.45Å; K374-I378 PolarHBondContact O-N 3.45Å; F375-I378 PolarHBondContact O-N 2.85Å; I378-R381 PolarHBondContact O-N 3.36Å; I378-K382 WeakPolarHBondContact O-CB 3.34Å; I378-K382 PolarHBondContact O-N 3.01Å
379	R	96.6	Very high	96.3	Very high	133 Å²	133	111.3 Å²	111.3	50%	0.502	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-45	178.2	-168.6	-173.6	-64.9	162.9	1.4	111.5	F375 Q376 L377 K382 Y383	F375-R379 VanDerWaalsContact O-CB 3.28Å; F375-R379 WeakPolarHBondContact O-CB 3.29Å; F375-R379 PolarHBondContact O-N 3.44Å; Q376-R379 PolarHBondContact O-N 3.07Å; L377-R379 VanDerWaalsContact C-N 3.34Å; R379-K382 PolarHBondContact O-N 3.46Å; R379-Y383 HydrophobicContact CG-CD2 3.97Å; R379-Y383 HydrophobicContact CG-CE2 3.42Å; R379-Y383 VanDerWaalsContact CG-CE2 3.42Å; R379-Y383 WeakPolarHBondContact O-CD2 3.3Å; R379-Y383 PolarHBondContact O-N 3.46Å
380	A	96.2	Very high	96.3	Very high	57 Å²	57	111.2 Å²	111.2	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-42.4	176.6	0	0	0	0	0	112.1	Q376 L377 Y383 F384	Q376-A380 WeakPolarHBondContact O-CB 3.07Å; Q376-A380 PolarHBondContact O-N 3.32Å; L377-A380 PolarHBondContact O-N 3.17Å; A380-Y383 PolarHBondContact O-N 3.36Å; A380-F384 WeakPolarHBondContact O-CB 3.24Å; A380-F384 PolarHBondContact O-N 3.1Å
381	R	96.5	Very high	96.3	Very high	179 Å²	179	114.3 Å²	114.3	68%	0.675	51%	0.51	S	S	*	.	H	α-helix	trans	-61.1	-47.4	173.9	-75.5	178.6	-176.7	-137.3	2.1	111.7	L377 I378 Y383 F384 D385	L377-R381 WeakPolarHBondContact O-CB 3.43Å; L377-R381 VanDerWaalsContact O-CG 3.32Å; L377-R381 WeakPolarHBondContact O-CG 3.44Å; L377-R381 PolarHBondContact O-N 3.48Å; I378-R381 PolarHBondContact O-N 3.36Å; R381-Y383 VanDerWaalsContact C-N 3.34Å; R381-Y383 PolarHBondContact O-N 3.49Å; R381-F384 PolarHBondContact O-N 3.41Å; R381-F384 VanDerWaalsContact O-N 3.14Å; R381-D385 PolarHBondContact O-N 3.06Å
382	K	96.6	Very high	96.3	Very high	129 Å²	129	115 Å²	115	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-57.5	-45.4	177.3	-173.8	-178.8	175.2	-176.8	0	111.9	I378 R379 F384 D385 E386	I378-K382 WeakPolarHBondContact O-CB 3.34Å; I378-K382 PolarHBondContact O-N 3.01Å; R379-K382 PolarHBondContact O-N 3.46Å; K382-F384 PolarHBondContact O-N 3.17Å; K382-D385 PolarHBondContact O-N 3.35Å; K382-E386 WeakPolarHBondContact CE-OE1 3.25Å; K382-E386 WeakPolarHBondContact O-CB 3.38Å; K382-E386 WeakPolarHBondContact O-CG 3.43Å; K382-E386 PolarHBondContact O-N 3.41Å
383	Y	96.7	Very high	96.4	Very high	145 Å²	145	115.4 Å²	115.4	57%	0.569	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-39	176.5	-72.3	-50	0	0	0	112.9	R379 A380 R381 F387	R379-Y383 HydrophobicContact CG-CD2 3.97Å; R379-Y383 HydrophobicContact CG-CE2 3.42Å; R379-Y383 VanDerWaalsContact CG-CE2 3.42Å; R379-Y383 WeakPolarHBondContact O-CD2 3.3Å; R379-Y383 PolarHBondContact O-N 3.46Å; A380-Y383 PolarHBondContact O-N 3.36Å; R381-Y383 VanDerWaalsContact C-N 3.34Å; R381-Y383 PolarHBondContact O-N 3.49Å; Y383-F387 VanDerWaalsContact O-CB 3.25Å; Y383-F387 WeakPolarHBondContact O-CB 3.4Å; Y383-F387 PolarHBondContact O-N 3.5Å
384	F	96.9	Very high	96.4	Very high	132 Å²	132	115.7 Å²	115.7	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-65	-45	176.1	-176.6	-97.8	0	0	0	111.5	A380 R381 K382 F387 V388	A380-F384 WeakPolarHBondContact O-CB 3.24Å; A380-F384 PolarHBondContact O-N 3.1Å; R381-F384 PolarHBondContact O-N 3.41Å; R381-F384 VanDerWaalsContact O-N 3.14Å; K382-F384 PolarHBondContact O-N 3.17Å; F384-F387 PolarHBondContact O-N 2.95Å; F384-V388 HydrophobicContact CD1-CG2 4.1Å; F384-V388 HydrophobicContact CE1-CG2 3.71Å; F384-V388 HydrophobicContact CE2-CG2 4.29Å; F384-V388 HydrophobicContact CZ-CG2 3.81Å; F384-V388 VanDerWaalsContact O-CG2 3.32Å; F384-V388 WeakPolarHBondContact O-CG2 3.37Å; F384-V388 PolarHBondContact O-N 2.65Å
385	D	96.4	Very high	96.5	Very high	104 Å²	104	115.5 Å²	115.5	56%	0.556	52%	0.518	S	S	*	.	H	α-helix	trans	-64	-42.7	178.3	-68.8	-22.8	0	0	0	111.7	R381 K382 V388 R389	R381-D385 PolarHBondContact O-N 3.06Å; K382-D385 PolarHBondContact O-N 3.35Å; D385-V388 PolarHBondContact O-N 2.93Å; D385-R389 WeakPolarHBondContact O-CB 3.33Å; D385-R389 PolarHBondContact O-N 3.41Å
386	E	96.4	Very high	96.4	Very high	70 Å²	70	114.5 Å²	114.5	33%	0.327	52%	0.517	S	S	.	.	H	α-helix	trans	-61.7	-45.3	173	-76.2	175.2	-174.9	0	0	111.4	K382 V388 R389 E390	K382-E386 WeakPolarHBondContact CE-OE1 3.25Å; K382-E386 WeakPolarHBondContact O-CB 3.38Å; K382-E386 WeakPolarHBondContact O-CG 3.43Å; K382-E386 PolarHBondContact O-N 3.41Å; E386-V388 PolarHBondContact O-N 2.87Å; E386-R389 PolarHBondContact O-N 3.3Å; E386-E390 WeakPolarHBondContact O-CB 3.31Å; E386-E390 WeakPolarHBondContact O-CG 3.28Å; E386-E390 PolarHBondContact O-N 3.48Å
387	F	96.5	Very high	96.4	Very high	123 Å²	123	112.1 Å²	112.1	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-60.8	-45.3	177	175.4	-97.2	0	0	0	112.1	Y383 F384 R389 E390 F391	Y383-F387 VanDerWaalsContact O-CB 3.25Å; Y383-F387 WeakPolarHBondContact O-CB 3.4Å; Y383-F387 PolarHBondContact O-N 3.5Å; F384-F387 PolarHBondContact O-N 2.95Å; F387-R389 VanDerWaalsContact C-N 3.33Å; F387-R389 PolarHBondContact O-N 2.86Å; F387-E390 PolarHBondContact O-N 2.92Å; F387-F391 VanDerWaalsContact O-CB 3.24Å; F387-F391 WeakPolarHBondContact O-CB 3.47Å; F387-F391 PolarHBondContact O-N 2.97Å
388	V	96.4	Very high	96.4	Very high	38 Å²	38	111.1 Å²	111.1	23%	0.23	51%	0.505	C	S	.	.	H	α-helix	trans	-63.5	-40.7	177.4	170.8	0	0	0	0	110.7	F384 D385 E386 F391 R392	F384-V388 HydrophobicContact CD1-CG2 4.1Å; F384-V388 HydrophobicContact CE1-CG2 3.71Å; F384-V388 HydrophobicContact CE2-CG2 4.29Å; F384-V388 HydrophobicContact CZ-CG2 3.81Å; F384-V388 VanDerWaalsContact O-CG2 3.32Å; F384-V388 WeakPolarHBondContact O-CG2 3.37Å; F384-V388 PolarHBondContact O-N 2.65Å; D385-V388 PolarHBondContact O-N 2.93Å; E386-V388 PolarHBondContact O-N 2.87Å; V388-F391 PolarHBondContact O-N 3.3Å; V388-R392 WeakPolarHBondContact O-CB 3.48Å; V388-R392 VanDerWaalsContact O-CG 3.26Å; V388-R392 WeakPolarHBondContact O-CG 3.38Å; V388-R392 PolarHBondContact O-N 3.21Å
389	R	96	Very high	96.3	Very high	141 Å²	141	110.5 Å²	110.5	53%	0.532	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-50.7	175.9	-173.4	-175	66.2	-164.4	-4.7	111.4	D385 E386 F387 F391 R392 L393	D385-R389 WeakPolarHBondContact O-CB 3.33Å; D385-R389 PolarHBondContact O-N 3.41Å; E386-R389 PolarHBondContact O-N 3.3Å; F387-R389 VanDerWaalsContact C-N 3.33Å; F387-R389 PolarHBondContact O-N 2.86Å; R389-F391 VanDerWaalsContact C-N 3.31Å; R389-F391 PolarHBondContact O-N 2.96Å; R389-R392 PolarHBondContact O-N 2.97Å; R389-L393 HydrophobicContact CG-CD1 4.27Å; R389-L393 WeakPolarHBondContact O-CG 3.47Å; R389-L393 PolarHBondContact O-N 3.03Å
390	E	96.3	Very high	96.2	Very high	85 Å²	85	108.4 Å²	108.4	40%	0.397	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-41.3	177.2	-72.4	-55.6	131.3	0	0	112	E386 F387 L393 K394	E386-E390 WeakPolarHBondContact O-CB 3.31Å; E386-E390 WeakPolarHBondContact O-CG 3.28Å; E386-E390 PolarHBondContact O-N 3.48Å; F387-E390 PolarHBondContact O-N 2.92Å; E390-L393 PolarHBondContact O-N 3.21Å; E390-K394 WeakPolarHBondContact O-CB 3.35Å; E390-K394 WeakPolarHBondContact O-CG 3.4Å; E390-K394 PolarHBondContact O-N 3.45Å
391	F	96.2	Very high	96.2	Very high	124 Å²	124	109.4 Å²	109.4	54%	0.544	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-43.9	176.8	-175	-95.9	0	0	0	111.8	F387 V388 R389 K394 K395	F387-F391 VanDerWaalsContact O-CB 3.24Å; F387-F391 WeakPolarHBondContact O-CB 3.47Å; F387-F391 PolarHBondContact O-N 2.97Å; V388-F391 PolarHBondContact O-N 3.3Å; R389-F391 VanDerWaalsContact C-N 3.31Å; R389-F391 PolarHBondContact O-N 2.96Å; F391-K394 PolarHBondContact O-N 3.45Å; F391-K395 WeakPolarHBondContact O-CB 3.34Å; F391-K395 PolarHBondContact O-N 3.36Å
392	R	96.2	Very high	96.1	Very high	169 Å²	169	103.5 Å²	103.5	64%	0.638	49%	0.486	S	S	*	.	H	α-helix	trans	-62.6	-44.2	174.8	-74.1	175.1	-176.3	-173.2	2.9	111.7	V388 R389 K395 I396	V388-R392 WeakPolarHBondContact O-CB 3.48Å; V388-R392 VanDerWaalsContact O-CG 3.26Å; V388-R392 WeakPolarHBondContact O-CG 3.38Å; V388-R392 PolarHBondContact O-N 3.21Å; R389-R392 PolarHBondContact O-N 2.97Å; R392-K395 PolarHBondContact O-N 2.93Å; R392-I396 WeakPolarHBondContact O-CG1 3.41Å; R392-I396 PolarHBondContact O-N 3.32Å
393	L	96.7	Very high	96.1	Very high	91 Å²	91	101.1 Å²	101.1	48%	0.476	48%	0.477	S	S	.	.	H	α-helix	trans	-61	-45.1	176.5	-71.7	173.6	0	0	0	111.5	R389 E390 K395 I396 A397	R389-L393 HydrophobicContact CG-CD1 4.27Å; R389-L393 WeakPolarHBondContact O-CG 3.47Å; R389-L393 PolarHBondContact O-N 3.03Å; E390-L393 PolarHBondContact O-N 3.21Å; L393-K395 PolarHBondContact O-N 2.99Å; L393-I396 PolarHBondContact O-N 2.99Å; L393-A397 WeakPolarHBondContact O-CB 3.25Å; L393-A397 PolarHBondContact O-N 2.83Å
394	K	97	Very high	96	Very high	144 Å²	144	100.6 Å²	100.6	63%	0.626	48%	0.478	S	S	*	.	H	α-helix	trans	-61.9	-41.1	174.9	-74.6	176.8	-178	179.5	0	112.3	E390 F391 A397 K398	E390-K394 WeakPolarHBondContact O-CB 3.35Å; E390-K394 WeakPolarHBondContact O-CG 3.4Å; E390-K394 PolarHBondContact O-N 3.45Å; F391-K394 PolarHBondContact O-N 3.45Å; K394-A397 PolarHBondContact O-N 3.16Å; K394-K398 WeakPolarHBondContact O-CB 3.35Å; K394-K398 PolarHBondContact O-N 2.96Å
395	K	96.5	Very high	95.9	Very high	140 Å²	140	98.3 Å²	98.3	61%	0.609	47%	0.471	S	S	*	.	H	α-helix	trans	-62.7	-47	176.2	-172.5	177.1	-180	178	0	111.2	F391 R392 L393 K398 V399	F391-K395 WeakPolarHBondContact O-CB 3.34Å; F391-K395 PolarHBondContact O-N 3.36Å; R392-K395 PolarHBondContact O-N 2.93Å; L393-K395 PolarHBondContact O-N 2.99Å; K395-K398 PolarHBondContact O-N 3.46Å; K395-V399 WeakPolarHBondContact O-CG2 3.28Å; K395-V399 PolarHBondContact O-N 3.38Å
396	I	95.9	Very high	95.8	Very high	97 Å²	97	97.8 Å²	97.8	50%	0.497	46%	0.464	S	S	.	.	H	α-helix	trans	-62.6	-43.3	176.5	-67.8	167.1	0	0	0	110.7	R392 L393 K398 V399 N400	R392-I396 WeakPolarHBondContact O-CG1 3.41Å; R392-I396 PolarHBondContact O-N 3.32Å; L393-I396 PolarHBondContact O-N 2.99Å; I396-K398 VanDerWaalsContact C-N 3.34Å; I396-K398 PolarHBondContact O-N 3.05Å; I396-V399 PolarHBondContact O-N 2.95Å; I396-N400 WeakPolarHBondContact O-CB 3.17Å; I396-N400 PolarHBondContact O-N 3.42Å; I396-N400 PolarHBondContact O-OD1 3.43Å
397	A	95.7	Very high	95.8	Very high	51 Å²	51	101.6 Å²	101.6	42%	0.421	48%	0.475	S	S	.	.	H	α-helix	trans	-60.2	-43.6	177.1	0	0	0	0	0	111.9	L393 K394 N400 T401	L393-A397 WeakPolarHBondContact O-CB 3.25Å; L393-A397 PolarHBondContact O-N 2.83Å; K394-A397 PolarHBondContact O-N 3.16Å; A397-N400 PolarHBondContact O-N 2.92Å; A397-T401 WeakPolarHBondContact O-CG2 3.41Å; A397-T401 PolarHBondContact O-N 3.19Å; A397-T401 PolarHBondContact O-OG1 3.44Å
398	K	96	Very high	95.7	Very high	92 Å²	92	100.2 Å²	100.2	40%	0.4	47%	0.471	S	S	.	.	H	α-helix	trans	-61.9	-47	175.3	-173.1	-177.9	178.5	-174.9	0	111.9	M175 K394 K395 I396 N400 T401 D402	M175-K398 PolarHBondContact SD-NZ 3.28Å; K394-K398 WeakPolarHBondContact O-CB 3.35Å; K394-K398 PolarHBondContact O-N 2.96Å; K395-K398 PolarHBondContact O-N 3.46Å; I396-K398 VanDerWaalsContact C-N 3.34Å; I396-K398 PolarHBondContact O-N 3.05Å; K398-N400 VanDerWaalsContact C-N 3.3Å; K398-N400 PolarHBondContact O-N 3.18Å; K398-T401 WeakPolarHBondContact CA-OG1 3.27Å; K398-T401 PolarHBondContact O-N 3.31Å; K398-T401 PolarHBondContact O-OG1 3.12Å; K398-D402 WeakPolarHBondContact O-CB 3.46Å; K398-D402 VanDerWaalsContact O-CG 3.24Å; K398-D402 PolarHBondContact O-N 3.01Å
399	V	94.1	Very high	95.7	Very high	77 Å²	77	102.2 Å²	102.2	47%	0.467	48%	0.476	S	S	.	.	H	α-helix	trans	-59.6	-42.9	176.4	172.1	0	0	0	0	110.8	K395 I396 T401 D402 E403	K395-V399 WeakPolarHBondContact O-CG2 3.28Å; K395-V399 PolarHBondContact O-N 3.38Å; I396-V399 PolarHBondContact O-N 2.95Å; V399-T401 PolarHBondContact O-N 2.98Å; V399-D402 PolarHBondContact O-N 3.36Å; V399-E403 VanDerWaalsContact O-CB 3.28Å; V399-E403 WeakPolarHBondContact O-CB 3.35Å; V399-E403 PolarHBondContact O-N 3.44Å
400	N	95.6	Very high	95.6	Very high	89 Å²	89	101.2 Å²	101.2	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-66.2	-37.5	177.9	-69.9	-9.4	0	0	0	112.7	I396 A397 K398 K404	I396-N400 WeakPolarHBondContact O-CB 3.17Å; I396-N400 PolarHBondContact O-N 3.42Å; I396-N400 PolarHBondContact O-OD1 3.43Å; A397-N400 PolarHBondContact O-N 2.92Å; K398-N400 VanDerWaalsContact C-N 3.3Å; K398-N400 PolarHBondContact O-N 3.18Å; N400-K404 WeakPolarHBondContact O-CB 3.35Å; N400-K404 PolarHBondContact O-N 3.05Å
401	T	95.7	Very high	95.6	Very high	77 Å²	77	103.5 Å²	103.5	47%	0.472	49%	0.487	S	S	.	.	H	α-helix	trans	-67.1	-42.3	174.8	50.6	0	0	0	0	111.4	A397 K398 V399 K404 I405	A397-T401 WeakPolarHBondContact O-CG2 3.41Å; A397-T401 PolarHBondContact O-N 3.19Å; A397-T401 PolarHBondContact O-OG1 3.44Å; K398-T401 WeakPolarHBondContact CA-OG1 3.27Å; K398-T401 PolarHBondContact O-N 3.31Å; K398-T401 PolarHBondContact O-OG1 3.12Å; V399-T401 PolarHBondContact O-N 2.98Å; T401-K404 PolarHBondContact O-N 2.87Å; T401-I405 WeakPolarHBondContact O-CG1 3.4Å; T401-I405 PolarHBondContact O-N 3.23Å
402	D	95.3	Very high	95.6	Very high	55 Å²	55	104 Å²	104	29%	0.294	49%	0.491	S	S	.	.	H	α-helix	trans	-64.4	-46.1	177.3	-67.6	-19.1	0	0	0	110.1	K398 V399 K404 I405 F406	K398-D402 WeakPolarHBondContact O-CB 3.46Å; K398-D402 VanDerWaalsContact O-CG 3.24Å; K398-D402 PolarHBondContact O-N 3.01Å; V399-D402 PolarHBondContact O-N 3.36Å; D402-K404 VanDerWaalsContact C-N 3.31Å; D402-K404 PolarHBondContact O-N 2.98Å; D402-I405 WeakPolarHBondContact O-CB 3.16Å; D402-I405 PolarHBondContact O-N 2.69Å; D402-I405 VanDerWaalsContact O-N 3.12Å; D402-F406 HydrophobicContact CB-CD2 4.44Å; D402-F406 HydrophobicContact CB-CE2 4.2Å; D402-F406 WeakPolarHBondContact O-CD2 3.31Å; D402-F406 PolarHBondContact O-N 3.33Å
403	E	95	Very high	95.5	Very high	79 Å²	79	99.1 Å²	99.1	37%	0.369	48%	0.477	S	S	.	.	H	α-helix	trans	-59.6	-39.2	175.5	-168.1	-172.5	150.6	0	0	112.2	V399 F406 R407	V399-E403 VanDerWaalsContact O-CB 3.28Å; V399-E403 WeakPolarHBondContact O-CB 3.35Å; V399-E403 PolarHBondContact O-N 3.44Å; E403-F406 PolarHBondContact O-N 2.93Å; E403-R407 WeakPolarHBondContact O-CB 3.45Å; E403-R407 VanDerWaalsContact O-CG 3.23Å; E403-R407 WeakPolarHBondContact O-CG 3.46Å; E403-R407 PolarHBondContact O-N 2.93Å; E403-R407 IonicContact OE1-CZ 3.52Å; E403-R407 IonicContact OE1-NE 2.89Å; E403-R407 PolarHBondContact OE1-NE 3.35Å; E403-R407 IonicContact OE1-NH2 3.32Å; E403-R407 PolarHBondContact OE1-NH2 3.31Å
404	K	95.5	Very high	95.5	Very high	134 Å²	134	98.9 Å²	98.9	58%	0.583	48%	0.475	S	S	*	.	H	α-helix	trans	-63.4	-42.7	174.7	-173.5	178.8	179.8	-179.4	0	111.7	N400 T401 D402 R407 Q408	N400-K404 WeakPolarHBondContact O-CB 3.35Å; N400-K404 PolarHBondContact O-N 3.05Å; T401-K404 PolarHBondContact O-N 2.87Å; D402-K404 VanDerWaalsContact C-N 3.31Å; D402-K404 PolarHBondContact O-N 2.98Å; K404-R407 PolarHBondContact O-N 3.17Å; K404-Q408 WeakPolarHBondContact O-CG 3.24Å; K404-Q408 PolarHBondContact O-N 3.41Å
405	I	94.9	Very high	95.4	Very high	85 Å²	85	96.5 Å²	96.5	44%	0.436	47%	0.466	S	S	.	.	H	α-helix	trans	-63.1	-46.3	175.7	-66.6	162.9	0	0	0	110	T401 D402 R407 Q408 F409	T401-I405 WeakPolarHBondContact O-CG1 3.4Å; T401-I405 PolarHBondContact O-N 3.23Å; D402-I405 WeakPolarHBondContact O-CB 3.16Å; D402-I405 PolarHBondContact O-N 2.69Å; D402-I405 VanDerWaalsContact O-N 3.12Å; I405-R407 PolarHBondContact O-N 3.25Å; I405-Q408 PolarHBondContact O-N 2.99Å; I405-F409 WeakPolarHBondContact O-CB 2.99Å; I405-F409 PolarHBondContact O-N 3.44Å
406	F	94.1	Very high	95.4	Very high	92 Å²	92	95 Å²	95	40%	0.404	46%	0.46	S	S	.	.	H	α-helix	trans	-60.6	-45.3	176.6	-73.8	-60.4	0	0	0	111.9	M168 D402 E403 Q408 F409 F410	M168-F406 HydrophobicContact SD-CE1 3.65Å; M168-F406 HydrophobicContact SD-CZ 3.8Å; D402-F406 HydrophobicContact CB-CD2 4.44Å; D402-F406 HydrophobicContact CB-CE2 4.2Å; D402-F406 WeakPolarHBondContact O-CD2 3.31Å; D402-F406 PolarHBondContact O-N 3.33Å; E403-F406 PolarHBondContact O-N 2.93Å; F406-Q408 VanDerWaalsContact C-N 3.33Å; F406-Q408 PolarHBondContact O-N 3.5Å; F406-F409 PolarHBondContact O-N 3.32Å; F406-F410 HydrophobicContact CB-CD2 4.37Å; F406-F410 HydrophobicContact CB-CE2 4.37Å; F406-F410 WeakPolarHBondContact O-CB 3.28Å; F406-F410 WeakPolarHBondContact O-CD2 3.49Å; F406-F410 PolarHBondContact O-N 3.2Å
407	R	95.6	Very high	95.3	Very high	151 Å²	151	97 Å²	97	57%	0.57	47%	0.467	S	S	*	.	H	α-helix	trans	-58.4	-44.2	176.2	-74.8	171.9	-178.3	-79.8	2.4	111.8	E403 K404 I405 Q411	E403-R407 WeakPolarHBondContact O-CB 3.45Å; E403-R407 VanDerWaalsContact O-CG 3.23Å; E403-R407 WeakPolarHBondContact O-CG 3.46Å; E403-R407 PolarHBondContact O-N 2.93Å; E403-R407 IonicContact OE1-CZ 3.52Å; E403-R407 IonicContact OE1-NE 2.89Å; E403-R407 PolarHBondContact OE1-NE 3.35Å; E403-R407 IonicContact OE1-NH2 3.32Å; E403-R407 PolarHBondContact OE1-NH2 3.31Å; K404-R407 PolarHBondContact O-N 3.17Å; I405-R407 PolarHBondContact O-N 3.25Å; R407-Q411 WeakPolarHBondContact O-CB 3.43Å; R407-Q411 VanDerWaalsContact O-CG 3.24Å; R407-Q411 WeakPolarHBondContact O-CG 3.23Å; R407-Q411 PolarHBondContact O-N 2.96Å
408	Q	95.4	Very high	95.3	Very high	94 Å²	94	100.4 Å²	100.4	44%	0.439	47%	0.472	S	S	.	.	H	α-helix	trans	-63.7	-44	175.9	-74	178.6	-23.6	0	0	111.8	K404 I405 F406 Q411 Q412	K404-Q408 WeakPolarHBondContact O-CG 3.24Å; K404-Q408 PolarHBondContact O-N 3.41Å; I405-Q408 PolarHBondContact O-N 2.99Å; F406-Q408 VanDerWaalsContact C-N 3.33Å; F406-Q408 PolarHBondContact O-N 3.5Å; Q408-Q411 PolarHBondContact O-N 2.85Å; Q408-Q412 WeakPolarHBondContact O-CG 3.45Å; Q408-Q412 PolarHBondContact O-N 3.42Å
409	F	95.6	Very high	95.3	Very high	79 Å²	79	101 Å²	101	35%	0.346	48%	0.476	S	S	.	.	H	α-helix	trans	-61.5	-46.5	176.9	-179.7	-104.3	0	0	0	112	I405 F406 Q411 Q412 L413	I405-F409 WeakPolarHBondContact O-CB 2.99Å; I405-F409 PolarHBondContact O-N 3.44Å; F406-F409 PolarHBondContact O-N 3.32Å; F409-Q411 PolarHBondContact O-N 2.72Å; F409-Q412 PolarHBondContact O-N 2.86Å; F409-L413 HydrophobicContact CD1-CD1 3.77Å; F409-L413 HydrophobicContact CD1-CG 4.39Å; F409-L413 HydrophobicContact CE1-CD1 3.33Å; F409-L413 HydrophobicContact CE1-CG 4.09Å; F409-L413 HydrophobicContact CZ-CD1 3.81Å; F409-L413 HydrophobicContact CZ-CD2 4.39Å; F409-L413 HydrophobicContact CZ-CG 4.19Å; F409-L413 WeakPolarHBondContact O-CG 3.48Å; F409-L413 PolarHBondContact O-N 3.43Å
410	F	95.2	Very high	95.4	Very high	121 Å²	121	105.1 Å²	105.1	53%	0.531	49%	0.485	S	S	.	.	H	α-helix	trans	-63.7	-39	175.4	-80	-65.1	0	0	0	112.5	F406 L413 I414	F406-F410 HydrophobicContact CB-CD2 4.37Å; F406-F410 HydrophobicContact CB-CE2 4.37Å; F406-F410 WeakPolarHBondContact O-CB 3.28Å; F406-F410 WeakPolarHBondContact O-CD2 3.49Å; F406-F410 PolarHBondContact O-N 3.2Å; F410-L413 HydrophobicContact CD1-CD1 4.38Å; F410-L413 PolarHBondContact O-N 3.36Å; F410-I414 VanDerWaalsContact O-CG1 3.27Å; F410-I414 WeakPolarHBondContact O-CG1 3.45Å; F410-I414 PolarHBondContact O-N 2.93Å
411	Q	95.8	Very high	95.4	Very high	133 Å²	133	106.8 Å²	106.8	62%	0.621	49%	0.488	S	S	*	.	H	α-helix	trans	-62.1	-43.2	174.1	-77.6	174	-12.9	0	0	111.7	R407 Q408 F409 I414 Q415	R407-Q411 WeakPolarHBondContact O-CB 3.43Å; R407-Q411 VanDerWaalsContact O-CG 3.24Å; R407-Q411 WeakPolarHBondContact O-CG 3.23Å; R407-Q411 PolarHBondContact O-N 2.96Å; Q408-Q411 PolarHBondContact O-N 2.85Å; F409-Q411 PolarHBondContact O-N 2.72Å; Q411-I414 PolarHBondContact O-N 2.66Å; Q411-Q415 WeakPolarHBondContact O-CB 3.49Å; Q411-Q415 PolarHBondContact O-N 2.86Å
412	Q	95.6	Very high	95.4	Very high	134 Å²	134	108.4 Å²	108.4	63%	0.626	49%	0.493	S	S	*	.	H	α-helix	trans	-63.6	-41.7	175	-72.3	174.5	1.2	0	0	112	Q408 F409 Q415 K416	Q408-Q412 WeakPolarHBondContact O-CG 3.45Å; Q408-Q412 PolarHBondContact O-N 3.42Å; F409-Q412 PolarHBondContact O-N 2.86Å; Q412-Q415 PolarHBondContact O-N 3.06Å; Q412-K416 WeakPolarHBondContact O-CB 3.33Å; Q412-K416 PolarHBondContact O-N 3.34Å
413	L	95	Very high	95.5	Very high	66 Å²	66	110.1 Å²	110.1	35%	0.346	50%	0.499	S	S	.	.	H	α-helix	trans	-61.9	-46.1	175.5	-75.9	176.3	0	0	0	112.1	F409 F410 Q415 K416 Q417	F409-L413 HydrophobicContact CD1-CD1 3.77Å; F409-L413 HydrophobicContact CD1-CG 4.39Å; F409-L413 HydrophobicContact CE1-CD1 3.33Å; F409-L413 HydrophobicContact CE1-CG 4.09Å; F409-L413 HydrophobicContact CZ-CD1 3.81Å; F409-L413 HydrophobicContact CZ-CD2 4.39Å; F409-L413 HydrophobicContact CZ-CG 4.19Å; F409-L413 WeakPolarHBondContact O-CG 3.48Å; F409-L413 PolarHBondContact O-N 3.43Å; F410-L413 HydrophobicContact CD1-CD1 4.38Å; F410-L413 PolarHBondContact O-N 3.36Å; L413-Q415 VanDerWaalsContact C-N 3.3Å; L413-Q415 PolarHBondContact O-N 3.5Å; L413-K416 PolarHBondContact O-N 3.34Å; L413-Q417 WeakPolarHBondContact O-CB 3.19Å; L413-Q417 PolarHBondContact O-N 2.77Å
414	I	96.2	Very high	95.5	Very high	87 Å²	87	109.1 Å²	109.1	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-61.7	-41.6	176.6	-69.6	166.6	0	0	0	110.4	F410 Q411 Q417 K418	F410-I414 VanDerWaalsContact O-CG1 3.27Å; F410-I414 WeakPolarHBondContact O-CG1 3.45Å; F410-I414 PolarHBondContact O-N 2.93Å; Q411-I414 PolarHBondContact O-N 2.66Å; I414-Q417 PolarHBondContact O-N 3.46Å; I414-K418 HydrophobicContact CG2-CD 4.4Å; I414-K418 WeakPolarHBondContact O-CG 3.44Å; I414-K418 PolarHBondContact O-N 3.17Å
415	Q	95.4	Very high	95.6	Very high	94 Å²	94	106.9 Å²	106.9	44%	0.439	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-46	177.8	-177.4	57.2	29.1	0	0	111.5	Q411 Q412 L413 Q417 K418 E419	Q411-Q415 WeakPolarHBondContact O-CB 3.49Å; Q411-Q415 PolarHBondContact O-N 2.86Å; Q412-Q415 PolarHBondContact O-N 3.06Å; L413-Q415 VanDerWaalsContact C-N 3.3Å; L413-Q415 PolarHBondContact O-N 3.5Å; Q415-Q417 VanDerWaalsContact C-N 3.32Å; Q415-Q417 PolarHBondContact O-N 3.08Å; Q415-K418 WeakPolarHBondContact O-CB 3.23Å; Q415-K418 PolarHBondContact O-N 2.99Å; Q415-E419 WeakPolarHBondContact CG-OE1 3.22Å; Q415-E419 PolarHBondContact NE2-OE1 3.18Å; Q415-E419 WeakPolarHBondContact O-CG 3.37Å; Q415-E419 PolarHBondContact O-N 3.27Å
416	K	95.5	Very high	95.7	Very high	108 Å²	108	107.2 Å²	107.2	47%	0.47	49%	0.487	S	S	.	.	H	α-helix	trans	-61.3	-38.8	175.2	-171.1	178.8	179.8	-177.9	0	112.2	Q412 L413 E419 Y420	Q412-K416 WeakPolarHBondContact O-CB 3.33Å; Q412-K416 PolarHBondContact O-N 3.34Å; L413-K416 PolarHBondContact O-N 3.34Å; K416-E419 PolarHBondContact O-N 3.29Å; K416-Y420 WeakPolarHBondContact O-CB 3.39Å; K416-Y420 PolarHBondContact O-N 3.23Å
417	Q	93.7	Very high	95.8	Very high	140 Å²	140	107 Å²	107	65%	0.654	49%	0.49	S	S	*	.	H	α-helix	trans	-66.8	-38.1	175.9	-170.8	178.5	10.7	0	0	112	L413 I414 Q415 Y420 F421	L413-Q417 WeakPolarHBondContact O-CB 3.19Å; L413-Q417 PolarHBondContact O-N 2.77Å; I414-Q417 PolarHBondContact O-N 3.46Å; Q415-Q417 VanDerWaalsContact C-N 3.32Å; Q415-Q417 PolarHBondContact O-N 3.08Å; Q417-Y420 PolarHBondContact O-N 2.72Å; Q417-F421 WeakPolarHBondContact O-CB 3.27Å; Q417-F421 PolarHBondContact O-N 2.85Å
418	K	96.6	Very high	95.8	Very high	122 Å²	122	104.8 Å²	104.8	53%	0.53	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-43.4	173.3	-74.1	176.6	178.8	-177.3	0	111.8	I414 Q415 F421 L422	I414-K418 HydrophobicContact CG2-CD 4.4Å; I414-K418 WeakPolarHBondContact O-CG 3.44Å; I414-K418 PolarHBondContact O-N 3.17Å; Q415-K418 WeakPolarHBondContact O-CB 3.23Å; Q415-K418 PolarHBondContact O-N 2.99Å; K418-F421 PolarHBondContact O-N 3.45Å; K418-L422 WeakPolarHBondContact O-CG 3.41Å; K418-L422 PolarHBondContact O-N 2.92Å
419	E	95.5	Very high	95.9	Very high	104 Å²	104	107.9 Å²	107.9	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-60.2	-46.6	175.3	-74.1	163.9	-166.6	0	0	111.1	Q415 K416 F421 L422 E423	Q415-E419 WeakPolarHBondContact CG-OE1 3.22Å; Q415-E419 PolarHBondContact NE2-OE1 3.18Å; Q415-E419 WeakPolarHBondContact O-CG 3.37Å; Q415-E419 PolarHBondContact O-N 3.27Å; K416-E419 PolarHBondContact O-N 3.29Å; E419-F421 VanDerWaalsContact C-N 3.35Å; E419-F421 PolarHBondContact O-N 2.92Å; E419-L422 PolarHBondContact O-N 3.02Å; E419-E423 PolarHBondContact O-N 3.48Å
420	Y	95.4	Very high	95.9	Very high	164 Å²	164	108 Å²	108	64%	0.643	50%	0.495	S	S	*	.	H	α-helix	trans	-58.9	-44.5	174.6	-177	-97.4	0	0	0	112.3	K416 Q417 L422 E423 V424	K416-Y420 WeakPolarHBondContact O-CB 3.39Å; K416-Y420 PolarHBondContact O-N 3.23Å; Q417-Y420 PolarHBondContact O-N 2.72Å; Y420-L422 VanDerWaalsContact C-N 3.34Å; Y420-L422 PolarHBondContact O-N 3.42Å; Y420-E423 PolarHBondContact O-N 3.39Å; Y420-V424 HydrophobicContact CD1-CG2 4.03Å; Y420-V424 HydrophobicContact CE1-CG2 3.6Å; Y420-V424 HydrophobicContact CE2-CG2 4.32Å; Y420-V424 WeakPolarHBondContact O-CG2 3.28Å; Y420-V424 PolarHBondContact O-N 2.93Å
421	F	96.1	Very high	96	Very high	123 Å²	123	106.9 Å²	106.9	54%	0.539	49%	0.492	S	S	.	.	H	α-helix	trans	-62.6	-40	177.3	179.9	-101.3	0	0	0	112.7	Q417 K418 E419 K425	Q417-F421 WeakPolarHBondContact O-CB 3.27Å; Q417-F421 PolarHBondContact O-N 2.85Å; K418-F421 PolarHBondContact O-N 3.45Å; E419-F421 VanDerWaalsContact C-N 3.35Å; E419-F421 PolarHBondContact O-N 2.92Å; F421-K425 HydrophobicContact CE1-CD 4.14Å; F421-K425 HydrophobicContact CE1-CG 4.21Å; F421-K425 HydrophobicContact CZ-CD 4.25Å; F421-K425 HydrophobicContact CZ-CG 4.28Å; F421-K425 WeakPolarHBondContact O-CB 3.34Å; F421-K425 WeakPolarHBondContact O-CG 3.38Å; F421-K425 PolarHBondContact O-N 3.16Å
422	L	97	Very high	96	Very high	111 Å²	111	104 Å²	104	58%	0.581	48%	0.481	S	S	*	.	H	α-helix	trans	-65.7	-40.2	175.4	-72.1	173.3	0	0	0	111.8	K418 E419 Y420 K425 K426	K418-L422 WeakPolarHBondContact O-CG 3.41Å; K418-L422 PolarHBondContact O-N 2.92Å; E419-L422 PolarHBondContact O-N 3.02Å; Y420-L422 VanDerWaalsContact C-N 3.34Å; Y420-L422 PolarHBondContact O-N 3.42Å; L422-K425 PolarHBondContact O-N 3.33Å; L422-K426 WeakPolarHBondContact O-CB 3.38Å; L422-K426 PolarHBondContact O-N 3.44Å
423	E	96.3	Very high	96.1	Very high	91 Å²	91	102.2 Å²	102.2	43%	0.425	48%	0.475	S	S	.	.	H	α-helix	trans	-66.3	-44.3	176.8	-167.4	62.3	-163.3	0	0	111.4	E419 Y420 K425 K426 L427	E419-E423 PolarHBondContact O-N 3.48Å; Y420-E423 PolarHBondContact O-N 3.39Å; E423-K425 VanDerWaalsContact C-N 3.33Å; E423-K425 PolarHBondContact O-N 2.92Å; E423-K426 WeakPolarHBondContact O-CB 3.33Å; E423-K426 PolarHBondContact O-N 3.26Å; E423-K426 IonicContact OE1-NZ 3.74Å; E423-L427 HydrophobicContact CG-CD1 4.48Å; E423-L427 WeakPolarHBondContact O-CG 3.36Å; E423-L427 PolarHBondContact O-N 2.86Å
424	V	95.9	Very high	96.2	Very high	59 Å²	59	104.4 Å²	104.4	36%	0.358	48%	0.483	S	S	.	.	H	α-helix	trans	-58.7	-45.1	174.1	171.2	0	0	0	0	111	Y420 K426 L427 E428	Y420-V424 HydrophobicContact CD1-CG2 4.03Å; Y420-V424 HydrophobicContact CE1-CG2 3.6Å; Y420-V424 HydrophobicContact CE2-CG2 4.32Å; Y420-V424 WeakPolarHBondContact O-CG2 3.28Å; Y420-V424 PolarHBondContact O-N 2.93Å; V424-K426 VanDerWaalsContact C-N 3.28Å; V424-K426 PolarHBondContact O-N 2.94Å; V424-L427 PolarHBondContact O-N 3.39Å; V424-E428 WeakPolarHBondContact O-CB 3.38Å; V424-E428 PolarHBondContact O-N 3.24Å
425	K	96.8	Very high	96.2	Very high	86 Å²	86	104.6 Å²	104.6	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-63	-32.8	175.2	-79.7	-136.8	175.2	-167.3	0	113.2	F421 L422 E423 R429	F421-K425 HydrophobicContact CE1-CD 4.14Å; F421-K425 HydrophobicContact CE1-CG 4.21Å; F421-K425 HydrophobicContact CZ-CD 4.25Å; F421-K425 HydrophobicContact CZ-CG 4.28Å; F421-K425 WeakPolarHBondContact O-CB 3.34Å; F421-K425 WeakPolarHBondContact O-CG 3.38Å; F421-K425 PolarHBondContact O-N 3.16Å; L422-K425 PolarHBondContact O-N 3.33Å; E423-K425 VanDerWaalsContact C-N 3.33Å; E423-K425 PolarHBondContact O-N 2.92Å; K425-R429 WeakPolarHBondContact O-CG 3.47Å; K425-R429 PolarHBondContact O-N 3.39Å
426	K	97.2	Very high	96.3	Very high	92 Å²	92	106.1 Å²	106.1	40%	0.4	49%	0.488	S	S	.	.	H	α-helix	trans	-69.5	-47.5	176.3	-179.2	-172.5	164.8	-151.2	0	110.3	L422 E423 V424 E428 R429 E430	L422-K426 WeakPolarHBondContact O-CB 3.38Å; L422-K426 PolarHBondContact O-N 3.44Å; E423-K426 WeakPolarHBondContact O-CB 3.33Å; E423-K426 PolarHBondContact O-N 3.26Å; E423-K426 IonicContact OE1-NZ 3.74Å; V424-K426 VanDerWaalsContact C-N 3.28Å; V424-K426 PolarHBondContact O-N 2.94Å; K426-E428 VanDerWaalsContact C-N 3.34Å; K426-E428 PolarHBondContact O-N 2.83Å; K426-R429 WeakPolarHBondContact O-CB 3.33Å; K426-R429 PolarHBondContact O-N 3.3Å; K426-R429 VanDerWaalsContact O-N 3.15Å; K426-E430 WeakPolarHBondContact CE-OE1 3.4Å; K426-E430 IonicContact NZ-OE1 3.2Å; K426-E430 WeakPolarHBondContact O-CG 3.48Å; K426-E430 PolarHBondContact O-N 3.49Å
427	L	96.5	Very high	96.4	Very high	89 Å²	89	105.7 Å²	105.7	47%	0.466	49%	0.488	S	S	.	.	H	α-helix	trans	-59.9	-41.5	176.2	-68.1	173	0	0	0	112.1	E423 V424 R429 E430 E431	E423-L427 HydrophobicContact CG-CD1 4.48Å; E423-L427 WeakPolarHBondContact O-CG 3.36Å; E423-L427 PolarHBondContact O-N 2.86Å; V424-L427 PolarHBondContact O-N 3.39Å; L427-R429 VanDerWaalsContact C-N 3.32Å; L427-R429 PolarHBondContact O-N 2.68Å; L427-E430 PolarHBondContact O-N 3.29Å; L427-E431 WeakPolarHBondContact O-CB 3.3Å; L427-E431 PolarHBondContact O-N 2.94Å
428	E	95.3	Very high	96.5	Very high	104 Å²	104	104.5 Å²	104.5	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-61.4	-39.1	175.7	-174.2	-176.7	-169.8	0	0	112.1	V424 K426 N432	V424-E428 WeakPolarHBondContact O-CB 3.38Å; V424-E428 PolarHBondContact O-N 3.24Å; K426-E428 VanDerWaalsContact C-N 3.34Å; K426-E428 PolarHBondContact O-N 2.83Å; E428-N432 WeakPolarHBondContact O-CB 3.39Å; E428-N432 VanDerWaalsContact O-CG 3.22Å; E428-N432 PolarHBondContact O-N 3.46Å; E428-N432 PolarHBondContact O-ND2 2.96Å; E428-N432 VanDerWaalsContact O-ND2 3.14Å
429	R	96.8	Very high	96.6	Very high	158 Å²	158	105.5 Å²	105.5	60%	0.596	49%	0.487	S	S	*	.	H	α-helix	trans	-67	-42.3	174.3	-70	-179.6	-154.8	122.9	-1.7	112	K425 K426 L427 N432 L433	K425-R429 WeakPolarHBondContact O-CG 3.47Å; K425-R429 PolarHBondContact O-N 3.39Å; K426-R429 WeakPolarHBondContact O-CB 3.33Å; K426-R429 PolarHBondContact O-N 3.3Å; K426-R429 VanDerWaalsContact O-N 3.15Å; L427-R429 VanDerWaalsContact C-N 3.32Å; L427-R429 PolarHBondContact O-N 2.68Å; R429-N432 PolarHBondContact O-N 2.81Å; R429-L433 WeakPolarHBondContact O-CB 3.38Å; R429-L433 PolarHBondContact O-N 2.82Å
430	E	96.4	Very high	96.7	Very high	81 Å²	81	106.9 Å²	106.9	38%	0.379	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-41.9	176.8	-71.4	173.1	-174.2	0	0	111.2	K426 L427 L433 Q434	K426-E430 WeakPolarHBondContact CE-OE1 3.4Å; K426-E430 IonicContact NZ-OE1 3.2Å; K426-E430 WeakPolarHBondContact O-CG 3.48Å; K426-E430 PolarHBondContact O-N 3.49Å; L427-E430 PolarHBondContact O-N 3.29Å; E430-L433 PolarHBondContact O-N 2.94Å; E430-Q434 WeakPolarHBondContact O-CG 3.39Å; E430-Q434 PolarHBondContact O-N 2.88Å
431	E	96.5	Very high	96.8	Very high	98 Å²	98	105.4 Å²	105.4	46%	0.458	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-43.7	175.1	-169	-168.7	168	0	0	111.6	L427 Q434 K435	L427-E431 WeakPolarHBondContact O-CB 3.3Å; L427-E431 PolarHBondContact O-N 2.94Å; E431-Q434 PolarHBondContact O-N 3.21Å; E431-K435 HydrophobicContact CG-CD 4.49Å; E431-K435 WeakPolarHBondContact O-CG 3.23Å; E431-K435 PolarHBondContact O-N 2.95Å; E431-K435 WeakPolarHBondContact OE1-CE 3.5Å; E431-K435 IonicContact OE1-NZ 2.92Å; E431-K435 PolarHBondContact OE1-NZ 2.89Å
432	N	96.9	Very high	96.8	Very high	73 Å²	73	103.1 Å²	103.1	39%	0.39	48%	0.481	S	S	.	.	H	α-helix	trans	-63.7	-42.5	176.4	-73.7	-28.6	0	0	0	111.9	E428 R429 K435 E436	E428-N432 WeakPolarHBondContact O-CB 3.39Å; E428-N432 VanDerWaalsContact O-CG 3.22Å; E428-N432 PolarHBondContact O-N 3.46Å; E428-N432 PolarHBondContact O-ND2 2.96Å; E428-N432 VanDerWaalsContact O-ND2 3.14Å; R429-N432 PolarHBondContact O-N 2.81Å; N432-K435 PolarHBondContact O-N 3.4Å; N432-E436 WeakPolarHBondContact O-CG 3.27Å; N432-E436 PolarHBondContact O-N 3.23Å
433	L	97.5	Very high	96.8	Very high	96 Å²	96	102.9 Å²	102.9	50%	0.503	48%	0.477	S	S	.	.	H	α-helix	trans	-61.7	-44.4	175.4	-171.6	73.8	0	0	0	111.3	R429 E430 K435 E436 E437	R429-L433 WeakPolarHBondContact O-CB 3.38Å; R429-L433 PolarHBondContact O-N 2.82Å; E430-L433 PolarHBondContact O-N 2.94Å; L433-K435 VanDerWaalsContact C-N 3.34Å; L433-K435 PolarHBondContact O-N 3.34Å; L433-E436 PolarHBondContact O-N 3.46Å; L433-E437 WeakPolarHBondContact O-CG 3.44Å; L433-E437 PolarHBondContact O-N 3.19Å
434	Q	96.4	Very high	96.9	Very high	112 Å²	112	103 Å²	103	52%	0.523	48%	0.478	S	S	.	.	H	α-helix	trans	-61.9	-41	175.9	-74.8	-179.9	10.5	0	0	112.1	E430 E431 E436 E437 Q438	E430-Q434 WeakPolarHBondContact O-CG 3.39Å; E430-Q434 PolarHBondContact O-N 2.88Å; E431-Q434 PolarHBondContact O-N 3.21Å; Q434-E436 VanDerWaalsContact C-N 3.33Å; Q434-E436 PolarHBondContact O-N 3.3Å; Q434-E437 PolarHBondContact O-N 3.37Å; Q434-Q438 WeakPolarHBondContact O-CB 3.16Å; Q434-Q438 VanDerWaalsContact O-CG 3.25Å; Q434-Q438 WeakPolarHBondContact O-CG 3.34Å; Q434-Q438 PolarHBondContact O-N 3.34Å
435	K	96.9	Very high	96.9	Very high	91 Å²	91	103.8 Å²	103.8	40%	0.396	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-40.1	174.6	-74.9	172.1	-176.8	165.6	0	111.7	E431 N432 L433 K439	E431-K435 HydrophobicContact CG-CD 4.49Å; E431-K435 WeakPolarHBondContact O-CG 3.23Å; E431-K435 PolarHBondContact O-N 2.95Å; E431-K435 WeakPolarHBondContact OE1-CE 3.5Å; E431-K435 IonicContact OE1-NZ 2.92Å; E431-K435 PolarHBondContact OE1-NZ 2.89Å; N432-K435 PolarHBondContact O-N 3.4Å; L433-K435 VanDerWaalsContact C-N 3.34Å; L433-K435 PolarHBondContact O-N 3.34Å; K435-K439 WeakPolarHBondContact O-CB 3.46Å; K435-K439 VanDerWaalsContact O-CG 3.27Å; K435-K439 WeakPolarHBondContact O-CG 3.49Å; K435-K439 PolarHBondContact O-N 3.1Å
436	E	97	Very high	97	Very high	127 Å²	127	104 Å²	104	59%	0.593	49%	0.491	S	S	*	.	H	α-helix	trans	-66.2	-43.9	175.3	-74.1	179.5	178.8	0	0	112	N432 L433 Q434 Q438 K439 K440	N432-E436 WeakPolarHBondContact O-CG 3.27Å; N432-E436 PolarHBondContact O-N 3.23Å; L433-E436 PolarHBondContact O-N 3.46Å; Q434-E436 VanDerWaalsContact C-N 3.33Å; Q434-E436 PolarHBondContact O-N 3.3Å; E436-Q438 PolarHBondContact O-N 2.83Å; E436-K439 PolarHBondContact O-N 2.87Å; E436-K440 WeakPolarHBondContact O-CB 3.24Å; E436-K440 PolarHBondContact O-N 2.85Å
437	E	97.6	Very high	97	Very high	98 Å²	98	104.1 Å²	104.1	46%	0.458	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-42.3	174.6	-74.5	-176.6	179.3	0	0	112.2	L433 Q434 K440 K441	L433-E437 WeakPolarHBondContact O-CG 3.44Å; L433-E437 PolarHBondContact O-N 3.19Å; Q434-E437 PolarHBondContact O-N 3.37Å; E437-K440 PolarHBondContact O-N 3.41Å; E437-K441 WeakPolarHBondContact O-CG 3.44Å; E437-K441 PolarHBondContact O-N 2.9Å
438	Q	96.7	Very high	97	Very high	116 Å²	116	104.7 Å²	104.7	54%	0.542	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-46.4	175	-75.4	176.2	1.9	0	0	111.4	Q434 E436 K440 K441 I442	Q434-Q438 WeakPolarHBondContact O-CB 3.16Å; Q434-Q438 VanDerWaalsContact O-CG 3.25Å; Q434-Q438 WeakPolarHBondContact O-CG 3.34Å; Q434-Q438 PolarHBondContact O-N 3.34Å; E436-Q438 PolarHBondContact O-N 2.83Å; Q438-K440 VanDerWaalsContact C-N 3.31Å; Q438-K440 PolarHBondContact O-N 3.4Å; Q438-K441 PolarHBondContact O-N 3.5Å; Q438-I442 VanDerWaalsContact O-CG1 3.28Å; Q438-I442 WeakPolarHBondContact O-CG1 3.44Å; Q438-I442 PolarHBondContact O-N 3.41Å
439	K	97.2	Very high	97.1	Very high	143 Å²	143	104.4 Å²	104.4	62%	0.622	49%	0.492	S	S	*	.	H	α-helix	trans	-57.9	-44.2	174.8	-76.5	174.6	-178.8	-179.7	0	111.4	K435 E436 I442 M443	K435-K439 WeakPolarHBondContact O-CB 3.46Å; K435-K439 VanDerWaalsContact O-CG 3.27Å; K435-K439 WeakPolarHBondContact O-CG 3.49Å; K435-K439 PolarHBondContact O-N 3.1Å; E436-K439 PolarHBondContact O-N 2.87Å; K439-I442 PolarHBondContact O-N 2.95Å; K439-M443 WeakPolarHBondContact O-CG 3.44Å; K439-M443 PolarHBondContact O-N 3.24Å
440	K	97.5	Very high	97.1	Very high	133 Å²	133	101.8 Å²	101.8	58%	0.578	49%	0.486	S	S	*	.	H	α-helix	trans	-61.8	-46.7	177.8	-174.5	177.8	174.2	-176	0	111.8	E436 E437 Q438 I442 M443 E444	E436-K440 WeakPolarHBondContact O-CB 3.24Å; E436-K440 PolarHBondContact O-N 2.85Å; E437-K440 PolarHBondContact O-N 3.41Å; Q438-K440 VanDerWaalsContact C-N 3.31Å; Q438-K440 PolarHBondContact O-N 3.4Å; K440-I442 VanDerWaalsContact C-N 3.32Å; K440-I442 PolarHBondContact O-N 2.91Å; K440-M443 PolarHBondContact O-N 2.95Å; K440-E444 WeakPolarHBondContact CE-OE1 3.38Å; K440-E444 HydrophobicContact CG-CG 4.48Å; K440-E444 WeakPolarHBondContact O-CG 3.46Å; K440-E444 PolarHBondContact O-N 3.41Å
441	K	97.7	Very high	97.2	Very high	133 Å²	133	103.2 Å²	103.2	58%	0.578	49%	0.488	S	S	*	.	H	α-helix	trans	-60.2	-40.6	175.9	-73.3	173.5	-176.6	173.4	0	112.5	E437 Q438 E444 S445	E437-K441 WeakPolarHBondContact O-CG 3.44Å; E437-K441 PolarHBondContact O-N 2.9Å; Q438-K441 PolarHBondContact O-N 3.5Å; K441-E444 PolarHBondContact O-N 2.94Å; K441-S445 WeakPolarHBondContact O-CB 3.29Å; K441-S445 PolarHBondContact O-N 3.02Å
442	I	97	Very high	97.3	Very high	75 Å²	75	102.4 Å²	102.4	39%	0.385	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-46	175.9	-67.8	164.8	0	0	0	110.2	Q438 K439 K440 S445 L446	Q438-I442 VanDerWaalsContact O-CG1 3.28Å; Q438-I442 WeakPolarHBondContact O-CG1 3.44Å; Q438-I442 PolarHBondContact O-N 3.41Å; K439-I442 PolarHBondContact O-N 2.95Å; K440-I442 VanDerWaalsContact C-N 3.32Å; K440-I442 PolarHBondContact O-N 2.91Å; I442-S445 PolarHBondContact O-N 3.06Å; I442-L446 HydrophobicContact CG2-CD1 4.05Å; I442-L446 HydrophobicContact CG2-CG 4.46Å; I442-L446 WeakPolarHBondContact O-CG 3.35Å; I442-L446 PolarHBondContact O-N 2.74Å
443	M	97.4	Very high	97.3	Very high	105 Å²	105	106 Å²	106	52%	0.517	49%	0.494	S	S	.	.	H	α-helix	trans	-60.1	-47.3	176.2	-73	-60.1	-58	0	0	111.9	K439 K440 S445 L446 E447	K439-M443 WeakPolarHBondContact O-CG 3.44Å; K439-M443 PolarHBondContact O-N 3.24Å; K440-M443 PolarHBondContact O-N 2.95Å; M443-S445 VanDerWaalsContact C-N 3.3Å; M443-S445 PolarHBondContact O-N 3.28Å; M443-L446 PolarHBondContact O-N 3.42Å; M443-E447 WeakPolarHBondContact O-CB 3.38Å; M443-E447 VanDerWaalsContact O-CG 3.28Å; M443-E447 WeakPolarHBondContact O-CG 3.45Å; M443-E447 PolarHBondContact O-N 3.48Å
444	E	97.5	Very high	97.3	Very high	94 Å²	94	104.7 Å²	104.7	44%	0.439	49%	0.487	S	S	.	.	H	α-helix	trans	-59.3	-39.6	177.4	-73.9	171.6	176.7	0	0	112.3	K440 K441 H448	K440-E444 WeakPolarHBondContact CE-OE1 3.38Å; K440-E444 HydrophobicContact CG-CG 4.48Å; K440-E444 WeakPolarHBondContact O-CG 3.46Å; K440-E444 PolarHBondContact O-N 3.41Å; K441-E444 PolarHBondContact O-N 2.94Å; E444-H448 WeakPolarHBondContact O-CB 3.45Å; E444-H448 PolarHBondContact O-N 3.14Å
445	S	96.6	Very high	97.3	Very high	75 Å²	75	105.4 Å²	105.4	52%	0.524	49%	0.49	S	S	.	.	H	α-helix	trans	-65.8	-46.7	175.9	-176.3	0	0	0	0	112.1	K441 I442 M443 E447 H448 E449	K441-S445 WeakPolarHBondContact O-CB 3.29Å; K441-S445 PolarHBondContact O-N 3.02Å; I442-S445 PolarHBondContact O-N 3.06Å; M443-S445 VanDerWaalsContact C-N 3.3Å; M443-S445 PolarHBondContact O-N 3.28Å; S445-E447 PolarHBondContact O-N 2.81Å; S445-H448 WeakPolarHBondContact O-CB 3.27Å; S445-H448 PolarHBondContact O-N 3.36Å; S445-E449 PolarHBondContact O-N 2.81Å
446	L	97.6	Very high	97.4	Very high	92 Å²	92	105.1 Å²	105.1	48%	0.482	49%	0.493	S	S	.	.	H	α-helix	trans	-64.1	-40.9	177.2	-71.9	173.7	0	0	0	111.8	I442 M443 H448 E449 H450	I442-L446 HydrophobicContact CG2-CD1 4.05Å; I442-L446 HydrophobicContact CG2-CG 4.46Å; I442-L446 WeakPolarHBondContact O-CG 3.35Å; I442-L446 PolarHBondContact O-N 2.74Å; M443-L446 PolarHBondContact O-N 3.42Å; L446-H448 VanDerWaalsContact C-N 3.32Å; L446-E449 PolarHBondContact O-N 3.38Å; L446-H450 WeakPolarHBondContact O-CB 3.25Å; L446-H450 PolarHBondContact O-N 3.24Å
447	E	97.2	Very high	97.4	Very high	93 Å²	93	103.6 Å²	103.6	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-63.8	-39	174.2	-73.1	177	-173.6	0	0	111.5	M443 S445 H450 R451	M443-E447 WeakPolarHBondContact O-CB 3.38Å; M443-E447 VanDerWaalsContact O-CG 3.28Å; M443-E447 WeakPolarHBondContact O-CG 3.45Å; M443-E447 PolarHBondContact O-N 3.48Å; S445-E447 PolarHBondContact O-N 2.81Å; E447-H450 PolarHBondContact O-N 2.86Å; E447-R451 WeakPolarHBondContact O-CB 3.44Å; E447-R451 VanDerWaalsContact O-CG 3.29Å; E447-R451 WeakPolarHBondContact O-CG 3.41Å; E447-R451 PolarHBondContact O-N 3.41Å; E447-R451 IonicContact OE2-NH1 3.82Å
448	H	97.5	Very high	97.4	Very high	102 Å²	102	102.9 Å²	102.9	47%	0.472	49%	0.486	S	S	.	.	H	α-helix	trans	-64.4	-46.1	175.2	-180	55.7	0	0	0	112	E444 S445 L446 H450 R451 I452	E444-H448 WeakPolarHBondContact O-CB 3.45Å; E444-H448 PolarHBondContact O-N 3.14Å; S445-H448 WeakPolarHBondContact O-CB 3.27Å; S445-H448 PolarHBondContact O-N 3.36Å; L446-H448 VanDerWaalsContact C-N 3.32Å; H448-H450 VanDerWaalsContact C-N 3.29Å; H448-H450 PolarHBondContact O-N 3.27Å; H448-R451 PolarHBondContact O-N 3.31Å; H448-I452 VanDerWaalsContact CE1-CD1 3.48Å; H448-I452 WeakPolarHBondContact CE1-CD1 3.42Å; H448-I452 VanDerWaalsContact NE2-CD1 3.33Å; H448-I452 WeakPolarHBondContact NE2-CD1 3.48Å; H448-I452 WeakPolarHBondContact O-CG1 3.32Å; H448-I452 PolarHBondContact O-N 2.68Å
449	E	97.2	Very high	97.4	Very high	97 Å²	97	103.6 Å²	103.6	45%	0.453	49%	0.489	S	S	.	.	H	α-helix	trans	-58.6	-43.6	174.6	-167.3	-161.6	144.9	0	0	111.2	S445 L446 I452 R453	S445-E449 PolarHBondContact O-N 2.81Å; L446-E449 PolarHBondContact O-N 3.38Å; E449-I452 PolarHBondContact O-N 3.45Å; E449-R453 WeakPolarHBondContact O-CB 3.31Å; E449-R453 PolarHBondContact O-N 3.3Å; E449-R453 IonicContact OE1-CZ 3.99Å; E449-R453 IonicContact OE1-NH2 3.6Å; E449-R453 PolarHBondContact OE1-NH2 3.48Å
450	H	97.7	Very high	97.4	Very high	103 Å²	103	103.3 Å²	103.3	48%	0.477	49%	0.488	S	S	.	.	H	α-helix	trans	-64.5	-42.6	177.3	-173.8	-94.3	0	0	0	112.1	L446 E447 H448 R453 L454	L446-H450 WeakPolarHBondContact O-CB 3.25Å; L446-H450 PolarHBondContact O-N 3.24Å; E447-H450 PolarHBondContact O-N 2.86Å; H448-H450 VanDerWaalsContact C-N 3.29Å; H448-H450 PolarHBondContact O-N 3.27Å; H450-R453 PolarHBondContact O-N 3.01Å; H450-L454 VanDerWaalsContact CE1-CD1 3.44Å; H450-L454 WeakPolarHBondContact CE1-CD1 3.49Å; H450-L454 WeakPolarHBondContact O-CG 3.44Å; H450-L454 PolarHBondContact O-N 2.86Å
451	R	97.9	Very high	97.4	Very high	112 Å²	112	99.7 Å²	99.7	42%	0.423	48%	0.475	S	S	.	.	H	α-helix	trans	-59	-48.7	174.3	-76.9	-173.2	-62.5	-95.1	0.1	111.4	E447 H448 R453 L454 E455	E447-R451 WeakPolarHBondContact O-CB 3.44Å; E447-R451 VanDerWaalsContact O-CG 3.29Å; E447-R451 WeakPolarHBondContact O-CG 3.41Å; E447-R451 PolarHBondContact O-N 3.41Å; E447-R451 IonicContact OE2-NH1 3.82Å; H448-R451 PolarHBondContact O-N 3.31Å; R451-R453 VanDerWaalsContact C-N 3.3Å; R451-R453 PolarHBondContact O-N 3.46Å; R451-L454 PolarHBondContact O-N 2.94Å; R451-E455 WeakPolarHBondContact O-CG 3.42Å; R451-E455 PolarHBondContact O-N 3.26Å
452	I	97.7	Very high	97.3	Very high	81 Å²	81	97.2 Å²	97.2	42%	0.415	47%	0.468	S	S	.	.	H	α-helix	trans	-58.3	-43.6	176.2	-70	169.4	0	0	0	110.9	H448 E449 L454 E455 L456	H448-I452 VanDerWaalsContact CE1-CD1 3.48Å; H448-I452 WeakPolarHBondContact CE1-CD1 3.42Å; H448-I452 VanDerWaalsContact NE2-CD1 3.33Å; H448-I452 WeakPolarHBondContact NE2-CD1 3.48Å; H448-I452 WeakPolarHBondContact O-CG1 3.32Å; H448-I452 PolarHBondContact O-N 2.68Å; E449-I452 PolarHBondContact O-N 3.45Å; I452-L454 VanDerWaalsContact C-N 3.34Å; I452-L454 PolarHBondContact O-N 2.9Å; I452-E455 PolarHBondContact O-N 3.02Å; I452-L456 WeakPolarHBondContact O-CB 3.25Å; I452-L456 PolarHBondContact O-N 3.27Å
453	R	97.5	Very high	97.4	Very high	147 Å²	147	99.8 Å²	99.8	56%	0.555	48%	0.476	S	S	*	.	H	α-helix	trans	-62.9	-40.9	179.2	-168.8	-176.1	-60.5	167.2	1.6	112	E449 H450 R451 M457	E449-R453 WeakPolarHBondContact O-CB 3.31Å; E449-R453 PolarHBondContact O-N 3.3Å; E449-R453 IonicContact OE1-CZ 3.99Å; E449-R453 IonicContact OE1-NH2 3.6Å; E449-R453 PolarHBondContact OE1-NH2 3.48Å; H450-R453 PolarHBondContact O-N 3.01Å; R451-R453 VanDerWaalsContact C-N 3.3Å; R451-R453 PolarHBondContact O-N 3.46Å; R453-M457 WeakPolarHBondContact O-CB 3.38Å; R453-M457 PolarHBondContact O-N 2.93Å
454	L	97.6	Very high	97.3	Very high	70 Å²	70	100.2 Å²	100.2	37%	0.366	48%	0.477	S	S	.	.	H	α-helix	trans	-66	-43.5	174.8	-72.9	179.4	0	0	0	111.8	H450 R451 I452 M457 N458	H450-L454 VanDerWaalsContact CE1-CD1 3.44Å; H450-L454 WeakPolarHBondContact CE1-CD1 3.49Å; H450-L454 WeakPolarHBondContact O-CG 3.44Å; H450-L454 PolarHBondContact O-N 2.86Å; R451-L454 PolarHBondContact O-N 2.94Å; I452-L454 VanDerWaalsContact C-N 3.34Å; I452-L454 PolarHBondContact O-N 2.9Å; L454-M457 HydrophobicContact CD2-CE 4Å; L454-M457 PolarHBondContact O-N 3.41Å; L454-N458 WeakPolarHBondContact O-CB 3.12Å; L454-N458 VanDerWaalsContact O-CG 3.24Å; L454-N458 PolarHBondContact O-N 3.5Å; L454-N458 PolarHBondContact O-ND2 2.88Å
455	E	97.3	Very high	97.3	Very high	126 Å²	126	103.4 Å²	103.4	59%	0.589	49%	0.485	S	S	*	.	H	α-helix	trans	-58.7	-47.7	175.6	-74.7	170.9	-170.2	0	0	111.1	R451 I452 M457 N458 E459	R451-E455 WeakPolarHBondContact O-CG 3.42Å; R451-E455 PolarHBondContact O-N 3.26Å; I452-E455 PolarHBondContact O-N 3.02Å; E455-M457 VanDerWaalsContact C-N 3.34Å; E455-M457 PolarHBondContact O-N 3.48Å; E455-N458 PolarHBondContact O-N 3.28Å; E455-E459 WeakPolarHBondContact O-CB 3.5Å; E455-E459 PolarHBondContact O-N 2.95Å
456	L	97.4	Very high	97.3	Very high	85 Å²	85	106 Å²	106	45%	0.445	49%	0.489	S	S	.	.	H	α-helix	trans	-62.1	-39.3	176.5	-177.1	68.1	0	0	0	112.5	I452 K460	I452-L456 WeakPolarHBondContact O-CB 3.25Å; I452-L456 PolarHBondContact O-N 3.27Å; L456-K460 WeakPolarHBondContact O-CG 3.47Å; L456-K460 PolarHBondContact O-N 3.37Å; L456-K460 VanDerWaalsContact O-N 3.08Å
457	M	97.6	Very high	97.3	Very high	95 Å²	95	105.6 Å²	105.6	47%	0.468	49%	0.485	S	S	.	.	H	α-helix	trans	-66.9	-42.8	176	-173.5	179.2	71	0	0	111.3	R453 L454 E455 K460 I461	R453-M457 WeakPolarHBondContact O-CB 3.38Å; R453-M457 PolarHBondContact O-N 2.93Å; L454-M457 HydrophobicContact CD2-CE 4Å; L454-M457 PolarHBondContact O-N 3.41Å; E455-M457 VanDerWaalsContact C-N 3.34Å; E455-M457 PolarHBondContact O-N 3.48Å; M457-K460 PolarHBondContact O-N 2.9Å; M457-I461 HydrophobicContact CG-CD1 4.07Å; M457-I461 VanDerWaalsContact O-CG1 3.3Å; M457-I461 WeakPolarHBondContact O-CG1 3.3Å; M457-I461 PolarHBondContact O-N 2.92Å
458	N	97.6	Very high	97.2	Very high	83 Å²	83	106.1 Å²	106.1	44%	0.444	49%	0.487	S	S	.	.	H	α-helix	trans	-64.3	-40.1	176.8	-73.9	-25.3	0	0	0	111.8	L454 E455 I461 N462	L454-N458 WeakPolarHBondContact O-CB 3.12Å; L454-N458 VanDerWaalsContact O-CG 3.24Å; L454-N458 PolarHBondContact O-N 3.5Å; L454-N458 PolarHBondContact O-ND2 2.88Å; E455-N458 PolarHBondContact O-N 3.28Å; N458-I461 PolarHBondContact O-N 3.49Å; N458-N462 WeakPolarHBondContact O-CB 3.3Å; N458-N462 VanDerWaalsContact O-CG 3.24Å; N458-N462 PolarHBondContact O-N 3.35Å; N458-N462 PolarHBondContact O-ND2 2.91Å
459	E	97.1	Very high	97.2	Very high	131 Å²	131	103.8 Å²	103.8	61%	0.612	48%	0.482	S	S	*	.	H	α-helix	trans	-59.9	-46.2	173.4	-170.6	-172.2	168.9	0	0	111.1	E455 I461 N462 K463	E455-E459 WeakPolarHBondContact O-CB 3.5Å; E455-E459 PolarHBondContact O-N 2.95Å; E459-I461 PolarHBondContact O-N 3.28Å; E459-N462 PolarHBondContact O-N 3.38Å; E459-K463 WeakPolarHBondContact O-CB 3.45Å; E459-K463 PolarHBondContact O-N 3.08Å
460	K	97.3	Very high	97.1	Very high	138 Å²	138	102.9 Å²	102.9	60%	0.6	48%	0.48	S	S	*	.	H	α-helix	trans	-60.5	-44.6	175.2	-74.4	177.6	-178.2	-178.3	0	112.5	L456 M457 N462 K463 E464	L456-K460 WeakPolarHBondContact O-CG 3.47Å; L456-K460 PolarHBondContact O-N 3.37Å; L456-K460 VanDerWaalsContact O-N 3.08Å; M457-K460 PolarHBondContact O-N 2.9Å; K460-N462 VanDerWaalsContact C-N 3.34Å; K460-N462 PolarHBondContact O-N 2.91Å; K460-K463 PolarHBondContact O-N 3.36Å; K460-E464 WeakPolarHBondContact O-CB 3.46Å; K460-E464 PolarHBondContact O-N 3.34Å
461	I	97	Very high	97.1	Very high	56 Å²	56	103.1 Å²	103.1	29%	0.287	48%	0.476	S	S	.	.	H	α-helix	trans	-62.1	-42.8	176.9	-70	166.2	0	0	0	110.6	M457 N458 E459 E464 R465	M457-I461 HydrophobicContact CG-CD1 4.07Å; M457-I461 VanDerWaalsContact O-CG1 3.3Å; M457-I461 WeakPolarHBondContact O-CG1 3.3Å; M457-I461 PolarHBondContact O-N 2.92Å; N458-I461 PolarHBondContact O-N 3.49Å; E459-I461 PolarHBondContact O-N 3.28Å; I461-E464 PolarHBondContact O-N 3.45Å; I461-R465 VanDerWaalsContact O-CG 3.3Å; I461-R465 WeakPolarHBondContact O-CG 3.41Å; I461-R465 PolarHBondContact O-N 3.32Å
462	N	96.6	Very high	97	Very high	82 Å²	82	100.6 Å²	100.6	44%	0.439	47%	0.473	S	S	.	.	H	α-helix	trans	-64.9	-43.9	178.4	-73.5	-20.3	0	0	0	111.4	N458 E459 K460 E464 R465 E466	N458-N462 WeakPolarHBondContact O-CB 3.3Å; N458-N462 VanDerWaalsContact O-CG 3.24Å; N458-N462 PolarHBondContact O-N 3.35Å; N458-N462 PolarHBondContact O-ND2 2.91Å; E459-N462 PolarHBondContact O-N 3.38Å; K460-N462 VanDerWaalsContact C-N 3.34Å; K460-N462 PolarHBondContact O-N 2.91Å; N462-E464 PolarHBondContact O-N 3.47Å; N462-R465 WeakPolarHBondContact O-CB 3.37Å; N462-R465 PolarHBondContact O-N 2.88Å; N462-E466 WeakPolarHBondContact O-CG 3.41Å; N462-E466 PolarHBondContact O-N 2.93Å
463	K	97.4	Very high	96.9	Very high	128 Å²	128	103.9 Å²	103.9	56%	0.557	48%	0.48	S	S	*	.	H	α-helix	trans	-60.2	-44	174.3	-172.8	177.7	177.8	-179.5	0	111.9	E459 K460 R465 E466 E467	E459-K463 WeakPolarHBondContact O-CB 3.45Å; E459-K463 PolarHBondContact O-N 3.08Å; K460-K463 PolarHBondContact O-N 3.36Å; K463-R465 VanDerWaalsContact C-N 3.33Å; K463-R465 PolarHBondContact O-N 3.16Å; K463-E466 PolarHBondContact O-N 3.43Å; K463-E467 VanDerWaalsContact CE-OE1 3.26Å; K463-E467 WeakPolarHBondContact CE-OE1 3.45Å; K463-E467 WeakPolarHBondContact O-CG 3.3Å; K463-E467 PolarHBondContact O-N 3.23Å
464	E	96.8	Very high	96.8	Very high	114 Å²	114	102.4 Å²	102.4	53%	0.533	48%	0.48	S	S	.	.	H	α-helix	trans	-61.4	-40.5	176.2	-175.7	177.7	-171.8	0	0	112	K460 I461 N462 E467 Q468	K460-E464 WeakPolarHBondContact O-CB 3.46Å; K460-E464 PolarHBondContact O-N 3.34Å; I461-E464 PolarHBondContact O-N 3.45Å; N462-E464 PolarHBondContact O-N 3.47Å; E464-E467 PolarHBondContact O-N 2.96Å; E464-Q468 VanDerWaalsContact O-CB 3.3Å; E464-Q468 WeakPolarHBondContact O-CB 3.38Å; E464-Q468 PolarHBondContact O-N 3.47Å
465	R	97.1	Very high	96.7	Very high	161 Å²	161	105.1 Å²	105.1	61%	0.608	49%	0.491	S	S	*	.	H	α-helix	trans	-64.4	-40.9	174.7	-73.5	173.8	-179.4	-179.3	1.2	112.4	I461 N462 K463 Q468 S469	I461-R465 VanDerWaalsContact O-CG 3.3Å; I461-R465 WeakPolarHBondContact O-CG 3.41Å; I461-R465 PolarHBondContact O-N 3.32Å; N462-R465 WeakPolarHBondContact O-CB 3.37Å; N462-R465 PolarHBondContact O-N 2.88Å; K463-R465 VanDerWaalsContact C-N 3.33Å; K463-R465 PolarHBondContact O-N 3.16Å; R465-Q468 PolarHBondContact O-N 3.43Å; R465-S469 WeakPolarHBondContact O-CB 3.39Å; R465-S469 PolarHBondContact O-N 3.27Å
466	E	96.7	Very high	96.6	Very high	129 Å²	129	103.4 Å²	103.4	60%	0.603	48%	0.482	S	S	*	.	H	α-helix	trans	-63.9	-47.4	175.3	-73.9	177.4	-175.4	0	0	111.3	N462 K463 Q468 S469 I470	N462-E466 WeakPolarHBondContact O-CG 3.41Å; N462-E466 PolarHBondContact O-N 2.93Å; K463-E466 PolarHBondContact O-N 3.43Å; E466-Q468 VanDerWaalsContact C-N 3.32Å; E466-Q468 PolarHBondContact O-N 2.84Å; E466-S469 WeakPolarHBondContact O-CB 3.35Å; E466-S469 PolarHBondContact O-N 2.94Å; E466-S469 VanDerWaalsContact O-N 3.16Å; E466-I470 WeakPolarHBondContact O-CG1 3.26Å; E466-I470 PolarHBondContact O-N 3.24Å
467	E	96.7	Very high	96.6	Very high	85 Å²	85	105.6 Å²	105.6	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-60	-41.7	175.1	-71.5	175.5	-171.3	0	0	111.5	K463 E464 I470 R471	K463-E467 VanDerWaalsContact CE-OE1 3.26Å; K463-E467 WeakPolarHBondContact CE-OE1 3.45Å; K463-E467 WeakPolarHBondContact O-CG 3.3Å; K463-E467 PolarHBondContact O-N 3.23Å; E464-E467 PolarHBondContact O-N 2.96Å; E467-I470 PolarHBondContact O-N 2.94Å; E467-R471 WeakPolarHBondContact O-CG 3.4Å; E467-R471 PolarHBondContact O-N 2.92Å; E467-R471 IonicContact OE2-NH1 2.72Å
468	Q	95.9	Very high	96.5	Very high	104 Å²	104	104.7 Å²	104.7	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-64.7	-40	175.2	-168.4	174.1	15.3	0	0	111.8	E464 R465 E466 I470 R471 V472	E464-Q468 VanDerWaalsContact O-CB 3.3Å; E464-Q468 WeakPolarHBondContact O-CB 3.38Å; E464-Q468 PolarHBondContact O-N 3.47Å; R465-Q468 PolarHBondContact O-N 3.43Å; E466-Q468 VanDerWaalsContact C-N 3.32Å; E466-Q468 PolarHBondContact O-N 2.84Å; Q468-I470 VanDerWaalsContact C-N 3.3Å; Q468-I470 PolarHBondContact O-N 3.45Å; Q468-R471 PolarHBondContact O-N 3.17Å; Q468-V472 WeakPolarHBondContact O-CB 3.28Å; Q468-V472 VanDerWaalsContact O-CG2 3.28Å; Q468-V472 WeakPolarHBondContact O-CG2 3.49Å; Q468-V472 PolarHBondContact O-N 3.37Å
469	S	96.6	Very high	96.4	Very high	52 Å²	52	105.2 Å²	105.2	36%	0.364	49%	0.49	S	S	.	.	H	α-helix	trans	-62.3	-37.3	174.2	-178.1	0	0	0	0	112.3	R465 E466 R473	R465-S469 WeakPolarHBondContact O-CB 3.39Å; R465-S469 PolarHBondContact O-N 3.27Å; E466-S469 WeakPolarHBondContact O-CB 3.35Å; E466-S469 PolarHBondContact O-N 2.94Å; E466-S469 VanDerWaalsContact O-N 3.16Å; S469-R473 WeakPolarHBondContact O-CG 3.36Å; S469-R473 PolarHBondContact O-N 3.15Å; S469-R473 VanDerWaalsContact O-N 3.15Å; S469-R473 PolarHBondContact O-NE 3.04Å; S469-R473 VanDerWaalsContact O-NE 3.17Å; S469-R473 PolarHBondContact OG-NE 3.42Å; S469-R473 PolarHBondContact OG-NH2 2.9Å
470	I	96.3	Very high	96.3	Very high	79 Å²	79	106.2 Å²	106.2	41%	0.405	49%	0.488	S	S	.	.	H	α-helix	trans	-68.2	-49.8	175.1	-66.2	164.7	0	0	0	110	E466 E467 Q468 V472 R473 E474	E466-I470 WeakPolarHBondContact O-CG1 3.26Å; E466-I470 PolarHBondContact O-N 3.24Å; E467-I470 PolarHBondContact O-N 2.94Å; Q468-I470 VanDerWaalsContact C-N 3.3Å; Q468-I470 PolarHBondContact O-N 3.45Å; I470-V472 VanDerWaalsContact C-N 3.34Å; I470-V472 PolarHBondContact O-N 3.45Å; I470-R473 WeakPolarHBondContact O-CB 3.42Å; I470-R473 PolarHBondContact O-N 2.93Å; I470-E474 HydrophobicContact CG2-CG 4.45Å; I470-E474 WeakPolarHBondContact O-CG 3.35Å; I470-E474 PolarHBondContact O-N 2.86Å
471	R	96.3	Very high	96.2	Very high	107 Å²	107	103.4 Å²	103.4	40%	0.404	48%	0.477	S	S	.	.	H	α-helix	trans	-54.6	-47.5	176.6	-73.3	-169.7	-63.3	-93.1	3.8	112	E467 Q468 R473 E474 E475	E467-R471 WeakPolarHBondContact O-CG 3.4Å; E467-R471 PolarHBondContact O-N 2.92Å; E467-R471 IonicContact OE2-NH1 2.72Å; Q468-R471 PolarHBondContact O-N 3.17Å; R471-R473 VanDerWaalsContact C-N 3.31Å; R471-R473 PolarHBondContact O-N 3.02Å; R471-E474 PolarHBondContact O-N 2.9Å; R471-E475 WeakPolarHBondContact O-CB 3.48Å; R471-E475 WeakPolarHBondContact O-CG 3.27Å; R471-E475 PolarHBondContact O-N 3.35Å
472	V	96.3	Very high	96.1	Very high	60 Å²	60	104.7 Å²	104.7	36%	0.364	49%	0.485	S	S	.	.	H	α-helix	trans	-61.6	-38.7	177.5	170.8	0	0	0	0	111.6	Q468 I470 Q476	Q468-V472 WeakPolarHBondContact O-CB 3.28Å; Q468-V472 VanDerWaalsContact O-CG2 3.28Å; Q468-V472 WeakPolarHBondContact O-CG2 3.49Å; Q468-V472 PolarHBondContact O-N 3.37Å; I470-V472 VanDerWaalsContact C-N 3.34Å; I470-V472 PolarHBondContact O-N 3.45Å; V472-Q476 WeakPolarHBondContact O-CB 3.41Å; V472-Q476 VanDerWaalsContact O-CG 3.27Å; V472-Q476 WeakPolarHBondContact O-CG 3.46Å; V472-Q476 PolarHBondContact O-N 3.19Å
473	R	96	Very high	96.1	Very high	150 Å²	150	106.2 Å²	106.2	57%	0.566	49%	0.488	S	S	*	.	H	α-helix	trans	-65.8	-40.3	175.7	-82.4	-179.6	-94.2	166	-11.4	112.2	S469 I470 R471 Q476 K477	S469-R473 WeakPolarHBondContact O-CG 3.36Å; S469-R473 PolarHBondContact O-N 3.15Å; S469-R473 VanDerWaalsContact O-N 3.15Å; S469-R473 PolarHBondContact O-NE 3.04Å; S469-R473 VanDerWaalsContact O-NE 3.17Å; S469-R473 PolarHBondContact OG-NE 3.42Å; S469-R473 PolarHBondContact OG-NH2 2.9Å; I470-R473 WeakPolarHBondContact O-CB 3.42Å; I470-R473 PolarHBondContact O-N 2.93Å; R471-R473 VanDerWaalsContact C-N 3.31Å; R471-R473 PolarHBondContact O-N 3.02Å; R473-Q476 PolarHBondContact O-N 3.39Å; R473-K477 PolarHBondContact O-N 3.37Å
474	E	95.6	Very high	96	Very high	116 Å²	116	107.8 Å²	107.8	54%	0.542	49%	0.49	S	S	.	.	H	α-helix	trans	-65.9	-47.1	175.8	-70.5	175.3	170.1	0	0	111.5	I470 R471 Q476 K477 V478	I470-E474 HydrophobicContact CG2-CG 4.45Å; I470-E474 WeakPolarHBondContact O-CG 3.35Å; I470-E474 PolarHBondContact O-N 2.86Å; R471-E474 PolarHBondContact O-N 2.9Å; E474-Q476 VanDerWaalsContact C-N 3.32Å; E474-Q476 PolarHBondContact O-N 3.48Å; E474-K477 WeakPolarHBondContact O-CA 3.26Å; E474-K477 WeakPolarHBondContact O-CB 3.28Å; E474-K477 PolarHBondContact O-N 2.82Å; E474-V478 WeakPolarHBondContact O-CG2 3.47Å; E474-V478 PolarHBondContact O-N 2.98Å
475	E	95.6	Very high	95.9	Very high	127 Å²	127	108.9 Å²	108.9	59%	0.593	49%	0.493	S	S	*	.	H	α-helix	trans	-58	-43.2	174.3	-73.8	174.1	-176.9	0	0	111.7	R471 K477 V478 L479	R471-E475 WeakPolarHBondContact O-CB 3.48Å; R471-E475 WeakPolarHBondContact O-CG 3.27Å; R471-E475 PolarHBondContact O-N 3.35Å; E475-K477 VanDerWaalsContact C-N 3.32Å; E475-K477 PolarHBondContact O-N 2.99Å; E475-V478 PolarHBondContact O-N 3.4Å; E475-L479 VanDerWaalsContact O-CB 3.28Å; E475-L479 WeakPolarHBondContact O-CB 3.38Å; E475-L479 PolarHBondContact O-N 3.16Å
476	Q	96	Very high	95.9	Very high	89 Å²	89	105.9 Å²	105.9	42%	0.416	49%	0.488	S	S	.	.	H	α-helix	trans	-62.6	-37.4	174.3	-77.4	-177.1	17	0	0	112.5	V472 R473 E474 R480	V472-Q476 WeakPolarHBondContact O-CB 3.41Å; V472-Q476 VanDerWaalsContact O-CG 3.27Å; V472-Q476 WeakPolarHBondContact O-CG 3.46Å; V472-Q476 PolarHBondContact O-N 3.19Å; R473-Q476 PolarHBondContact O-N 3.39Å; E474-Q476 VanDerWaalsContact C-N 3.32Å; E474-Q476 PolarHBondContact O-N 3.48Å; Q476-R480 VanDerWaalsContact O-CG 3.26Å; Q476-R480 WeakPolarHBondContact O-CG 3.43Å; Q476-R480 PolarHBondContact O-N 3.43Å
477	K	95.5	Very high	95.8	Very high	132 Å²	132	105.8 Å²	105.8	57%	0.574	48%	0.483	S	S	*	.	H	α-helix	trans	-65.8	-47.9	176.2	-173.2	-176	174.2	-170.8	0	110.8	R473 E474 E475 L479 R480 E481	R473-K477 PolarHBondContact O-N 3.37Å; E474-K477 WeakPolarHBondContact O-CA 3.26Å; E474-K477 WeakPolarHBondContact O-CB 3.28Å; E474-K477 PolarHBondContact O-N 2.82Å; E475-K477 VanDerWaalsContact C-N 3.32Å; E475-K477 PolarHBondContact O-N 2.99Å; K477-L479 VanDerWaalsContact C-N 3.32Å; K477-L479 PolarHBondContact O-N 3.37Å; K477-R480 WeakPolarHBondContact O-CB 3.49Å; K477-R480 PolarHBondContact O-N 2.9Å; K477-R480 VanDerWaalsContact O-N 3.16Å; K477-E481 WeakPolarHBondContact CE-OE1 3.49Å; K477-E481 PolarHBondContact O-N 3.43Å
478	V	95.4	Very high	95.7	Very high	75 Å²	75	106.8 Å²	106.8	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-59.3	-43.6	175.4	173.9	0	0	0	0	110.7	E474 E475 R480 E481 N482	E474-V478 WeakPolarHBondContact O-CG2 3.47Å; E474-V478 PolarHBondContact O-N 2.98Å; E475-V478 PolarHBondContact O-N 3.4Å; V478-R480 VanDerWaalsContact C-N 3.33Å; V478-R480 PolarHBondContact O-N 3.04Å; V478-E481 PolarHBondContact O-N 3Å; V478-N482 WeakPolarHBondContact O-CB 3.47Å; V478-N482 PolarHBondContact O-N 2.91Å
479	L	96	Very high	95.6	Very high	94 Å²	94	107.3 Å²	107.3	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-61.6	-40.3	176.7	-172.6	68.7	0	0	0	112	E475 K477 K483	E475-L479 VanDerWaalsContact O-CB 3.28Å; E475-L479 WeakPolarHBondContact O-CB 3.38Å; E475-L479 PolarHBondContact O-N 3.16Å; K477-L479 VanDerWaalsContact C-N 3.32Å; K477-L479 PolarHBondContact O-N 3.37Å; L479-K483 WeakPolarHBondContact O-CB 3.41Å; L479-K483 VanDerWaalsContact O-CG 3.31Å; L479-K483 WeakPolarHBondContact O-CG 3.38Å; L479-K483 PolarHBondContact O-N 3.45Å
480	R	95.3	Very high	95.5	Very high	152 Å²	152	109.7 Å²	109.7	57%	0.574	50%	0.498	S	S	*	.	H	α-helix	trans	-65.2	-41.7	175.3	-73.2	172.7	-164.8	177	6.8	111.8	Q476 K477 V478 K483 R484	Q476-R480 VanDerWaalsContact O-CG 3.26Å; Q476-R480 WeakPolarHBondContact O-CG 3.43Å; Q476-R480 PolarHBondContact O-N 3.43Å; K477-R480 WeakPolarHBondContact O-CB 3.49Å; K477-R480 PolarHBondContact O-N 2.9Å; K477-R480 VanDerWaalsContact O-N 3.16Å; V478-R480 VanDerWaalsContact C-N 3.33Å; V478-R480 PolarHBondContact O-N 3.04Å; R480-K483 PolarHBondContact O-N 3.42Å; R480-R484 WeakPolarHBondContact O-CG 3.45Å; R480-R484 PolarHBondContact O-N 3.5Å
481	E	95.8	Very high	95.4	Very high	79 Å²	79	110.5 Å²	110.5	37%	0.369	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-45.4	176.1	-72.6	176	-168.4	0	0	111.5	K477 V478 K483 R484 K485	K477-E481 WeakPolarHBondContact CE-OE1 3.49Å; K477-E481 PolarHBondContact O-N 3.43Å; V478-E481 PolarHBondContact O-N 3Å; E481-K483 VanDerWaalsContact C-N 3.35Å; E481-K483 PolarHBondContact O-N 2.87Å; E481-R484 WeakPolarHBondContact O-CB 3.45Å; E481-R484 PolarHBondContact O-N 2.87Å; E481-R484 VanDerWaalsContact O-N 3.1Å; E481-K485 WeakPolarHBondContact O-CG 3.38Å; E481-K485 PolarHBondContact O-N 2.85Å
482	N	95	Very high	95.2	Very high	83 Å²	83	109 Å²	109	44%	0.444	50%	0.498	S	S	.	.	H	α-helix	trans	-61.5	-41.8	175	-72.3	-11	0	0	0	111.7	V478 R484 K485 L486	V478-N482 WeakPolarHBondContact O-CB 3.47Å; V478-N482 PolarHBondContact O-N 2.91Å; N482-R484 VanDerWaalsContact C-N 3.31Å; N482-R484 PolarHBondContact O-N 3.1Å; N482-K485 PolarHBondContact O-N 3.22Å; N482-L486 WeakPolarHBondContact O-CB 3.32Å; N482-L486 PolarHBondContact O-N 3.42Å
483	K	95.6	Very high	94.9	Very high	114 Å²	114	109.4 Å²	109.4	50%	0.496	50%	0.498	S	S	.	.	H	α-helix	trans	-60.9	-37.8	173	-77.9	-178.2	179.4	-173.4	0	112.4	L479 R480 E481 R487	L479-K483 WeakPolarHBondContact O-CB 3.41Å; L479-K483 VanDerWaalsContact O-CG 3.31Å; L479-K483 WeakPolarHBondContact O-CG 3.38Å; L479-K483 PolarHBondContact O-N 3.45Å; R480-K483 PolarHBondContact O-N 3.42Å; E481-K483 VanDerWaalsContact C-N 3.35Å; E481-K483 PolarHBondContact O-N 2.87Å; K483-R487 WeakPolarHBondContact O-CB 3.31Å; K483-R487 WeakPolarHBondContact O-CG 3.32Å; K483-R487 PolarHBondContact O-N 3.33Å
484	R	95.3	Very high	94.6	Very high	161 Å²	161	106.5 Å²	106.5	61%	0.608	49%	0.493	S	S	*	.	H	α-helix	trans	-68.1	-46	175.3	-72.8	174.3	-173.4	167.8	0.5	111.5	R480 E481 N482 L486 R487 H488	R480-R484 WeakPolarHBondContact O-CG 3.45Å; R480-R484 PolarHBondContact O-N 3.5Å; E481-R484 WeakPolarHBondContact O-CB 3.45Å; E481-R484 PolarHBondContact O-N 2.87Å; E481-R484 VanDerWaalsContact O-N 3.1Å; N482-R484 VanDerWaalsContact C-N 3.31Å; N482-R484 PolarHBondContact O-N 3.1Å; R484-L486 VanDerWaalsContact C-N 3.34Å; R484-L486 PolarHBondContact O-N 2.99Å; R484-R487 PolarHBondContact O-N 3.23Å; R484-H488 WeakPolarHBondContact O-CB 3.44Å; R484-H488 PolarHBondContact O-N 3.41Å
485	K	95.4	Very high	94.3	Very high	138 Å²	138	107.5 Å²	107.5	60%	0.6	49%	0.492	S	S	*	.	H	α-helix	trans	-59.3	-45.5	176.1	-71.3	177.3	-178.8	176.1	0	111.3	E481 N482 H488 Q489	E481-K485 WeakPolarHBondContact O-CG 3.38Å; E481-K485 PolarHBondContact O-N 2.85Å; N482-K485 PolarHBondContact O-N 3.22Å; K485-H488 PolarHBondContact O-N 3.35Å; K485-Q489 WeakPolarHBondContact O-CB 3.45Å; K485-Q489 PolarHBondContact O-N 2.89Å
486	L	95.8	Very high	93.9	Very high	97 Å²	97	107.7 Å²	107.7	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-62.1	-44.7	176.5	-177.5	63.9	0	0	0	111.7	N482 R484 Q489 L490	N482-L486 WeakPolarHBondContact O-CB 3.32Å; N482-L486 PolarHBondContact O-N 3.42Å; R484-L486 VanDerWaalsContact C-N 3.34Å; R484-L486 PolarHBondContact O-N 2.99Å; L486-Q489 PolarHBondContact O-N 3.38Å; L486-L490 HydrophobicContact CG-CD1 4.25Å; L486-L490 WeakPolarHBondContact O-CB 3.46Å; L486-L490 VanDerWaalsContact O-CG 3.32Å; L486-L490 WeakPolarHBondContact O-CG 3.32Å; L486-L490 PolarHBondContact O-N 2.83Å
487	R	95.1	Very high	93.4	Very high	127 Å²	127	108.5 Å²	108.5	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-59.3	-46.6	173.7	-80.4	-170.2	-65.7	-92.4	0.8	112	K483 R484 Q489 L490 E491	K483-R487 WeakPolarHBondContact O-CB 3.31Å; K483-R487 WeakPolarHBondContact O-CG 3.32Å; K483-R487 PolarHBondContact O-N 3.33Å; R484-R487 PolarHBondContact O-N 3.23Å; R487-Q489 VanDerWaalsContact C-N 3.33Å; R487-Q489 PolarHBondContact O-N 3.44Å; R487-L490 PolarHBondContact O-N 3.29Å; R487-E491 WeakPolarHBondContact O-CB 3.49Å; R487-E491 WeakPolarHBondContact O-CG 3.42Å; R487-E491 PolarHBondContact O-N 2.91Å
488	H	94.4	Very high	92.9	Very high	107 Å²	107	107.3 Å²	107.3	50%	0.495	50%	0.495	S	S	.	.	H	α-helix	trans	-62	-41.2	178.5	-172.6	61.7	0	0	0	112.1	R484 K485 E491 M492	R484-H488 WeakPolarHBondContact O-CB 3.44Å; R484-H488 PolarHBondContact O-N 3.41Å; K485-H488 PolarHBondContact O-N 3.35Å; H488-E491 PolarHBondContact O-N 3.25Å; H488-M492 VanDerWaalsContact O-CG 3.32Å; H488-M492 WeakPolarHBondContact O-CG 3.32Å; H488-M492 PolarHBondContact O-N 2.86Å
489	Q	94.4	Very high	92.3	Very high	114 Å²	114	109.3 Å²	109.3	53%	0.533	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-43.3	175.1	-171.4	176.7	6.4	0	0	111.7	K485 L486 R487 M492 N493	K485-Q489 WeakPolarHBondContact O-CB 3.45Å; K485-Q489 PolarHBondContact O-N 2.89Å; L486-Q489 PolarHBondContact O-N 3.38Å; R487-Q489 VanDerWaalsContact C-N 3.33Å; R487-Q489 PolarHBondContact O-N 3.44Å; Q489-M492 PolarHBondContact O-N 2.88Å; Q489-N493 WeakPolarHBondContact O-CB 3.37Å; Q489-N493 PolarHBondContact O-N 2.96Å; Q489-N493 PolarHBondContact O-OD1 3.27Å
490	L	94.1	Very high	91.6	Very high	102 Å²	102	107.1 Å²	107.1	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-39.4	174.7	-71	171.7	0	0	0	112.1	L486 R487 N493 L494	L486-L490 HydrophobicContact CG-CD1 4.25Å; L486-L490 WeakPolarHBondContact O-CB 3.46Å; L486-L490 VanDerWaalsContact O-CG 3.32Å; L486-L490 WeakPolarHBondContact O-CG 3.32Å; L486-L490 PolarHBondContact O-N 2.83Å; R487-L490 PolarHBondContact O-N 3.29Å; L490-N493 PolarHBondContact O-N 2.85Å; L490-L494 VanDerWaalsContact O-CB 3.23Å; L490-L494 WeakPolarHBondContact O-CB 3.39Å; L490-L494 PolarHBondContact O-N 3.47Å
491	E	94	Very high	90.4	Very high	97 Å²	97	106.4 Å²	106.4	45%	0.453	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-39.7	174.8	-75.5	169.8	-165.1	0	0	112.2	R487 H488 L494 R495	R487-E491 WeakPolarHBondContact O-CB 3.49Å; R487-E491 WeakPolarHBondContact O-CG 3.42Å; R487-E491 PolarHBondContact O-N 2.91Å; H488-E491 PolarHBondContact O-N 3.25Å; E491-L494 PolarHBondContact O-N 2.87Å; E491-R495 WeakPolarHBondContact O-CG 3.36Å; E491-R495 PolarHBondContact O-N 3.49Å
492	M	92.6	Very high	89.1	Confident	75 Å²	75	108.2 Å²	108.2	37%	0.369	51%	0.508	S	S	.	.	H	α-helix	trans	-66.1	-48.1	174.2	-70.9	-64.2	95.2	0	0	111.4	H488 Q489 L494 R495 E496	H488-M492 VanDerWaalsContact O-CG 3.32Å; H488-M492 WeakPolarHBondContact O-CG 3.32Å; H488-M492 PolarHBondContact O-N 2.86Å; Q489-M492 PolarHBondContact O-N 2.88Å; M492-L494 PolarHBondContact O-N 3.32Å; M492-R495 PolarHBondContact O-N 2.82Å; M492-R495 VanDerWaalsContact O-N 3.15Å; M492-E496 WeakPolarHBondContact O-CB 3.35Å; M492-E496 PolarHBondContact O-N 3.15Å
493	N	90.8	Very high	87.9	Confident	68 Å²	68	110.8 Å²	110.8	36%	0.364	52%	0.521	S	S	.	.	H	α-helix	trans	-59.2	-38.4	175.7	-68.1	0.8	0	0	0	111.4	Q489 L490 E496 M497	Q489-N493 WeakPolarHBondContact O-CB 3.37Å; Q489-N493 PolarHBondContact O-N 2.96Å; Q489-N493 PolarHBondContact O-OD1 3.27Å; L490-N493 PolarHBondContact O-N 2.85Å; N493-E496 PolarHBondContact O-N 3.31Å; N493-M497 WeakPolarHBondContact O-CB 3.23Å; N493-M497 VanDerWaalsContact O-CG 3.3Å; N493-M497 WeakPolarHBondContact O-CG 3.4Å; N493-M497 PolarHBondContact O-N 2.9Å
494	L	89	Confident	86.1	Confident	89 Å²	89	110 Å²	110	47%	0.466	52%	0.522	S	S	.	.	H	α-helix	trans	-69.1	-38.6	177.7	-168.1	137.6	0	0	0	112	L490 E491 M492 M497 Q498	L490-L494 VanDerWaalsContact O-CB 3.23Å; L490-L494 WeakPolarHBondContact O-CB 3.39Å; L490-L494 PolarHBondContact O-N 3.47Å; E491-L494 PolarHBondContact O-N 2.87Å; M492-L494 PolarHBondContact O-N 3.32Å; L494-M497 HydrophobicContact CB-CE 4.44Å; L494-Q498 HydrophobicContact CD2-CG 4.39Å; L494-Q498 WeakPolarHBondContact O-CB 3.43Å; L494-Q498 VanDerWaalsContact O-CG 3.23Å; L494-Q498 WeakPolarHBondContact O-CG 3.22Å; L494-Q498 PolarHBondContact O-N 2.92Å
495	R	88.7	Confident	84.4	Confident	137 Å²	137	105.8 Å²	105.8	52%	0.517	53%	0.529	S	S	.	.	H	α-helix	trans	-65.5	-43.9	171.4	-75.3	-177.7	-148.5	-132.8	2.9	112.2	E491 M492 M497 Q498 E499	E491-R495 WeakPolarHBondContact O-CG 3.36Å; E491-R495 PolarHBondContact O-N 3.49Å; M492-R495 PolarHBondContact O-N 2.82Å; M492-R495 VanDerWaalsContact O-N 3.15Å; R495-M497 VanDerWaalsContact C-N 3.33Å; R495-M497 PolarHBondContact O-N 3.23Å; R495-Q498 CarbonylContact O-C 3.58Å; R495-Q498 WeakPolarHBondContact O-CB 3.33Å; R495-Q498 PolarHBondContact O-N 3.5Å; R495-Q498 VanDerWaalsContact O-N 3.14Å; R495-E499 WeakPolarHBondContact O-CG 3.31Å; R495-E499 PolarHBondContact O-N 3.38Å
496	E	88	Confident	82.7	Confident	132 Å²	132	103.9 Å²	103.9	62%	0.617	53%	0.526	S	S	*	.	H	α-helix	trans	-61.2	-43.2	176.9	-173.3	179	-171.3	0	0	110.8	M492 N493 E499 A500	M492-E496 WeakPolarHBondContact O-CB 3.35Å; M492-E496 PolarHBondContact O-N 3.15Å; N493-E496 PolarHBondContact O-N 3.31Å; E496-E499 PolarHBondContact O-N 2.78Å; E496-A500 WeakPolarHBondContact O-CB 3.4Å; E496-A500 PolarHBondContact O-N 3.35Å
497	M	85.9	Confident	81	Confident	106 Å²	106	100.2 Å²	100.2	52%	0.522	51%	0.508	S	S	.	.	H	α-helix	trans	-60.7	-45.1	171.7	-76.4	-173	-67.6	0	0	111.7	N493 L494 R495 A500 F501	N493-M497 WeakPolarHBondContact O-CB 3.23Å; N493-M497 VanDerWaalsContact O-CG 3.3Å; N493-M497 WeakPolarHBondContact O-CG 3.4Å; N493-M497 PolarHBondContact O-N 2.9Å; L494-M497 HydrophobicContact CB-CE 4.44Å; R495-M497 VanDerWaalsContact C-N 3.33Å; R495-M497 PolarHBondContact O-N 3.23Å; M497-A500 PolarHBondContact O-N 3.09Å; M497-F501 HydrophobicContact CB-CE2 4.45Å; M497-F501 WeakPolarHBondContact O-CD2 3.33Å; M497-F501 PolarHBondContact O-N 3.5Å
498	Q	83.8	Confident	79.5	Confident	107 Å²	107	97.3 Å²	97.3	50%	0.5	51%	0.512	S	S	.	.	H	α-helix	trans	-62.2	-41.7	177	-76	173.3	-20.9	0	0	112.5	L494 R495 F501 L502	L494-Q498 HydrophobicContact CD2-CG 4.39Å; L494-Q498 WeakPolarHBondContact O-CB 3.43Å; L494-Q498 VanDerWaalsContact O-CG 3.23Å; L494-Q498 WeakPolarHBondContact O-CG 3.22Å; L494-Q498 PolarHBondContact O-N 2.92Å; R495-Q498 CarbonylContact O-C 3.58Å; R495-Q498 WeakPolarHBondContact O-CB 3.33Å; R495-Q498 PolarHBondContact O-N 3.5Å; R495-Q498 VanDerWaalsContact O-N 3.14Å; Q498-F501 PolarHBondContact O-N 2.9Å; Q498-L502 WeakPolarHBondContact O-CG 3.35Å; Q498-L502 PolarHBondContact O-N 3.3Å
499	E	82.7	Confident	78.2	Confident	117 Å²	117	97.5 Å²	97.5	55%	0.547	51%	0.512	S	S	.	.	H	α-helix	trans	-66.5	-40.2	175.4	-76.1	179.1	-169.7	0	0	111.6	R495 E496 F501 L502 N503	R495-E499 WeakPolarHBondContact O-CG 3.31Å; R495-E499 PolarHBondContact O-N 3.38Å; E496-E499 PolarHBondContact O-N 2.78Å; E499-F501 VanDerWaalsContact C-N 3.33Å; E499-F501 PolarHBondContact O-N 3.28Å; E499-L502 PolarHBondContact O-N 3.33Å; E499-N503 WeakPolarHBondContact O-CB 3.23Å; E499-N503 PolarHBondContact O-N 3.14Å; E499-N503 PolarHBondContact O-ND2 2.93Å
500	A	81.2	Confident	76.9	Confident	48 Å²	48	96.9 Å²	96.9	40%	0.397	51%	0.508	S	S	.	.	H	α-helix	trans	-61.4	-40.7	173	0	0	0	0	0	111.7	E496 M497 L502 N504	E496-A500 WeakPolarHBondContact O-CB 3.4Å; E496-A500 PolarHBondContact O-N 3.35Å; M497-A500 PolarHBondContact O-N 3.09Å; A500-L502 VanDerWaalsContact C-N 3.33Å; A500-L502 PolarHBondContact O-N 3.01Å; A500-N504 WeakPolarHBondContact O-CB 3.36Å; A500-N504 VanDerWaalsContact O-CG 3.22Å; A500-N504 PolarHBondContact O-N 2.93Å; A500-N504 VanDerWaalsContact O-N 3.13Å; A500-N504 PolarHBondContact O-ND2 2.77Å; A500-N504 VanDerWaalsContact O-ND2 3.12Å
501	F	70.5	Confident	75.8	Confident	136 Å²	136	99.5 Å²	99.5	60%	0.596	51%	0.511	S	S	*	.	H	α-helix	trans	-66	-31.9	173.9	-77.3	-60.6	0	0	0	113.3	M497 Q498 E499	M497-F501 HydrophobicContact CB-CE2 4.45Å; M497-F501 WeakPolarHBondContact O-CD2 3.33Å; M497-F501 PolarHBondContact O-N 3.5Å; Q498-F501 PolarHBondContact O-N 2.9Å; E499-F501 VanDerWaalsContact C-N 3.33Å; E499-F501 PolarHBondContact O-N 3.28Å
502	L	69.7	Low	74.8	Confident	118 Å²	118	100.1 Å²	100.1	62%	0.618	51%	0.514	S	S	*	.	H	α-helix	trans	-80.3	-36.3	178.6	-73.1	169.7	0	0	0	113.3	Q498 E499 A500	Q498-L502 WeakPolarHBondContact O-CG 3.35Å; Q498-L502 PolarHBondContact O-N 3.3Å; E499-L502 PolarHBondContact O-N 3.33Å; A500-L502 VanDerWaalsContact C-N 3.33Å; A500-L502 PolarHBondContact O-N 3.01Å
503	N	68.3	Low	74	Confident	136 Å²	136	101.2 Å²	101.2	73%	0.727	52%	0.518	S	S	*	.	H	α-helix	trans	-84.2	-20.3	-177.3	-72.8	-29	0	0	0	113.6	E499 G505	E499-N503 WeakPolarHBondContact O-CB 3.23Å; E499-N503 PolarHBondContact O-N 3.14Å; E499-N503 PolarHBondContact O-ND2 2.93Å; N503-G505 PolarHBondContact O-N 2.89Å
504	N	59.3	Low	73.3	Confident	97 Å²	97	102.7 Å²	102.7	52%	0.519	53%	0.526	S	S	.	.	S	Bend	trans	-69	124.8	169.9	-76.2	-26.3	0	0	0	109.5	A500 D506 S507	A500-N504 WeakPolarHBondContact O-CB 3.36Å; A500-N504 VanDerWaalsContact O-CG 3.22Å; A500-N504 PolarHBondContact O-N 2.93Å; A500-N504 VanDerWaalsContact O-N 3.13Å; A500-N504 PolarHBondContact O-ND2 2.77Å; A500-N504 VanDerWaalsContact O-ND2 3.12Å; N504-D506 PolarHBondContact O-N 3.48Å; N504-S507 PolarHBondContact O-N 2.8Å
505	G	59.2	Low	72.5	Confident	73 Å²	73	100.7 Å²	100.7	75%	0.753	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-6.9	178.9	0	0	0	0	0	115	N503 S507	N503-G505 PolarHBondContact O-N 2.89Å; G505-S507 PolarHBondContact O-N 3.47Å
506	D	58.7	Low	71.8	Confident	98 Å²	98	100.2 Å²	100.2	52%	0.524	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-3.5	171.7	-69.6	-23.8	0	0	0	113.9	N504 A508 H509 F510	N504-D506 PolarHBondContact O-N 3.48Å; D506-A508 PolarHBondContact O-N 3.38Å; D506-H509 WeakPolarHBondContact O-CA 3.46Å; D506-H509 WeakPolarHBondContact O-CB 3.43Å; D506-H509 PolarHBondContact O-N 2.86Å; D506-F510 HydrophobicContact CB-CD2 3.88Å; D506-F510 HydrophobicContact CB-CE2 3.62Å; D506-F510 VanDerWaalsContact O-CD2 3.27Å; D506-F510 WeakPolarHBondContact O-CD2 3.3Å; D506-F510 PolarHBondContact O-N 2.82Å
507	S	59.8	Low	71.1	Confident	21 Å²	21	99.3 Å²	99.3	15%	0.147	52%	0.521	C	S	.	.	H	α-helix	trans	-60.5	-19.8	178.1	75.7	0	0	0	0	113.5	N504 G505 R511	N504-S507 PolarHBondContact O-N 2.8Å; G505-S507 PolarHBondContact O-N 3.47Å; S507-R511 VanDerWaalsContact O-CB 3.26Å; S507-R511 WeakPolarHBondContact O-CB 3.4Å; S507-R511 WeakPolarHBondContact O-CG 3.46Å; S507-R511 PolarHBondContact O-N 3.33Å; S507-R511 PolarHBondContact O-NE 3.43Å; S507-R511 PolarHBondContact OG-NH2 2.9Å
508	A	63.8	Low	70.3	Confident	66 Å²	66	100 Å²	100	55%	0.545	53%	0.526	S	S	.	.	H	α-helix	trans	-74.1	-42.7	169.3	0	0	0	0	0	111.7	D506 R511 E512	D506-A508 PolarHBondContact O-N 3.38Å; A508-R511 PolarHBondContact O-N 2.87Å; A508-E512 WeakPolarHBondContact O-CB 3.48Å; A508-E512 PolarHBondContact O-N 2.77Å
509	H	67.1	Low	69.6	Low	111 Å²	111	101 Å²	101	51%	0.514	53%	0.534	S	S	.	.	H	α-helix	trans	-64.2	-46.6	178.4	-173.8	-72.4	0	0	0	111.5	D506 E512 Q513	D506-H509 WeakPolarHBondContact O-CA 3.46Å; D506-H509 WeakPolarHBondContact O-CB 3.43Å; D506-H509 PolarHBondContact O-N 2.86Å; H509-E512 PolarHBondContact O-N 3.29Å; H509-Q513 PolarHBondContact CE1-OE1 2.94Å; H509-Q513 VanDerWaalsContact CE1-OE1 3.26Å; H509-Q513 WeakPolarHBondContact O-CB 3.21Å; H509-Q513 PolarHBondContact O-N 2.91Å
510	F	68.7	Low	68.8	Low	101 Å²	101	98.2 Å²	98.2	44%	0.443	53%	0.531	S	S	.	.	H	α-helix	trans	-67.7	-37.7	177.7	-68.3	-67	0	0	0	112.4	D506 Q513 D514	D506-F510 HydrophobicContact CB-CD2 3.88Å; D506-F510 HydrophobicContact CB-CE2 3.62Å; D506-F510 VanDerWaalsContact O-CD2 3.27Å; D506-F510 WeakPolarHBondContact O-CD2 3.3Å; D506-F510 PolarHBondContact O-N 2.82Å; F510-Q513 PolarHBondContact O-N 3.37Å; F510-D514 WeakPolarHBondContact O-CB 3.5Å; F510-D514 PolarHBondContact O-N 2.86Å
511	R	71.1	Confident	67.9	Low	157 Å²	157	97.5 Å²	97.5	59%	0.592	52%	0.523	S	S	*	.	H	α-helix	trans	-66.2	-36.4	174.4	-78.3	-176.4	-84.8	-152.9	-1.4	112.8	S507 A508 A515	S507-R511 VanDerWaalsContact O-CB 3.26Å; S507-R511 WeakPolarHBondContact O-CB 3.4Å; S507-R511 WeakPolarHBondContact O-CG 3.46Å; S507-R511 PolarHBondContact O-N 3.33Å; S507-R511 PolarHBondContact O-NE 3.43Å; S507-R511 PolarHBondContact OG-NH2 2.9Å; A508-R511 PolarHBondContact O-N 2.87Å; R511-A515 WeakPolarHBondContact O-CB 3.47Å; R511-A515 PolarHBondContact O-N 3.44Å
512	E	71.4	Confident	67.3	Low	109 Å²	109	97.1 Å²	97.1	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-68.5	-39.3	173.2	-167.2	-172.2	153.7	0	0	111.6	A508 H509 A515 K516	A508-E512 WeakPolarHBondContact O-CB 3.48Å; A508-E512 PolarHBondContact O-N 2.77Å; H509-E512 PolarHBondContact O-N 3.29Å; E512-A515 PolarHBondContact O-N 2.78Å; E512-K516 WeakPolarHBondContact O-CB 3.44Å; E512-K516 WeakPolarHBondContact O-CG 3.18Å; E512-K516 PolarHBondContact O-N 3.17Å; E512-K516 WeakPolarHBondContact OE1-CE 3.26Å; E512-K516 IonicContact OE1-NZ 3.61Å; E512-K516 PolarHBondContact OE1-NZ 2.92Å
513	Q	76.1	Confident	66.7	Low	98 Å²	98	98 Å²	98	46%	0.458	53%	0.533	S	S	.	.	H	α-helix	trans	-70.1	-39.4	177.5	-167.5	164.3	-6	0	0	112.3	H509 F510 K516 M517	H509-Q513 PolarHBondContact CE1-OE1 2.94Å; H509-Q513 VanDerWaalsContact CE1-OE1 3.26Å; H509-Q513 WeakPolarHBondContact O-CB 3.21Å; H509-Q513 PolarHBondContact O-N 2.91Å; F510-Q513 PolarHBondContact O-N 3.37Å; Q513-K516 WeakPolarHBondContact O-CB 3.22Å; Q513-K516 PolarHBondContact O-N 3.48Å; Q513-M517 WeakPolarHBondContact O-CB 2.99Å; Q513-M517 WeakPolarHBondContact O-CG 3.4Å; Q513-M517 PolarHBondContact O-N 3.47Å
514	D	75.3	Confident	66.3	Low	100 Å²	100	98 Å²	98	54%	0.535	53%	0.533	S	S	.	.	H	α-helix	trans	-66.5	-38.5	171.8	-81.4	-9.6	0	0	0	111.4	F510 M517 L518	F510-D514 WeakPolarHBondContact O-CB 3.5Å; F510-D514 PolarHBondContact O-N 2.86Å; D514-M517 PolarHBondContact O-N 3.26Å; D514-L518 WeakPolarHBondContact O-CB 3.4Å; D514-L518 WeakPolarHBondContact O-CG 3.34Å; D514-L518 PolarHBondContact O-N 3.12Å
515	A	73.5	Confident	66	Low	46 Å²	46	101.3 Å²	101.3	38%	0.38	54%	0.543	S	S	.	.	H	α-helix	trans	-64.2	-41.1	172.6	0	0	0	0	0	111.6	R511 E512 L518 L519	R511-A515 WeakPolarHBondContact O-CB 3.47Å; R511-A515 PolarHBondContact O-N 3.44Å; E512-A515 PolarHBondContact O-N 2.78Å; A515-L518 PolarHBondContact O-N 3.13Å; A515-L519 VanDerWaalsContact O-CB 3.31Å; A515-L519 WeakPolarHBondContact O-CB 3.37Å; A515-L519 WeakPolarHBondContact O-CG 3.35Å; A515-L519 PolarHBondContact O-N 2.88Å
516	K	74	Confident	65.5	Low	128 Å²	128	105.9 Å²	105.9	56%	0.557	55%	0.549	S	S	*	.	H	α-helix	trans	-62.7	-41.3	171.9	-78.8	172.3	-175.1	159.3	0	111.7	E512 Q513 A520	E512-K516 WeakPolarHBondContact O-CB 3.44Å; E512-K516 WeakPolarHBondContact O-CG 3.18Å; E512-K516 PolarHBondContact O-N 3.17Å; E512-K516 WeakPolarHBondContact OE1-CE 3.26Å; E512-K516 IonicContact OE1-NZ 3.61Å; E512-K516 PolarHBondContact OE1-NZ 2.92Å; Q513-K516 WeakPolarHBondContact O-CB 3.22Å; Q513-K516 PolarHBondContact O-N 3.48Å; K516-A520 WeakPolarHBondContact O-CB 3.39Å; K516-A520 PolarHBondContact O-N 3.4Å
517	M	72.7	Confident	65.3	Low	113 Å²	113	106.2 Å²	106.2	56%	0.557	56%	0.558	S	S	*	*	H	α-helix	trans	-66.5	-43.8	176.7	-85.6	-63.6	-43.8	0	0	112.5	Q513 D514 A520 S521	Q513-M517 WeakPolarHBondContact O-CB 2.99Å; Q513-M517 WeakPolarHBondContact O-CG 3.4Å; Q513-M517 PolarHBondContact O-N 3.47Å; D514-M517 PolarHBondContact O-N 3.26Å; M517-A520 CarbonylContact O-C 3.6Å; M517-A520 PolarHBondContact O-N 2.72Å; M517-S521 WeakPolarHBondContact O-CB 3.34Å; M517-S521 PolarHBondContact O-N 2.96Å
518	L	70.3	Confident	64.6	Low	121 Å²	121	112.8 Å²	112.8	63%	0.634	59%	0.591	S	S	*	*	H	α-helix	trans	-66.6	-40.7	176.7	-78.2	166.3	0	0	0	111.2	D514 A515 A520 S521 N522	D514-L518 WeakPolarHBondContact O-CB 3.4Å; D514-L518 WeakPolarHBondContact O-CG 3.34Å; D514-L518 PolarHBondContact O-N 3.12Å; A515-L518 PolarHBondContact O-N 3.13Å; L518-A520 VanDerWaalsContact C-N 3.32Å; L518-A520 PolarHBondContact O-N 3.26Å; L518-S521 PolarHBondContact O-N 3.33Å; L518-N522 WeakPolarHBondContact O-CB 3.44Å; L518-N522 PolarHBondContact O-N 2.89Å
519	L	68.9	Low	63.8	Low	128 Å²	128	117.9 Å²	117.9	67%	0.67	61%	0.607	S	S	*	*	H	α-helix	trans	-67.4	-32.1	173.9	-71.3	170	0	0	0	112.4	A515	A515-L519 VanDerWaalsContact O-CB 3.31Å; A515-L519 WeakPolarHBondContact O-CB 3.37Å; A515-L519 WeakPolarHBondContact O-CG 3.35Å; A515-L519 PolarHBondContact O-N 2.88Å
520	A	64.9	Low	62.5	Low	58 Å²	58	125.9 Å²	125.9	48%	0.479	64%	0.641	S	S	.	*	H	α-helix	trans	-76.7	-33	174	0	0	0	0	0	113	K516 M517 L518	K516-A520 WeakPolarHBondContact O-CB 3.39Å; K516-A520 PolarHBondContact O-N 3.4Å; M517-A520 CarbonylContact O-C 3.6Å; M517-A520 PolarHBondContact O-N 2.72Å; L518-A520 VanDerWaalsContact C-N 3.32Å; L518-A520 PolarHBondContact O-N 3.26Å
521	S	62.4	Low	62.2	Low	33 Å²	33	127.2 Å²	127.2	23%	0.231	65%	0.651	C	S	.	*	H	α-helix	trans	-83.4	-27.7	-179.6	111.4	0	0	0	0	112.6	M517 L518 N523 N524 F525	M517-S521 WeakPolarHBondContact O-CB 3.34Å; M517-S521 PolarHBondContact O-N 2.96Å; L518-S521 PolarHBondContact O-N 3.33Å; S521-N523 PolarHBondContact O-N 3.06Å; S521-N523 VanDerWaalsContact O-N 3.09Å; S521-N524 PolarHBondContact O-N 3.41Å; S521-F525 WeakPolarHBondContact O-CD2 3.39Å; S521-F525 PolarHBondContact O-N 3.03Å; S521-F525 WeakPolarHBondContact OG-CD2 3.45Å; S521-F525 WeakPolarHBondContact OG-CE2 3.27Å
522	N	57.6	Low	61.7	Low	127 Å²	127	125.6 Å²	125.6	68%	0.679	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-17.9	176.5	-135.7	11	0	0	0	113.2	L518	L518-N522 WeakPolarHBondContact O-CB 3.44Å; L518-N522 PolarHBondContact O-N 2.89Å
523	N	57.8	Low	61.2	Low	138 Å²	138	126.5 Å²	126.5	74%	0.738	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-4.6	172.7	-68.4	-28	0	0	0	113.9	S521	S521-N523 PolarHBondContact O-N 3.06Å; S521-N523 VanDerWaalsContact O-N 3.09Å
524	N	58.8	Low	60.3	Low	135 Å²	135	128.2 Å²	128.2	72%	0.722	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	-5.4	-177	-81.8	-15.9	0	0	0	115.1	S521 L526	S521-N524 PolarHBondContact O-N 3.41Å; N524-L526 VanDerWaalsContact C-N 3.31Å; N524-L526 PolarHBondContact O-N 2.87Å
525	F	53.5	Low	59.3	Low	166 Å²	166	129.9 Å²	129.9	73%	0.728	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	10.2	-178	-94.5	-80.8	0	0	0	115.3	S521 C527	S521-F525 WeakPolarHBondContact O-CD2 3.39Å; S521-F525 PolarHBondContact O-N 3.03Å; S521-F525 WeakPolarHBondContact OG-CD2 3.45Å; S521-F525 WeakPolarHBondContact OG-CE2 3.27Å; F525-C527 VanDerWaalsContact C-N 3.33Å; F525-C527 PolarHBondContact O-N 3.37Å
526	L	49.4	Very low	58.4	Low	170 Å²	170	135.5 Å²	135.5	89%	0.89	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	7.5	-179.5	-137.4	102.8	0	0	0	115.1	N524	N524-L526 VanDerWaalsContact C-N 3.31Å; N524-L526 PolarHBondContact O-N 2.87Å
527	C	53.6	Low	57.3	Low	105 Å²	105	136.1 Å²	136.1	71%	0.709	71%	0.713	S	S	*	*	S	Bend	trans	-108.6	-24.8	-168.8	-78.4	0	0	0	0	118.6	F525	F525-C527 VanDerWaalsContact C-N 3.33Å; F525-C527 PolarHBondContact O-N 3.37Å
528	D	46.4	Very low	56.1	Low	159 Å²	159	137.8 Å²	137.8	85%	0.85	73%	0.725	S	S	*	*			trans	-135.1	80	-171.1	-70.6	-46.5	0	0	0	113.6
529	I	46.3	Very low	54.9	Low	172 Å²	172	139.3 Å²	139.3	88%	0.882	73%	0.733	S	S	*	*			trans	-114.4	92.8	148.9	-61.5	176.1	0	0	0	106.2
530	K	39.4	Very low	53.6	Low	280 Å²	280	140.3 Å²	140.3	100%	1.217	74%	0.739	S	S	*	*			trans	-158.4	0	156.1	-108.5	-176.2	-172.8	179.4	0	110.8

Retrieved 530 of 530 residues in 330.1 ms (Link to these results)

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