A0A3Q0KTH0_SCHMA Loading...

Integrase catalytic domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTH0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 745 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	51.4	Low	59.6	Low	181 Å²	181	96.4 Å²	96.4	89%	0.892	53%	0.534	S	S	*	.				0	-52.4	0	-71.7	-176.9	179.1	0	0	112.7	S3 C4 A5	M1-S3 VanDerWaalsContact C-N 3.31Å; M1-S3 PolarHBondContact O-N 3.4Å; M1-S3 VanDerWaalsContact O-N 3.15Å; M1-C4 WeakPolarHBondContact O-CA 3.38Å; M1-C4 VanDerWaalsContact O-CB 3.3Å; M1-C4 WeakPolarHBondContact O-CB 3.5Å; M1-C4 PolarHBondContact O-N 2.88Å; M1-A5 PolarHBondContact O-N 2.97Å; M1-A5 VanDerWaalsContact O-N 3.08Å
2	R	45	Very low	59.5	Low	90 Å²	90	98.2 Å²	98.2	34%	0.34	54%	0.538	S	S	.	.	H	α-helix	trans	-45.9	-46.6	-178	-138.3	-177.2	-159.4	115.1	5.2	114.9	C4 A5 L6 Y48 E55	R2-C4 VanDerWaalsContact C-N 3.32Å; R2-C4 PolarHBondContact O-N 3.02Å; R2-A5 PolarHBondContact O-N 3.18Å; R2-L6 PolarHBondContact O-N 3.15Å; R2-Y48 PolarHBondContact NH2-OH 3.01Å; R2-E55 IonicContact CZ-OE2 3.48Å; R2-E55 VanDerWaalsContact NH1-CD 3.26Å; R2-E55 IonicContact NH1-OE1 3.72Å; R2-E55 PolarHBondContact NH1-OE1 3Å; R2-E55 VanDerWaalsContact NH1-OE1 3.15Å; R2-E55 IonicContact NH1-OE2 2.59Å; R2-E55 PolarHBondContact NH1-OE2 3.03Å; R2-E55 IonicContact NH2-OE2 3.72Å
3	S	56.5	Low	59.5	Low	84 Å²	84	103.5 Å²	103.5	59%	0.587	55%	0.547	S	S	*	.	H	α-helix	trans	-62.8	-32.7	175.8	-40.9	0	0	0	0	114	M1 L7	M1-S3 VanDerWaalsContact C-N 3.31Å; M1-S3 PolarHBondContact O-N 3.4Å; M1-S3 VanDerWaalsContact O-N 3.15Å; S3-L7 VanDerWaalsContact O-CB 3.29Å; S3-L7 WeakPolarHBondContact O-CB 3.37Å; S3-L7 WeakPolarHBondContact O-CD1 3.29Å; S3-L7 WeakPolarHBondContact O-CG 3.38Å; S3-L7 PolarHBondContact O-N 3.12Å
4	C	58.6	Low	59.4	Low	87 Å²	87	103.6 Å²	103.6	59%	0.588	55%	0.554	S	S	*	*	H	α-helix	trans	-73.3	-37.8	176.7	-49.1	0	0	0	0	111.2	M1 R2 F8	M1-C4 WeakPolarHBondContact O-CA 3.38Å; M1-C4 VanDerWaalsContact O-CB 3.3Å; M1-C4 WeakPolarHBondContact O-CB 3.5Å; M1-C4 PolarHBondContact O-N 2.88Å; R2-C4 VanDerWaalsContact C-N 3.32Å; R2-C4 PolarHBondContact O-N 3.02Å; C4-F8 WeakPolarHBondContact O-CB 3.34Å; C4-F8 PolarHBondContact O-N 3.26Å
5	A	61.7	Low	58.6	Low	50 Å²	50	104 Å²	104	41%	0.413	56%	0.556	S	S	.	*	H	α-helix	trans	-67	-43.8	174.4	0	0	0	0	0	111.4	M1 R2 F8 V9	M1-A5 PolarHBondContact O-N 2.97Å; M1-A5 VanDerWaalsContact O-N 3.08Å; R2-A5 PolarHBondContact O-N 3.18Å; A5-F8 PolarHBondContact O-N 3.35Å; A5-V9 WeakPolarHBondContact O-CG2 3.39Å; A5-V9 PolarHBondContact O-N 3.3Å
6	L	65.2	Low	58	Low	103 Å²	103	104.6 Å²	104.6	54%	0.539	57%	0.565	S	S	.	*	H	α-helix	trans	-60.7	-48.6	172.7	-75.5	167	0	0	0	111.5	R2 F8 V9 D10	R2-L6 PolarHBondContact O-N 3.15Å; L6-F8 PolarHBondContact O-N 3.02Å; L6-V9 PolarHBondContact O-N 2.93Å; L6-V9 VanDerWaalsContact O-N 3.15Å; L6-D10 WeakPolarHBondContact O-CB 3.43Å; L6-D10 PolarHBondContact O-N 3.42Å
7	L	64.8	Low	57.1	Low	120 Å²	120	107.1 Å²	107.1	63%	0.628	58%	0.578	S	S	*	*	H	α-helix	trans	-60.4	-30.4	175.1	-76.2	168.4	0	0	0	113.3	S3 A11	S3-L7 VanDerWaalsContact O-CB 3.29Å; S3-L7 WeakPolarHBondContact O-CB 3.37Å; S3-L7 WeakPolarHBondContact O-CD1 3.29Å; S3-L7 WeakPolarHBondContact O-CG 3.38Å; S3-L7 PolarHBondContact O-N 3.12Å; L7-A11 WeakPolarHBondContact O-CB 3.44Å; L7-A11 PolarHBondContact O-N 3.26Å
8	F	63.3	Low	56.4	Low	146 Å²	146	112.2 Å²	112.2	64%	0.64	59%	0.589	S	S	*	*	H	α-helix	trans	-75.5	-38.5	175.8	-157.7	-87.4	0	0	0	112	C4 A5 L6 A11 M12	C4-F8 WeakPolarHBondContact O-CB 3.34Å; C4-F8 PolarHBondContact O-N 3.26Å; A5-F8 PolarHBondContact O-N 3.35Å; L6-F8 PolarHBondContact O-N 3.02Å; F8-A11 PolarHBondContact O-N 2.87Å; F8-M12 HydrophobicContact CD1-CG 4.04Å; F8-M12 HydrophobicContact CE1-CG 4.01Å; F8-M12 HydrophobicContact CE1-SD 4.26Å; F8-M12 WeakPolarHBondContact O-CB 3.27Å; F8-M12 WeakPolarHBondContact O-CG 3.27Å; F8-M12 PolarHBondContact O-N 3.09Å
9	V	64.2	Low	55.6	Low	61 Å²	61	112.6 Å²	112.6	37%	0.37	59%	0.592	S	S	.	*	H	α-helix	trans	-66	-48.2	172.3	172.9	0	0	0	0	110.4	A5 L6 A11 M12 Y13	A5-V9 WeakPolarHBondContact O-CG2 3.39Å; A5-V9 PolarHBondContact O-N 3.3Å; L6-V9 PolarHBondContact O-N 2.93Å; L6-V9 VanDerWaalsContact O-N 3.15Å; V9-A11 VanDerWaalsContact C-N 3.31Å; V9-A11 PolarHBondContact O-N 2.89Å; V9-M12 WeakPolarHBondContact O-CB 3.37Å; V9-M12 PolarHBondContact O-N 2.98Å; V9-M12 VanDerWaalsContact O-N 3.12Å; V9-Y13 HydrophobicContact CG1-CD2 3.82Å; V9-Y13 HydrophobicContact CG1-CE2 3.98Å; V9-Y13 WeakPolarHBondContact O-CD2 3.48Å; V9-Y13 PolarHBondContact O-N 3.06Å
10	D	63.9	Low	54.7	Low	90 Å²	90	114.8 Å²	114.8	48%	0.481	60%	0.599	S	S	.	*	H	α-helix	trans	-60.2	-39.8	175.6	-72.5	-26.6	0	0	0	111.3	L6 Y13 T14	L6-D10 WeakPolarHBondContact O-CB 3.43Å; L6-D10 PolarHBondContact O-N 3.42Å; D10-Y13 PolarHBondContact O-N 3.11Å; D10-T14 VanDerWaalsContact O-CB 3.31Å; D10-T14 WeakPolarHBondContact O-CB 3.23Å; D10-T14 VanDerWaalsContact O-CG2 3.29Å; D10-T14 WeakPolarHBondContact O-CG2 3.44Å; D10-T14 PolarHBondContact O-N 3.2Å; D10-T14 PolarHBondContact O-OG1 3.09Å
11	A	61.1	Low	54	Low	48 Å²	48	117 Å²	117	40%	0.397	61%	0.61	S	S	.	*	H	α-helix	trans	-62.2	-44.6	172.7	0	0	0	0	0	112.1	L7 F8 V9 Y13 T14 N15	L7-A11 WeakPolarHBondContact O-CB 3.44Å; L7-A11 PolarHBondContact O-N 3.26Å; F8-A11 PolarHBondContact O-N 2.87Å; V9-A11 VanDerWaalsContact C-N 3.31Å; V9-A11 PolarHBondContact O-N 2.89Å; A11-Y13 VanDerWaalsContact C-N 3.27Å; A11-Y13 PolarHBondContact O-N 3.07Å; A11-T14 PolarHBondContact O-N 3.47Å; A11-N15 WeakPolarHBondContact O-CB 3.49Å; A11-N15 PolarHBondContact O-N 3.02Å
12	M	58.3	Low	53.3	Low	118 Å²	118	113.7 Å²	113.7	58%	0.581	60%	0.602	S	S	*	*	H	α-helix	trans	-62.6	-32.6	176.2	-70.3	-82.2	-78.8	0	0	112.5	F8 V9	F8-M12 HydrophobicContact CD1-CG 4.04Å; F8-M12 HydrophobicContact CE1-CG 4.01Å; F8-M12 HydrophobicContact CE1-SD 4.26Å; F8-M12 WeakPolarHBondContact O-CB 3.27Å; F8-M12 WeakPolarHBondContact O-CG 3.27Å; F8-M12 PolarHBondContact O-N 3.09Å; V9-M12 WeakPolarHBondContact O-CB 3.37Å; V9-M12 PolarHBondContact O-N 2.98Å; V9-M12 VanDerWaalsContact O-N 3.12Å
13	Y	59.1	Low	52.9	Low	168 Å²	168	115.5 Å²	115.5	66%	0.659	63%	0.628	S	S	*	*	H	α-helix	trans	-84.2	-26.5	176.3	-86.6	-81.8	0	0	0	114.4	V9 D10 A11	V9-Y13 HydrophobicContact CG1-CD2 3.82Å; V9-Y13 HydrophobicContact CG1-CE2 3.98Å; V9-Y13 WeakPolarHBondContact O-CD2 3.48Å; V9-Y13 PolarHBondContact O-N 3.06Å; D10-Y13 PolarHBondContact O-N 3.11Å; A11-Y13 VanDerWaalsContact C-N 3.27Å; A11-Y13 PolarHBondContact O-N 3.07Å
14	T	58.4	Low	51.8	Low	104 Å²	104	117.7 Å²	117.7	64%	0.638	64%	0.641	S	S	*	*	H	α-helix	trans	-94.5	-18.8	-177.6	53.2	0	0	0	0	114.4	D10 A11 T16	D10-T14 VanDerWaalsContact O-CB 3.31Å; D10-T14 WeakPolarHBondContact O-CB 3.23Å; D10-T14 VanDerWaalsContact O-CG2 3.29Å; D10-T14 WeakPolarHBondContact O-CG2 3.44Å; D10-T14 PolarHBondContact O-N 3.2Å; D10-T14 PolarHBondContact O-OG1 3.09Å; A11-T14 PolarHBondContact O-N 3.47Å; T14-T16 PolarHBondContact O-N 2.82Å
15	N	48.4	Very low	50.6	Low	110 Å²	110	119 Å²	119	59%	0.588	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	21.8	-178.4	-159	23.9	0	0	0	114.3	A11 N17	A11-N15 WeakPolarHBondContact O-CB 3.49Å; A11-N15 PolarHBondContact O-N 3.02Å; N15-N17 VanDerWaalsContact C-N 3.31Å
16	T	47.9	Very low	49.4	Very low	114 Å²	114	120.3 Å²	120.3	70%	0.699	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	5.4	-179.8	51	0	0	0	0	114	T14	T14-T16 PolarHBondContact O-N 2.82Å
17	N	43.6	Very low	48.3	Very low	146 Å²	146	122.8 Å²	122.8	78%	0.781	68%	0.683	S	S	*	*			trans	-106	43.9	179.2	-101.4	-7	0	0	0	112.9	N15 N19	N15-N17 VanDerWaalsContact C-N 3.31Å; N17-N19 PolarHBondContact O-N 3.15Å
18	Y	44.7	Very low	47.1	Very low	199 Å²	199	125.6 Å²	125.6	78%	0.78	69%	0.692	S	S	*	*			trans	-75.6	112.4	163	-104.1	-89.5	0	0	0	109.5
19	N	41.2	Very low	46.2	Very low	120 Å²	120	127.1 Å²	127.1	64%	0.642	70%	0.699	S	S	*	*			trans	-73.4	166	178.8	-79.9	-12.7	0	0	0	113.4	N17	N17-N19 PolarHBondContact O-N 3.15Å
20	E	36.9	Very low	45.5	Very low	156 Å²	156	132.7 Å²	132.7	73%	0.729	71%	0.714	S	S	*	*			trans	81.7	114.6	147.2	-77.8	151	-115.3	0	0	121.2
21	L	39.3	Very low	44.9	Very low	161 Å²	161	135.4 Å²	135.4	84%	0.843	73%	0.729	S	S	*	*			trans	82.1	156	142.8	-65.7	163.9	0	0	0	118.5
22	P	36.9	Very low	44.6	Very low	112 Å²	112	138.5 Å²	138.5	73%	0.727	74%	0.735	S	S	*	*			trans	-118.8	164.8	-141.7	41.9	-33.2	0	0	0	115.9
23	C	37.4	Very low	44.8	Very low	129 Å²	129	136.2 Å²	136.2	87%	0.872	73%	0.729	S	S	*	*			trans	-147.6	110.8	158.3	-92.6	0	0	0	0	112.5
24	C	32.5	Very low	45.2	Very low	129 Å²	129	135.3 Å²	135.3	87%	0.872	73%	0.731	S	S	*	*			trans	-81	141.7	143.6	-72	0	0	0	0	107.1
25	S	34.5	Very low	46	Very low	116 Å²	116	136.7 Å²	136.7	81%	0.811	73%	0.73	S	S	*	*	S	Bend	cis	-158.5	136	3.7	48.2	0	0	0	0	111.1
26	G	35.9	Very low	47.3	Very low	76 Å²	76	136 Å²	136	78%	0.784	72%	0.723	S	S	*	*			trans	111.2	128.2	167.2	0	0	0	0	0	114.4
27	L	42.7	Very low	48.8	Very low	156 Å²	156	136.5 Å²	136.5	82%	0.817	72%	0.716	S	S	*	*			trans	-167.3	127.6	152	-109.4	165.2	0	0	0	108.4
28	E	38.7	Very low	50.6	Low	178 Å²	178	135.5 Å²	135.5	83%	0.832	71%	0.706	S	S	*	*			trans	-80.8	158.4	174.4	-61.6	168.4	127.1	0	0	110.2
29	K	45.3	Very low	52.5	Low	178 Å²	178	131 Å²	131	77%	0.774	70%	0.695	S	S	*	*			trans	77.4	96.2	-172.8	-48.2	170.4	-176.2	179	0	114.3
30	Y	48.1	Very low	54.6	Low	178 Å²	178	129.2 Å²	129.2	70%	0.698	69%	0.685	S	S	*	*			trans	-127.8	-6.5	176.7	-111.5	-84	0	0	0	116.1	P33	Y30-P33 WeakPolarHBondContact O-CD 3.3Å
31	D	51.8	Low	56.9	Low	147 Å²	147	125.7 Å²	125.7	79%	0.786	67%	0.67	S	S	*	*	S	Bend	trans	-82.2	-19.4	177.8	-51.4	-44.6	0	0	0	113.3
32	Q	55.5	Low	59.2	Low	114 Å²	114	121.8 Å²	121.8	53%	0.533	65%	0.65	S	S	.	*	H	α-helix	trans	-61.2	-44.7	-175.6	-159.1	179.2	-40.4	0	0	114.9	E34 H35 E36	Q32-E34 VanDerWaalsContact C-N 3.34Å; Q32-E34 PolarHBondContact O-N 3.46Å; Q32-H35 PolarHBondContact O-N 3.01Å; Q32-E36 WeakPolarHBondContact CG-OE1 3.37Å; Q32-E36 PolarHBondContact NE2-OE1 3.47Å; Q32-E36 WeakPolarHBondContact O-CG 3.4Å; Q32-E36 PolarHBondContact O-N 2.99Å; Q32-E36 VanDerWaalsContact O-N 3.1Å
33	P	62	Low	61.6	Low	70 Å²	70	121.9 Å²	121.9	46%	0.455	64%	0.641	S	S	.	*	H	α-helix	trans	-69.8	-23.3	-176.3	27.2	-36.1	0	0	0	114.6	Y30 K37	Y30-P33 WeakPolarHBondContact O-CD 3.3Å; P33-K37 VanDerWaalsContact O-CB 3.29Å; P33-K37 WeakPolarHBondContact O-CB 3.43Å; P33-K37 PolarHBondContact O-N 2.89Å
34	E	67.9	Low	64	Low	149 Å²	149	118.9 Å²	118.9	70%	0.696	62%	0.619	S	S	*	*	H	α-helix	trans	-72.3	-41.6	174.2	-67	-145.7	129.1	0	0	111.4	Q32 E36 K37 E38	Q32-E34 VanDerWaalsContact C-N 3.34Å; Q32-E34 PolarHBondContact O-N 3.46Å; E34-E36 PolarHBondContact O-N 3.01Å; E34-K37 WeakPolarHBondContact O-CB 3.43Å; E34-K37 PolarHBondContact O-N 3.44Å; E34-E38 PolarHBondContact O-N 3.01Å
35	H	74.2	Confident	66.7	Low	132 Å²	132	116.4 Å²	116.4	61%	0.611	60%	0.6	S	S	*	*	H	α-helix	trans	-65	-39.6	175.1	-168.8	-7.4	0	0	0	111.6	Q32 E38 L39	Q32-H35 PolarHBondContact O-N 3.01Å; H35-E38 PolarHBondContact O-N 2.74Å; H35-L39 WeakPolarHBondContact O-CB 3.31Å; H35-L39 PolarHBondContact O-N 3.08Å
36	E	76.9	Confident	69.5	Low	95 Å²	95	117.1 Å²	117.1	44%	0.444	59%	0.588	S	S	.	*	H	α-helix	trans	-63.8	-39.7	174	-71.8	174	-172	0	0	111.8	Q32 E34 L39 I40	Q32-E36 WeakPolarHBondContact CG-OE1 3.37Å; Q32-E36 PolarHBondContact NE2-OE1 3.47Å; Q32-E36 WeakPolarHBondContact O-CG 3.4Å; Q32-E36 PolarHBondContact O-N 2.99Å; Q32-E36 VanDerWaalsContact O-N 3.1Å; E34-E36 PolarHBondContact O-N 3.01Å; E36-L39 WeakPolarHBondContact O-CB 3.5Å; E36-L39 PolarHBondContact O-N 3.25Å; E36-I40 WeakPolarHBondContact O-CD1 3.4Å; E36-I40 VanDerWaalsContact O-CG1 3.28Å; E36-I40 WeakPolarHBondContact O-CG1 3.4Å; E36-I40 PolarHBondContact O-N 3.07Å
37	K	79.3	Confident	72.1	Confident	126 Å²	126	118.8 Å²	118.8	55%	0.548	58%	0.579	S	S	.	*	H	α-helix	trans	-63.6	-44.2	174.2	-179.5	-177.2	176.4	-173.7	0	112.4	P33 E34 L39 I40 I41	P33-K37 VanDerWaalsContact O-CB 3.29Å; P33-K37 WeakPolarHBondContact O-CB 3.43Å; P33-K37 PolarHBondContact O-N 2.89Å; E34-K37 WeakPolarHBondContact O-CB 3.43Å; E34-K37 PolarHBondContact O-N 3.44Å; K37-L39 VanDerWaalsContact C-N 3.33Å; K37-I40 PolarHBondContact O-N 3.49Å; K37-I41 HydrophobicContact CG-CD1 4.11Å; K37-I41 WeakPolarHBondContact O-CG1 3.38Å; K37-I41 PolarHBondContact O-N 3.2Å
38	E	80.9	Confident	74.4	Confident	124 Å²	124	117.2 Å²	117.2	58%	0.579	56%	0.563	S	S	*	*	H	α-helix	trans	-66.9	-34.9	176.2	-176	170.5	-153.7	0	0	111.9	E34 H35 I41 N42	E34-E38 PolarHBondContact O-N 3.01Å; H35-E38 PolarHBondContact O-N 2.74Å; E38-I41 PolarHBondContact O-N 2.98Å; E38-N42 WeakPolarHBondContact CG-ND2 3.27Å; E38-N42 WeakPolarHBondContact O-CB 3.33Å; E38-N42 PolarHBondContact O-N 2.89Å; E38-N42 PolarHBondContact O-ND2 3.44Å
39	L	84.3	Confident	76.9	Confident	104 Å²	104	111.9 Å²	111.9	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-60.4	-49.6	172.2	-167.3	79.4	0	0	0	110.9	H35 E36 K37 I41 N42 E43	H35-L39 WeakPolarHBondContact O-CB 3.31Å; H35-L39 PolarHBondContact O-N 3.08Å; E36-L39 WeakPolarHBondContact O-CB 3.5Å; E36-L39 PolarHBondContact O-N 3.25Å; K37-L39 VanDerWaalsContact C-N 3.33Å; L39-I41 PolarHBondContact O-N 2.92Å; L39-N42 PolarHBondContact O-N 3.28Å; L39-E43 WeakPolarHBondContact O-CB 3.32Å; L39-E43 PolarHBondContact O-N 3.24Å
40	I	84.8	Confident	79.1	Confident	83 Å²	83	109.4 Å²	109.4	43%	0.426	54%	0.535	S	S	.	.	H	α-helix	trans	-61.2	-41.1	178.1	-69.4	162.9	0	0	0	111.5	E36 K37 E43 T44	E36-I40 WeakPolarHBondContact O-CD1 3.4Å; E36-I40 VanDerWaalsContact O-CG1 3.28Å; E36-I40 WeakPolarHBondContact O-CG1 3.4Å; E36-I40 PolarHBondContact O-N 3.07Å; K37-I40 PolarHBondContact O-N 3.49Å; I40-E43 PolarHBondContact O-N 2.88Å; I40-T44 VanDerWaalsContact O-CB 3.27Å; I40-T44 WeakPolarHBondContact O-CB 3.48Å; I40-T44 PolarHBondContact O-N 3.12Å; I40-T44 PolarHBondContact O-OG1 3.34Å
41	I	86.7	Confident	81.3	Confident	82 Å²	82	103.2 Å²	103.2	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-64.3	-45.7	177	-70.5	166.1	0	0	0	110.8	K37 E38 L39 E43 T44 T45	K37-I41 HydrophobicContact CG-CD1 4.11Å; K37-I41 WeakPolarHBondContact O-CG1 3.38Å; K37-I41 PolarHBondContact O-N 3.2Å; E38-I41 PolarHBondContact O-N 2.98Å; L39-I41 PolarHBondContact O-N 2.92Å; I41-E43 VanDerWaalsContact C-N 3.35Å; I41-E43 PolarHBondContact O-N 2.88Å; I41-T44 PolarHBondContact O-N 3.38Å; I41-T45 WeakPolarHBondContact O-CB 3.49Å; I41-T45 PolarHBondContact O-N 3.02Å; I41-T45 PolarHBondContact O-OG1 2.91Å
42	N	86.4	Confident	83.2	Confident	79 Å²	79	99 Å²	99	42%	0.422	49%	0.49	S	S	.	.	H	α-helix	trans	-63.6	-39.4	177.1	-84.1	-72.1	0	0	0	112.3	E38 L39 T45 K46	E38-N42 WeakPolarHBondContact CG-ND2 3.27Å; E38-N42 WeakPolarHBondContact O-CB 3.33Å; E38-N42 PolarHBondContact O-N 2.89Å; E38-N42 PolarHBondContact O-ND2 3.44Å; L39-N42 PolarHBondContact O-N 3.28Å; N42-T45 PolarHBondContact O-N 3.25Å; N42-K46 WeakPolarHBondContact O-CG 3.49Å; N42-K46 PolarHBondContact O-N 3.06Å
43	E	88.2	Confident	85	Confident	114 Å²	114	99 Å²	99	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-70	-41.1	176.6	-169.7	155.5	-126.3	0	0	112.1	L39 I40 I41 T45 K46 L47	L39-E43 WeakPolarHBondContact O-CB 3.32Å; L39-E43 PolarHBondContact O-N 3.24Å; I40-E43 PolarHBondContact O-N 2.88Å; I41-E43 VanDerWaalsContact C-N 3.35Å; I41-E43 PolarHBondContact O-N 2.88Å; E43-T45 VanDerWaalsContact C-N 3.31Å; E43-T45 PolarHBondContact O-N 3.31Å; E43-K46 PolarHBondContact O-N 3.41Å; E43-L47 HydrophobicContact CG-CD1 4.47Å; E43-L47 WeakPolarHBondContact O-CG 3.45Å; E43-L47 PolarHBondContact O-N 3.13Å
44	T	87.3	Confident	86.5	Confident	67 Å²	67	97.8 Å²	97.8	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-61.3	-39.7	172.8	-55.9	0	0	0	0	111.5	I40 I41 L47 Y48	I40-T44 VanDerWaalsContact O-CB 3.27Å; I40-T44 WeakPolarHBondContact O-CB 3.48Å; I40-T44 PolarHBondContact O-N 3.12Å; I40-T44 PolarHBondContact O-OG1 3.34Å; I41-T44 PolarHBondContact O-N 3.38Å; T44-L47 PolarHBondContact O-N 3.38Å; T44-Y48 PolarHBondContact O-N 2.76Å
45	T	89.8	Confident	87.7	Confident	77 Å²	77	93.6 Å²	93.6	47%	0.472	47%	0.469	S	S	.	.	H	α-helix	trans	-65.8	-43.5	176.2	-54.9	0	0	0	0	111.3	I41 N42 E43 L47 Y48 C49	I41-T45 WeakPolarHBondContact O-CB 3.49Å; I41-T45 PolarHBondContact O-N 3.02Å; I41-T45 PolarHBondContact O-OG1 2.91Å; N42-T45 PolarHBondContact O-N 3.25Å; E43-T45 VanDerWaalsContact C-N 3.31Å; E43-T45 PolarHBondContact O-N 3.31Å; T45-L47 PolarHBondContact O-N 3.1Å; T45-Y48 PolarHBondContact O-N 3.38Å; T45-C49 PolarHBondContact O-N 2.92Å; T45-C49 PolarHBondContact O-SG 3Å; T45-C49 VanDerWaalsContact O-SG 3.41Å
46	K	92.2	Very high	88.6	Confident	131 Å²	131	91.3 Å²	91.3	57%	0.57	46%	0.461	S	S	*	.	H	α-helix	trans	-59.2	-46.5	172.6	-71.3	166.8	-174.2	171.3	0	111.5	N42 E43 Y48 C49 H50	N42-K46 WeakPolarHBondContact O-CG 3.49Å; N42-K46 PolarHBondContact O-N 3.06Å; E43-K46 PolarHBondContact O-N 3.41Å; K46-Y48 VanDerWaalsContact C-N 3.31Å; K46-Y48 PolarHBondContact O-N 3.04Å; K46-C49 PolarHBondContact O-N 2.95Å; K46-H50 PolarHBondContact O-CD2 2.89Å; K46-H50 PolarHBondContact O-N 2.93Å
47	L	91.4	Very high	89.4	Confident	111 Å²	111	88.7 Å²	88.7	58%	0.581	46%	0.456	S	S	*	.	H	α-helix	trans	-60.6	-38.7	176.9	-72.5	169.6	0	0	0	112.1	E43 T44 T45 H50 L51	E43-L47 HydrophobicContact CG-CD1 4.47Å; E43-L47 WeakPolarHBondContact O-CG 3.45Å; E43-L47 PolarHBondContact O-N 3.13Å; T44-L47 PolarHBondContact O-N 3.38Å; T45-L47 PolarHBondContact O-N 3.1Å; L47-H50 PolarHBondContact O-N 3.37Å; L47-L51 WeakPolarHBondContact O-CB 3.46Å; L47-L51 PolarHBondContact O-N 2.9Å
48	Y	90.7	Very high	90.1	Very high	122 Å²	122	88.3 Å²	88.3	48%	0.478	46%	0.459	S	S	.	.	H	α-helix	trans	-66.1	-43.1	174.2	-173.6	-95.4	0	0	0	112.4	R2 T44 T45 K46 L51 Q52	R2-Y48 PolarHBondContact NH2-OH 3.01Å; T44-Y48 PolarHBondContact O-N 2.76Å; T45-Y48 PolarHBondContact O-N 3.38Å; K46-Y48 VanDerWaalsContact C-N 3.31Å; K46-Y48 PolarHBondContact O-N 3.04Å; Y48-L51 PolarHBondContact O-N 3.25Å; Y48-Q52 PolarHBondContact O-N 2.95Å
49	C	90.8	Very high	90.7	Very high	67 Å²	67	85.4 Å²	85.4	45%	0.453	46%	0.455	S	S	.	.	H	α-helix	trans	-62.2	-42.2	173.7	-68.6	0	0	0	0	112.2	T45 K46 L51 Q52 L53	T45-C49 PolarHBondContact O-N 2.92Å; T45-C49 PolarHBondContact O-SG 3Å; T45-C49 VanDerWaalsContact O-SG 3.41Å; K46-C49 PolarHBondContact O-N 2.95Å; C49-L51 VanDerWaalsContact C-N 3.34Å; C49-Q52 PolarHBondContact O-N 3.44Å; C49-L53 WeakPolarHBondContact O-CB 3.49Å; C49-L53 WeakPolarHBondContact O-CG 3.49Å; C49-L53 PolarHBondContact O-N 3.02Å
50	H	92.5	Very high	91.2	Very high	125 Å²	125	85.5 Å²	85.5	58%	0.579	45%	0.453	S	S	*	.	H	α-helix	trans	-64.7	-36.7	174.2	-71.6	-55.2	0	0	0	112.4	K46 L47 A54	K46-H50 PolarHBondContact O-CD2 2.89Å; K46-H50 PolarHBondContact O-N 2.93Å; L47-H50 PolarHBondContact O-N 3.37Å; H50-A54 WeakPolarHBondContact O-CB 3.43Å; H50-A54 PolarHBondContact O-N 3.39Å
51	L	93	Very high	91.7	Very high	49 Å²	49	87.3 Å²	87.3	26%	0.257	46%	0.459	S	S	.	.	H	α-helix	trans	-66.4	-43.8	175.3	-175.8	65.6	0	0	0	111.7	L47 Y48 C49 A54 E55	L47-L51 WeakPolarHBondContact O-CB 3.46Å; L47-L51 PolarHBondContact O-N 2.9Å; Y48-L51 PolarHBondContact O-N 3.25Å; C49-L51 VanDerWaalsContact C-N 3.34Å; L51-A54 PolarHBondContact O-N 3.41Å; L51-E55 WeakPolarHBondContact O-CG 3.46Å; L51-E55 PolarHBondContact O-N 3.31Å
52	Q	92.4	Very high	92.1	Very high	58 Å²	58	86.3 Å²	86.3	27%	0.271	46%	0.46	S	S	.	.	H	α-helix	trans	-63.6	-45.1	176.5	-172.9	63.2	58.7	0	0	111.3	Y48 C49 A54 E55 D56	Y48-Q52 PolarHBondContact O-N 2.95Å; C49-Q52 PolarHBondContact O-N 3.44Å; Q52-A54 PolarHBondContact O-N 2.88Å; Q52-E55 PolarHBondContact O-N 3.29Å; Q52-E55 VanDerWaalsContact O-N 3.14Å; Q52-D56 PolarHBondContact NE2-OD1 2.81Å; Q52-D56 WeakPolarHBondContact O-CB 3.43Å; Q52-D56 PolarHBondContact O-N 3.03Å
53	L	93.8	Very high	92.5	Very high	115 Å²	115	85.6 Å²	85.6	60%	0.602	47%	0.465	S	S	*	.	H	α-helix	trans	-60.1	-34	174.9	-72.1	169.6	0	0	0	112.4	C49 A57	C49-L53 WeakPolarHBondContact O-CB 3.49Å; C49-L53 WeakPolarHBondContact O-CG 3.49Å; C49-L53 PolarHBondContact O-N 3.02Å; L53-A57 VanDerWaalsContact O-CB 3.26Å; L53-A57 WeakPolarHBondContact O-CB 3.36Å; L53-A57 PolarHBondContact O-N 2.96Å
54	A	93	Very high	92.8	Very high	44 Å²	44	84.4 Å²	84.4	36%	0.364	46%	0.458	S	S	.	.	H	α-helix	trans	-72.1	-40.7	174	0	0	0	0	0	112.5	H50 L51 Q52 A57 I58	H50-A54 WeakPolarHBondContact O-CB 3.43Å; H50-A54 PolarHBondContact O-N 3.39Å; L51-A54 PolarHBondContact O-N 3.41Å; Q52-A54 PolarHBondContact O-N 2.88Å; A54-A57 PolarHBondContact O-N 3.05Å; A54-I58 WeakPolarHBondContact O-CB 3.45Å; A54-I58 WeakPolarHBondContact O-CD1 3.5Å; A54-I58 WeakPolarHBondContact O-CG1 3.32Å; A54-I58 PolarHBondContact O-N 3.5Å
55	E	93.1	Very high	93.2	Very high	61 Å²	61	85.8 Å²	85.8	29%	0.285	46%	0.46	S	S	.	.	H	α-helix	trans	-62.8	-44.6	173.8	-73.9	178.8	162.5	0	0	111.7	R2 L51 Q52 I58 A59	R2-E55 IonicContact CZ-OE2 3.48Å; R2-E55 VanDerWaalsContact NH1-CD 3.26Å; R2-E55 IonicContact NH1-OE1 3.72Å; R2-E55 PolarHBondContact NH1-OE1 3Å; R2-E55 VanDerWaalsContact NH1-OE1 3.15Å; R2-E55 IonicContact NH1-OE2 2.59Å; R2-E55 PolarHBondContact NH1-OE2 3.03Å; R2-E55 IonicContact NH2-OE2 3.72Å; L51-E55 WeakPolarHBondContact O-CG 3.46Å; L51-E55 PolarHBondContact O-N 3.31Å; Q52-E55 PolarHBondContact O-N 3.29Å; Q52-E55 VanDerWaalsContact O-N 3.14Å; E55-I58 PolarHBondContact O-N 3.4Å; E55-A59 PolarHBondContact O-N 2.88Å
56	D	93.7	Very high	93.4	Very high	84 Å²	84	86.1 Å²	86.1	45%	0.449	46%	0.459	S	S	.	.	H	α-helix	trans	-63.4	-43.1	177.8	-63.6	-18.8	0	0	0	111	Q52 A59 E60	Q52-D56 PolarHBondContact NE2-OD1 2.81Å; Q52-D56 WeakPolarHBondContact O-CB 3.43Å; Q52-D56 PolarHBondContact O-N 3.03Å; D56-A59 PolarHBondContact O-N 3.39Å; D56-E60 PolarHBondContact O-N 3.06Å
57	A	93.6	Very high	93.6	Very high	39 Å²	39	84 Å²	84	32%	0.322	45%	0.453	S	S	.	.	H	α-helix	trans	-64.5	-40.6	174.2	0	0	0	0	0	112.2	L53 A54 A59 E60 H61	L53-A57 VanDerWaalsContact O-CB 3.26Å; L53-A57 WeakPolarHBondContact O-CB 3.36Å; L53-A57 PolarHBondContact O-N 2.96Å; A54-A57 PolarHBondContact O-N 3.05Å; A57-A59 VanDerWaalsContact C-N 3.33Å; A57-A59 PolarHBondContact O-N 3.14Å; A57-E60 PolarHBondContact O-N 3.49Å; A57-H61 WeakPolarHBondContact O-CB 3.37Å; A57-H61 PolarHBondContact O-CD2 3.22Å; A57-H61 PolarHBondContact O-N 3.38Å
58	I	94.5	Very high	93.8	Very high	119 Å²	119	84.1 Å²	84.1	61%	0.61	45%	0.454	S	S	*	.	H	α-helix	trans	-62.3	-40.9	175	-73.8	163.3	0	0	0	110.8	A54 E55 H61 S62	A54-I58 WeakPolarHBondContact O-CB 3.45Å; A54-I58 WeakPolarHBondContact O-CD1 3.5Å; A54-I58 WeakPolarHBondContact O-CG1 3.32Å; A54-I58 PolarHBondContact O-N 3.5Å; E55-I58 PolarHBondContact O-N 3.4Å; I58-H61 PolarHBondContact O-N 3.21Å; I58-S62 WeakPolarHBondContact O-CB 3.38Å; I58-S62 PolarHBondContact O-N 2.93Å
59	A	93.4	Very high	94	Very high	62 Å²	62	84.9 Å²	84.9	51%	0.512	46%	0.456	S	S	.	.	H	α-helix	trans	-64.2	-44	175.6	0	0	0	0	0	112	E55 D56 A57 S62 A63	E55-A59 PolarHBondContact O-N 2.88Å; D56-A59 PolarHBondContact O-N 3.39Å; A57-A59 VanDerWaalsContact C-N 3.33Å; A57-A59 PolarHBondContact O-N 3.14Å; A59-S62 PolarHBondContact O-N 2.64Å; A59-A63 PolarHBondContact O-N 2.98Å
60	E	94.5	Very high	94.2	Very high	107 Å²	107	88.1 Å²	88.1	50%	0.5	46%	0.464	S	S	.	.	H	α-helix	trans	-64.2	-40	175.7	-156.4	-151.2	176.1	0	0	111.8	D56 A57 A63 K64	D56-E60 PolarHBondContact O-N 3.06Å; A57-E60 PolarHBondContact O-N 3.49Å; E60-A63 PolarHBondContact O-N 2.94Å; E60-K64 VanDerWaalsContact CD-CE 3.41Å; E60-K64 VanDerWaalsContact O-CG 3.28Å; E60-K64 WeakPolarHBondContact O-CG 3.34Å; E60-K64 PolarHBondContact O-N 3.06Å; E60-K64 WeakPolarHBondContact OE1-CE 3.29Å; E60-K64 IonicContact OE1-NZ 3.17Å; E60-K64 PolarHBondContact OE1-NZ 2.98Å; E60-K64 IonicContact OE2-NZ 2.85Å; E60-K64 PolarHBondContact OE2-NZ 3.12Å
61	H	94.8	Very high	94.4	Very high	120 Å²	120	87.4 Å²	87.4	56%	0.556	46%	0.46	S	S	*	.	H	α-helix	trans	-66	-39.8	174.9	-82.3	-65.7	0	0	0	112.5	A57 I58 K64 E65	A57-H61 WeakPolarHBondContact O-CB 3.37Å; A57-H61 PolarHBondContact O-CD2 3.22Å; A57-H61 PolarHBondContact O-N 3.38Å; I58-H61 PolarHBondContact O-N 3.21Å; H61-K64 PolarHBondContact O-N 2.98Å; H61-E65 WeakPolarHBondContact O-CB 3.44Å; H61-E65 PolarHBondContact O-N 3.35Å
62	S	94.4	Very high	94.5	Very high	61 Å²	61	90.8 Å²	90.8	43%	0.427	48%	0.477	S	S	.	.	H	α-helix	trans	-61.4	-46.3	174.6	-167.6	0	0	0	0	111.5	I58 A59 K64 E65 D66	I58-S62 WeakPolarHBondContact O-CB 3.38Å; I58-S62 PolarHBondContact O-N 2.93Å; A59-S62 PolarHBondContact O-N 2.64Å; S62-K64 VanDerWaalsContact C-N 3.31Å; S62-K64 PolarHBondContact O-N 3.43Å; S62-E65 WeakPolarHBondContact O-CB 3.22Å; S62-E65 PolarHBondContact O-N 2.98Å; S62-E65 VanDerWaalsContact O-N 3.1Å; S62-D66 PolarHBondContact O-N 2.97Å
63	A	94.8	Very high	94.6	Very high	64 Å²	64	94 Å²	94	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-35.9	177.6	0	0	0	0	0	112.6	A59 E60 L67	A59-A63 PolarHBondContact O-N 2.98Å; E60-A63 PolarHBondContact O-N 2.94Å; A63-L67 PolarHBondContact O-N 2.98Å
64	K	95.7	Very high	94.6	Very high	89 Å²	89	92.2 Å²	92.2	39%	0.387	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-39.7	171.1	-72.8	165.7	-177.3	168.9	0	111.7	E60 H61 S62 L67 L68	E60-K64 VanDerWaalsContact CD-CE 3.41Å; E60-K64 VanDerWaalsContact O-CG 3.28Å; E60-K64 WeakPolarHBondContact O-CG 3.34Å; E60-K64 PolarHBondContact O-N 3.06Å; E60-K64 WeakPolarHBondContact OE1-CE 3.29Å; E60-K64 IonicContact OE1-NZ 3.17Å; E60-K64 PolarHBondContact OE1-NZ 2.98Å; E60-K64 IonicContact OE2-NZ 2.85Å; E60-K64 PolarHBondContact OE2-NZ 3.12Å; H61-K64 PolarHBondContact O-N 2.98Å; S62-K64 VanDerWaalsContact C-N 3.31Å; S62-K64 PolarHBondContact O-N 3.43Å; K64-L67 PolarHBondContact O-N 3.09Å; K64-L68 WeakPolarHBondContact O-CB 3.28Å; K64-L68 VanDerWaalsContact O-CG 3.25Å; K64-L68 WeakPolarHBondContact O-CG 3.36Å; K64-L68 PolarHBondContact O-N 3.16Å
65	E	95.2	Very high	94.7	Very high	97 Å²	97	95.2 Å²	95.2	45%	0.453	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-46.5	177.9	-164.2	-173.8	137.5	0	0	111.6	H61 S62 L67 L68 R69	H61-E65 WeakPolarHBondContact O-CB 3.44Å; H61-E65 PolarHBondContact O-N 3.35Å; S62-E65 WeakPolarHBondContact O-CB 3.22Å; S62-E65 PolarHBondContact O-N 2.98Å; S62-E65 VanDerWaalsContact O-N 3.1Å; E65-L67 PolarHBondContact O-N 2.97Å; E65-L68 CarbonylContact O-C 3.58Å; E65-L68 PolarHBondContact O-N 2.83Å; E65-L68 VanDerWaalsContact O-N 3.13Å; E65-R69 VanDerWaalsContact O-CG 3.31Å; E65-R69 WeakPolarHBondContact O-CG 3.41Å; E65-R69 PolarHBondContact O-N 3.28Å; E65-R69 IonicContact OE1-CZ 3.15Å; E65-R69 IonicContact OE1-NE 2.69Å; E65-R69 PolarHBondContact OE1-NE 3.38Å; E65-R69 IonicContact OE1-NH2 2.72Å; E65-R69 PolarHBondContact OE1-NH2 3.44Å
66	D	95	Very high	94.7	Very high	84 Å²	84	95.7 Å²	95.7	45%	0.449	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-41.8	177	-75.8	-38.9	0	0	0	112.3	S62 L68 R69 Q70	S62-D66 PolarHBondContact O-N 2.97Å; D66-L68 VanDerWaalsContact C-N 3.32Å; D66-L68 PolarHBondContact O-N 3.42Å; D66-R69 PolarHBondContact O-N 2.88Å; D66-Q70 WeakPolarHBondContact O-CG 3.48Å; D66-Q70 PolarHBondContact O-N 3.45Å
67	L	95.1	Very high	94.7	Very high	87 Å²	87	93.3 Å²	93.3	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-63.3	-37.1	174.3	-179.1	61.7	0	0	0	112.2	A63 K64 E65 K71	A63-L67 PolarHBondContact O-N 2.98Å; K64-L67 PolarHBondContact O-N 3.09Å; E65-L67 PolarHBondContact O-N 2.97Å; L67-K71 HydrophobicContact CG-CD 4.49Å; L67-K71 WeakPolarHBondContact O-CG 3.32Å; L67-K71 PolarHBondContact O-N 3.06Å; L67-K71 VanDerWaalsContact O-N 3.11Å
68	L	95.7	Very high	94.7	Very high	113 Å²	113	95.2 Å²	95.2	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-70.7	-38.4	175	-72.7	168.6	0	0	0	111.8	K64 E65 D66 K71 L72	K64-L68 WeakPolarHBondContact O-CB 3.28Å; K64-L68 VanDerWaalsContact O-CG 3.25Å; K64-L68 WeakPolarHBondContact O-CG 3.36Å; K64-L68 PolarHBondContact O-N 3.16Å; E65-L68 CarbonylContact O-C 3.58Å; E65-L68 PolarHBondContact O-N 2.83Å; E65-L68 VanDerWaalsContact O-N 3.13Å; D66-L68 VanDerWaalsContact C-N 3.32Å; D66-L68 PolarHBondContact O-N 3.42Å; L68-K71 PolarHBondContact O-N 2.94Å; L68-L72 WeakPolarHBondContact O-CB 3.4Å; L68-L72 PolarHBondContact O-N 2.88Å
69	R	95.2	Very high	94.7	Very high	137 Å²	137	91.3 Å²	91.3	52%	0.517	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-45.8	173.6	-73.5	168.8	174.3	-84.8	0.8	111.4	E65 D66 L72 I73	E65-R69 VanDerWaalsContact O-CG 3.31Å; E65-R69 WeakPolarHBondContact O-CG 3.41Å; E65-R69 PolarHBondContact O-N 3.28Å; E65-R69 IonicContact OE1-CZ 3.15Å; E65-R69 IonicContact OE1-NE 2.69Å; E65-R69 PolarHBondContact OE1-NE 3.38Å; E65-R69 IonicContact OE1-NH2 2.72Å; E65-R69 PolarHBondContact OE1-NH2 3.44Å; D66-R69 PolarHBondContact O-N 2.88Å; R69-L72 PolarHBondContact O-N 3.47Å; R69-I73 WeakPolarHBondContact O-CG1 3.47Å; R69-I73 PolarHBondContact O-N 3.39Å
70	Q	95.1	Very high	94.7	Very high	135 Å²	135	92 Å²	92	63%	0.631	50%	0.497	S	S	*	.	H	α-helix	trans	-61.4	-44.8	175.2	-71.1	179.1	11.2	0	0	112.2	D66 L72 I73 S74	D66-Q70 WeakPolarHBondContact O-CG 3.48Å; D66-Q70 PolarHBondContact O-N 3.45Å; Q70-L72 PolarHBondContact O-N 3.09Å; Q70-I73 PolarHBondContact O-N 3.32Å; Q70-S74 PolarHBondContact O-N 3.03Å
71	K	96.3	Very high	94.7	Very high	111 Å²	111	92.2 Å²	92.2	48%	0.483	50%	0.498	S	S	.	.	H	α-helix	trans	-62	-41.3	175.5	-74.7	173.7	180	179.1	0	112.2	L67 L68 I73 S74 I75	L67-K71 HydrophobicContact CG-CD 4.49Å; L67-K71 WeakPolarHBondContact O-CG 3.32Å; L67-K71 PolarHBondContact O-N 3.06Å; L67-K71 VanDerWaalsContact O-N 3.11Å; L68-K71 PolarHBondContact O-N 2.94Å; K71-I73 VanDerWaalsContact C-N 3.35Å; K71-I73 PolarHBondContact O-N 2.99Å; K71-S74 PolarHBondContact O-N 2.95Å; K71-I75 WeakPolarHBondContact O-CB 3.48Å; K71-I75 VanDerWaalsContact O-CG1 3.27Å; K71-I75 WeakPolarHBondContact O-CG1 3.46Å; K71-I75 PolarHBondContact O-N 3.02Å
72	L	94.8	Very high	94.7	Very high	120 Å²	120	93.4 Å²	93.4	63%	0.628	50%	0.498	S	S	*	.	H	α-helix	trans	-62.7	-40.2	177.1	-177.3	62.7	0	0	0	112	L68 R69 Q70 I75 S76	L68-L72 WeakPolarHBondContact O-CB 3.4Å; L68-L72 PolarHBondContact O-N 2.88Å; R69-L72 PolarHBondContact O-N 3.47Å; Q70-L72 PolarHBondContact O-N 3.09Å; L72-I75 PolarHBondContact O-N 3.07Å; L72-S76 VanDerWaalsContact O-CB 3.32Å; L72-S76 WeakPolarHBondContact O-CB 3.24Å; L72-S76 PolarHBondContact O-N 2.75Å
73	I	94.9	Very high	94.7	Very high	125 Å²	125	93.6 Å²	93.6	64%	0.641	49%	0.494	S	S	*	.	H	α-helix	trans	-63.6	-44.8	174.9	-67.9	163.9	0	0	0	110.8	R69 Q70 K71 S76 G77	R69-I73 WeakPolarHBondContact O-CG1 3.47Å; R69-I73 PolarHBondContact O-N 3.39Å; Q70-I73 PolarHBondContact O-N 3.32Å; K71-I73 VanDerWaalsContact C-N 3.35Å; K71-I73 PolarHBondContact O-N 2.99Å; I73-S76 WeakPolarHBondContact O-CB 3.39Å; I73-S76 PolarHBondContact O-N 2.89Å; I73-G77 PolarHBondContact O-N 3.21Å
74	S	94.2	Very high	94.7	Very high	77 Å²	77	97 Å²	97	54%	0.538	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-42.2	177.1	177.5	0	0	0	0	112.9	Q70 K71 S76 G77 T78	Q70-S74 PolarHBondContact O-N 3.03Å; K71-S74 PolarHBondContact O-N 2.95Å; S74-S76 VanDerWaalsContact C-N 3.34Å; S74-G77 PolarHBondContact O-N 3.46Å; S74-T78 PolarHBondContact O-N 2.83Å; S74-T78 PolarHBondContact O-OG1 3.45Å; S74-T78 VanDerWaalsContact O-OG1 3.13Å
75	I	94.3	Very high	94.6	Very high	107 Å²	107	98.5 Å²	98.5	55%	0.549	51%	0.508	S	S	.	.	H	α-helix	trans	-64.8	-39.5	175.1	-68.5	164.8	0	0	0	110.8	K71 L72 T78 A79	K71-I75 WeakPolarHBondContact O-CB 3.48Å; K71-I75 VanDerWaalsContact O-CG1 3.27Å; K71-I75 WeakPolarHBondContact O-CG1 3.46Å; K71-I75 PolarHBondContact O-N 3.02Å; L72-I75 PolarHBondContact O-N 3.07Å; I75-T78 PolarHBondContact O-OG1 3.29Å; I75-T78 VanDerWaalsContact O-OG1 3.07Å; I75-A79 WeakPolarHBondContact O-CB 3.43Å; I75-A79 PolarHBondContact O-N 2.86Å
76	S	94.1	Very high	94.5	Very high	71 Å²	71	97.8 Å²	97.8	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-43.5	175.1	-170.7	0	0	0	0	112.2	L72 I73 S74 A79 V80	L72-S76 VanDerWaalsContact O-CB 3.32Å; L72-S76 WeakPolarHBondContact O-CB 3.24Å; L72-S76 PolarHBondContact O-N 2.75Å; I73-S76 WeakPolarHBondContact O-CB 3.39Å; I73-S76 PolarHBondContact O-N 2.89Å; S74-S76 VanDerWaalsContact C-N 3.34Å; S76-A79 PolarHBondContact O-N 2.98Å; S76-V80 WeakPolarHBondContact O-CG2 3.44Å; S76-V80 PolarHBondContact O-N 3.48Å
77	G	93.8	Very high	94.5	Very high	34 Å²	34	101.1 Å²	101.1	35%	0.351	52%	0.518	S	S	.	.	H	α-helix	trans	-59.4	-51.6	175.4	0	0	0	0	0	112.8	I73 S74 A79 V80 E81	I73-G77 PolarHBondContact O-N 3.21Å; S74-G77 PolarHBondContact O-N 3.46Å; G77-A79 VanDerWaalsContact C-N 3.3Å; G77-A79 PolarHBondContact O-N 3.33Å; G77-V80 PolarHBondContact O-N 3.18Å; G77-V80 VanDerWaalsContact O-N 3.12Å; G77-E81 PolarHBondContact O-N 2.99Å
78	T	93.9	Very high	94.4	Very high	79 Å²	79	102.8 Å²	102.8	49%	0.485	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-30.9	178.9	52.1	0	0	0	0	113	S74 I75 E81 R82	S74-T78 PolarHBondContact O-N 2.83Å; S74-T78 PolarHBondContact O-OG1 3.45Å; S74-T78 VanDerWaalsContact O-OG1 3.13Å; I75-T78 PolarHBondContact O-OG1 3.29Å; I75-T78 VanDerWaalsContact O-OG1 3.07Å; T78-E81 PolarHBondContact O-N 3.02Å; T78-R82 WeakPolarHBondContact O-CB 3.27Å; T78-R82 PolarHBondContact O-N 3.36Å
79	A	93.3	Very high	94.4	Very high	37 Å²	37	102.1 Å²	102.1	31%	0.306	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-44.2	171	0	0	0	0	0	112.2	I75 S76 G77 E81 R82 D83	I75-A79 WeakPolarHBondContact O-CB 3.43Å; I75-A79 PolarHBondContact O-N 2.86Å; S76-A79 PolarHBondContact O-N 2.98Å; G77-A79 VanDerWaalsContact C-N 3.3Å; G77-A79 PolarHBondContact O-N 3.33Å; A79-E81 VanDerWaalsContact C-N 3.32Å; A79-E81 PolarHBondContact O-N 2.85Å; A79-R82 PolarHBondContact O-N 2.85Å; A79-D83 WeakPolarHBondContact O-CB 3.42Å; A79-D83 PolarHBondContact O-N 3.32Å
80	V	94.7	Very high	94.3	Very high	76 Å²	76	100.4 Å²	100.4	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-35.8	176.4	170.4	0	0	0	0	111.9	S76 G77 K84	S76-V80 WeakPolarHBondContact O-CG2 3.44Å; S76-V80 PolarHBondContact O-N 3.48Å; G77-V80 PolarHBondContact O-N 3.18Å; G77-V80 VanDerWaalsContact O-N 3.12Å; V80-K84 WeakPolarHBondContact O-CG 3.32Å; V80-K84 PolarHBondContact O-N 2.78Å; V80-K84 VanDerWaalsContact O-N 3.13Å
81	E	93.7	Very high	94.1	Very high	113 Å²	113	97 Å²	97	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-69.3	-46	175.1	-71.5	172.7	169.3	0	0	112.3	G77 T78 A79 D83 K84 L85	G77-E81 PolarHBondContact O-N 2.99Å; T78-E81 PolarHBondContact O-N 3.02Å; A79-E81 VanDerWaalsContact C-N 3.32Å; A79-E81 PolarHBondContact O-N 2.85Å; E81-D83 VanDerWaalsContact C-N 3.26Å; E81-D83 PolarHBondContact O-N 3.37Å; E81-K84 WeakPolarHBondContact O-CB 3.47Å; E81-K84 PolarHBondContact O-N 3Å; E81-K84 VanDerWaalsContact O-N 3.16Å; E81-L85 WeakPolarHBondContact O-CG 3.5Å; E81-L85 PolarHBondContact O-N 3.34Å
82	R	93.9	Very high	93.9	Very high	145 Å²	145	95.9 Å²	95.9	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-54.6	-44.1	172.2	-175.1	-157.4	70.2	167.2	-0.4	111.3	T78 A79 K84 L85 L86	T78-R82 WeakPolarHBondContact O-CB 3.27Å; T78-R82 PolarHBondContact O-N 3.36Å; A79-R82 PolarHBondContact O-N 2.85Å; R82-K84 VanDerWaalsContact C-N 3.32Å; R82-K84 PolarHBondContact O-N 2.81Å; R82-L85 PolarHBondContact O-N 3.38Å; R82-L86 HydrophobicContact CG-CD1 4.19Å; R82-L86 WeakPolarHBondContact O-CG 3.31Å; R82-L86 PolarHBondContact O-N 2.96Å
83	D	94.6	Very high	93.7	Very high	65 Å²	65	93.5 Å²	93.5	35%	0.348	49%	0.493	S	S	.	.	H	α-helix	trans	-72.9	-23.2	-177.5	-69.6	6.4	0	0	0	112.9	A79 E81 K87	A79-D83 WeakPolarHBondContact O-CB 3.42Å; A79-D83 PolarHBondContact O-N 3.32Å; E81-D83 VanDerWaalsContact C-N 3.26Å; E81-D83 PolarHBondContact O-N 3.37Å; D83-K87 WeakPolarHBondContact O-CG 3.5Å; D83-K87 PolarHBondContact O-N 3.39Å
84	K	94.6	Very high	93.6	Very high	135 Å²	135	91.8 Å²	91.8	59%	0.587	49%	0.488	S	S	*	.	H	α-helix	trans	-71.3	-45.4	165.6	-70.2	166.5	-175.8	171.7	0	111.3	V80 E81 R82 L86 K87 F88	V80-K84 WeakPolarHBondContact O-CG 3.32Å; V80-K84 PolarHBondContact O-N 2.78Å; V80-K84 VanDerWaalsContact O-N 3.13Å; E81-K84 WeakPolarHBondContact O-CB 3.47Å; E81-K84 PolarHBondContact O-N 3Å; E81-K84 VanDerWaalsContact O-N 3.16Å; R82-K84 VanDerWaalsContact C-N 3.32Å; R82-K84 PolarHBondContact O-N 2.81Å; K84-L86 PolarHBondContact O-N 3.5Å; K84-K87 PolarHBondContact O-N 3.28Å; K84-F88 PolarHBondContact O-N 3.06Å
85	L	94.3	Very high	93.5	Very high	121 Å²	121	94.6 Å²	94.6	63%	0.634	49%	0.488	S	S	*	.	H	α-helix	trans	-64.5	-37.9	-179.9	-70.8	171.7	0	0	0	112.3	E81 R82 F88 L89	E81-L85 WeakPolarHBondContact O-CG 3.5Å; E81-L85 PolarHBondContact O-N 3.34Å; R82-L85 PolarHBondContact O-N 3.38Å; L85-F88 PolarHBondContact O-N 3.33Å; L85-L89 WeakPolarHBondContact O-CB 3.49Å; L85-L89 PolarHBondContact O-N 3.4Å
86	L	93.4	Very high	93.4	Very high	82 Å²	82	96 Å²	96	43%	0.429	49%	0.491	S	S	.	.	H	α-helix	trans	-60.9	-49.7	173.1	-73	168.8	0	0	0	111.3	R82 K84 F88 L89 D90	R82-L86 HydrophobicContact CG-CD1 4.19Å; R82-L86 WeakPolarHBondContact O-CG 3.31Å; R82-L86 PolarHBondContact O-N 2.96Å; K84-L86 PolarHBondContact O-N 3.5Å; L86-F88 VanDerWaalsContact C-N 3.29Å; L86-F88 PolarHBondContact O-N 2.83Å; L86-L89 WeakPolarHBondContact O-CB 3.18Å; L86-L89 PolarHBondContact O-N 2.96Å; L86-L89 VanDerWaalsContact O-N 3.11Å; L86-D90 PolarHBondContact O-N 2.88Å
87	K	94	Very high	93.3	Very high	154 Å²	154	100.3 Å²	100.3	67%	0.67	50%	0.497	S	S	*	.	H	α-helix	trans	-60.4	-36.4	176.8	-72.3	173.1	-177.7	177.8	0	113.2	D83 K84 S91	D83-K87 WeakPolarHBondContact O-CG 3.5Å; D83-K87 PolarHBondContact O-N 3.39Å; K84-K87 PolarHBondContact O-N 3.28Å; K87-S91 PolarHBondContact O-N 3.33Å
88	F	94.1	Very high	93.2	Very high	122 Å²	122	101.4 Å²	101.4	54%	0.535	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-47.4	173.6	-179.7	-104	0	0	0	111.2	K84 L85 L86 D90 S91 E92	K84-F88 PolarHBondContact O-N 3.06Å; L85-F88 PolarHBondContact O-N 3.33Å; L86-F88 VanDerWaalsContact C-N 3.29Å; L86-F88 PolarHBondContact O-N 2.83Å; F88-D90 VanDerWaalsContact C-N 3.34Å; F88-D90 PolarHBondContact O-N 3.48Å; F88-S91 PolarHBondContact O-N 3.48Å; F88-S91 VanDerWaalsContact O-N 3.11Å; F88-S91 PolarHBondContact O-OG 2.97Å; F88-E92 HydrophobicContact CD1-CG 4.37Å; F88-E92 HydrophobicContact CE1-CG 3.78Å; F88-E92 HydrophobicContact CE2-CG 4.22Å; F88-E92 HydrophobicContact CZ-CG 3.67Å; F88-E92 PolarHBondContact O-N 3.19Å
89	L	94.5	Very high	93.2	Very high	98 Å²	98	101.5 Å²	101.5	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-60.6	-40.1	177.4	-177.5	61.7	0	0	0	112.6	L85 L86 S91 E92 M93	L85-L89 WeakPolarHBondContact O-CB 3.49Å; L85-L89 PolarHBondContact O-N 3.4Å; L86-L89 WeakPolarHBondContact O-CB 3.18Å; L86-L89 PolarHBondContact O-N 2.96Å; L86-L89 VanDerWaalsContact O-N 3.11Å; L89-S91 VanDerWaalsContact C-N 3.31Å; L89-S91 PolarHBondContact O-N 3.45Å; L89-E92 PolarHBondContact O-N 3.24Å; L89-M93 HydrophobicContact CD1-CG 4.35Å; L89-M93 WeakPolarHBondContact O-CB 3.38Å; L89-M93 VanDerWaalsContact O-CG 3.29Å; L89-M93 WeakPolarHBondContact O-CG 3.42Å; L89-M93 PolarHBondContact O-N 2.95Å
90	D	93	Very high	93.1	Very high	101 Å²	101	102.3 Å²	102.3	54%	0.54	50%	0.501	S	S	.	.	H	α-helix	trans	-61.7	-39.6	174.6	-68.4	-31.4	0	0	0	111.6	L86 F88 T94	L86-D90 PolarHBondContact O-N 2.88Å; F88-D90 VanDerWaalsContact C-N 3.34Å; F88-D90 PolarHBondContact O-N 3.48Å; D90-T94 WeakPolarHBondContact O-CB 3.44Å; D90-T94 PolarHBondContact O-N 2.78Å; D90-T94 PolarHBondContact O-OG1 3.15Å
91	S	91.8	Very high	93.1	Very high	63 Å²	63	105.6 Å²	105.6	44%	0.441	51%	0.505	S	S	.	.	H	α-helix	trans	-69.2	-42.3	177.1	73.6	0	0	0	0	112.8	K87 F88 L89 T94 Y95	K87-S91 PolarHBondContact O-N 3.33Å; F88-S91 PolarHBondContact O-N 3.48Å; F88-S91 VanDerWaalsContact O-N 3.11Å; F88-S91 PolarHBondContact O-OG 2.97Å; L89-S91 VanDerWaalsContact C-N 3.31Å; L89-S91 PolarHBondContact O-N 3.45Å; S91-T94 PolarHBondContact O-N 3.02Å; S91-Y95 PolarHBondContact O-N 3Å
92	E	92	Very high	93	Very high	89 Å²	89	104.4 Å²	104.4	42%	0.416	50%	0.502	S	S	.	.	H	α-helix	trans	-63.8	-41.8	174	-82.8	-66.2	156.6	0	0	112	F88 L89 T94 Y95 K96	F88-E92 HydrophobicContact CD1-CG 4.37Å; F88-E92 HydrophobicContact CE1-CG 3.78Å; F88-E92 HydrophobicContact CE2-CG 4.22Å; F88-E92 HydrophobicContact CZ-CG 3.67Å; F88-E92 PolarHBondContact O-N 3.19Å; L89-E92 PolarHBondContact O-N 3.24Å; E92-T94 VanDerWaalsContact C-N 3.35Å; E92-T94 PolarHBondContact O-N 2.98Å; E92-Y95 PolarHBondContact O-N 2.84Å; E92-K96 VanDerWaalsContact O-CB 3.28Å; E92-K96 WeakPolarHBondContact O-CB 3.32Å; E92-K96 PolarHBondContact O-N 2.86Å
93	M	91.7	Very high	93	Very high	70 Å²	70	102.6 Å²	102.6	35%	0.345	50%	0.502	S	S	.	.	H	α-helix	trans	-63	-41.2	174.2	-76.2	-65.1	-64.3	0	0	111.6	L89 K96 Y97	L89-M93 HydrophobicContact CD1-CG 4.35Å; L89-M93 WeakPolarHBondContact O-CB 3.38Å; L89-M93 VanDerWaalsContact O-CG 3.29Å; L89-M93 WeakPolarHBondContact O-CG 3.42Å; L89-M93 PolarHBondContact O-N 2.95Å; M93-K96 PolarHBondContact O-N 3.01Å; M93-K96 HydrophobicContact SD-CD 4.42Å; M93-Y97 HydrophobicContact CE-CE2 3.79Å; M93-Y97 WeakPolarHBondContact O-CD2 3.45Å; M93-Y97 PolarHBondContact O-N 3.16Å
94	T	92.4	Very high	92.9	Very high	88 Å²	88	104 Å²	104	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-42.2	175.9	-57.9	0	0	0	0	111.9	D90 S91 E92 Y97 T98	D90-T94 WeakPolarHBondContact O-CB 3.44Å; D90-T94 PolarHBondContact O-N 2.78Å; D90-T94 PolarHBondContact O-OG1 3.15Å; S91-T94 PolarHBondContact O-N 3.02Å; E92-T94 VanDerWaalsContact C-N 3.35Å; E92-T94 PolarHBondContact O-N 2.98Å; T94-Y97 PolarHBondContact O-N 3.01Å; T94-T98 PolarHBondContact O-N 3.36Å; T94-T98 PolarHBondContact O-OG1 3.23Å
95	Y	90.7	Very high	92.7	Very high	136 Å²	136	100.6 Å²	100.6	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-45.5	174.1	179.5	-121.2	0	0	0	111.6	S91 E92 Y97 T98 L99	S91-Y95 PolarHBondContact O-N 3Å; E92-Y95 PolarHBondContact O-N 2.84Å; Y95-Y97 PolarHBondContact O-N 3.41Å; Y95-T98 WeakPolarHBondContact O-CA 3.44Å; Y95-T98 WeakPolarHBondContact O-CB 3.47Å; Y95-T98 PolarHBondContact O-N 2.91Å; Y95-T98 VanDerWaalsContact O-N 3.09Å; Y95-L99 HydrophobicContact CD1-CD1 4.13Å; Y95-L99 HydrophobicContact CD2-CG 4.45Å; Y95-L99 HydrophobicContact CE1-CD1 3.59Å; Y95-L99 HydrophobicContact CE1-CG 4.26Å; Y95-L99 HydrophobicContact CE2-CD1 4.26Å; Y95-L99 HydrophobicContact CE2-CD2 4.17Å; Y95-L99 HydrophobicContact CE2-CG 4.06Å; Y95-L99 PolarHBondContact O-N 3.32Å
96	K	93.5	Very high	92.6	Very high	138 Å²	138	98.7 Å²	98.7	60%	0.6	48%	0.481	S	S	*	.	H	α-helix	trans	-60	-43	176.3	-176.3	179.8	178.4	-178.3	0	112.9	E92 M93 T98 L99 A100	E92-K96 VanDerWaalsContact O-CB 3.28Å; E92-K96 WeakPolarHBondContact O-CB 3.32Å; E92-K96 PolarHBondContact O-N 2.86Å; M93-K96 PolarHBondContact O-N 3.01Å; M93-K96 HydrophobicContact SD-CD 4.42Å; K96-T98 VanDerWaalsContact C-N 3.31Å; K96-L99 PolarHBondContact O-N 2.59Å; K96-A100 WeakPolarHBondContact O-CB 3.5Å; K96-A100 PolarHBondContact O-N 2.74Å
97	Y	91.2	Very high	92.6	Very high	160 Å²	160	99.3 Å²	99.3	63%	0.627	48%	0.48	S	S	*	.	H	α-helix	trans	-63.8	-37.7	173.3	-77.2	-58.7	0	0	0	112	M93 T94 Y95 A100 R101	M93-Y97 HydrophobicContact CE-CE2 3.79Å; M93-Y97 WeakPolarHBondContact O-CD2 3.45Å; M93-Y97 PolarHBondContact O-N 3.16Å; T94-Y97 PolarHBondContact O-N 3.01Å; Y95-Y97 PolarHBondContact O-N 3.41Å; Y97-A100 PolarHBondContact O-N 3.37Å; Y97-R101 PolarHBondContact O-N 3.15Å
98	T	92.8	Very high	92.4	Very high	57 Å²	57	94.9 Å²	94.9	35%	0.35	47%	0.468	S	S	.	.	H	α-helix	trans	-65.6	-45	176.7	-57.1	0	0	0	0	111.6	T94 Y95 K96 R101 L102	T94-T98 PolarHBondContact O-N 3.36Å; T94-T98 PolarHBondContact O-OG1 3.23Å; Y95-T98 WeakPolarHBondContact O-CA 3.44Å; Y95-T98 WeakPolarHBondContact O-CB 3.47Å; Y95-T98 PolarHBondContact O-N 2.91Å; Y95-T98 VanDerWaalsContact O-N 3.09Å; K96-T98 VanDerWaalsContact C-N 3.31Å; T98-R101 PolarHBondContact O-N 3.31Å; T98-L102 HydrophobicContact CG2-CD1 4.22Å; T98-L102 WeakPolarHBondContact O-CG 3.16Å; T98-L102 PolarHBondContact O-N 3.45Å
99	L	92.1	Very high	92.3	Very high	81 Å²	81	94.8 Å²	94.8	42%	0.424	46%	0.464	S	S	.	.	H	α-helix	trans	-62	-42.3	173.4	-71.7	-178.9	0	0	0	112.3	Y95 K96 R101 L102 L103	Y95-L99 HydrophobicContact CD1-CD1 4.13Å; Y95-L99 HydrophobicContact CD2-CG 4.45Å; Y95-L99 HydrophobicContact CE1-CD1 3.59Å; Y95-L99 HydrophobicContact CE1-CG 4.26Å; Y95-L99 HydrophobicContact CE2-CD1 4.26Å; Y95-L99 HydrophobicContact CE2-CD2 4.17Å; Y95-L99 HydrophobicContact CE2-CG 4.06Å; Y95-L99 PolarHBondContact O-N 3.32Å; K96-L99 PolarHBondContact O-N 2.59Å; L99-R101 PolarHBondContact O-N 3.16Å; L99-L102 PolarHBondContact O-N 3.48Å; L99-L103 WeakPolarHBondContact O-CB 3.18Å; L99-L103 PolarHBondContact O-N 3.44Å
100	A	92.6	Very high	92.2	Very high	54 Å²	54	93.4 Å²	93.4	45%	0.446	46%	0.457	S	S	.	.	H	α-helix	trans	-61.7	-41.9	177.4	0	0	0	0	0	112	K96 Y97 L103 E104	K96-A100 WeakPolarHBondContact O-CB 3.5Å; K96-A100 PolarHBondContact O-N 2.74Å; Y97-A100 PolarHBondContact O-N 3.37Å; A100-L103 PolarHBondContact O-N 3.01Å; A100-E104 PolarHBondContact O-N 2.56Å; A100-E104 VanDerWaalsContact O-N 3.1Å
101	R	93.3	Very high	92.1	Very high	145 Å²	145	93.8 Å²	93.8	55%	0.547	46%	0.458	S	S	.	.	H	α-helix	trans	-62.8	-47.2	173.9	-179.3	173.9	64.8	94.6	-11.3	112	Y97 T98 L99 L103 E104 E105	Y97-R101 PolarHBondContact O-N 3.15Å; T98-R101 PolarHBondContact O-N 3.31Å; L99-R101 PolarHBondContact O-N 3.16Å; R101-L103 VanDerWaalsContact C-N 3.31Å; R101-L103 PolarHBondContact O-N 2.87Å; R101-E104 PolarHBondContact O-N 2.63Å; R101-E105 IonicContact CZ-OE1 2.8Å; R101-E105 IonicContact NH1-OE1 3.85Å; R101-E105 PolarHBondContact NH1-OE1 3.49Å; R101-E105 WeakPolarHBondContact O-CG 3.42Å; R101-E105 PolarHBondContact O-N 3.2Å
102	L	92.6	Very high	92	Very high	88 Å²	88	96.3 Å²	96.3	46%	0.461	46%	0.463	S	S	.	.	H	α-helix	trans	-63.5	-36.3	179.5	-71.5	171.1	0	0	0	112.4	T98 L99 Q106	T98-L102 HydrophobicContact CG2-CD1 4.22Å; T98-L102 WeakPolarHBondContact O-CG 3.16Å; T98-L102 PolarHBondContact O-N 3.45Å; L99-L102 PolarHBondContact O-N 3.48Å; L102-Q106 WeakPolarHBondContact O-CB 3.37Å; L102-Q106 PolarHBondContact O-N 3.41Å
103	L	93.9	Very high	92	Very high	107 Å²	107	97.1 Å²	97.1	56%	0.56	47%	0.47	S	S	*	.	H	α-helix	trans	-63.5	-45.1	173.7	178.1	61.3	0	0	0	111.6	L99 A100 R101 Q106 K107	L99-L103 WeakPolarHBondContact O-CB 3.18Å; L99-L103 PolarHBondContact O-N 3.44Å; A100-L103 PolarHBondContact O-N 3.01Å; R101-L103 VanDerWaalsContact C-N 3.31Å; R101-L103 PolarHBondContact O-N 2.87Å; L103-Q106 PolarHBondContact O-N 3.22Å; L103-K107 WeakPolarHBondContact O-CG 3.47Å; L103-K107 PolarHBondContact O-N 3.12Å
104	E	91.6	Very high	92	Very high	95 Å²	95	99 Å²	99	44%	0.444	48%	0.478	S	S	.	.	H	α-helix	trans	-68.5	-41.5	179	-153.8	61.6	-140.4	0	0	111.9	A100 R101 Q106 K107 C108	A100-E104 PolarHBondContact O-N 2.56Å; A100-E104 VanDerWaalsContact O-N 3.1Å; R101-E104 PolarHBondContact O-N 2.63Å; E104-Q106 PolarHBondContact O-N 3.05Å; E104-K107 PolarHBondContact O-N 2.9Å; E104-K107 WeakPolarHBondContact OE1-CD 3.36Å; E104-K107 IonicContact OE1-NZ 2.74Å; E104-K107 WeakPolarHBondContact OE2-CE 3.23Å; E104-K107 IonicContact OE2-NZ 3.7Å; E104-K107 PolarHBondContact OE2-NZ 3.06Å; E104-C108 PolarHBondContact O-N 3.44Å; E104-C108 PolarHBondContact O-SG 3.33Å; E104-C108 VanDerWaalsContact O-SG 3.37Å
105	E	92.1	Very high	91.9	Very high	63 Å²	63	99.1 Å²	99.1	29%	0.294	47%	0.472	S	S	.	.	H	α-helix	trans	-56.3	-38.4	170.5	-77.3	-177.1	-141.2	0	0	112.1	R101 R109	R101-E105 IonicContact CZ-OE1 2.8Å; R101-E105 IonicContact NH1-OE1 3.85Å; R101-E105 PolarHBondContact NH1-OE1 3.49Å; R101-E105 WeakPolarHBondContact O-CG 3.42Å; R101-E105 PolarHBondContact O-N 3.2Å; E105-R109 VanDerWaalsContact O-CG 3.24Å; E105-R109 WeakPolarHBondContact O-CG 3.44Å; E105-R109 PolarHBondContact O-N 3.49Å; E105-R109 VanDerWaalsContact O-N 3.08Å; E105-R109 IonicContact OE2-CZ 2.69Å; E105-R109 IonicContact OE2-NH2 3.12Å; E105-R109 PolarHBondContact OE2-NH2 2.87Å
106	Q	91.6	Very high	91.9	Very high	82 Å²	82	97.7 Å²	97.7	38%	0.383	47%	0.469	S	S	.	.	H	α-helix	trans	-72.8	-37.8	178.1	-170.2	57.1	40.9	0	0	112.6	L102 L103 E104 C108 R109 N110	L102-Q106 WeakPolarHBondContact O-CB 3.37Å; L102-Q106 PolarHBondContact O-N 3.41Å; L103-Q106 PolarHBondContact O-N 3.22Å; E104-Q106 PolarHBondContact O-N 3.05Å; Q106-C108 VanDerWaalsContact C-N 3.35Å; Q106-C108 PolarHBondContact O-N 2.98Å; Q106-R109 PolarHBondContact O-N 3.46Å; Q106-N110 PolarHBondContact NE2-OD1 3.43Å; Q106-N110 PolarHBondContact O-N 2.97Å; Q106-N110 PolarHBondContact O-OD1 3.33Å
107	K	93	Very high	91.8	Very high	94 Å²	94	93.1 Å²	93.1	41%	0.409	46%	0.456	S	S	.	.	H	α-helix	trans	-58.6	-46.7	170.7	-67.6	178.1	-163	162.2	0	111.4	L103 E104 R109 N110 L111	L103-K107 WeakPolarHBondContact O-CG 3.47Å; L103-K107 PolarHBondContact O-N 3.12Å; E104-K107 PolarHBondContact O-N 2.9Å; E104-K107 WeakPolarHBondContact OE1-CD 3.36Å; E104-K107 IonicContact OE1-NZ 2.74Å; E104-K107 WeakPolarHBondContact OE2-CE 3.23Å; E104-K107 IonicContact OE2-NZ 3.7Å; E104-K107 PolarHBondContact OE2-NZ 3.06Å; K107-R109 VanDerWaalsContact C-N 3.26Å; K107-R109 PolarHBondContact O-N 2.94Å; K107-N110 PolarHBondContact O-N 3.27Å; K107-N110 VanDerWaalsContact O-N 3.12Å; K107-L111 WeakPolarHBondContact O-CG 3.44Å; K107-L111 PolarHBondContact O-N 3.15Å
108	C	89.9	Confident	91.8	Very high	62 Å²	62	87.6 Å²	87.6	42%	0.419	44%	0.444	S	S	.	.	H	α-helix	trans	-59.3	-37	176.8	-69.6	0	0	0	0	112.3	E104 Q106 Q112	E104-C108 PolarHBondContact O-N 3.44Å; E104-C108 PolarHBondContact O-SG 3.33Å; E104-C108 VanDerWaalsContact O-SG 3.37Å; Q106-C108 VanDerWaalsContact C-N 3.35Å; Q106-C108 PolarHBondContact O-N 2.98Å; C108-Q112 VanDerWaalsContact O-CG 3.32Å; C108-Q112 WeakPolarHBondContact O-CG 3.37Å; C108-Q112 PolarHBondContact O-N 3.34Å
109	R	91.3	Very high	91.8	Very high	120 Å²	120	88.6 Å²	88.6	45%	0.453	45%	0.45	S	S	.	.	H	α-helix	trans	-69.3	-40.6	173.9	-68.5	166.4	-160	-178.3	6.8	112.2	E105 Q106 K107 Q112 L113	E105-R109 VanDerWaalsContact O-CG 3.24Å; E105-R109 WeakPolarHBondContact O-CG 3.44Å; E105-R109 PolarHBondContact O-N 3.49Å; E105-R109 VanDerWaalsContact O-N 3.08Å; E105-R109 IonicContact OE2-CZ 2.69Å; E105-R109 IonicContact OE2-NH2 3.12Å; E105-R109 PolarHBondContact OE2-NH2 2.87Å; Q106-R109 PolarHBondContact O-N 3.46Å; K107-R109 VanDerWaalsContact C-N 3.26Å; K107-R109 PolarHBondContact O-N 2.94Å; R109-Q112 PolarHBondContact O-N 3.26Å; R109-L113 WeakPolarHBondContact O-CG 3.48Å; R109-L113 PolarHBondContact O-N 3.09Å; R109-L113 VanDerWaalsContact O-N 3.08Å
110	N	92.2	Very high	91.8	Very high	68 Å²	68	91 Å²	91	36%	0.364	46%	0.457	S	S	.	.	H	α-helix	trans	-62.3	-49.6	176.8	-73.3	15.6	0	0	0	111.3	Q106 K107 Q112 L113 E114	Q106-N110 PolarHBondContact NE2-OD1 3.43Å; Q106-N110 PolarHBondContact O-N 2.97Å; Q106-N110 PolarHBondContact O-OD1 3.33Å; K107-N110 PolarHBondContact O-N 3.27Å; K107-N110 VanDerWaalsContact O-N 3.12Å; N110-Q112 VanDerWaalsContact C-N 3.26Å; N110-Q112 PolarHBondContact O-N 3.38Å; N110-L113 CarbonylContact O-C 3.57Å; N110-L113 WeakPolarHBondContact O-CA 3.35Å; N110-L113 WeakPolarHBondContact O-CB 3.39Å; N110-L113 PolarHBondContact O-N 2.94Å; N110-E114 WeakPolarHBondContact O-CG 3.47Å; N110-E114 PolarHBondContact O-N 2.85Å
111	L	92.2	Very high	91.7	Very high	109 Å²	109	94.8 Å²	94.8	57%	0.571	47%	0.466	S	S	*	.	H	α-helix	trans	-56.4	-39.2	175.7	-69.8	167.3	0	0	0	112.4	K107 L113 H115	K107-L111 WeakPolarHBondContact O-CG 3.44Å; K107-L111 PolarHBondContact O-N 3.15Å; L111-L113 VanDerWaalsContact C-N 3.29Å; L111-L113 PolarHBondContact O-N 3.32Å; L111-H115 WeakPolarHBondContact O-CB 3.37Å; L111-H115 PolarHBondContact O-N 2.98Å
112	Q	89.5	Confident	91.6	Very high	116 Å²	116	93.4 Å²	93.4	54%	0.542	47%	0.469	S	S	.	.	H	α-helix	trans	-69.9	-21.3	174.2	-75.1	-178.8	19.9	0	0	114.3	C108 R109 N110 K116	C108-Q112 VanDerWaalsContact O-CG 3.32Å; C108-Q112 WeakPolarHBondContact O-CG 3.37Å; C108-Q112 PolarHBondContact O-N 3.34Å; R109-Q112 PolarHBondContact O-N 3.26Å; N110-Q112 VanDerWaalsContact C-N 3.26Å; N110-Q112 PolarHBondContact O-N 3.38Å; Q112-K116 WeakPolarHBondContact O-CD 3.42Å; Q112-K116 WeakPolarHBondContact O-CE 3.26Å; Q112-K116 WeakPolarHBondContact O-CG 3.41Å
113	L	91.9	Very high	91.6	Very high	107 Å²	107	96.5 Å²	96.5	56%	0.56	48%	0.475	S	S	*	.	H	α-helix	trans	-87	-40.1	175	-71.2	169	0	0	0	110.9	R109 N110 L111 K116 A117	R109-L113 WeakPolarHBondContact O-CG 3.48Å; R109-L113 PolarHBondContact O-N 3.09Å; R109-L113 VanDerWaalsContact O-N 3.08Å; N110-L113 CarbonylContact O-C 3.57Å; N110-L113 WeakPolarHBondContact O-CA 3.35Å; N110-L113 WeakPolarHBondContact O-CB 3.39Å; N110-L113 PolarHBondContact O-N 2.94Å; L111-L113 VanDerWaalsContact C-N 3.29Å; L111-L113 PolarHBondContact O-N 3.32Å; L113-K116 CarbonylContact O-C 3.41Å; L113-K116 PolarHBondContact O-N 2.84Å; L113-K116 VanDerWaalsContact O-N 3.15Å; L113-A117 PolarHBondContact O-N 3.05Å
114	E	92	Very high	91.5	Very high	110 Å²	110	97.3 Å²	97.3	51%	0.514	48%	0.475	S	S	.	.	H	α-helix	trans	-58.7	-49.3	172.8	-70.6	158.2	-156.6	0	0	111	N110 K116 A117 A118	N110-E114 WeakPolarHBondContact O-CG 3.47Å; N110-E114 PolarHBondContact O-N 2.85Å; E114-K116 VanDerWaalsContact C-N 3.26Å; E114-K116 PolarHBondContact O-N 3.12Å; E114-A117 WeakPolarHBondContact O-CB 3.41Å; E114-A117 PolarHBondContact O-N 3.47Å; E114-A117 VanDerWaalsContact O-N 3.13Å; E114-A118 PolarHBondContact O-N 2.94Å
115	H	89.8	Confident	91.6	Very high	90 Å²	90	95 Å²	95	42%	0.417	47%	0.473	S	S	.	.	H	α-helix	trans	-61.9	-33	174.6	-170.5	-43	0	0	0	112.4	L111 V119 Y282	L111-H115 WeakPolarHBondContact O-CB 3.37Å; L111-H115 PolarHBondContact O-N 2.98Å; H115-V119 VanDerWaalsContact O-CG2 3.29Å; H115-V119 WeakPolarHBondContact O-CG2 3.41Å; H115-V119 PolarHBondContact O-N 3.14Å; H115-Y282 AromaticContact NE2-CE1 3.6Å
116	K	91.8	Very high	91.6	Very high	106 Å²	106	96.4 Å²	96.4	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-72.4	-36.5	174.9	-76.6	168.1	-167.9	152.8	0	111.9	Q112 L113 E114 F120	Q112-K116 WeakPolarHBondContact O-CD 3.42Å; Q112-K116 WeakPolarHBondContact O-CE 3.26Å; Q112-K116 WeakPolarHBondContact O-CG 3.41Å; L113-K116 CarbonylContact O-C 3.41Å; L113-K116 PolarHBondContact O-N 2.84Å; L113-K116 VanDerWaalsContact O-N 3.15Å; E114-K116 VanDerWaalsContact C-N 3.26Å; E114-K116 PolarHBondContact O-N 3.12Å; K116-F120 HydrophobicContact CB-CE2 4.34Å; K116-F120 WeakPolarHBondContact O-CD2 3.45Å; K116-F120 WeakPolarHBondContact O-CG 3.29Å; K116-F120 PolarHBondContact O-N 3.45Å
117	A	90.8	Very high	91.6	Very high	41 Å²	41	96.3 Å²	96.3	34%	0.339	48%	0.482	S	S	.	.	H	α-helix	trans	-61.9	-51.9	175.2	0	0	0	0	0	110.7	L113 E114 V119 F120 E121	L113-A117 PolarHBondContact O-N 3.05Å; E114-A117 WeakPolarHBondContact O-CB 3.41Å; E114-A117 PolarHBondContact O-N 3.47Å; E114-A117 VanDerWaalsContact O-N 3.13Å; A117-V119 VanDerWaalsContact C-N 3.35Å; A117-V119 PolarHBondContact O-N 2.96Å; A117-F120 CarbonylContact O-C 3.3Å; A117-F120 WeakPolarHBondContact O-CA 3.48Å; A117-F120 WeakPolarHBondContact O-CB 3.4Å; A117-F120 PolarHBondContact O-N 3.36Å; A117-E121 WeakPolarHBondContact O-CG 3.32Å; A117-E121 PolarHBondContact O-N 3.26Å
118	A	91.6	Very high	91.6	Very high	45 Å²	45	95.8 Å²	95.8	37%	0.372	48%	0.484	S	S	.	.	H	α-helix	trans	-55	-46.6	176.7	0	0	0	0	0	112.6	E114 F120 E121 D122	E114-A118 PolarHBondContact O-N 2.94Å; A118-F120 VanDerWaalsContact C-N 3.26Å; A118-F120 PolarHBondContact O-N 3.38Å; A118-E121 PolarHBondContact O-N 2.88Å; A118-E121 VanDerWaalsContact O-N 3.13Å; A118-D122 PolarHBondContact O-N 3.09Å
119	V	92.6	Very high	91.8	Very high	77 Å²	77	97.6 Å²	97.6	47%	0.467	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-27	176.9	170	0	0	0	0	112.9	H115 A117 R123	H115-V119 VanDerWaalsContact O-CG2 3.29Å; H115-V119 WeakPolarHBondContact O-CG2 3.41Å; H115-V119 PolarHBondContact O-N 3.14Å; A117-V119 VanDerWaalsContact C-N 3.35Å; A117-V119 PolarHBondContact O-N 2.96Å; V119-R123 WeakPolarHBondContact O-CB 2.98Å; V119-R123 PolarHBondContact O-N 2.95Å
120	F	90.7	Very high	91.8	Very high	133 Å²	133	96.7 Å²	96.7	58%	0.583	49%	0.489	S	S	*	.	H	α-helix	trans	-78.3	-37	171.4	-70.8	-49.7	0	0	0	112.5	K116 A117 A118 R123 E124	K116-F120 HydrophobicContact CB-CE2 4.34Å; K116-F120 WeakPolarHBondContact O-CD2 3.45Å; K116-F120 WeakPolarHBondContact O-CG 3.29Å; K116-F120 PolarHBondContact O-N 3.45Å; A117-F120 CarbonylContact O-C 3.3Å; A117-F120 WeakPolarHBondContact O-CA 3.48Å; A117-F120 WeakPolarHBondContact O-CB 3.4Å; A117-F120 PolarHBondContact O-N 3.36Å; A118-F120 VanDerWaalsContact C-N 3.26Å; A118-F120 PolarHBondContact O-N 3.38Å; F120-R123 PolarHBondContact O-N 3.2Å; F120-E124 WeakPolarHBondContact O-CB 3.46Å; F120-E124 PolarHBondContact O-N 2.94Å
121	E	91.9	Very high	91.8	Very high	133 Å²	133	98.5 Å²	98.5	62%	0.621	50%	0.498	S	S	*	.	H	α-helix	trans	-64.8	-45.9	175.7	-71.3	170	-171.8	0	0	111.5	A117 A118 R123 E124 A125	A117-E121 WeakPolarHBondContact O-CG 3.32Å; A117-E121 PolarHBondContact O-N 3.26Å; A118-E121 PolarHBondContact O-N 2.88Å; A118-E121 VanDerWaalsContact O-N 3.13Å; E121-R123 VanDerWaalsContact C-N 3.3Å; E121-R123 PolarHBondContact O-N 3.36Å; E121-E124 PolarHBondContact O-N 3.38Å; E121-A125 WeakPolarHBondContact O-CB 3.47Å; E121-A125 PolarHBondContact O-N 3.43Å
122	D	91.2	Very high	91.8	Very high	116 Å²	116	100 Å²	100	62%	0.62	50%	0.5	S	S	*	.	H	α-helix	trans	-57.6	-42.8	172.1	-77.2	-31.4	0	0	0	111.7	A118 A125 M126	A118-D122 PolarHBondContact O-N 3.09Å; D122-A125 PolarHBondContact O-N 3.19Å; D122-M126 WeakPolarHBondContact O-CB 2.77Å; D122-M126 PolarHBondContact O-N 2.9Å
123	R	91.9	Very high	92	Very high	153 Å²	153	101.6 Å²	101.6	58%	0.577	51%	0.505	S	S	*	.	H	α-helix	trans	-68	-38.1	178.4	-175.8	176.1	-179.4	168.1	3.3	112	V119 F120 E121 M126 L127	V119-R123 WeakPolarHBondContact O-CB 2.98Å; V119-R123 PolarHBondContact O-N 2.95Å; F120-R123 PolarHBondContact O-N 3.2Å; E121-R123 VanDerWaalsContact C-N 3.3Å; E121-R123 PolarHBondContact O-N 3.36Å; R123-M126 HydrophobicContact CG-CE 4.43Å; R123-M126 PolarHBondContact O-N 2.83Å; R123-L127 HydrophobicContact CG-CD1 4.14Å; R123-L127 WeakPolarHBondContact O-CB 3.38Å; R123-L127 VanDerWaalsContact O-CG 3.26Å; R123-L127 WeakPolarHBondContact O-CG 3.49Å; R123-L127 PolarHBondContact O-N 2.84Å
124	E	91.8	Very high	92	Very high	123 Å²	123	100.9 Å²	100.9	58%	0.575	50%	0.501	S	S	*	.	H	α-helix	trans	-66.7	-44.1	174.8	-177.9	167	167.2	0	0	110.8	F120 E121 M126 L127 N128	F120-E124 WeakPolarHBondContact O-CB 3.46Å; F120-E124 PolarHBondContact O-N 2.94Å; E121-E124 PolarHBondContact O-N 3.38Å; E124-M126 VanDerWaalsContact C-N 3.35Å; E124-M126 PolarHBondContact O-N 2.85Å; E124-L127 PolarHBondContact O-N 2.99Å; E124-N128 WeakPolarHBondContact CG-ND2 3.44Å; E124-N128 WeakPolarHBondContact O-CB 3.32Å; E124-N128 VanDerWaalsContact O-CG 3.3Å; E124-N128 PolarHBondContact O-N 3.05Å; E124-N128 PolarHBondContact O-ND2 3.48Å
125	A	92.7	Very high	92.1	Very high	48 Å²	48	100.3 Å²	100.3	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-42	173.6	0	0	0	0	0	112.3	E121 D122 N129	E121-A125 WeakPolarHBondContact O-CB 3.47Å; E121-A125 PolarHBondContact O-N 3.43Å; D122-A125 PolarHBondContact O-N 3.19Å; A125-N129 WeakPolarHBondContact O-CB 3.47Å; A125-N129 PolarHBondContact O-N 3.2Å; A125-N129 PolarHBondContact O-ND2 3.27Å
126	M	92.1	Very high	92.3	Very high	91 Å²	91	101.3 Å²	101.3	45%	0.448	51%	0.505	S	S	.	.	H	α-helix	trans	-62.7	-45.8	173.4	-176.6	-164.9	61.9	0	0	111.8	D122 R123 E124 N129 K130	D122-M126 WeakPolarHBondContact O-CB 2.77Å; D122-M126 PolarHBondContact O-N 2.9Å; R123-M126 HydrophobicContact CG-CE 4.43Å; R123-M126 PolarHBondContact O-N 2.83Å; E124-M126 VanDerWaalsContact C-N 3.35Å; E124-M126 PolarHBondContact O-N 2.85Å; M126-N129 PolarHBondContact O-N 3.32Å; M126-K130 PolarHBondContact O-N 3.12Å
127	L	92.7	Very high	92.4	Very high	80 Å²	80	99.6 Å²	99.6	42%	0.419	50%	0.499	S	S	.	.	H	α-helix	trans	-66.2	-41.6	-179.5	-74.5	170.2	0	0	0	112	R123 E124 N129 K130 L131	R123-L127 HydrophobicContact CG-CD1 4.14Å; R123-L127 WeakPolarHBondContact O-CB 3.38Å; R123-L127 VanDerWaalsContact O-CG 3.26Å; R123-L127 WeakPolarHBondContact O-CG 3.49Å; R123-L127 PolarHBondContact O-N 2.84Å; E124-L127 PolarHBondContact O-N 2.99Å; L127-N129 VanDerWaalsContact C-N 3.34Å; L127-N129 PolarHBondContact O-N 3.43Å; L127-K130 PolarHBondContact O-N 3.33Å; L127-K130 VanDerWaalsContact O-N 3.12Å; L127-L131 WeakPolarHBondContact O-CG 3.43Å; L127-L131 PolarHBondContact O-N 3.31Å
128	N	92.5	Very high	92.5	Very high	83 Å²	83	102.3 Å²	102.3	44%	0.444	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-38.9	175.3	-72.2	-26.3	0	0	0	111.6	E124 L131 F132	E124-N128 WeakPolarHBondContact CG-ND2 3.44Å; E124-N128 WeakPolarHBondContact O-CB 3.32Å; E124-N128 VanDerWaalsContact O-CG 3.3Å; E124-N128 PolarHBondContact O-N 3.05Å; E124-N128 PolarHBondContact O-ND2 3.48Å; N128-L131 PolarHBondContact O-N 3.32Å; N128-F132 WeakPolarHBondContact O-CB 3.08Å; N128-F132 PolarHBondContact O-N 3.44Å
129	N	94	Very high	92.5	Very high	101 Å²	101	103.6 Å²	103.6	54%	0.54	51%	0.51	S	S	.	.	H	α-helix	trans	-64.8	-36.3	171.4	-84.2	-66.7	0	0	0	113.1	A125 M126 L127 K133	A125-N129 WeakPolarHBondContact O-CB 3.47Å; A125-N129 PolarHBondContact O-N 3.2Å; A125-N129 PolarHBondContact O-ND2 3.27Å; M126-N129 PolarHBondContact O-N 3.32Å; L127-N129 VanDerWaalsContact C-N 3.34Å; L127-N129 PolarHBondContact O-N 3.43Å; N129-K133 WeakPolarHBondContact O-CG 3.47Å; N129-K133 PolarHBondContact O-N 2.9Å
130	K	92.7	Very high	92.6	Very high	101 Å²	101	104 Å²	104	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-68.8	-41.7	173.5	-71.7	-168.5	-180	-163.4	0	111.7	M126 L127 K133 L134	M126-K130 PolarHBondContact O-N 3.12Å; L127-K130 PolarHBondContact O-N 3.33Å; L127-K130 VanDerWaalsContact O-N 3.12Å; K130-K133 PolarHBondContact O-N 3.13Å; K130-L134 WeakPolarHBondContact O-CG 3.33Å; K130-L134 PolarHBondContact O-N 3.38Å; K130-L134 VanDerWaalsContact O-N 3.09Å
131	L	90.6	Very high	92.7	Very high	105 Å²	105	103.9 Å²	103.9	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-61.1	-45.6	175.2	-72.9	171.1	0	0	0	111.9	L127 N128 K133 L134 D135	L127-L131 WeakPolarHBondContact O-CG 3.43Å; L127-L131 PolarHBondContact O-N 3.31Å; N128-L131 PolarHBondContact O-N 3.32Å; L131-K133 VanDerWaalsContact C-N 3.32Å; L131-K133 PolarHBondContact O-N 3.21Å; L131-L134 PolarHBondContact O-N 2.87Å; L131-L134 VanDerWaalsContact O-N 3.14Å; L131-D135 WeakPolarHBondContact O-CB 3.33Å; L131-D135 PolarHBondContact O-N 2.83Å
132	F	92	Very high	92.8	Very high	142 Å²	142	101.7 Å²	101.7	62%	0.623	50%	0.496	S	S	*	.	H	α-helix	trans	-60.8	-38.2	177.3	-178.4	-103.2	0	0	0	113	N128 K136	N128-F132 WeakPolarHBondContact O-CB 3.08Å; N128-F132 PolarHBondContact O-N 3.44Å; F132-K136 PolarHBondContact O-N 3.29Å; F132-K136 VanDerWaalsContact O-N 3.12Å
133	K	93.8	Very high	92.9	Very high	148 Å²	148	101 Å²	101	64%	0.643	49%	0.489	S	S	*	.	H	α-helix	trans	-64.9	-41.3	173.5	-73.6	178	178.7	-175.4	0	112.2	N129 K130 L131 Q137	N129-K133 WeakPolarHBondContact O-CG 3.47Å; N129-K133 PolarHBondContact O-N 2.9Å; K130-K133 PolarHBondContact O-N 3.13Å; L131-K133 VanDerWaalsContact C-N 3.32Å; L131-K133 PolarHBondContact O-N 3.21Å; K133-Q137 WeakPolarHBondContact O-CG 3.39Å; K133-Q137 PolarHBondContact O-N 3.32Å
134	L	93.7	Very high	92.8	Very high	92 Å²	92	98.9 Å²	98.9	48%	0.482	49%	0.485	S	S	.	.	H	α-helix	trans	-68.3	-40	178	-71	169	0	0	0	112.2	K130 L131 Q137 L138	K130-L134 WeakPolarHBondContact O-CG 3.33Å; K130-L134 PolarHBondContact O-N 3.38Å; K130-L134 VanDerWaalsContact O-N 3.09Å; L131-L134 PolarHBondContact O-N 2.87Å; L131-L134 VanDerWaalsContact O-N 3.14Å; L134-Q137 CarbonylContact O-C 3.57Å; L134-Q137 PolarHBondContact O-N 3.36Å; L134-L138 WeakPolarHBondContact O-CG 3.21Å; L134-L138 PolarHBondContact O-N 3.18Å
135	D	93.6	Very high	92.8	Very high	99 Å²	99	96.9 Å²	96.9	53%	0.529	48%	0.478	S	S	.	.	H	α-helix	trans	-62.1	-42.8	176	-167.5	61.3	0	0	0	111.6	L131 Q137 L138 T139	L131-D135 WeakPolarHBondContact O-CB 3.33Å; L131-D135 PolarHBondContact O-N 2.83Å; D135-Q137 PolarHBondContact O-N 3.03Å; D135-L138 PolarHBondContact O-N 3.26Å; D135-T139 PolarHBondContact O-N 3.33Å; D135-T139 PolarHBondContact O-OG1 3.18Å
136	K	94.3	Very high	92.9	Very high	111 Å²	111	99.3 Å²	99.3	48%	0.483	48%	0.479	S	S	.	.	H	α-helix	trans	-60.1	-44.9	170.9	-172.1	172.1	-176.5	-70.8	0	112.3	F132 L138 T139 E140	F132-K136 PolarHBondContact O-N 3.29Å; F132-K136 VanDerWaalsContact O-N 3.12Å; K136-L138 VanDerWaalsContact C-N 3.3Å; K136-L138 PolarHBondContact O-N 3.3Å; K136-T139 PolarHBondContact O-N 2.92Å; K136-T139 PolarHBondContact O-OG1 3.32Å; K136-E140 IonicContact NZ-OE1 2.88Å; K136-E140 PolarHBondContact NZ-OE1 3.45Å; K136-E140 WeakPolarHBondContact O-CB 3.42Å; K136-E140 VanDerWaalsContact O-CG 3.32Å; K136-E140 WeakPolarHBondContact O-CG 3.43Å; K136-E140 PolarHBondContact O-N 3.22Å
137	Q	92.5	Very high	92.9	Very high	69 Å²	69	100.5 Å²	100.5	32%	0.322	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-29	176.1	-75	-178.1	-17.9	0	0	113.6	K133 L134 D135 R141	K133-Q137 WeakPolarHBondContact O-CG 3.39Å; K133-Q137 PolarHBondContact O-N 3.32Å; L134-Q137 CarbonylContact O-C 3.57Å; L134-Q137 PolarHBondContact O-N 3.36Å; D135-Q137 PolarHBondContact O-N 3.03Å; Q137-R141 WeakPolarHBondContact O-CG 3.43Å; Q137-R141 PolarHBondContact O-N 3.13Å; Q137-R141 VanDerWaalsContact O-N 3.16Å
138	L	93.2	Very high	93	Very high	98 Å²	98	101.5 Å²	101.5	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-71.2	-49.6	174.4	-75	169	0	0	0	110.8	L134 D135 K136 E140 R141 D142	L134-L138 WeakPolarHBondContact O-CG 3.21Å; L134-L138 PolarHBondContact O-N 3.18Å; D135-L138 PolarHBondContact O-N 3.26Å; K136-L138 VanDerWaalsContact C-N 3.3Å; K136-L138 PolarHBondContact O-N 3.3Å; L138-E140 VanDerWaalsContact C-N 3.31Å; L138-E140 PolarHBondContact O-N 3.33Å; L138-R141 WeakPolarHBondContact O-CA 3.19Å; L138-R141 PolarHBondContact O-N 2.83Å; L138-D142 PolarHBondContact O-N 3.05Å
139	T	93.1	Very high	92.9	Very high	72 Å²	72	104 Å²	104	44%	0.442	50%	0.496	S	S	.	.	H	α-helix	trans	-59.7	-40.3	176.4	53.3	0	0	0	0	112.3	D135 K136 R141 D142 E143	D135-T139 PolarHBondContact O-N 3.33Å; D135-T139 PolarHBondContact O-OG1 3.18Å; K136-T139 PolarHBondContact O-N 2.92Å; K136-T139 PolarHBondContact O-OG1 3.32Å; T139-R141 VanDerWaalsContact C-N 3.32Å; T139-R141 PolarHBondContact O-N 3.3Å; T139-D142 PolarHBondContact O-N 3.01Å; T139-E143 PolarHBondContact O-N 2.92Å; T139-E143 VanDerWaalsContact O-N 3.15Å
140	E	93	Very high	92.8	Very high	86 Å²	86	105.2 Å²	105.2	40%	0.402	50%	0.498	S	S	.	.	H	α-helix	trans	-61.3	-36.4	172.4	-74.4	170.3	177.3	0	0	112.8	K136 L138 H144	K136-E140 IonicContact NZ-OE1 2.88Å; K136-E140 PolarHBondContact NZ-OE1 3.45Å; K136-E140 WeakPolarHBondContact O-CB 3.42Å; K136-E140 VanDerWaalsContact O-CG 3.32Å; K136-E140 WeakPolarHBondContact O-CG 3.43Å; K136-E140 PolarHBondContact O-N 3.22Å; L138-E140 VanDerWaalsContact C-N 3.31Å; L138-E140 PolarHBondContact O-N 3.33Å; E140-H144 PolarHBondContact O-N 3.01Å; E140-H144 PolarHBondContact O-ND1 2.97Å
141	R	93.4	Very high	92.8	Very high	130 Å²	130	104.5 Å²	104.5	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-74.3	-36.1	175.8	-77.4	174.7	177.4	147.4	3.1	112.6	Q137 L138 T139 E143 H144 I145	Q137-R141 WeakPolarHBondContact O-CG 3.43Å; Q137-R141 PolarHBondContact O-N 3.13Å; Q137-R141 VanDerWaalsContact O-N 3.16Å; L138-R141 WeakPolarHBondContact O-CA 3.19Å; L138-R141 PolarHBondContact O-N 2.83Å; T139-R141 VanDerWaalsContact C-N 3.32Å; T139-R141 PolarHBondContact O-N 3.3Å; R141-E143 VanDerWaalsContact C-N 3.34Å; R141-E143 PolarHBondContact O-N 2.96Å; R141-H144 PolarHBondContact O-N 3.29Å; R141-I145 WeakPolarHBondContact O-CB 3.47Å; R141-I145 VanDerWaalsContact O-CG1 3.27Å; R141-I145 WeakPolarHBondContact O-CG1 3.42Å; R141-I145 PolarHBondContact O-N 3.43Å
142	D	93.5	Very high	92.9	Very high	88 Å²	88	103.6 Å²	103.6	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-36.3	177	-78	-17.1	0	0	0	112	L138 T139 I145 K146	L138-D142 PolarHBondContact O-N 3.05Å; T139-D142 PolarHBondContact O-N 3.01Å; D142-I145 PolarHBondContact O-N 3.24Å; D142-K146 WeakPolarHBondContact O-CG 3.41Å; D142-K146 PolarHBondContact O-N 3.1Å; D142-K146 VanDerWaalsContact O-N 3.16Å
143	E	93.1	Very high	92.8	Very high	101 Å²	101	101.6 Å²	101.6	47%	0.472	49%	0.485	S	S	.	.	H	α-helix	trans	-66.9	-46.9	171.8	-59.6	-48.6	144.6	0	0	112	T139 R141 I145 K146 E147	T139-E143 PolarHBondContact O-N 2.92Å; T139-E143 VanDerWaalsContact O-N 3.15Å; R141-E143 VanDerWaalsContact C-N 3.34Å; R141-E143 PolarHBondContact O-N 2.96Å; E143-I145 PolarHBondContact O-N 3.46Å; E143-K146 WeakPolarHBondContact O-CB 3.17Å; E143-K146 PolarHBondContact O-N 2.71Å; E143-K146 IonicContact OE1-NZ 3.69Å; E143-K146 PolarHBondContact OE1-NZ 3.19Å; E143-K146 WeakPolarHBondContact OE2-CD 3.42Å; E143-K146 WeakPolarHBondContact OE2-CE 3.5Å; E143-K146 IonicContact OE2-NZ 2.87Å; E143-K146 PolarHBondContact OE2-NZ 3.35Å; E143-E147 PolarHBondContact O-N 2.72Å
144	H	91.4	Very high	92.8	Very high	109 Å²	109	99.1 Å²	99.1	51%	0.505	48%	0.479	S	S	.	.	H	α-helix	trans	-58.3	-34	174.7	-69.2	116.5	0	0	0	112.6	E140 R141 E147 L148	E140-H144 PolarHBondContact O-N 3.01Å; E140-H144 PolarHBondContact O-ND1 2.97Å; R141-H144 PolarHBondContact O-N 3.29Å; H144-E147 IonicContact CD2-OE2 3.98Å; H144-E147 PolarHBondContact O-N 3.49Å; H144-L148 WeakPolarHBondContact O-CB 3.28Å; H144-L148 VanDerWaalsContact O-CG 3.31Å; H144-L148 WeakPolarHBondContact O-CG 3.39Å; H144-L148 PolarHBondContact O-N 3.09Å
145	I	91.8	Very high	92.7	Very high	81 Å²	81	102 Å²	102	42%	0.415	49%	0.485	S	S	.	.	H	α-helix	trans	-66.5	-39.6	175.3	-74.1	165.7	0	0	0	111	R141 D142 E143 L148 F149	R141-I145 WeakPolarHBondContact O-CB 3.47Å; R141-I145 VanDerWaalsContact O-CG1 3.27Å; R141-I145 WeakPolarHBondContact O-CG1 3.42Å; R141-I145 PolarHBondContact O-N 3.43Å; D142-I145 PolarHBondContact O-N 3.24Å; E143-I145 PolarHBondContact O-N 3.46Å; I145-L148 PolarHBondContact O-N 3.1Å; I145-F149 HydrophobicContact CG2-CD2 3.77Å; I145-F149 HydrophobicContact CG2-CE2 3.53Å; I145-F149 WeakPolarHBondContact O-CD2 3.4Å; I145-F149 PolarHBondContact O-N 3.26Å
146	K	92.9	Very high	92.7	Very high	98 Å²	98	102.5 Å²	102.5	43%	0.426	48%	0.484	S	S	.	.	H	α-helix	trans	-64.8	-43.4	173.6	-64.7	169.5	-146.5	168.5	0	111.7	D142 E143 L148 F149 H150	D142-K146 WeakPolarHBondContact O-CG 3.41Å; D142-K146 PolarHBondContact O-N 3.1Å; D142-K146 VanDerWaalsContact O-N 3.16Å; E143-K146 WeakPolarHBondContact O-CB 3.17Å; E143-K146 PolarHBondContact O-N 2.71Å; E143-K146 IonicContact OE1-NZ 3.69Å; E143-K146 PolarHBondContact OE1-NZ 3.19Å; E143-K146 WeakPolarHBondContact OE2-CD 3.42Å; E143-K146 WeakPolarHBondContact OE2-CE 3.5Å; E143-K146 IonicContact OE2-NZ 2.87Å; E143-K146 PolarHBondContact OE2-NZ 3.35Å; K146-L148 VanDerWaalsContact C-N 3.32Å; K146-L148 PolarHBondContact O-N 3.21Å; K146-F149 PolarHBondContact O-N 3.17Å; K146-H150 PolarHBondContact O-CD2 3.2Å; K146-H150 PolarHBondContact O-N 2.61Å
147	E	93.7	Very high	92.6	Very high	117 Å²	117	100.6 Å²	100.6	55%	0.547	48%	0.479	S	S	.	.	H	α-helix	trans	-57.9	-45.2	174.6	-68.2	-176.8	157.7	0	0	111.3	E143 H144 F149 H150 I151	E143-E147 PolarHBondContact O-N 2.72Å; H144-E147 IonicContact CD2-OE2 3.98Å; H144-E147 PolarHBondContact O-N 3.49Å; E147-F149 PolarHBondContact O-N 3.2Å; E147-H150 PolarHBondContact O-N 3.21Å; E147-I151 WeakPolarHBondContact O-CG1 3.36Å; E147-I151 PolarHBondContact O-N 3.48Å
148	L	93.4	Very high	92.7	Very high	100 Å²	100	101.8 Å²	101.8	52%	0.524	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-39.2	175.3	-73.3	170.3	0	0	0	112.7	H144 I145 K146 I151 I152	H144-L148 WeakPolarHBondContact O-CB 3.28Å; H144-L148 VanDerWaalsContact O-CG 3.31Å; H144-L148 WeakPolarHBondContact O-CG 3.39Å; H144-L148 PolarHBondContact O-N 3.09Å; I145-L148 PolarHBondContact O-N 3.1Å; K146-L148 VanDerWaalsContact C-N 3.32Å; K146-L148 PolarHBondContact O-N 3.21Å; L148-I151 PolarHBondContact O-N 3.29Å; L148-I152 WeakPolarHBondContact O-CB 3.48Å; L148-I152 WeakPolarHBondContact O-CD1 3.26Å; L148-I152 VanDerWaalsContact O-CG1 3.24Å; L148-I152 WeakPolarHBondContact O-CG1 3.3Å; L148-I152 PolarHBondContact O-N 3.17Å
149	F	91.5	Very high	92.6	Very high	136 Å²	136	102.7 Å²	102.7	60%	0.596	49%	0.492	S	S	*	.	H	α-helix	trans	-63.6	-38.9	173.8	-83	-60.3	0	0	0	112.7	I145 K146 E147 I152 H153	I145-F149 HydrophobicContact CG2-CD2 3.77Å; I145-F149 HydrophobicContact CG2-CE2 3.53Å; I145-F149 WeakPolarHBondContact O-CD2 3.4Å; I145-F149 PolarHBondContact O-N 3.26Å; K146-F149 PolarHBondContact O-N 3.17Å; E147-F149 PolarHBondContact O-N 3.2Å; F149-I152 PolarHBondContact O-N 3.01Å; F149-H153 WeakPolarHBondContact O-CB 3.38Å; F149-H153 PolarHBondContact O-N 2.86Å
150	H	91.8	Very high	92.6	Very high	127 Å²	127	104 Å²	104	59%	0.588	50%	0.496	S	S	*	.	H	α-helix	trans	-63.7	-45	172.9	-74	-62.3	0	0	0	111.8	K146 E147 I152 H153 D154	K146-H150 PolarHBondContact O-CD2 3.2Å; K146-H150 PolarHBondContact O-N 2.61Å; E147-H150 PolarHBondContact O-N 3.21Å; H150-I152 PolarHBondContact O-N 3.05Å; H150-H153 PolarHBondContact O-N 3.26Å; H150-D154 PolarHBondContact O-N 3.02Å
151	I	93.2	Very high	92.6	Very high	86 Å²	86	104.1 Å²	104.1	44%	0.441	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-42.9	176.8	-69	164	0	0	0	111.4	E147 L148 D154 Y155	E147-I151 WeakPolarHBondContact O-CG1 3.36Å; E147-I151 PolarHBondContact O-N 3.48Å; L148-I151 PolarHBondContact O-N 3.29Å; I151-D154 PolarHBondContact O-N 2.84Å; I151-Y155 HydrophobicContact CG2-CD2 3.74Å; I151-Y155 HydrophobicContact CG2-CE2 3.61Å; I151-Y155 VanDerWaalsContact O-CD2 3.22Å; I151-Y155 WeakPolarHBondContact O-CD2 3.28Å; I151-Y155 PolarHBondContact O-N 2.78Å
152	I	91.1	Very high	92.6	Very high	86 Å²	86	101.8 Å²	101.8	44%	0.441	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-47.9	176.3	-71.5	163.4	0	0	0	110.6	L148 F149 H150 D154 Y155 E156	L148-I152 WeakPolarHBondContact O-CB 3.48Å; L148-I152 WeakPolarHBondContact O-CD1 3.26Å; L148-I152 VanDerWaalsContact O-CG1 3.24Å; L148-I152 WeakPolarHBondContact O-CG1 3.3Å; L148-I152 PolarHBondContact O-N 3.17Å; F149-I152 PolarHBondContact O-N 3.01Å; H150-I152 PolarHBondContact O-N 3.05Å; I152-D154 VanDerWaalsContact C-N 3.31Å; I152-D154 PolarHBondContact O-N 3.34Å; I152-Y155 PolarHBondContact O-N 3.04Å; I152-E156 HydrophobicContact CG2-CG 4.44Å; I152-E156 WeakPolarHBondContact O-CG 3.39Å; I152-E156 PolarHBondContact O-N 3.34Å
153	H	91.7	Very high	92.6	Very high	100 Å²	100	102.4 Å²	102.4	46%	0.463	50%	0.496	S	S	.	.	H	α-helix	trans	-58.9	-40.5	177.6	172.5	-93.9	0	0	0	112.2	F149 H150 E156 N157	F149-H153 WeakPolarHBondContact O-CB 3.38Å; F149-H153 PolarHBondContact O-N 2.86Å; H150-H153 PolarHBondContact O-N 3.26Å; H153-E156 PolarHBondContact O-N 3.22Å; H153-N157 PolarHBondContact CE1-ND2 2.95Å; H153-N157 PolarHBondContact ND1-ND2 3.44Å; H153-N157 PolarHBondContact NE2-ND2 2.84Å; H153-N157 PolarHBondContact O-N 3.2Å; H153-N157 PolarHBondContact O-ND2 3.26Å
154	D	93	Very high	92.5	Very high	95 Å²	95	103.9 Å²	103.9	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-68.5	-37.9	177.3	-71.2	-5.6	0	0	0	111.9	H150 I151 I152 N157 L158	H150-D154 PolarHBondContact O-N 3.02Å; I151-D154 PolarHBondContact O-N 2.84Å; I152-D154 VanDerWaalsContact C-N 3.31Å; I152-D154 PolarHBondContact O-N 3.34Å; D154-N157 PolarHBondContact O-N 2.78Å; D154-L158 WeakPolarHBondContact O-CG 3.35Å; D154-L158 PolarHBondContact O-N 2.89Å
155	Y	92.4	Very high	92.6	Very high	153 Å²	153	103.4 Å²	103.4	60%	0.6	50%	0.501	S	S	*	.	H	α-helix	trans	-64.6	-39.8	170.5	-83	-63.3	0	0	0	113	I151 I152 N157 L158 L159	I151-Y155 HydrophobicContact CG2-CD2 3.74Å; I151-Y155 HydrophobicContact CG2-CE2 3.61Å; I151-Y155 VanDerWaalsContact O-CD2 3.22Å; I151-Y155 WeakPolarHBondContact O-CD2 3.28Å; I151-Y155 PolarHBondContact O-N 2.78Å; I152-Y155 PolarHBondContact O-N 3.04Å; Y155-N157 VanDerWaalsContact C-N 3.33Å; Y155-N157 PolarHBondContact O-N 3.34Å; Y155-L158 PolarHBondContact O-N 3.02Å; Y155-L159 WeakPolarHBondContact O-CB 3.36Å; Y155-L159 VanDerWaalsContact O-CG 3.28Å; Y155-L159 WeakPolarHBondContact O-CG 3.37Å; Y155-L159 PolarHBondContact O-N 3.25Å
156	E	92.4	Very high	92.5	Very high	110 Å²	110	103.7 Å²	103.7	51%	0.514	51%	0.506	S	S	.	.	H	α-helix	trans	-61.5	-41.4	174.3	-73.9	-176.1	159.5	0	0	111.5	I152 H153 L159 N160	I152-E156 HydrophobicContact CG2-CG 4.44Å; I152-E156 WeakPolarHBondContact O-CG 3.39Å; I152-E156 PolarHBondContact O-N 3.34Å; H153-E156 PolarHBondContact O-N 3.22Å; E156-L159 PolarHBondContact O-N 3.08Å; E156-N160 PolarHBondContact O-N 3.38Å; E156-N160 PolarHBondContact O-ND2 3.09Å
157	N	93.3	Very high	92.5	Very high	71 Å²	71	102.3 Å²	102.3	38%	0.38	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-43.4	175.2	-76.4	-67.8	0	0	0	112	H153 D154 Y155 L159 N160 I161	H153-N157 PolarHBondContact CE1-ND2 2.95Å; H153-N157 PolarHBondContact ND1-ND2 3.44Å; H153-N157 PolarHBondContact NE2-ND2 2.84Å; H153-N157 PolarHBondContact O-N 3.2Å; H153-N157 PolarHBondContact O-ND2 3.26Å; D154-N157 PolarHBondContact O-N 2.78Å; Y155-N157 VanDerWaalsContact C-N 3.33Å; Y155-N157 PolarHBondContact O-N 3.34Å; N157-L159 PolarHBondContact O-N 2.92Å; N157-N160 PolarHBondContact O-N 3.04Å; N157-I161 WeakPolarHBondContact O-CG1 3.48Å; N157-I161 PolarHBondContact O-N 2.7Å
158	L	92.8	Very high	92.5	Very high	93 Å²	93	103.2 Å²	103.2	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-40.3	174.3	-72.3	169.7	0	0	0	112.5	D154 Y155 I161 N162	D154-L158 WeakPolarHBondContact O-CG 3.35Å; D154-L158 PolarHBondContact O-N 2.89Å; Y155-L158 PolarHBondContact O-N 3.02Å; L158-I161 PolarHBondContact O-N 2.87Å; L158-N162 WeakPolarHBondContact O-CB 3.27Å; L158-N162 VanDerWaalsContact O-CG 3.23Å; L158-N162 PolarHBondContact O-N 3.15Å; L158-N162 PolarHBondContact O-ND2 3.4Å; L158-N162 VanDerWaalsContact O-ND2 3.16Å
159	L	91.9	Very high	92.5	Very high	118 Å²	118	104.6 Å²	104.6	62%	0.618	51%	0.51	S	S	*	.	H	α-helix	trans	-64	-42.1	175.6	-75.4	169	0	0	0	111.8	Y155 E156 N157 N162 Q163	Y155-L159 WeakPolarHBondContact O-CB 3.36Å; Y155-L159 VanDerWaalsContact O-CG 3.28Å; Y155-L159 WeakPolarHBondContact O-CG 3.37Å; Y155-L159 PolarHBondContact O-N 3.25Å; E156-L159 PolarHBondContact O-N 3.08Å; N157-L159 PolarHBondContact O-N 2.92Å; L159-N162 PolarHBondContact O-N 3.31Å; L159-Q163 WeakPolarHBondContact O-CB 3.31Å; L159-Q163 PolarHBondContact O-N 3.4Å
160	N	93	Very high	92.6	Very high	100 Å²	100	101.7 Å²	101.7	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-61.2	-47	174.7	-78.2	-61.6	0	0	0	111.8	E156 N157 N162 Q163 E164	E156-N160 PolarHBondContact O-N 3.38Å; E156-N160 PolarHBondContact O-ND2 3.09Å; N157-N160 PolarHBondContact O-N 3.04Å; N160-N162 VanDerWaalsContact C-N 3.35Å; N160-N162 PolarHBondContact O-N 2.9Å; N160-Q163 PolarHBondContact O-N 3.41Å; N160-E164 PolarHBondContact O-N 2.81Å
161	I	93.4	Very high	92.7	Very high	88 Å²	88	101.6 Å²	101.6	45%	0.451	51%	0.506	S	S	.	.	H	α-helix	trans	-59.9	-44.8	176.6	-68.2	163.7	0	0	0	111	N157 L158 Q163 E164 Q165	N157-I161 WeakPolarHBondContact O-CG1 3.48Å; N157-I161 PolarHBondContact O-N 2.7Å; L158-I161 PolarHBondContact O-N 2.87Å; I161-Q163 VanDerWaalsContact C-N 3.34Å; I161-Q163 PolarHBondContact O-N 3.03Å; I161-E164 PolarHBondContact O-N 3.48Å; I161-Q165 WeakPolarHBondContact O-CG 2.87Å; I161-Q165 PolarHBondContact O-N 3.5Å
162	N	92.7	Very high	92.7	Very high	81 Å²	81	101.8 Å²	101.8	43%	0.433	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-37.5	177.8	-73.3	-29.3	0	0	0	112	L158 L159 N160 Q165 V166	L158-N162 WeakPolarHBondContact O-CB 3.27Å; L158-N162 VanDerWaalsContact O-CG 3.23Å; L158-N162 PolarHBondContact O-N 3.15Å; L158-N162 PolarHBondContact O-ND2 3.4Å; L158-N162 VanDerWaalsContact O-ND2 3.16Å; L159-N162 PolarHBondContact O-N 3.31Å; N160-N162 VanDerWaalsContact C-N 3.35Å; N160-N162 PolarHBondContact O-N 2.9Å; N162-Q165 PolarHBondContact O-N 2.87Å; N162-V166 WeakPolarHBondContact O-CB 3.21Å; N162-V166 WeakPolarHBondContact O-CG2 3.23Å; N162-V166 PolarHBondContact O-N 3.33Å
163	Q	93.7	Very high	92.8	Very high	100 Å²	100	102.3 Å²	102.3	47%	0.467	51%	0.508	S	S	.	.	H	α-helix	trans	-67.3	-37	176.1	-173.6	61.8	21.3	0	0	112.4	L159 N160 I161 V166 T167	L159-Q163 WeakPolarHBondContact O-CB 3.31Å; L159-Q163 PolarHBondContact O-N 3.4Å; N160-Q163 PolarHBondContact O-N 3.41Å; I161-Q163 VanDerWaalsContact C-N 3.34Å; I161-Q163 PolarHBondContact O-N 3.03Å; Q163-V166 PolarHBondContact O-N 3.44Å; Q163-T167 WeakPolarHBondContact O-CB 3.37Å; Q163-T167 WeakPolarHBondContact O-CG2 3.38Å; Q163-T167 PolarHBondContact O-N 3.21Å; Q163-T167 PolarHBondContact O-OG1 3.04Å
164	E	92.6	Very high	92.8	Very high	133 Å²	133	104 Å²	104	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-65.5	-39	171.8	-70.4	-169.9	161.1	0	0	111.6	N160 I161 T167 K168	N160-E164 PolarHBondContact O-N 2.81Å; I161-E164 PolarHBondContact O-N 3.48Å; E164-T167 WeakPolarHBondContact CA-OG1 3.38Å; E164-T167 PolarHBondContact O-OG1 3.36Å; E164-T167 VanDerWaalsContact O-OG1 3.07Å; E164-K168 WeakPolarHBondContact O-CB 3.48Å; E164-K168 PolarHBondContact O-N 2.88Å
165	Q	91.5	Very high	92.9	Very high	99 Å²	99	102.2 Å²	102.2	46%	0.463	51%	0.507	S	S	.	.	H	α-helix	trans	-66.5	-42.2	173.4	-69.2	-172.7	35.3	0	0	113.2	I161 N162 K168 K169	I161-Q165 WeakPolarHBondContact O-CG 2.87Å; I161-Q165 PolarHBondContact O-N 3.5Å; N162-Q165 PolarHBondContact O-N 2.87Å; Q165-K168 PolarHBondContact O-N 2.82Å; Q165-K169 WeakPolarHBondContact O-CG 3.31Å; Q165-K169 PolarHBondContact O-N 3.03Å
166	V	91.7	Very high	92.9	Very high	86 Å²	86	96.9 Å²	96.9	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-42.6	178.4	167.4	0	0	0	0	111	N162 Q163 K169 S170	N162-V166 WeakPolarHBondContact O-CB 3.21Å; N162-V166 WeakPolarHBondContact O-CG2 3.23Å; N162-V166 PolarHBondContact O-N 3.33Å; Q163-V166 PolarHBondContact O-N 3.44Å; V166-K169 PolarHBondContact O-N 3.1Å; V166-S170 VanDerWaalsContact O-CB 3.29Å; V166-S170 WeakPolarHBondContact O-CB 3.38Å; V166-S170 PolarHBondContact O-N 2.96Å
167	T	92.1	Very high	92.9	Very high	70 Å²	70	98 Å²	98	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-66.1	-39.3	176.7	47.9	0	0	0	0	112.2	Q163 E164 S170 H171	Q163-T167 WeakPolarHBondContact O-CB 3.37Å; Q163-T167 WeakPolarHBondContact O-CG2 3.38Å; Q163-T167 PolarHBondContact O-N 3.21Å; Q163-T167 PolarHBondContact O-OG1 3.04Å; E164-T167 WeakPolarHBondContact CA-OG1 3.38Å; E164-T167 PolarHBondContact O-OG1 3.36Å; E164-T167 VanDerWaalsContact O-OG1 3.07Å; T167-S170 PolarHBondContact O-N 3.12Å; T167-H171 PolarHBondContact O-N 2.85Å; T167-H171 VanDerWaalsContact O-N 3.09Å
168	K	93.1	Very high	92.8	Very high	135 Å²	135	97.4 Å²	97.4	59%	0.587	50%	0.499	S	S	*	.	H	α-helix	trans	-59.6	-51.7	171.8	-174.2	175.9	-174.4	-86.7	0	112.1	E164 Q165 S170 H171 E172	E164-K168 WeakPolarHBondContact O-CB 3.48Å; E164-K168 PolarHBondContact O-N 2.88Å; Q165-K168 PolarHBondContact O-N 2.82Å; K168-S170 VanDerWaalsContact C-N 3.28Å; K168-S170 PolarHBondContact O-N 2.97Å; K168-H171 WeakPolarHBondContact O-CB 2.99Å; K168-H171 PolarHBondContact O-N 3.22Å; K168-H171 VanDerWaalsContact O-N 3.12Å; K168-E172 WeakPolarHBondContact CE-OE1 3.29Å; K168-E172 IonicContact NZ-OE1 2.67Å; K168-E172 PolarHBondContact NZ-OE1 2.69Å; K168-E172 WeakPolarHBondContact O-CG 3.49Å; K168-E172 PolarHBondContact O-N 3.41Å
169	K	94.1	Very high	92.9	Very high	130 Å²	130	98.1 Å²	98.1	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-62.9	-33.2	178.7	-74.5	176.7	177	173.5	0	113	Q165 V166 L173	Q165-K169 WeakPolarHBondContact O-CG 3.31Å; Q165-K169 PolarHBondContact O-N 3.03Å; V166-K169 PolarHBondContact O-N 3.1Å; K169-L173 VanDerWaalsContact O-CB 3.27Å; K169-L173 WeakPolarHBondContact O-CB 3.39Å; K169-L173 PolarHBondContact O-N 3.35Å
170	S	92.5	Very high	92.8	Very high	75 Å²	75	98 Å²	98	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-65.3	-39.7	174	-169.9	0	0	0	0	112	V166 T167 K168 L173 F174	V166-S170 VanDerWaalsContact O-CB 3.29Å; V166-S170 WeakPolarHBondContact O-CB 3.38Å; V166-S170 PolarHBondContact O-N 2.96Å; T167-S170 PolarHBondContact O-N 3.12Å; K168-S170 VanDerWaalsContact C-N 3.28Å; K168-S170 PolarHBondContact O-N 2.97Å; S170-L173 PolarHBondContact O-N 3.02Å; S170-F174 PolarHBondContact O-N 3.23Å
171	H	93.8	Very high	92.8	Very high	124 Å²	124	97.1 Å²	97.1	57%	0.574	50%	0.5	S	S	*	.	H	α-helix	trans	-68.6	-43.8	174.4	-175.5	61.1	0	0	0	112.3	T167 K168 L173 F174 V175	T167-H171 PolarHBondContact O-N 2.85Å; T167-H171 VanDerWaalsContact O-N 3.09Å; K168-H171 WeakPolarHBondContact O-CB 2.99Å; K168-H171 PolarHBondContact O-N 3.22Å; K168-H171 VanDerWaalsContact O-N 3.12Å; H171-L173 VanDerWaalsContact C-N 3.29Å; H171-L173 PolarHBondContact O-N 2.92Å; H171-F174 WeakPolarHBondContact O-CB 3.25Å; H171-F174 PolarHBondContact O-N 2.91Å; H171-F174 VanDerWaalsContact O-N 3.09Å; H171-V175 WeakPolarHBondContact O-CG2 3.21Å; H171-V175 PolarHBondContact O-N 3.46Å
172	E	93.2	Very high	92.8	Very high	90 Å²	90	97.7 Å²	97.7	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-56.4	-43.6	173.4	-69	165.8	172	0	0	111.4	K168 F174 V175 A176	K168-E172 WeakPolarHBondContact CE-OE1 3.29Å; K168-E172 IonicContact NZ-OE1 2.67Å; K168-E172 PolarHBondContact NZ-OE1 2.69Å; K168-E172 WeakPolarHBondContact O-CG 3.49Å; K168-E172 PolarHBondContact O-N 3.41Å; E172-F174 PolarHBondContact O-N 2.91Å; E172-V175 PolarHBondContact O-N 3.36Å; E172-A176 PolarHBondContact O-N 3.1Å
173	L	93.3	Very high	92.8	Very high	97 Å²	97	98.4 Å²	98.4	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-67.9	-31.2	175.9	-177.7	149.9	0	0	0	113.2	K169 S170 H171 K177	K169-L173 VanDerWaalsContact O-CB 3.27Å; K169-L173 WeakPolarHBondContact O-CB 3.39Å; K169-L173 PolarHBondContact O-N 3.35Å; S170-L173 PolarHBondContact O-N 3.02Å; H171-L173 VanDerWaalsContact C-N 3.29Å; H171-L173 PolarHBondContact O-N 2.92Å; L173-K177 HydrophobicContact CD2-CD 3.93Å; L173-K177 WeakPolarHBondContact O-CG 3.27Å; L173-K177 PolarHBondContact O-N 2.8Å; L173-K177 VanDerWaalsContact O-N 3.14Å
174	F	92.9	Very high	92.7	Very high	137 Å²	137	102.4 Å²	102.4	60%	0.601	52%	0.515	S	S	*	.	H	α-helix	trans	-68.8	-44.9	173.3	177.6	-91.4	0	0	0	111.7	S170 H171 E172 K177 S178	S170-F174 PolarHBondContact O-N 3.23Å; H171-F174 WeakPolarHBondContact O-CB 3.25Å; H171-F174 PolarHBondContact O-N 2.91Å; H171-F174 VanDerWaalsContact O-N 3.09Å; E172-F174 PolarHBondContact O-N 2.91Å; F174-K177 WeakPolarHBondContact O-CB 3.43Å; F174-K177 PolarHBondContact O-N 3.35Å; F174-S178 PolarHBondContact O-N 3.37Å
175	V	94.2	Very high	92.7	Very high	56 Å²	56	98.3 Å²	98.3	34%	0.339	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-50.2	176.3	174.7	0	0	0	0	110.5	H171 E172 K177 S178 E179	H171-V175 WeakPolarHBondContact O-CG2 3.21Å; H171-V175 PolarHBondContact O-N 3.46Å; E172-V175 PolarHBondContact O-N 3.36Å; V175-K177 PolarHBondContact O-N 2.97Å; V175-S178 WeakPolarHBondContact O-CA 3.43Å; V175-S178 VanDerWaalsContact O-CB 3.32Å; V175-S178 WeakPolarHBondContact O-CB 2.89Å; V175-S178 PolarHBondContact O-N 3.32Å; V175-E179 HydrophobicContact CG1-CG 4.5Å; V175-E179 PolarHBondContact O-N 2.95Å
176	A	92	Very high	92.7	Very high	41 Å²	41	98.4 Å²	98.4	34%	0.339	50%	0.503	S	S	.	.	H	α-helix	trans	-59.8	-31.8	177.4	0	0	0	0	0	113.3	E172 L180	E172-A176 PolarHBondContact O-N 3.1Å; A176-L180 WeakPolarHBondContact O-CB 3.36Å; A176-L180 VanDerWaalsContact O-CG 3.27Å; A176-L180 WeakPolarHBondContact O-CG 3.44Å; A176-L180 PolarHBondContact O-N 2.89Å
177	K	93.3	Very high	92.7	Very high	134 Å²	134	98.6 Å²	98.6	58%	0.583	50%	0.5	S	S	*	.	H	α-helix	trans	-69.3	-35.9	171.9	-82.1	178.5	176.1	177.5	0	113	L173 F174 V175 S181	L173-K177 HydrophobicContact CD2-CD 3.93Å; L173-K177 WeakPolarHBondContact O-CG 3.27Å; L173-K177 PolarHBondContact O-N 2.8Å; L173-K177 VanDerWaalsContact O-N 3.14Å; F174-K177 WeakPolarHBondContact O-CB 3.43Å; F174-K177 PolarHBondContact O-N 3.35Å; V175-K177 PolarHBondContact O-N 2.97Å; K177-S181 WeakPolarHBondContact O-CB 3.36Å; K177-S181 PolarHBondContact O-N 3.13Å
178	S	91.4	Very high	92.6	Very high	58 Å²	58	99.6 Å²	99.6	41%	0.406	50%	0.503	S	S	.	.	H	α-helix	trans	-65.5	-48.1	174.2	-162.1	0	0	0	0	110.7	F174 V175 L180 S181 E182	F174-S178 PolarHBondContact O-N 3.37Å; V175-S178 WeakPolarHBondContact O-CA 3.43Å; V175-S178 VanDerWaalsContact O-CB 3.32Å; V175-S178 WeakPolarHBondContact O-CB 2.89Å; V175-S178 PolarHBondContact O-N 3.32Å; S178-L180 PolarHBondContact O-N 3.35Å; S178-S181 WeakPolarHBondContact O-CA 3.21Å; S178-S181 WeakPolarHBondContact O-CB 3.34Å; S178-S181 PolarHBondContact O-N 2.85Å; S178-E182 PolarHBondContact O-N 3.49Å
179	E	93.9	Very high	92.5	Very high	109 Å²	109	97.2 Å²	97.2	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-57.9	-45.1	176.4	-67.4	172	175.5	0	0	111.9	V175 S181 E182 L183	V175-E179 HydrophobicContact CG1-CG 4.5Å; V175-E179 PolarHBondContact O-N 2.95Å; E179-S181 VanDerWaalsContact C-N 3.29Å; E179-S181 PolarHBondContact O-N 3.17Å; E179-E182 PolarHBondContact O-N 3.42Å; E179-L183 WeakPolarHBondContact O-CB 3.45Å; E179-L183 VanDerWaalsContact O-CG 3.3Å; E179-L183 WeakPolarHBondContact O-CG 3.45Å; E179-L183 PolarHBondContact O-N 3.48Å
180	L	91.7	Very high	92.3	Very high	116 Å²	116	96 Å²	96	61%	0.607	50%	0.495	S	S	*	.	H	α-helix	trans	-63.1	-32.8	174.4	-76.1	170.1	0	0	0	113	A176 S178 R184	A176-L180 WeakPolarHBondContact O-CB 3.36Å; A176-L180 VanDerWaalsContact O-CG 3.27Å; A176-L180 WeakPolarHBondContact O-CG 3.44Å; A176-L180 PolarHBondContact O-N 2.89Å; S178-L180 PolarHBondContact O-N 3.35Å; L180-R184 WeakPolarHBondContact O-CB 3.34Å; L180-R184 PolarHBondContact O-N 3.42Å
181	S	92.5	Very high	92.2	Very high	80 Å²	80	97.5 Å²	97.5	56%	0.559	49%	0.494	S	S	*	.	H	α-helix	trans	-71.6	-40.8	175.8	-164.2	0	0	0	0	111.8	K177 S178 E179 R184 A185	K177-S181 WeakPolarHBondContact O-CB 3.36Å; K177-S181 PolarHBondContact O-N 3.13Å; S178-S181 WeakPolarHBondContact O-CA 3.21Å; S178-S181 WeakPolarHBondContact O-CB 3.34Å; S178-S181 PolarHBondContact O-N 2.85Å; E179-S181 VanDerWaalsContact C-N 3.29Å; E179-S181 PolarHBondContact O-N 3.17Å; S181-R184 PolarHBondContact O-N 2.91Å; S181-A185 PolarHBondContact O-N 3.03Å
182	E	92.5	Very high	91.9	Very high	101 Å²	101	97.5 Å²	97.5	47%	0.472	49%	0.494	S	S	.	.	H	α-helix	trans	-65.2	-41.8	173.2	-75.3	-173.8	-140.8	0	0	112.6	S178 E179 R184 A185 K186	S178-E182 PolarHBondContact O-N 3.49Å; E179-E182 PolarHBondContact O-N 3.42Å; E182-R184 VanDerWaalsContact C-N 3.33Å; E182-A185 PolarHBondContact O-N 3.17Å; E182-K186 WeakPolarHBondContact O-CD 3.32Å; E182-K186 VanDerWaalsContact O-CG 3.31Å; E182-K186 WeakPolarHBondContact O-CG 3.42Å; E182-K186 PolarHBondContact O-N 3.44Å; E182-K186 IonicContact OE2-NZ 3.52Å; E182-K186 PolarHBondContact OE2-NZ 3.25Å
183	L	92.8	Very high	91.5	Very high	95 Å²	95	97.8 Å²	97.8	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-64	-39.9	176.2	-73.4	169.8	0	0	0	111.1	E179 K186 I187	E179-L183 WeakPolarHBondContact O-CB 3.45Å; E179-L183 VanDerWaalsContact O-CG 3.3Å; E179-L183 WeakPolarHBondContact O-CG 3.45Å; E179-L183 PolarHBondContact O-N 3.48Å; L183-K186 PolarHBondContact O-N 2.86Å; L183-I187 WeakPolarHBondContact O-CD1 3.22Å; L183-I187 VanDerWaalsContact O-CG1 3.27Å; L183-I187 WeakPolarHBondContact O-CG1 3.5Å; L183-I187 PolarHBondContact O-N 3.18Å
184	R	91.9	Very high	91.1	Very high	184 Å²	184	96.6 Å²	96.6	69%	0.694	49%	0.492	S	S	*	.	H	α-helix	trans	-63.5	-40.7	173.1	177.4	171.4	-80	-180	-6.6	112.2	L180 S181 E182 I187 N188	L180-R184 WeakPolarHBondContact O-CB 3.34Å; L180-R184 PolarHBondContact O-N 3.42Å; S181-R184 PolarHBondContact O-N 2.91Å; E182-R184 VanDerWaalsContact C-N 3.33Å; R184-I187 PolarHBondContact O-N 3.42Å; R184-N188 VanDerWaalsContact O-CG 3.28Å; R184-N188 PolarHBondContact O-N 3.46Å; R184-N188 PolarHBondContact O-OD1 3.48Å; R184-N188 VanDerWaalsContact O-OD1 3.1Å
185	A	91.7	Very high	90.6	Very high	47 Å²	47	94.3 Å²	94.3	39%	0.388	49%	0.486	S	S	.	.	H	α-helix	trans	-60.4	-50.3	173.9	0	0	0	0	0	111.3	S181 E182 I187 N188 D189	S181-A185 PolarHBondContact O-N 3.03Å; E182-A185 PolarHBondContact O-N 3.17Å; A185-I187 VanDerWaalsContact C-N 3.26Å; A185-I187 PolarHBondContact O-N 3.35Å; A185-N188 WeakPolarHBondContact O-CB 3.29Å; A185-N188 PolarHBondContact O-N 3.44Å; A185-D189 VanDerWaalsContact O-CG 3.23Å; A185-D189 PolarHBondContact O-N 3.49Å
186	K	92.9	Very high	90	Very high	101 Å²	101	95.8 Å²	95.8	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-59.7	-33.2	177.8	-69	159.1	-171.9	157.1	0	112.9	E182 L183 I190	E182-K186 WeakPolarHBondContact O-CD 3.32Å; E182-K186 VanDerWaalsContact O-CG 3.31Å; E182-K186 WeakPolarHBondContact O-CG 3.42Å; E182-K186 PolarHBondContact O-N 3.44Å; E182-K186 IonicContact OE2-NZ 3.52Å; E182-K186 PolarHBondContact OE2-NZ 3.25Å; L183-K186 PolarHBondContact O-N 2.86Å; K186-I190 WeakPolarHBondContact O-CD1 3.46Å; K186-I190 VanDerWaalsContact O-CG1 3.23Å; K186-I190 WeakPolarHBondContact O-CG1 3.39Å; K186-I190 PolarHBondContact O-N 2.69Å; K186-I190 VanDerWaalsContact O-N 3.12Å
187	I	91.3	Very high	89.4	Confident	90 Å²	90	99.3 Å²	99.3	46%	0.462	50%	0.502	S	S	.	.	H	α-helix	trans	-66.4	-48.6	172.7	-73.1	162.7	0	0	0	110.6	L183 R184 A185 D189 I190 E191	L183-I187 WeakPolarHBondContact O-CD1 3.22Å; L183-I187 VanDerWaalsContact O-CG1 3.27Å; L183-I187 WeakPolarHBondContact O-CG1 3.5Å; L183-I187 PolarHBondContact O-N 3.18Å; R184-I187 PolarHBondContact O-N 3.42Å; A185-I187 VanDerWaalsContact C-N 3.26Å; A185-I187 PolarHBondContact O-N 3.35Å; I187-D189 VanDerWaalsContact C-N 3.31Å; I187-D189 PolarHBondContact O-N 3.31Å; I187-I190 PolarHBondContact O-N 3.18Å; I187-I190 VanDerWaalsContact O-N 3.13Å; I187-E191 HydrophobicContact CG2-CG 4.42Å; I187-E191 WeakPolarHBondContact O-CG 3.03Å; I187-E191 PolarHBondContact O-N 3.11Å
188	N	90.2	Very high	88.5	Confident	91 Å²	91	98.7 Å²	98.7	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-58.2	-43.1	176.5	-62.3	0.6	0	0	0	111.6	R184 A185 I190 E191 E192	R184-N188 VanDerWaalsContact O-CG 3.28Å; R184-N188 PolarHBondContact O-N 3.46Å; R184-N188 PolarHBondContact O-OD1 3.48Å; R184-N188 VanDerWaalsContact O-OD1 3.1Å; A185-N188 WeakPolarHBondContact O-CB 3.29Å; A185-N188 PolarHBondContact O-N 3.44Å; N188-I190 VanDerWaalsContact C-N 3.3Å; N188-I190 PolarHBondContact O-N 2.83Å; N188-E191 PolarHBondContact O-N 3.03Å; N188-E192 PolarHBondContact O-N 3.37Å
189	D	91.2	Very high	87.6	Confident	86 Å²	86	100.1 Å²	100.1	46%	0.46	50%	0.504	S	S	.	.	H	α-helix	trans	-60	-40.9	177.1	-58.3	-28	0	0	0	111.1	A185 I187 N193	A185-D189 VanDerWaalsContact O-CG 3.23Å; A185-D189 PolarHBondContact O-N 3.49Å; I187-D189 VanDerWaalsContact C-N 3.31Å; I187-D189 PolarHBondContact O-N 3.31Å; D189-N193 WeakPolarHBondContact O-CB 3.4Å; D189-N193 PolarHBondContact O-N 3.23Å; D189-N193 PolarHBondContact O-ND2 2.72Å
190	I	90	Very high	86.5	Confident	103 Å²	103	98.5 Å²	98.5	53%	0.528	50%	0.504	S	S	.	.	H	α-helix	trans	-69.1	-41	177	-70.9	165.4	0	0	0	111	K186 I187 N188 N193 I194	K186-I190 WeakPolarHBondContact O-CD1 3.46Å; K186-I190 VanDerWaalsContact O-CG1 3.23Å; K186-I190 WeakPolarHBondContact O-CG1 3.39Å; K186-I190 PolarHBondContact O-N 2.69Å; K186-I190 VanDerWaalsContact O-N 3.12Å; I187-I190 PolarHBondContact O-N 3.18Å; I187-I190 VanDerWaalsContact O-N 3.13Å; N188-I190 VanDerWaalsContact C-N 3.3Å; N188-I190 PolarHBondContact O-N 2.83Å; I190-N193 PolarHBondContact O-N 3Å; I190-I194 HydrophobicContact CG2-CD1 3.8Å; I190-I194 HydrophobicContact CG2-CG1 4.42Å; I190-I194 VanDerWaalsContact O-CG1 3.29Å; I190-I194 WeakPolarHBondContact O-CG1 3.27Å; I190-I194 PolarHBondContact O-N 3.06Å
191	E	89.9	Confident	85.1	Confident	108 Å²	108	96.2 Å²	96.2	51%	0.505	50%	0.498	S	S	.	.	H	α-helix	trans	-62.2	-42.3	175.5	-72.4	177.2	179.2	0	0	111.5	I187 N188 I194 N195	I187-E191 HydrophobicContact CG2-CG 4.42Å; I187-E191 WeakPolarHBondContact O-CG 3.03Å; I187-E191 PolarHBondContact O-N 3.11Å; N188-E191 PolarHBondContact O-N 3.03Å; E191-I194 PolarHBondContact O-N 3.38Å; E191-N195 VanDerWaalsContact O-CG 3.32Å; E191-N195 PolarHBondContact O-N 3.45Å; E191-N195 PolarHBondContact O-ND2 3.44Å
192	E	86.6	Confident	83.7	Confident	124 Å²	124	96.3 Å²	96.3	58%	0.579	50%	0.498	S	S	*	.	H	α-helix	trans	-62.4	-46.1	172.9	-175.2	169.7	-168.7	0	0	111.7	N188 I194 N195 L196	N188-E192 PolarHBondContact O-N 3.37Å; E192-I194 VanDerWaalsContact C-N 3.32Å; E192-I194 PolarHBondContact O-N 3.18Å; E192-N195 PolarHBondContact O-N 3.47Å; E192-L196 HydrophobicContact CG-CD1 4.17Å; E192-L196 HydrophobicContact CG-CG 4.48Å; E192-L196 WeakPolarHBondContact O-CG 3.34Å; E192-L196 PolarHBondContact O-N 2.85Å
193	N	86.1	Confident	82.1	Confident	96 Å²	96	98.2 Å²	98.2	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-37.4	176.6	-82.8	-75.9	0	0	0	112.8	D189 I190 L196 M197	D189-N193 WeakPolarHBondContact O-CB 3.4Å; D189-N193 PolarHBondContact O-N 3.23Å; D189-N193 PolarHBondContact O-ND2 2.72Å; I190-N193 PolarHBondContact O-N 3Å; N193-L196 PolarHBondContact O-N 2.85Å; N193-M197 WeakPolarHBondContact O-CG 3.2Å; N193-M197 PolarHBondContact O-N 2.88Å
194	I	85	Confident	80.4	Confident	72 Å²	72	98 Å²	98	37%	0.369	51%	0.507	S	S	.	.	H	α-helix	trans	-65.3	-44.7	174.5	-71.9	166.8	0	0	0	110.8	I190 E191 E192 L196 M197 Q198	I190-I194 HydrophobicContact CG2-CD1 3.8Å; I190-I194 HydrophobicContact CG2-CG1 4.42Å; I190-I194 VanDerWaalsContact O-CG1 3.29Å; I190-I194 WeakPolarHBondContact O-CG1 3.27Å; I190-I194 PolarHBondContact O-N 3.06Å; E191-I194 PolarHBondContact O-N 3.38Å; E192-I194 VanDerWaalsContact C-N 3.32Å; E192-I194 PolarHBondContact O-N 3.18Å; I194-L196 VanDerWaalsContact C-N 3.34Å; I194-L196 PolarHBondContact O-N 3.35Å; I194-M197 HydrophobicContact CG1-CE 4.09Å; I194-M197 PolarHBondContact O-N 3.48Å; I194-Q198 WeakPolarHBondContact O-CG 3.37Å; I194-Q198 PolarHBondContact O-N 2.79Å
195	N	81.6	Confident	78.5	Confident	88 Å²	88	94.6 Å²	94.6	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-60.8	-42.8	175.7	-71.8	-46.7	0	0	0	111.5	E191 E192 Q198 I199	E191-N195 VanDerWaalsContact O-CG 3.32Å; E191-N195 PolarHBondContact O-N 3.45Å; E191-N195 PolarHBondContact O-ND2 3.44Å; E192-N195 PolarHBondContact O-N 3.47Å; N195-Q198 PolarHBondContact O-N 3.44Å; N195-I199 WeakPolarHBondContact O-CG1 3.4Å; N195-I199 PolarHBondContact O-N 3.03Å; N195-I199 VanDerWaalsContact O-N 3.07Å
196	L	82.4	Confident	76.5	Confident	87 Å²	87	94.7 Å²	94.7	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-41.9	174.7	-70.8	172.2	0	0	0	112.3	E192 N193 I194 Q198 I199 C200	E192-L196 HydrophobicContact CG-CD1 4.17Å; E192-L196 HydrophobicContact CG-CG 4.48Å; E192-L196 WeakPolarHBondContact O-CG 3.34Å; E192-L196 PolarHBondContact O-N 2.85Å; N193-L196 PolarHBondContact O-N 2.85Å; I194-L196 VanDerWaalsContact C-N 3.34Å; I194-L196 PolarHBondContact O-N 3.35Å; L196-Q198 PolarHBondContact O-N 3.49Å; L196-I199 PolarHBondContact O-N 3.42Å; L196-C200 PolarHBondContact O-N 3.1Å; L196-C200 PolarHBondContact O-SG 3.48Å
197	M	78.5	Confident	74.4	Confident	115 Å²	115	96.5 Å²	96.5	57%	0.567	52%	0.517	S	S	*	.	H	α-helix	trans	-62	-41.3	174.8	-76.7	-168.2	-62.9	0	0	112.1	N193 I194 I199 C200 S201	N193-M197 WeakPolarHBondContact O-CG 3.2Å; N193-M197 PolarHBondContact O-N 2.88Å; I194-M197 HydrophobicContact CG1-CE 4.09Å; I194-M197 PolarHBondContact O-N 3.48Å; M197-I199 VanDerWaalsContact C-N 3.34Å; M197-I199 PolarHBondContact O-N 2.84Å; M197-C200 PolarHBondContact O-N 3.29Å; M197-C200 VanDerWaalsContact O-N 3.15Å; M197-S201 PolarHBondContact O-N 3.4Å; M197-S201 PolarHBondContact O-OG 3.37Å; M197-S201 VanDerWaalsContact O-OG 3.09Å
198	Q	74.9	Confident	72.3	Confident	121 Å²	121	98.5 Å²	98.5	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-63.4	-38.6	175.9	-69.1	174.7	12.8	0	0	112.2	I194 N195 L196 C200 S202	I194-Q198 WeakPolarHBondContact O-CG 3.37Å; I194-Q198 PolarHBondContact O-N 2.79Å; N195-Q198 PolarHBondContact O-N 3.44Å; L196-Q198 PolarHBondContact O-N 3.49Å; Q198-C200 VanDerWaalsContact C-N 3.35Å; Q198-S202 PolarHBondContact O-N 3Å; Q198-S202 PolarHBondContact O-OG 3.12Å
199	I	73.2	Confident	70.2	Confident	88 Å²	88	102.4 Å²	102.4	45%	0.451	54%	0.539	S	S	.	.	H	α-helix	trans	-65.4	-37.3	172.8	-66.7	163.8	0	0	0	111.3	N195 L196 M197 S202 K203	N195-I199 WeakPolarHBondContact O-CG1 3.4Å; N195-I199 PolarHBondContact O-N 3.03Å; N195-I199 VanDerWaalsContact O-N 3.07Å; L196-I199 PolarHBondContact O-N 3.42Å; M197-I199 VanDerWaalsContact C-N 3.34Å; M197-I199 PolarHBondContact O-N 2.84Å; I199-S202 PolarHBondContact O-OG 3.32Å; I199-K203 PolarHBondContact O-N 3.21Å
200	C	69.1	Low	68.3	Low	75 Å²	75	104.4 Å²	104.4	51%	0.507	55%	0.55	S	S	.	*	H	α-helix	trans	-71	-44.7	175.7	-73.6	0	0	0	0	112.3	L196 M197 Q198 S202 K203 V204	L196-C200 PolarHBondContact O-N 3.1Å; L196-C200 PolarHBondContact O-SG 3.48Å; M197-C200 PolarHBondContact O-N 3.29Å; M197-C200 VanDerWaalsContact O-N 3.15Å; Q198-C200 VanDerWaalsContact C-N 3.35Å; C200-S202 VanDerWaalsContact C-N 3.34Å; C200-S202 PolarHBondContact O-N 3.49Å; C200-K203 WeakPolarHBondContact O-CA 3.49Å; C200-K203 WeakPolarHBondContact O-CB 3.49Å; C200-K203 PolarHBondContact O-N 3.08Å; C200-V204 PolarHBondContact O-N 3.2Å
201	S	62.6	Low	66.4	Low	69 Å²	69	105.5 Å²	105.5	48%	0.483	56%	0.556	S	S	.	*	H	α-helix	trans	-59.9	-42.6	177.1	-60.9	0	0	0	0	112	M197 K203 V204 N205	M197-S201 PolarHBondContact O-N 3.4Å; M197-S201 PolarHBondContact O-OG 3.37Å; M197-S201 VanDerWaalsContact O-OG 3.09Å; S201-K203 PolarHBondContact O-N 2.98Å; S201-V204 PolarHBondContact O-N 2.85Å; S201-V204 VanDerWaalsContact O-N 3.11Å; S201-N205 PolarHBondContact O-N 2.9Å; S201-N205 VanDerWaalsContact O-N 3.12Å; S201-N205 PolarHBondContact O-OD1 3.46Å
202	S	62.6	Low	64.4	Low	82 Å²	82	109.1 Å²	109.1	57%	0.573	57%	0.572	S	S	*	*	H	α-helix	trans	-64.2	-19.9	175.3	54.1	0	0	0	0	114.1	Q198 I199 C200	Q198-S202 PolarHBondContact O-N 3Å; Q198-S202 PolarHBondContact O-OG 3.12Å; I199-S202 PolarHBondContact O-OG 3.32Å; C200-S202 VanDerWaalsContact C-N 3.34Å; C200-S202 PolarHBondContact O-N 3.49Å
203	K	60.1	Low	62.5	Low	141 Å²	141	108.4 Å²	108.4	61%	0.613	58%	0.581	S	S	*	*	H	α-helix	trans	-84.8	-35	169.8	-69.7	175.3	-179.8	176.3	0	113.4	I199 C200 S201 N205 G206	I199-K203 PolarHBondContact O-N 3.21Å; C200-K203 WeakPolarHBondContact O-CA 3.49Å; C200-K203 WeakPolarHBondContact O-CB 3.49Å; C200-K203 PolarHBondContact O-N 3.08Å; S201-K203 PolarHBondContact O-N 2.98Å; K203-N205 VanDerWaalsContact C-N 3.33Å; K203-G206 PolarHBondContact O-N 2.96Å; K203-G206 VanDerWaalsContact O-N 3.07Å
204	V	56.5	Low	60.6	Low	89 Å²	89	111.1 Å²	111.1	54%	0.539	59%	0.594	S	S	.	*	H	α-helix	trans	-64.7	-38.9	177.5	173.3	0	0	0	0	111.1	C200 S201 G206 F207 E208	C200-V204 PolarHBondContact O-N 3.2Å; S201-V204 PolarHBondContact O-N 2.85Å; S201-V204 VanDerWaalsContact O-N 3.11Å; V204-G206 PolarHBondContact O-N 2.83Å; V204-G206 VanDerWaalsContact O-N 3.09Å; V204-F207 PolarHBondContact O-N 2.96Å; V204-E208 PolarHBondContact O-N 3.19Å
205	N	51.3	Low	58.4	Low	113 Å²	113	113.5 Å²	113.5	60%	0.604	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-19.8	173.1	-66.8	21	0	0	0	113.1	S201 K203	S201-N205 PolarHBondContact O-N 2.9Å; S201-N205 VanDerWaalsContact O-N 3.12Å; S201-N205 PolarHBondContact O-OD1 3.46Å; K203-N205 VanDerWaalsContact C-N 3.33Å
206	G	50.4	Low	56.2	Low	49 Å²	49	114.6 Å²	114.6	51%	0.505	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.5	-0.1	172.6	0	0	0	0	0	115	K203 V204	K203-G206 PolarHBondContact O-N 2.96Å; K203-G206 VanDerWaalsContact O-N 3.07Å; V204-G206 PolarHBondContact O-N 2.83Å; V204-G206 VanDerWaalsContact O-N 3.09Å
207	F	49.8	Very low	54.1	Low	140 Å²	140	120.5 Å²	120.5	61%	0.614	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-25.3	177.4	-100.3	-89.9	0	0	0	113.4	V204 E209 N210	V204-F207 PolarHBondContact O-N 2.96Å; F207-E209 PolarHBondContact O-N 3.38Å; F207-N210 PolarHBondContact O-N 2.92Å
208	E	46.2	Very low	52	Low	131 Å²	131	122.8 Å²	122.8	61%	0.612	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-65.1	-26.8	-174.5	-156.2	159.2	-141.7	0	0	113	V204 N210	V204-E208 PolarHBondContact O-N 3.19Å; E208-N210 PolarHBondContact O-N 2.59Å
209	E	47.3	Very low	50.3	Low	174 Å²	174	120.4 Å²	120.4	81%	0.813	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-65.9	-18.7	172.1	-63.1	-170	143	0	0	114.2	F207	F207-E209 PolarHBondContact O-N 3.38Å
210	N	50.5	Low	48.7	Very low	128 Å²	128	121 Å²	121	68%	0.684	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-96.8	-11	-175.7	-87.3	-58.4	0	0	0	114.9	F207 E208	F207-N210 PolarHBondContact O-N 2.92Å; E208-N210 PolarHBondContact O-N 2.59Å
211	I	50.3	Low	47.1	Very low	126 Å²	126	124.9 Å²	124.9	65%	0.646	69%	0.694	S	S	*	*	S	Bend	trans	-99.1	-15.5	-162.7	-67.9	175	0	0	0	113.9	S213	I211-S213 PolarHBondContact O-N 2.9Å
212	Q	47	Very low	46	Very low	183 Å²	183	129.8 Å²	129.8	86%	0.855	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	6.5	-169.5	-64.2	-171.8	-7	0	0	117
213	S	47	Very low	45	Very low	109 Å²	109	130.1 Å²	130.1	76%	0.762	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-41.4	-164.5	-66.4	0	0	0	0	117.3	I211	I211-S213 PolarHBondContact O-N 2.9Å
214	I	45.7	Very low	43.8	Very low	153 Å²	153	131.2 Å²	131.2	79%	0.785	73%	0.725	S	S	*	*	S	Bend	trans	-143.8	135.1	-165.9	-50.8	-178.2	0	0	0	114.3
215	S	40.4	Very low	42.8	Very low	122 Å²	122	133.4 Å²	133.4	85%	0.853	73%	0.734	S	S	*	*			trans	92.5	133.3	165.6	78.4	0	0	0	0	117.6
216	S	34.7	Very low	42	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	74%	0.736	S	S	*	*			trans	-133.5	132.1	-173.4	55.2	0	0	0	0	109.9
217	Y	37.2	Very low	41.5	Very low	211 Å²	211	136 Å²	136	83%	0.827	75%	0.746	S	S	*	*			trans	-156.5	162	140.2	-144.1	-103.4	0	0	0	112.6
218	E	36	Very low	40.8	Very low	164 Å²	164	136.5 Å²	136.5	77%	0.766	76%	0.755	S	S	*	*			trans	-77.2	146.6	-178.7	-60.6	166.2	114.5	0	0	111.5
219	G	38.4	Very low	40.3	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	77%	0.765	S	S	*	*			trans	-158.2	52.3	-166.8	0	0	0	0	0	116.3
220	S	40.1	Very low	39.7	Very low	100 Å²	100	135.5 Å²	135.5	70%	0.699	76%	0.758	S	S	*	*			trans	26.7	116.1	153.7	61.7	0	0	0	0	121.1
221	N	35.3	Very low	39	Very low	157 Å²	157	139.7 Å²	139.7	84%	0.84	77%	0.766	S	S	*	*				43.7	103.8	126.8	-52.6	-21.9	0	0	0	119.8
222	L	40.2	Very low	38.1	Very low	172 Å²	172	138.4 Å²	138.4	90%	0.901	76%	0.76	S	S	*	*			trans	-149.2	156	141.6	-98.3	147.5	0	0	0	108.2
223	P	39.8	Very low	37.3	Very low	89 Å²	89	138.4 Å²	138.4	58%	0.578	76%	0.757	S	S	*	*			trans	-86.5	143.8	-146	31.3	-37.8	0	0	0	116.1	N225	P223-N225 VanDerWaalsContact C-N 3.26Å; P223-N225 PolarHBondContact O-N 3.37Å
224	I	35.1	Very low	36.7	Very low	163 Å²	163	138.9 Å²	138.9	84%	0.836	76%	0.761	S	S	*	*			trans	-74.5	81.5	158.8	-57.8	167.6	0	0	0	107.9	V226	I224-V226 HydrophobicContact CG2-CG2 4.13Å; I224-V226 PolarHBondContact O-N 2.83Å
225	N	37.1	Very low	36.2	Very low	135 Å²	135	140.7 Å²	140.7	72%	0.722	76%	0.763	S	S	*	*			trans	-88.7	91.4	167.7	-83	-1.8	0	0	0	109.1	P223 P227	P223-N225 VanDerWaalsContact C-N 3.26Å; P223-N225 PolarHBondContact O-N 3.37Å; N225-P227 WeakPolarHBondContact O-CD 3.24Å
226	V	34.2	Very low	35.6	Very low	107 Å²	107	142.5 Å²	142.5	65%	0.648	76%	0.761	S	S	*	*			trans	-62.6	124.3	165.2	178.1	0	0	0	0	108.2	I224 D228	I224-V226 HydrophobicContact CG2-CG2 4.13Å; I224-V226 PolarHBondContact O-N 2.83Å; V226-D228 PolarHBondContact O-N 3.5Å
227	P	40	Very low	35.5	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	75%	0.751	S	S	*	*			trans	-74.4	113.8	164.6	-8.1	25.7	0	0	0	107.9	N225 I229	N225-P227 WeakPolarHBondContact O-CD 3.24Å; P227-I229 PolarHBondContact O-N 3.38Å
228	D	34.9	Very low	35.1	Very low	149 Å²	149	136 Å²	136	80%	0.797	74%	0.742	S	S	*	*			trans	-56.7	120.8	171.1	-82.5	-54.8	0	0	0	110	V226 D230	V226-D228 PolarHBondContact O-N 3.5Å; D228-D230 PolarHBondContact O-N 2.87Å
229	I	35.7	Very low	35	Very low	159 Å²	159	135.6 Å²	135.6	82%	0.815	74%	0.743	S	S	*	*			trans	-81.3	55.7	168	-47.4	-179.7	0	0	0	108	P227	P227-I229 PolarHBondContact O-N 3.38Å
230	D	33.4	Very low	34.4	Very low	126 Å²	126	141 Å²	141	67%	0.674	74%	0.742	S	S	*	*			trans	-73.7	133.2	174.7	-173.2	17.4	0	0	0	110.1	D228 N232	D228-D230 PolarHBondContact O-N 2.87Å; D230-N232 VanDerWaalsContact C-N 3.28Å; D230-N232 PolarHBondContact O-N 3.37Å
231	Y	36.2	Very low	34.3	Very low	215 Å²	215	140.9 Å²	140.9	84%	0.843	74%	0.741	S	S	*	*			trans	-94.2	48.1	-151.8	-143.7	-94.7	0	0	0	111.3
232	N	32.4	Very low	33.8	Very low	99 Å²	99	139.1 Å²	139.1	53%	0.529	73%	0.728	S	S	.	*			trans	-135.8	131.6	-162.5	-97.3	-73.2	0	0	0	116.7	D230	D230-N232 VanDerWaalsContact C-N 3.28Å; D230-N232 PolarHBondContact O-N 3.37Å
233	K	30.5	Very low	33.3	Very low	183 Å²	183	135.8 Å²	135.8	80%	0.796	71%	0.714	S	S	*	*			trans	57.9	76	145.1	-60.3	162.9	-173.3	160.1	0	117.8
234	S	32.5	Very low	32.7	Very low	119 Å²	119	139.1 Å²	139.1	83%	0.832	72%	0.722	S	S	*	*	S	Bend		-146.7	125.5	128.4	-89.1	0	0	0	0	110.8	I236	S234-I236 PolarHBondContact O-N 2.85Å
235	K	36	Very low	32.4	Very low	191 Å²	191	139 Å²	139	83%	0.83	72%	0.718	S	S	*	*			trans	-25.9	96.7	-171.7	-69.4	176.3	174.9	177.7	0	115.1	S237	K235-S237 PolarHBondContact O-N 3.45Å
236	I	28.4	Very low	32.2	Very low	160 Å²	160	136.3 Å²	136.3	82%	0.821	71%	0.71	S	S	*	*			trans	-70.7	74	133.8	-53	-178.6	0	0	0	106	S234 V238	S234-I236 PolarHBondContact O-N 2.85Å; I236-V238 HydrophobicContact CG2-CG2 3.8Å; I236-V238 PolarHBondContact O-N 2.89Å
237	S	32.1	Very low	31.9	Very low	82 Å²	82	143.8 Å²	143.8	57%	0.573	73%	0.727	S	S	*	*			trans	-69	83.2	155.7	48.4	0	0	0	0	105.9	K235 I239	K235-S237 PolarHBondContact O-N 3.45Å; S237-I239 PolarHBondContact O-N 3.13Å; S237-I239 VanDerWaalsContact O-N 3.08Å
238	V	28.5	Very low	31.4	Very low	105 Å²	105	144.1 Å²	144.1	64%	0.636	72%	0.721	S	S	*	*			trans	-45.6	120.3	156.9	-177.4	0	0	0	0	105	I236 R240	I236-V238 HydrophobicContact CG2-CG2 3.8Å; I236-V238 PolarHBondContact O-N 2.89Å; V238-R240 HydrophobicContact CG1-CG 4.03Å; V238-R240 PolarHBondContact O-N 2.81Å
239	I	33.7	Very low	31.1	Very low	154 Å²	154	145.1 Å²	145.1	79%	0.79	72%	0.721	S	S	*	*			trans	-76.9	60.4	174.9	-50.2	-178.5	0	0	0	108	S237 S241	S237-I239 PolarHBondContact O-N 3.13Å; S237-I239 VanDerWaalsContact O-N 3.08Å; I239-S241 PolarHBondContact O-N 2.87Å
240	R	26.8	Very low	30.7	Very low	185 Å²	185	144.1 Å²	144.1	70%	0.698	72%	0.717	S	S	*	*			trans	-76	81.1	142.1	-72.2	-170	-176.8	180	2.6	106.3	V238 H242	V238-R240 HydrophobicContact CG1-CG 4.03Å; V238-R240 PolarHBondContact O-N 2.81Å; R240-H242 WeakPolarHBondContact O-CB 3.17Å
241	S	37.3	Very low	30.4	Very low	98 Å²	98	145.4 Å²	145.4	69%	0.685	72%	0.719	S	S	*	*				-72.1	99.7	124.9	50.6	0	0	0	0	105.8	I239	I239-S241 PolarHBondContact O-N 2.87Å
242	H	25.1	Very low	30.1	Very low	120 Å²	120	140.6 Å²	140.6	56%	0.556	71%	0.714	S	S	*	*			cis	33.4	124.3	44	-79.6	-55.5	0	0	0	113.1	R240	R240-H242 WeakPolarHBondContact O-CB 3.17Å
243	T	29.6	Very low	30	Very low	101 Å²	101	143.8 Å²	143.8	62%	0.62	73%	0.73	S	S	*	*			trans	40.3	109.6	146.2	65.8	0	0	0	0	115.9
244	E	27.5	Very low	29.8	Very low	159 Å²	159	140.7 Å²	140.7	74%	0.743	73%	0.727	S	S	*	*				-177.7	160.7	63.8	-99.9	109.1	-161.9	0	0	106
245	E	29.5	Very low	29.7	Very low	162 Å²	162	138.7 Å²	138.7	76%	0.757	72%	0.717	S	S	*	*			cis	-139.5	165	-0.2	-91.4	125.5	159	0	0	109.2
246	S	31.4	Very low	29.4	Very low	77 Å²	77	138.2 Å²	138.2	54%	0.538	72%	0.715	S	S	.	*			trans	38.2	107.4	160.9	60.3	0	0	0	0	117.1	I248	S246-I248 PolarHBondContact O-N 2.88Å; S246-I248 WeakPolarHBondContact OG-CG1 3.27Å
247	W	28	Very low	29.6	Very low	265 Å²	265	136.8 Å²	136.8	100%	1.004	71%	0.708	S	S	*	*				22	46.5	62.9	-68.3	85.1	0	0	0	114.3	Q249	W247-Q249 VanDerWaalsContact C-N 3.3Å; W247-Q249 PolarHBondContact O-N 2.83Å
248	I	30.2	Very low	29.7	Very low	117 Å²	117	139.9 Å²	139.9	60%	0.6	72%	0.718	S	S	*	*			trans	-68.1	98.4	162.3	-56.5	-175.6	0	0	0	106.2	S246 N250	S246-I248 PolarHBondContact O-N 2.88Å; S246-I248 WeakPolarHBondContact OG-CG1 3.27Å; I248-N250 HydrophobicContact CG2-CB 4.35Å; I248-N250 WeakPolarHBondContact CG2-OD1 3.3Å; I248-N250 PolarHBondContact O-N 3.17Å
249	Q	27.5	Very low	30	Very low	170 Å²	170	143.2 Å²	143.2	79%	0.794	73%	0.727	S	S	*	*			trans	-73.6	56.6	177.5	-166.4	-176.1	1.1	0	0	110.4	W247 Q251	W247-Q249 VanDerWaalsContact C-N 3.3Å; W247-Q249 PolarHBondContact O-N 2.83Å; Q249-Q251 VanDerWaalsContact C-N 3.31Å; Q249-Q251 PolarHBondContact O-N 2.83Å
250	N	29.3	Very low	30.1	Very low	138 Å²	138	140.4 Å²	140.4	74%	0.738	71%	0.709	S	S	*	*			trans	-66.5	95	170.1	-82.2	-10.3	0	0	0	107.7	I248	I248-N250 HydrophobicContact CG2-CB 4.35Å; I248-N250 WeakPolarHBondContact CG2-OD1 3.3Å; I248-N250 PolarHBondContact O-N 3.17Å
251	Q	26.3	Very low	30.6	Very low	154 Å²	154	134.4 Å²	134.4	72%	0.72	70%	0.695	S	S	*	*			trans	-50.3	137.1	167.2	-65.6	179.3	-17.8	0	0	108.3	Q249 L253	Q249-Q251 VanDerWaalsContact C-N 3.31Å; Q249-Q251 PolarHBondContact O-N 2.83Å; Q251-L253 PolarHBondContact O-N 2.82Å
252	P	28.8	Very low	30.5	Very low	113 Å²	113	134.6 Å²	134.6	73%	0.734	69%	0.688	S	S	*	*			trans	-59.8	113.3	166.4	26.6	-32	0	0	0	106.4	T254	P252-T254 PolarHBondContact O-N 2.78Å; P252-T254 PolarHBondContact O-OG1 3.35Å
253	L	30.4	Very low	30.8	Very low	167 Å²	167	131 Å²	131	87%	0.874	68%	0.68	S	S	*	*			trans	-65.6	99.9	-177.2	-168.1	79	0	0	0	107.4	Q251 A255	Q251-L253 PolarHBondContact O-N 2.82Å; L253-A255 PolarHBondContact O-N 2.88Å
254	T	27.6	Very low	31.4	Very low	117 Å²	117	130 Å²	130	72%	0.718	67%	0.67	S	S	*	*			trans	-77.8	70.3	-163.6	-33.1	0	0	0	0	111.5	P252 K256	P252-T254 PolarHBondContact O-N 2.78Å; P252-T254 PolarHBondContact O-OG1 3.35Å; T254-K256 PolarHBondContact O-N 3.45Å
255	A	29.6	Very low	31.9	Very low	77 Å²	77	126.2 Å²	126.2	64%	0.636	65%	0.653	S	S	*	*			trans	-58.1	98	169.2	0	0	0	0	0	108.6	L253 I257	L253-A255 PolarHBondContact O-N 2.88Å; A255-I257 HydrophobicContact CB-CG1 4.35Å; A255-I257 PolarHBondContact O-N 2.9Å
256	K	30.8	Very low	32.2	Very low	181 Å²	181	123.4 Å²	123.4	79%	0.787	64%	0.642	S	S	*	*			trans	-70.6	77.5	171.4	-74.8	-173.5	174.6	-176.3	0	108.8	T254 N258	T254-K256 PolarHBondContact O-N 3.45Å; K256-N258 PolarHBondContact O-N 3.25Å
257	I	32.5	Very low	32.4	Very low	131 Å²	131	127 Å²	127	67%	0.672	65%	0.648	S	S	*	*			trans	-70.6	85.9	168.3	-50.6	-179.4	0	0	0	106.7	A255 Q259	A255-I257 HydrophobicContact CB-CG1 4.35Å; A255-I257 PolarHBondContact O-N 2.9Å; I257-Q259 HydrophobicContact CG2-CG 3.77Å; I257-Q259 PolarHBondContact O-N 3.36Å
258	N	33.9	Very low	32.9	Very low	147 Å²	147	119.4 Å²	119.4	79%	0.786	62%	0.624	S	S	*	*			trans	-66.2	83.8	169.3	-79.6	-3.4	0	0	0	108.2	K256 K260	K256-N258 PolarHBondContact O-N 3.25Å; N258-K260 PolarHBondContact O-N 2.88Å
259	Q	35.1	Very low	33	Very low	174 Å²	174	118.6 Å²	118.6	81%	0.813	62%	0.619	S	S	*	*			trans	-71.3	82.2	169	-65.5	-171	-17.9	0	0	109.1	I257	I257-Q259 HydrophobicContact CG2-CG 3.77Å; I257-Q259 PolarHBondContact O-N 3.36Å
260	K	34.8	Very low	33.4	Very low	96 Å²	96	118.6 Å²	118.6	42%	0.417	62%	0.619	S	S	.	*			trans	-59.9	134.2	148.8	-113.8	-165.8	170.1	-170.9	0	106.6	N258 E265 E268	N258-K260 PolarHBondContact O-N 2.88Å; K260-E265 HydrophobicContact CD-CG 3.98Å; K260-E268 IonicContact NZ-OE1 3.77Å; K260-E268 PolarHBondContact NZ-OE1 3.45Å; K260-E268 IonicContact NZ-OE2 2.64Å; K260-E268 PolarHBondContact NZ-OE2 2.88Å
261	S	38.1	Very low	33.6	Very low	59 Å²	59	115.1 Å²	115.1	41%	0.413	61%	0.61	S	S	.	*			trans	-68.3	145	175.7	-172.6	0	0	0	0	109.2	A263 D264 E265	S261-A263 PolarHBondContact O-N 2.92Å; S261-A263 VanDerWaalsContact O-N 3.15Å; S261-A263 PolarHBondContact OG-N 3.23Å; S261-D264 WeakPolarHBondContact CA-OD2 3.49Å; S261-D264 VanDerWaalsContact CB-CG 3.47Å; S261-D264 WeakPolarHBondContact CB-OD2 3.32Å; S261-D264 PolarHBondContact N-OD2 2.92Å; S261-D264 WeakPolarHBondContact O-CB 3.47Å; S261-D264 PolarHBondContact O-N 3.25Å; S261-E265 PolarHBondContact O-N 3.09Å
262	L	35.1	Very low	33.9	Very low	102 Å²	102	114 Å²	114	53%	0.534	61%	0.609	S	S	.	*	H	α-helix	trans	-59	-25.7	170.5	-159.4	79.6	0	0	0	111.1	L266	L262-L266 WeakPolarHBondContact O-CD1 3.3Å; L262-L266 VanDerWaalsContact O-CG 3.23Å; L262-L266 WeakPolarHBondContact O-CG 3.46Å; L262-L266 PolarHBondContact O-N 2.82Å
263	A	31.7	Very low	34.3	Very low	45 Å²	45	116.8 Å²	116.8	37%	0.372	61%	0.611	S	S	.	*	H	α-helix	trans	-68.4	-38.9	172	0	0	0	0	0	112.6	S261 L266 F267	S261-A263 PolarHBondContact O-N 2.92Å; S261-A263 VanDerWaalsContact O-N 3.15Å; S261-A263 PolarHBondContact OG-N 3.23Å; A263-L266 PolarHBondContact O-N 3.46Å; A263-F267 WeakPolarHBondContact O-CD2 3.43Å; A263-F267 PolarHBondContact O-N 3.13Å
264	D	40.2	Very low	34.7	Very low	78 Å²	78	114.1 Å²	114.1	42%	0.417	60%	0.598	S	S	.	*	H	α-helix	trans	-66.4	-43.1	-177.3	-51.4	-29.4	0	0	0	110.6	S261 L266 F267 E268	S261-D264 WeakPolarHBondContact CA-OD2 3.49Å; S261-D264 VanDerWaalsContact CB-CG 3.47Å; S261-D264 WeakPolarHBondContact CB-OD2 3.32Å; S261-D264 PolarHBondContact N-OD2 2.92Å; S261-D264 WeakPolarHBondContact O-CB 3.47Å; S261-D264 PolarHBondContact O-N 3.25Å; D264-L266 VanDerWaalsContact C-N 3.31Å; D264-L266 PolarHBondContact O-N 2.73Å; D264-F267 PolarHBondContact O-N 2.84Å; D264-E268 WeakPolarHBondContact O-CB 3.33Å; D264-E268 WeakPolarHBondContact O-CG 3.39Å; D264-E268 PolarHBondContact O-N 3.37Å
265	E	39.4	Very low	35.1	Very low	81 Å²	81	113.7 Å²	113.7	38%	0.379	60%	0.595	S	S	.	*	H	α-helix	trans	-68.9	-27.4	176.5	-64.9	-168.4	150.6	0	0	113.1	K260 S261 M269	K260-E265 HydrophobicContact CD-CG 3.98Å; S261-E265 PolarHBondContact O-N 3.09Å; E265-M269 WeakPolarHBondContact O-CE 3.43Å; E265-M269 PolarHBondContact O-N 2.88Å
266	L	35.6	Very low	35.2	Very low	102 Å²	102	116.9 Å²	116.9	53%	0.534	60%	0.597	S	S	.	*	H	α-helix	trans	-76.5	-43.1	174.8	-74	169.1	0	0	0	111.8	L262 A263 D264 M269 E270	L262-L266 WeakPolarHBondContact O-CD1 3.3Å; L262-L266 VanDerWaalsContact O-CG 3.23Å; L262-L266 WeakPolarHBondContact O-CG 3.46Å; L262-L266 PolarHBondContact O-N 2.82Å; A263-L266 PolarHBondContact O-N 3.46Å; D264-L266 VanDerWaalsContact C-N 3.31Å; D264-L266 PolarHBondContact O-N 2.73Å; L266-M269 HydrophobicContact CD2-CE 4.27Å; L266-M269 PolarHBondContact O-N 3.5Å; L266-E270 PolarHBondContact O-N 3.48Å
267	F	35.6	Very low	35.2	Very low	154 Å²	154	110.5 Å²	110.5	68%	0.675	58%	0.575	S	S	*	*	H	α-helix	trans	-69.3	-35.2	176.4	-86.8	-70.2	0	0	0	113.2	A263 D264 M269 E270	A263-F267 WeakPolarHBondContact O-CD2 3.43Å; A263-F267 PolarHBondContact O-N 3.13Å; D264-F267 PolarHBondContact O-N 2.84Å; F267-M269 PolarHBondContact O-N 2.95Å; F267-E270 PolarHBondContact O-N 3.27Å
268	E	38	Very low	35.2	Very low	104 Å²	104	109.1 Å²	109.1	49%	0.486	57%	0.568	S	S	.	*	H	α-helix	trans	-66	-23	171.5	-76.6	178.6	170.4	0	0	112.6	K260 D264	K260-E268 IonicContact NZ-OE1 3.77Å; K260-E268 PolarHBondContact NZ-OE1 3.45Å; K260-E268 IonicContact NZ-OE2 2.64Å; K260-E268 PolarHBondContact NZ-OE2 2.88Å; D264-E268 WeakPolarHBondContact O-CB 3.33Å; D264-E268 WeakPolarHBondContact O-CG 3.39Å; D264-E268 PolarHBondContact O-N 3.37Å
269	M	33.4	Very low	35	Very low	101 Å²	101	107.6 Å²	107.6	50%	0.498	56%	0.559	S	S	.	*	H	α-helix	trans	-84.2	-19.1	177.5	-94	-170.1	-76	0	0	115.3	E265 L266 F267 A271	E265-M269 WeakPolarHBondContact O-CE 3.43Å; E265-M269 PolarHBondContact O-N 2.88Å; L266-M269 HydrophobicContact CD2-CE 4.27Å; L266-M269 PolarHBondContact O-N 3.5Å; F267-M269 PolarHBondContact O-N 2.95Å; M269-A271 VanDerWaalsContact C-N 3.28Å
270	E	35.9	Very low	34.7	Very low	169 Å²	169	105 Å²	105	79%	0.79	55%	0.55	S	S	*	.	S	Bend	trans	-84.5	-4.8	172.4	-68.1	-161.5	130.9	0	0	112.9	L266 F267	L266-E270 PolarHBondContact O-N 3.48Å; F267-E270 PolarHBondContact O-N 3.27Å
271	A	32.9	Very low	34.6	Very low	66 Å²	66	103.5 Å²	103.5	55%	0.545	55%	0.549	S	S	.	.			trans	-83.1	-8.5	-178.6	0	0	0	0	0	114.9	M269 Q273	M269-A271 VanDerWaalsContact C-N 3.28Å; A271-Q273 WeakPolarHBondContact O-CG 3.39Å; A271-Q273 PolarHBondContact O-N 3.03Å
272	D	32	Very low	34.4	Very low	131 Å²	131	106.3 Å²	106.3	70%	0.701	55%	0.551	S	S	*	*			trans	-70.5	92.7	176.7	-89.8	-22	0	0	0	111.1	D274	D272-D274 PolarHBondContact O-N 2.79Å
273	Q	37.4	Very low	34.2	Very low	170 Å²	170	103.1 Å²	103.1	79%	0.794	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.1	-169.5	-57.5	-169.9	-95.2	0	0	114.9	A271 V275 H276 S277	A271-Q273 WeakPolarHBondContact O-CG 3.39Å; A271-Q273 PolarHBondContact O-N 3.03Å; Q273-V275 PolarHBondContact O-N 2.91Å; Q273-H276 PolarHBondContact O-N 3.09Å; Q273-S277 PolarHBondContact O-N 3.19Å
274	D	39.3	Very low	34.2	Very low	112 Å²	112	104.8 Å²	104.8	60%	0.599	55%	0.549	S	S	*	.	H	α-helix	trans	-73.3	-22.7	-172.3	-79.7	-41.6	0	0	0	115.2	D272 H276 S277 I278	D272-D274 PolarHBondContact O-N 2.79Å; D274-H276 PolarHBondContact O-N 3.2Å; D274-S277 WeakPolarHBondContact CA-OG 3.47Å; D274-S277 PolarHBondContact O-N 3.5Å; D274-S277 PolarHBondContact O-OG 2.86Å; D274-S277 PolarHBondContact OD1-OG 3.24Å; D274-S277 VanDerWaalsContact OD1-OG 3.09Å; D274-I278 WeakPolarHBondContact O-CG1 3.24Å; D274-I278 PolarHBondContact O-N 3.11Å; D274-I278 VanDerWaalsContact O-N 3.12Å
275	V	35.3	Very low	33.9	Very low	108 Å²	108	106.6 Å²	106.6	66%	0.655	56%	0.555	S	S	*	*	H	α-helix	trans	-64.8	-28.2	172.8	-174.6	0	0	0	0	111	Q273	Q273-V275 PolarHBondContact O-N 2.91Å
276	H	31.6	Very low	33.6	Very low	144 Å²	144	108.2 Å²	108.2	67%	0.667	56%	0.562	S	S	*	*	H	α-helix	trans	-82.3	-32.1	173.3	-101.6	-61	0	0	0	113.2	Q273 D274 L280	Q273-H276 PolarHBondContact O-N 3.09Å; D274-H276 PolarHBondContact O-N 3.2Å; H276-L280 PolarHBondContact O-N 2.9Å
277	S	31.7	Very low	33.4	Very low	46 Å²	46	108.3 Å²	108.3	32%	0.322	56%	0.562	S	S	.	*	H	α-helix	trans	-66.2	-49	178.8	74.5	0	0	0	0	111	Q273 D274 L279 L280 T281	Q273-S277 PolarHBondContact O-N 3.19Å; D274-S277 WeakPolarHBondContact CA-OG 3.47Å; D274-S277 PolarHBondContact O-N 3.5Å; D274-S277 PolarHBondContact O-OG 2.86Å; D274-S277 PolarHBondContact OD1-OG 3.24Å; D274-S277 VanDerWaalsContact OD1-OG 3.09Å; S277-L279 VanDerWaalsContact C-N 3.35Å; S277-L279 PolarHBondContact O-N 3.39Å; S277-L280 PolarHBondContact O-N 3.41Å; S277-T281 PolarHBondContact O-N 2.84Å; S277-T281 PolarHBondContact O-OG1 3.46Å
278	I	32.2	Very low	33.2	Very low	103 Å²	103	105.2 Å²	105.2	53%	0.528	55%	0.553	S	S	.	*	H	α-helix	trans	-57.1	-45.6	-178.9	-64.8	166.1	0	0	0	111.6	D274 Y282	D274-I278 WeakPolarHBondContact O-CG1 3.24Å; D274-I278 PolarHBondContact O-N 3.11Å; D274-I278 VanDerWaalsContact O-N 3.12Å; I278-Y282 HydrophobicContact CG2-CD2 4.19Å; I278-Y282 HydrophobicContact CG2-CE2 4.49Å; I278-Y282 WeakPolarHBondContact O-CB 3.36Å; I278-Y282 PolarHBondContact O-N 2.67Å
279	L	29.6	Very low	32.9	Very low	114 Å²	114	104 Å²	104	60%	0.597	56%	0.555	S	S	*	*	H	α-helix	trans	-69.6	-31.4	-179.3	-90.9	164.1	0	0	0	113.9	S277 G283	S277-L279 VanDerWaalsContact C-N 3.35Å; S277-L279 PolarHBondContact O-N 3.39Å; L279-G283 PolarHBondContact O-N 3.08Å
280	L	29.6	Very low	32.8	Very low	119 Å²	119	102.3 Å²	102.3	62%	0.623	55%	0.553	S	S	*	*	H	α-helix	trans	-76.6	-42.7	175.6	-79.4	165.6	0	0	0	111.6	H276 S277 G283 T284	H276-L280 PolarHBondContact O-N 2.9Å; S277-L280 PolarHBondContact O-N 3.41Å; L280-G283 PolarHBondContact O-N 2.85Å; L280-T284 PolarHBondContact O-N 3.1Å; L280-T284 PolarHBondContact O-OG1 3.06Å
281	T	33	Very low	32.5	Very low	65 Å²	65	96 Å²	96	40%	0.399	53%	0.529	S	S	.	.	H	α-helix	trans	-63.8	-47.4	178	-55.3	0	0	0	0	111.5	S277 G283 T284 E285	S277-T281 PolarHBondContact O-N 2.84Å; S277-T281 PolarHBondContact O-OG1 3.46Å; T281-G283 PolarHBondContact O-N 2.92Å; T281-T284 PolarHBondContact O-N 3.18Å; T281-T284 PolarHBondContact O-OG1 2.88Å; T281-T284 VanDerWaalsContact O-OG1 3.05Å; T281-E285 HydrophobicContact CG2-CG 4.25Å; T281-E285 WeakPolarHBondContact O-CB 3.37Å; T281-E285 WeakPolarHBondContact O-CG 3.38Å; T281-E285 PolarHBondContact O-N 3.49Å
282	Y	33.4	Very low	32.5	Very low	118 Å²	118	100.9 Å²	100.9	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-59.4	-35.3	173.6	-98.1	-101	0	0	0	112.5	H115 I278 H286	H115-Y282 AromaticContact NE2-CE1 3.6Å; I278-Y282 HydrophobicContact CG2-CD2 4.19Å; I278-Y282 HydrophobicContact CG2-CE2 4.49Å; I278-Y282 WeakPolarHBondContact O-CB 3.36Å; I278-Y282 PolarHBondContact O-N 2.67Å; Y282-H286 WeakPolarHBondContact O-CB 3.34Å; Y282-H286 PolarHBondContact O-N 2.87Å
283	G	31	Very low	32.5	Very low	35 Å²	35	102.2 Å²	102.2	36%	0.361	54%	0.537	S	S	.	.	H	α-helix	trans	-63.2	-47	175.4	0	0	0	0	0	112.8	L279 L280 T281 I287	L279-G283 PolarHBondContact O-N 3.08Å; L280-G283 PolarHBondContact O-N 2.85Å; T281-G283 PolarHBondContact O-N 2.92Å; G283-I287 WeakPolarHBondContact O-CD1 3.5Å; G283-I287 VanDerWaalsContact O-CG1 3.25Å; G283-I287 WeakPolarHBondContact O-CG1 3.44Å; G283-I287 PolarHBondContact O-N 2.67Å
284	T	31.2	Very low	32	Very low	80 Å²	80	100.9 Å²	100.9	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-74.8	-33.8	179.7	50.7	0	0	0	0	113	L280 T281 N288	L280-T284 PolarHBondContact O-N 3.1Å; L280-T284 PolarHBondContact O-OG1 3.06Å; T281-T284 PolarHBondContact O-N 3.18Å; T281-T284 PolarHBondContact O-OG1 2.88Å; T281-T284 VanDerWaalsContact O-OG1 3.05Å; T284-N288 PolarHBondContact O-N 2.95Å; T284-N288 PolarHBondContact O-ND2 3.29Å; T284-N288 VanDerWaalsContact O-ND2 3.17Å
285	E	33.2	Very low	31.5	Very low	117 Å²	117	102.7 Å²	102.7	55%	0.547	53%	0.534	S	S	.	.	H	α-helix	trans	-71.2	-39.2	176.4	-71.5	-175.8	163.2	0	0	112.1	T281 N288 S289	T281-E285 HydrophobicContact CG2-CG 4.25Å; T281-E285 WeakPolarHBondContact O-CB 3.37Å; T281-E285 WeakPolarHBondContact O-CG 3.38Å; T281-E285 PolarHBondContact O-N 3.49Å; E285-N288 CarbonylContact O-C 3.6Å; E285-N288 PolarHBondContact O-N 3.41Å; E285-S289 PolarHBondContact O-N 2.87Å
286	H	33.8	Very low	31.1	Very low	114 Å²	114	103.4 Å²	103.4	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-68.7	-32.5	173	-100.9	-69.3	0	0	0	113.8	Y282 N288 S289 C290	Y282-H286 WeakPolarHBondContact O-CB 3.34Å; Y282-H286 PolarHBondContact O-N 2.87Å; H286-N288 PolarHBondContact O-N 2.91Å; H286-S289 WeakPolarHBondContact CA-OG 3.43Å; H286-S289 PolarHBondContact ND1-OG 3.22Å; H286-S289 PolarHBondContact O-OG 3.32Å; H286-C290 VanDerWaalsContact O-CB 3.31Å; H286-C290 WeakPolarHBondContact O-CB 3.41Å; H286-C290 PolarHBondContact O-N 2.94Å; H286-C290 PolarHBondContact O-SG 2.91Å
287	I	32.1	Very low	30.8	Very low	104 Å²	104	102.9 Å²	102.9	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-63.7	-31.5	172.1	-72.8	167.3	0	0	0	110.9	G283	G283-I287 WeakPolarHBondContact O-CD1 3.5Å; G283-I287 VanDerWaalsContact O-CG1 3.25Å; G283-I287 WeakPolarHBondContact O-CG1 3.44Å; G283-I287 PolarHBondContact O-N 2.67Å
288	N	31.3	Very low	30.5	Very low	90 Å²	90	106.7 Å²	106.7	48%	0.481	55%	0.551	S	S	.	*	H	α-helix	trans	-90.8	-25.9	177.9	-72.6	-44	0	0	0	114.4	T284 E285 H286 C290 A291 R294	T284-N288 PolarHBondContact O-N 2.95Å; T284-N288 PolarHBondContact O-ND2 3.29Å; T284-N288 VanDerWaalsContact O-ND2 3.17Å; E285-N288 CarbonylContact O-C 3.6Å; E285-N288 PolarHBondContact O-N 3.41Å; H286-N288 PolarHBondContact O-N 2.91Å; N288-C290 VanDerWaalsContact C-N 3.33Å; N288-A291 WeakPolarHBondContact O-CB 3.21Å; N288-A291 PolarHBondContact O-N 3.1Å; N288-R294 PolarHBondContact OD1-NH1 2.85Å
289	S	32	Very low	30.3	Very low	77 Å²	77	108.2 Å²	108.2	54%	0.538	55%	0.554	S	S	.	*	H	α-helix	trans	-72.2	-30.6	168.8	69.4	0	0	0	0	111.6	E285 H286 A291	E285-S289 PolarHBondContact O-N 2.87Å; H286-S289 WeakPolarHBondContact CA-OG 3.43Å; H286-S289 PolarHBondContact ND1-OG 3.22Å; H286-S289 PolarHBondContact O-OG 3.32Å; S289-A291 PolarHBondContact O-N 3.23Å; S289-A291 VanDerWaalsContact O-N 3.11Å
290	C	31.5	Very low	30.1	Very low	67 Å²	67	109.4 Å²	109.4	45%	0.453	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-66.6	1.4	164.3	-76.8	0	0	0	0	114.3	H286 N288 H292 Y293	H286-C290 VanDerWaalsContact O-CB 3.31Å; H286-C290 WeakPolarHBondContact O-CB 3.41Å; H286-C290 PolarHBondContact O-N 2.94Å; H286-C290 PolarHBondContact O-SG 2.91Å; N288-C290 VanDerWaalsContact C-N 3.33Å; C290-H292 PolarHBondContact O-N 3.01Å; C290-Y293 WeakPolarHBondContact O-CB 3.47Å; C290-Y293 PolarHBondContact O-N 3.24Å
291	A	29	Very low	30	Very low	35 Å²	35	109.9 Å²	109.9	29%	0.289	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-60.8	-15.3	174	0	0	0	0	0	113.4	N288 S289 Y293 R294	N288-A291 WeakPolarHBondContact O-CB 3.21Å; N288-A291 PolarHBondContact O-N 3.1Å; S289-A291 PolarHBondContact O-N 3.23Å; S289-A291 VanDerWaalsContact O-N 3.11Å; A291-Y293 PolarHBondContact O-N 2.9Å; A291-R294 WeakPolarHBondContact O-CB 3.29Å; A291-R294 PolarHBondContact O-N 3.34Å
292	H	32.5	Very low	29.9	Very low	169 Å²	169	113.9 Å²	113.9	78%	0.782	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-62.6	-19.4	170.4	-135.3	-46.5	0	0	0	113.4	C290	C290-H292 PolarHBondContact O-N 3.01Å
293	Y	31.3	Very low	30.2	Very low	159 Å²	159	111.6 Å²	111.6	62%	0.624	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-88.2	-11	169.6	-70.2	-81.2	0	0	0	114.2	C290 A291 N295 L296	C290-Y293 WeakPolarHBondContact O-CB 3.47Å; C290-Y293 PolarHBondContact O-N 3.24Å; A291-Y293 PolarHBondContact O-N 2.9Å; Y293-N295 PolarHBondContact O-N 2.86Å; Y293-N295 VanDerWaalsContact O-N 3.13Å; Y293-L296 HydrophobicContact CD1-CD1 3.91Å; Y293-L296 HydrophobicContact CE1-CD1 4.32Å; Y293-L296 PolarHBondContact O-N 3.29Å; Y293-L296 VanDerWaalsContact O-N 3.09Å
294	R	27.6	Very low	30.3	Very low	142 Å²	142	112.2 Å²	112.2	54%	0.536	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-61.8	-20.7	175.3	-81.8	-180	164.2	130.8	-4	112.7	N288 A291	N288-R294 PolarHBondContact OD1-NH1 2.85Å; A291-R294 WeakPolarHBondContact O-CB 3.29Å; A291-R294 PolarHBondContact O-N 3.34Å
295	N	28.4	Very low	30.7	Very low	151 Å²	151	115.3 Å²	115.3	81%	0.807	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-94.6	8.7	177.9	-68	-4.5	0	0	0	114.5	Y293	Y293-N295 PolarHBondContact O-N 2.86Å; Y293-N295 VanDerWaalsContact O-N 3.13Å
296	L	27.8	Very low	31.1	Very low	123 Å²	123	115.8 Å²	115.8	64%	0.644	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-101.5	6.6	169.6	-83.4	162.5	0	0	0	113	Y293 T298	Y293-L296 HydrophobicContact CD1-CD1 3.91Å; Y293-L296 HydrophobicContact CE1-CD1 4.32Å; Y293-L296 PolarHBondContact O-N 3.29Å; Y293-L296 VanDerWaalsContact O-N 3.09Å; L296-T298 PolarHBondContact O-N 2.9Å
297	F	25.4	Very low	31.4	Very low	133 Å²	133	116.4 Å²	116.4	58%	0.583	58%	0.58	S	S	*	*			trans	-79.7	59.4	176.3	-77.4	-82.7	0	0	0	113.4	F299	F297-F299 HydrophobicContact CD1-CD2 4.39Å; F297-F299 HydrophobicContact CD1-CE1 4.05Å; F297-F299 AromaticContact CD1-CE2 3.7Å; F297-F299 HydrophobicContact CD1-CE2 3.7Å; F297-F299 AromaticContact CD1-CZ 3.51Å; F297-F299 HydrophobicContact CD1-CZ 3.51Å; F297-F299 HydrophobicContact CE1-CE1 4.15Å; F297-F299 HydrophobicContact CE1-CE2 4.26Å; F297-F299 AromaticContact CE1-CZ 3.65Å; F297-F299 HydrophobicContact CE1-CZ 3.65Å
298	T	25.3	Very low	31.8	Very low	126 Å²	126	116.1 Å²	116.1	77%	0.773	58%	0.579	S	S	*	*			trans	-101.4	93.2	152.5	49.6	0	0	0	0	107.7	L296 E300	L296-T298 PolarHBondContact O-N 2.9Å; T298-E300 PolarHBondContact O-N 3.47Å
299	F	26.9	Very low	32.4	Very low	134 Å²	134	118.7 Å²	118.7	59%	0.588	58%	0.581	S	S	*	*			trans	-66.4	97.5	-176.7	-78.2	-67.7	0	0	0	112.2	F297 V304	F297-F299 HydrophobicContact CD1-CD2 4.39Å; F297-F299 HydrophobicContact CD1-CE1 4.05Å; F297-F299 AromaticContact CD1-CE2 3.7Å; F297-F299 HydrophobicContact CD1-CE2 3.7Å; F297-F299 AromaticContact CD1-CZ 3.51Å; F297-F299 HydrophobicContact CD1-CZ 3.51Å; F297-F299 HydrophobicContact CE1-CE1 4.15Å; F297-F299 HydrophobicContact CE1-CE2 4.26Å; F297-F299 AromaticContact CE1-CZ 3.65Å; F297-F299 HydrophobicContact CE1-CZ 3.65Å; F299-V304 HydrophobicContact CB-CG2 4.48Å; F299-V304 HydrophobicContact CD1-CG2 3.38Å; F299-V304 HydrophobicContact CE1-CG2 3.77Å; F299-V304 HydrophobicContact CG-CG2 4.19Å
300	E	25.3	Very low	33	Very low	140 Å²	140	117.6 Å²	117.6	65%	0.654	57%	0.57	S	S	*	*			trans	-73.8	119.8	152.7	-71.7	-158.7	167.3	0	0	108.8	T298 K302 T303	T298-E300 PolarHBondContact O-N 3.47Å; E300-K302 PolarHBondContact O-N 3.47Å; E300-T303 PolarHBondContact O-N 2.86Å; E300-T303 PolarHBondContact O-OG1 3.49Å
301	N	28	Very low	33.5	Very low	129 Å²	129	116.2 Å²	116.2	69%	0.69	56%	0.558	S	S	*	*	H	α-helix	trans	-48.6	-31.7	-171.2	-77.4	-25.5	0	0	0	115.1	T303 V304 E305	N301-T303 VanDerWaalsContact C-N 3.26Å; N301-T303 PolarHBondContact O-N 3.37Å; N301-V304 WeakPolarHBondContact O-CB 3.44Å; N301-V304 PolarHBondContact O-N 2.82Å; N301-V304 VanDerWaalsContact O-N 3.1Å; N301-E305 PolarHBondContact O-N 2.71Å; N301-E305 VanDerWaalsContact O-N 3.14Å
302	K	30.8	Very low	34.1	Very low	148 Å²	148	117.9 Å²	117.9	64%	0.643	57%	0.567	S	S	*	*	H	α-helix	trans	-54.2	-41.1	176.5	-66.9	177.7	179.2	172.5	0	112.6	E300 V304 E305 E306	E300-K302 PolarHBondContact O-N 3.47Å; K302-V304 VanDerWaalsContact C-N 3.3Å; K302-V304 PolarHBondContact O-N 3.49Å; K302-E305 PolarHBondContact O-N 3.42Å; K302-E306 WeakPolarHBondContact O-CB 3.48Å; K302-E306 VanDerWaalsContact O-CG 3.32Å; K302-E306 WeakPolarHBondContact O-CG 3.29Å; K302-E306 PolarHBondContact O-N 3.36Å
303	T	40	Very low	34.7	Very low	71 Å²	71	111.1 Å²	111.1	44%	0.436	54%	0.536	S	S	.	.	H	α-helix	trans	-68.4	-29.2	-179.1	62	0	0	0	0	112.6	E300 N301 F307	E300-T303 PolarHBondContact O-N 2.86Å; E300-T303 PolarHBondContact O-OG1 3.49Å; N301-T303 VanDerWaalsContact C-N 3.26Å; N301-T303 PolarHBondContact O-N 3.37Å; T303-F307 WeakPolarHBondContact O-CB 3.48Å; T303-F307 PolarHBondContact O-N 3.2Å
304	V	34	Very low	35.3	Very low	47 Å²	47	111.4 Å²	111.4	29%	0.285	54%	0.536	S	S	.	.	H	α-helix	trans	-73	-43.8	174.8	-173.8	0	0	0	0	110.3	F299 N301 K302 E306 F307 L308	F299-V304 HydrophobicContact CB-CG2 4.48Å; F299-V304 HydrophobicContact CD1-CG2 3.38Å; F299-V304 HydrophobicContact CE1-CG2 3.77Å; F299-V304 HydrophobicContact CG-CG2 4.19Å; N301-V304 WeakPolarHBondContact O-CB 3.44Å; N301-V304 PolarHBondContact O-N 2.82Å; N301-V304 VanDerWaalsContact O-N 3.1Å; K302-V304 VanDerWaalsContact C-N 3.3Å; K302-V304 PolarHBondContact O-N 3.49Å; V304-E306 VanDerWaalsContact C-N 3.34Å; V304-E306 PolarHBondContact O-N 3.3Å; V304-F307 PolarHBondContact O-N 2.85Å; V304-L308 HydrophobicContact CG1-CD1 3.95Å; V304-L308 HydrophobicContact CG1-CG 4.35Å; V304-L308 WeakPolarHBondContact O-CB 3.46Å; V304-L308 VanDerWaalsContact O-CG 3.27Å; V304-L308 WeakPolarHBondContact O-CG 3.2Å; V304-L308 PolarHBondContact O-N 3.36Å
305	E	38.4	Very low	36	Very low	145 Å²	145	107.1 Å²	107.1	68%	0.678	52%	0.524	S	S	*	.	H	α-helix	trans	-63.3	-39.4	174.4	-66.8	-166.5	133.8	0	0	112	N301 K302 R309	N301-E305 PolarHBondContact O-N 2.71Å; N301-E305 VanDerWaalsContact O-N 3.14Å; K302-E305 PolarHBondContact O-N 3.42Å; E305-R309 WeakPolarHBondContact O-CB 3.35Å; E305-R309 PolarHBondContact O-N 2.87Å
306	E	41.5	Very low	36.7	Very low	127 Å²	127	103.4 Å²	103.4	59%	0.593	50%	0.502	S	S	*	.	H	α-helix	trans	-65.2	-44.5	174.9	-75.1	170.4	174.7	0	0	112.2	K302 V304 R309 D310	K302-E306 WeakPolarHBondContact O-CB 3.48Å; K302-E306 VanDerWaalsContact O-CG 3.32Å; K302-E306 WeakPolarHBondContact O-CG 3.29Å; K302-E306 PolarHBondContact O-N 3.36Å; V304-E306 VanDerWaalsContact C-N 3.34Å; V304-E306 PolarHBondContact O-N 3.3Å; E306-R309 PolarHBondContact O-N 2.91Å; E306-D310 PolarHBondContact O-N 3.47Å
307	F	41.3	Very low	37.4	Very low	128 Å²	128	100.4 Å²	100.4	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-63.8	-47.2	175.2	176.9	-99.5	0	0	0	112.1	T303 V304 R309 D310 L311	T303-F307 WeakPolarHBondContact O-CB 3.48Å; T303-F307 PolarHBondContact O-N 3.2Å; V304-F307 PolarHBondContact O-N 2.85Å; F307-R309 VanDerWaalsContact C-N 3.29Å; F307-R309 PolarHBondContact O-N 3.43Å; F307-D310 PolarHBondContact O-N 3.12Å; F307-L311 HydrophobicContact CE1-CD2 4.32Å; F307-L311 VanDerWaalsContact O-CB 3.24Å; F307-L311 WeakPolarHBondContact O-CB 3.38Å; F307-L311 PolarHBondContact O-N 2.9Å
308	L	39.3	Very low	38.3	Very low	98 Å²	98	97 Å²	97	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-64.8	-33.3	176.3	-70.4	175	0	0	0	111.8	V304 S312	V304-L308 HydrophobicContact CG1-CD1 3.95Å; V304-L308 HydrophobicContact CG1-CG 4.35Å; V304-L308 WeakPolarHBondContact O-CB 3.46Å; V304-L308 VanDerWaalsContact O-CG 3.27Å; V304-L308 WeakPolarHBondContact O-CG 3.2Å; V304-L308 PolarHBondContact O-N 3.36Å; L308-S312 WeakPolarHBondContact O-CB 3.24Å; L308-S312 PolarHBondContact O-N 3.48Å
309	R	44.3	Very low	39.2	Very low	143 Å²	143	96.5 Å²	96.5	54%	0.54	46%	0.46	S	S	.	.	H	α-helix	trans	-67.2	-48.5	173.4	175.1	178.2	-86	-173.1	-4.9	111.4	E305 E306 F307 S312 I313	E305-R309 WeakPolarHBondContact O-CB 3.35Å; E305-R309 PolarHBondContact O-N 2.87Å; E306-R309 PolarHBondContact O-N 2.91Å; F307-R309 VanDerWaalsContact C-N 3.29Å; F307-R309 PolarHBondContact O-N 3.43Å; R309-S312 PolarHBondContact O-N 2.92Å; R309-I313 HydrophobicContact CG-CD1 3.89Å; R309-I313 WeakPolarHBondContact O-CB 3.21Å; R309-I313 WeakPolarHBondContact O-CG1 3.47Å; R309-I313 PolarHBondContact O-N 3.49Å
310	D	44	Very low	39.8	Very low	55 Å²	55	93.6 Å²	93.6	29%	0.294	45%	0.451	S	S	.	.	H	α-helix	trans	-68.4	-37.3	178.1	-172.8	49.2	0	0	0	111.9	E306 F307 I313 R314	E306-D310 PolarHBondContact O-N 3.47Å; F307-D310 PolarHBondContact O-N 3.12Å; D310-I313 PolarHBondContact O-N 2.91Å; D310-R314 WeakPolarHBondContact O-CB 3.45Å; D310-R314 VanDerWaalsContact O-CG 3.25Å; D310-R314 WeakPolarHBondContact O-CG 3.17Å; D310-R314 PolarHBondContact O-N 3.47Å; D310-R314 IonicContact OD1-NE 2.7Å; D310-R314 IonicContact OD2-CZ 2.72Å; D310-R314 IonicContact OD2-NE 2.72Å; D310-R314 PolarHBondContact OD2-NE 3.27Å; D310-R314 IonicContact OD2-NH2 2.63Å; D310-R314 PolarHBondContact OD2-NH2 3.44Å
311	L	42.9	Very low	40.7	Very low	37 Å²	37	89.8 Å²	89.8	19%	0.194	43%	0.432	C	S	.	.	H	α-helix	trans	-61.4	-45.1	171.1	-179.2	63.8	0	0	0	111.6	F307 R314 L315 T379	F307-L311 HydrophobicContact CE1-CD2 4.32Å; F307-L311 VanDerWaalsContact O-CB 3.24Å; F307-L311 WeakPolarHBondContact O-CB 3.38Å; F307-L311 PolarHBondContact O-N 2.9Å; L311-R314 PolarHBondContact O-N 3.14Å; L311-L315 HydrophobicContact CD1-CD1 4.29Å; L311-L315 HydrophobicContact CD1-CG 4.44Å; L311-L315 HydrophobicContact CG-CD1 4.08Å; L311-L315 WeakPolarHBondContact O-CB 3.3Å; L311-L315 WeakPolarHBondContact O-CG 3.36Å; L311-L315 PolarHBondContact O-N 3.29Å; L311-T379 HydrophobicContact CD1-CG2 3.84Å; L311-T379 HydrophobicContact CD2-CG2 3.72Å; L311-T379 HydrophobicContact CG-CG2 4.4Å
312	S	42	Very low	41.5	Very low	71 Å²	71	87.4 Å²	87.4	50%	0.497	42%	0.419	S	S	.	.	H	α-helix	trans	-62.3	-42.4	174.9	-176.8	0	0	0	0	111.6	L308 R309 L315 H316	L308-S312 WeakPolarHBondContact O-CB 3.24Å; L308-S312 PolarHBondContact O-N 3.48Å; R309-S312 PolarHBondContact O-N 2.92Å; S312-L315 PolarHBondContact O-N 2.97Å; S312-H316 VanDerWaalsContact O-CB 3.25Å; S312-H316 WeakPolarHBondContact O-CB 3.43Å; S312-H316 PolarHBondContact O-N 2.97Å
313	I	43.5	Very low	42	Very low	26 Å²	26	84.4 Å²	84.4	13%	0.133	40%	0.403	C	S	.	.	H	α-helix	trans	-58.3	-51.8	172.7	-73.6	165	0	0	0	110.1	R309 D310 L315 H316 T317 C505	R309-I313 HydrophobicContact CG-CD1 3.89Å; R309-I313 WeakPolarHBondContact O-CB 3.21Å; R309-I313 WeakPolarHBondContact O-CG1 3.47Å; R309-I313 PolarHBondContact O-N 3.49Å; D310-I313 PolarHBondContact O-N 2.91Å; I313-L315 PolarHBondContact O-N 3.22Å; I313-H316 PolarHBondContact O-N 2.94Å; I313-T317 WeakPolarHBondContact O-CB 3.36Å; I313-T317 PolarHBondContact O-N 3.09Å; I313-T317 PolarHBondContact O-OG1 3.16Å; I313-T317 VanDerWaalsContact O-OG1 3.05Å; I313-C505 VanDerWaalsContact CG1-SG 3.59Å
314	R	44.7	Very low	41.9	Very low	165 Å²	165	84.4 Å²	84.4	62%	0.623	41%	0.406	S	S	*	.	H	α-helix	trans	-59.3	-45.3	179.1	-70.9	172.5	-166	-136.6	9.2	111.9	D310 L311 T317 F318	D310-R314 WeakPolarHBondContact O-CB 3.45Å; D310-R314 VanDerWaalsContact O-CG 3.25Å; D310-R314 WeakPolarHBondContact O-CG 3.17Å; D310-R314 PolarHBondContact O-N 3.47Å; D310-R314 IonicContact OD1-NE 2.7Å; D310-R314 IonicContact OD2-CZ 2.72Å; D310-R314 IonicContact OD2-NE 2.72Å; D310-R314 PolarHBondContact OD2-NE 3.27Å; D310-R314 IonicContact OD2-NH2 2.63Å; D310-R314 PolarHBondContact OD2-NH2 3.44Å; L311-R314 PolarHBondContact O-N 3.14Å; R314-T317 PolarHBondContact O-N 3.13Å; R314-F318 VanDerWaalsContact O-CB 3.31Å; R314-F318 WeakPolarHBondContact O-CB 3.36Å; R314-F318 PolarHBondContact O-N 3.32Å
315	L	42.7	Very low	42.4	Very low	53 Å²	53	84.8 Å²	84.8	28%	0.277	40%	0.404	S	S	.	.	H	α-helix	trans	-64.8	-38.4	176	-72.8	170.2	0	0	0	112	L311 S312 I313 F318 K319 I375	L311-L315 HydrophobicContact CD1-CD1 4.29Å; L311-L315 HydrophobicContact CD1-CG 4.44Å; L311-L315 HydrophobicContact CG-CD1 4.08Å; L311-L315 WeakPolarHBondContact O-CB 3.3Å; L311-L315 WeakPolarHBondContact O-CG 3.36Å; L311-L315 PolarHBondContact O-N 3.29Å; S312-L315 PolarHBondContact O-N 2.97Å; I313-L315 PolarHBondContact O-N 3.22Å; L315-F318 PolarHBondContact O-N 3.07Å; L315-K319 WeakPolarHBondContact O-CB 3.31Å; L315-K319 PolarHBondContact O-N 2.62Å; L315-I375 HydrophobicContact CD2-CD1 4.46Å; L315-I375 HydrophobicContact CD2-CG2 4.33Å
316	H	43.4	Very low	42.4	Very low	73 Å²	73	81.6 Å²	81.6	34%	0.338	39%	0.385	S	S	.	.	H	α-helix	trans	-70.7	-40.6	176.6	-151.5	117.6	0	0	0	111.4	S312 I313 K319 L320	S312-H316 VanDerWaalsContact O-CB 3.25Å; S312-H316 WeakPolarHBondContact O-CB 3.43Å; S312-H316 PolarHBondContact O-N 2.97Å; I313-H316 PolarHBondContact O-N 2.94Å; H316-K319 PolarHBondContact O-N 3.25Å; H316-L320 WeakPolarHBondContact O-CB 3.47Å; H316-L320 VanDerWaalsContact O-CG 3.32Å; H316-L320 WeakPolarHBondContact O-CG 3.24Å; H316-L320 PolarHBondContact O-N 3.29Å
317	T	42.6	Very low	42.2	Very low	59 Å²	59	79.8 Å²	79.8	36%	0.362	38%	0.38	S	S	.	.	H	α-helix	trans	-62.9	-42.1	172.3	-62.5	0	0	0	0	111.3	I313 R314 L320 K321	I313-T317 WeakPolarHBondContact O-CB 3.36Å; I313-T317 PolarHBondContact O-N 3.09Å; I313-T317 PolarHBondContact O-OG1 3.16Å; I313-T317 VanDerWaalsContact O-OG1 3.05Å; R314-T317 PolarHBondContact O-N 3.13Å; T317-L320 PolarHBondContact O-N 2.92Å; T317-K321 HydrophobicContact CG2-CD 4.09Å; T317-K321 HydrophobicContact CG2-CG 4.47Å; T317-K321 WeakPolarHBondContact O-CB 3.35Å; T317-K321 WeakPolarHBondContact O-CG 3.42Å; T317-K321 PolarHBondContact O-N 3.36Å
318	F	43.9	Very low	42	Very low	61 Å²	61	77.9 Å²	77.9	27%	0.268	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-46.2	174.2	-177.1	-105.6	0	0	0	111.3	R314 L315 L320 K321 L322	R314-F318 VanDerWaalsContact O-CB 3.31Å; R314-F318 WeakPolarHBondContact O-CB 3.36Å; R314-F318 PolarHBondContact O-N 3.32Å; L315-F318 PolarHBondContact O-N 3.07Å; F318-L320 VanDerWaalsContact C-N 3.33Å; F318-L320 PolarHBondContact O-N 2.82Å; F318-K321 PolarHBondContact O-N 2.84Å; F318-L322 HydrophobicContact CD1-CD1 3.83Å; F318-L322 HydrophobicContact CE1-CD1 3.53Å; F318-L322 HydrophobicContact CE1-CG 4.39Å; F318-L322 HydrophobicContact CZ-CD1 4.07Å; F318-L322 WeakPolarHBondContact O-CB 3.28Å; F318-L322 WeakPolarHBondContact O-CG 3.35Å; F318-L322 PolarHBondContact O-N 2.83Å
319	K	43.6	Very low	41.7	Very low	116 Å²	116	75.5 Å²	75.5	50%	0.504	36%	0.361	S	S	.	.	H	α-helix	trans	-62.6	-34.1	174.8	-173.3	175.9	-172.9	170.6	0	113.2	L315 H316 R323	L315-K319 WeakPolarHBondContact O-CB 3.31Å; L315-K319 PolarHBondContact O-N 2.62Å; H316-K319 PolarHBondContact O-N 3.25Å; K319-R323 WeakPolarHBondContact O-CG 3.23Å; K319-R323 PolarHBondContact O-N 2.98Å
320	L	40.3	Very low	41.4	Very low	73 Å²	73	73.5 Å²	73.5	38%	0.382	36%	0.358	S	S	.	.	H	α-helix	trans	-72.4	-44.4	171.9	-75.6	171.8	0	0	0	111.6	H316 T317 F318 L322 R323 C324	H316-L320 WeakPolarHBondContact O-CB 3.47Å; H316-L320 VanDerWaalsContact O-CG 3.32Å; H316-L320 WeakPolarHBondContact O-CG 3.24Å; H316-L320 PolarHBondContact O-N 3.29Å; T317-L320 PolarHBondContact O-N 2.92Å; F318-L320 VanDerWaalsContact C-N 3.33Å; F318-L320 PolarHBondContact O-N 2.82Å; L320-L322 VanDerWaalsContact C-N 3.3Å; L320-L322 PolarHBondContact O-N 3.33Å; L320-R323 CarbonylContact O-C 3.56Å; L320-R323 WeakPolarHBondContact O-CA 3.45Å; L320-R323 WeakPolarHBondContact O-CB 3.34Å; L320-R323 PolarHBondContact O-N 3.1Å; L320-C324 PolarHBondContact O-N 3.44Å; L320-C324 PolarHBondContact O-SG 3.45Å
321	K	44	Very low	41	Very low	61 Å²	61	77.2 Å²	77.2	27%	0.265	37%	0.373	S	S	.	.	H	α-helix	trans	-62.2	-36.9	175.6	-71.8	-179.3	-176.4	-161.4	0	111.4	T317 F318 K325 D698	T317-K321 HydrophobicContact CG2-CD 4.09Å; T317-K321 HydrophobicContact CG2-CG 4.47Å; T317-K321 WeakPolarHBondContact O-CB 3.35Å; T317-K321 WeakPolarHBondContact O-CG 3.42Å; T317-K321 PolarHBondContact O-N 3.36Å; F318-K321 PolarHBondContact O-N 2.84Å; K321-K325 WeakPolarHBondContact O-CB 3.47Å; K321-K325 WeakPolarHBondContact O-CG 3.4Å; K321-K325 PolarHBondContact O-N 3.44Å; K321-D698 WeakPolarHBondContact CD-O 3.31Å; K321-D698 WeakPolarHBondContact CE-O 3.39Å; K321-D698 WeakPolarHBondContact CE-OD1 3.38Å; K321-D698 PolarHBondContact NZ-O 2.91Å; K321-D698 IonicContact NZ-OD1 2.69Å; K321-D698 PolarHBondContact NZ-OD1 2.88Å
322	L	44	Very low	40.5	Very low	79 Å²	79	81.2 Å²	81.2	41%	0.414	39%	0.391	S	S	.	.	H	α-helix	trans	-65.1	-40.6	169.3	-74.8	173.3	0	0	0	112.9	F318 L320 R326	F318-L322 HydrophobicContact CD1-CD1 3.83Å; F318-L322 HydrophobicContact CE1-CD1 3.53Å; F318-L322 HydrophobicContact CE1-CG 4.39Å; F318-L322 HydrophobicContact CZ-CD1 4.07Å; F318-L322 WeakPolarHBondContact O-CB 3.28Å; F318-L322 WeakPolarHBondContact O-CG 3.35Å; F318-L322 PolarHBondContact O-N 2.83Å; L320-L322 VanDerWaalsContact C-N 3.3Å; L320-L322 PolarHBondContact O-N 3.33Å; L322-R326 WeakPolarHBondContact O-CB 3.4Å; L322-R326 PolarHBondContact O-N 3.06Å
323	R	42.4	Very low	39.8	Very low	84 Å²	84	80.2 Å²	80.2	32%	0.317	39%	0.392	S	S	.	.	H	α-helix	trans	-65.9	-44.2	173.6	-83.3	-176.9	174	-176	-0.4	112.9	K319 L320 K325 R326 N327	K319-R323 WeakPolarHBondContact O-CG 3.23Å; K319-R323 PolarHBondContact O-N 2.98Å; L320-R323 CarbonylContact O-C 3.56Å; L320-R323 WeakPolarHBondContact O-CA 3.45Å; L320-R323 WeakPolarHBondContact O-CB 3.34Å; L320-R323 PolarHBondContact O-N 3.1Å; R323-K325 VanDerWaalsContact C-N 3.34Å; R323-R326 PolarHBondContact O-N 3.34Å; R323-N327 WeakPolarHBondContact O-CB 3.36Å; R323-N327 VanDerWaalsContact O-CG 3.26Å; R323-N327 PolarHBondContact O-N 2.91Å; R323-N327 PolarHBondContact O-OD1 2.93Å
324	C	36.2	Very low	39	Very low	72 Å²	72	86.5 Å²	86.5	49%	0.486	42%	0.415	S	S	.	.	H	α-helix	trans	-62.5	-42.5	176	-69.2	0	0	0	0	110.6	L320 N327 M328	L320-C324 PolarHBondContact O-N 3.44Å; L320-C324 PolarHBondContact O-SG 3.45Å; C324-N327 PolarHBondContact O-N 3.24Å; C324-M328 WeakPolarHBondContact O-CG 3.42Å; C324-M328 PolarHBondContact O-N 3.45Å
325	K	44.5	Very low	38.4	Very low	54 Å²	54	88.4 Å²	88.4	24%	0.235	42%	0.424	C	S	.	.	H	α-helix	trans	-63.3	-42.5	172.2	-73.7	179.4	-175.4	178.9	0	112.4	K321 R323 N327 M328 L329 G699 M701	K321-K325 WeakPolarHBondContact O-CB 3.47Å; K321-K325 WeakPolarHBondContact O-CG 3.4Å; K321-K325 PolarHBondContact O-N 3.44Å; R323-K325 VanDerWaalsContact C-N 3.34Å; K325-N327 VanDerWaalsContact C-N 3.35Å; K325-N327 PolarHBondContact O-N 3.45Å; K325-M328 PolarHBondContact O-N 3.07Å; K325-L329 VanDerWaalsContact O-CB 3.25Å; K325-L329 WeakPolarHBondContact O-CB 3.44Å; K325-L329 WeakPolarHBondContact O-CD1 3.25Å; K325-L329 WeakPolarHBondContact O-CG 3.21Å; K325-L329 PolarHBondContact O-N 3.38Å; K325-G699 WeakPolarHBondContact CE-O 3.33Å; K325-G699 PolarHBondContact NZ-O 3.14Å; K325-M701 HydrophobicContact CD-CG 4.21Å
326	R	38.7	Very low	37.8	Very low	79 Å²	79	90 Å²	90	30%	0.298	43%	0.432	S	S	.	.	H	α-helix	trans	-58.5	-44.1	172.2	177.3	172.2	167.1	151.9	-2.6	112	L322 R323 L329 Q330 L336 D338	L322-R326 WeakPolarHBondContact O-CB 3.4Å; L322-R326 PolarHBondContact O-N 3.06Å; R323-R326 PolarHBondContact O-N 3.34Å; R326-L329 PolarHBondContact O-N 2.87Å; R326-Q330 WeakPolarHBondContact O-CB 2.97Å; R326-Q330 WeakPolarHBondContact O-CG 3.5Å; R326-Q330 PolarHBondContact O-N 2.68Å; R326-L336 HydrophobicContact CB-CD1 4.17Å; R326-D338 IonicContact CZ-OD1 3.88Å; R326-D338 VanDerWaalsContact CZ-OD1 3.29Å; R326-D338 IonicContact CZ-OD2 3.05Å; R326-D338 IonicContact NH1-OD1 2.73Å; R326-D338 PolarHBondContact NH1-OD1 3.42Å; R326-D338 IonicContact NH1-OD2 3.89Å; R326-D338 IonicContact NH2-OD1 2.6Å; R326-D338 PolarHBondContact NH2-OD1 3.32Å; R326-D338 IonicContact NH2-OD2 3.75Å; R326-D338 PolarHBondContact NH2-OD2 3.43Å
327	N	38.3	Very low	37.1	Very low	89 Å²	89	91 Å²	91	48%	0.476	44%	0.439	S	S	.	.	H	α-helix	trans	-66.8	-42.1	178.6	-68.4	2	0	0	0	112	R323 C324 K325 Q330 Q331	R323-N327 WeakPolarHBondContact O-CB 3.36Å; R323-N327 VanDerWaalsContact O-CG 3.26Å; R323-N327 PolarHBondContact O-N 2.91Å; R323-N327 PolarHBondContact O-OD1 2.93Å; C324-N327 PolarHBondContact O-N 3.24Å; K325-N327 VanDerWaalsContact C-N 3.35Å; K325-N327 PolarHBondContact O-N 3.45Å; N327-Q330 PolarHBondContact O-N 3.4Å; N327-Q331 WeakPolarHBondContact O-CG 3.33Å; N327-Q331 PolarHBondContact O-N 2.9Å
328	M	36	Very low	36.5	Very low	88 Å²	88	90.9 Å²	90.9	43%	0.433	44%	0.437	S	S	.	.	H	α-helix	trans	-67.7	-39.9	176	-70.9	-170.5	78	0	0	111.9	C324 K325 Q331 H332	C324-M328 WeakPolarHBondContact O-CG 3.42Å; C324-M328 PolarHBondContact O-N 3.45Å; K325-M328 PolarHBondContact O-N 3.07Å; M328-Q331 CarbonylContact O-C 3.54Å; M328-Q331 WeakPolarHBondContact O-CB 3.38Å; M328-Q331 PolarHBondContact O-N 2.94Å; M328-Q331 VanDerWaalsContact O-N 3.14Å; M328-H332 PolarHBondContact O-CD2 3.47Å; M328-H332 PolarHBondContact O-N 2.9Å
329	L	34.2	Very low	35.7	Very low	47 Å²	47	97.8 Å²	97.8	25%	0.246	46%	0.462	C	S	.	.	H	α-helix	trans	-65.6	-40.2	175.6	-72.1	165.2	0	0	0	110.9	K325 R326 Q331 H332 G333 Y334 L336	K325-L329 VanDerWaalsContact O-CB 3.25Å; K325-L329 WeakPolarHBondContact O-CB 3.44Å; K325-L329 WeakPolarHBondContact O-CD1 3.25Å; K325-L329 WeakPolarHBondContact O-CG 3.21Å; K325-L329 PolarHBondContact O-N 3.38Å; R326-L329 PolarHBondContact O-N 2.87Å; L329-Q331 VanDerWaalsContact C-N 3.35Å; L329-Q331 PolarHBondContact O-N 3Å; L329-H332 CarbonylContact O-C 3.55Å; L329-H332 PolarHBondContact O-N 3.31Å; L329-H332 VanDerWaalsContact O-N 3.1Å; L329-G333 PolarHBondContact O-N 3.47Å; L329-G333 VanDerWaalsContact O-N 3.07Å; L329-Y334 CarbonylContact C-O 3.59Å; L329-Y334 VanDerWaalsContact C-O 3.3Å; L329-Y334 HydrophobicContact CD2-CD2 4.19Å; L329-Y334 HydrophobicContact CD2-CG 4.06Å; L329-Y334 PolarHBondContact O-N 3.18Å; L329-L336 HydrophobicContact CD1-CD1 3.57Å; L329-L336 HydrophobicContact CD1-CG 4.16Å
330	Q	36.8	Very low	34.9	Very low	101 Å²	101	100.1 Å²	100.1	47%	0.472	48%	0.475	S	S	.	.	H	α-helix	trans	-60.1	-39.1	168.4	-76.8	-176.6	-42.8	0	0	112.9	R326 N327 H332 G333	R326-Q330 WeakPolarHBondContact O-CB 2.97Å; R326-Q330 WeakPolarHBondContact O-CG 3.5Å; R326-Q330 PolarHBondContact O-N 2.68Å; N327-Q330 PolarHBondContact O-N 3.4Å; Q330-H332 VanDerWaalsContact C-N 3.28Å; Q330-H332 PolarHBondContact O-N 3.01Å; Q330-G333 PolarHBondContact O-N 2.68Å
331	Q	36.7	Very low	34.6	Very low	133 Å²	133	104.5 Å²	104.5	62%	0.621	49%	0.494	S	S	*	.	H	α-helix	trans	-68.2	-24.1	173.7	-76	175.6	-22	0	0	113.6	N327 M328 L329	N327-Q331 WeakPolarHBondContact O-CG 3.33Å; N327-Q331 PolarHBondContact O-N 2.9Å; M328-Q331 CarbonylContact O-C 3.54Å; M328-Q331 WeakPolarHBondContact O-CB 3.38Å; M328-Q331 PolarHBondContact O-N 2.94Å; M328-Q331 VanDerWaalsContact O-N 3.14Å; L329-Q331 VanDerWaalsContact C-N 3.35Å; L329-Q331 PolarHBondContact O-N 3Å
332	H	32	Very low	33.9	Very low	121 Å²	121	104.5 Å²	104.5	56%	0.56	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	9.5	176.4	-65.1	-49.8	0	0	0	113.6	M328 L329 Q330 Y334	M328-H332 PolarHBondContact O-CD2 3.47Å; M328-H332 PolarHBondContact O-N 2.9Å; L329-H332 CarbonylContact O-C 3.55Å; L329-H332 PolarHBondContact O-N 3.31Å; L329-H332 VanDerWaalsContact O-N 3.1Å; Q330-H332 VanDerWaalsContact C-N 3.28Å; Q330-H332 PolarHBondContact O-N 3.01Å; H332-Y334 HydrophobicContact CB-CD2 3.71Å; H332-Y334 HydrophobicContact CB-CE2 4.1Å; H332-Y334 VanDerWaalsContact O-CD2 3.29Å; H332-Y334 WeakPolarHBondContact O-CD2 3.45Å; H332-Y334 PolarHBondContact O-N 3.24Å
333	G	26.9	Very low	33.2	Very low	50 Å²	50	107.1 Å²	107.1	52%	0.515	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	2.5	179.4	0	0	0	0	0	115.4	L329 Q330 Y335	L329-G333 PolarHBondContact O-N 3.47Å; L329-G333 VanDerWaalsContact O-N 3.07Å; Q330-G333 PolarHBondContact O-N 2.68Å; G333-Y335 WeakPolarHBondContact O-CD2 3.48Å; G333-Y335 PolarHBondContact O-N 2.78Å
334	Y	27.5	Very low	32.6	Very low	159 Å²	159	112.3 Å²	112.3	62%	0.624	53%	0.534	S	S	*	.			trans	-83.3	99.9	176.1	-68	-86.7	0	0	0	110.1	L329 H332 L336	L329-Y334 CarbonylContact C-O 3.59Å; L329-Y334 VanDerWaalsContact C-O 3.3Å; L329-Y334 HydrophobicContact CD2-CD2 4.19Å; L329-Y334 HydrophobicContact CD2-CG 4.06Å; L329-Y334 PolarHBondContact O-N 3.18Å; H332-Y334 HydrophobicContact CB-CD2 3.71Å; H332-Y334 HydrophobicContact CB-CE2 4.1Å; H332-Y334 VanDerWaalsContact O-CD2 3.29Å; H332-Y334 WeakPolarHBondContact O-CD2 3.45Å; H332-Y334 PolarHBondContact O-N 3.24Å; Y334-L336 PolarHBondContact O-N 2.84Å
335	Y	31	Very low	32.3	Very low	205 Å²	205	113.1 Å²	113.1	80%	0.804	55%	0.554	S	S	*	*			trans	-69.4	95.3	172.4	-65.1	-86.8	0	0	0	110.5	G333 L337	G333-Y335 WeakPolarHBondContact O-CD2 3.48Å; G333-Y335 PolarHBondContact O-N 2.78Å; Y335-L337 PolarHBondContact O-N 3.49Å; Y335-L337 VanDerWaalsContact O-N 3.07Å
336	L	30	Very low	31.6	Very low	86 Å²	86	116.2 Å²	116.2	45%	0.45	57%	0.567	S	S	.	*			trans	-59.8	109	156.6	-107.9	167.3	0	0	0	107.6	R326 L329 Y334 D338	R326-L336 HydrophobicContact CB-CD1 4.17Å; L329-L336 HydrophobicContact CD1-CD1 3.57Å; L329-L336 HydrophobicContact CD1-CG 4.16Å; Y334-L336 PolarHBondContact O-N 2.84Å; L336-D338 PolarHBondContact O-N 3.32Å
337	L	28.6	Very low	31.1	Very low	94 Å²	94	122.2 Å²	122.2	49%	0.492	59%	0.59	S	S	.	*			trans	-38.3	125	-179.1	-90.8	161.1	0	0	0	111.6	Y335 Y339 I342	Y335-L337 PolarHBondContact O-N 3.49Å; Y335-L337 VanDerWaalsContact O-N 3.07Å; L337-Y339 PolarHBondContact O-N 2.79Å; L337-I342 HydrophobicContact CB-CD1 4.37Å
338	D	30.2	Very low	30.6	Very low	57 Å²	57	127.7 Å²	127.7	31%	0.305	61%	0.605	S	S	.	*			trans	-77	122.9	-177.2	-131.1	-26.9	0	0	0	110.3	R326 L336 E340 Q341	R326-D338 IonicContact CZ-OD1 3.88Å; R326-D338 VanDerWaalsContact CZ-OD1 3.29Å; R326-D338 IonicContact CZ-OD2 3.05Å; R326-D338 IonicContact NH1-OD1 2.73Å; R326-D338 PolarHBondContact NH1-OD1 3.42Å; R326-D338 IonicContact NH1-OD2 3.89Å; R326-D338 IonicContact NH2-OD1 2.6Å; R326-D338 PolarHBondContact NH2-OD1 3.32Å; R326-D338 IonicContact NH2-OD2 3.75Å; R326-D338 PolarHBondContact NH2-OD2 3.43Å; L336-D338 PolarHBondContact O-N 3.32Å; D338-E340 PolarHBondContact O-N 2.7Å; D338-Q341 PolarHBondContact O-N 2.81Å
339	Y	27	Very low	30.5	Very low	206 Å²	206	126.5 Å²	126.5	81%	0.808	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-9.1	-174.6	-127	-99.3	0	0	0	113.4	L337	L337-Y339 PolarHBondContact O-N 2.79Å
340	E	28.5	Very low	30.4	Very low	165 Å²	165	126.3 Å²	126.3	77%	0.771	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-11.1	177.3	-65.2	177.5	174.2	0	0	113	D338	D338-E340 PolarHBondContact O-N 2.7Å
341	Q	33.1	Very low	30	Very low	165 Å²	165	125 Å²	125	77%	0.771	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-17.8	177.8	-71.2	-171.7	-17.2	0	0	114.5	D338 H343	D338-Q341 PolarHBondContact O-N 2.81Å; Q341-H343 PolarHBondContact O-N 3.08Å; Q341-H343 VanDerWaalsContact O-N 3.14Å
342	I	30.4	Very low	29.9	Very low	61 Å²	61	126.1 Å²	126.1	31%	0.313	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89	43.2	-179.5	-39.8	-177.8	0	0	0	110.9	L337 W349	L337-I342 HydrophobicContact CB-CD1 4.37Å; I342-W349 HydrophobicContact CG2-CZ2 3.82Å
343	H	28.1	Very low	30.2	Very low	134 Å²	134	122 Å²	122	62%	0.62	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.2	20.7	-174	-130.3	-64.9	0	0	0	119	Q341	Q341-H343 PolarHBondContact O-N 3.08Å; Q341-H343 VanDerWaalsContact O-N 3.14Å
344	E	29.9	Very low	30.5	Very low	193 Å²	193	123 Å²	123	90%	0.902	59%	0.588	S	S	*	*	S	Bend	trans	-109.4	142.3	155.3	-68	-164.9	150.5	0	0	110.6	K346	E344-K346 PolarHBondContact O-N 2.74Å; E344-K346 VanDerWaalsContact O-N 3.11Å
345	G	30.2	Very low	30.7	Very low	88 Å²	88	121.6 Å²	121.6	91%	0.907	59%	0.591	S	S	*	*	S	Bend	trans	84.7	-58	171.6	0	0	0	0	0	117.4
346	K	29.4	Very low	31	Very low	119 Å²	119	116.9 Å²	116.9	52%	0.517	58%	0.58	S	S	.	*			trans	-107.8	108	-172.8	-74	-167.7	172.6	-166.6	0	113.2	E344 W349 D353	E344-K346 PolarHBondContact O-N 2.74Å; E344-K346 VanDerWaalsContact O-N 3.11Å; K346-W349 HydrophobicContact CD-CE3 4.24Å; K346-W349 HydrophobicContact CD-CH2 4.42Å; K346-W349 HydrophobicContact CD-CZ3 4.04Å; K346-D353 IonicContact NZ-OD1 3.86Å
347	R	29.1	Very low	30.9	Very low	206 Å²	206	116.9 Å²	116.9	78%	0.777	58%	0.577	S	S	*	*	S	Bend	trans	-96.9	-6.1	174.3	-70.4	-172.2	179.6	-175.9	0.3	114.9
348	Y	27.9	Very low	30.9	Very low	203 Å²	203	121.9 Å²	121.9	80%	0.796	59%	0.594	S	S	*	*			trans	-141.2	153.3	178.5	-57.5	-75.3	0	0	0	109.2
349	W	32.6	Very low	30.8	Very low	63 Å²	63	121.2 Å²	121.2	24%	0.239	59%	0.594	C	S	.	*			trans	-136.5	140.8	175.4	-51.4	81.1	0	0	0	107.3	I342 K346 D353 P387 T388	I342-W349 HydrophobicContact CG2-CZ2 3.82Å; K346-W349 HydrophobicContact CD-CE3 4.24Å; K346-W349 HydrophobicContact CD-CH2 4.42Å; K346-W349 HydrophobicContact CD-CZ3 4.04Å; W349-D353 HydrophobicContact CB-CB 3.99Å; W349-D353 HydrophobicContact CE3-CB 4.21Å; W349-P387 HydrophobicContact CB-CG 4.27Å; W349-P387 VanDerWaalsContact CD1-CD 3.43Å; W349-P387 VanDerWaalsContact CG-CD 3.44Å; W349-P387 HydrophobicContact CG-CG 4.49Å; W349-P387 VanDerWaalsContact CZ2-O 3.24Å; W349-P387 WeakPolarHBondContact CZ2-O 3.48Å; W349-T388 HydrophobicContact CD2-CG2 3.88Å; W349-T388 HydrophobicContact CE3-CG2 3.48Å; W349-T388 VanDerWaalsContact CE3-CG2 3.48Å; W349-T388 HydrophobicContact CG-CG2 4.41Å; W349-T388 HydrophobicContact CH2-CG2 4.47Å; W349-T388 WeakPolarHBondContact CH2-OG1 2.95Å; W349-T388 HydrophobicContact CZ3-CG2 3.83Å; W349-T388 WeakPolarHBondContact CZ3-OG1 3.33Å
350	S	31.9	Very low	31	Very low	44 Å²	44	121.3 Å²	121.3	31%	0.308	60%	0.601	S	S	.	*			trans	-80	174.1	-179.4	67.6	0	0	0	0	112.3	E352 D353 V354	S350-E352 PolarHBondContact O-N 2.8Å; S350-E352 PolarHBondContact OG-N 3.33Å; S350-D353 WeakPolarHBondContact CB-OD2 3.39Å; S350-D353 PolarHBondContact N-OD2 3.48Å; S350-D353 PolarHBondContact O-N 2.87Å; S350-D353 PolarHBondContact OG-N 3.36Å; S350-D353 PolarHBondContact OG-OD2 3.35Å; S350-V354 WeakPolarHBondContact O-CG2 3.36Å; S350-V354 PolarHBondContact O-N 3.38Å
351	A	28.7	Very low	31.2	Very low	72 Å²	72	115.8 Å²	115.8	60%	0.595	58%	0.581	S	S	*	*	H	α-helix	trans	-65.5	-27.2	167.6	0	0	0	0	0	112	V354 N355	A351-V354 WeakPolarHBondContact O-CB 3.28Å; A351-V354 PolarHBondContact O-N 2.85Å; A351-N355 PolarHBondContact O-N 3.25Å; A351-N355 VanDerWaalsContact O-N 3.1Å; A351-N355 PolarHBondContact O-ND2 2.62Å; A351-N355 PolarHBondContact O-OD1 3.24Å
352	E	35.9	Very low	31	Very low	157 Å²	157	115.6 Å²	115.6	73%	0.734	58%	0.58	S	S	*	*	H	α-helix	trans	-70.8	-43.5	175.8	-60.2	166.8	161.7	0	0	110.2	S350 V354 N355 D356	S350-E352 PolarHBondContact O-N 2.8Å; S350-E352 PolarHBondContact OG-N 3.33Å; E352-V354 PolarHBondContact O-N 3.02Å; E352-N355 PolarHBondContact O-N 2.94Å; E352-N355 VanDerWaalsContact O-N 3.09Å; E352-D356 PolarHBondContact O-N 3.34Å
353	D	37.9	Very low	31.4	Very low	36 Å²	36	117.8 Å²	117.8	19%	0.193	60%	0.596	C	S	.	*	H	α-helix	trans	-60	-25.1	170.7	-65.8	-84.4	0	0	0	112.2	K346 W349 S350 T388 F389	K346-D353 IonicContact NZ-OD1 3.86Å; W349-D353 HydrophobicContact CB-CB 3.99Å; W349-D353 HydrophobicContact CE3-CB 4.21Å; S350-D353 WeakPolarHBondContact CB-OD2 3.39Å; S350-D353 PolarHBondContact N-OD2 3.48Å; S350-D353 PolarHBondContact O-N 2.87Å; S350-D353 PolarHBondContact OG-N 3.36Å; S350-D353 PolarHBondContact OG-OD2 3.35Å; D353-T388 HydrophobicContact CB-CG2 4.08Å; D353-T388 WeakPolarHBondContact O-CG2 3.49Å; D353-F389 WeakPolarHBondContact O-CE2 3.38Å; D353-F389 WeakPolarHBondContact O-CZ 3.31Å
354	V	32	Very low	31.6	Very low	70 Å²	70	115.4 Å²	115.4	42%	0.424	58%	0.583	S	S	.	*	H	α-helix	trans	-76.4	-41.6	172.9	172.2	0	0	0	0	111.7	S350 A351 E352 F357 P387	S350-V354 WeakPolarHBondContact O-CG2 3.36Å; S350-V354 PolarHBondContact O-N 3.38Å; A351-V354 WeakPolarHBondContact O-CB 3.28Å; A351-V354 PolarHBondContact O-N 2.85Å; E352-V354 PolarHBondContact O-N 3.02Å; V354-F357 WeakPolarHBondContact O-CB 3.39Å; V354-F357 PolarHBondContact O-N 2.9Å; V354-P387 HydrophobicContact CG2-CB 4.48Å; V354-P387 HydrophobicContact CG2-CG 3.55Å
355	N	33.3	Very low	31.8	Very low	129 Å²	129	111.8 Å²	111.8	69%	0.69	56%	0.564	S	S	*	*	H	α-helix	trans	-76.4	-28.6	-164.6	-71.9	-11.2	0	0	0	114.4	A351 E352 F357	A351-N355 PolarHBondContact O-N 3.25Å; A351-N355 VanDerWaalsContact O-N 3.1Å; A351-N355 PolarHBondContact O-ND2 2.62Å; A351-N355 PolarHBondContact O-OD1 3.24Å; E352-N355 PolarHBondContact O-N 2.94Å; E352-N355 VanDerWaalsContact O-N 3.09Å; N355-F357 PolarHBondContact O-N 2.82Å
356	D	36.5	Very low	32.2	Very low	107 Å²	107	109.4 Å²	109.4	57%	0.572	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	1.3	174	-87.5	-27.6	0	0	0	113.5	E352 K358 F389 W390	E352-D356 PolarHBondContact O-N 3.34Å; D356-K358 VanDerWaalsContact C-N 3.29Å; D356-K358 PolarHBondContact O-N 3.29Å; D356-F389 HydrophobicContact CB-CE2 3.96Å; D356-F389 HydrophobicContact CB-CZ 3.81Å; D356-W390 HydrophobicContact CB-CH2 4.38Å
357	F	28.6	Very low	32.8	Very low	86 Å²	86	108.2 Å²	108.2	38%	0.377	54%	0.538	S	S	.	.			trans	-77.6	75.4	-176.9	-158.9	-20.8	0	0	0	112.4	V354 N355 C359 T388 F389	V354-F357 WeakPolarHBondContact O-CB 3.39Å; V354-F357 PolarHBondContact O-N 2.9Å; N355-F357 PolarHBondContact O-N 2.82Å; F357-C359 HydrophobicContact CD1-CB 4.1Å; F357-C359 HydrophobicContact CE1-CB 4.04Å; F357-C359 PolarHBondContact O-N 3.3Å; F357-T388 VanDerWaalsContact CE2-N 3.29Å; F357-F389 HydrophobicContact CB-CD2 4.47Å; F357-F389 HydrophobicContact CB-CE2 4.18Å
358	K	27.6	Very low	33.3	Very low	199 Å²	199	101.1 Å²	101.1	87%	0.865	52%	0.515	S	S	*	.			trans	-64.4	92.4	167.3	-70.4	-176.8	177.8	176.8	0	111.4	D356	D356-K358 VanDerWaalsContact C-N 3.29Å; D356-K358 PolarHBondContact O-N 3.29Å
359	C	29.4	Very low	33.9	Very low	43 Å²	43	94.8 Å²	94.8	29%	0.291	50%	0.495	S	S	.	.			trans	-107.7	116.8	166.8	-172.8	0	0	0	0	109.1	F357 S361	F357-C359 HydrophobicContact CD1-CB 4.1Å; F357-C359 HydrophobicContact CE1-CB 4.04Å; F357-C359 PolarHBondContact O-N 3.3Å; C359-S361 PolarHBondContact O-N 3Å; C359-S361 PolarHBondContact SG-OG 3.33Å
360	E	30.5	Very low	34.6	Very low	207 Å²	207	96.9 Å²	96.9	97%	0.967	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	25	-176.8	-56.7	-179.4	142.2	0	0	113.8
361	S	31.9	Very low	35.1	Very low	49 Å²	49	98.9 Å²	98.9	34%	0.343	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.2	41.6	-178.8	64.3	0	0	0	0	113.3	C359 T363 Y364 F365	C359-S361 PolarHBondContact O-N 3Å; C359-S361 PolarHBondContact SG-OG 3.33Å; S361-T363 PolarHBondContact O-N 3.33Å; S361-Y364 PolarHBondContact O-N 3.46Å; S361-F365 PolarHBondContact O-N 3.41Å
362	E	29.9	Very low	35.6	Very low	161 Å²	161	97 Å²	97	75%	0.752	49%	0.492	S	S	*	.	H	α-helix	trans	-46.2	-37.7	176.8	-60.3	179.3	130.6	0	0	113.2	Y364 G366	E362-Y364 VanDerWaalsContact C-N 3.31Å; E362-Y364 PolarHBondContact O-N 2.79Å; E362-G366 PolarHBondContact O-N 2.84Å
363	T	37.8	Very low	35.9	Very low	107 Å²	107	91.8 Å²	91.8	66%	0.656	48%	0.476	S	S	*	.	H	α-helix	trans	-57.9	-37	175.5	50.5	0	0	0	0	113.6	S361 L367	S361-T363 PolarHBondContact O-N 3.33Å; T363-L367 WeakPolarHBondContact O-CB 3.18Å; T363-L367 WeakPolarHBondContact O-CD1 3.14Å; T363-L367 WeakPolarHBondContact O-CG 3.28Å; T363-L367 PolarHBondContact O-N 2.88Å; T363-L367 VanDerWaalsContact O-N 3.1Å
364	Y	32.8	Very low	36.1	Very low	84 Å²	84	94.3 Å²	94.3	33%	0.329	49%	0.486	S	S	.	.	H	α-helix	trans	-81	-42.5	-178	-113.2	-83.6	0	0	0	112.6	S361 E362 L367 I368 M701	S361-Y364 PolarHBondContact O-N 3.46Å; E362-Y364 VanDerWaalsContact C-N 3.31Å; E362-Y364 PolarHBondContact O-N 2.79Å; Y364-L367 PolarHBondContact O-N 3.36Å; Y364-I368 WeakPolarHBondContact O-CG1 3.46Å; Y364-I368 PolarHBondContact O-N 2.96Å; Y364-M701 HydrophobicContact CD1-CE 4.33Å; Y364-M701 HydrophobicContact CD2-CE 4.14Å; Y364-M701 HydrophobicContact CE1-CE 3.93Å; Y364-M701 HydrophobicContact CE1-CG 4.16Å; Y364-M701 HydrophobicContact CE1-SD 4.46Å; Y364-M701 HydrophobicContact CE2-CE 3.72Å; Y364-M701 HydrophobicContact CG-CE 4.42Å; Y364-M701 WeakPolarHBondContact OH-CG 3.47Å
365	F	33.9	Very low	36.4	Very low	117 Å²	117	92.7 Å²	92.7	51%	0.513	48%	0.475	S	S	.	.	H	α-helix	trans	-68.4	-38.4	174.1	-107.5	-83.6	0	0	0	111.7	S361 I368 I369	S361-F365 PolarHBondContact O-N 3.41Å; F365-I368 PolarHBondContact O-N 2.82Å; F365-I369 HydrophobicContact CD1-CD1 4.41Å; F365-I369 WeakPolarHBondContact O-CB 3.36Å; F365-I369 WeakPolarHBondContact O-CD1 3.05Å; F365-I369 VanDerWaalsContact O-CG1 3.27Å; F365-I369 WeakPolarHBondContact O-CG1 3.26Å; F365-I369 PolarHBondContact O-N 2.99Å
366	G	38.1	Very low	36.6	Very low	38 Å²	38	87.5 Å²	87.5	39%	0.392	45%	0.449	S	S	.	.	H	α-helix	trans	-58.9	-44.7	172	0	0	0	0	0	112.5	E362 I369 K370	E362-G366 PolarHBondContact O-N 2.84Å; G366-I369 PolarHBondContact O-N 2.7Å; G366-K370 WeakPolarHBondContact O-CB 3.31Å; G366-K370 PolarHBondContact O-N 2.85Å
367	L	42.7	Very low	36.6	Very low	94 Å²	94	88 Å²	88	49%	0.492	46%	0.456	S	S	.	.	H	α-helix	trans	-64.1	-40	174.7	-80.1	169.2	0	0	0	113.1	T363 Y364 K370 Q371	T363-L367 WeakPolarHBondContact O-CB 3.18Å; T363-L367 WeakPolarHBondContact O-CD1 3.14Å; T363-L367 WeakPolarHBondContact O-CG 3.28Å; T363-L367 PolarHBondContact O-N 2.88Å; T363-L367 VanDerWaalsContact O-N 3.1Å; Y364-L367 PolarHBondContact O-N 3.36Å; L367-K370 PolarHBondContact O-N 2.69Å; L367-Q371 WeakPolarHBondContact O-CB 3.19Å; L367-Q371 WeakPolarHBondContact O-CG 3.24Å; L367-Q371 PolarHBondContact O-N 3.31Å
368	I	38.8	Very low	36.9	Very low	58 Å²	58	90.4 Å²	90.4	30%	0.297	47%	0.471	S	S	.	.	H	α-helix	trans	-67.4	-44.8	177.2	-69	165.6	0	0	0	110.8	Y364 F365 K370 Q371 C372	Y364-I368 WeakPolarHBondContact O-CG1 3.46Å; Y364-I368 PolarHBondContact O-N 2.96Å; F365-I368 PolarHBondContact O-N 2.82Å; I368-K370 VanDerWaalsContact C-N 3.32Å; I368-K370 PolarHBondContact O-N 3.35Å; I368-Q371 PolarHBondContact O-N 3.5Å; I368-C372 WeakPolarHBondContact O-CB 3.33Å; I368-C372 PolarHBondContact O-N 2.82Å; I368-C372 PolarHBondContact O-SG 3.41Å; I368-C372 VanDerWaalsContact O-SG 3.41Å
369	I	42.2	Very low	37	Very low	70 Å²	70	82.8 Å²	82.8	36%	0.359	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-41.5	176.2	-68.4	163	0	0	0	110.3	F365 G366 C372 A373	F365-I369 HydrophobicContact CD1-CD1 4.41Å; F365-I369 WeakPolarHBondContact O-CB 3.36Å; F365-I369 WeakPolarHBondContact O-CD1 3.05Å; F365-I369 VanDerWaalsContact O-CG1 3.27Å; F365-I369 WeakPolarHBondContact O-CG1 3.26Å; F365-I369 PolarHBondContact O-N 2.99Å; G366-I369 PolarHBondContact O-N 2.7Å; I369-C372 PolarHBondContact O-N 2.72Å; I369-A373 WeakPolarHBondContact O-CB 3.22Å; I369-A373 PolarHBondContact O-N 2.74Å
370	K	46.4	Very low	37	Very low	106 Å²	106	83.3 Å²	83.3	46%	0.461	45%	0.454	S	S	.	.	H	α-helix	trans	-62.7	-45.4	175.2	-179.9	166.8	176	168.9	0	111.9	G366 L367 I368 C372 A373 E374	G366-K370 WeakPolarHBondContact O-CB 3.31Å; G366-K370 PolarHBondContact O-N 2.85Å; L367-K370 PolarHBondContact O-N 2.69Å; I368-K370 VanDerWaalsContact C-N 3.32Å; I368-K370 PolarHBondContact O-N 3.35Å; K370-C372 PolarHBondContact O-N 3.31Å; K370-A373 PolarHBondContact O-N 2.82Å; K370-E374 WeakPolarHBondContact CE-OE1 3.34Å; K370-E374 HydrophobicContact CG-CG 4.38Å; K370-E374 WeakPolarHBondContact CG-OE1 3.49Å; K370-E374 WeakPolarHBondContact O-CB 3.25Å; K370-E374 VanDerWaalsContact O-CG 3.29Å; K370-E374 WeakPolarHBondContact O-CG 3.48Å; K370-E374 PolarHBondContact O-N 2.87Å
371	Q	43.1	Very low	36.9	Very low	86 Å²	86	78.2 Å²	78.2	40%	0.402	43%	0.431	S	S	.	.	H	α-helix	trans	-64.3	-38.7	175.1	-75.6	178.7	-4.7	0	0	112.4	L367 I368 A373 E374 I375	L367-Q371 WeakPolarHBondContact O-CB 3.19Å; L367-Q371 WeakPolarHBondContact O-CG 3.24Å; L367-Q371 PolarHBondContact O-N 3.31Å; I368-Q371 PolarHBondContact O-N 3.5Å; Q371-A373 VanDerWaalsContact C-N 3.34Å; Q371-E374 PolarHBondContact O-N 3.17Å; Q371-I375 WeakPolarHBondContact O-CB 3.38Å; Q371-I375 WeakPolarHBondContact O-CD1 3.31Å; Q371-I375 WeakPolarHBondContact O-CG1 3.19Å; Q371-I375 PolarHBondContact O-N 2.81Å
372	C	38.3	Very low	36.8	Very low	32 Å²	32	83.9 Å²	83.9	22%	0.216	45%	0.452	C	S	.	.	H	α-helix	trans	-66	-34.7	173	-73.7	0	0	0	0	112.4	I368 I369 K370 S376 F383	I368-C372 WeakPolarHBondContact O-CB 3.33Å; I368-C372 PolarHBondContact O-N 2.82Å; I368-C372 PolarHBondContact O-SG 3.41Å; I368-C372 VanDerWaalsContact O-SG 3.41Å; I369-C372 PolarHBondContact O-N 2.72Å; K370-C372 PolarHBondContact O-N 3.31Å; C372-S376 WeakPolarHBondContact O-CB 3.41Å; C372-S376 PolarHBondContact O-N 2.92Å; C372-S376 PolarHBondContact O-OG 2.84Å; C372-F383 HydrophobicContact CB-CD2 4.39Å
373	A	42.7	Very low	36.8	Very low	48 Å²	48	81.8 Å²	81.8	40%	0.397	44%	0.441	S	S	.	.	H	α-helix	trans	-71.8	-43.1	174.2	0	0	0	0	0	112.2	I369 K370 Q371 I375 S376 V377	I369-A373 WeakPolarHBondContact O-CB 3.22Å; I369-A373 PolarHBondContact O-N 2.74Å; K370-A373 PolarHBondContact O-N 2.82Å; Q371-A373 VanDerWaalsContact C-N 3.34Å; A373-I375 VanDerWaalsContact C-N 3.33Å; A373-I375 PolarHBondContact O-N 2.76Å; A373-S376 WeakPolarHBondContact O-CB 3.25Å; A373-S376 PolarHBondContact O-N 3.43Å; A373-S376 VanDerWaalsContact O-N 3.1Å; A373-V377 WeakPolarHBondContact O-CG2 3.31Å; A373-V377 PolarHBondContact O-N 3.41Å
374	E	41.9	Very low	36.2	Very low	89 Å²	89	86.3 Å²	86.3	42%	0.416	46%	0.455	S	S	.	.	H	α-helix	trans	-58.7	-44.2	172.3	-73.4	165.8	176.5	0	0	110.7	K370 Q371 V377 L378	K370-E374 WeakPolarHBondContact CE-OE1 3.34Å; K370-E374 HydrophobicContact CG-CG 4.38Å; K370-E374 WeakPolarHBondContact CG-OE1 3.49Å; K370-E374 WeakPolarHBondContact O-CB 3.25Å; K370-E374 VanDerWaalsContact O-CG 3.29Å; K370-E374 WeakPolarHBondContact O-CG 3.48Å; K370-E374 PolarHBondContact O-N 2.87Å; Q371-E374 PolarHBondContact O-N 3.17Å; E374-V377 PolarHBondContact O-N 3.31Å; E374-L378 VanDerWaalsContact O-CB 3.29Å; E374-L378 WeakPolarHBondContact O-CB 3.41Å; E374-L378 WeakPolarHBondContact O-CD1 3.47Å; E374-L378 WeakPolarHBondContact O-CG 3.19Å; E374-L378 PolarHBondContact O-N 3.35Å
375	I	37.7	Very low	35.9	Very low	37 Å²	37	90.2 Å²	90.2	19%	0.19	47%	0.473	C	S	.	.	H	α-helix	trans	-63.1	-43.5	171.7	-69.9	165.3	0	0	0	111	L315 Q371 A373 V377 L378 T379 F383	L315-I375 HydrophobicContact CD2-CD1 4.46Å; L315-I375 HydrophobicContact CD2-CG2 4.33Å; Q371-I375 WeakPolarHBondContact O-CB 3.38Å; Q371-I375 WeakPolarHBondContact O-CD1 3.31Å; Q371-I375 WeakPolarHBondContact O-CG1 3.19Å; Q371-I375 PolarHBondContact O-N 2.81Å; A373-I375 VanDerWaalsContact C-N 3.33Å; A373-I375 PolarHBondContact O-N 2.76Å; I375-V377 VanDerWaalsContact C-N 3.31Å; I375-V377 PolarHBondContact O-N 2.81Å; I375-L378 PolarHBondContact O-N 3.24Å; I375-T379 HydrophobicContact CG2-CG2 4.2Å; I375-T379 WeakPolarHBondContact O-CB 3.48Å; I375-T379 WeakPolarHBondContact O-CG2 3.24Å; I375-T379 PolarHBondContact O-N 3.05Å; I375-T379 PolarHBondContact O-OG1 2.89Å; I375-F383 HydrophobicContact CG2-CE2 4.28Å
376	S	37.9	Very low	35.6	Very low	19 Å²	19	88.2 Å²	88.2	13%	0.133	48%	0.478	C	S	.	.	H	α-helix	trans	-58.6	-43.4	177.6	-56.8	0	0	0	0	111.5	C372 A373 G380 M381	C372-S376 WeakPolarHBondContact O-CB 3.41Å; C372-S376 PolarHBondContact O-N 2.92Å; C372-S376 PolarHBondContact O-OG 2.84Å; A373-S376 WeakPolarHBondContact O-CB 3.25Å; A373-S376 PolarHBondContact O-N 3.43Å; A373-S376 VanDerWaalsContact O-N 3.1Å; S376-G380 VanDerWaalsContact O-CA 3.28Å; S376-G380 WeakPolarHBondContact O-CA 3.45Å; S376-G380 PolarHBondContact O-N 3.43Å; S376-M381 WeakPolarHBondContact CA-O 3.33Å; S376-M381 WeakPolarHBondContact CB-O 3.46Å; S376-M381 PolarHBondContact OG-O 3.39Å; S376-M381 VanDerWaalsContact OG-O 3.08Å
377	V	36.7	Very low	35	Very low	119 Å²	119	88.1 Å²	88.1	72%	0.721	47%	0.471	S	S	*	.	H	α-helix	trans	-69.4	-38.7	177.7	170.9	0	0	0	0	111.8	A373 E374 I375 T379	A373-V377 WeakPolarHBondContact O-CG2 3.31Å; A373-V377 PolarHBondContact O-N 3.41Å; E374-V377 PolarHBondContact O-N 3.31Å; I375-V377 VanDerWaalsContact C-N 3.31Å; I375-V377 PolarHBondContact O-N 2.81Å; V377-T379 VanDerWaalsContact C-N 3.34Å; V377-T379 PolarHBondContact O-N 3.04Å
378	L	33.8	Very low	34.2	Very low	135 Å²	135	84 Å²	84	71%	0.707	45%	0.449	S	S	*	.	H	α-helix	trans	-78.3	-11.6	179.6	-71.8	168.4	0	0	0	114.5	E374 I375	E374-L378 VanDerWaalsContact O-CB 3.29Å; E374-L378 WeakPolarHBondContact O-CB 3.41Å; E374-L378 WeakPolarHBondContact O-CD1 3.47Å; E374-L378 WeakPolarHBondContact O-CG 3.19Å; E374-L378 PolarHBondContact O-N 3.35Å; I375-L378 PolarHBondContact O-N 3.24Å
379	T	31	Very low	33.5	Very low	40 Å²	40	83.3 Å²	83.3	25%	0.245	44%	0.444	C	S	.	.	H	α-helix	trans	-133.8	-9.9	-172.6	65.7	0	0	0	0	115.2	L311 I375 V377 M381	L311-T379 HydrophobicContact CD1-CG2 3.84Å; L311-T379 HydrophobicContact CD2-CG2 3.72Å; L311-T379 HydrophobicContact CG-CG2 4.4Å; I375-T379 HydrophobicContact CG2-CG2 4.2Å; I375-T379 WeakPolarHBondContact O-CB 3.48Å; I375-T379 WeakPolarHBondContact O-CG2 3.24Å; I375-T379 PolarHBondContact O-N 3.05Å; I375-T379 PolarHBondContact O-OG1 2.89Å; V377-T379 VanDerWaalsContact C-N 3.34Å; V377-T379 PolarHBondContact O-N 3.04Å; T379-M381 PolarHBondContact O-N 3.48Å; T379-M381 WeakPolarHBondContact OG1-CB 3.39Å; T379-M381 WeakPolarHBondContact OG1-CG 3.49Å; T379-M381 PolarHBondContact OG1-N 2.81Å
380	G	29.8	Very low	32.7	Very low	53 Å²	53	88.2 Å²	88.2	55%	0.546	46%	0.458	S	S	.	.			trans	71.4	-0.2	-169.1	0	0	0	0	0	114.7	S376 H382	S376-G380 VanDerWaalsContact O-CA 3.28Å; S376-G380 WeakPolarHBondContact O-CA 3.45Å; S376-G380 PolarHBondContact O-N 3.43Å; G380-H382 PolarHBondContact O-CD2 2.78Å; G380-H382 PolarHBondContact O-N 3.42Å; G380-H382 VanDerWaalsContact O-N 3.16Å
381	M	27.1	Very low	31.7	Very low	100 Å²	100	87.9 Å²	87.9	49%	0.493	47%	0.465	S	S	.	.			trans	-82.9	91.1	-176.8	-63.2	-174.4	66.6	0	0	112	S376 T379 F383	S376-M381 WeakPolarHBondContact CA-O 3.33Å; S376-M381 WeakPolarHBondContact CB-O 3.46Å; S376-M381 PolarHBondContact OG-O 3.39Å; S376-M381 VanDerWaalsContact OG-O 3.08Å; T379-M381 PolarHBondContact O-N 3.48Å; T379-M381 WeakPolarHBondContact OG1-CB 3.39Å; T379-M381 WeakPolarHBondContact OG1-CG 3.49Å; T379-M381 PolarHBondContact OG1-N 2.81Å; M381-F383 WeakPolarHBondContact O-CD2 3.33Å; M381-F383 PolarHBondContact O-N 2.85Å
382	H	30.1	Very low	31	Very low	169 Å²	169	90.5 Å²	90.5	78%	0.782	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-68.5	126.4	175.3	-67.1	-82.8	0	0	0	112.8	G380	G380-H382 PolarHBondContact O-CD2 2.78Å; G380-H382 PolarHBondContact O-N 3.42Å; G380-H382 VanDerWaalsContact O-N 3.16Å
383	F	29.9	Very low	30.4	Very low	116 Å²	116	95.1 Å²	95.1	51%	0.509	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-99.4	122.5	169.4	-63.5	-86.9	0	0	0	110.8	C372 I375 M381	C372-F383 HydrophobicContact CB-CD2 4.39Å; I375-F383 HydrophobicContact CG2-CE2 4.28Å; M381-F383 WeakPolarHBondContact O-CD2 3.33Å; M381-F383 PolarHBondContact O-N 2.85Å
384	Q	26	Very low	29.9	Very low	202 Å²	202	97.7 Å²	97.7	94%	0.944	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-71.7	150.9	172.5	-74.9	-178.9	-38.1	0	0	111.7
385	K	26.2	Very low	29.2	Very low	167 Å²	167	98 Å²	98	73%	0.726	53%	0.534	S	S	*	.			trans	-134	127.4	-171.2	-177.5	-170.9	176.5	-168.5	0	111.9
386	A	26.8	Very low	28.8	Very low	74 Å²	74	103.3 Å²	103.3	61%	0.612	56%	0.563	S	S	*	*			trans	-156.2	157.8	169	0	0	0	0	0	110.1
387	P	26.5	Very low	28.3	Very low	37 Å²	37	109.5 Å²	109.5	24%	0.24	60%	0.599	C	S	.	*			trans	-128.1	-162.3	-148.6	28.3	-4.1	0	0	0	116.5	W349 V354	W349-P387 HydrophobicContact CB-CG 4.27Å; W349-P387 VanDerWaalsContact CD1-CD 3.43Å; W349-P387 VanDerWaalsContact CG-CD 3.44Å; W349-P387 HydrophobicContact CG-CG 4.49Å; W349-P387 VanDerWaalsContact CZ2-O 3.24Å; W349-P387 WeakPolarHBondContact CZ2-O 3.48Å; V354-P387 HydrophobicContact CG2-CB 4.48Å; V354-P387 HydrophobicContact CG2-CG 3.55Å
388	T	25.9	Very low	27.9	Very low	6 Å²	6	106.8 Å²	106.8	4%	0.037	60%	0.595	C	S	.	*			trans	71.2	160	161.4	126.4	0	0	0	0	119.6	W349 D353 F357	W349-T388 HydrophobicContact CD2-CG2 3.88Å; W349-T388 HydrophobicContact CE3-CG2 3.48Å; W349-T388 VanDerWaalsContact CE3-CG2 3.48Å; W349-T388 HydrophobicContact CG-CG2 4.41Å; W349-T388 HydrophobicContact CH2-CG2 4.47Å; W349-T388 WeakPolarHBondContact CH2-OG1 2.95Å; W349-T388 HydrophobicContact CZ3-CG2 3.83Å; W349-T388 WeakPolarHBondContact CZ3-OG1 3.33Å; D353-T388 HydrophobicContact CB-CG2 4.08Å; D353-T388 WeakPolarHBondContact O-CG2 3.49Å; F357-T388 VanDerWaalsContact CE2-N 3.29Å
389	F	23.5	Very low	27.6	Very low	44 Å²	44	109.1 Å²	109.1	19%	0.193	60%	0.603	C	S	.	*			cis	-160.7	170.1	-2.5	-108.5	159.7	0	0	0	111.4	D353 D356 F357	D353-F389 WeakPolarHBondContact O-CE2 3.38Å; D353-F389 WeakPolarHBondContact O-CZ 3.31Å; D356-F389 HydrophobicContact CB-CE2 3.96Å; D356-F389 HydrophobicContact CB-CZ 3.81Å; F357-F389 HydrophobicContact CB-CD2 4.47Å; F357-F389 HydrophobicContact CB-CE2 4.18Å
390	W	25.4	Very low	27.5	Very low	173 Å²	173	117.5 Å²	117.5	66%	0.655	63%	0.63	S	S	*	*			trans	62.4	165	148.9	-62.8	159.4	0	0	0	121.1	D356	D356-W390 HydrophobicContact CB-CH2 4.38Å
391	T	25.6	Very low	27.5	Very low	99 Å²	99	123.5 Å²	123.5	61%	0.607	64%	0.641	S	S	*	*			cis	-165.8	156	-23.3	32.4	0	0	0	0	110.8
392	N	27.9	Very low	27.5	Very low	141 Å²	141	124.8 Å²	124.8	75%	0.754	65%	0.649	S	S	*	*			trans	66.5	139.5	163.3	-57.1	-31.8	0	0	0	117.7
393	V	27.2	Very low	27.4	Very low	129 Å²	129	122.2 Å²	122.2	78%	0.782	65%	0.645	S	S	*	*			cis	81.8	138	29.7	179.8	0	0	0	0	112.5
394	P	30.2	Very low	27.3	Very low	103 Å²	103	121.3 Å²	121.3	67%	0.669	65%	0.65	S	S	*	*			cis	-138.6	-174.7	-0.9	35.3	-13.4	0	0	0	118
395	S	28.8	Very low	27.3	Very low	95 Å²	95	120.7 Å²	120.7	66%	0.664	64%	0.644	S	S	*	*			trans	71.1	159.2	136.4	70.6	0	0	0	0	121.8
396	N	28.8	Very low	27.4	Very low	149 Å²	149	119.4 Å²	119.4	80%	0.797	64%	0.644	S	S	*	*			cis	-167.1	-175.7	-16.5	-105.9	-11.3	0	0	0	111.1
397	V	27.9	Very low	27.6	Very low	148 Å²	148	122.6 Å²	122.6	90%	0.897	65%	0.65	S	S	*	*			trans	81.8	134.6	158.7	-163.5	0	0	0	0	116.5
398	G	27.7	Very low	27.5	Very low	62 Å²	62	132 Å²	132	64%	0.639	68%	0.681	S	S	*	*			cis	169.1	153	-10.6	0	0	0	0	0	116.5
399	E	28.2	Very low	27.8	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.864	71%	0.714	S	S	*	*			trans	31.9	129.1	144	-54.8	-172.1	139.3	0	0	123.9
400	R	27.7	Very low	28	Very low	216 Å²	216	141.1 Å²	141.1	82%	0.815	75%	0.745	S	S	*	*			trans	170	146.6	130.6	-87.7	151	-166.8	-153.4	2.9	107.4
401	F	29.9	Very low	28.1	Very low	178 Å²	178	137.7 Å²	137.7	78%	0.781	75%	0.748	S	S	*	*			cis	-130.7	144.4	24.4	-78.9	-98.9	0	0	0	109.8
402	L	27.9	Very low	28.3	Very low	128 Å²	128	141.1 Å²	141.1	67%	0.67	76%	0.757	S	S	*	*				64.6	143.5	71.7	-68.2	156.4	0	0	0	112.9
403	T	28	Very low	28.3	Very low	114 Å²	114	139.8 Å²	139.8	70%	0.699	75%	0.754	S	S	*	*			cis	-167.6	160.7	20.9	-3.1	0	0	0	0	107.8
404	T	26.7	Very low	28.2	Very low	97 Å²	97	144.6 Å²	144.6	60%	0.595	76%	0.758	S	S	*	*			cis	-168.9	175.8	-4.9	-5.5	0	0	0	0	110.6
405	F	26.4	Very low	28	Very low	189 Å²	189	144.9 Å²	144.9	83%	0.829	76%	0.762	S	S	*	*			trans	77.9	147.5	158.1	-58.5	-55.1	0	0	0	118.9
406	I	29.6	Very low	27.8	Very low	140 Å²	140	146.3 Å²	146.3	72%	0.718	77%	0.771	S	S	*	*			cis	-131.6	144.4	19.1	-70.4	174.2	0	0	0	113.1
407	N	30	Very low	27.7	Very low	141 Å²	141	144.6 Å²	144.6	75%	0.754	77%	0.771	S	S	*	*			trans	53	142	165.4	-62.8	-14.3	0	0	0	121.1
408	R	25.2	Very low	27.6	Very low	234 Å²	234	144 Å²	144	88%	0.883	77%	0.767	S	S	*	*			cis	118.3	91.3	1.6	-86	-166	160.2	-172.8	-3.5	116.4
409	S	31	Very low	27.5	Very low	105 Å²	105	149.1 Å²	149.1	73%	0.734	78%	0.775	S	S	*	*			trans	-176.8	117	135.2	39	0	0	0	0	108
410	T	27.1	Very low	27.4	Very low	138 Å²	138	147.2 Å²	147.2	85%	0.847	77%	0.77	S	S	*	*				52	123.7	81.4	61.8	0	0	0	0	113.4
411	S	29.3	Very low	27.3	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	76%	0.761	S	S	*	*			cis	-149.9	164.5	26.7	55.1	0	0	0	0	115.1
412	E	28.4	Very low	27	Very low	171 Å²	171	140.7 Å²	140.7	80%	0.799	76%	0.762	S	S	*	*			trans	28.6	141.2	132.9	-57.1	176.1	157.9	0	0	121.2
413	T	27.7	Very low	26.8	Very low	114 Å²	114	143.5 Å²	143.5	70%	0.699	77%	0.769	S	S	*	*			cis	-166.4	149.8	-4.1	16	0	0	0	0	112.2
414	R	26.5	Very low	26.7	Very low	230 Å²	230	142.7 Å²	142.7	87%	0.868	77%	0.768	S	S	*	*			trans	68	141.1	148.1	-72	178.1	171.5	175.3	-2.3	122.3
415	S	25.5	Very low	26.5	Very low	108 Å²	108	141.5 Å²	141.5	76%	0.755	77%	0.774	S	S	*	*			trans	65.9	96.2	148.9	50	0	0	0	0	121.9
416	C	23.9	Very low	26.4	Very low	125 Å²	125	143.7 Å²	143.7	85%	0.845	78%	0.778	S	S	*	*				52.6	82.3	120.4	-53.3	0	0	0	0	120.7
417	S	26.6	Very low	26.2	Very low	114 Å²	114	144.8 Å²	144.8	80%	0.797	78%	0.777	S	S	*	*				179.5	138.5	104	42.4	0	0	0	0	110.1
418	T	27.2	Very low	26.1	Very low	134 Å²	134	141.1 Å²	141.1	82%	0.822	77%	0.773	S	S	*	*			trans	-148.5	135	-161.8	55	0	0	0	0	112.1
419	H	25.4	Very low	26.4	Very low	171 Å²	171	138.4 Å²	138.4	79%	0.792	77%	0.768	S	S	*	*			cis	-161.5	150.6	-12.7	-147.7	-83.6	0	0	0	110.3
420	D	25.1	Very low	26.4	Very low	144 Å²	144	142.5 Å²	142.5	77%	0.77	77%	0.772	S	S	*	*			trans	-84	156.9	168.7	-83.9	-61.9	0	0	0	113
421	A	25.2	Very low	26.5	Very low	75 Å²	75	139.1 Å²	139.1	62%	0.62	77%	0.765	S	S	*	*			trans	57.4	123.3	139.2	0	0	0	0	0	123.1
422	F	23.9	Very low	26.6	Very low	183 Å²	183	142.6 Å²	142.6	80%	0.803	77%	0.767	S	S	*	*			trans	64.9	156.8	150.5	-74.1	-116.5	0	0	0	116.1
423	F	25.1	Very low	26.8	Very low	187 Å²	187	140.2 Å²	140.2	82%	0.82	76%	0.76	S	S	*	*			cis	-143.7	175.6	26.4	-80.8	-103	0	0	0	109.7
424	S	25	Very low	26.9	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	76%	0.76	S	S	*	*			cis	-179.3	151	-31.9	62.7	0	0	0	0	109.8
425	G	23.3	Very low	27.2	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	76%	0.756	S	S	*	*			trans	90.5	123.3	142.7	0	0	0	0	0	120.7
426	W	24.3	Very low	27.4	Very low	236 Å²	236	137.4 Å²	137.4	89%	0.894	76%	0.759	S	S	*	*			trans	68.4	117.5	142.8	-76.8	4.3	0	0	0	122.6
427	F	25.2	Very low	27.7	Very low	162 Å²	162	135.4 Å²	135.4	71%	0.711	76%	0.759	S	S	*	*			trans	36.9	132.1	140.4	-56.8	-78.1	0	0	0	120.4
428	G	26.8	Very low	27.8	Very low	65 Å²	65	136.8 Å²	136.8	67%	0.67	76%	0.763	S	S	*	*			cis	121.1	167.8	12.8	0	0	0	0	0	111.7
429	K	31.1	Very low	27.9	Very low	177 Å²	177	137.2 Å²	137.2	77%	0.77	77%	0.765	S	S	*	*			trans	69.2	139.3	-173.1	-66.5	162.2	-179.5	167.3	0	112.8
430	K	31.1	Very low	28.1	Very low	191 Å²	191	137.8 Å²	137.8	83%	0.83	77%	0.765	S	S	*	*			cis	-148.2	157.6	-3.9	-91	143.5	177.7	-176.5	0	106.4
431	G	29.3	Very low	28.6	Very low	67 Å²	67	139.3 Å²	139.3	69%	0.691	77%	0.768	S	S	*	*			cis	130.9	-180	5.5	0	0	0	0	0	111.1
432	K	31.4	Very low	28.8	Very low	172 Å²	172	142.4 Å²	142.4	75%	0.748	77%	0.769	S	S	*	*			trans	71.8	149.5	169.1	-72.1	-179.5	141.1	-72.7	0	117.1
433	D	33.2	Very low	29.4	Very low	122 Å²	122	140.9 Å²	140.9	65%	0.652	76%	0.762	S	S	*	*			cis	-137.8	159.7	1.6	-111	-34.8	0	0	0	113.1
434	T	29.1	Very low	29.7	Very low	114 Å²	114	141.8 Å²	141.8	70%	0.699	77%	0.766	S	S	*	*			trans	-98.6	158.6	-178.4	52.4	0	0	0	0	112.9
435	T	33.8	Very low	30	Very low	126 Å²	126	140.3 Å²	140.3	77%	0.773	77%	0.766	S	S	*	*			trans	-180	118.2	132.5	29.5	0	0	0	0	108.7
436	N	29.8	Very low	30.4	Very low	152 Å²	152	145.2 Å²	145.2	81%	0.813	77%	0.773	S	S	*	*				72.2	123.8	78.1	-68.4	-3.9	0	0	0	114.5
437	G	29.7	Very low	30.7	Very low	83 Å²	83	139.9 Å²	139.9	86%	0.856	76%	0.763	S	S	*	*			trans	161	62.3	169.8	0	0	0	0	0	117.5
438	T	28.8	Very low	31	Very low	143 Å²	143	138.8 Å²	138.8	88%	0.877	76%	0.764	S	S	*	*			trans	-75.6	130	175.3	44.2	0	0	0	0	114
439	V	30.2	Very low	31	Very low	144 Å²	144	145.8 Å²	145.8	87%	0.873	77%	0.77	S	S	*	*			trans	-139.5	149.9	149.8	-176.5	0	0	0	0	109.3
440	K	29.8	Very low	30.8	Very low	182 Å²	182	142.6 Å²	142.6	79%	0.791	77%	0.77	S	S	*	*			trans	-86.4	164.7	-173.2	-53.3	168.2	-177.1	175.6	0	112.2
441	H	34.8	Very low	30.6	Very low	177 Å²	177	141 Å²	141	82%	0.819	77%	0.77	S	S	*	*				-171.6	174.5	117.5	-99.2	-67.7	0	0	0	112.5
442	E	30.2	Very low	30.3	Very low	140 Å²	140	143.3 Å²	143.3	65%	0.654	77%	0.771	S	S	*	*			trans	-74.1	178.2	-173	-45.5	161.5	102.4	0	0	112.4
443	K	34.4	Very low	30.6	Very low	151 Å²	151	139.8 Å²	139.8	66%	0.657	77%	0.765	S	S	*	*			cis	-175.9	141.8	37	-140.2	148.3	-166.6	149.5	0	112.4
444	K	33.4	Very low	30.1	Very low	206 Å²	206	139.9 Å²	139.9	90%	0.896	77%	0.77	S	S	*	*			trans	60.7	147.8	164.5	-62.1	175	176.3	-175	0	118.2
445	G	30	Very low	29.7	Very low	66 Å²	66	141.1 Å²	141.1	68%	0.68	77%	0.771	S	S	*	*			cis	146	154.4	-10.4	0	0	0	0	0	114
446	I	31.7	Very low	29.2	Very low	173 Å²	173	140.5 Å²	140.5	89%	0.887	77%	0.767	S	S	*	*			trans	74.4	143.6	171.8	-54.2	171.2	0	0	0	115
447	D	30	Very low	28.9	Very low	125 Å²	125	136.4 Å²	136.4	67%	0.668	76%	0.761	S	S	*	*			cis	-168	-172.7	-41.9	-137.2	-50.4	0	0	0	108.5
448	D	31.7	Very low	28.6	Very low	139 Å²	139	141.7 Å²	141.7	74%	0.743	76%	0.76	S	S	*	*			trans	66.1	124.7	173.5	-67.6	-39.9	0	0	0	117.2
449	R	27.5	Very low	28.3	Very low	211 Å²	211	138.8 Å²	138.8	80%	0.796	75%	0.746	S	S	*	*			cis	97.8	127.8	24.2	-71.7	-177.1	164	-155.4	-1.7	115.4
450	S	26.4	Very low	28.1	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	74%	0.741	S	S	*	*			trans	74.1	154.9	149.8	83.5	0	0	0	0	117.1
451	L	27.8	Very low	27.8	Very low	157 Å²	157	136.6 Å²	136.6	82%	0.822	73%	0.732	S	S	*	*			cis	-152.9	177.2	-18.7	-119.8	170.3	0	0	0	109.8
452	V	22.8	Very low	27.2	Very low	117 Å²	117	133.4 Å²	133.4	71%	0.709	73%	0.725	S	S	*	*			trans	-84.7	173.3	179.7	-108	0	0	0	0	111.8
453	P	37.8	Very low	27	Very low	97 Å²	97	136 Å²	136	63%	0.63	73%	0.729	S	S	*	*			trans	-117	-131.8	-131	44.5	-32.6	0	0	0	113.9
454	V	22.2	Very low	26.4	Very low	125 Å²	125	132.8 Å²	132.8	76%	0.758	72%	0.722	S	S	*	*			trans	86.6	156	166.2	-155.3	0	0	0	0	116.7
455	I	22.1	Very low	26.1	Very low	139 Å²	139	130 Å²	130	71%	0.713	72%	0.717	S	S	*	*			trans	96.9	108.3	156.1	-42.8	178.7	0	0	0	117.1
456	T	22.5	Very low	25.8	Very low	114 Å²	114	132.7 Å²	132.7	70%	0.699	72%	0.716	S	S	*	*			trans	53.8	121.7	160.1	56.2	0	0	0	0	118.1
457	G	23.3	Very low	25.4	Very low	66 Å²	66	130.7 Å²	130.7	68%	0.68	71%	0.706	S	S	*	*			cis	76	167.4	19.5	0	0	0	0	0	112.5
458	K	23.1	Very low	25.2	Very low	194 Å²	194	131.7 Å²	131.7	84%	0.843	71%	0.711	S	S	*	*			trans	75	144.6	-157.1	-58.1	176	-178	171.8	0	111
459	S	23.5	Very low	24.8	Very low	82 Å²	82	128.9 Å²	128.9	57%	0.573	71%	0.707	S	S	*	*			cis	-169.2	140.7	-0.2	30.3	0	0	0	0	112.8
460	Q	24.4	Very low	24.7	Very low	166 Å²	166	125.4 Å²	125.4	78%	0.776	70%	0.704	S	S	*	*			trans	61.5	-175.1	138.1	-60.1	163.4	3.7	0	0	115.6
461	L	24.1	Very low	24.7	Very low	113 Å²	113	127 Å²	127	59%	0.592	70%	0.7	S	S	*	*			cis	-91.7	162.3	-35.5	-85.8	91.2	0	0	0	107
462	T	23.3	Very low	24.5	Very low	111 Å²	111	126.1 Å²	126.1	68%	0.681	69%	0.691	S	S	*	*				42.4	149.1	67.9	18.4	0	0	0	0	113.1
463	R	24.1	Very low	24.7	Very low	194 Å²	194	126.2 Å²	126.2	73%	0.732	69%	0.687	S	S	*	*			cis	-160.9	164	28.8	-134.7	155.1	-174.3	163.4	-0.3	109.3
464	T	22.7	Very low	24	Very low	84 Å²	84	129.9 Å²	129.9	52%	0.515	70%	0.696	S	S	.	*			trans	9.7	139.4	142.5	63.3	0	0	0	0	118
465	N	27.1	Very low	24.1	Very low	148 Å²	148	131.1 Å²	131.1	79%	0.791	71%	0.705	S	S	*	*			cis	-133.3	145.1	42.6	-48.9	-58.7	0	0	0	112.6
466	D	23.5	Very low	24.1	Very low	121 Å²	121	129.4 Å²	129.4	65%	0.647	71%	0.705	S	S	*	*			cis	67.3	138.2	46.8	-93.7	-42.3	0	0	0	115.5
467	I	24.4	Very low	24.3	Very low	132 Å²	132	131 Å²	131	68%	0.677	71%	0.714	S	S	*	*			trans	74.9	123.4	142.9	-70.8	168	0	0	0	119.1
468	N	24.8	Very low	24.3	Very low	145 Å²	145	133.5 Å²	133.5	78%	0.775	71%	0.712	S	S	*	*			trans	68.5	115.5	160.1	-62.2	-7.4	0	0	0	117.9
469	A	23.5	Very low	24.3	Very low	80 Å²	80	129.7 Å²	129.7	66%	0.661	70%	0.701	S	S	*	*			cis	87.4	120.7	49.8	0	0	0	0	0	113.1
470	N	26.1	Very low	24.3	Very low	138 Å²	138	134.1 Å²	134.1	74%	0.738	71%	0.71	S	S	*	*				-154.5	144.1	120	-84.9	-22.9	0	0	0	105.3
471	Q	25	Very low	24.3	Very low	145 Å²	145	132.3 Å²	132.3	68%	0.678	70%	0.704	S	S	*	*				56.8	125.3	62.6	-68.9	-166.1	-65.1	0	0	111.3
472	E	24.9	Very low	24.3	Very low	137 Å²	137	135.8 Å²	135.8	64%	0.64	72%	0.723	S	S	*	*			cis	-166.5	-175.1	-3.8	-138.7	156.8	-138.4	0	0	110
473	N	25.5	Very low	24.4	Very low	119 Å²	119	137.9 Å²	137.9	64%	0.636	73%	0.725	S	S	*	*			trans	66.7	96.8	159.5	-54.3	-26.9	0	0	0	116.3
474	E	23.4	Very low	24.4	Very low	174 Å²	174	134.7 Å²	134.7	81%	0.813	73%	0.727	S	S	*	*				76.5	115	77.6	-77	-170.6	161.6	0	0	114.1
475	T	24.3	Very low	24.5	Very low	152 Å²	152	137.3 Å²	137.3	93%	0.933	74%	0.742	S	S	*	*				-160.8	144.2	114.4	8.7	0	0	0	0	110.8
476	S	22.5	Very low	24.5	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	74%	0.742	S	S	*	*			trans	-104.4	114.6	-169.8	50.7	0	0	0	0	113.3
477	V	26.5	Very low	24.7	Very low	146 Å²	146	133.5 Å²	133.5	89%	0.885	74%	0.738	S	S	*	*			trans	-140.4	90.1	155.2	-171.7	0	0	0	0	106.8
478	N	23.7	Very low	25	Very low	120 Å²	120	130.1 Å²	130.1	64%	0.642	73%	0.727	S	S	*	*			cis	74.7	117	48.1	-157.5	9.6	0	0	0	113.5
479	N	23	Very low	25.1	Very low	114 Å²	114	128 Å²	128	61%	0.61	71%	0.714	S	S	*	*			trans	73.6	114.9	161.6	-80.1	-49.1	0	0	0	121.9
480	K	23.9	Very low	25.3	Very low	175 Å²	175	131.5 Å²	131.5	76%	0.761	72%	0.717	S	S	*	*				91.8	146.5	128.7	-69.4	171.8	-175.7	179.1	0	120.7
481	L	23.9	Very low	25.6	Very low	127 Å²	127	130.5 Å²	130.5	67%	0.665	71%	0.708	S	S	*	*			trans	68.2	83	157.7	-66.6	160.9	0	0	0	118.4	E483	L481-E483 HydrophobicContact CD2-CB 3.99Å; L481-E483 HydrophobicContact CD2-CG 4.34Å
482	L	23.4	Very low	25.8	Very low	187 Å²	187	127.9 Å²	127.9	98%	0.979	70%	0.698	S	S	*	*				-116.5	50.1	130	-91.5	174.8	0	0	0	110.6
483	E	25.2	Very low	26	Very low	154 Å²	154	123.8 Å²	123.8	72%	0.72	68%	0.682	S	S	*	*			trans	-75.6	119.3	152	-68.5	-174.7	122.8	0	0	107.8	L481	L481-E483 HydrophobicContact CD2-CB 3.99Å; L481-E483 HydrophobicContact CD2-CG 4.34Å
484	T	24.7	Very low	26.2	Very low	128 Å²	128	128.2 Å²	128.2	79%	0.785	69%	0.692	S	S	*	*			trans	27.3	121.5	150.3	58.4	0	0	0	0	120.1
485	V	26.2	Very low	26.6	Very low	138 Å²	138	123.6 Å²	123.6	84%	0.836	67%	0.672	S	S	*	*				178.5	143.6	122.4	143	0	0	0	0	109.1
486	P	26.2	Very low	26.8	Very low	119 Å²	119	123 Å²	123	77%	0.773	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-93.5	151.6	-160.9	35.4	-36.8	0	0	0	115.1
487	A	28.1	Very low	27.2	Very low	70 Å²	70	126 Å²	126	58%	0.579	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-76.1	161.6	165.4	0	0	0	0	0	112	Q491	A487-Q491 VanDerWaalsContact CB-OE1 3.27Å
488	S	29.2	Very low	27.3	Very low	62 Å²	62	121.7 Å²	121.7	43%	0.434	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-76.7	158.1	-158.8	68.5	0	0	0	0	115.6	E490 Q491	S488-E490 PolarHBondContact O-N 2.87Å; S488-E490 VanDerWaalsContact O-N 3.08Å; S488-Q491 WeakPolarHBondContact O-CB 3.44Å; S488-Q491 PolarHBondContact O-N 3.29Å
489	I	27.5	Very low	27.7	Very low	101 Å²	101	121.3 Å²	121.3	52%	0.518	65%	0.648	S	S	.	*	H	α-helix	trans	-54.5	-28.5	179.6	-72	170.1	0	0	0	113.2	L492 T493 L528	I489-L492 WeakPolarHBondContact O-CB 3.38Å; I489-L492 PolarHBondContact O-N 3.5Å; I489-T493 PolarHBondContact O-N 2.87Å; I489-L528 HydrophobicContact CB-CD2 4.36Å; I489-L528 HydrophobicContact CD1-CD2 3.85Å; I489-L528 HydrophobicContact CG1-CD2 4Å; I489-L528 HydrophobicContact CG2-CD2 3.46Å; I489-L528 VanDerWaalsContact CG2-CD2 3.46Å
490	E	28.2	Very low	28.1	Very low	153 Å²	153	124.2 Å²	124.2	72%	0.715	66%	0.657	S	S	*	*	H	α-helix	trans	-71.6	-34.8	-179.9	-65.7	178.4	132.8	0	0	112.1	S488 L492 T493	S488-E490 PolarHBondContact O-N 2.87Å; S488-E490 VanDerWaalsContact O-N 3.08Å; E490-L492 VanDerWaalsContact C-N 3.31Å; E490-L492 PolarHBondContact O-N 3.35Å; E490-T493 WeakPolarHBondContact O-CB 3.39Å; E490-T493 PolarHBondContact O-N 2.85Å; E490-T493 VanDerWaalsContact O-N 3.13Å; E490-T493 PolarHBondContact O-OG1 2.93Å
491	Q	32.5	Very low	28.6	Very low	116 Å²	116	122.2 Å²	122.2	54%	0.542	65%	0.649	S	S	.	*	H	α-helix	trans	-67.1	-32.8	173.1	-62.4	-173.9	-8.4	0	0	111.8	A487 S488 T493 Y494 I495	A487-Q491 VanDerWaalsContact CB-OE1 3.27Å; S488-Q491 WeakPolarHBondContact O-CB 3.44Å; S488-Q491 PolarHBondContact O-N 3.29Å; Q491-T493 PolarHBondContact O-N 2.8Å; Q491-Y494 WeakPolarHBondContact O-CB 3.5Å; Q491-Y494 PolarHBondContact O-N 2.92Å; Q491-I495 PolarHBondContact O-N 3.46Å
492	L	28.3	Very low	29.1	Very low	90 Å²	90	119.1 Å²	119.1	47%	0.471	64%	0.635	S	S	.	*	H	α-helix	trans	-64.2	-23.5	172.7	-75.7	165.5	0	0	0	113	I489 E490 Y494 I495	I489-L492 WeakPolarHBondContact O-CB 3.38Å; I489-L492 PolarHBondContact O-N 3.5Å; E490-L492 VanDerWaalsContact C-N 3.31Å; E490-L492 PolarHBondContact O-N 3.35Å; L492-Y494 VanDerWaalsContact C-N 3.3Å; L492-I495 HydrophobicContact CD2-CD1 4.18Å; L492-I495 PolarHBondContact O-N 3.09Å
493	T	29.4	Very low	29.5	Very low	51 Å²	51	117 Å²	117	31%	0.313	62%	0.624	S	S	.	*	H	α-helix	trans	-71.9	-22.2	170.1	-0.8	0	0	0	0	113.6	I489 E490 Q491 I495 L496 K530	I489-T493 PolarHBondContact O-N 2.87Å; E490-T493 WeakPolarHBondContact O-CB 3.39Å; E490-T493 PolarHBondContact O-N 2.85Å; E490-T493 VanDerWaalsContact O-N 3.13Å; E490-T493 PolarHBondContact O-OG1 2.93Å; Q491-T493 PolarHBondContact O-N 2.8Å; T493-I495 VanDerWaalsContact C-N 3.33Å; T493-L496 HydrophobicContact CG2-CD1 4.48Å; T493-K530 HydrophobicContact CG2-CD 4Å
494	Y	30.4	Very low	29.8	Very low	212 Å²	212	114.6 Å²	114.6	83%	0.831	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-84.4	-8.7	173.7	-110.7	-86.1	0	0	0	113	Q491 L492 L496	Q491-Y494 WeakPolarHBondContact O-CB 3.5Å; Q491-Y494 PolarHBondContact O-N 2.92Å; L492-Y494 VanDerWaalsContact C-N 3.3Å; Y494-L496 VanDerWaalsContact C-N 3.31Å
495	I	30.7	Very low	30	Very low	78 Å²	78	111.8 Å²	111.8	40%	0.4	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-92	7.8	-179.2	-70.4	166.7	0	0	0	111.5	Q491 L492 T493 D497 A498	Q491-I495 PolarHBondContact O-N 3.46Å; L492-I495 HydrophobicContact CD2-CD1 4.18Å; L492-I495 PolarHBondContact O-N 3.09Å; T493-I495 VanDerWaalsContact C-N 3.33Å; I495-D497 PolarHBondContact O-N 3.05Å; I495-A498 HydrophobicContact CG2-CB 4.25Å; I495-A498 PolarHBondContact O-N 2.84Å; I495-A498 VanDerWaalsContact O-N 3.14Å
496	L	29.5	Very low	30.1	Very low	138 Å²	138	108.9 Å²	108.9	72%	0.723	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-67.1	-16.5	175.1	-84.4	165.4	0	0	0	114.5	T493 Y494	T493-L496 HydrophobicContact CG2-CD1 4.48Å; Y494-L496 VanDerWaalsContact C-N 3.31Å
497	D	30.4	Very low	30.2	Very low	168 Å²	168	107.8 Å²	107.8	90%	0.898	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-106.5	8.4	172.6	-69.8	-53.2	0	0	0	113.3	I495	I495-D497 PolarHBondContact O-N 3.05Å
498	A	29	Very low	30.3	Very low	55 Å²	55	108.5 Å²	108.5	46%	0.455	58%	0.579	S	S	.	*	S	Bend	trans	-121.8	94.9	-166.9	0	0	0	0	0	115	I495	I495-A498 HydrophobicContact CG2-CB 4.25Å; I495-A498 PolarHBondContact O-N 2.84Å; I495-A498 VanDerWaalsContact O-N 3.14Å
499	D	32.9	Very low	30.4	Very low	112 Å²	112	110.4 Å²	110.4	60%	0.599	58%	0.582	S	S	*	*			trans	37.9	96.3	156.9	-136.5	-34.1	0	0	0	119.8	K501 T502	D499-K501 PolarHBondContact O-N 2.93Å; D499-T502 PolarHBondContact O-N 3.01Å; D499-T502 PolarHBondContact O-OG1 3.4Å
500	H	31.5	Very low	30.4	Very low	175 Å²	175	113.7 Å²	113.7	81%	0.81	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-14.2	-177.1	-72.1	-134.7	0	0	0	115.2
501	K	32.7	Very low	30.6	Very low	132 Å²	132	112.5 Å²	112.5	57%	0.574	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-28.9	-179.9	-77.4	177.3	176.3	173.4	0	113.8	D499 L503 C505	D499-K501 PolarHBondContact O-N 2.93Å; K501-L503 PolarHBondContact O-N 3.32Å; K501-C505 PolarHBondContact O-SG 2.9Å; K501-C505 VanDerWaalsContact O-SG 3.41Å
502	T	34.4	Very low	30.6	Very low	63 Å²	63	110.4 Å²	110.4	39%	0.387	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-73.5	-28.4	-159.4	-50.7	0	0	0	0	114.1	D499 L504	D499-T502 PolarHBondContact O-N 3.01Å; D499-T502 PolarHBondContact O-OG1 3.4Å; T502-L504 PolarHBondContact O-N 2.97Å
503	L	31.8	Very low	30.7	Very low	141 Å²	141	115.5 Å²	115.5	74%	0.738	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-80.6	-13.7	-168.8	-84.4	162.9	0	0	0	116	K501	K501-L503 PolarHBondContact O-N 3.32Å
504	L	31.9	Very low	30.7	Very low	105 Å²	105	122.6 Å²	122.6	55%	0.55	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-103.1	-5.7	-174.3	-79.5	167	0	0	0	114.8	T502 G506 Y542	T502-L504 PolarHBondContact O-N 2.97Å; L504-G506 VanDerWaalsContact C-N 3.3Å; L504-G506 PolarHBondContact O-N 2.6Å; L504-Y542 HydrophobicContact CD1-CE1 4.31Å
505	C	28.9	Very low	30.5	Very low	68 Å²	68	115.8 Å²	115.8	46%	0.459	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80	0.7	-167.3	-59.3	0	0	0	0	115.9	I313 K501	I313-C505 VanDerWaalsContact CG1-SG 3.59Å; K501-C505 PolarHBondContact O-SG 2.9Å; K501-C505 VanDerWaalsContact O-SG 3.41Å
506	G	28.9	Very low	30.2	Very low	78 Å²	78	121.7 Å²	121.7	80%	0.804	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-11.1	-176.6	0	0	0	0	0	116.6	L504	L504-G506 VanDerWaalsContact C-N 3.3Å; L504-G506 PolarHBondContact O-N 2.6Å
507	I	29	Very low	30	Very low	95 Å²	95	119.8 Å²	119.8	49%	0.487	62%	0.615	S	S	.	*			trans	-96.6	117.7	-165.6	-59.4	179.3	0	0	0	112.1	M509 L512	I507-M509 HydrophobicContact CG2-SD 4.13Å; I507-M509 PolarHBondContact O-N 2.76Å; I507-L512 HydrophobicContact CG2-CD1 3.55Å
508	N	28.4	Very low	29.8	Very low	86 Å²	86	120.8 Å²	120.8	46%	0.46	62%	0.615	S	S	.	*			trans	-76.1	84	174.8	-172.9	-0.9	0	0	0	112	R510 Q511	N508-R510 PolarHBondContact O-N 2.94Å; N508-R510 WeakPolarHBondContact OD1-CB 3.29Å; N508-R510 PolarHBondContact OD1-N 2.98Å; N508-Q511 PolarHBondContact ND2-OE1 3.14Å; N508-Q511 PolarHBondContact O-N 3.03Å
509	M	32.2	Very low	29.6	Very low	101 Å²	101	124.7 Å²	124.7	50%	0.498	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.7	-0.1	177.4	-64.4	-69.8	-85.6	0	0	115.2	I507 L512	I507-M509 HydrophobicContact CG2-SD 4.13Å; I507-M509 PolarHBondContact O-N 2.76Å; M509-L512 HydrophobicContact SD-CD1 3.84Å
510	R	28.3	Very low	29.5	Very low	171 Å²	171	123.7 Å²	123.7	65%	0.645	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-21.6	172.1	-139.5	176.4	-163.2	174.9	1.4	113.2	N508	N508-R510 PolarHBondContact O-N 2.94Å; N508-R510 WeakPolarHBondContact OD1-CB 3.29Å; N508-R510 PolarHBondContact OD1-N 2.98Å
511	Q	31.5	Very low	29.4	Very low	127 Å²	127	119.5 Å²	119.5	59%	0.593	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-40.8	175	-75.1	169.5	-58.4	0	0	111.6	N508 K513 K514 T515	N508-Q511 PolarHBondContact ND2-OE1 3.14Å; N508-Q511 PolarHBondContact O-N 3.03Å; Q511-K513 PolarHBondContact O-N 3.28Å; Q511-K514 PolarHBondContact O-N 2.93Å; Q511-T515 PolarHBondContact O-OG1 3.3Å
512	L	32	Very low	29.3	Very low	72 Å²	72	116.1 Å²	116.1	38%	0.377	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.5	-23.1	176.5	-88.7	158	0	0	0	115.1	I507 M509 F519	I507-L512 HydrophobicContact CG2-CD1 3.55Å; M509-L512 HydrophobicContact SD-CD1 3.84Å; L512-F519 HydrophobicContact CD2-CE2 4.38Å
513	K	30.7	Very low	29.2	Very low	198 Å²	198	122.9 Å²	122.9	86%	0.861	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-3	176.5	-98.5	-160.3	173.5	-164.1	0	115.4	Q511	Q511-K513 PolarHBondContact O-N 3.28Å
514	K	28.9	Very low	29.3	Very low	200 Å²	200	121.2 Å²	121.2	87%	0.87	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	-2.6	176.5	-82.3	-166	172.3	-172.3	0	114.5	Q511	Q511-K514 PolarHBondContact O-N 2.93Å
515	T	26.4	Very low	29.3	Very low	69 Å²	69	118.4 Å²	118.4	42%	0.423	59%	0.59	S	S	.	*			trans	-123.1	114.1	-177.4	53.7	0	0	0	0	110.2	Q511 I517	Q511-T515 PolarHBondContact O-OG1 3.3Å; T515-I517 PolarHBondContact O-N 3.4Å; T515-I517 WeakPolarHBondContact OG1-CD1 3.09Å
516	H	24.5	Very low	29.6	Very low	201 Å²	201	122.2 Å²	122.2	93%	0.931	61%	0.605	S	S	*	*			trans	-61.9	107	161.7	-80.6	-99.1	0	0	0	108.1
517	I	26.1	Very low	30.2	Very low	98 Å²	98	124.5 Å²	124.5	50%	0.503	59%	0.592	S	S	.	*			trans	-125.9	102.7	173.9	-61	177.8	0	0	0	107.1	T515 F519	T515-I517 PolarHBondContact O-N 3.4Å; T515-I517 WeakPolarHBondContact OG1-CD1 3.09Å; I517-F519 HydrophobicContact CG2-CD2 3.92Å; I517-F519 HydrophobicContact CG2-CE2 3.93Å; I517-F519 PolarHBondContact O-N 3.5Å; I517-F519 VanDerWaalsContact O-N 3.15Å
518	E	25	Very low	30.4	Very low	190 Å²	190	122.8 Å²	122.8	89%	0.888	58%	0.584	S	S	*	*			trans	-66	106.9	168.8	-61.1	-178.2	141.5	0	0	108.3	P520	E518-P520 VanDerWaalsContact O-CD 3.29Å; E518-P520 WeakPolarHBondContact O-CD 3.39Å
519	F	26.4	Very low	30.9	Very low	136 Å²	136	127.7 Å²	127.7	60%	0.596	60%	0.596	S	S	*	*			trans	-82.6	116.3	-179.4	-105.6	-81.8	0	0	0	110.8	L512 I517 L521	L512-F519 HydrophobicContact CD2-CE2 4.38Å; I517-F519 HydrophobicContact CG2-CD2 3.92Å; I517-F519 HydrophobicContact CG2-CE2 3.93Å; I517-F519 PolarHBondContact O-N 3.5Å; I517-F519 VanDerWaalsContact O-N 3.15Å; F519-L521 HydrophobicContact CB-CD1 4.46Å; F519-L521 HydrophobicContact CD1-CD1 3.67Å; F519-L521 HydrophobicContact CE1-CD1 4.38Å; F519-L521 HydrophobicContact CG-CD1 4.42Å; F519-L521 PolarHBondContact O-N 3.4Å
520	P	28.9	Very low	31.3	Very low	92 Å²	92	130.8 Å²	130.8	60%	0.597	61%	0.607	S	S	*	*			trans	-78.2	36.2	-178.6	34.4	-37.5	0	0	0	113.2	E518 S522 R523	E518-P520 VanDerWaalsContact O-CD 3.29Å; E518-P520 WeakPolarHBondContact O-CD 3.39Å; P520-S522 PolarHBondContact O-N 2.81Å; P520-R523 PolarHBondContact O-N 2.87Å
521	L	29.7	Very low	32	Very low	86 Å²	86	125.7 Å²	125.7	45%	0.45	59%	0.591	S	S	.	*	H	α-helix	trans	-59.1	-32.3	-172.9	-125.9	75.7	0	0	0	113	F519 R523 I525	F519-L521 HydrophobicContact CB-CD1 4.46Å; F519-L521 HydrophobicContact CD1-CD1 3.67Å; F519-L521 HydrophobicContact CE1-CD1 4.38Å; F519-L521 HydrophobicContact CG-CD1 4.42Å; F519-L521 PolarHBondContact O-N 3.4Å; L521-R523 VanDerWaalsContact C-N 3.27Å; L521-R523 PolarHBondContact O-N 3.1Å; L521-I525 HydrophobicContact CB-CD1 4.37Å; L521-I525 HydrophobicContact CD2-CD1 4.05Å; L521-I525 HydrophobicContact CG-CD1 4.03Å; L521-I525 WeakPolarHBondContact O-CD1 3.5Å; L521-I525 VanDerWaalsContact O-CG1 3.29Å; L521-I525 WeakPolarHBondContact O-CG1 3.49Å; L521-I525 PolarHBondContact O-N 2.96Å
522	S	31.3	Very low	32.7	Very low	62 Å²	62	122.6 Å²	122.6	43%	0.434	58%	0.584	S	S	.	*	H	α-helix	trans	-63	-28.6	-179.2	52.5	0	0	0	0	113.8	P520 L526	P520-S522 PolarHBondContact O-N 2.81Å; S522-L526 WeakPolarHBondContact O-CD1 3.28Å
523	R	33.4	Very low	33.4	Very low	204 Å²	204	122.2 Å²	122.2	77%	0.77	59%	0.591	S	S	*	*	H	α-helix	trans	-86.3	-28.4	-173.8	-141.4	176.3	-166.9	177.2	4.3	113.7	P520 L521	P520-R523 PolarHBondContact O-N 2.87Å; L521-R523 VanDerWaalsContact C-N 3.27Å; L521-R523 PolarHBondContact O-N 3.1Å
524	E	32.1	Very low	34.3	Very low	107 Å²	107	117 Å²	117	50%	0.5	58%	0.576	S	S	.	*	H	α-helix	trans	-83.3	-41.2	174.6	-70.4	-55.4	124	0	0	112.2	L526 K527	E524-L526 PolarHBondContact O-N 2.9Å; E524-K527 WeakPolarHBondContact O-CB 3.24Å; E524-K527 PolarHBondContact O-N 2.87Å; E524-K527 WeakPolarHBondContact OE1-CE 3.43Å; E524-K527 IonicContact OE1-NZ 3.15Å; E524-K527 PolarHBondContact OE1-NZ 3.34Å; E524-K527 WeakPolarHBondContact OE2-CD 3.1Å; E524-K527 WeakPolarHBondContact OE2-CE 3.29Å; E524-K527 IonicContact OE2-NZ 2.78Å; E524-K527 PolarHBondContact OE2-NZ 3.42Å
525	I	33.6	Very low	35.1	Very low	46 Å²	46	113.1 Å²	113.1	24%	0.236	56%	0.556	C	S	.	*	H	α-helix	trans	-62.7	-30.1	-178.1	-67.3	170.8	0	0	0	111.6	L521 K527 L528 I531 L536	L521-I525 HydrophobicContact CB-CD1 4.37Å; L521-I525 HydrophobicContact CD2-CD1 4.05Å; L521-I525 HydrophobicContact CG-CD1 4.03Å; L521-I525 WeakPolarHBondContact O-CD1 3.5Å; L521-I525 VanDerWaalsContact O-CG1 3.29Å; L521-I525 WeakPolarHBondContact O-CG1 3.49Å; L521-I525 PolarHBondContact O-N 2.96Å; I525-K527 PolarHBondContact O-N 2.86Å; I525-L528 PolarHBondContact O-N 3.32Å; I525-L528 VanDerWaalsContact O-N 3.12Å; I525-I531 HydrophobicContact CG2-CD1 4.17Å; I525-L536 HydrophobicContact CG2-CD1 3.52Å
526	L	34.9	Very low	36.2	Very low	148 Å²	148	112.8 Å²	112.8	78%	0.775	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-18.3	172.9	-83.3	169.3	0	0	0	114.7	S522 E524	S522-L526 WeakPolarHBondContact O-CD1 3.28Å; E524-L526 PolarHBondContact O-N 2.9Å
527	K	40	Very low	37.6	Very low	125 Å²	125	111.4 Å²	111.4	54%	0.543	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-25.9	173.1	-58.5	178.8	-172.9	165.9	0	112	E524 I525 R529	E524-K527 WeakPolarHBondContact O-CB 3.24Å; E524-K527 PolarHBondContact O-N 2.87Å; E524-K527 WeakPolarHBondContact OE1-CE 3.43Å; E524-K527 IonicContact OE1-NZ 3.15Å; E524-K527 PolarHBondContact OE1-NZ 3.34Å; E524-K527 WeakPolarHBondContact OE2-CD 3.1Å; E524-K527 WeakPolarHBondContact OE2-CE 3.29Å; E524-K527 IonicContact OE2-NZ 2.78Å; E524-K527 PolarHBondContact OE2-NZ 3.42Å; I525-K527 PolarHBondContact O-N 2.86Å; K527-R529 PolarHBondContact O-N 2.81Å
528	L	33.8	Very low	38.9	Very low	60 Å²	60	112.5 Å²	112.5	31%	0.314	54%	0.541	S	S	.	.			trans	-83.8	75.1	-174.9	-69.4	170.3	0	0	0	111.7	I489 I525 K530 I531	I489-L528 HydrophobicContact CB-CD2 4.36Å; I489-L528 HydrophobicContact CD1-CD2 3.85Å; I489-L528 HydrophobicContact CG1-CD2 4Å; I489-L528 HydrophobicContact CG2-CD2 3.46Å; I489-L528 VanDerWaalsContact CG2-CD2 3.46Å; I525-L528 PolarHBondContact O-N 3.32Å; I525-L528 VanDerWaalsContact O-N 3.12Å; L528-K530 PolarHBondContact O-N 3.05Å; L528-I531 HydrophobicContact CB-CD1 3.75Å; L528-I531 HydrophobicContact CB-CG1 4.05Å; L528-I531 HydrophobicContact CD1-CD1 3.74Å; L528-I531 HydrophobicContact CG-CD1 4.39Å; L528-I531 PolarHBondContact O-N 2.91Å; L528-I531 VanDerWaalsContact O-N 3.13Å
529	R	38.5	Very low	39.9	Very low	188 Å²	188	106.3 Å²	106.3	71%	0.709	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	2.1	176.2	-72.9	-174.9	171.8	-176.9	-5.3	116.4	K527 M563 G564	K527-R529 PolarHBondContact O-N 2.81Å; R529-M563 PolarHBondContact NH2-O 2.88Å; R529-G564 VanDerWaalsContact CZ-O 3.23Å; R529-G564 PolarHBondContact NH1-O 3.49Å; R529-G564 PolarHBondContact NH2-O 3.11Å
530	K	42.2	Very low	41.2	Very low	167 Å²	167	104.7 Å²	104.7	73%	0.726	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	-8.5	179.8	-64.3	-176.3	-179.6	177.9	0	114.3	T493 L528 S532	T493-K530 HydrophobicContact CG2-CD 4Å; L528-K530 PolarHBondContact O-N 3.05Å; K530-S532 PolarHBondContact O-N 3.27Å
531	I	41.2	Very low	42.3	Very low	63 Å²	63	106.5 Å²	106.5	32%	0.323	51%	0.51	S	S	.	.			trans	-76.9	123.3	178.9	-65.7	174.2	0	0	0	109.9	I525 L528 Y535 L536	I525-I531 HydrophobicContact CG2-CD1 4.17Å; L528-I531 HydrophobicContact CB-CD1 3.75Å; L528-I531 HydrophobicContact CB-CG1 4.05Å; L528-I531 HydrophobicContact CD1-CD1 3.74Å; L528-I531 HydrophobicContact CG-CD1 4.39Å; L528-I531 PolarHBondContact O-N 2.91Å; L528-I531 VanDerWaalsContact O-N 3.13Å; I531-Y535 HydrophobicContact CG2-CD1 3.85Å; I531-Y535 HydrophobicContact CG2-CG 4.49Å; I531-L536 HydrophobicContact CG2-CB 4.27Å; I531-L536 HydrophobicContact CG2-CD1 4.21Å
532	S	46.9	Very low	43	Very low	63 Å²	63	107.9 Å²	107.9	44%	0.441	51%	0.51	S	S	.	.			trans	-70.3	146.4	178.1	80.2	0	0	0	0	111.7	K530 V534 Y535 L536	K530-S532 PolarHBondContact O-N 3.27Å; S532-V534 PolarHBondContact O-N 2.75Å; S532-V534 PolarHBondContact OG-N 2.97Å; S532-Y535 PolarHBondContact O-N 3.28Å; S532-Y535 VanDerWaalsContact O-N 3.07Å; S532-Y535 WeakPolarHBondContact OG-CB 3.31Å; S532-Y535 PolarHBondContact OG-N 3.48Å; S532-L536 PolarHBondContact O-N 3.41Å
533	A	46.3	Very low	43.6	Very low	63 Å²	63	108 Å²	108	52%	0.521	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-1.9	173.5	0	0	0	0	0	113.7	R537	A533-R537 PolarHBondContact O-NE 3.11Å; A533-R537 PolarHBondContact O-NH2 3.34Å
534	V	49.6	Very low	44.1	Very low	90 Å²	90	102.6 Å²	102.6	55%	0.545	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-50.2	168.3	-179	0	0	0	0	109.6	S532 L536 R537 Q538	S532-V534 PolarHBondContact O-N 2.75Å; S532-V534 PolarHBondContact OG-N 2.97Å; V534-L536 PolarHBondContact O-N 3.46Å; V534-R537 CarbonylContact O-C 3.59Å; V534-R537 PolarHBondContact O-N 2.7Å; V534-R537 VanDerWaalsContact O-N 3.12Å; V534-Q538 WeakPolarHBondContact O-CG 3.27Å; V534-Q538 PolarHBondContact O-N 3.19Å
535	Y	46.3	Very low	44.8	Very low	117 Å²	117	101.9 Å²	101.9	46%	0.459	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-43.2	176.5	-172.6	-88.7	0	0	0	111.6	I531 S532 R537 Q538 L539	I531-Y535 HydrophobicContact CG2-CD1 3.85Å; I531-Y535 HydrophobicContact CG2-CG 4.49Å; S532-Y535 PolarHBondContact O-N 3.28Å; S532-Y535 VanDerWaalsContact O-N 3.07Å; S532-Y535 WeakPolarHBondContact OG-CB 3.31Å; S532-Y535 PolarHBondContact OG-N 3.48Å; Y535-R537 VanDerWaalsContact C-N 3.27Å; Y535-R537 PolarHBondContact O-N 3.41Å; Y535-Q538 PolarHBondContact O-N 2.88Å; Y535-Q538 VanDerWaalsContact O-N 3.14Å; Y535-L539 WeakPolarHBondContact O-CB 3.33Å; Y535-L539 PolarHBondContact O-N 2.87Å
536	L	49.5	Very low	45	Very low	63 Å²	63	105 Å²	105	33%	0.33	51%	0.505	S	S	.	.	H	α-helix	trans	-59.1	-38.9	175.5	-161.2	100.5	0	0	0	111.8	I525 I531 S532 V534 L540	I525-L536 HydrophobicContact CG2-CD1 3.52Å; I531-L536 HydrophobicContact CG2-CB 4.27Å; I531-L536 HydrophobicContact CG2-CD1 4.21Å; S532-L536 PolarHBondContact O-N 3.41Å; V534-L536 PolarHBondContact O-N 3.46Å; L536-L540 HydrophobicContact CD2-CD1 4.1Å; L536-L540 HydrophobicContact CG-CD1 4.34Å; L536-L540 WeakPolarHBondContact O-CB 3.2Å; L536-L540 VanDerWaalsContact O-CG 3.26Å; L536-L540 WeakPolarHBondContact O-CG 3.38Å; L536-L540 PolarHBondContact O-N 2.93Å
537	R	53	Low	45	Very low	172 Å²	172	102.7 Å²	102.7	65%	0.649	49%	0.492	S	S	*	.	H	α-helix	trans	-72	-35.8	175.4	-88	-176.3	-84.5	-160.6	-7.7	112.8	A533 V534 Y535 K541	A533-R537 PolarHBondContact O-NE 3.11Å; A533-R537 PolarHBondContact O-NH2 3.34Å; V534-R537 CarbonylContact O-C 3.59Å; V534-R537 PolarHBondContact O-N 2.7Å; V534-R537 VanDerWaalsContact O-N 3.12Å; Y535-R537 VanDerWaalsContact C-N 3.27Å; Y535-R537 PolarHBondContact O-N 3.41Å; R537-K541 WeakPolarHBondContact O-CB 3.49Å; R537-K541 PolarHBondContact O-N 2.96Å
538	Q	54.1	Low	44.6	Very low	120 Å²	120	104.8 Å²	104.8	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-65.7	-42.8	172.8	-73.4	171.2	-26.4	0	0	111.4	V534 Y535 K541 Y542	V534-Q538 WeakPolarHBondContact O-CG 3.27Å; V534-Q538 PolarHBondContact O-N 3.19Å; Y535-Q538 PolarHBondContact O-N 2.88Å; Y535-Q538 VanDerWaalsContact O-N 3.14Å; Q538-K541 PolarHBondContact O-N 3.32Å; Q538-Y542 WeakPolarHBondContact O-CB 3.06Å; Q538-Y542 PolarHBondContact O-N 3.41Å
539	L	47	Very low	44.6	Very low	61 Å²	61	107.8 Å²	107.8	32%	0.319	52%	0.517	S	S	.	.	H	α-helix	trans	-64.8	-47.8	177	-167	76.6	0	0	0	111.6	Y535 K541 Y542 I543	Y535-L539 WeakPolarHBondContact O-CB 3.33Å; Y535-L539 PolarHBondContact O-N 2.87Å; L539-K541 VanDerWaalsContact C-N 3.32Å; L539-K541 PolarHBondContact O-N 3.23Å; L539-Y542 WeakPolarHBondContact O-CB 3.32Å; L539-Y542 PolarHBondContact O-N 3.41Å; L539-I543 HydrophobicContact CG-CD1 4.24Å; L539-I543 VanDerWaalsContact O-CG1 3.27Å; L539-I543 WeakPolarHBondContact O-CG1 3.42Å; L539-I543 PolarHBondContact O-N 2.83Å
540	L	52.7	Low	44.4	Very low	101 Å²	101	103.9 Å²	103.9	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-60.1	-41.7	174.8	-75.1	167.8	0	0	0	111.7	L536 I543 E544	L536-L540 HydrophobicContact CD2-CD1 4.1Å; L536-L540 HydrophobicContact CG-CD1 4.34Å; L536-L540 WeakPolarHBondContact O-CB 3.2Å; L536-L540 VanDerWaalsContact O-CG 3.26Å; L536-L540 WeakPolarHBondContact O-CG 3.38Å; L536-L540 PolarHBondContact O-N 2.93Å; L540-I543 PolarHBondContact O-N 3.5Å; L540-E544 VanDerWaalsContact O-CB 3.3Å; L540-E544 WeakPolarHBondContact O-CB 3.25Å; L540-E544 PolarHBondContact O-N 3.38Å
541	K	52.1	Low	44.2	Very low	131 Å²	131	101.5 Å²	101.5	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-69.9	-32.2	177.7	-168.7	163.3	-168.2	169.8	0	113	R537 Q538 L539 T545	R537-K541 WeakPolarHBondContact O-CB 3.49Å; R537-K541 PolarHBondContact O-N 2.96Å; Q538-K541 PolarHBondContact O-N 3.32Å; L539-K541 VanDerWaalsContact C-N 3.32Å; L539-K541 PolarHBondContact O-N 3.23Å; K541-T545 WeakPolarHBondContact O-CG2 3.4Å; K541-T545 PolarHBondContact O-N 3.02Å; K541-T545 PolarHBondContact O-OG1 3.1Å; K541-T545 VanDerWaalsContact O-OG1 3.05Å
542	Y	45.4	Very low	43.9	Very low	114 Å²	114	101 Å²	101	45%	0.447	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-47	171.1	-179.7	-100.1	0	0	0	110.6	L504 Q538 L539 T545 Q546	L504-Y542 HydrophobicContact CD1-CE1 4.31Å; Q538-Y542 WeakPolarHBondContact O-CB 3.06Å; Q538-Y542 PolarHBondContact O-N 3.41Å; L539-Y542 WeakPolarHBondContact O-CB 3.32Å; L539-Y542 PolarHBondContact O-N 3.41Å; Y542-T545 WeakPolarHBondContact CA-OG1 3.08Å; Y542-T545 PolarHBondContact O-N 3.02Å; Y542-T545 PolarHBondContact O-OG1 3.05Å; Y542-Q546 HydrophobicContact CD1-CG 4.39Å; Y542-Q546 HydrophobicContact CE1-CG 4.16Å; Y542-Q546 HydrophobicContact CE2-CG 4.44Å; Y542-Q546 WeakPolarHBondContact O-CB 3.39Å; Y542-Q546 VanDerWaalsContact O-CG 3.22Å; Y542-Q546 WeakPolarHBondContact O-CG 3.36Å; Y542-Q546 PolarHBondContact O-N 3.38Å
543	I	43.8	Very low	43.4	Very low	64 Å²	64	106 Å²	106	33%	0.328	54%	0.538	S	S	.	.	H	α-helix	trans	-60.6	-46.2	175.2	-67.2	165.5	0	0	0	110.9	L539 L540 T545 Q546 I547	L539-I543 HydrophobicContact CG-CD1 4.24Å; L539-I543 VanDerWaalsContact O-CG1 3.27Å; L539-I543 WeakPolarHBondContact O-CG1 3.42Å; L539-I543 PolarHBondContact O-N 2.83Å; L540-I543 PolarHBondContact O-N 3.5Å; I543-T545 PolarHBondContact O-N 3.32Å; I543-Q546 PolarHBondContact O-N 3.42Å; I543-Q546 VanDerWaalsContact O-N 3.1Å; I543-I547 HydrophobicContact CG2-CD1 3.74Å; I543-I547 HydrophobicContact CG2-CG1 4.35Å; I543-I547 WeakPolarHBondContact O-CB 3.45Å; I543-I547 WeakPolarHBondContact O-CG1 3.21Å; I543-I547 PolarHBondContact O-N 3.17Å
544	E	43.8	Very low	42.8	Very low	92 Å²	92	108.1 Å²	108.1	43%	0.43	54%	0.54	S	S	.	.	H	α-helix	trans	-53	-49.1	173.7	-178.3	-179.2	-142.1	0	0	111.5	L540 Q546 F548 I551	L540-E544 VanDerWaalsContact O-CB 3.3Å; L540-E544 WeakPolarHBondContact O-CB 3.25Å; L540-E544 PolarHBondContact O-N 3.38Å; E544-Q546 VanDerWaalsContact C-N 3.32Å; E544-Q546 PolarHBondContact O-N 3.43Å; E544-F548 PolarHBondContact O-N 3.26Å; E544-I551 HydrophobicContact CG-CD1 4.31Å; E544-I551 WeakPolarHBondContact OE1-CD1 3.32Å
545	T	45.6	Very low	41.9	Very low	91 Å²	91	109.1 Å²	109.1	56%	0.558	55%	0.546	S	S	*	.	H	α-helix	trans	-70.8	-18.6	177.7	53.7	0	0	0	0	115.3	K541 Y542 I543	K541-T545 WeakPolarHBondContact O-CG2 3.4Å; K541-T545 PolarHBondContact O-N 3.02Å; K541-T545 PolarHBondContact O-OG1 3.1Å; K541-T545 VanDerWaalsContact O-OG1 3.05Å; Y542-T545 WeakPolarHBondContact CA-OG1 3.08Å; Y542-T545 PolarHBondContact O-N 3.02Å; Y542-T545 PolarHBondContact O-OG1 3.05Å; I543-T545 PolarHBondContact O-N 3.32Å
546	Q	37.9	Very low	41.3	Very low	112 Å²	112	111 Å²	111	52%	0.523	56%	0.559	S	S	.	*	H	α-helix	trans	-96.6	-20.1	-178.9	-70	-73.4	-5.6	0	0	113.5	Y542 I543 E544	Y542-Q546 HydrophobicContact CD1-CG 4.39Å; Y542-Q546 HydrophobicContact CE1-CG 4.16Å; Y542-Q546 HydrophobicContact CE2-CG 4.44Å; Y542-Q546 WeakPolarHBondContact O-CB 3.39Å; Y542-Q546 VanDerWaalsContact O-CG 3.22Å; Y542-Q546 WeakPolarHBondContact O-CG 3.36Å; Y542-Q546 PolarHBondContact O-N 3.38Å; I543-Q546 PolarHBondContact O-N 3.42Å; I543-Q546 VanDerWaalsContact O-N 3.1Å; E544-Q546 VanDerWaalsContact C-N 3.32Å; E544-Q546 PolarHBondContact O-N 3.43Å
547	I	34.9	Very low	40.5	Very low	99 Å²	99	115.5 Å²	115.5	51%	0.508	57%	0.572	S	S	.	*	H	α-helix	trans	-113.8	-19.2	-168.3	-60.6	-170.1	0	0	0	114.2	I543 L549	I543-I547 HydrophobicContact CG2-CD1 3.74Å; I543-I547 HydrophobicContact CG2-CG1 4.35Å; I543-I547 WeakPolarHBondContact O-CB 3.45Å; I543-I547 WeakPolarHBondContact O-CG1 3.21Å; I543-I547 PolarHBondContact O-N 3.17Å; I547-L549 HydrophobicContact CG2-CB 4.12Å; I547-L549 HydrophobicContact CG2-CD1 3.84Å; I547-L549 HydrophobicContact CG2-CG 4.22Å; I547-L549 PolarHBondContact O-N 3.14Å
548	F	32.2	Very low	39.4	Very low	170 Å²	170	117.8 Å²	117.8	75%	0.746	58%	0.581	S	S	*	*			trans	59.6	19.6	178.5	-90	-87.7	0	0	0	115.3	E544	E544-F548 PolarHBondContact O-N 3.26Å
549	L	33.2	Very low	38.1	Very low	122 Å²	122	119 Å²	119	64%	0.639	59%	0.592	S	S	*	*			trans	-89.1	125	176	-99.7	166	0	0	0	111.6	I547	I547-L549 HydrophobicContact CG2-CB 4.12Å; I547-L549 HydrophobicContact CG2-CD1 3.84Å; I547-L549 HydrophobicContact CG2-CG 4.22Å; I547-L549 PolarHBondContact O-N 3.14Å
550	P	35	Very low	37.6	Very low	107 Å²	107	120.9 Å²	120.9	70%	0.695	61%	0.608	S	S	*	*			trans	-67.7	133.4	177.8	-20.5	33.2	0	0	0	112.9	G552	P550-G552 PolarHBondContact O-N 2.83Å
551	I	38.5	Very low	36.4	Very low	116 Å²	116	125.5 Å²	125.5	60%	0.595	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	50.7	178.1	-42.4	-178.5	0	0	0	111.1	E544 L554	E544-I551 HydrophobicContact CG-CD1 4.31Å; E544-I551 WeakPolarHBondContact OE1-CD1 3.32Å; I551-L554 HydrophobicContact CG2-CB 4.29Å; I551-L554 HydrophobicContact CG2-CD1 4.48Å
552	G	34.8	Very low	35.3	Very low	54 Å²	54	124.9 Å²	124.9	56%	0.557	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-30.7	175.5	0	0	0	0	0	113.6	P550	P550-G552 PolarHBondContact O-N 2.83Å
553	E	36.3	Very low	34.5	Very low	167 Å²	167	128.1 Å²	128.1	78%	0.78	65%	0.654	S	S	*	*	S	Bend	trans	-96.9	-7.4	-167.1	-61	177.4	162.7	0	0	113.7	T555	E553-T555 PolarHBondContact O-N 2.83Å
554	L	32.3	Very low	33.7	Very low	108 Å²	108	127.5 Å²	127.5	57%	0.565	66%	0.664	S	S	*	*			trans	-96	37.2	-178.4	-70.5	170.5	0	0	0	113.5	I551 Q556 Y557	I551-L554 HydrophobicContact CG2-CB 4.29Å; I551-L554 HydrophobicContact CG2-CD1 4.48Å; L554-Q556 PolarHBondContact O-N 3.05Å; L554-Y557 HydrophobicContact CD2-CD2 4.03Å; L554-Y557 HydrophobicContact CD2-CE2 3.94Å; L554-Y557 PolarHBondContact O-N 3.27Å
555	T	31.6	Very low	33	Very low	110 Å²	110	134.7 Å²	134.7	68%	0.675	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-59.9	-15.8	176	46.7	0	0	0	0	114.1	E553 Y557	E553-T555 PolarHBondContact O-N 2.83Å; T555-Y557 VanDerWaalsContact C-N 3.29Å; T555-Y557 PolarHBondContact O-N 3Å
556	Q	34	Very low	32.3	Very low	156 Å²	156	134.5 Å²	134.5	73%	0.729	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-77.3	-4.3	-175.7	-53.2	-179.8	40.9	0	0	114.7	L554	L554-Q556 PolarHBondContact O-N 3.05Å
557	Y	32.7	Very low	31.8	Very low	158 Å²	158	135.9 Å²	135.9	62%	0.62	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-121.8	15.4	-174	-62.3	-79.4	0	0	0	114.4	L554 T555	L554-Y557 HydrophobicContact CD2-CD2 4.03Å; L554-Y557 HydrophobicContact CD2-CE2 3.94Å; L554-Y557 PolarHBondContact O-N 3.27Å; T555-Y557 VanDerWaalsContact C-N 3.29Å; T555-Y557 PolarHBondContact O-N 3Å
558	R	28.5	Very low	31.7	Very low	220 Å²	220	138.7 Å²	138.7	83%	0.83	71%	0.71	S	S	*	*	S	Bend	trans	-84.4	108.9	164	-76.1	-174.7	176.1	-178.6	-0.2	109.2
559	D	27.4	Very low	31.6	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	70%	0.704	S	S	*	*			trans	67	164	170.3	-65.5	-51.1	0	0	0	116.1
560	P	36.3	Very low	31.5	Very low	101 Å²	101	136.7 Å²	136.7	66%	0.656	71%	0.707	S	S	*	*			cis	-143.5	-172.1	-48.1	42.4	-27.7	0	0	0	114.8
561	K	28.7	Very low	31.1	Very low	198 Å²	198	138.9 Å²	138.9	86%	0.861	71%	0.707	S	S	*	*			trans	82.9	157.5	151.6	-78.8	172.9	-177.9	176.2	0	119.5
562	P	29	Very low	30.7	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	71%	0.707	S	S	*	*			trans	-122.8	167.9	-150.5	42.6	-30.4	0	0	0	115.5
563	M	27.3	Very low	30.4	Very low	183 Å²	183	143.6 Å²	143.6	90%	0.901	71%	0.71	S	S	*	*			trans	-143.4	148.7	160.7	-76.9	-158.8	175.6	0	0	114.2	R529	R529-M563 PolarHBondContact NH2-O 2.88Å
564	G	27.5	Very low	29.9	Very low	51 Å²	51	141.1 Å²	141.1	53%	0.526	71%	0.706	S	S	.	*			trans	97.7	87.6	145.7	0	0	0	0	0	117.4	R529	R529-G564 VanDerWaalsContact CZ-O 3.23Å; R529-G564 PolarHBondContact NH1-O 3.49Å; R529-G564 PolarHBondContact NH2-O 3.11Å
565	R	30.2	Very low	29.6	Very low	242 Å²	242	145.6 Å²	145.6	91%	0.913	72%	0.722	S	S	*	*			trans	-36.9	166.3	155.8	-55.4	166.8	-177.3	-179.7	-1.7	113.6
566	S	29.6	Very low	29.4	Very low	87 Å²	87	145 Å²	145	61%	0.608	72%	0.722	S	S	*	*			cis	-149.2	149.8	9.7	-151.3	0	0	0	0	106.6
567	L	28.3	Very low	29.3	Very low	142 Å²	142	144.6 Å²	144.6	74%	0.743	73%	0.725	S	S	*	*				46.3	130.3	62.7	-73.1	98.4	0	0	0	112.1
568	E	31.6	Very low	29.3	Very low	158 Å²	158	142.4 Å²	142.4	74%	0.738	73%	0.728	S	S	*	*			cis	-146.6	134	48.4	-79.8	-175.5	162.8	0	0	111.4
569	N	31	Very low	29.4	Very low	115 Å²	115	138 Å²	138	62%	0.615	72%	0.721	S	S	*	*				87.5	149.7	103.5	-64.2	-11.3	0	0	0	113.1
570	I	30.1	Very low	29.7	Very low	135 Å²	135	138.1 Å²	138.1	69%	0.692	72%	0.722	S	S	*	*			cis	-151.7	152.6	2.9	-130.5	161	0	0	0	111.8
571	H	28.1	Very low	29.4	Very low	152 Å²	152	136.6 Å²	136.6	70%	0.704	73%	0.725	S	S	*	*			trans	3.9	159.8	140.2	-72.4	-97.8	0	0	0	121.5
572	E	28.4	Very low	29.7	Very low	128 Å²	128	132.6 Å²	132.6	60%	0.598	72%	0.722	S	S	*	*			cis	175.7	-179.8	-19	-149.5	-171.9	157.3	0	0	109
573	K	28.9	Very low	29.7	Very low	142 Å²	142	138.3 Å²	138.3	62%	0.617	73%	0.728	S	S	*	*			trans	73.8	109.7	144	-86.7	177.2	176.1	73.8	0	124
574	T	26.7	Very low	29.9	Very low	114 Å²	114	141 Å²	141	70%	0.699	73%	0.73	S	S	*	*				62.5	120	122.4	55.8	0	0	0	0	124.6
575	F	26.1	Very low	29.8	Very low	202 Å²	202	143.4 Å²	143.4	89%	0.886	74%	0.738	S	S	*	*				53	164.8	109.9	-95.7	-88.3	0	0	0	123.4
576	S	27.4	Very low	29.9	Very low	99 Å²	99	140.5 Å²	140.5	69%	0.692	73%	0.733	S	S	*	*			trans	65.4	140.4	-170.7	65.5	0	0	0	0	115
577	D	30.8	Very low	30.1	Very low	146 Å²	146	144.9 Å²	144.9	78%	0.781	74%	0.741	S	S	*	*			cis	-166.2	-178.8	-7.2	-107	-14.8	0	0	0	108.6
578	T	33.6	Very low	30.1	Very low	112 Å²	112	144.7 Å²	144.7	69%	0.687	74%	0.736	S	S	*	*			cis	-156.7	156.8	10.5	-7.4	0	0	0	0	112.2
579	N	31.1	Very low	30.3	Very low	127 Å²	127	145.3 Å²	145.3	68%	0.679	74%	0.744	S	S	*	*			trans	50.6	139.7	143.5	-80.6	34.7	0	0	0	127.6
580	D	33.4	Very low	30.3	Very low	150 Å²	150	147.2 Å²	147.2	80%	0.802	75%	0.747	S	S	*	*			trans	64.1	142	137.1	-64	-40.9	0	0	0	123.6
581	G	30.1	Very low	30.6	Very low	69 Å²	69	146.7 Å²	146.7	71%	0.711	76%	0.755	S	S	*	*			trans	175.1	27.8	173.5	0	0	0	0	0	123.4
582	S	34.2	Very low	30.8	Very low	114 Å²	114	147.4 Å²	147.4	80%	0.797	76%	0.759	S	S	*	*			trans	54.8	117.1	161.3	62.5	0	0	0	0	122.5
583	R	28.7	Very low	31.1	Very low	237 Å²	237	148.1 Å²	148.1	89%	0.894	77%	0.767	S	S	*	*			trans	9.4	126.9	140.8	-55.6	173.9	-174.2	161.8	1.8	119.7
584	Y	31.9	Very low	31.3	Very low	240 Å²	240	149.7 Å²	149.7	94%	0.941	78%	0.776	S	S	*	*			trans	-138.5	148.8	132.3	-100.5	-83.5	0	0	0	110.3
585	S	26	Very low	31.4	Very low	100 Å²	100	149.9 Å²	149.9	70%	0.699	78%	0.778	S	S	*	*			trans	-137	134.5	-172.1	57	0	0	0	0	111
586	F	31.4	Very low	31.8	Very low	182 Å²	182	149.5 Å²	149.5	80%	0.798	78%	0.776	S	S	*	*			trans	-151.3	105.5	169.7	-131.2	-97.1	0	0	0	115.5
587	K	34.7	Very low	31.9	Very low	179 Å²	179	149.9 Å²	149.9	78%	0.778	78%	0.778	S	S	*	*			trans	61.1	148	147.7	-62.8	-169	-177.2	-177.8	0	122.6
588	E	28.5	Very low	31.9	Very low	138 Å²	138	148.9 Å²	148.9	65%	0.645	78%	0.777	S	S	*	*			trans	-71.2	162.7	172.7	-57.3	162.1	89.8	0	0	112.9	K590	E588-K590 WeakPolarHBondContact OE1-CE 3.39Å; E588-K590 IonicContact OE1-NZ 2.78Å; E588-K590 PolarHBondContact OE1-NZ 2.94Å
589	N	35.4	Very low	31.5	Very low	171 Å²	171	148.7 Å²	148.7	91%	0.914	78%	0.781	S	S	*	*				-143.1	138.4	127.1	-104.9	-34.3	0	0	0	109.7
590	K	30.8	Very low	31.5	Very low	155 Å²	155	150.4 Å²	150.4	67%	0.674	78%	0.784	S	S	*	*			trans	-97.8	148.2	-178.5	-71.6	172.8	171.3	115.8	0	110.8	E588	E588-K590 WeakPolarHBondContact OE1-CE 3.39Å; E588-K590 IonicContact OE1-NZ 2.78Å; E588-K590 PolarHBondContact OE1-NZ 2.94Å
591	S	35.5	Very low	31.3	Very low	123 Å²	123	153 Å²	153	86%	0.86	79%	0.785	S	S	*	*			trans	-131.9	145.2	143.7	54.5	0	0	0	0	108.6
592	Q	32.3	Very low	31.2	Very low	167 Å²	167	154.6 Å²	154.6	78%	0.78	78%	0.784	S	S	*	*			trans	-114.3	148.8	178.3	-69	172.7	-110	0	0	109.1
593	N	35.1	Very low	30.8	Very low	144 Å²	144	156.7 Å²	156.7	77%	0.77	79%	0.787	S	S	*	*			trans	158.3	142.4	145.3	-81.5	1.1	0	0	0	108.4
594	E	33.8	Very low	30.8	Very low	174 Å²	174	153.4 Å²	153.4	81%	0.813	78%	0.783	S	S	*	*			cis	-152.5	169	-15.8	-123	178.1	145.1	0	0	108.4
595	T	28.5	Very low	30.5	Very low	119 Å²	119	150.4 Å²	150.4	73%	0.73	78%	0.778	S	S	*	*			trans	-108.7	170.1	-171.4	51	0	0	0	0	114.4
596	K	33.7	Very low	30.6	Very low	194 Å²	194	153.6 Å²	153.6	84%	0.843	78%	0.784	S	S	*	*			trans	92.2	150.4	178	-53.4	152.2	-171.2	166.7	0	113.3
597	S	31.3	Very low	30.3	Very low	106 Å²	106	151.4 Å²	151.4	74%	0.741	78%	0.78	S	S	*	*			cis	-171.7	172.9	-17	51.2	0	0	0	0	107.4
598	V	29.3	Very low	30	Very low	126 Å²	126	150.8 Å²	150.8	76%	0.764	79%	0.785	S	S	*	*			cis	-142.9	158.1	16.1	-170.5	0	0	0	0	108.7
599	S	26.4	Very low	29.8	Very low	108 Å²	108	152.5 Å²	152.5	76%	0.755	79%	0.79	S	S	*	*			trans	-99.6	132.5	169.2	56.7	0	0	0	0	112.4
600	Q	30.5	Very low	29.4	Very low	162 Å²	162	153.2 Å²	153.2	76%	0.757	79%	0.786	S	S	*	*			trans	-158.4	155.9	168.3	-127.1	165.3	12.2	0	0	114.3
601	Y	29.7	Very low	29.3	Very low	206 Å²	206	156.8 Å²	156.8	81%	0.808	80%	0.795	S	S	*	*			trans	72.8	103.2	178.3	-63.4	-74.8	0	0	0	118.2
602	S	27.2	Very low	28.8	Very low	101 Å²	101	157 Å²	157	71%	0.706	79%	0.786	S	S	*	*			trans	-116.2	165.5	168.7	-41.8	0	0	0	0	109.4
603	N	26.8	Very low	28.7	Very low	159 Å²	159	154.8 Å²	154.8	85%	0.85	79%	0.787	S	S	*	*			trans	64.2	112.7	157.1	-56.7	-3.2	0	0	0	118.8
604	M	28.2	Very low	28.5	Very low	167 Å²	167	157.3 Å²	157.3	82%	0.823	79%	0.791	S	S	*	*			trans	-146.5	82.3	136.5	-164.4	166.1	-68.4	0	0	111.3	M606	M604-M606 HydrophobicContact SD-CE 4.22Å
605	E	24.2	Very low	28.3	Very low	177 Å²	177	154.9 Å²	154.9	83%	0.827	78%	0.783	S	S	*	*			trans	-70.6	132.5	160.6	-70.7	-172.7	113.6	0	0	109.6
606	M	29.6	Very low	28.5	Very low	167 Å²	167	155.4 Å²	155.4	82%	0.823	78%	0.778	S	S	*	*			trans	-136.8	121.3	154.7	-85.1	-159.2	-84.5	0	0	112.4	M604	M604-M606 HydrophobicContact SD-CE 4.22Å
607	N	24.6	Very low	28.3	Very low	136 Å²	136	155 Å²	155	73%	0.727	78%	0.776	S	S	*	*			trans	-72.1	144.5	173.2	-78.5	-106	0	0	0	110.7
608	L	28.5	Very low	28.3	Very low	166 Å²	166	156 Å²	156	87%	0.869	78%	0.783	S	S	*	*			trans	-148.9	146.8	151.6	-108.3	166.7	0	0	0	111.1
609	K	24.5	Very low	28.3	Very low	175 Å²	175	159.4 Å²	159.4	76%	0.761	79%	0.788	S	S	*	*			trans	-120.1	122.8	-165.3	-58.8	170.2	-178.1	171.4	0	112.2
610	F	27.3	Very low	28.5	Very low	186 Å²	186	166.4 Å²	166.4	82%	0.816	80%	0.797	S	S	*	*			trans	-141.5	118.2	155.3	-73	-79.4	0	0	0	108.3
611	R	27.9	Very low	28.5	Very low	229 Å²	229	162.1 Å²	162.1	86%	0.864	80%	0.796	S	S	*	*				98.4	113.8	51.9	-167.4	176.6	-160.1	-172.3	5.7	109.4
612	D	25.8	Very low	28.4	Very low	128 Å²	128	159.3 Å²	159.3	68%	0.684	80%	0.801	S	S	*	*			trans	-72.1	128.8	-163.1	-158.1	-26.1	0	0	0	112.7	F614	D612-F614 VanDerWaalsContact C-N 3.29Å; D612-F614 PolarHBondContact O-N 3.38Å
613	P	29.8	Very low	28.4	Very low	121 Å²	121	162.3 Å²	162.3	79%	0.786	80%	0.804	S	S	*	*			trans	-75.3	-4.8	-177.5	-18.6	33.1	0	0	0	116	D615	P613-D615 PolarHBondContact O-N 3.31Å
614	F	29.9	Very low	28.6	Very low	197 Å²	197	161.6 Å²	161.6	86%	0.864	81%	0.805	S	S	*	*			trans	-78.6	52.4	-176.2	-81.7	-76.8	0	0	0	114.3	D612	D612-F614 VanDerWaalsContact C-N 3.29Å; D612-F614 PolarHBondContact O-N 3.38Å
615	D	31.2	Very low	28.4	Very low	122 Å²	122	159.4 Å²	159.4	65%	0.652	80%	0.796	S	S	*	*			trans	-136	124.9	167.8	-148	-8.9	0	0	0	114.7	P613	P613-D615 PolarHBondContact O-N 3.31Å
616	Q	32	Very low	28.4	Very low	131 Å²	131	158 Å²	158	61%	0.612	79%	0.793	S	S	*	*			trans	60.1	91.7	160	-79.5	168.9	101.4	0	0	123.8
617	K	29.8	Very low	28.4	Very low	184 Å²	184	157.6 Å²	157.6	80%	0.8	79%	0.794	S	S	*	*				61.8	90.7	119.7	-61.1	166.4	-164.3	151.9	0	118.6
618	S	30.2	Very low	28.8	Very low	127 Å²	127	156.2 Å²	156.2	89%	0.888	79%	0.786	S	S	*	*			trans	-143.7	150.8	130.6	-163.2	0	0	0	0	112.3
619	K	30.1	Very low	29	Very low	199 Å²	199	151.8 Å²	151.8	87%	0.865	77%	0.767	S	S	*	*			trans	-93.8	111.5	-159.4	-60.9	167.7	-179.1	172.1	0	112.9
620	R	31.6	Very low	29.5	Very low	255 Å²	255	150.2 Å²	150.2	96%	0.962	77%	0.767	S	S	*	*			trans	-177.4	141.5	149.2	-98	164	-149.5	-157.4	6.9	107.1
621	G	29.4	Very low	29.8	Very low	71 Å²	71	146.9 Å²	146.9	73%	0.732	76%	0.757	S	S	*	*			cis	169.7	104.9	-4.6	0	0	0	0	0	108.9	Q623	G621-Q623 PolarHBondContact O-N 3Å; G621-Q623 VanDerWaalsContact O-N 3.09Å
622	T	27.2	Very low	30.4	Very low	147 Å²	147	140 Å²	140	90%	0.902	74%	0.735	S	S	*	*			trans	-71	99	-167.2	-49.6	0	0	0	0	113.1
623	Q	27	Very low	30.9	Very low	164 Å²	164	137.3 Å²	137.3	77%	0.766	72%	0.72	S	S	*	*			trans	-156.4	48.2	172.6	-124.4	167.3	16.3	0	0	117.1	G621 L625	G621-Q623 PolarHBondContact O-N 3Å; G621-Q623 VanDerWaalsContact O-N 3.09Å; Q623-L625 HydrophobicContact CG-CD1 4.02Å
624	V	31.5	Very low	31	Very low	145 Å²	145	133.7 Å²	133.7	88%	0.879	70%	0.7	S	S	*	*			trans	-135.5	90.5	157.1	-176.5	0	0	0	0	105.3
625	L	24	Very low	31.6	Very low	121 Å²	121	127.6 Å²	127.6	63%	0.634	67%	0.673	S	S	*	*			cis	62.5	115.8	46.5	-77.3	173.2	0	0	0	114.5	Q623	Q623-L625 HydrophobicContact CG-CD1 4.02Å
626	L	25.5	Very low	31.8	Very low	146 Å²	146	125.2 Å²	125.2	76%	0.764	67%	0.665	S	S	*	*			trans	61.9	103.7	151.4	-56.7	168.1	0	0	0	117.8
627	N	29.7	Very low	32.1	Very low	159 Å²	159	124.3 Å²	124.3	85%	0.85	66%	0.664	S	S	*	*			trans	157.4	1.9	136.1	-79.5	-15.7	0	0	0	114.7	P629	N627-P629 WeakPolarHBondContact O-CD 3.4Å
628	I	31.5	Very low	32.8	Very low	108 Å²	108	122 Å²	122	55%	0.554	66%	0.656	S	S	*	*	S	Bend	trans	-68.2	127.3	168.6	-51.3	174.1	0	0	0	109	E632 I633	I628-E632 HydrophobicContact CG2-CB 3.68Å; I628-I633 HydrophobicContact CB-CD1 4.1Å; I628-I633 HydrophobicContact CB-CG1 3.78Å; I628-I633 HydrophobicContact CG2-CD1 4.39Å; I628-I633 HydrophobicContact CG2-CG1 3.53Å
629	P	33.9	Very low	33.6	Very low	72 Å²	72	119.2 Å²	119.2	47%	0.468	63%	0.63	S	S	.	*			trans	-56.9	138.8	172.6	-24.1	33.8	0	0	0	111.7	N627 L631 E632 I633	N627-P629 WeakPolarHBondContact O-CD 3.4Å; P629-L631 PolarHBondContact O-N 3.32Å; P629-E632 WeakPolarHBondContact CD-OE2 3.43Å; P629-E632 PolarHBondContact O-N 2.98Å; P629-I633 PolarHBondContact O-N 2.97Å
630	N	34.6	Very low	34.3	Very low	142 Å²	142	112.2 Å²	112.2	76%	0.759	61%	0.607	S	S	*	*	H	α-helix	trans	-53	-28.1	-178.9	-74.5	-29.5	0	0	0	113.7	A634	N630-A634 VanDerWaalsContact O-CB 3.31Å; N630-A634 WeakPolarHBondContact O-CB 3.49Å; N630-A634 PolarHBondContact O-N 3.43Å
631	L	34.3	Very low	34.9	Very low	116 Å²	116	108.1 Å²	108.1	61%	0.607	59%	0.593	S	S	*	*	H	α-helix	trans	-68.9	-34.3	176.1	-167.5	69.1	0	0	0	113.2	P629 K635	P629-L631 PolarHBondContact O-N 3.32Å; L631-K635 VanDerWaalsContact O-CG 3.26Å; L631-K635 WeakPolarHBondContact O-CG 3.22Å; L631-K635 PolarHBondContact O-N 3.38Å
632	E	39.9	Very low	35.5	Very low	85 Å²	85	106.8 Å²	106.8	40%	0.397	57%	0.572	S	S	.	*	H	α-helix	trans	-79.7	-37.2	178.4	-71.6	-179	172.4	0	0	111.7	I628 P629 A634 K635 C636	I628-E632 HydrophobicContact CG2-CB 3.68Å; P629-E632 WeakPolarHBondContact CD-OE2 3.43Å; P629-E632 PolarHBondContact O-N 2.98Å; E632-A634 VanDerWaalsContact C-N 3.31Å; E632-A634 PolarHBondContact O-N 2.88Å; E632-K635 PolarHBondContact O-N 2.97Å; E632-C636 WeakPolarHBondContact O-CB 3.47Å; E632-C636 PolarHBondContact O-N 3.49Å; E632-C636 PolarHBondContact O-SG 3.43Å
633	I	35.1	Very low	36.5	Very low	72 Å²	72	101.8 Å²	101.8	37%	0.369	54%	0.539	S	S	.	.	H	α-helix	trans	-59.8	-45.5	169.5	-53	-178.8	0	0	0	109.6	I628 P629 C636 L637	I628-I633 HydrophobicContact CB-CD1 4.1Å; I628-I633 HydrophobicContact CB-CG1 3.78Å; I628-I633 HydrophobicContact CG2-CD1 4.39Å; I628-I633 HydrophobicContact CG2-CG1 3.53Å; P629-I633 PolarHBondContact O-N 2.97Å; I633-C636 PolarHBondContact O-N 3.27Å; I633-L637 HydrophobicContact CG2-CD1 3.95Å; I633-L637 HydrophobicContact CG2-CG 4.36Å; I633-L637 WeakPolarHBondContact O-CB 3.42Å; I633-L637 VanDerWaalsContact O-CG 3.3Å; I633-L637 WeakPolarHBondContact O-CG 3.48Å; I633-L637 PolarHBondContact O-N 2.96Å
634	A	33.6	Very low	37.7	Very low	45 Å²	45	97.8 Å²	97.8	37%	0.372	52%	0.523	S	S	.	.	H	α-helix	trans	-61.6	-45	177.2	0	0	0	0	0	112.8	N630 E632 L637 Q638	N630-A634 VanDerWaalsContact O-CB 3.31Å; N630-A634 WeakPolarHBondContact O-CB 3.49Å; N630-A634 PolarHBondContact O-N 3.43Å; E632-A634 VanDerWaalsContact C-N 3.31Å; E632-A634 PolarHBondContact O-N 2.88Å; A634-L637 PolarHBondContact O-N 2.83Å; A634-Q638 WeakPolarHBondContact O-CG 3.47Å; A634-Q638 PolarHBondContact O-N 2.94Å
635	K	40.8	Very low	38.4	Very low	69 Å²	69	93.5 Å²	93.5	30%	0.3	50%	0.497	S	S	.	.	H	α-helix	trans	-61.9	-43.5	174.9	-75.1	169	-178.3	174.6	0	112.2	L631 E632 Q638 L639 E692	L631-K635 VanDerWaalsContact O-CG 3.26Å; L631-K635 WeakPolarHBondContact O-CG 3.22Å; L631-K635 PolarHBondContact O-N 3.38Å; E632-K635 PolarHBondContact O-N 2.97Å; K635-Q638 PolarHBondContact O-N 3.22Å; K635-L639 WeakPolarHBondContact O-CG 3.48Å; K635-L639 PolarHBondContact O-N 3.44Å; K635-E692 IonicContact NZ-OE1 2.66Å; K635-E692 PolarHBondContact NZ-OE1 3.49Å
636	C	37	Very low	39.4	Very low	71 Å²	71	90.7 Å²	90.7	48%	0.48	48%	0.482	S	S	.	.	H	α-helix	trans	-67.7	-35.1	177.4	-68.3	0	0	0	0	112.2	E632 I633 S640	E632-C636 WeakPolarHBondContact O-CB 3.47Å; E632-C636 PolarHBondContact O-N 3.49Å; E632-C636 PolarHBondContact O-SG 3.43Å; I633-C636 PolarHBondContact O-N 3.27Å; C636-S640 WeakPolarHBondContact O-CB 3.42Å; C636-S640 PolarHBondContact O-N 2.95Å
637	L	38.5	Very low	40.7	Very low	113 Å²	113	90.4 Å²	90.4	59%	0.592	48%	0.475	S	S	*	.	H	α-helix	trans	-66.7	-40.1	171.5	-75.3	170.5	0	0	0	111.8	I633 A634 S640 Y641	I633-L637 HydrophobicContact CG2-CD1 3.95Å; I633-L637 HydrophobicContact CG2-CG 4.36Å; I633-L637 WeakPolarHBondContact O-CB 3.42Å; I633-L637 VanDerWaalsContact O-CG 3.3Å; I633-L637 WeakPolarHBondContact O-CG 3.48Å; I633-L637 PolarHBondContact O-N 2.96Å; A634-L637 PolarHBondContact O-N 2.83Å; L637-S640 PolarHBondContact O-N 2.95Å; L637-Y641 VanDerWaalsContact O-CB 3.24Å; L637-Y641 WeakPolarHBondContact O-CB 3.37Å; L637-Y641 PolarHBondContact O-N 3.13Å
638	Q	43.4	Very low	41.5	Very low	134 Å²	134	91.3 Å²	91.3	63%	0.626	47%	0.466	S	S	*	.	H	α-helix	trans	-63.8	-46.7	173.1	-76.3	-176.1	-52.8	0	0	112.1	A634 K635 S640 Y641 C642	A634-Q638 WeakPolarHBondContact O-CG 3.47Å; A634-Q638 PolarHBondContact O-N 2.94Å; K635-Q638 PolarHBondContact O-N 3.22Å; Q638-S640 PolarHBondContact O-N 3.34Å; Q638-Y641 WeakPolarHBondContact O-CB 3.34Å; Q638-Y641 PolarHBondContact O-N 2.86Å; Q638-C642 PolarHBondContact O-N 3.34Å; Q638-C642 PolarHBondContact O-SG 3.39Å; Q638-C642 VanDerWaalsContact O-SG 3.37Å
639	L	46.7	Very low	42	Very low	69 Å²	69	88.4 Å²	88.4	36%	0.361	45%	0.453	S	S	.	.	H	α-helix	trans	-63.7	-40.5	176.8	-73.5	167.3	0	0	0	111.9	K635 C642 N643	K635-L639 WeakPolarHBondContact O-CG 3.48Å; K635-L639 PolarHBondContact O-N 3.44Å; L639-C642 PolarHBondContact O-N 3.18Å; L639-N643 VanDerWaalsContact O-CB 3.27Å; L639-N643 WeakPolarHBondContact O-CB 3.47Å; L639-N643 PolarHBondContact O-N 2.82Å
640	S	45.1	Very low	42.5	Very low	53 Å²	53	87.5 Å²	87.5	37%	0.371	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-42.2	172.2	-179.1	0	0	0	0	111.7	C636 L637 Q638 N643 N644	C636-S640 WeakPolarHBondContact O-CB 3.42Å; C636-S640 PolarHBondContact O-N 2.95Å; L637-S640 PolarHBondContact O-N 2.95Å; Q638-S640 PolarHBondContact O-N 3.34Å; S640-N643 PolarHBondContact O-N 3.44Å; S640-N644 VanDerWaalsContact O-CB 3.3Å; S640-N644 WeakPolarHBondContact O-CB 3.3Å; S640-N644 PolarHBondContact O-N 3.16Å; S640-N644 PolarHBondContact O-ND2 3.12Å; S640-N644 PolarHBondContact OG-ND2 3.07Å
641	Y	43.7	Very low	42.8	Very low	169 Å²	169	82 Å²	82	66%	0.663	42%	0.421	S	S	*	.	H	α-helix	trans	-62.9	-48.7	176	-175	-92.3	0	0	0	111.3	L637 Q638 N643 N644 V645	L637-Y641 VanDerWaalsContact O-CB 3.24Å; L637-Y641 WeakPolarHBondContact O-CB 3.37Å; L637-Y641 PolarHBondContact O-N 3.13Å; Q638-Y641 WeakPolarHBondContact O-CB 3.34Å; Q638-Y641 PolarHBondContact O-N 2.86Å; Y641-N643 PolarHBondContact O-N 3.14Å; Y641-N644 PolarHBondContact O-N 3.32Å; Y641-V645 HydrophobicContact CD1-CG2 4.06Å; Y641-V645 HydrophobicContact CE1-CG2 3.79Å; Y641-V645 WeakPolarHBondContact O-CG2 3.47Å; Y641-V645 PolarHBondContact O-N 3.13Å
642	C	43.2	Very low	43.2	Very low	43 Å²	43	83.2 Å²	83.2	29%	0.291	42%	0.423	S	S	.	.	H	α-helix	trans	-59.3	-45.5	175.4	-69.5	0	0	0	0	112.3	Q638 L639 N644 V645 I646	Q638-C642 PolarHBondContact O-N 3.34Å; Q638-C642 PolarHBondContact O-SG 3.39Å; Q638-C642 VanDerWaalsContact O-SG 3.37Å; L639-C642 PolarHBondContact O-N 3.18Å; C642-N644 VanDerWaalsContact C-N 3.34Å; C642-N644 PolarHBondContact O-N 2.86Å; C642-V645 PolarHBondContact O-N 2.95Å; C642-I646 VanDerWaalsContact O-CG1 3.3Å; C642-I646 WeakPolarHBondContact O-CG1 3.41Å; C642-I646 PolarHBondContact O-N 3.48Å
643	N	48.5	Very low	43.1	Very low	41 Å²	41	82.2 Å²	82.2	22%	0.219	42%	0.423	C	S	.	.	H	α-helix	trans	-64.9	-37.5	178.1	-162.2	-21.7	0	0	0	111.4	L639 S640 Y641 K647	L639-N643 VanDerWaalsContact O-CB 3.27Å; L639-N643 WeakPolarHBondContact O-CB 3.47Å; L639-N643 PolarHBondContact O-N 2.82Å; S640-N643 PolarHBondContact O-N 3.44Å; Y641-N643 PolarHBondContact O-N 3.14Å; N643-K647 WeakPolarHBondContact O-CB 3.42Å; N643-K647 VanDerWaalsContact O-CG 3.31Å; N643-K647 WeakPolarHBondContact O-CG 3.34Å; N643-K647 PolarHBondContact O-N 2.85Å
644	N	51.1	Low	43.2	Very low	80 Å²	80	87 Å²	87	43%	0.428	44%	0.441	S	S	.	.	H	α-helix	trans	-70.3	-34.2	173	-78.5	-58.9	0	0	0	113.5	S640 Y641 C642 R648	S640-N644 VanDerWaalsContact O-CB 3.3Å; S640-N644 WeakPolarHBondContact O-CB 3.3Å; S640-N644 PolarHBondContact O-N 3.16Å; S640-N644 PolarHBondContact O-ND2 3.12Å; S640-N644 PolarHBondContact OG-ND2 3.07Å; Y641-N644 PolarHBondContact O-N 3.32Å; C642-N644 VanDerWaalsContact C-N 3.34Å; C642-N644 PolarHBondContact O-N 2.86Å; N644-R648 WeakPolarHBondContact O-CB 3.13Å; N644-R648 WeakPolarHBondContact O-CG 3.49Å; N644-R648 PolarHBondContact O-N 2.95Å
645	V	46.2	Very low	43.2	Very low	56 Å²	56	92.4 Å²	92.4	34%	0.339	46%	0.458	S	S	.	.	H	α-helix	trans	-65.8	-47.2	172.2	167.8	0	0	0	0	110.2	Y641 C642 K647 R648 V649	Y641-V645 HydrophobicContact CD1-CG2 4.06Å; Y641-V645 HydrophobicContact CE1-CG2 3.79Å; Y641-V645 WeakPolarHBondContact O-CG2 3.47Å; Y641-V645 PolarHBondContact O-N 3.13Å; C642-V645 PolarHBondContact O-N 2.95Å; V645-K647 PolarHBondContact O-N 3.04Å; V645-R648 PolarHBondContact O-N 3.15Å; V645-R648 VanDerWaalsContact O-N 3.13Å; V645-V649 WeakPolarHBondContact O-CG2 3.49Å; V645-V649 PolarHBondContact O-N 3.28Å
646	I	44.9	Very low	42.8	Very low	62 Å²	62	95.6 Å²	95.6	32%	0.318	47%	0.468	S	S	.	.	H	α-helix	trans	-58.1	-47.3	174.5	-68.5	164.6	0	0	0	110.4	C642 R648 V649 I650 I681	C642-I646 VanDerWaalsContact O-CG1 3.3Å; C642-I646 WeakPolarHBondContact O-CG1 3.41Å; C642-I646 PolarHBondContact O-N 3.48Å; I646-R648 VanDerWaalsContact C-N 3.31Å; I646-R648 PolarHBondContact O-N 3.02Å; I646-V649 PolarHBondContact O-N 3.03Å; I646-I650 HydrophobicContact CG2-CD1 3.65Å; I646-I650 HydrophobicContact CG2-CG1 4.42Å; I646-I650 WeakPolarHBondContact O-CB 3.27Å; I646-I650 WeakPolarHBondContact O-CG1 3.26Å; I646-I650 PolarHBondContact O-N 3.07Å; I646-I681 HydrophobicContact CD1-CD1 3.96Å; I646-I681 HydrophobicContact CG1-CD1 4.18Å
647	K	52.1	Low	42.3	Very low	139 Å²	139	97.8 Å²	97.8	60%	0.604	48%	0.475	S	S	*	.	H	α-helix	trans	-62	-33	175.6	-76.7	-178.4	179.1	-171.3	0	113.5	N643 V645 G651	N643-K647 WeakPolarHBondContact O-CB 3.42Å; N643-K647 VanDerWaalsContact O-CG 3.31Å; N643-K647 WeakPolarHBondContact O-CG 3.34Å; N643-K647 PolarHBondContact O-N 2.85Å; V645-K647 PolarHBondContact O-N 3.04Å; K647-G651 PolarHBondContact O-N 3.13Å
648	R	48.2	Very low	41.7	Very low	179 Å²	179	97.7 Å²	97.7	68%	0.675	48%	0.481	S	S	*	.	H	α-helix	trans	-70.4	-44.9	173	-76.3	177.3	-173	-173.1	2.8	111.8	N644 V645 I646 I650 G651 H652	N644-R648 WeakPolarHBondContact O-CB 3.13Å; N644-R648 WeakPolarHBondContact O-CG 3.49Å; N644-R648 PolarHBondContact O-N 2.95Å; V645-R648 PolarHBondContact O-N 3.15Å; V645-R648 VanDerWaalsContact O-N 3.13Å; I646-R648 VanDerWaalsContact C-N 3.31Å; I646-R648 PolarHBondContact O-N 3.02Å; R648-I650 PolarHBondContact O-N 3.47Å; R648-G651 PolarHBondContact O-N 3.46Å; R648-H652 PolarHBondContact O-CD2 2.97Å; R648-H652 PolarHBondContact O-N 3.43Å
649	V	41.2	Very low	41.2	Very low	46 Å²	46	99.1 Å²	99.1	28%	0.279	49%	0.493	S	S	.	.	H	α-helix	trans	-60.2	-46.3	176.5	173.2	0	0	0	0	110.7	V645 I646 G651 H652 T653 T674	V645-V649 WeakPolarHBondContact O-CG2 3.49Å; V645-V649 PolarHBondContact O-N 3.28Å; I646-V649 PolarHBondContact O-N 3.03Å; V649-G651 VanDerWaalsContact C-N 3.34Å; V649-G651 PolarHBondContact O-N 3.34Å; V649-H652 PolarHBondContact O-N 3.48Å; V649-T653 PolarHBondContact O-N 3.34Å; V649-T674 HydrophobicContact CG1-CG2 4.35Å; V649-T674 WeakPolarHBondContact CG1-OG1 3.27Å
650	I	45.1	Very low	40.3	Very low	53 Å²	53	101.2 Å²	101.2	27%	0.272	50%	0.502	S	S	.	.	H	α-helix	trans	-69.4	-29.8	175.9	-63.9	172.7	0	0	0	112.2	I646 R648 T653 T723	I646-I650 HydrophobicContact CG2-CD1 3.65Å; I646-I650 HydrophobicContact CG2-CG1 4.42Å; I646-I650 WeakPolarHBondContact O-CB 3.27Å; I646-I650 WeakPolarHBondContact O-CG1 3.26Å; I646-I650 PolarHBondContact O-N 3.07Å; R648-I650 PolarHBondContact O-N 3.47Å; I650-T653 PolarHBondContact O-OG1 3.45Å; I650-T723 HydrophobicContact CD1-CG2 4.37Å
651	G	41.1	Very low	39.7	Very low	27 Å²	27	104.4 Å²	104.4	28%	0.278	52%	0.522	S	S	.	.	H	α-helix	trans	-65.3	-42.1	170.7	0	0	0	0	0	112.1	K647 R648 V649 T653 K654 H655	K647-G651 PolarHBondContact O-N 3.13Å; R648-G651 PolarHBondContact O-N 3.46Å; V649-G651 VanDerWaalsContact C-N 3.34Å; V649-G651 PolarHBondContact O-N 3.34Å; G651-T653 VanDerWaalsContact C-N 3.33Å; G651-T653 PolarHBondContact O-N 2.94Å; G651-K654 PolarHBondContact O-N 2.91Å; G651-H655 PolarHBondContact O-CD2 2.99Å; G651-H655 PolarHBondContact O-N 3.29Å
652	H	42.3	Very low	39.1	Very low	141 Å²	141	99.3 Å²	99.3	65%	0.653	51%	0.51	S	S	*	.	H	α-helix	trans	-69.2	-25	177.5	-76.5	-63.1	0	0	0	113.7	R648 V649 K654	R648-H652 PolarHBondContact O-CD2 2.97Å; R648-H652 PolarHBondContact O-N 3.43Å; V649-H652 PolarHBondContact O-N 3.48Å; H652-K654 VanDerWaalsContact C-N 3.31Å
653	T	38.3	Very low	38.6	Very low	64 Å²	64	103.7 Å²	103.7	39%	0.393	53%	0.53	S	S	.	.	H	α-helix	trans	-77.8	-12.7	172.3	58.1	0	0	0	0	113.9	V649 I650 G651 N670	V649-T653 PolarHBondContact O-N 3.34Å; I650-T653 PolarHBondContact O-OG1 3.45Å; G651-T653 VanDerWaalsContact C-N 3.33Å; G651-T653 PolarHBondContact O-N 2.94Å; T653-N670 HydrophobicContact CG2-CB 4.26Å
654	K	35.5	Very low	38.2	Very low	173 Å²	173	107.6 Å²	107.6	75%	0.752	56%	0.556	S	S	*	*	H	α-helix	trans	-106.1	-7.1	177.9	-68.6	-170.4	176.1	-175.8	0	115.3	G651 H652	G651-K654 PolarHBondContact O-N 2.91Å; H652-K654 VanDerWaalsContact C-N 3.31Å
655	H	33.6	Very low	37.8	Very low	158 Å²	158	108.5 Å²	108.5	73%	0.731	56%	0.564	S	S	*	*			trans	-109.7	90.1	174.6	-73.3	-65.6	0	0	0	112.1	G651	G651-H655 PolarHBondContact O-CD2 2.99Å; G651-H655 PolarHBondContact O-N 3.29Å
656	R	34.1	Very low	38.2	Very low	136 Å²	136	108.5 Å²	108.5	51%	0.513	56%	0.562	S	S	.	*			trans	-131	152	157.7	-71	-166.6	175.7	-174.2	-0.1	110.2	D666	R656-D666 IonicContact CZ-OD2 2.59Å; R656-D666 IonicContact NH1-OD2 2.56Å; R656-D666 PolarHBondContact NH1-OD2 3.49Å; R656-D666 IonicContact NH2-OD2 2.63Å; R656-D666 PolarHBondContact NH2-OD2 2.91Å
657	L	25.5	Very low	38.5	Very low	117 Å²	117	112.6 Å²	112.6	61%	0.613	57%	0.573	S	S	*	*			trans	-77.7	156.8	-149.2	-53.8	70.7	0	0	0	113.4	M660	L657-M660 HydrophobicContact CB-CB 4.19Å; L657-M660 HydrophobicContact CD1-CB 4.13Å; L657-M660 HydrophobicContact CD2-CB 4.35Å; L657-M660 HydrophobicContact CG-CB 4.46Å
658	P	26.9	Very low	38.7	Very low	111 Å²	111	111.3 Å²	111.3	72%	0.721	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	140.4	142.7	30.4	-33	0	0	0	109.2	M660	P658-M660 PolarHBondContact O-N 3.12Å
659	D	32.5	Very low	39.3	Very low	165 Å²	165	107.3 Å²	107.3	88%	0.882	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.6	22.1	175.1	-48.6	-23.8	0	0	0	117.6
660	M	26.4	Very low	40.1	Very low	113 Å²	113	107.7 Å²	107.7	56%	0.557	56%	0.56	S	S	*	*			trans	-130.2	107.9	163.5	-120.8	-66.6	-178	0	0	111.9	L657 P658 C662	L657-M660 HydrophobicContact CB-CB 4.19Å; L657-M660 HydrophobicContact CD1-CB 4.13Å; L657-M660 HydrophobicContact CD2-CB 4.35Å; L657-M660 HydrophobicContact CG-CB 4.46Å; P658-M660 PolarHBondContact O-N 3.12Å; M660-C662 PolarHBondContact O-N 3.07Å
661	P	32.9	Very low	40.9	Very low	119 Å²	119	105.7 Å²	105.7	77%	0.773	55%	0.55	S	S	*	.			trans	-79.4	119.5	-179.1	30.9	-32.9	0	0	0	111.1
662	C	32.2	Very low	42	Very low	63 Å²	63	108.1 Å²	108.1	43%	0.426	56%	0.556	S	S	.	*			trans	-132.6	87.5	-169.9	-65.7	0	0	0	0	114.4	M660	M660-C662 PolarHBondContact O-N 3.07Å
663	L	33	Very low	43.1	Very low	135 Å²	135	105 Å²	105	71%	0.707	54%	0.543	S	S	*	.			trans	25	113.9	147.1	-70.9	156.5	0	0	0	118.7	T665 D666	L663-T665 PolarHBondContact O-N 3.07Å; L663-D666 PolarHBondContact O-N 2.95Å
664	T	39.5	Very low	44.3	Very low	123 Å²	123	102.8 Å²	102.8	76%	0.755	53%	0.53	S	S	*	.	H	α-helix	trans	-59.5	-25.5	177.2	46.7	0	0	0	0	115.1	D666 R667 K668	T664-D666 VanDerWaalsContact C-N 3.33Å; T664-D666 PolarHBondContact O-N 3.35Å; T664-R667 PolarHBondContact O-N 3.36Å; T664-K668 PolarHBondContact O-N 3.18Å
665	T	42.3	Very low	45.8	Very low	98 Å²	98	95.4 Å²	95.4	60%	0.601	50%	0.499	S	S	*	.	H	α-helix	trans	-60.9	-39.5	176.4	41.1	0	0	0	0	112.6	L663 R667 K668 L669	L663-T665 PolarHBondContact O-N 3.07Å; T665-R667 PolarHBondContact O-N 3.01Å; T665-K668 PolarHBondContact O-N 3.31Å; T665-L669 PolarHBondContact O-N 2.85Å; T665-L669 VanDerWaalsContact O-N 3.09Å
666	D	55.6	Low	47.4	Very low	56 Å²	56	92.5 Å²	92.5	30%	0.299	49%	0.488	S	S	.	.	H	α-helix	trans	-71.4	-32.2	-176.2	-161	21.8	0	0	0	111.4	R656 L663 T664 N670	R656-D666 IonicContact CZ-OD2 2.59Å; R656-D666 IonicContact NH1-OD2 2.56Å; R656-D666 PolarHBondContact NH1-OD2 3.49Å; R656-D666 IonicContact NH2-OD2 2.63Å; R656-D666 PolarHBondContact NH2-OD2 2.91Å; L663-D666 PolarHBondContact O-N 2.95Å; T664-D666 VanDerWaalsContact C-N 3.33Å; T664-D666 PolarHBondContact O-N 3.35Å; D666-N670 WeakPolarHBondContact O-CB 3.35Å; D666-N670 PolarHBondContact O-N 3.12Å; D666-N670 PolarHBondContact O-ND2 3.35Å; D666-N670 PolarHBondContact OD1-ND2 3.47Å
667	R	50.8	Low	49	Very low	148 Å²	148	89.8 Å²	89.8	56%	0.558	48%	0.483	S	S	*	.	H	α-helix	trans	-66	-44.1	171.8	-175.1	174.2	176.1	162.9	-1.2	111.8	T664 T665 L669 N670 N671 E730	T664-R667 PolarHBondContact O-N 3.36Å; T665-R667 PolarHBondContact O-N 3.01Å; R667-L669 PolarHBondContact O-N 3.45Å; R667-N670 PolarHBondContact O-N 3.05Å; R667-N671 WeakPolarHBondContact O-CB 3.36Å; R667-N671 PolarHBondContact O-N 3.08Å; R667-N671 PolarHBondContact O-OD1 2.78Å; R667-E730 IonicContact CZ-OE1 3.29Å; R667-E730 IonicContact CZ-OE2 2.7Å; R667-E730 IonicContact NE-OE2 2.72Å; R667-E730 PolarHBondContact NE-OE2 3.15Å; R667-E730 VanDerWaalsContact NE-OE2 3.17Å; R667-E730 IonicContact NH2-OE1 2.99Å; R667-E730 PolarHBondContact NH2-OE1 2.78Å; R667-E730 IonicContact NH2-OE2 3.69Å; R667-E730 PolarHBondContact NH2-OE2 3.49Å
668	K	56.2	Low	50.7	Low	113 Å²	113	85.9 Å²	85.9	49%	0.491	47%	0.465	S	S	.	.	H	α-helix	trans	-63.6	-40	177.4	-70.2	-155	173.9	-154.2	0	112.1	T664 T665 N671 L672	T664-K668 PolarHBondContact O-N 3.18Å; T665-K668 PolarHBondContact O-N 3.31Å; K668-N671 PolarHBondContact O-N 3.26Å; K668-L672 WeakPolarHBondContact O-CB 3.36Å; K668-L672 PolarHBondContact O-N 3.45Å
669	L	59.5	Low	52.6	Low	94 Å²	94	83.3 Å²	83.3	49%	0.492	45%	0.45	S	S	.	.	H	α-helix	trans	-65.8	-45	176.4	-176.7	61	0	0	0	112.4	T665 R667 L672 I673	T665-L669 PolarHBondContact O-N 2.85Å; T665-L669 VanDerWaalsContact O-N 3.09Å; R667-L669 PolarHBondContact O-N 3.45Å; L669-L672 PolarHBondContact O-N 3.35Å; L669-I673 HydrophobicContact CD1-CD1 4.1Å; L669-I673 HydrophobicContact CD1-CG1 4.39Å; L669-I673 HydrophobicContact CG-CD1 3.96Å; L669-I673 WeakPolarHBondContact O-CG1 3.44Å; L669-I673 PolarHBondContact O-N 2.76Å
670	N	59.9	Low	54.1	Low	55 Å²	55	79.8 Å²	79.8	29%	0.294	43%	0.43	S	S	.	.	H	α-helix	trans	-65.5	-38.7	176.7	-78.9	-76.4	0	0	0	112.3	T653 D666 R667 I673 T674	T653-N670 HydrophobicContact CG2-CB 4.26Å; D666-N670 WeakPolarHBondContact O-CB 3.35Å; D666-N670 PolarHBondContact O-N 3.12Å; D666-N670 PolarHBondContact O-ND2 3.35Å; D666-N670 PolarHBondContact OD1-ND2 3.47Å; R667-N670 PolarHBondContact O-N 3.05Å; N670-I673 PolarHBondContact O-N 3.27Å; N670-T674 WeakPolarHBondContact O-CB 3.38Å; N670-T674 PolarHBondContact O-N 3.06Å; N670-T674 PolarHBondContact O-OG1 2.86Å
671	N	61.7	Low	55.9	Low	10 Å²	10	76.5 Å²	76.5	5%	0.053	41%	0.414	C	S	.	.	H	α-helix	trans	-62.8	-41.9	172.9	-76.6	11.8	0	0	0	111.2	R667 K668 T674 L675 L727 E730 L731	R667-N671 WeakPolarHBondContact O-CB 3.36Å; R667-N671 PolarHBondContact O-N 3.08Å; R667-N671 PolarHBondContact O-OD1 2.78Å; K668-N671 PolarHBondContact O-N 3.26Å; N671-T674 PolarHBondContact O-N 3.39Å; N671-L675 WeakPolarHBondContact O-CB 3.49Å; N671-L675 PolarHBondContact O-N 3.13Å; N671-L727 HydrophobicContact CB-CD2 3.91Å; N671-E730 PolarHBondContact ND2-OE2 2.95Å; N671-E730 VanDerWaalsContact ND2-OE2 3.13Å; N671-L731 HydrophobicContact CB-CD1 4.21Å; N671-L731 HydrophobicContact CB-CD2 3.8Å; N671-L731 HydrophobicContact CB-CG 4.09Å
672	L	63.6	Low	57.4	Low	78 Å²	78	73.3 Å²	73.3	41%	0.408	39%	0.394	S	S	.	.	H	α-helix	trans	-65.3	-43.1	176.4	-178.4	66.6	0	0	0	112.9	K668 L669 T674 L675 L676	K668-L672 WeakPolarHBondContact O-CB 3.36Å; K668-L672 PolarHBondContact O-N 3.45Å; L669-L672 PolarHBondContact O-N 3.35Å; L672-T674 VanDerWaalsContact C-N 3.32Å; L672-L675 WeakPolarHBondContact O-CB 3.49Å; L672-L675 PolarHBondContact O-N 3.31Å; L672-L676 HydrophobicContact CG-CD1 4.29Å; L672-L676 WeakPolarHBondContact O-CG 3.42Å; L672-L676 PolarHBondContact O-N 3.36Å
673	I	65.4	Low	58.9	Low	75 Å²	75	78.8 Å²	78.8	39%	0.385	41%	0.407	S	S	.	.	H	α-helix	trans	-64.6	-39.9	175.7	-68.8	167.7	0	0	0	110.3	L669 N670 L676 L677	L669-I673 HydrophobicContact CD1-CD1 4.1Å; L669-I673 HydrophobicContact CD1-CG1 4.39Å; L669-I673 HydrophobicContact CG-CD1 3.96Å; L669-I673 WeakPolarHBondContact O-CG1 3.44Å; L669-I673 PolarHBondContact O-N 2.76Å; N670-I673 PolarHBondContact O-N 3.27Å; I673-L676 PolarHBondContact O-N 3.48Å; I673-L677 HydrophobicContact CG2-CD1 3.94Å; I673-L677 HydrophobicContact CG2-CG 4.46Å; I673-L677 WeakPolarHBondContact O-CB 3.49Å; I673-L677 VanDerWaalsContact O-CG 3.31Å; I673-L677 WeakPolarHBondContact O-CG 3.46Å; I673-L677 PolarHBondContact O-N 3.03Å
674	T	64.1	Low	60.2	Low	18 Å²	18	79 Å²	79	11%	0.11	40%	0.403	C	S	.	.	H	α-helix	trans	-63.9	-42.1	174.6	-56.1	0	0	0	0	111.3	V649 N670 N671 L672 L677 S678 L727	V649-T674 HydrophobicContact CG1-CG2 4.35Å; V649-T674 WeakPolarHBondContact CG1-OG1 3.27Å; N670-T674 WeakPolarHBondContact O-CB 3.38Å; N670-T674 PolarHBondContact O-N 3.06Å; N670-T674 PolarHBondContact O-OG1 2.86Å; N671-T674 PolarHBondContact O-N 3.39Å; L672-T674 VanDerWaalsContact C-N 3.32Å; T674-L677 PolarHBondContact O-N 3.32Å; T674-S678 WeakPolarHBondContact O-CB 3.49Å; T674-S678 PolarHBondContact O-N 3.11Å; T674-S678 PolarHBondContact O-OG 3.19Å; T674-L727 HydrophobicContact CG2-CD1 4.23Å
675	L	66	Low	61.3	Low	19 Å²	19	75.2 Å²	75.2	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-59.2	-53	174.6	-164.3	81.2	0	0	0	110.6	N671 L672 L677 S678 C679 Y724 L731	N671-L675 WeakPolarHBondContact O-CB 3.49Å; N671-L675 PolarHBondContact O-N 3.13Å; L672-L675 WeakPolarHBondContact O-CB 3.49Å; L672-L675 PolarHBondContact O-N 3.31Å; L675-L677 PolarHBondContact O-N 3.48Å; L675-S678 PolarHBondContact O-N 3.06Å; L675-S678 VanDerWaalsContact O-N 3.12Å; L675-S678 PolarHBondContact O-OG 2.94Å; L675-C679 PolarHBondContact O-N 3.21Å; L675-C679 PolarHBondContact O-SG 2.8Å; L675-Y724 HydrophobicContact CD1-CD2 3.78Å; L675-Y724 HydrophobicContact CD1-CE2 3.56Å; L675-Y724 HydrophobicContact CG-CE2 4.41Å; L675-L731 HydrophobicContact CD2-CD1 4.31Å
676	L	66.6	Low	62.2	Low	96 Å²	96	73.9 Å²	73.9	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-59	-45.2	178.5	-72.9	168.6	0	0	0	112.4	L672 I673 S678 C679 I680	L672-L676 HydrophobicContact CG-CD1 4.29Å; L672-L676 WeakPolarHBondContact O-CG 3.42Å; L672-L676 PolarHBondContact O-N 3.36Å; I673-L676 PolarHBondContact O-N 3.48Å; L676-S678 VanDerWaalsContact C-N 3.34Å; L676-S678 PolarHBondContact O-N 2.73Å; L676-C679 PolarHBondContact O-N 3.01Å; L676-I680 WeakPolarHBondContact O-CB 3.47Å; L676-I680 WeakPolarHBondContact O-CD1 3.45Å; L676-I680 VanDerWaalsContact O-CG1 3.22Å; L676-I680 WeakPolarHBondContact O-CG1 3.25Å; L676-I680 PolarHBondContact O-N 3.27Å
677	L	68.2	Low	62.3	Low	79 Å²	79	75 Å²	75	41%	0.414	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-39.9	175	-74.2	169.7	0	0	0	111.8	I673 T674 L675 I681	I673-L677 HydrophobicContact CG2-CD1 3.94Å; I673-L677 HydrophobicContact CG2-CG 4.46Å; I673-L677 WeakPolarHBondContact O-CB 3.49Å; I673-L677 VanDerWaalsContact O-CG 3.31Å; I673-L677 WeakPolarHBondContact O-CG 3.46Å; I673-L677 PolarHBondContact O-N 3.03Å; T674-L677 PolarHBondContact O-N 3.32Å; L675-L677 PolarHBondContact O-N 3.48Å; L677-I681 WeakPolarHBondContact O-CB 3.35Å; L677-I681 VanDerWaalsContact O-CG1 3.23Å; L677-I681 WeakPolarHBondContact O-CG1 3.29Å; L677-I681 PolarHBondContact O-N 3.28Å
678	S	62.2	Low	62.9	Low	35 Å²	35	72 Å²	72	25%	0.245	38%	0.376	C	S	.	.	H	α-helix	trans	-65.3	-44	175.9	76.4	0	0	0	0	111.7	T674 L675 L676 I681 C682	T674-S678 WeakPolarHBondContact O-CB 3.49Å; T674-S678 PolarHBondContact O-N 3.11Å; T674-S678 PolarHBondContact O-OG 3.19Å; L675-S678 PolarHBondContact O-N 3.06Å; L675-S678 VanDerWaalsContact O-N 3.12Å; L675-S678 PolarHBondContact O-OG 2.94Å; L676-S678 VanDerWaalsContact C-N 3.34Å; L676-S678 PolarHBondContact O-N 2.73Å; S678-I681 PolarHBondContact O-N 2.63Å; S678-C682 VanDerWaalsContact O-CB 3.31Å; S678-C682 WeakPolarHBondContact O-CB 3.47Å; S678-C682 PolarHBondContact O-N 3.44Å; S678-C682 PolarHBondContact O-SG 3.03Å
679	C	65.2	Low	62.9	Low	58 Å²	58	68.4 Å²	68.4	39%	0.392	36%	0.362	S	S	.	.	H	α-helix	trans	-63.6	-43	176.3	-66.3	0	0	0	0	111.9	L675 L676 C682 Y683	L675-C679 PolarHBondContact O-N 3.21Å; L675-C679 PolarHBondContact O-SG 2.8Å; L676-C679 PolarHBondContact O-N 3.01Å; C679-C682 PolarHBondContact O-N 2.72Å; C679-Y683 WeakPolarHBondContact O-CB 3.32Å; C679-Y683 PolarHBondContact O-N 2.99Å
680	I	65.4	Low	62.7	Low	90 Å²	90	68.9 Å²	68.9	46%	0.462	36%	0.363	S	S	.	.	H	α-helix	trans	-62.6	-48.1	175.7	-71.1	165.3	0	0	0	110.5	L676 C682 Y683 F684	L676-I680 WeakPolarHBondContact O-CB 3.47Å; L676-I680 WeakPolarHBondContact O-CD1 3.45Å; L676-I680 VanDerWaalsContact O-CG1 3.22Å; L676-I680 WeakPolarHBondContact O-CG1 3.25Å; L676-I680 PolarHBondContact O-N 3.27Å; I680-C682 VanDerWaalsContact C-N 3.34Å; I680-C682 PolarHBondContact O-N 2.69Å; I680-Y683 PolarHBondContact O-N 3.44Å; I680-F684 HydrophobicContact CG2-CD2 3.89Å; I680-F684 HydrophobicContact CG2-CE2 4.15Å; I680-F684 WeakPolarHBondContact O-CD2 3.29Å; I680-F684 PolarHBondContact O-N 3.48Å
681	I	64	Low	62.6	Low	45 Å²	45	71.3 Å²	71.3	23%	0.231	37%	0.372	C	S	.	.	H	α-helix	trans	-62.2	-43.8	178.3	-70.7	169.5	0	0	0	110.1	I646 L677 S678 T685	I646-I681 HydrophobicContact CD1-CD1 3.96Å; I646-I681 HydrophobicContact CG1-CD1 4.18Å; L677-I681 WeakPolarHBondContact O-CB 3.35Å; L677-I681 VanDerWaalsContact O-CG1 3.23Å; L677-I681 WeakPolarHBondContact O-CG1 3.29Å; L677-I681 PolarHBondContact O-N 3.28Å; S678-I681 PolarHBondContact O-N 2.63Å; I681-T685 HydrophobicContact CG2-CG2 4.17Å; I681-T685 VanDerWaalsContact O-CB 3.25Å; I681-T685 WeakPolarHBondContact O-CB 3.4Å; I681-T685 VanDerWaalsContact O-CG2 3.31Å; I681-T685 WeakPolarHBondContact O-CG2 3.32Å; I681-T685 PolarHBondContact O-N 3.13Å; I681-T685 PolarHBondContact O-OG1 3.1Å
682	C	63.8	Low	62.1	Low	51 Å²	51	73.1 Å²	73.1	35%	0.345	38%	0.38	S	S	.	.	H	α-helix	trans	-61.4	-49.9	175	-74.1	0	0	0	0	111.7	S678 C679 I680 F684 T685 L686	S678-C682 VanDerWaalsContact O-CB 3.31Å; S678-C682 WeakPolarHBondContact O-CB 3.47Å; S678-C682 PolarHBondContact O-N 3.44Å; S678-C682 PolarHBondContact O-SG 3.03Å; C679-C682 PolarHBondContact O-N 2.72Å; I680-C682 VanDerWaalsContact C-N 3.34Å; I680-C682 PolarHBondContact O-N 2.69Å; C682-F684 VanDerWaalsContact C-N 3.31Å; C682-F684 PolarHBondContact O-N 3.19Å; C682-T685 PolarHBondContact O-N 3.48Å; C682-L686 HydrophobicContact CB-CD1 3.65Å; C682-L686 VanDerWaalsContact O-CB 3.31Å; C682-L686 WeakPolarHBondContact O-CB 3.49Å; C682-L686 WeakPolarHBondContact O-CD1 3.34Å; C682-L686 PolarHBondContact O-N 2.85Å
683	Y	64.9	Low	61.4	Low	178 Å²	178	72.3 Å²	72.3	70%	0.698	38%	0.376	S	S	*	.	H	α-helix	trans	-61.8	-33.6	-177.8	-170.1	-91.6	0	0	0	113.3	C679 I680 P687	C679-Y683 WeakPolarHBondContact O-CB 3.32Å; C679-Y683 PolarHBondContact O-N 2.99Å; I680-Y683 PolarHBondContact O-N 3.44Å; Y683-P687 WeakPolarHBondContact O-CD 3.5Å; Y683-P687 WeakPolarHBondContact O-CG 3.33Å
684	F	59.9	Low	60.7	Low	141 Å²	141	72 Å²	72	62%	0.618	38%	0.38	S	S	*	.	H	α-helix	trans	-89.4	-30.9	175.5	-75.4	-71.3	0	0	0	114.3	I680 C682 V688	I680-F684 HydrophobicContact CG2-CD2 3.89Å; I680-F684 HydrophobicContact CG2-CE2 4.15Å; I680-F684 WeakPolarHBondContact O-CD2 3.29Å; I680-F684 PolarHBondContact O-N 3.48Å; C682-F684 VanDerWaalsContact C-N 3.31Å; C682-F684 PolarHBondContact O-N 3.19Å; F684-V688 WeakPolarHBondContact O-CG2 3.31Å
685	T	61.1	Low	59.9	Low	42 Å²	42	78.1 Å²	78.1	26%	0.258	40%	0.401	S	S	.	.	H	α-helix	trans	-89.9	-37.9	-178	63	0	0	0	0	113.6	I681 C682 V688 I689	I681-T685 HydrophobicContact CG2-CG2 4.17Å; I681-T685 VanDerWaalsContact O-CB 3.25Å; I681-T685 WeakPolarHBondContact O-CB 3.4Å; I681-T685 VanDerWaalsContact O-CG2 3.31Å; I681-T685 WeakPolarHBondContact O-CG2 3.32Å; I681-T685 PolarHBondContact O-N 3.13Å; I681-T685 PolarHBondContact O-OG1 3.1Å; C682-T685 PolarHBondContact O-N 3.48Å; T685-V688 PolarHBondContact O-N 2.95Å; T685-I689 VanDerWaalsContact O-CB 3.28Å; T685-I689 WeakPolarHBondContact O-CB 3.08Å; T685-I689 VanDerWaalsContact O-CG1 3.24Å; T685-I689 WeakPolarHBondContact O-CG1 3.28Å; T685-I689 PolarHBondContact O-N 3.1Å
686	L	62.4	Low	59	Low	71 Å²	71	82.5 Å²	82.5	37%	0.372	42%	0.419	S	S	.	.	H	α-helix	trans	-60.1	-44.9	178.9	-91.3	113	0	0	0	112.6	C682 V688 I689 M690	C682-L686 HydrophobicContact CB-CD1 3.65Å; C682-L686 VanDerWaalsContact O-CB 3.31Å; C682-L686 WeakPolarHBondContact O-CB 3.49Å; C682-L686 WeakPolarHBondContact O-CD1 3.34Å; C682-L686 PolarHBondContact O-N 2.85Å; L686-V688 VanDerWaalsContact C-N 3.32Å; L686-V688 PolarHBondContact O-N 3.4Å; L686-I689 PolarHBondContact O-N 3.31Å; L686-M690 HydrophobicContact CD2-CE 4.21Å; L686-M690 WeakPolarHBondContact O-CB 3.41Å; L686-M690 WeakPolarHBondContact O-CG 3.36Å; L686-M690 PolarHBondContact O-N 2.66Å
687	P	58.4	Low	58.1	Low	78 Å²	78	81.8 Å²	81.8	51%	0.506	42%	0.423	S	S	.	.	H	α-helix	trans	-64	-35	177.4	-26.1	37.3	0	0	0	113.3	Y683 H691	Y683-P687 WeakPolarHBondContact O-CD 3.5Å; Y683-P687 WeakPolarHBondContact O-CG 3.33Å; P687-H691 VanDerWaalsContact O-CB 3.24Å; P687-H691 WeakPolarHBondContact O-CB 3.44Å; P687-H691 PolarHBondContact O-N 2.78Å
688	V	62.3	Low	56.9	Low	85 Å²	85	83.2 Å²	83.2	52%	0.515	43%	0.431	S	S	.	.	H	α-helix	trans	-70.7	-45.6	176	176.2	0	0	0	0	110.8	F684 T685 L686 H691 E692	F684-V688 WeakPolarHBondContact O-CG2 3.31Å; T685-V688 PolarHBondContact O-N 2.95Å; L686-V688 VanDerWaalsContact C-N 3.32Å; L686-V688 PolarHBondContact O-N 3.4Å; V688-H691 PolarHBondContact O-N 2.93Å; V688-E692 WeakPolarHBondContact O-CG 3.46Å; V688-E692 PolarHBondContact O-N 2.9Å
689	I	57.2	Low	55.8	Low	39 Å²	39	82.7 Å²	82.7	20%	0.2	43%	0.431	C	S	.	.	H	α-helix	trans	-63.6	-44	176.9	-72.2	168	0	0	0	110.4	T685 L686 E692 I693 I713	T685-I689 VanDerWaalsContact O-CB 3.28Å; T685-I689 WeakPolarHBondContact O-CB 3.08Å; T685-I689 VanDerWaalsContact O-CG1 3.24Å; T685-I689 WeakPolarHBondContact O-CG1 3.28Å; T685-I689 PolarHBondContact O-N 3.1Å; L686-I689 PolarHBondContact O-N 3.31Å; I689-E692 PolarHBondContact O-N 2.71Å; I689-I693 HydrophobicContact CG2-CD1 3.61Å; I689-I693 HydrophobicContact CG2-CG1 4.33Å; I689-I693 VanDerWaalsContact O-CB 3.31Å; I689-I693 WeakPolarHBondContact O-CB 3.45Å; I689-I693 WeakPolarHBondContact O-CG1 3.38Å; I689-I693 PolarHBondContact O-N 2.85Å; I689-I713 HydrophobicContact CG2-CD1 3.92Å
690	M	54.5	Low	54.6	Low	103 Å²	103	82.4 Å²	82.4	51%	0.507	43%	0.429	S	S	.	.	H	α-helix	trans	-67.4	-36	176.2	-71.5	-65.2	-174.4	0	0	111.9	L686 S694	L686-M690 HydrophobicContact CD2-CE 4.21Å; L686-M690 WeakPolarHBondContact O-CB 3.41Å; L686-M690 WeakPolarHBondContact O-CG 3.36Å; L686-M690 PolarHBondContact O-N 2.66Å; M690-S694 VanDerWaalsContact O-CB 3.28Å; M690-S694 WeakPolarHBondContact O-CB 3.34Å; M690-S694 PolarHBondContact O-N 3.34Å; M690-S694 PolarHBondContact O-OG 3.33Å
691	H	57.1	Low	53.3	Low	106 Å²	106	82.3 Å²	82.3	49%	0.491	43%	0.428	S	S	.	.	H	α-helix	trans	-67.4	-40.4	174.4	-172.2	58.7	0	0	0	112.3	P687 V688 S694 R695	P687-H691 VanDerWaalsContact O-CB 3.24Å; P687-H691 WeakPolarHBondContact O-CB 3.44Å; P687-H691 PolarHBondContact O-N 2.78Å; V688-H691 PolarHBondContact O-N 2.93Å; H691-S694 PolarHBondContact O-N 3.49Å; H691-R695 PolarHBondContact CD2-NE 3.34Å; H691-R695 VanDerWaalsContact CD2-NE 3.32Å; H691-R695 PolarHBondContact NE2-NE 2.86Å; H691-R695 PolarHBondContact NE2-NH2 3.39Å; H691-R695 WeakPolarHBondContact O-CD 3.32Å; H691-R695 VanDerWaalsContact O-CG 3.29Å; H691-R695 WeakPolarHBondContact O-CG 3.16Å; H691-R695 PolarHBondContact O-N 2.98Å
692	E	51.4	Low	52.3	Low	49 Å²	49	88.6 Å²	88.6	23%	0.229	45%	0.45	C	S	.	.	H	α-helix	trans	-69.1	-43.3	173.4	-62.9	-78.7	-136.1	0	0	111.2	K635 V688 I689 S694 R695 F696	K635-E692 IonicContact NZ-OE1 2.66Å; K635-E692 PolarHBondContact NZ-OE1 3.49Å; V688-E692 WeakPolarHBondContact O-CG 3.46Å; V688-E692 PolarHBondContact O-N 2.9Å; I689-E692 PolarHBondContact O-N 2.71Å; E692-S694 VanDerWaalsContact C-N 3.25Å; E692-S694 PolarHBondContact O-N 3.05Å; E692-R695 CarbonylContact O-C 3.59Å; E692-R695 WeakPolarHBondContact O-CA 3.37Å; E692-R695 WeakPolarHBondContact O-CB 3.46Å; E692-R695 PolarHBondContact O-N 3.2Å; E692-R695 VanDerWaalsContact O-N 3.08Å; E692-R695 WeakPolarHBondContact OE2-CD 3.5Å; E692-R695 IonicContact OE2-NE 3.41Å; E692-R695 IonicContact OE2-NH1 3.14Å; E692-F696 HydrophobicContact CB-CD2 4.47Å; E692-F696 HydrophobicContact CB-CE2 4.49Å; E692-F696 WeakPolarHBondContact O-CD2 3.26Å; E692-F696 PolarHBondContact O-N 3.06Å
693	I	49.8	Very low	51.4	Low	60 Å²	60	90.1 Å²	90.1	31%	0.308	46%	0.455	S	S	.	.	H	α-helix	trans	-58.2	-38.9	172.7	-73.1	170.4	0	0	0	110.9	I689 F696 S697	I689-I693 HydrophobicContact CG2-CD1 3.61Å; I689-I693 HydrophobicContact CG2-CG1 4.33Å; I689-I693 VanDerWaalsContact O-CB 3.31Å; I689-I693 WeakPolarHBondContact O-CB 3.45Å; I689-I693 WeakPolarHBondContact O-CG1 3.38Å; I689-I693 PolarHBondContact O-N 2.85Å; I693-F696 CarbonylContact O-C 3.57Å; I693-F696 PolarHBondContact O-N 3.29Å; I693-S697 WeakPolarHBondContact O-CB 3.48Å; I693-S697 PolarHBondContact O-N 3.01Å
694	S	50.6	Low	50.5	Low	68 Å²	68	84.7 Å²	84.7	48%	0.476	44%	0.443	S	S	.	.	H	α-helix	trans	-63.7	-43.9	174.6	-60.1	0	0	0	0	111.3	M690 H691 E692 F696 S697	M690-S694 VanDerWaalsContact O-CB 3.28Å; M690-S694 WeakPolarHBondContact O-CB 3.34Å; M690-S694 PolarHBondContact O-N 3.34Å; M690-S694 PolarHBondContact O-OG 3.33Å; H691-S694 PolarHBondContact O-N 3.49Å; E692-S694 VanDerWaalsContact C-N 3.25Å; E692-S694 PolarHBondContact O-N 3.05Å; S694-F696 PolarHBondContact O-N 3.23Å; S694-S697 WeakPolarHBondContact O-CB 3.37Å; S694-S697 PolarHBondContact O-N 2.85Å; S694-S697 PolarHBondContact O-OG 3.26Å
695	R	47.7	Very low	49.8	Very low	148 Å²	148	81.5 Å²	81.5	56%	0.558	44%	0.438	S	S	*	.	H	α-helix	trans	-62	-39.4	173.7	-70.2	159.2	165.9	-117.9	-10	112.8	H691 E692	H691-R695 PolarHBondContact CD2-NE 3.34Å; H691-R695 VanDerWaalsContact CD2-NE 3.32Å; H691-R695 PolarHBondContact NE2-NE 2.86Å; H691-R695 PolarHBondContact NE2-NH2 3.39Å; H691-R695 WeakPolarHBondContact O-CD 3.32Å; H691-R695 VanDerWaalsContact O-CG 3.29Å; H691-R695 WeakPolarHBondContact O-CG 3.16Å; H691-R695 PolarHBondContact O-N 2.98Å; E692-R695 CarbonylContact O-C 3.59Å; E692-R695 WeakPolarHBondContact O-CA 3.37Å; E692-R695 WeakPolarHBondContact O-CB 3.46Å; E692-R695 PolarHBondContact O-N 3.2Å; E692-R695 VanDerWaalsContact O-N 3.08Å; E692-R695 WeakPolarHBondContact OE2-CD 3.5Å; E692-R695 IonicContact OE2-NE 3.41Å; E692-R695 IonicContact OE2-NH1 3.14Å
696	F	46.4	Very low	49.3	Very low	110 Å²	110	81.7 Å²	81.7	48%	0.482	44%	0.44	S	S	.	.	H	α-helix	trans	-76.6	-22.8	176.1	-74.6	-67.2	0	0	0	113.1	E692 I693 S694 D698	E692-F696 HydrophobicContact CB-CD2 4.47Å; E692-F696 HydrophobicContact CB-CE2 4.49Å; E692-F696 WeakPolarHBondContact O-CD2 3.26Å; E692-F696 PolarHBondContact O-N 3.06Å; I693-F696 CarbonylContact O-C 3.57Å; I693-F696 PolarHBondContact O-N 3.29Å; S694-F696 PolarHBondContact O-N 3.23Å; F696-D698 PolarHBondContact O-N 2.89Å
697	S	47.6	Very low	48.9	Very low	82 Å²	82	83.3 Å²	83.3	57%	0.573	45%	0.448	S	S	*	.	H	α-helix	trans	-65.8	-15.2	174.5	80.7	0	0	0	0	112.9	I693 S694 G699	I693-S697 WeakPolarHBondContact O-CB 3.48Å; I693-S697 PolarHBondContact O-N 3.01Å; S694-S697 WeakPolarHBondContact O-CB 3.37Å; S694-S697 PolarHBondContact O-N 2.85Å; S694-S697 PolarHBondContact O-OG 3.26Å; S697-G699 PolarHBondContact O-N 3.14Å
698	D	42.2	Very low	49	Very low	108 Å²	108	85.9 Å²	85.9	58%	0.578	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	27.8	-179.1	-117.4	-34	0	0	0	115.1	K321 F696	K321-D698 WeakPolarHBondContact CD-O 3.31Å; K321-D698 WeakPolarHBondContact CE-O 3.39Å; K321-D698 WeakPolarHBondContact CE-OD1 3.38Å; K321-D698 PolarHBondContact NZ-O 2.91Å; K321-D698 IonicContact NZ-OD1 2.69Å; K321-D698 PolarHBondContact NZ-OD1 2.88Å; F696-D698 PolarHBondContact O-N 2.89Å
699	G	40.7	Very low	48.6	Very low	24 Å²	24	86.3 Å²	86.3	25%	0.247	45%	0.446	C	S	.	.	S	Bend	trans	82.1	19.2	151.7	0	0	0	0	0	116.8	K325 S697	K325-G699 WeakPolarHBondContact CE-O 3.33Å; K325-G699 PolarHBondContact NZ-O 3.14Å; S697-G699 PolarHBondContact O-N 3.14Å
700	S	39	Very low	48.4	Very low	52 Å²	52	90.7 Å²	90.7	36%	0.364	46%	0.461	S	S	.	.	S	Bend	trans	-59.4	168.8	147.5	47.3	0	0	0	0	110.1
701	M	38	Very low	48.7	Very low	88 Å²	88	89 Å²	89	43%	0.433	46%	0.46	S	S	.	.			trans	-73.5	142.2	-173.4	-65.3	166.3	68.1	0	0	110.9	K325 Y364 D703	K325-M701 HydrophobicContact CD-CG 4.21Å; Y364-M701 HydrophobicContact CD1-CE 4.33Å; Y364-M701 HydrophobicContact CD2-CE 4.14Å; Y364-M701 HydrophobicContact CE1-CE 3.93Å; Y364-M701 HydrophobicContact CE1-CG 4.16Å; Y364-M701 HydrophobicContact CE1-SD 4.46Å; Y364-M701 HydrophobicContact CE2-CE 3.72Å; Y364-M701 HydrophobicContact CG-CE 4.42Å; Y364-M701 WeakPolarHBondContact OH-CG 3.47Å; M701-D703 VanDerWaalsContact C-N 3.3Å; M701-D703 PolarHBondContact O-N 2.79Å
702	Y	44.3	Very low	48.7	Very low	177 Å²	177	89.9 Å²	89.9	69%	0.694	46%	0.459	S	S	*	.			trans	-65.3	94.5	159.6	-75.1	-87.1	0	0	0	108.1	L707	Y702-L707 HydrophobicContact CD1-CD1 4.45Å
703	D	45	Very low	48.8	Very low	84 Å²	84	88.9 Å²	88.9	45%	0.449	46%	0.455	S	S	.	.			trans	-68	155.6	167.1	179.7	28.6	0	0	0	109.7	M701 S705 T706 L707	M701-D703 VanDerWaalsContact C-N 3.3Å; M701-D703 PolarHBondContact O-N 2.79Å; D703-S705 PolarHBondContact O-N 3.06Å; D703-S705 WeakPolarHBondContact OD2-CB 3.44Å; D703-S705 PolarHBondContact OD2-N 2.88Å; D703-S705 PolarHBondContact OD2-OG 3Å; D703-T706 WeakPolarHBondContact O-CB 3.37Å; D703-T706 PolarHBondContact O-N 2.87Å; D703-L707 PolarHBondContact O-N 3.41Å
704	S	45.9	Very low	49.3	Very low	63 Å²	63	94.5 Å²	94.5	44%	0.441	47%	0.473	S	S	.	.	H	α-helix	trans	-52.9	-36.4	171	-169.4	0	0	0	0	110.8	L707 K708	S704-L707 PolarHBondContact O-N 3.42Å; S704-K708 VanDerWaalsContact O-CB 3.29Å; S704-K708 WeakPolarHBondContact O-CB 3.46Å; S704-K708 WeakPolarHBondContact O-CD 3.4Å; S704-K708 WeakPolarHBondContact O-CG 3.34Å; S704-K708 PolarHBondContact O-N 3.44Å; S704-K708 WeakPolarHBondContact OG-CE 3.43Å; S704-K708 PolarHBondContact OG-NZ 3.41Å
705	S	45.2	Very low	49.8	Very low	74 Å²	74	96.8 Å²	96.8	52%	0.517	48%	0.475	S	S	.	.	H	α-helix	trans	-61	-45.9	173.5	-45.5	0	0	0	0	112.3	D703 K708 F709	D703-S705 PolarHBondContact O-N 3.06Å; D703-S705 WeakPolarHBondContact OD2-CB 3.44Å; D703-S705 PolarHBondContact OD2-N 2.88Å; D703-S705 PolarHBondContact OD2-OG 3Å; S705-K708 PolarHBondContact O-N 3.23Å; S705-F709 VanDerWaalsContact O-CB 3.27Å; S705-F709 WeakPolarHBondContact O-CB 3.4Å; S705-F709 PolarHBondContact O-N 3.26Å
706	T	50.2	Low	50.2	Low	47 Å²	47	93 Å²	93	29%	0.288	47%	0.466	S	S	.	.	H	α-helix	trans	-65.8	-40.9	178.3	-44.2	0	0	0	0	111.6	D703 F709 Y710	D703-T706 WeakPolarHBondContact O-CB 3.37Å; D703-T706 PolarHBondContact O-N 2.87Å; T706-F709 PolarHBondContact O-N 2.93Å; T706-Y710 WeakPolarHBondContact O-CB 3.49Å; T706-Y710 PolarHBondContact O-N 3.25Å
707	L	53.7	Low	50.8	Low	105 Å²	105	91.1 Å²	91.1	55%	0.55	46%	0.463	S	S	.	.	H	α-helix	trans	-68.5	-40.3	178.1	-159.3	77	0	0	0	111.8	Y702 D703 S704 Y710 S711	Y702-L707 HydrophobicContact CD1-CD1 4.45Å; D703-L707 PolarHBondContact O-N 3.41Å; S704-L707 PolarHBondContact O-N 3.42Å; L707-Y710 PolarHBondContact O-N 3.15Å; L707-S711 PolarHBondContact O-N 3.4Å; L707-S711 PolarHBondContact O-OG 3.42Å
708	K	60.7	Low	51.4	Low	132 Å²	132	93.1 Å²	93.1	57%	0.574	46%	0.462	S	S	*	.	H	α-helix	trans	-64.9	-38.6	172.4	-75.4	164.4	178.4	152.7	0	112.2	S704 S705 S711 Y712	S704-K708 VanDerWaalsContact O-CB 3.29Å; S704-K708 WeakPolarHBondContact O-CB 3.46Å; S704-K708 WeakPolarHBondContact O-CD 3.4Å; S704-K708 WeakPolarHBondContact O-CG 3.34Å; S704-K708 PolarHBondContact O-N 3.44Å; S704-K708 WeakPolarHBondContact OG-CE 3.43Å; S704-K708 PolarHBondContact OG-NZ 3.41Å; S705-K708 PolarHBondContact O-N 3.23Å; K708-S711 WeakPolarHBondContact CA-OG 3.27Å; K708-S711 PolarHBondContact O-OG 2.88Å; K708-Y712 WeakPolarHBondContact O-CB 3.43Å; K708-Y712 PolarHBondContact O-N 2.96Å
709	F	52.9	Low	52.3	Low	93 Å²	93	91.4 Å²	91.4	41%	0.408	45%	0.452	S	S	.	.	H	α-helix	trans	-67.2	-40.3	175	-174.8	-107.7	0	0	0	111.6	S705 T706 Y712 I713	S705-F709 VanDerWaalsContact O-CB 3.27Å; S705-F709 WeakPolarHBondContact O-CB 3.4Å; S705-F709 PolarHBondContact O-N 3.26Å; T706-F709 PolarHBondContact O-N 2.93Å; F709-Y712 PolarHBondContact O-N 3.42Å; F709-I713 HydrophobicContact CD1-CD1 3.95Å; F709-I713 HydrophobicContact CE1-CD1 3.38Å; F709-I713 HydrophobicContact CE1-CG1 4.38Å; F709-I713 HydrophobicContact CE2-CD1 4.26Å; F709-I713 HydrophobicContact CZ-CD1 3.57Å; F709-I713 HydrophobicContact CZ-CG1 4.38Å; F709-I713 WeakPolarHBondContact O-CG1 3.43Å; F709-I713 PolarHBondContact O-N 2.88Å
710	Y	53	Low	52.9	Low	131 Å²	131	92.4 Å²	92.4	51%	0.514	46%	0.458	S	S	.	.	H	α-helix	trans	-64.3	-44.6	173.7	-179.4	-96.9	0	0	0	112.1	T706 L707 Y712 I713 R714	T706-Y710 WeakPolarHBondContact O-CB 3.49Å; T706-Y710 PolarHBondContact O-N 3.25Å; L707-Y710 PolarHBondContact O-N 3.15Å; Y710-Y712 VanDerWaalsContact C-N 3.35Å; Y710-Y712 PolarHBondContact O-N 2.92Å; Y710-I713 PolarHBondContact O-N 2.59Å; Y710-R714 WeakPolarHBondContact O-CB 3.28Å; Y710-R714 PolarHBondContact O-N 2.82Å
711	S	61.2	Low	53.7	Low	68 Å²	68	92.6 Å²	92.6	48%	0.476	46%	0.457	S	S	.	.	H	α-helix	trans	-66.3	-36.2	175.6	66.1	0	0	0	0	112.3	L707 K708 R714 H715	L707-S711 PolarHBondContact O-N 3.4Å; L707-S711 PolarHBondContact O-OG 3.42Å; K708-S711 WeakPolarHBondContact CA-OG 3.27Å; K708-S711 PolarHBondContact O-OG 2.88Å; S711-R714 PolarHBondContact O-N 3.26Å; S711-H715 VanDerWaalsContact O-CB 3.26Å; S711-H715 WeakPolarHBondContact O-CB 3.41Å; S711-H715 PolarHBondContact O-N 3.03Å
712	Y	57.1	Low	54.9	Low	125 Å²	125	92.8 Å²	92.8	49%	0.49	46%	0.457	S	S	.	.	H	α-helix	trans	-64	-43.9	172.9	-177.6	-109	0	0	0	112.5	K708 F709 Y710 H715 I716	K708-Y712 WeakPolarHBondContact O-CB 3.43Å; K708-Y712 PolarHBondContact O-N 2.96Å; F709-Y712 PolarHBondContact O-N 3.42Å; Y710-Y712 VanDerWaalsContact C-N 3.35Å; Y710-Y712 PolarHBondContact O-N 2.92Å; Y712-H715 PolarHBondContact O-N 2.79Å; Y712-I716 HydrophobicContact CD1-CD1 3.84Å; Y712-I716 HydrophobicContact CE1-CD1 3.39Å; Y712-I716 HydrophobicContact CE2-CD1 4.28Å; Y712-I716 HydrophobicContact CG-CD1 4.45Å; Y712-I716 WeakPolarHBondContact O-CG1 3.3Å; Y712-I716 PolarHBondContact O-N 3.48Å
713	I	54.1	Low	55.7	Low	27 Å²	27	87.1 Å²	87.1	14%	0.138	44%	0.441	C	S	.	.	H	α-helix	trans	-65.5	-44.3	173.2	-74.3	-178.6	0	0	0	111	I689 F709 Y710 H715 I716 V717	I689-I713 HydrophobicContact CG2-CD1 3.92Å; F709-I713 HydrophobicContact CD1-CD1 3.95Å; F709-I713 HydrophobicContact CE1-CD1 3.38Å; F709-I713 HydrophobicContact CE1-CG1 4.38Å; F709-I713 HydrophobicContact CE2-CD1 4.26Å; F709-I713 HydrophobicContact CZ-CD1 3.57Å; F709-I713 HydrophobicContact CZ-CG1 4.38Å; F709-I713 WeakPolarHBondContact O-CG1 3.43Å; F709-I713 PolarHBondContact O-N 2.88Å; Y710-I713 PolarHBondContact O-N 2.59Å; I713-H715 VanDerWaalsContact C-N 3.25Å; I713-H715 PolarHBondContact O-N 3.48Å; I713-I716 PolarHBondContact O-N 3.36Å; I713-I716 VanDerWaalsContact O-N 3.13Å; I713-V717 HydrophobicContact CG2-CG2 4.22Å; I713-V717 WeakPolarHBondContact O-CG2 3.33Å; I713-V717 PolarHBondContact O-N 3.5Å
714	R	60	Low	56.4	Low	178 Å²	178	86.7 Å²	86.7	67%	0.672	43%	0.434	S	S	*	.	H	α-helix	trans	-59.7	-37.9	176.7	-169.5	177.3	-176.6	-168.7	1.4	111.4	Y710 S711 K718	Y710-R714 WeakPolarHBondContact O-CB 3.28Å; Y710-R714 PolarHBondContact O-N 2.82Å; S711-R714 PolarHBondContact O-N 3.26Å; R714-K718 VanDerWaalsContact O-CB 3.28Å; R714-K718 WeakPolarHBondContact O-CB 3.43Å; R714-K718 PolarHBondContact O-N 2.87Å
715	H	61	Low	57.1	Low	116 Å²	116	85.9 Å²	85.9	54%	0.537	43%	0.428	S	S	.	.	H	α-helix	trans	-69.9	-40	174.2	-168.5	-26.2	0	0	0	112.4	S711 Y712 I713 N719	S711-H715 VanDerWaalsContact O-CB 3.26Å; S711-H715 WeakPolarHBondContact O-CB 3.41Å; S711-H715 PolarHBondContact O-N 3.03Å; Y712-H715 PolarHBondContact O-N 2.79Å; I713-H715 VanDerWaalsContact C-N 3.25Å; I713-H715 PolarHBondContact O-N 3.48Å; H715-N719 PolarHBondContact CE1-OD1 2.89Å; H715-N719 PolarHBondContact ND1-OD1 2.94Å; H715-N719 WeakPolarHBondContact O-CB 3.43Å; H715-N719 PolarHBondContact O-N 3.44Å; H715-N719 PolarHBondContact O-OD1 3.43Å
716	I	56.9	Low	57.9	Low	70 Å²	70	86.2 Å²	86.2	36%	0.359	43%	0.426	S	S	.	.	H	α-helix	trans	-63.1	-46.8	173.1	-75.4	171.5	0	0	0	110.8	Y712 I713 N719 A720	Y712-I716 HydrophobicContact CD1-CD1 3.84Å; Y712-I716 HydrophobicContact CE1-CD1 3.39Å; Y712-I716 HydrophobicContact CE2-CD1 4.28Å; Y712-I716 HydrophobicContact CG-CD1 4.45Å; Y712-I716 WeakPolarHBondContact O-CG1 3.3Å; Y712-I716 PolarHBondContact O-N 3.48Å; I713-I716 PolarHBondContact O-N 3.36Å; I713-I716 VanDerWaalsContact O-N 3.13Å; I716-N719 PolarHBondContact O-N 3.28Å; I716-A720 VanDerWaalsContact O-CB 3.24Å; I716-A720 WeakPolarHBondContact O-CB 3.48Å; I716-A720 PolarHBondContact O-N 2.98Å
717	V	57.4	Low	58.2	Low	70 Å²	70	84.9 Å²	84.9	42%	0.424	42%	0.418	S	S	.	.	H	α-helix	trans	-63.6	-46.2	179	173.3	0	0	0	0	110.3	I713 N719 A720 T721	I713-V717 HydrophobicContact CG2-CG2 4.22Å; I713-V717 WeakPolarHBondContact O-CG2 3.33Å; I713-V717 PolarHBondContact O-N 3.5Å; V717-N719 PolarHBondContact O-N 3.35Å; V717-A720 WeakPolarHBondContact O-CB 3.29Å; V717-A720 PolarHBondContact O-N 2.9Å; V717-A720 VanDerWaalsContact O-N 3.17Å; V717-T721 PolarHBondContact O-N 3.41Å; V717-T721 PolarHBondContact O-OG1 3.22Å; V717-T721 VanDerWaalsContact O-OG1 3.04Å
718	K	61.8	Low	58.1	Low	124 Å²	124	80.1 Å²	80.1	54%	0.539	39%	0.393	S	S	.	.	H	α-helix	trans	-57.4	-50.9	175.7	179.6	169.6	173.3	172.4	0	111.9	R714 A720 T721 E722	R714-K718 VanDerWaalsContact O-CB 3.28Å; R714-K718 WeakPolarHBondContact O-CB 3.43Å; R714-K718 PolarHBondContact O-N 2.87Å; K718-A720 VanDerWaalsContact C-N 3.28Å; K718-A720 PolarHBondContact O-N 2.93Å; K718-T721 WeakPolarHBondContact CA-OG1 3.15Å; K718-T721 PolarHBondContact O-N 2.97Å; K718-T721 PolarHBondContact O-OG1 3.26Å; K718-E722 WeakPolarHBondContact CE-OE1 3.46Å; K718-E722 HydrophobicContact CG-CG 4.48Å; K718-E722 IonicContact NZ-OE1 2.68Å; K718-E722 WeakPolarHBondContact O-CG 3.39Å; K718-E722 PolarHBondContact O-N 3.36Å
719	N	61	Low	58	Low	71 Å²	71	76.2 Å²	76.2	38%	0.38	38%	0.383	S	S	.	.	H	α-helix	trans	-63	-34.7	177.3	-76.8	48.2	0	0	0	112.4	H715 I716 V717 T723	H715-N719 PolarHBondContact CE1-OD1 2.89Å; H715-N719 PolarHBondContact ND1-OD1 2.94Å; H715-N719 WeakPolarHBondContact O-CB 3.43Å; H715-N719 PolarHBondContact O-N 3.44Å; H715-N719 PolarHBondContact O-OD1 3.43Å; I716-N719 PolarHBondContact O-N 3.28Å; V717-N719 PolarHBondContact O-N 3.35Å; N719-T723 VanDerWaalsContact O-CB 3.28Å; N719-T723 WeakPolarHBondContact O-CB 3.49Å; N719-T723 PolarHBondContact O-N 3.38Å; N719-T723 PolarHBondContact O-OG1 2.7Å
720	A	53.4	Low	58.4	Low	46 Å²	46	75.8 Å²	75.8	38%	0.38	38%	0.382	S	S	.	.	H	α-helix	trans	-67.6	-43.5	175	0	0	0	0	0	111.2	I716 V717 K718 T723 Y724	I716-A720 VanDerWaalsContact O-CB 3.24Å; I716-A720 WeakPolarHBondContact O-CB 3.48Å; I716-A720 PolarHBondContact O-N 2.98Å; V717-A720 WeakPolarHBondContact O-CB 3.29Å; V717-A720 PolarHBondContact O-N 2.9Å; V717-A720 VanDerWaalsContact O-N 3.17Å; K718-A720 VanDerWaalsContact C-N 3.28Å; K718-A720 PolarHBondContact O-N 2.93Å; A720-T723 PolarHBondContact O-N 2.82Å; A720-Y724 WeakPolarHBondContact O-CB 3.42Å; A720-Y724 PolarHBondContact O-N 2.97Å
721	T	54.6	Low	58.3	Low	55 Å²	55	70.7 Å²	70.7	34%	0.337	36%	0.363	S	S	.	.	H	α-helix	trans	-67.4	-36.5	175.9	47.3	0	0	0	0	113	V717 K718 Y724 S725	V717-T721 PolarHBondContact O-N 3.41Å; V717-T721 PolarHBondContact O-OG1 3.22Å; V717-T721 VanDerWaalsContact O-OG1 3.04Å; K718-T721 WeakPolarHBondContact CA-OG1 3.15Å; K718-T721 PolarHBondContact O-N 2.97Å; K718-T721 PolarHBondContact O-OG1 3.26Å; T721-Y724 PolarHBondContact O-N 2.95Å; T721-S725 WeakPolarHBondContact O-CB 3.2Å; T721-S725 PolarHBondContact O-N 2.95Å; T721-S725 PolarHBondContact O-OG 2.79Å
722	E	63.5	Low	57.9	Low	92 Å²	92	73 Å²	73	43%	0.43	37%	0.365	S	S	.	.	H	α-helix	trans	-67.6	-41.2	172.7	-72.5	172.5	174.9	0	0	111.4	K718 Y724 S725 V726	K718-E722 WeakPolarHBondContact CE-OE1 3.46Å; K718-E722 HydrophobicContact CG-CG 4.48Å; K718-E722 IonicContact NZ-OE1 2.68Å; K718-E722 WeakPolarHBondContact O-CG 3.39Å; K718-E722 PolarHBondContact O-N 3.36Å; E722-Y724 VanDerWaalsContact C-N 3.32Å; E722-S725 PolarHBondContact O-OG 3.1Å; E722-S725 VanDerWaalsContact O-OG 3.1Å; E722-V726 VanDerWaalsContact O-CG2 3.3Å; E722-V726 WeakPolarHBondContact O-CG2 3.48Å; E722-V726 PolarHBondContact O-N 3.08Å; E722-V726 VanDerWaalsContact O-N 3.12Å
723	T	62	Low	57.4	Low	58 Å²	58	74.3 Å²	74.3	36%	0.356	38%	0.38	S	S	.	.	H	α-helix	trans	-66.7	-37	174.6	-54.8	0	0	0	0	111.1	I650 N719 A720 L727	I650-T723 HydrophobicContact CD1-CG2 4.37Å; N719-T723 VanDerWaalsContact O-CB 3.28Å; N719-T723 WeakPolarHBondContact O-CB 3.49Å; N719-T723 PolarHBondContact O-N 3.38Å; N719-T723 PolarHBondContact O-OG1 2.7Å; A720-T723 PolarHBondContact O-N 2.82Å; T723-L727 HydrophobicContact CG2-CD1 4.05Å; T723-L727 WeakPolarHBondContact O-CB 3.38Å; T723-L727 VanDerWaalsContact O-CG 3.27Å; T723-L727 WeakPolarHBondContact O-CG 3.14Å; T723-L727 PolarHBondContact O-N 3.34Å
724	Y	58.8	Low	56.7	Low	76 Å²	76	77.7 Å²	77.7	30%	0.298	40%	0.398	S	S	.	.	H	α-helix	trans	-69	-44.1	177.6	-175.1	-88.3	0	0	0	111.8	L675 A720 T721 E722 V726 L727 C728	L675-Y724 HydrophobicContact CD1-CD2 3.78Å; L675-Y724 HydrophobicContact CD1-CE2 3.56Å; L675-Y724 HydrophobicContact CG-CE2 4.41Å; A720-Y724 WeakPolarHBondContact O-CB 3.42Å; A720-Y724 PolarHBondContact O-N 2.97Å; T721-Y724 PolarHBondContact O-N 2.95Å; E722-Y724 VanDerWaalsContact C-N 3.32Å; Y724-V726 VanDerWaalsContact C-N 3.34Å; Y724-V726 PolarHBondContact O-N 3.5Å; Y724-L727 PolarHBondContact O-N 3.36Å; Y724-C728 WeakPolarHBondContact CE1-SG 3.31Å; Y724-C728 WeakPolarHBondContact O-CB 3.48Å; Y724-C728 PolarHBondContact O-N 2.99Å
725	S	59.6	Low	55.8	Low	46 Å²	46	75.6 Å²	75.6	32%	0.322	40%	0.4	S	S	.	.	H	α-helix	trans	-64.8	-38.6	176.9	67.6	0	0	0	0	111.9	T721 E722 S729	T721-S725 WeakPolarHBondContact O-CB 3.2Å; T721-S725 PolarHBondContact O-N 2.95Å; T721-S725 PolarHBondContact O-OG 2.79Å; E722-S725 PolarHBondContact O-OG 3.1Å; E722-S725 VanDerWaalsContact O-OG 3.1Å; S725-S729 VanDerWaalsContact O-CB 3.32Å; S725-S729 WeakPolarHBondContact O-CB 3.29Å; S725-S729 PolarHBondContact O-N 3.15Å; S725-S729 PolarHBondContact O-OG 2.93Å
726	V	62.7	Low	54.9	Low	80 Å²	80	73 Å²	73	49%	0.485	39%	0.39	S	S	.	.	H	α-helix	trans	-63.8	-45.4	171.3	171.6	0	0	0	0	111.5	E722 Y724 S729 E730	E722-V726 VanDerWaalsContact O-CG2 3.3Å; E722-V726 WeakPolarHBondContact O-CG2 3.48Å; E722-V726 PolarHBondContact O-N 3.08Å; E722-V726 VanDerWaalsContact O-N 3.12Å; Y724-V726 VanDerWaalsContact C-N 3.34Å; Y724-V726 PolarHBondContact O-N 3.5Å; V726-S729 PolarHBondContact O-N 3.26Å; V726-E730 PolarHBondContact O-N 3.12Å
727	L	55.9	Low	54.3	Low	19 Å²	19	77.9 Å²	77.9	10%	0.099	41%	0.411	C	S	.	.	H	α-helix	trans	-64	-42	177.4	-79.1	169.2	0	0	0	112.6	N671 T674 T723 Y724 E730 L731	N671-L727 HydrophobicContact CB-CD2 3.91Å; T674-L727 HydrophobicContact CG2-CD1 4.23Å; T723-L727 HydrophobicContact CG2-CD1 4.05Å; T723-L727 WeakPolarHBondContact O-CB 3.38Å; T723-L727 VanDerWaalsContact O-CG 3.27Å; T723-L727 WeakPolarHBondContact O-CG 3.14Å; T723-L727 PolarHBondContact O-N 3.34Å; Y724-L727 PolarHBondContact O-N 3.36Å; L727-E730 PolarHBondContact O-N 3.38Å; L727-L731 VanDerWaalsContact O-CB 3.23Å; L727-L731 WeakPolarHBondContact O-CB 3.29Å; L727-L731 WeakPolarHBondContact O-CG 3.38Å; L727-L731 PolarHBondContact O-N 3.24Å
728	C	52.6	Low	53.7	Low	6 Å²	6	78.1 Å²	78.1	4%	0.041	40%	0.404	C	S	.	.	H	α-helix	trans	-65.7	-39.7	175.5	-77.2	0	0	0	0	111.9	Y724 L731 F732 I736	Y724-C728 WeakPolarHBondContact CE1-SG 3.31Å; Y724-C728 WeakPolarHBondContact O-CB 3.48Å; Y724-C728 PolarHBondContact O-N 2.99Å; C728-L731 PolarHBondContact O-N 2.94Å; C728-F732 HydrophobicContact CB-CD2 4.43Å; C728-F732 WeakPolarHBondContact O-CD2 3.22Å; C728-F732 PolarHBondContact O-N 2.92Å; C728-I736 HydrophobicContact CB-CD1 4.26Å
729	S	59.5	Low	52.6	Low	50 Å²	50	76.9 Å²	76.9	35%	0.35	41%	0.412	S	S	.	.	H	α-helix	trans	-62.7	-46.7	173.8	-56.8	0	0	0	0	111.3	S725 V726 L731 D733	S725-S729 VanDerWaalsContact O-CB 3.32Å; S725-S729 WeakPolarHBondContact O-CB 3.29Å; S725-S729 PolarHBondContact O-N 3.15Å; S725-S729 PolarHBondContact O-OG 2.93Å; V726-S729 PolarHBondContact O-N 3.26Å; S729-L731 VanDerWaalsContact C-N 3.29Å; S729-L731 PolarHBondContact O-N 2.91Å; S729-D733 PolarHBondContact O-N 3.36Å
730	E	60.2	Low	51.7	Low	84 Å²	84	81.3 Å²	81.3	39%	0.393	44%	0.435	S	S	.	.	H	α-helix	trans	-66.7	-24.1	176	-78.2	-162.3	-172.4	0	0	114.4	R667 N671 V726 L727	R667-E730 IonicContact CZ-OE1 3.29Å; R667-E730 IonicContact CZ-OE2 2.7Å; R667-E730 IonicContact NE-OE2 2.72Å; R667-E730 PolarHBondContact NE-OE2 3.15Å; R667-E730 VanDerWaalsContact NE-OE2 3.17Å; R667-E730 IonicContact NH2-OE1 2.99Å; R667-E730 PolarHBondContact NH2-OE1 2.78Å; R667-E730 IonicContact NH2-OE2 3.69Å; R667-E730 PolarHBondContact NH2-OE2 3.49Å; N671-E730 PolarHBondContact ND2-OE2 2.95Å; N671-E730 VanDerWaalsContact ND2-OE2 3.13Å; V726-E730 PolarHBondContact O-N 3.12Å; L727-E730 PolarHBondContact O-N 3.38Å
731	L	51.7	Low	51.1	Low	23 Å²	23	81.5 Å²	81.5	12%	0.12	44%	0.442	C	S	.	.	H	α-helix	trans	-91.5	-39.8	-176.2	-79.5	171.4	0	0	0	113.5	N671 L675 L727 C728 S729	N671-L731 HydrophobicContact CB-CD1 4.21Å; N671-L731 HydrophobicContact CB-CD2 3.8Å; N671-L731 HydrophobicContact CB-CG 4.09Å; L675-L731 HydrophobicContact CD2-CD1 4.31Å; L727-L731 VanDerWaalsContact O-CB 3.23Å; L727-L731 WeakPolarHBondContact O-CB 3.29Å; L727-L731 WeakPolarHBondContact O-CG 3.38Å; L727-L731 PolarHBondContact O-N 3.24Å; C728-L731 PolarHBondContact O-N 2.94Å; S729-L731 VanDerWaalsContact C-N 3.29Å; S729-L731 PolarHBondContact O-N 2.91Å
732	F	52.4	Low	50.1	Low	117 Å²	117	83.6 Å²	83.6	51%	0.513	46%	0.457	S	S	.	.	H	α-helix	trans	-120.5	-8.2	-163.4	-61.8	-76.2	0	0	0	115.8	C728 I734	C728-F732 HydrophobicContact CB-CD2 4.43Å; C728-F732 WeakPolarHBondContact O-CD2 3.22Å; C728-F732 PolarHBondContact O-N 2.92Å; F732-I734 HydrophobicContact CB-CB 4.39Å; F732-I734 HydrophobicContact CB-CD1 3.99Å; F732-I734 HydrophobicContact CB-CG1 3.89Å; F732-I734 PolarHBondContact O-N 3.3Å; F732-I734 VanDerWaalsContact O-N 3.1Å
733	D	45.8	Very low	48.8	Very low	152 Å²	152	81.9 Å²	81.9	81%	0.813	45%	0.454	S	S	*	.			trans	56.8	15	-169.2	-68.5	-53.3	0	0	0	114.3	S729	S729-D733 PolarHBondContact O-N 3.36Å
734	I	40.3	Very low	47.5	Very low	99 Å²	99	84 Å²	84	51%	0.508	47%	0.469	S	S	.	.			trans	-91.1	113.1	175.9	-51.8	173.1	0	0	0	108.8	F732 I736	F732-I734 HydrophobicContact CB-CB 4.39Å; F732-I734 HydrophobicContact CB-CD1 3.99Å; F732-I734 HydrophobicContact CB-CG1 3.89Å; F732-I734 PolarHBondContact O-N 3.3Å; F732-I734 VanDerWaalsContact O-N 3.1Å; I734-I736 VanDerWaalsContact C-N 3.33Å; I734-I736 HydrophobicContact CB-CG1 4.06Å; I734-I736 HydrophobicContact CG2-CD1 4.45Å; I734-I736 HydrophobicContact CG2-CG1 3.57Å; I734-I736 PolarHBondContact O-N 3Å
735	N	41	Very low	46.3	Very low	133 Å²	133	91.9 Å²	91.9	71%	0.711	51%	0.514	S	S	*	.			trans	-78.5	78.7	174.4	-172	12	0	0	0	110.4	Q737	N735-Q737 PolarHBondContact O-N 3.33Å
736	I	41.7	Very low	45.7	Very low	63 Å²	63	94.2 Å²	94.2	32%	0.323	52%	0.524	S	S	.	.			trans	-78.7	90.4	-173.5	-39.9	170.2	0	0	0	111.1	C728 I734 Y738	C728-I736 HydrophobicContact CB-CD1 4.26Å; I734-I736 VanDerWaalsContact C-N 3.33Å; I734-I736 HydrophobicContact CB-CG1 4.06Å; I734-I736 HydrophobicContact CG2-CD1 4.45Å; I734-I736 HydrophobicContact CG2-CG1 3.57Å; I734-I736 PolarHBondContact O-N 3Å; I736-Y738 HydrophobicContact CB-CE1 4.39Å; I736-Y738 HydrophobicContact CB-CE2 4.23Å; I736-Y738 HydrophobicContact CG2-CD1 3.8Å; I736-Y738 HydrophobicContact CG2-CD2 4.35Å; I736-Y738 HydrophobicContact CG2-CE1 3.26Å; I736-Y738 HydrophobicContact CG2-CE2 3.92Å; I736-Y738 HydrophobicContact CG2-CG 4.3Å; I736-Y738 PolarHBondContact O-N 2.66Å
737	Q	43.7	Very low	44.8	Very low	172 Å²	172	94.9 Å²	94.9	80%	0.804	53%	0.526	S	S	*	.			trans	-74.9	100.4	166.4	-71.4	-173.6	-28.8	0	0	110.2	N735	N735-Q737 PolarHBondContact O-N 3.33Å
738	Y	45.7	Very low	44.2	Very low	74 Å²	74	99.2 Å²	99.2	29%	0.29	55%	0.549	S	S	.	.			trans	-81.7	117.6	168.7	-60.1	-62.1	0	0	0	110.4	I736 D740 P743 P744	I736-Y738 HydrophobicContact CB-CE1 4.39Å; I736-Y738 HydrophobicContact CB-CE2 4.23Å; I736-Y738 HydrophobicContact CG2-CD1 3.8Å; I736-Y738 HydrophobicContact CG2-CD2 4.35Å; I736-Y738 HydrophobicContact CG2-CE1 3.26Å; I736-Y738 HydrophobicContact CG2-CE2 3.92Å; I736-Y738 HydrophobicContact CG2-CG 4.3Å; I736-Y738 PolarHBondContact O-N 2.66Å; Y738-D740 PolarHBondContact O-N 3.04Å; Y738-P743 HydrophobicContact CE1-CB 4.09Å; Y738-P743 HydrophobicContact CE2-CB 4.15Å; Y738-P744 VanDerWaalsContact CE1-CD 3.41Å
739	S	38.3	Very low	43.7	Very low	99 Å²	99	104.6 Å²	104.6	69%	0.692	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-59.2	134	157.3	50.1	0	0	0	0	109.2	G741	S739-G741 PolarHBondContact O-N 2.83Å
740	D	43.3	Very low	42.7	Very low	164 Å²	164	108.1 Å²	108.1	88%	0.877	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	59.8	15.6	171.2	-47.7	-38.3	0	0	0	117	Y738 C742	Y738-D740 PolarHBondContact O-N 3.04Å; D740-C742 VanDerWaalsContact C-N 3.35Å; D740-C742 PolarHBondContact O-N 3.38Å
741	G	39.4	Very low	41.5	Very low	50 Å²	50	109.7 Å²	109.7	52%	0.515	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	75.9	10.5	163.3	0	0	0	0	0	116.7	S739	S739-G741 PolarHBondContact O-N 2.83Å
742	C	34.4	Very low	40.8	Very low	98 Å²	98	115.9 Å²	115.9	66%	0.662	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-98.5	123.9	170.8	-82.9	0	0	0	0	111.4	D740	D740-C742 VanDerWaalsContact C-N 3.35Å; D740-C742 PolarHBondContact O-N 3.38Å
743	P	34.9	Very low	39.9	Very low	56 Å²	56	115.8 Å²	115.8	36%	0.364	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-71.9	157.5	163.2	32.7	-34.3	0	0	0	110.8	Y738	Y738-P743 HydrophobicContact CE1-CB 4.09Å; Y738-P743 HydrophobicContact CE2-CB 4.15Å
744	P	36.2	Very low	39.4	Very low	104 Å²	104	112.8 Å²	112.8	68%	0.675	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-62.7	155.9	164.9	29.9	-35.5	0	0	0	110.8	Y738	Y738-P744 VanDerWaalsContact CE1-CD 3.41Å
745	I	33.7	Very low	39.3	Very low	241 Å²	241	114 Å²	114	100%	1.236	65%	0.65	S	S	*	*			trans	-78.1	0	179.2	-58.4	175.2	0	0	0	110.4

Retrieved 745 of 745 residues in 830.3 ms (Link to these results)

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