A0A3Q0KT53_SCHMA Loading...

Putative transcription factor

AlphaFold DB , UniProt , Accession A0A3Q0KT53, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 599 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.6	Very low	44.4	Very low	227 Å²	227	165 Å²	165	100%	1.118	80%	0.802	S	S	*	*				0	123.1	0	-95.7	53.8	-176.4	0	0	106.8
2	N	44.7	Very low	44.3	Very low	136 Å²	136	161.4 Å²	161.4	73%	0.727	81%	0.806	S	S	*	*			trans	-100.5	134.4	-151.6	-56.3	1.8	0	0	0	110.1	Y4	N2-Y4 PolarHBondContact O-N 3.47Å
3	Q	39.5	Very low	45.1	Very low	164 Å²	164	157.6 Å²	157.6	77%	0.766	81%	0.805	S	S	*	*			trans	-69.8	124.3	163.9	-68.1	171.6	-11.5	0	0	107.7
4	Y	50	Low	45.4	Very low	215 Å²	215	154.9 Å²	154.9	84%	0.843	80%	0.802	S	S	*	*			trans	-98.2	110.5	156.2	-83.3	-85.7	0	0	0	106.1	N2	N2-Y4 PolarHBondContact O-N 3.47Å
5	Q	44.9	Very low	45.7	Very low	168 Å²	168	151.1 Å²	151.1	79%	0.785	80%	0.803	S	S	*	*			trans	-81.5	146.6	171.7	-68.1	173.5	-78.9	0	0	108.8	E7	Q5-E7 PolarHBondContact O-N 3.44Å
6	N	42.2	Very low	46.3	Very low	153 Å²	153	148.3 Å²	148.3	82%	0.818	80%	0.796	S	S	*	*			trans	-74.3	119.8	176.2	-61.6	-27.9	0	0	0	109.3	V8	N6-V8 PolarHBondContact O-N 3.08Å
7	E	42.2	Very low	46.2	Very low	167 Å²	167	146.9 Å²	146.9	78%	0.78	80%	0.801	S	S	*	*			trans	-81.6	107.7	159.2	-71.8	-166.8	159.8	0	0	108.6	Q5 Y9	Q5-E7 PolarHBondContact O-N 3.44Å; E7-Y9 PolarHBondContact O-N 3.47Å
8	V	43.4	Very low	46.5	Very low	116 Å²	116	145.6 Å²	145.6	70%	0.703	79%	0.792	S	S	*	*			trans	-85.4	105	171	179.2	0	0	0	0	107.5	N6 E10	N6-V8 PolarHBondContact O-N 3.08Å; V8-E10 VanDerWaalsContact C-N 3.33Å; V8-E10 HydrophobicContact CG1-CG 4.15Å; V8-E10 PolarHBondContact O-N 3.46Å
9	Y	49.9	Very low	46.8	Very low	194 Å²	194	142.7 Å²	142.7	76%	0.761	78%	0.78	S	S	*	*			trans	-77.5	81.6	173.5	-103.4	-94.4	0	0	0	110.8	E7 S11	E7-Y9 PolarHBondContact O-N 3.47Å; Y9-S11 PolarHBondContact O-N 2.97Å
10	E	41.3	Very low	47.2	Very low	173 Å²	173	143.1 Å²	143.1	81%	0.808	78%	0.781	S	S	*	*			trans	-77	101.6	161.1	-77.8	-171.6	137.2	0	0	109.8	V8	V8-E10 VanDerWaalsContact C-N 3.33Å; V8-E10 HydrophobicContact CG1-CG 4.15Å; V8-E10 PolarHBondContact O-N 3.46Å
11	S	50.2	Low	47.6	Very low	102 Å²	102	143.4 Å²	143.4	71%	0.713	78%	0.782	S	S	*	*			trans	-119.3	71.1	168.4	66.5	0	0	0	0	110.7	Y9 S13	Y9-S11 PolarHBondContact O-N 2.97Å; S11-S13 PolarHBondContact O-N 3.12Å
12	S	43.2	Very low	48.4	Very low	122 Å²	122	139 Å²	139	85%	0.853	76%	0.758	S	S	*	*			trans	-63.9	124.8	171.1	-70.6	0	0	0	0	110.5
13	S	54.8	Low	48.5	Very low	112 Å²	112	137.9 Å²	137.9	78%	0.783	76%	0.76	S	S	*	*			trans	-139.6	142.6	167.8	-141.7	0	0	0	0	110	S11	S11-S13 PolarHBondContact O-N 3.12Å
14	P	49.3	Very low	49.2	Very low	119 Å²	119	135.1 Å²	135.1	77%	0.773	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-79.6	139.5	-164.3	-12	29.5	0	0	0	112.7	P16	P14-P16 WeakPolarHBondContact O-CD 3.48Å
15	A	50	Low	49.2	Very low	98 Å²	98	132.7 Å²	132.7	81%	0.81	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-67.6	125.5	174.1	0	0	0	0	0	111.3
16	P	55.6	Low	49.8	Very low	106 Å²	106	129.7 Å²	129.7	69%	0.688	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-73.4	139.8	167	31.2	-32.9	0	0	0	109.6	P14 L18	P14-P16 WeakPolarHBondContact O-CD 3.48Å; P16-L18 PolarHBondContact O-N 2.81Å; P16-L18 VanDerWaalsContact O-N 3.09Å
17	S	44	Very low	50.5	Low	126 Å²	126	128.2 Å²	128.2	88%	0.881	74%	0.74	S	S	*	*			trans	-67.5	106.7	176.1	54.4	0	0	0	0	110.7
18	L	51.9	Low	51.4	Low	123 Å²	123	127.2 Å²	127.2	64%	0.644	74%	0.735	S	S	*	*			trans	-97.2	132.7	174.7	-103.8	155.3	0	0	0	110.3	P16	P16-L18 PolarHBondContact O-N 2.81Å; P16-L18 VanDerWaalsContact O-N 3.09Å
19	T	51.5	Low	52.5	Low	91 Å²	91	123 Å²	123	56%	0.558	72%	0.716	S	S	*	*			trans	-70.8	142	178	48.7	0	0	0	0	111.4	D21 Q22	T19-D21 PolarHBondContact O-N 3.21Å; T19-Q22 PolarHBondContact O-N 3.29Å
20	D	56.4	Low	53.5	Low	150 Å²	150	121.2 Å²	121.2	80%	0.802	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-58.4	-20	-168.9	-56	-81	0	0	0	115.4	Q22	D20-Q22 VanDerWaalsContact C-N 3.31Å; D20-Q22 PolarHBondContact O-N 3.3Å
21	D	55.9	Low	55.3	Low	150 Å²	150	118.1 Å²	118.1	80%	0.802	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-75	-1.1	-174.9	-67.4	-41.1	0	0	0	116.1	T19	T19-D21 PolarHBondContact O-N 3.21Å
22	Q	54.6	Low	56.8	Low	133 Å²	133	119 Å²	119	62%	0.621	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-103.3	-1.3	179.9	-66.9	-163.1	22	0	0	115.7	T19 D20 S24	T19-Q22 PolarHBondContact O-N 3.29Å; D20-Q22 VanDerWaalsContact C-N 3.31Å; D20-Q22 PolarHBondContact O-N 3.3Å; Q22-S24 PolarHBondContact O-N 3.02Å
23	C	48.6	Very low	58.8	Low	114 Å²	114	118 Å²	118	77%	0.77	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	9.2	-176	-63.3	0	0	0	0	115.4
24	S	53.4	Low	60.5	Low	106 Å²	106	116.6 Å²	116.6	74%	0.741	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	-0.4	-172	57.2	0	0	0	0	115.1	Q22	Q22-S24 PolarHBondContact O-N 3.02Å
25	L	50.6	Low	62.5	Low	164 Å²	164	115.7 Å²	115.7	86%	0.859	64%	0.639	S	S	*	*			trans	-143.5	45.4	180	-159	72.1	0	0	0	112.9
26	I	57.2	Low	64.5	Low	104 Å²	104	116.6 Å²	116.6	53%	0.533	63%	0.63	S	S	.	*	S	Bend	trans	-88.3	125.3	153.4	-55.7	175.5	0	0	0	105.7	E28 W31	I26-E28 PolarHBondContact O-N 3.29Å; I26-W31 HydrophobicContact CB-CH2 3.88Å; I26-W31 HydrophobicContact CB-CZ3 3.81Å; I26-W31 HydrophobicContact CG2-CE3 4.23Å; I26-W31 HydrophobicContact CG2-CH2 3.92Å; I26-W31 HydrophobicContact CG2-CZ3 3.43Å; I26-W31 VanDerWaalsContact CG2-CZ3 3.43Å; I26-W31 WeakPolarHBondContact O-CH2 3.16Å
27	D	57.4	Low	66.3	Low	122 Å²	122	116.3 Å²	116.3	65%	0.652	62%	0.622	S	S	*	*			trans	-59.5	128.1	-171.4	-170.8	-9.6	0	0	0	111.4	G29 Y30	D27-G29 PolarHBondContact O-N 3.49Å; D27-G29 VanDerWaalsContact O-N 3.09Å; D27-G29 PolarHBondContact OD1-N 3.45Å; D27-Y30 WeakPolarHBondContact O-CB 3.24Å; D27-Y30 PolarHBondContact O-N 2.9Å
28	E	59.6	Low	68.6	Low	146 Å²	146	115.2 Å²	115.2	68%	0.682	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-7.7	-174.6	-159.6	156.5	-157.7	0	0	112.9	I26 W31 H32	I26-E28 PolarHBondContact O-N 3.29Å; E28-W31 HydrophobicContact CB-CZ2 4.17Å; E28-W31 HydrophobicContact CG-CZ2 4.07Å; E28-W31 PolarHBondContact O-NE1 3.09Å; E28-H32 PolarHBondContact O-CD2 3.36Å
29	G	67.2	Low	70.7	Confident	28 Å²	28	112.2 Å²	112.2	29%	0.289	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.6	-27.5	164.2	0	0	0	0	0	115.3	D27 W31 H32 D33	D27-G29 PolarHBondContact O-N 3.49Å; D27-G29 VanDerWaalsContact O-N 3.09Å; D27-G29 PolarHBondContact OD1-N 3.45Å; G29-W31 PolarHBondContact O-N 2.81Å; G29-H32 WeakPolarHBondContact O-CB 3.42Å; G29-H32 PolarHBondContact O-N 3.37Å; G29-H32 VanDerWaalsContact O-N 3.08Å; G29-D33 PolarHBondContact O-N 3.06Å
30	Y	71	Confident	72.7	Confident	157 Å²	157	110.9 Å²	110.9	62%	0.616	60%	0.597	S	S	*	*	H	α-helix	trans	-66.6	-41	-163.8	-175.3	-102	0	0	0	114	D27 N34	D27-Y30 WeakPolarHBondContact O-CB 3.24Å; D27-Y30 PolarHBondContact O-N 2.9Å; Y30-N34 WeakPolarHBondContact O-CB 3.47Å; Y30-N34 PolarHBondContact O-N 2.96Å; Y30-N34 VanDerWaalsContact O-N 3.1Å
31	W	78.1	Confident	74.5	Confident	107 Å²	107	109.8 Å²	109.8	41%	0.405	59%	0.587	S	S	.	*	H	α-helix	trans	-69.3	-34.4	173.7	27.6	76.1	0	0	0	112.3	I26 E28 G29 N34 D35	I26-W31 HydrophobicContact CB-CH2 3.88Å; I26-W31 HydrophobicContact CB-CZ3 3.81Å; I26-W31 HydrophobicContact CG2-CE3 4.23Å; I26-W31 HydrophobicContact CG2-CH2 3.92Å; I26-W31 HydrophobicContact CG2-CZ3 3.43Å; I26-W31 VanDerWaalsContact CG2-CZ3 3.43Å; I26-W31 WeakPolarHBondContact O-CH2 3.16Å; E28-W31 HydrophobicContact CB-CZ2 4.17Å; E28-W31 HydrophobicContact CG-CZ2 4.07Å; E28-W31 PolarHBondContact O-NE1 3.09Å; G29-W31 PolarHBondContact O-N 2.81Å; W31-N34 PolarHBondContact O-N 3.26Å; W31-D35 WeakPolarHBondContact O-CB 3.49Å; W31-D35 PolarHBondContact O-N 3.08Å
32	H	82.4	Confident	76.5	Confident	122 Å²	122	107.7 Å²	107.7	57%	0.565	58%	0.575	S	S	*	*	H	α-helix	trans	-67.3	-40.8	176.3	-67.9	-36.1	0	0	0	112.2	E28 G29 L36	E28-H32 PolarHBondContact O-CD2 3.36Å; G29-H32 WeakPolarHBondContact O-CB 3.42Å; G29-H32 PolarHBondContact O-N 3.37Å; G29-H32 VanDerWaalsContact O-N 3.08Å; H32-L36 WeakPolarHBondContact O-CB 3.44Å; H32-L36 PolarHBondContact O-N 3.25Å
33	D	86.2	Confident	78.4	Confident	99 Å²	99	102.7 Å²	102.7	53%	0.529	56%	0.559	S	S	.	*	H	α-helix	trans	-64.5	-42.7	173.4	-80.2	-17.5	0	0	0	111.6	G29 L36 I37	G29-D33 PolarHBondContact O-N 3.06Å; D33-L36 PolarHBondContact O-N 2.96Å; D33-I37 WeakPolarHBondContact O-CB 3.42Å; D33-I37 WeakPolarHBondContact O-CD1 3.3Å; D33-I37 VanDerWaalsContact O-CG1 3.23Å; D33-I37 WeakPolarHBondContact O-CG1 3.26Å; D33-I37 PolarHBondContact O-N 2.94Å
34	N	88.6	Confident	80.8	Confident	84 Å²	84	103.9 Å²	103.9	45%	0.449	55%	0.551	S	S	.	*	H	α-helix	trans	-63.6	-45.6	177.6	-179	81.2	0	0	0	112.6	Y30 W31 L36 I37 L38	Y30-N34 WeakPolarHBondContact O-CB 3.47Å; Y30-N34 PolarHBondContact O-N 2.96Å; Y30-N34 VanDerWaalsContact O-N 3.1Å; W31-N34 PolarHBondContact O-N 3.26Å; N34-L36 VanDerWaalsContact C-N 3.32Å; N34-L36 PolarHBondContact O-N 3.06Å; N34-I37 PolarHBondContact O-N 3.13Å; N34-L38 WeakPolarHBondContact O-CB 3.43Å; N34-L38 PolarHBondContact O-N 3.2Å
35	D	92.3	Very high	82.8	Confident	99 Å²	99	101.4 Å²	101.4	53%	0.529	54%	0.538	S	S	.	.	H	α-helix	trans	-65.1	-35.9	176.2	-78.4	-8.2	0	0	0	111.8	W31 L38 A39	W31-D35 WeakPolarHBondContact O-CB 3.49Å; W31-D35 PolarHBondContact O-N 3.08Å; D35-L38 PolarHBondContact O-N 3.19Å; D35-A39 VanDerWaalsContact O-CB 3.26Å; D35-A39 WeakPolarHBondContact O-CB 3.48Å; D35-A39 PolarHBondContact O-N 2.84Å
36	L	92.1	Very high	85	Confident	117 Å²	117	98.4 Å²	98.4	61%	0.613	52%	0.522	S	S	*	.	H	α-helix	trans	-67	-41.1	175.4	-176.7	63.3	0	0	0	111.9	H32 D33 N34 A39 A40	H32-L36 WeakPolarHBondContact O-CB 3.44Å; H32-L36 PolarHBondContact O-N 3.25Å; D33-L36 PolarHBondContact O-N 2.96Å; N34-L36 VanDerWaalsContact C-N 3.32Å; N34-L36 PolarHBondContact O-N 3.06Å; L36-A39 PolarHBondContact O-N 2.94Å; L36-A40 WeakPolarHBondContact O-CB 3.49Å; L36-A40 PolarHBondContact O-N 3.36Å
37	I	92.2	Very high	86.9	Confident	101 Å²	101	99.3 Å²	99.3	52%	0.518	53%	0.527	S	S	.	.	H	α-helix	trans	-62.3	-49.5	173.2	-70.8	162.9	0	0	0	110	D33 N34 A39 A40 E41	D33-I37 WeakPolarHBondContact O-CB 3.42Å; D33-I37 WeakPolarHBondContact O-CD1 3.3Å; D33-I37 VanDerWaalsContact O-CG1 3.23Å; D33-I37 WeakPolarHBondContact O-CG1 3.26Å; D33-I37 PolarHBondContact O-N 2.94Å; N34-I37 PolarHBondContact O-N 3.13Å; I37-A39 VanDerWaalsContact C-N 3.33Å; I37-A39 PolarHBondContact O-N 3.48Å; I37-A40 WeakPolarHBondContact O-CB 3.48Å; I37-A40 PolarHBondContact O-N 3.06Å; I37-A40 VanDerWaalsContact O-N 3.1Å; I37-E41 HydrophobicContact CG2-CG 4.5Å; I37-E41 WeakPolarHBondContact O-CG 3.27Å; I37-E41 PolarHBondContact O-N 3.43Å
38	L	94.1	Very high	88.8	Confident	102 Å²	102	96.9 Å²	96.9	53%	0.534	51%	0.514	S	S	.	.	H	α-helix	trans	-60.6	-41.1	178.7	179.7	60.1	0	0	0	112.1	N34 D35 A40 E41 L42	N34-L38 WeakPolarHBondContact O-CB 3.43Å; N34-L38 PolarHBondContact O-N 3.2Å; D35-L38 PolarHBondContact O-N 3.19Å; L38-A40 VanDerWaalsContact C-N 3.35Å; L38-E41 PolarHBondContact O-N 3.37Å; L38-L42 WeakPolarHBondContact O-CB 3.4Å; L38-L42 PolarHBondContact O-N 2.98Å
39	A	94.6	Very high	90.6	Very high	60 Å²	60	98 Å²	98	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-38	174.4	0	0	0	0	0	112.2	D35 L36 I37 G43	D35-A39 VanDerWaalsContact O-CB 3.26Å; D35-A39 WeakPolarHBondContact O-CB 3.48Å; D35-A39 PolarHBondContact O-N 2.84Å; L36-A39 PolarHBondContact O-N 2.94Å; I37-A39 VanDerWaalsContact C-N 3.33Å; I37-A39 PolarHBondContact O-N 3.48Å; A39-G43 PolarHBondContact O-N 2.9Å
40	A	94.6	Very high	92	Very high	64 Å²	64	100.5 Å²	100.5	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-69.1	-40.3	175.5	0	0	0	0	0	112.3	L36 I37 L38 G43 K44	L36-A40 WeakPolarHBondContact O-CB 3.49Å; L36-A40 PolarHBondContact O-N 3.36Å; I37-A40 WeakPolarHBondContact O-CB 3.48Å; I37-A40 PolarHBondContact O-N 3.06Å; I37-A40 VanDerWaalsContact O-N 3.1Å; L38-A40 VanDerWaalsContact C-N 3.35Å; A40-G43 PolarHBondContact O-N 2.85Å; A40-K44 VanDerWaalsContact O-CB 3.31Å; A40-K44 WeakPolarHBondContact O-CB 3.49Å; A40-K44 PolarHBondContact O-N 3.37Å
41	E	94.6	Very high	93.2	Very high	126 Å²	126	101 Å²	101	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-66	-44	174.7	-70	-158.6	148.4	0	0	112.2	I37 L38 K44 A45	I37-E41 HydrophobicContact CG2-CG 4.5Å; I37-E41 WeakPolarHBondContact O-CG 3.27Å; I37-E41 PolarHBondContact O-N 3.43Å; L38-E41 PolarHBondContact O-N 3.37Å; E41-K44 PolarHBondContact O-N 3.49Å; E41-A45 WeakPolarHBondContact O-CB 3.03Å; E41-A45 PolarHBondContact O-N 2.75Å
42	L	96.3	Very high	94.1	Very high	106 Å²	106	102.8 Å²	102.8	56%	0.555	53%	0.53	S	S	*	.	H	α-helix	trans	-62.9	-43.3	174.2	-178.7	61.7	0	0	0	111.2	L38 K44 A45 L46	L38-L42 WeakPolarHBondContact O-CB 3.4Å; L38-L42 PolarHBondContact O-N 2.98Å; L42-K44 PolarHBondContact O-N 3.32Å; L42-A45 PolarHBondContact O-N 3.46Å; L42-L46 HydrophobicContact CD1-CD1 4.42Å; L42-L46 HydrophobicContact CD1-CG 4.42Å; L42-L46 HydrophobicContact CG-CD1 4.15Å; L42-L46 WeakPolarHBondContact O-CB 3.49Å; L42-L46 VanDerWaalsContact O-CG 3.28Å; L42-L46 WeakPolarHBondContact O-CG 3.21Å; L42-L46 PolarHBondContact O-N 3.15Å
43	G	96.2	Very high	94.8	Very high	28 Å²	28	101.8 Å²	101.8	29%	0.289	53%	0.528	S	S	.	.	H	α-helix	trans	-59.4	-45.3	174.7	0	0	0	0	0	112.4	A39 A40 L46 L47	A39-G43 PolarHBondContact O-N 2.9Å; A40-G43 PolarHBondContact O-N 2.85Å; G43-L46 PolarHBondContact O-N 3.43Å; G43-L47 VanDerWaalsContact O-CG 3.31Å; G43-L47 WeakPolarHBondContact O-CG 3.37Å; G43-L47 PolarHBondContact O-N 3.43Å
44	K	97.3	Very high	95.3	Very high	139 Å²	139	102.6 Å²	102.6	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-60.9	-46.6	173.9	-179.9	-174.4	174.3	-170.4	0	111.8	A40 E41 L42 L46 L47 D48	A40-K44 VanDerWaalsContact O-CB 3.31Å; A40-K44 WeakPolarHBondContact O-CB 3.49Å; A40-K44 PolarHBondContact O-N 3.37Å; E41-K44 PolarHBondContact O-N 3.49Å; L42-K44 PolarHBondContact O-N 3.32Å; K44-L46 VanDerWaalsContact C-N 3.33Å; K44-L46 PolarHBondContact O-N 2.83Å; K44-L47 PolarHBondContact O-N 3.45Å; K44-D48 WeakPolarHBondContact O-CB 3.27Å; K44-D48 PolarHBondContact O-N 3.28Å
45	A	95.8	Very high	95.7	Very high	55 Å²	55	104.1 Å²	104.1	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-63.6	-36.9	178.2	0	0	0	0	0	112.5	E41 L42 R49	E41-A45 WeakPolarHBondContact O-CB 3.03Å; E41-A45 PolarHBondContact O-N 2.75Å; L42-A45 PolarHBondContact O-N 3.46Å; A45-R49 VanDerWaalsContact O-CB 3.26Å; A45-R49 WeakPolarHBondContact O-CB 3.49Å; A45-R49 PolarHBondContact O-N 2.91Å
46	L	97.2	Very high	95.9	Very high	101 Å²	101	102.3 Å²	102.3	53%	0.529	54%	0.535	S	S	.	.	H	α-helix	trans	-67.5	-41.2	173.2	-73.3	170.5	0	0	0	112	L42 G43 K44 R49 N50	L42-L46 HydrophobicContact CD1-CD1 4.42Å; L42-L46 HydrophobicContact CD1-CG 4.42Å; L42-L46 HydrophobicContact CG-CD1 4.15Å; L42-L46 WeakPolarHBondContact O-CB 3.49Å; L42-L46 VanDerWaalsContact O-CG 3.28Å; L42-L46 WeakPolarHBondContact O-CG 3.21Å; L42-L46 PolarHBondContact O-N 3.15Å; G43-L46 PolarHBondContact O-N 3.43Å; K44-L46 VanDerWaalsContact C-N 3.33Å; K44-L46 PolarHBondContact O-N 2.83Å; L46-R49 PolarHBondContact O-N 3.37Å; L46-N50 WeakPolarHBondContact O-CB 3.41Å; L46-N50 PolarHBondContact O-N 2.84Å
47	L	97.3	Very high	96.1	Very high	122 Å²	122	101.6 Å²	101.6	64%	0.639	53%	0.532	S	S	*	.	H	α-helix	trans	-65.7	-45.1	175.1	-72.6	169	0	0	0	112.1	G43 K44 R49 N50 R51	G43-L47 VanDerWaalsContact O-CG 3.31Å; G43-L47 WeakPolarHBondContact O-CG 3.37Å; G43-L47 PolarHBondContact O-N 3.43Å; K44-L47 PolarHBondContact O-N 3.45Å; L47-R49 VanDerWaalsContact C-N 3.3Å; L47-R49 PolarHBondContact O-N 3.09Å; L47-N50 PolarHBondContact O-N 3.06Å; L47-R51 WeakPolarHBondContact O-CB 3.4Å; L47-R51 PolarHBondContact O-N 2.87Å
48	D	96.8	Very high	96.4	Very high	71 Å²	71	102 Å²	102	38%	0.38	53%	0.531	S	S	.	.	H	α-helix	trans	-63.5	-35.2	175	-84.9	-28.8	0	0	0	112	K44 K52	K44-D48 WeakPolarHBondContact O-CB 3.27Å; K44-D48 PolarHBondContact O-N 3.28Å; D48-K52 WeakPolarHBondContact O-CB 3.45Å; D48-K52 VanDerWaalsContact O-CD 3.29Å; D48-K52 WeakPolarHBondContact O-CD 3.45Å; D48-K52 WeakPolarHBondContact O-CG 3.36Å; D48-K52 PolarHBondContact O-N 2.89Å
49	R	96.9	Very high	96.5	Very high	169 Å²	169	104 Å²	104	64%	0.638	54%	0.536	S	S	*	.	H	α-helix	trans	-68.4	-43.4	172.2	-179.9	175.1	177.3	163.5	-0.6	111.7	A45 L46 L47 K52 L53	A45-R49 VanDerWaalsContact O-CB 3.26Å; A45-R49 WeakPolarHBondContact O-CB 3.49Å; A45-R49 PolarHBondContact O-N 2.91Å; L46-R49 PolarHBondContact O-N 3.37Å; L47-R49 VanDerWaalsContact C-N 3.3Å; L47-R49 PolarHBondContact O-N 3.09Å; R49-K52 PolarHBondContact O-N 3.48Å; R49-L53 HydrophobicContact CG-CD1 4.24Å; R49-L53 WeakPolarHBondContact O-CG 3.26Å; R49-L53 PolarHBondContact O-N 2.75Å
50	N	96.8	Very high	96.6	Very high	82 Å²	82	104.3 Å²	104.3	44%	0.439	54%	0.535	S	S	.	.	H	α-helix	trans	-62.3	-50.5	178.8	-165.5	-2.4	0	0	0	110.4	L46 L47 K52 L53 E54	L46-N50 WeakPolarHBondContact O-CB 3.41Å; L46-N50 PolarHBondContact O-N 2.84Å; L47-N50 PolarHBondContact O-N 3.06Å; N50-K52 VanDerWaalsContact C-N 3.26Å; N50-K52 PolarHBondContact O-N 3.23Å; N50-L53 CarbonylContact O-C 3.54Å; N50-L53 WeakPolarHBondContact O-CA 3.38Å; N50-L53 WeakPolarHBondContact O-CB 3.39Å; N50-L53 PolarHBondContact O-N 2.89Å; N50-E54 WeakPolarHBondContact O-CG 3.4Å; N50-E54 PolarHBondContact O-N 3.38Å
51	R	97.1	Very high	96.7	Very high	166 Å²	166	105 Å²	105	63%	0.626	53%	0.525	S	S	*	.	H	α-helix	trans	-55.2	-37.4	175.1	-172.7	176.8	-177.3	168.9	3.5	113.4	L47 L55	L47-R51 WeakPolarHBondContact O-CB 3.4Å; L47-R51 PolarHBondContact O-N 2.87Å; R51-L55 HydrophobicContact CG-CD1 4.35Å; R51-L55 WeakPolarHBondContact O-CB 3.4Å; R51-L55 VanDerWaalsContact O-CG 3.27Å; R51-L55 WeakPolarHBondContact O-CG 3.35Å; R51-L55 PolarHBondContact O-N 3.15Å
52	K	97	Very high	96.8	Very high	145 Å²	145	102.6 Å²	102.6	63%	0.63	52%	0.522	S	S	*	.	H	α-helix	trans	-68.2	-35.4	174	-73.3	164.9	-169.1	169.3	0	112.5	D48 R49 N50 A56	D48-K52 WeakPolarHBondContact O-CB 3.45Å; D48-K52 VanDerWaalsContact O-CD 3.29Å; D48-K52 WeakPolarHBondContact O-CD 3.45Å; D48-K52 WeakPolarHBondContact O-CG 3.36Å; D48-K52 PolarHBondContact O-N 2.89Å; R49-K52 PolarHBondContact O-N 3.48Å; N50-K52 VanDerWaalsContact C-N 3.26Å; N50-K52 PolarHBondContact O-N 3.23Å; K52-A56 WeakPolarHBondContact O-CB 3.39Å; K52-A56 PolarHBondContact O-N 3.41Å; K52-A56 VanDerWaalsContact O-N 3.08Å
53	L	97.2	Very high	96.8	Very high	101 Å²	101	101.3 Å²	101.3	53%	0.529	52%	0.515	S	S	.	.	H	α-helix	trans	-72.2	-40.6	174.9	-68.9	168.6	0	0	0	111.8	R49 N50 A56 L57	R49-L53 HydrophobicContact CG-CD1 4.24Å; R49-L53 WeakPolarHBondContact O-CG 3.26Å; R49-L53 PolarHBondContact O-N 2.75Å; N50-L53 CarbonylContact O-C 3.54Å; N50-L53 WeakPolarHBondContact O-CA 3.38Å; N50-L53 WeakPolarHBondContact O-CB 3.39Å; N50-L53 PolarHBondContact O-N 2.89Å; L53-A56 PolarHBondContact O-N 2.83Å; L53-L57 VanDerWaalsContact O-CB 3.3Å; L53-L57 WeakPolarHBondContact O-CB 3.5Å; L53-L57 PolarHBondContact O-N 3.48Å
54	E	96.8	Very high	96.8	Very high	116 Å²	116	105.6 Å²	105.6	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-59.2	-48.6	173.6	-68.5	175.4	142.9	0	0	111.3	N50 A56 L57 E58	N50-E54 WeakPolarHBondContact O-CG 3.4Å; N50-E54 PolarHBondContact O-N 3.38Å; E54-A56 VanDerWaalsContact C-N 3.33Å; E54-A56 PolarHBondContact O-N 3.36Å; E54-L57 PolarHBondContact O-N 3.06Å; E54-E58 WeakPolarHBondContact O-CB 3.36Å; E54-E58 PolarHBondContact O-N 3.18Å
55	L	97.1	Very high	96.8	Very high	116 Å²	116	105.2 Å²	105.2	61%	0.607	53%	0.528	S	S	*	.	H	α-helix	trans	-63.5	-35.9	176.5	-71.6	169.7	0	0	0	112.8	R51 K59	R51-L55 HydrophobicContact CG-CD1 4.35Å; R51-L55 WeakPolarHBondContact O-CB 3.4Å; R51-L55 VanDerWaalsContact O-CG 3.27Å; R51-L55 WeakPolarHBondContact O-CG 3.35Å; R51-L55 PolarHBondContact O-N 3.15Å; L55-K59 WeakPolarHBondContact O-CB 3.44Å; L55-K59 PolarHBondContact O-N 2.98Å; L55-K59 VanDerWaalsContact O-N 3.13Å
56	A	95.9	Very high	96.8	Very high	61 Å²	61	107.4 Å²	107.4	50%	0.504	53%	0.529	S	S	.	.	H	α-helix	trans	-70.3	-40	175.4	0	0	0	0	0	112.1	K52 L53 E54 S60	K52-A56 WeakPolarHBondContact O-CB 3.39Å; K52-A56 PolarHBondContact O-N 3.41Å; K52-A56 VanDerWaalsContact O-N 3.08Å; L53-A56 PolarHBondContact O-N 2.83Å; E54-A56 VanDerWaalsContact C-N 3.33Å; E54-A56 PolarHBondContact O-N 3.36Å; A56-S60 WeakPolarHBondContact O-CB 3.28Å; A56-S60 PolarHBondContact O-N 3.3Å
57	L	96.9	Very high	96.7	Very high	102 Å²	102	106.5 Å²	106.5	53%	0.534	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-45.8	176.2	177.3	62.6	0	0	0	111.2	L53 E54 K59 S60 K61	L53-L57 VanDerWaalsContact O-CB 3.3Å; L53-L57 WeakPolarHBondContact O-CB 3.5Å; L53-L57 PolarHBondContact O-N 3.48Å; E54-L57 PolarHBondContact O-N 3.06Å; L57-K59 PolarHBondContact O-N 3.04Å; L57-S60 WeakPolarHBondContact O-CA 3.46Å; L57-S60 VanDerWaalsContact O-CB 3.29Å; L57-S60 WeakPolarHBondContact O-CB 3.43Å; L57-S60 PolarHBondContact O-N 3.42Å; L57-K61 PolarHBondContact O-N 3.33Å
58	E	97	Very high	96.7	Very high	109 Å²	109	105 Å²	105	51%	0.509	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-39.8	179.7	-159.2	61.1	-156.9	0	0	111.7	E54 S60 K61 S62	E54-E58 WeakPolarHBondContact O-CB 3.36Å; E54-E58 PolarHBondContact O-N 3.18Å; E58-S60 VanDerWaalsContact C-N 3.29Å; E58-S60 PolarHBondContact O-N 3.46Å; E58-K61 PolarHBondContact O-N 3.17Å; E58-K61 WeakPolarHBondContact OE2-CE 3.49Å; E58-K61 IonicContact OE2-NZ 2.63Å; E58-K61 PolarHBondContact OE2-NZ 3.15Å; E58-S62 PolarHBondContact O-N 2.96Å
59	K	97.5	Very high	96.7	Very high	145 Å²	145	104.3 Å²	104.3	63%	0.63	52%	0.518	S	S	*	.	H	α-helix	trans	-60.5	-38.5	169.3	179.8	170	179.6	171.9	0	112.1	L55 L57 S62 I63	L55-K59 WeakPolarHBondContact O-CB 3.44Å; L55-K59 PolarHBondContact O-N 2.98Å; L55-K59 VanDerWaalsContact O-N 3.13Å; L57-K59 PolarHBondContact O-N 3.04Å; K59-S62 PolarHBondContact O-N 3.45Å; K59-I63 HydrophobicContact CG-CD1 4.04Å; K59-I63 WeakPolarHBondContact O-CG1 3.41Å; K59-I63 PolarHBondContact O-N 3.49Å
60	S	95.9	Very high	96.7	Very high	67 Å²	67	100.8 Å²	100.8	47%	0.469	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-47	177.1	-161	0	0	0	0	111.6	A56 L57 E58 S62 I63 E64	A56-S60 WeakPolarHBondContact O-CB 3.28Å; A56-S60 PolarHBondContact O-N 3.3Å; L57-S60 WeakPolarHBondContact O-CA 3.46Å; L57-S60 VanDerWaalsContact O-CB 3.29Å; L57-S60 WeakPolarHBondContact O-CB 3.43Å; L57-S60 PolarHBondContact O-N 3.42Å; E58-S60 VanDerWaalsContact C-N 3.29Å; E58-S60 PolarHBondContact O-N 3.46Å; S60-S62 VanDerWaalsContact C-N 3.32Å; S60-S62 PolarHBondContact O-N 2.92Å; S60-I63 PolarHBondContact O-N 3.43Å; S60-E64 WeakPolarHBondContact O-CB 3.25Å; S60-E64 PolarHBondContact O-N 3.19Å
61	K	97.5	Very high	96.7	Very high	78 Å²	78	101.1 Å²	101.1	34%	0.339	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-40.9	175.7	-64.5	176	-164.5	159.1	0	112.5	L57 E58 I63 E64 Q65	L57-K61 PolarHBondContact O-N 3.33Å; E58-K61 PolarHBondContact O-N 3.17Å; E58-K61 WeakPolarHBondContact OE2-CE 3.49Å; E58-K61 IonicContact OE2-NZ 2.63Å; E58-K61 PolarHBondContact OE2-NZ 3.15Å; K61-I63 VanDerWaalsContact C-N 3.28Å; K61-I63 PolarHBondContact O-N 2.93Å; K61-E64 WeakPolarHBondContact O-CB 3.49Å; K61-E64 PolarHBondContact O-N 3.05Å; K61-Q65 WeakPolarHBondContact O-CB 3.49Å; K61-Q65 WeakPolarHBondContact O-CG 3.25Å; K61-Q65 PolarHBondContact O-N 3.42Å
62	S	95.7	Very high	96.7	Very high	75 Å²	75	100.2 Å²	100.2	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-63.7	-34.3	178.3	177.3	0	0	0	0	112.2	E58 K59 S60 E66	E58-S62 PolarHBondContact O-N 2.96Å; K59-S62 PolarHBondContact O-N 3.45Å; S60-S62 VanDerWaalsContact C-N 3.32Å; S60-S62 PolarHBondContact O-N 2.92Å; S62-E66 PolarHBondContact O-N 3.37Å
63	I	97.2	Very high	96.7	Very high	79 Å²	79	99.6 Å²	99.6	41%	0.405	51%	0.51	S	S	.	.	H	α-helix	trans	-76	-37.8	174.6	-65.8	165.1	0	0	0	110.6	K59 S60 K61 E66 K67	K59-I63 HydrophobicContact CG-CD1 4.04Å; K59-I63 WeakPolarHBondContact O-CG1 3.41Å; K59-I63 PolarHBondContact O-N 3.49Å; S60-I63 PolarHBondContact O-N 3.43Å; K61-I63 VanDerWaalsContact C-N 3.28Å; K61-I63 PolarHBondContact O-N 2.93Å; I63-E66 WeakPolarHBondContact O-CB 3.41Å; I63-E66 PolarHBondContact O-N 3.25Å; I63-K67 WeakPolarHBondContact O-CG 3.27Å; I63-K67 PolarHBondContact O-N 3.31Å
64	E	96	Very high	96.7	Very high	118 Å²	118	98.5 Å²	98.5	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-58.7	-49.3	174.8	-166.2	167.4	-153.1	0	0	110.7	S60 K61 E66 K67 D68	S60-E64 WeakPolarHBondContact O-CB 3.25Å; S60-E64 PolarHBondContact O-N 3.19Å; K61-E64 WeakPolarHBondContact O-CB 3.49Å; K61-E64 PolarHBondContact O-N 3.05Å; E64-E66 VanDerWaalsContact C-N 3.34Å; E64-E66 PolarHBondContact O-N 2.92Å; E64-K67 PolarHBondContact O-N 2.91Å; E64-D68 PolarHBondContact O-N 3.24Å
65	Q	96.5	Very high	96.7	Very high	131 Å²	131	97.7 Å²	97.7	61%	0.612	50%	0.503	S	S	*	.	H	α-helix	trans	-61	-36.1	174.1	-70.7	170.6	-1.6	0	0	113.6	K61 A69	K61-Q65 WeakPolarHBondContact O-CB 3.49Å; K61-Q65 WeakPolarHBondContact O-CG 3.25Å; K61-Q65 PolarHBondContact O-N 3.42Å; Q65-A69 WeakPolarHBondContact O-CB 3.42Å; Q65-A69 PolarHBondContact O-N 2.83Å; Q65-A69 VanDerWaalsContact O-N 3.11Å
66	E	96	Very high	96.7	Very high	101 Å²	101	99.6 Å²	99.6	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-40	173	-175.2	-170.5	-161.3	0	0	111.3	S62 I63 E64 E70	S62-E66 PolarHBondContact O-N 3.37Å; I63-E66 WeakPolarHBondContact O-CB 3.41Å; I63-E66 PolarHBondContact O-N 3.25Å; E64-E66 VanDerWaalsContact C-N 3.34Å; E64-E66 PolarHBondContact O-N 2.92Å; E66-E70 WeakPolarHBondContact O-CB 3.31Å; E66-E70 PolarHBondContact O-N 2.83Å
67	K	96.3	Very high	96.7	Very high	83 Å²	83	101.1 Å²	101.1	36%	0.361	50%	0.503	S	S	.	.	H	α-helix	trans	-69.7	-39.7	176.7	-67.9	-46.3	93.9	-167.6	0	111.8	I63 E64 A69 E70 I71	I63-K67 WeakPolarHBondContact O-CG 3.27Å; I63-K67 PolarHBondContact O-N 3.31Å; E64-K67 PolarHBondContact O-N 2.91Å; K67-A69 PolarHBondContact O-N 3.2Å; K67-E70 IonicContact NZ-OE2 2.67Å; K67-E70 PolarHBondContact NZ-OE2 3.47Å; K67-E70 PolarHBondContact O-N 2.88Å; K67-I71 WeakPolarHBondContact O-CB 3.43Å; K67-I71 WeakPolarHBondContact O-CD1 3.18Å; K67-I71 VanDerWaalsContact O-CG1 3.25Å; K67-I71 WeakPolarHBondContact O-CG1 3.43Å; K67-I71 PolarHBondContact O-N 2.95Å
68	D	97.2	Very high	96.6	Very high	90 Å²	90	100.5 Å²	100.5	48%	0.481	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-44.6	175.9	-69.3	-25.6	0	0	0	111	E64 E70 I71 E72	E64-D68 PolarHBondContact O-N 3.24Å; D68-E70 PolarHBondContact O-N 3.45Å; D68-I71 PolarHBondContact O-N 3.07Å; D68-E72 PolarHBondContact O-N 2.84Å
69	A	96.6	Very high	96.6	Very high	57 Å²	57	98.6 Å²	98.6	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-35.3	175.9	0	0	0	0	0	113.3	Q65 K67 F73	Q65-A69 WeakPolarHBondContact O-CB 3.42Å; Q65-A69 PolarHBondContact O-N 2.83Å; Q65-A69 VanDerWaalsContact O-N 3.11Å; K67-A69 PolarHBondContact O-N 3.2Å; A69-F73 WeakPolarHBondContact O-CB 3.41Å; A69-F73 PolarHBondContact O-N 3.42Å
70	E	97.1	Very high	96.5	Very high	95 Å²	95	95.8 Å²	95.8	44%	0.444	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-41.7	171.6	-176.8	178.3	-160.2	0	0	111.4	E66 K67 D68 F73 L74	E66-E70 WeakPolarHBondContact O-CB 3.31Å; E66-E70 PolarHBondContact O-N 2.83Å; K67-E70 IonicContact NZ-OE2 2.67Å; K67-E70 PolarHBondContact NZ-OE2 3.47Å; K67-E70 PolarHBondContact O-N 2.88Å; D68-E70 PolarHBondContact O-N 3.45Å; E70-F73 PolarHBondContact O-N 3.15Å; E70-L74 HydrophobicContact CG-CD1 4.01Å; E70-L74 WeakPolarHBondContact O-CB 3.42Å; E70-L74 VanDerWaalsContact O-CG 3.28Å; E70-L74 WeakPolarHBondContact O-CG 3.47Å; E70-L74 PolarHBondContact O-N 3.03Å
71	I	96.2	Very high	96.5	Very high	88 Å²	88	97.3 Å²	97.3	45%	0.451	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-46.4	176.7	-70.8	163.1	0	0	0	110.9	K67 D68 F73 L74 I75	K67-I71 WeakPolarHBondContact O-CB 3.43Å; K67-I71 WeakPolarHBondContact O-CD1 3.18Å; K67-I71 VanDerWaalsContact O-CG1 3.25Å; K67-I71 WeakPolarHBondContact O-CG1 3.43Å; K67-I71 PolarHBondContact O-N 2.95Å; D68-I71 PolarHBondContact O-N 3.07Å; I71-F73 VanDerWaalsContact C-N 3.32Å; I71-F73 PolarHBondContact O-N 3.18Å; I71-L74 PolarHBondContact O-N 3.43Å; I71-I75 HydrophobicContact CG2-CD1 3.69Å; I71-I75 HydrophobicContact CG2-CG1 4.4Å; I71-I75 WeakPolarHBondContact O-CB 3.31Å; I71-I75 VanDerWaalsContact O-CG1 3.28Å; I71-I75 WeakPolarHBondContact O-CG1 3.46Å; I71-I75 PolarHBondContact O-N 3.45Å
72	E	96.5	Very high	96.4	Very high	148 Å²	148	99.5 Å²	99.5	69%	0.692	50%	0.495	S	S	*	.	H	α-helix	trans	-58.8	-41.9	174.6	-74.7	-168	168.4	0	0	112.2	D68 K76	D68-E72 PolarHBondContact O-N 2.84Å; E72-K76 WeakPolarHBondContact O-CB 3.5Å; E72-K76 PolarHBondContact O-N 3.46Å
73	F	97.5	Very high	96.4	Very high	132 Å²	132	100.1 Å²	100.1	58%	0.579	49%	0.49	S	S	*	.	H	α-helix	trans	-62.7	-47	175.7	178.9	-88.2	0	0	0	111.9	A69 E70 I71 K76 E77	A69-F73 WeakPolarHBondContact O-CB 3.41Å; A69-F73 PolarHBondContact O-N 3.42Å; E70-F73 PolarHBondContact O-N 3.15Å; I71-F73 VanDerWaalsContact C-N 3.32Å; I71-F73 PolarHBondContact O-N 3.18Å; F73-K76 CarbonylContact O-C 3.59Å; F73-K76 WeakPolarHBondContact O-CB 3.35Å; F73-K76 PolarHBondContact O-N 3.42Å; F73-K76 VanDerWaalsContact O-N 3.16Å; F73-E77 PolarHBondContact O-N 2.84Å
74	L	97.3	Very high	96.2	Very high	78 Å²	78	99 Å²	99	41%	0.408	48%	0.484	S	S	.	.	H	α-helix	trans	-66.7	-37.7	-179.6	-70.4	170.4	0	0	0	112.2	E70 I71 K76 E77 I78	E70-L74 HydrophobicContact CG-CD1 4.01Å; E70-L74 WeakPolarHBondContact O-CB 3.42Å; E70-L74 VanDerWaalsContact O-CG 3.28Å; E70-L74 WeakPolarHBondContact O-CG 3.47Å; E70-L74 PolarHBondContact O-N 3.03Å; I71-L74 PolarHBondContact O-N 3.43Å; L74-K76 VanDerWaalsContact C-N 3.3Å; L74-K76 PolarHBondContact O-N 3.44Å; L74-E77 PolarHBondContact O-N 2.88Å; L74-I78 WeakPolarHBondContact O-CB 3.31Å; L74-I78 VanDerWaalsContact O-CG1 3.25Å; L74-I78 WeakPolarHBondContact O-CG1 3.38Å; L74-I78 PolarHBondContact O-N 3.47Å
75	I	96.6	Very high	96.2	Very high	99 Å²	99	96.7 Å²	96.7	51%	0.508	48%	0.481	S	S	.	.	H	α-helix	trans	-61.1	-41.6	171.6	-70.4	166.7	0	0	0	110.5	I71 I78 T79	I71-I75 HydrophobicContact CG2-CD1 3.69Å; I71-I75 HydrophobicContact CG2-CG1 4.4Å; I71-I75 WeakPolarHBondContact O-CB 3.31Å; I71-I75 VanDerWaalsContact O-CG1 3.28Å; I71-I75 WeakPolarHBondContact O-CG1 3.46Å; I71-I75 PolarHBondContact O-N 3.45Å; I75-I78 PolarHBondContact O-N 3.11Å; I75-T79 WeakPolarHBondContact O-CB 3.23Å; I75-T79 WeakPolarHBondContact O-CG2 3.43Å; I75-T79 PolarHBondContact O-N 2.98Å; I75-T79 PolarHBondContact O-OG1 3Å
76	K	97.1	Very high	96.1	Very high	155 Å²	155	96 Å²	96	67%	0.674	48%	0.478	S	S	*	.	H	α-helix	trans	-66.9	-33.8	176.3	-170.9	175.6	-178.1	175.9	0	113	E72 F73 L74 T79 N80	E72-K76 WeakPolarHBondContact O-CB 3.5Å; E72-K76 PolarHBondContact O-N 3.46Å; F73-K76 CarbonylContact O-C 3.59Å; F73-K76 WeakPolarHBondContact O-CB 3.35Å; F73-K76 PolarHBondContact O-N 3.42Å; F73-K76 VanDerWaalsContact O-N 3.16Å; L74-K76 VanDerWaalsContact C-N 3.3Å; L74-K76 PolarHBondContact O-N 3.44Å; K76-T79 WeakPolarHBondContact CA-OG1 3.13Å; K76-T79 PolarHBondContact O-OG1 3.48Å; K76-T79 VanDerWaalsContact O-OG1 3.09Å; K76-N80 WeakPolarHBondContact O-CB 3.4Å; K76-N80 PolarHBondContact O-N 2.84Å
77	E	96.1	Very high	96	Very high	94 Å²	94	96.1 Å²	96.1	44%	0.439	47%	0.474	S	S	.	.	H	α-helix	trans	-71	-45.3	173.1	-171.4	168.5	-171.6	0	0	111.4	F73 L74 T79 N80 L81	F73-E77 PolarHBondContact O-N 2.84Å; L74-E77 PolarHBondContact O-N 2.88Å; E77-T79 PolarHBondContact O-N 3.21Å; E77-N80 PolarHBondContact O-N 2.86Å; E77-L81 HydrophobicContact CG-CD1 4.11Å; E77-L81 HydrophobicContact CG-CG 4.47Å; E77-L81 WeakPolarHBondContact O-CB 3.39Å; E77-L81 WeakPolarHBondContact O-CG 3.11Å; E77-L81 PolarHBondContact O-N 3.15Å
78	I	95.7	Very high	96	Very high	89 Å²	89	97.4 Å²	97.4	46%	0.456	48%	0.48	S	S	.	.	H	α-helix	trans	-60.7	-44.6	177.8	-70.5	164.4	0	0	0	111.6	L74 I75 L81 R82	L74-I78 WeakPolarHBondContact O-CB 3.31Å; L74-I78 VanDerWaalsContact O-CG1 3.25Å; L74-I78 WeakPolarHBondContact O-CG1 3.38Å; L74-I78 PolarHBondContact O-N 3.47Å; I75-I78 PolarHBondContact O-N 3.11Å; I78-L81 PolarHBondContact O-N 2.88Å; I78-R82 WeakPolarHBondContact O-CG 3.24Å; I78-R82 PolarHBondContact O-N 3.29Å
79	T	95.7	Very high	95.8	Very high	68 Å²	68	98.3 Å²	98.3	42%	0.417	48%	0.482	S	S	.	.	H	α-helix	trans	-63.3	-43.7	176.9	45.1	0	0	0	0	111.8	I75 K76 E77 L81 R82 E83	I75-T79 WeakPolarHBondContact O-CB 3.23Å; I75-T79 WeakPolarHBondContact O-CG2 3.43Å; I75-T79 PolarHBondContact O-N 2.98Å; I75-T79 PolarHBondContact O-OG1 3Å; K76-T79 WeakPolarHBondContact CA-OG1 3.13Å; K76-T79 PolarHBondContact O-OG1 3.48Å; K76-T79 VanDerWaalsContact O-OG1 3.09Å; E77-T79 PolarHBondContact O-N 3.21Å; T79-L81 VanDerWaalsContact C-N 3.35Å; T79-L81 PolarHBondContact O-N 3.06Å; T79-R82 WeakPolarHBondContact O-CB 3.28Å; T79-R82 PolarHBondContact O-N 3.39Å; T79-E83 PolarHBondContact O-N 3.09Å
80	N	95.6	Very high	95.8	Very high	87 Å²	87	100.2 Å²	100.2	47%	0.465	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-37.5	175.5	-165.6	20.4	0	0	0	112.2	K76 E77 E83 L84	K76-N80 WeakPolarHBondContact O-CB 3.4Å; K76-N80 PolarHBondContact O-N 2.84Å; E77-N80 PolarHBondContact O-N 2.86Å; N80-E83 PolarHBondContact O-N 3.32Å; N80-L84 WeakPolarHBondContact O-CB 3.5Å; N80-L84 VanDerWaalsContact O-CG 3.29Å; N80-L84 WeakPolarHBondContact O-CG 3.47Å; N80-L84 PolarHBondContact O-N 2.88Å
81	L	95.5	Very high	95.6	Very high	98 Å²	98	101.3 Å²	101.3	51%	0.513	49%	0.485	S	S	.	.	H	α-helix	trans	-66.4	-39.2	172.8	-73.3	171	0	0	0	112.6	E77 I78 T79 L84 S85	E77-L81 HydrophobicContact CG-CD1 4.11Å; E77-L81 HydrophobicContact CG-CG 4.47Å; E77-L81 WeakPolarHBondContact O-CB 3.39Å; E77-L81 WeakPolarHBondContact O-CG 3.11Å; E77-L81 PolarHBondContact O-N 3.15Å; I78-L81 PolarHBondContact O-N 2.88Å; T79-L81 VanDerWaalsContact C-N 3.35Å; T79-L81 PolarHBondContact O-N 3.06Å; L81-L84 PolarHBondContact O-N 3.34Å; L81-S85 PolarHBondContact O-N 2.82Å
82	R	95.6	Very high	95.6	Very high	124 Å²	124	99.5 Å²	99.5	47%	0.468	48%	0.478	S	S	.	.	H	α-helix	trans	-60.3	-48.4	172.4	-74.8	176.6	175.7	-154.7	-5.6	110.8	I78 T79 L84 S85 Q86 F286	I78-R82 WeakPolarHBondContact O-CG 3.24Å; I78-R82 PolarHBondContact O-N 3.29Å; T79-R82 WeakPolarHBondContact O-CB 3.28Å; T79-R82 PolarHBondContact O-N 3.39Å; R82-L84 VanDerWaalsContact C-N 3.33Å; R82-L84 PolarHBondContact O-N 2.66Å; R82-S85 WeakPolarHBondContact O-CB 3.38Å; R82-S85 PolarHBondContact O-N 3.14Å; R82-Q86 PolarHBondContact O-N 3.4Å; R82-F286 PolarHBondContact NH2-O 3.36Å
83	E	95	Very high	95.5	Very high	88 Å²	88	96.5 Å²	96.5	41%	0.411	47%	0.466	S	S	.	.	H	α-helix	trans	-60.7	-38.8	175.4	-67.9	-171.8	-177.1	0	0	113.1	T79 N80 Q86 R87	T79-E83 PolarHBondContact O-N 3.09Å; N80-E83 PolarHBondContact O-N 3.32Å; E83-Q86 PolarHBondContact O-N 3.38Å; E83-R87 WeakPolarHBondContact O-CB 3.25Å; E83-R87 WeakPolarHBondContact O-CD 3.23Å; E83-R87 VanDerWaalsContact O-CG 3.25Å; E83-R87 WeakPolarHBondContact O-CG 3.47Å; E83-R87 PolarHBondContact O-N 3.09Å; E83-R87 IonicContact OE2-CZ 2.72Å; E83-R87 IonicContact OE2-NH1 2.64Å; E83-R87 PolarHBondContact OE2-NH1 2.96Å; E83-R87 IonicContact OE2-NH2 2.76Å; E83-R87 PolarHBondContact OE2-NH2 2.82Å
84	L	94.5	Very high	95.5	Very high	55 Å²	55	95 Å²	95	29%	0.288	46%	0.461	S	S	.	.	H	α-helix	trans	-68.1	-35.1	176.3	-75.1	168.4	0	0	0	112.1	N80 L81 R82 K88 I349	N80-L84 WeakPolarHBondContact O-CB 3.5Å; N80-L84 VanDerWaalsContact O-CG 3.29Å; N80-L84 WeakPolarHBondContact O-CG 3.47Å; N80-L84 PolarHBondContact O-N 2.88Å; L81-L84 PolarHBondContact O-N 3.34Å; R82-L84 VanDerWaalsContact C-N 3.33Å; R82-L84 PolarHBondContact O-N 2.66Å; L84-K88 WeakPolarHBondContact O-CB 3.48Å; L84-K88 PolarHBondContact O-N 3.31Å; L84-I349 HydrophobicContact CD2-CD1 4.36Å
85	S	95.2	Very high	95.4	Very high	70 Å²	70	92.9 Å²	92.9	49%	0.49	46%	0.455	S	S	.	.	H	α-helix	trans	-65.1	-46.9	173.2	-161.5	0	0	0	0	111.3	L81 R82 R87 K88 M89	L81-S85 PolarHBondContact O-N 2.82Å; R82-S85 WeakPolarHBondContact O-CB 3.38Å; R82-S85 PolarHBondContact O-N 3.14Å; S85-R87 PolarHBondContact O-N 3.06Å; S85-K88 WeakPolarHBondContact O-CB 3.41Å; S85-K88 PolarHBondContact O-N 2.91Å; S85-K88 VanDerWaalsContact O-N 3.17Å; S85-M89 PolarHBondContact O-N 3.05Å
86	Q	94.2	Very high	95.4	Very high	118 Å²	118	92.2 Å²	92.2	55%	0.551	45%	0.453	S	S	*	.	H	α-helix	trans	-57.8	-49.9	175.5	-174.2	-170.9	-30.6	0	0	111.5	R82 E83 K88 M89 E90	R82-Q86 PolarHBondContact O-N 3.4Å; E83-Q86 PolarHBondContact O-N 3.38Å; Q86-K88 PolarHBondContact O-N 3.28Å; Q86-M89 WeakPolarHBondContact O-CA 3.37Å; Q86-M89 WeakPolarHBondContact O-CB 3.46Å; Q86-M89 PolarHBondContact O-N 2.94Å; Q86-E90 PolarHBondContact NE2-OE1 2.94Å; Q86-E90 WeakPolarHBondContact O-CG 3.36Å; Q86-E90 PolarHBondContact O-N 3.11Å
87	R	95.1	Very high	95.3	Very high	102 Å²	102	90.6 Å²	90.6	39%	0.385	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-29.4	178.3	-71.2	165.9	-173.3	139.1	10.8	113.3	E83 S85 F91	E83-R87 WeakPolarHBondContact O-CB 3.25Å; E83-R87 WeakPolarHBondContact O-CD 3.23Å; E83-R87 VanDerWaalsContact O-CG 3.25Å; E83-R87 WeakPolarHBondContact O-CG 3.47Å; E83-R87 PolarHBondContact O-N 3.09Å; E83-R87 IonicContact OE2-CZ 2.72Å; E83-R87 IonicContact OE2-NH1 2.64Å; E83-R87 PolarHBondContact OE2-NH1 2.96Å; E83-R87 IonicContact OE2-NH2 2.76Å; E83-R87 PolarHBondContact OE2-NH2 2.82Å; S85-R87 PolarHBondContact O-N 3.06Å; R87-F91 WeakPolarHBondContact O-CB 3.48Å; R87-F91 PolarHBondContact O-N 3.33Å; R87-F91 VanDerWaalsContact O-N 3.16Å
88	K	95.1	Very high	95.3	Very high	111 Å²	111	92.6 Å²	92.6	48%	0.483	45%	0.447	S	S	.	.	H	α-helix	trans	-69.8	-41.8	172	-176.6	-165.8	170	-158.9	0	110.8	L84 S85 Q86 F91 V92 W345	L84-K88 WeakPolarHBondContact O-CB 3.48Å; L84-K88 PolarHBondContact O-N 3.31Å; S85-K88 WeakPolarHBondContact O-CB 3.41Å; S85-K88 PolarHBondContact O-N 2.91Å; S85-K88 VanDerWaalsContact O-N 3.17Å; Q86-K88 PolarHBondContact O-N 3.28Å; K88-F91 PolarHBondContact O-N 3.37Å; K88-V92 WeakPolarHBondContact O-CG2 3.47Å; K88-V92 PolarHBondContact O-N 3.23Å; K88-W345 HydrophobicContact CB-CH2 4.28Å; K88-W345 HydrophobicContact CD-CH2 4.21Å; K88-W345 HydrophobicContact CG-CH2 4.18Å; K88-W345 HydrophobicContact CG-CZ3 4.37Å
89	M	93.1	Very high	95.2	Very high	108 Å²	108	92 Å²	92	53%	0.532	44%	0.444	S	S	.	.	H	α-helix	trans	-61.3	-50	174.4	-164.7	71.5	81.1	0	0	111	S85 Q86 F91 V92 D93	S85-M89 PolarHBondContact O-N 3.05Å; Q86-M89 WeakPolarHBondContact O-CA 3.37Å; Q86-M89 WeakPolarHBondContact O-CB 3.46Å; Q86-M89 PolarHBondContact O-N 2.94Å; M89-F91 PolarHBondContact O-N 3.41Å; M89-V92 PolarHBondContact O-N 3.37Å; M89-D93 PolarHBondContact O-N 3.46Å
90	E	96.4	Very high	95.3	Very high	98 Å²	98	92.8 Å²	92.8	46%	0.458	44%	0.443	S	S	.	.	H	α-helix	trans	-54	-39	176.5	-69.3	166.5	-178.9	0	0	112.5	Q86 E94	Q86-E90 PolarHBondContact NE2-OE1 2.94Å; Q86-E90 WeakPolarHBondContact O-CG 3.36Å; Q86-E90 PolarHBondContact O-N 3.11Å; E90-E94 WeakPolarHBondContact O-CB 3.36Å; E90-E94 PolarHBondContact O-N 2.76Å; E90-E94 VanDerWaalsContact O-N 3.11Å
91	F	93.9	Very high	95.3	Very high	118 Å²	118	95 Å²	95	52%	0.518	45%	0.451	S	S	.	.	H	α-helix	trans	-73.6	-34.8	176.2	-178.8	-99.9	0	0	0	113.5	R87 K88 M89 A95	R87-F91 WeakPolarHBondContact O-CB 3.48Å; R87-F91 PolarHBondContact O-N 3.33Å; R87-F91 VanDerWaalsContact O-N 3.16Å; K88-F91 PolarHBondContact O-N 3.37Å; M89-F91 PolarHBondContact O-N 3.41Å; F91-A95 WeakPolarHBondContact O-CB 3.48Å; F91-A95 PolarHBondContact O-N 2.76Å
92	V	95.4	Very high	95.3	Very high	49 Å²	49	94.3 Å²	94.3	30%	0.297	45%	0.448	S	S	.	.	H	α-helix	trans	-67.5	-45.2	174	169.4	0	0	0	0	110.4	K88 M89 E94 A95 D96	K88-V92 WeakPolarHBondContact O-CG2 3.47Å; K88-V92 PolarHBondContact O-N 3.23Å; M89-V92 PolarHBondContact O-N 3.37Å; V92-E94 VanDerWaalsContact C-N 3.33Å; V92-E94 PolarHBondContact O-N 3Å; V92-A95 PolarHBondContact O-N 2.89Å; V92-D96 PolarHBondContact O-N 2.94Å
93	D	95.6	Very high	95.3	Very high	85 Å²	85	91.7 Å²	91.7	46%	0.455	44%	0.443	S	S	.	.	H	α-helix	trans	-59.6	-41	175.2	-79.8	-30.2	0	0	0	112.2	M89 D96 R97	M89-D93 PolarHBondContact O-N 3.46Å; D93-D96 PolarHBondContact O-N 3.35Å; D93-R97 WeakPolarHBondContact O-CG 3.39Å; D93-R97 PolarHBondContact O-N 3.19Å
94	E	96.1	Very high	95.3	Very high	100 Å²	100	91.8 Å²	91.8	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-67.5	-40.5	175.5	-168.4	70.1	-82.5	0	0	112.3	E90 V92 D96 R97 Y98	E90-E94 WeakPolarHBondContact O-CB 3.36Å; E90-E94 PolarHBondContact O-N 2.76Å; E90-E94 VanDerWaalsContact O-N 3.11Å; V92-E94 VanDerWaalsContact C-N 3.33Å; V92-E94 PolarHBondContact O-N 3Å; E94-D96 VanDerWaalsContact C-N 3.32Å; E94-D96 PolarHBondContact O-N 3.4Å; E94-R97 PolarHBondContact O-N 2.88Å; E94-R97 IonicContact OE1-CZ 3.29Å; E94-R97 VanDerWaalsContact OE1-CZ 3.24Å; E94-R97 IonicContact OE1-NE 2.76Å; E94-R97 PolarHBondContact OE1-NE 2.86Å; E94-R97 IonicContact OE1-NH2 3.77Å; E94-R97 PolarHBondContact OE1-NH2 3.18Å; E94-R97 IonicContact OE2-CZ 2.82Å; E94-R97 IonicContact OE2-NE 3.24Å; E94-R97 IonicContact OE2-NH2 2.66Å; E94-R97 PolarHBondContact OE2-NH2 2.84Å; E94-Y98 WeakPolarHBondContact O-CB 3.32Å; E94-Y98 PolarHBondContact O-N 2.93Å
95	A	96.6	Very high	95.3	Very high	35 Å²	35	92 Å²	92	29%	0.289	45%	0.452	S	S	.	.	H	α-helix	trans	-62.7	-40.4	174.6	0	0	0	0	0	111.4	F91 V92 Y98 N99	F91-A95 WeakPolarHBondContact O-CB 3.48Å; F91-A95 PolarHBondContact O-N 2.76Å; V92-A95 PolarHBondContact O-N 2.89Å; A95-Y98 PolarHBondContact O-N 2.63Å; A95-N99 VanDerWaalsContact O-CB 3.28Å; A95-N99 WeakPolarHBondContact O-CB 3.5Å; A95-N99 PolarHBondContact O-N 3.43Å; A95-N99 PolarHBondContact O-ND2 3.43Å
96	D	96.3	Very high	95.4	Very high	84 Å²	84	92.9 Å²	92.9	45%	0.449	45%	0.452	S	S	.	.	H	α-helix	trans	-72.6	-31.2	177	-89.7	5.3	0	0	0	113.3	V92 D93 E94 Q100	V92-D96 PolarHBondContact O-N 2.94Å; D93-D96 PolarHBondContact O-N 3.35Å; E94-D96 VanDerWaalsContact C-N 3.32Å; E94-D96 PolarHBondContact O-N 3.4Å; D96-Q100 WeakPolarHBondContact O-CB 3.25Å; D96-Q100 VanDerWaalsContact O-CG 3.23Å; D96-Q100 WeakPolarHBondContact O-CG 3.35Å; D96-Q100 PolarHBondContact O-N 3.26Å; D96-Q100 PolarHBondContact O-NE2 3.36Å
97	R	95.1	Very high	95.4	Very high	122 Å²	122	92.4 Å²	92.4	46%	0.46	45%	0.445	S	S	.	.	H	α-helix	trans	-61.8	-53.9	166.8	-77.5	-167	-65	-101	14.6	110.8	D93 E94 N99 Q100 E101	D93-R97 WeakPolarHBondContact O-CG 3.39Å; D93-R97 PolarHBondContact O-N 3.19Å; E94-R97 PolarHBondContact O-N 2.88Å; E94-R97 IonicContact OE1-CZ 3.29Å; E94-R97 VanDerWaalsContact OE1-CZ 3.24Å; E94-R97 IonicContact OE1-NE 2.76Å; E94-R97 PolarHBondContact OE1-NE 2.86Å; E94-R97 IonicContact OE1-NH2 3.77Å; E94-R97 PolarHBondContact OE1-NH2 3.18Å; E94-R97 IonicContact OE2-CZ 2.82Å; E94-R97 IonicContact OE2-NE 3.24Å; E94-R97 IonicContact OE2-NH2 2.66Å; E94-R97 PolarHBondContact OE2-NH2 2.84Å; R97-N99 VanDerWaalsContact C-N 3.34Å; R97-N99 PolarHBondContact O-N 3.48Å; R97-Q100 PolarHBondContact O-N 3.27Å; R97-Q100 VanDerWaalsContact O-N 3.09Å; R97-E101 PolarHBondContact O-N 3.05Å
98	Y	95.8	Very high	95.5	Very high	135 Å²	135	93.6 Å²	93.6	53%	0.529	46%	0.455	S	S	.	.	H	α-helix	trans	-61.3	-41.1	-178.8	179.1	-108.5	0	0	0	112.3	E94 A95 E101 L102	E94-Y98 WeakPolarHBondContact O-CB 3.32Å; E94-Y98 PolarHBondContact O-N 2.93Å; A95-Y98 PolarHBondContact O-N 2.63Å; Y98-E101 PolarHBondContact O-N 3.19Å; Y98-L102 HydrophobicContact CD1-CD1 4.03Å; Y98-L102 HydrophobicContact CD1-CG 4.47Å; Y98-L102 HydrophobicContact CE1-CD1 3.48Å; Y98-L102 VanDerWaalsContact CE1-CD1 3.48Å; Y98-L102 HydrophobicContact CE1-CG 4.06Å; Y98-L102 HydrophobicContact CE2-CD2 4.45Å; Y98-L102 HydrophobicContact CE2-CG 4.33Å; Y98-L102 WeakPolarHBondContact O-CG 3.2Å; Y98-L102 PolarHBondContact O-N 2.73Å
99	N	94	Very high	95.6	Very high	76 Å²	76	93 Å²	93	41%	0.406	46%	0.456	S	S	.	.	H	α-helix	trans	-58.4	-48.1	172	-76.7	-28.1	0	0	0	111.1	A95 R97 E101 L102 D103	A95-N99 VanDerWaalsContact O-CB 3.28Å; A95-N99 WeakPolarHBondContact O-CB 3.5Å; A95-N99 PolarHBondContact O-N 3.43Å; A95-N99 PolarHBondContact O-ND2 3.43Å; R97-N99 VanDerWaalsContact C-N 3.34Å; R97-N99 PolarHBondContact O-N 3.48Å; N99-E101 VanDerWaalsContact C-N 3.32Å; N99-E101 PolarHBondContact O-N 3.09Å; N99-L102 PolarHBondContact O-N 3.24Å; N99-D103 WeakPolarHBondContact O-CB 3.43Å; N99-D103 PolarHBondContact O-N 3.42Å
100	Q	96.4	Very high	95.7	Very high	85 Å²	85	93.2 Å²	93.2	40%	0.397	46%	0.457	S	S	.	.	H	α-helix	trans	-62.9	-34.1	177.3	-75.2	171.8	92.3	0	0	113.4	D96 R97 N104	D96-Q100 WeakPolarHBondContact O-CB 3.25Å; D96-Q100 VanDerWaalsContact O-CG 3.23Å; D96-Q100 WeakPolarHBondContact O-CG 3.35Å; D96-Q100 PolarHBondContact O-N 3.26Å; D96-Q100 PolarHBondContact O-NE2 3.36Å; R97-Q100 PolarHBondContact O-N 3.27Å; R97-Q100 VanDerWaalsContact O-N 3.09Å; Q100-N104 VanDerWaalsContact O-CB 3.31Å; Q100-N104 WeakPolarHBondContact O-CB 3.46Å; Q100-N104 PolarHBondContact O-N 3.46Å; Q100-N104 PolarHBondContact O-ND2 3.26Å; Q100-N104 VanDerWaalsContact O-ND2 3.11Å
101	E	95.8	Very high	95.6	Very high	133 Å²	133	95.7 Å²	95.7	62%	0.621	46%	0.462	S	S	*	.	H	α-helix	trans	-67.3	-47.3	173.5	-72.4	-176	-174.8	0	0	112.4	R97 Y98 N99 D103 N104 S105	R97-E101 PolarHBondContact O-N 3.05Å; Y98-E101 PolarHBondContact O-N 3.19Å; N99-E101 VanDerWaalsContact C-N 3.32Å; N99-E101 PolarHBondContact O-N 3.09Å; E101-D103 VanDerWaalsContact C-N 3.27Å; E101-D103 PolarHBondContact O-N 3.46Å; E101-N104 PolarHBondContact O-N 3.41Å; E101-S105 WeakPolarHBondContact O-CB 3.36Å; E101-S105 PolarHBondContact O-N 3.37Å
102	L	95.7	Very high	95.8	Very high	85 Å²	85	95.9 Å²	95.9	45%	0.445	46%	0.463	S	S	.	.	H	α-helix	trans	-57.2	-43.6	173.3	-73.9	-179.9	0	0	0	111.5	Y98 N99 S105 N106	Y98-L102 HydrophobicContact CD1-CD1 4.03Å; Y98-L102 HydrophobicContact CD1-CG 4.47Å; Y98-L102 HydrophobicContact CE1-CD1 3.48Å; Y98-L102 VanDerWaalsContact CE1-CD1 3.48Å; Y98-L102 HydrophobicContact CE1-CG 4.06Å; Y98-L102 HydrophobicContact CE2-CD2 4.45Å; Y98-L102 HydrophobicContact CE2-CG 4.33Å; Y98-L102 WeakPolarHBondContact O-CG 3.2Å; Y98-L102 PolarHBondContact O-N 2.73Å; N99-L102 PolarHBondContact O-N 3.24Å; L102-S105 WeakPolarHBondContact O-CB 3.46Å; L102-S105 PolarHBondContact O-N 3.23Å; L102-N106 VanDerWaalsContact O-CB 3.31Å; L102-N106 WeakPolarHBondContact O-CB 3.45Å; L102-N106 PolarHBondContact O-N 3Å
103	D	95.6	Very high	95.8	Very high	69 Å²	69	97.4 Å²	97.4	37%	0.369	47%	0.468	S	S	.	.	H	α-helix	trans	-69	-36.6	-177	-160.1	38.1	0	0	0	111.6	N99 E101 R107	N99-D103 WeakPolarHBondContact O-CB 3.43Å; N99-D103 PolarHBondContact O-N 3.42Å; E101-D103 VanDerWaalsContact C-N 3.27Å; E101-D103 PolarHBondContact O-N 3.46Å; D103-R107 WeakPolarHBondContact O-CB 3.49Å; D103-R107 WeakPolarHBondContact O-CG 3.48Å; D103-R107 PolarHBondContact O-N 3.48Å; D103-R107 PolarHBondContact O-NE 2.96Å; D103-R107 IonicContact OD1-NH1 3.84Å; D103-R107 PolarHBondContact OD1-NH1 2.64Å; D103-R107 IonicContact OD2-CZ 2.75Å; D103-R107 IonicContact OD2-NH1 3.17Å; D103-R107 PolarHBondContact OD2-NH1 2.78Å; D103-R107 IonicContact OD2-NH2 3.76Å; D103-R107 PolarHBondContact OD2-NH2 2.92Å
104	N	95.7	Very high	95.8	Very high	90 Å²	90	95.3 Å²	95.3	48%	0.481	46%	0.461	S	S	.	.	H	α-helix	trans	-69.1	-41.5	170.7	-74.1	-25.6	0	0	0	112.8	Q100 E101 R107 Q108	Q100-N104 VanDerWaalsContact O-CB 3.31Å; Q100-N104 WeakPolarHBondContact O-CB 3.46Å; Q100-N104 PolarHBondContact O-N 3.46Å; Q100-N104 PolarHBondContact O-ND2 3.26Å; Q100-N104 VanDerWaalsContact O-ND2 3.11Å; E101-N104 PolarHBondContact O-N 3.41Å; N104-R107 PolarHBondContact O-N 2.74Å; N104-R107 PolarHBondContact OD1-NE 3.1Å; N104-R107 PolarHBondContact OD1-NH2 3.39Å; N104-Q108 PolarHBondContact O-N 3.11Å
105	S	95.4	Very high	95.8	Very high	59 Å²	59	96 Å²	96	41%	0.413	46%	0.464	S	S	.	.	H	α-helix	trans	-61.2	-45.1	174	-176.3	0	0	0	0	111.1	E101 L102 Q108 L109	E101-S105 WeakPolarHBondContact O-CB 3.36Å; E101-S105 PolarHBondContact O-N 3.37Å; L102-S105 WeakPolarHBondContact O-CB 3.46Å; L102-S105 PolarHBondContact O-N 3.23Å; S105-Q108 WeakPolarHBondContact O-CA 3.39Å; S105-Q108 WeakPolarHBondContact O-CB 3.27Å; S105-Q108 PolarHBondContact O-N 3.4Å; S105-L109 WeakPolarHBondContact O-CG 3.48Å; S105-L109 PolarHBondContact O-N 3Å
106	N	95.8	Very high	95.8	Very high	89 Å²	89	97.3 Å²	97.3	48%	0.476	47%	0.466	S	S	.	.	H	α-helix	trans	-60.4	-47.9	175.1	-168.6	10.8	0	0	0	111.5	L102 Q108 L109 M110	L102-N106 VanDerWaalsContact O-CB 3.31Å; L102-N106 WeakPolarHBondContact O-CB 3.45Å; L102-N106 PolarHBondContact O-N 3Å; N106-Q108 PolarHBondContact O-N 2.87Å; N106-L109 PolarHBondContact O-N 3Å; N106-L109 VanDerWaalsContact O-N 3.15Å; N106-M110 WeakPolarHBondContact O-CG 3.39Å; N106-M110 PolarHBondContact O-N 3.2Å
107	R	95.7	Very high	95.8	Very high	107 Å²	107	99 Å²	99	40%	0.404	47%	0.471	S	S	.	.	H	α-helix	trans	-59.6	-26.3	172.3	-79.8	-175.1	-76.5	-83.9	1	114	D103 N104 R111	D103-R107 WeakPolarHBondContact O-CB 3.49Å; D103-R107 WeakPolarHBondContact O-CG 3.48Å; D103-R107 PolarHBondContact O-N 3.48Å; D103-R107 PolarHBondContact O-NE 2.96Å; D103-R107 IonicContact OD1-NH1 3.84Å; D103-R107 PolarHBondContact OD1-NH1 2.64Å; D103-R107 IonicContact OD2-CZ 2.75Å; D103-R107 IonicContact OD2-NH1 3.17Å; D103-R107 PolarHBondContact OD2-NH1 2.78Å; D103-R107 IonicContact OD2-NH2 3.76Å; D103-R107 PolarHBondContact OD2-NH2 2.92Å; N104-R107 PolarHBondContact O-N 2.74Å; N104-R107 PolarHBondContact OD1-NE 3.1Å; N104-R107 PolarHBondContact OD1-NH2 3.39Å; R107-R111 WeakPolarHBondContact O-CG 3.43Å; R107-R111 PolarHBondContact O-NE 3.15Å
108	Q	96.3	Very high	95.8	Very high	128 Å²	128	99.3 Å²	99.3	60%	0.598	47%	0.472	S	S	*	.	H	α-helix	trans	-78.8	-43.1	173.2	-169.4	177	11.8	0	0	111.8	N104 S105 N106 R111 K112	N104-Q108 PolarHBondContact O-N 3.11Å; S105-Q108 WeakPolarHBondContact O-CA 3.39Å; S105-Q108 WeakPolarHBondContact O-CB 3.27Å; S105-Q108 PolarHBondContact O-N 3.4Å; N106-Q108 PolarHBondContact O-N 2.87Å; Q108-R111 PolarHBondContact O-N 3.2Å; Q108-K112 PolarHBondContact O-N 3.09Å; Q108-K112 VanDerWaalsContact O-N 3.07Å
109	L	96.6	Very high	95.8	Very high	98 Å²	98	98.7 Å²	98.7	51%	0.513	47%	0.472	S	S	.	.	H	α-helix	trans	-62.6	-45	176.4	-69.9	170.4	0	0	0	111.8	S105 N106 R111 K112 I113	S105-L109 WeakPolarHBondContact O-CG 3.48Å; S105-L109 PolarHBondContact O-N 3Å; N106-L109 PolarHBondContact O-N 3Å; N106-L109 VanDerWaalsContact O-N 3.15Å; L109-R111 PolarHBondContact O-N 2.97Å; L109-K112 PolarHBondContact O-N 2.94Å; L109-I113 VanDerWaalsContact O-CG1 3.31Å; L109-I113 WeakPolarHBondContact O-CG1 3.28Å; L109-I113 PolarHBondContact O-N 3.18Å
110	M	95.5	Very high	95.9	Very high	113 Å²	113	100.1 Å²	100.1	56%	0.557	48%	0.479	S	S	*	.	H	α-helix	trans	-63.6	-37.9	178.3	-70.8	-59.6	-68.2	0	0	113	N106 I113 S114	N106-M110 WeakPolarHBondContact O-CG 3.39Å; N106-M110 PolarHBondContact O-N 3.2Å; M110-I113 PolarHBondContact O-N 3.46Å; M110-I113 HydrophobicContact SD-CD1 4.15Å; M110-S114 PolarHBondContact O-N 2.94Å
111	R	95.7	Very high	95.9	Very high	150 Å²	150	101.9 Å²	101.9	57%	0.566	49%	0.487	S	S	*	.	H	α-helix	trans	-61.6	-47.7	171.1	-79.4	-179.4	-69.7	156	-3.9	111.5	R107 Q108 L109 I113 S114 E115	R107-R111 WeakPolarHBondContact O-CG 3.43Å; R107-R111 PolarHBondContact O-NE 3.15Å; Q108-R111 PolarHBondContact O-N 3.2Å; L109-R111 PolarHBondContact O-N 2.97Å; R111-I113 VanDerWaalsContact C-N 3.35Å; R111-I113 PolarHBondContact O-N 3.19Å; R111-S114 WeakPolarHBondContact O-CB 3.29Å; R111-S114 PolarHBondContact O-N 3.4Å; R111-S114 VanDerWaalsContact O-N 3.15Å; R111-E115 WeakPolarHBondContact O-CG 3.29Å; R111-E115 PolarHBondContact O-N 2.8Å
112	K	96.3	Very high	95.9	Very high	121 Å²	121	104.3 Å²	104.3	53%	0.526	49%	0.491	S	S	.	.	H	α-helix	trans	-60.4	-42.8	177.2	-166.8	-168.6	175.3	-159.3	0	112.1	Q108 L109 S114 E115 D116	Q108-K112 PolarHBondContact O-N 3.09Å; Q108-K112 VanDerWaalsContact O-N 3.07Å; L109-K112 PolarHBondContact O-N 2.94Å; K112-S114 VanDerWaalsContact C-N 3.31Å; K112-S114 PolarHBondContact O-N 3.5Å; K112-E115 PolarHBondContact O-N 3Å; K112-E115 VanDerWaalsContact O-N 3.15Å; K112-D116 VanDerWaalsContact CE-OD2 3.25Å; K112-D116 WeakPolarHBondContact CE-OD2 3.37Å; K112-D116 IonicContact NZ-OD2 3.47Å; K112-D116 WeakPolarHBondContact O-CB 3.44Å; K112-D116 PolarHBondContact O-N 3.02Å
113	I	95.6	Very high	95.9	Very high	81 Å²	81	104.7 Å²	104.7	42%	0.415	49%	0.493	S	S	.	.	H	α-helix	trans	-59	-43.8	175.8	-70.7	163.4	0	0	0	110.4	L109 M110 R111 E115 D116 Q117	L109-I113 VanDerWaalsContact O-CG1 3.31Å; L109-I113 WeakPolarHBondContact O-CG1 3.28Å; L109-I113 PolarHBondContact O-N 3.18Å; M110-I113 PolarHBondContact O-N 3.46Å; M110-I113 HydrophobicContact SD-CD1 4.15Å; R111-I113 VanDerWaalsContact C-N 3.35Å; R111-I113 PolarHBondContact O-N 3.19Å; I113-E115 VanDerWaalsContact C-N 3.34Å; I113-E115 PolarHBondContact O-N 3.47Å; I113-D116 PolarHBondContact O-N 3.27Å; I113-Q117 HydrophobicContact CG2-CG 4.34Å; I113-Q117 VanDerWaalsContact O-CB 3.27Å; I113-Q117 WeakPolarHBondContact O-CB 3.41Å; I113-Q117 WeakPolarHBondContact O-CG 3.5Å; I113-Q117 PolarHBondContact O-N 2.98Å
114	S	95.4	Very high	96	Very high	42 Å²	42	104.3 Å²	104.3	29%	0.294	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-33.1	175.8	-179	0	0	0	0	113.6	M110 R111 K112 R118	M110-S114 PolarHBondContact O-N 2.94Å; R111-S114 WeakPolarHBondContact O-CB 3.29Å; R111-S114 PolarHBondContact O-N 3.4Å; R111-S114 VanDerWaalsContact O-N 3.15Å; K112-S114 VanDerWaalsContact C-N 3.31Å; K112-S114 PolarHBondContact O-N 3.5Å; S114-R118 WeakPolarHBondContact O-CB 3.14Å; S114-R118 WeakPolarHBondContact O-CG 3.38Å; S114-R118 PolarHBondContact O-N 3.04Å; S114-R118 PolarHBondContact O-NE 2.99Å; S114-R118 PolarHBondContact OG-NE 3.17Å; S114-R118 PolarHBondContact OG-NH2 2.97Å
115	E	96.3	Very high	96	Very high	114 Å²	114	104.6 Å²	104.6	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-72.4	-46.9	174.9	-71.9	164.8	-158.7	0	0	111.7	R111 K112 I113 R118 K119	R111-E115 WeakPolarHBondContact O-CG 3.29Å; R111-E115 PolarHBondContact O-N 2.8Å; K112-E115 PolarHBondContact O-N 3Å; K112-E115 VanDerWaalsContact O-N 3.15Å; I113-E115 VanDerWaalsContact C-N 3.34Å; I113-E115 PolarHBondContact O-N 3.47Å; E115-R118 PolarHBondContact O-N 3.02Å; E115-K119 WeakPolarHBondContact O-CB 3.33Å; E115-K119 PolarHBondContact O-N 3.43Å
116	D	96.3	Very high	96	Very high	63 Å²	63	105.1 Å²	105.1	34%	0.337	50%	0.498	S	S	.	.	H	α-helix	trans	-64.9	-38.5	176.6	-80.4	-36.6	0	0	0	111.2	K112 I113 K119 I120	K112-D116 VanDerWaalsContact CE-OD2 3.25Å; K112-D116 WeakPolarHBondContact CE-OD2 3.37Å; K112-D116 IonicContact NZ-OD2 3.47Å; K112-D116 WeakPolarHBondContact O-CB 3.44Å; K112-D116 PolarHBondContact O-N 3.02Å; I113-D116 PolarHBondContact O-N 3.27Å; D116-K119 WeakPolarHBondContact O-CB 3.29Å; D116-K119 PolarHBondContact O-N 3.16Å; D116-I120 WeakPolarHBondContact O-CB 3.12Å; D116-I120 VanDerWaalsContact O-CG1 3.25Å; D116-I120 WeakPolarHBondContact O-CG1 3.3Å; D116-I120 PolarHBondContact O-N 3.49Å
117	Q	96.7	Very high	96	Very high	119 Å²	119	105.1 Å²	105.1	56%	0.556	50%	0.497	S	S	*	.	H	α-helix	trans	-59.1	-49	171.2	-79.6	170.9	-18.9	0	0	112.2	I113 K119 I120 Q121	I113-Q117 HydrophobicContact CG2-CG 4.34Å; I113-Q117 VanDerWaalsContact O-CB 3.27Å; I113-Q117 WeakPolarHBondContact O-CB 3.41Å; I113-Q117 WeakPolarHBondContact O-CG 3.5Å; I113-Q117 PolarHBondContact O-N 2.98Å; Q117-K119 VanDerWaalsContact C-N 3.26Å; Q117-K119 PolarHBondContact O-N 2.95Å; Q117-I120 PolarHBondContact O-N 3.16Å; Q117-Q121 PolarHBondContact O-N 3.37Å
118	R	95.6	Very high	96	Very high	128 Å²	128	102.5 Å²	102.5	48%	0.483	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-32.8	176.4	-79.8	176.6	-80.9	172.8	-7.8	112.3	S114 E115 R122	S114-R118 WeakPolarHBondContact O-CB 3.14Å; S114-R118 WeakPolarHBondContact O-CG 3.38Å; S114-R118 PolarHBondContact O-N 3.04Å; S114-R118 PolarHBondContact O-NE 2.99Å; S114-R118 PolarHBondContact OG-NE 3.17Å; S114-R118 PolarHBondContact OG-NH2 2.97Å; E115-R118 PolarHBondContact O-N 3.02Å; R118-R122 VanDerWaalsContact O-CG 3.28Å; R118-R122 WeakPolarHBondContact O-CG 3.48Å; R118-R122 PolarHBondContact O-N 3.14Å
119	K	96.4	Very high	95.9	Very high	122 Å²	122	101.7 Å²	101.7	53%	0.53	50%	0.496	S	S	.	.	H	α-helix	trans	-69.9	-43.5	173.6	-176.7	-179.3	175.5	-174.3	0	112.1	E115 D116 Q117 R122 L123	E115-K119 WeakPolarHBondContact O-CB 3.33Å; E115-K119 PolarHBondContact O-N 3.43Å; D116-K119 WeakPolarHBondContact O-CB 3.29Å; D116-K119 PolarHBondContact O-N 3.16Å; Q117-K119 VanDerWaalsContact C-N 3.26Å; Q117-K119 PolarHBondContact O-N 2.95Å; K119-R122 PolarHBondContact O-N 3.42Å; K119-L123 HydrophobicContact CG-CD1 4.21Å; K119-L123 WeakPolarHBondContact O-CG 3.45Å; K119-L123 PolarHBondContact O-N 3.02Å
120	I	95.7	Very high	95.8	Very high	107 Å²	107	101.6 Å²	101.6	55%	0.549	50%	0.495	S	S	.	.	H	α-helix	trans	-59.7	-50.2	174.6	-70.9	161.7	0	0	0	109.9	D116 Q117 R122 L123 S124	D116-I120 WeakPolarHBondContact O-CB 3.12Å; D116-I120 VanDerWaalsContact O-CG1 3.25Å; D116-I120 WeakPolarHBondContact O-CG1 3.3Å; D116-I120 PolarHBondContact O-N 3.49Å; Q117-I120 PolarHBondContact O-N 3.16Å; I120-R122 VanDerWaalsContact C-N 3.33Å; I120-R122 PolarHBondContact O-N 3.26Å; I120-L123 PolarHBondContact O-N 3.46Å; I120-S124 PolarHBondContact O-N 2.98Å; I120-S124 PolarHBondContact O-OG 2.89Å
121	Q	96	Very high	95.8	Very high	122 Å²	122	102.1 Å²	102.1	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-57.4	-43.7	179.3	-169.4	-176.9	20.7	0	0	112.4	Q117 L123 S124 N125	Q117-Q121 PolarHBondContact O-N 3.37Å; Q121-L123 PolarHBondContact O-N 3.4Å; Q121-S124 PolarHBondContact O-N 2.82Å; Q121-N125 WeakPolarHBondContact O-CB 3.28Å; Q121-N125 VanDerWaalsContact O-CG 3.22Å; Q121-N125 PolarHBondContact O-N 3.01Å; Q121-N125 PolarHBondContact O-OD1 3.02Å
122	R	95.8	Very high	95.7	Very high	183 Å²	183	101.8 Å²	101.8	69%	0.691	50%	0.501	S	S	*	.	H	α-helix	trans	-60	-44.2	174.3	-73.6	168.7	-178.9	172.9	0.1	112.1	R118 K119 I120 N125 T126	R118-R122 VanDerWaalsContact O-CG 3.28Å; R118-R122 WeakPolarHBondContact O-CG 3.48Å; R118-R122 PolarHBondContact O-N 3.14Å; K119-R122 PolarHBondContact O-N 3.42Å; I120-R122 VanDerWaalsContact C-N 3.33Å; I120-R122 PolarHBondContact O-N 3.26Å; R122-N125 PolarHBondContact O-N 3.24Å; R122-T126 PolarHBondContact O-N 3.05Å; R122-T126 PolarHBondContact O-OG1 3.18Å
123	L	96.4	Very high	95.6	Very high	93 Å²	93	101.3 Å²	101.3	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-66.9	-44.4	179.3	-71.2	169	0	0	0	111.7	K119 I120 Q121 N125 T126 I127	K119-L123 HydrophobicContact CG-CD1 4.21Å; K119-L123 WeakPolarHBondContact O-CG 3.45Å; K119-L123 PolarHBondContact O-N 3.02Å; I120-L123 PolarHBondContact O-N 3.46Å; Q121-L123 PolarHBondContact O-N 3.4Å; L123-N125 VanDerWaalsContact C-N 3.32Å; L123-N125 PolarHBondContact O-N 2.68Å; L123-T126 WeakPolarHBondContact CA-OG1 3.25Å; L123-T126 PolarHBondContact O-N 2.72Å; L123-T126 VanDerWaalsContact O-N 3.15Å; L123-T126 PolarHBondContact O-OG1 3.39Å; L123-I127 WeakPolarHBondContact O-CG1 3.46Å; L123-I127 PolarHBondContact O-N 3.45Å
124	S	96.5	Very high	95.5	Very high	62 Å²	62	102.3 Å²	102.3	43%	0.434	51%	0.506	S	S	.	.	H	α-helix	trans	-57.4	-43.4	173.6	-61.2	0	0	0	0	112	I120 Q121 T126 I127 A128	I120-S124 PolarHBondContact O-N 2.98Å; I120-S124 PolarHBondContact O-OG 2.89Å; Q121-S124 PolarHBondContact O-N 2.82Å; S124-T126 PolarHBondContact O-N 3.45Å; S124-I127 PolarHBondContact O-N 3.23Å; S124-A128 PolarHBondContact O-N 3.42Å
125	N	95.7	Very high	95.4	Very high	96 Å²	96	103.1 Å²	103.1	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-41.6	175.7	-69.1	7.9	0	0	0	111.8	Q121 R122 L123 I127 A128 M129	Q121-N125 WeakPolarHBondContact O-CB 3.28Å; Q121-N125 VanDerWaalsContact O-CG 3.22Å; Q121-N125 PolarHBondContact O-N 3.01Å; Q121-N125 PolarHBondContact O-OD1 3.02Å; R122-N125 PolarHBondContact O-N 3.24Å; L123-N125 VanDerWaalsContact C-N 3.32Å; L123-N125 PolarHBondContact O-N 2.68Å; N125-I127 VanDerWaalsContact C-N 3.33Å; N125-I127 PolarHBondContact O-N 2.96Å; N125-A128 PolarHBondContact O-N 2.97Å; N125-M129 WeakPolarHBondContact O-CG 3.4Å; N125-M129 PolarHBondContact O-N 3.33Å
126	T	95.7	Very high	95.2	Very high	70 Å²	70	99.2 Å²	99.2	43%	0.429	51%	0.506	S	S	.	.	H	α-helix	trans	-67.4	-31.5	175.2	53.7	0	0	0	0	113.3	R122 L123 S124 L130	R122-T126 PolarHBondContact O-N 3.05Å; R122-T126 PolarHBondContact O-OG1 3.18Å; L123-T126 WeakPolarHBondContact CA-OG1 3.25Å; L123-T126 PolarHBondContact O-N 2.72Å; L123-T126 VanDerWaalsContact O-N 3.15Å; L123-T126 PolarHBondContact O-OG1 3.39Å; S124-T126 PolarHBondContact O-N 3.45Å; T126-L130 VanDerWaalsContact O-CG 3.27Å; T126-L130 WeakPolarHBondContact O-CG 3.43Å; T126-L130 PolarHBondContact O-N 3.09Å; T126-L130 VanDerWaalsContact O-N 3.15Å
127	I	96	Very high	95	Very high	88 Å²	88	100.6 Å²	100.6	45%	0.451	51%	0.513	S	S	.	.	H	α-helix	trans	-66.9	-50	173.9	-70.5	164.2	0	0	0	109.5	L123 S124 N125 M129 L130 E131	L123-I127 WeakPolarHBondContact O-CG1 3.46Å; L123-I127 PolarHBondContact O-N 3.45Å; S124-I127 PolarHBondContact O-N 3.23Å; N125-I127 VanDerWaalsContact C-N 3.33Å; N125-I127 PolarHBondContact O-N 2.96Å; I127-M129 VanDerWaalsContact C-N 3.31Å; I127-M129 PolarHBondContact O-N 3.32Å; I127-L130 CarbonylContact O-C 3.58Å; I127-L130 WeakPolarHBondContact O-CA 3.22Å; I127-L130 PolarHBondContact O-N 2.88Å; I127-E131 HydrophobicContact CG2-CG 4.18Å; I127-E131 WeakPolarHBondContact O-CG 3.32Å; I127-E131 PolarHBondContact O-N 2.91Å
128	A	94.7	Very high	94.8	Very high	52 Å²	52	98 Å²	98	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-57.2	-41.6	178	0	0	0	0	0	112.7	S124 N125 L130 E131 E132	S124-A128 PolarHBondContact O-N 3.42Å; N125-A128 PolarHBondContact O-N 2.97Å; A128-L130 VanDerWaalsContact C-N 3.34Å; A128-L130 PolarHBondContact O-N 2.88Å; A128-E131 PolarHBondContact O-N 3.34Å; A128-E132 WeakPolarHBondContact O-CB 3.31Å; A128-E132 PolarHBondContact O-N 3.33Å
129	M	94.7	Very high	94.6	Very high	112 Å²	112	95.6 Å²	95.6	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-64.1	-35.4	174.2	-71.4	-179.7	72.1	0	0	113.2	N125 I127 Q133	N125-M129 WeakPolarHBondContact O-CG 3.4Å; N125-M129 PolarHBondContact O-N 3.33Å; I127-M129 VanDerWaalsContact C-N 3.31Å; I127-M129 PolarHBondContact O-N 3.32Å; M129-Q133 VanDerWaalsContact O-CG 3.26Å; M129-Q133 WeakPolarHBondContact O-CG 3.38Å; M129-Q133 PolarHBondContact O-N 2.79Å; M129-Q133 VanDerWaalsContact O-N 3.09Å
130	L	95.4	Very high	94.2	Very high	96 Å²	96	96.4 Å²	96.4	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-74.4	-37.5	176.1	-71.7	168.9	0	0	0	111.5	T126 I127 A128 Q133 I134	T126-L130 VanDerWaalsContact O-CG 3.27Å; T126-L130 WeakPolarHBondContact O-CG 3.43Å; T126-L130 PolarHBondContact O-N 3.09Å; T126-L130 VanDerWaalsContact O-N 3.15Å; I127-L130 CarbonylContact O-C 3.58Å; I127-L130 WeakPolarHBondContact O-CA 3.22Å; I127-L130 PolarHBondContact O-N 2.88Å; A128-L130 VanDerWaalsContact C-N 3.34Å; A128-L130 PolarHBondContact O-N 2.88Å; L130-Q133 PolarHBondContact O-N 2.9Å; L130-I134 WeakPolarHBondContact O-CB 3.33Å; L130-I134 WeakPolarHBondContact O-CD1 3.33Å; L130-I134 WeakPolarHBondContact O-CG1 3.39Å; L130-I134 PolarHBondContact O-N 2.95Å
131	E	95.2	Very high	93.9	Very high	123 Å²	123	96.2 Å²	96.2	58%	0.575	50%	0.498	S	S	*	.	H	α-helix	trans	-63.5	-41.3	173.8	-70.8	173.6	150.2	0	0	111.4	I127 A128 I134 A135	I127-E131 HydrophobicContact CG2-CG 4.18Å; I127-E131 WeakPolarHBondContact O-CG 3.32Å; I127-E131 PolarHBondContact O-N 2.91Å; A128-E131 PolarHBondContact O-N 3.34Å; E131-I134 PolarHBondContact O-N 3.15Å; E131-A135 WeakPolarHBondContact O-CB 3.1Å; E131-A135 PolarHBondContact O-N 3.46Å
132	E	94	Very high	93.6	Very high	144 Å²	144	95.6 Å²	95.6	67%	0.673	49%	0.494	S	S	*	.	H	α-helix	trans	-61.5	-46.6	171.6	-174.4	-175.8	-170.5	0	0	111.8	A128 I134 A135 G136	A128-E132 WeakPolarHBondContact O-CB 3.31Å; A128-E132 PolarHBondContact O-N 3.33Å; E132-I134 VanDerWaalsContact C-N 3.33Å; E132-I134 PolarHBondContact O-N 3.37Å; E132-A135 PolarHBondContact O-N 3.09Å; E132-G136 PolarHBondContact O-N 2.93Å
133	Q	93.5	Very high	93.1	Very high	111 Å²	111	92.6 Å²	92.6	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-62.2	-39.3	176.4	-74.9	174.8	26.6	0	0	112.3	M129 L130 G136 L137	M129-Q133 VanDerWaalsContact O-CG 3.26Å; M129-Q133 WeakPolarHBondContact O-CG 3.38Å; M129-Q133 PolarHBondContact O-N 2.79Å; M129-Q133 VanDerWaalsContact O-N 3.09Å; L130-Q133 PolarHBondContact O-N 2.9Å; Q133-G136 PolarHBondContact O-N 2.71Å; Q133-L137 WeakPolarHBondContact O-CB 3.47Å; Q133-L137 VanDerWaalsContact O-CG 3.3Å; Q133-L137 WeakPolarHBondContact O-CG 3.47Å; Q133-L137 PolarHBondContact O-N 3.27Å
134	I	94.3	Very high	92.4	Very high	101 Å²	101	95.5 Å²	95.5	52%	0.518	49%	0.491	S	S	.	.	H	α-helix	trans	-65.8	-45.7	174.9	-71.6	163.9	0	0	0	110.3	L130 E131 E132 G136 L137 V138	L130-I134 WeakPolarHBondContact O-CB 3.33Å; L130-I134 WeakPolarHBondContact O-CD1 3.33Å; L130-I134 WeakPolarHBondContact O-CG1 3.39Å; L130-I134 PolarHBondContact O-N 2.95Å; E131-I134 PolarHBondContact O-N 3.15Å; E132-I134 VanDerWaalsContact C-N 3.33Å; E132-I134 PolarHBondContact O-N 3.37Å; I134-G136 VanDerWaalsContact C-N 3.34Å; I134-G136 PolarHBondContact O-N 2.89Å; I134-L137 WeakPolarHBondContact O-CB 3.33Å; I134-L137 PolarHBondContact O-N 3.4Å; I134-L137 VanDerWaalsContact O-N 3.09Å; I134-V138 HydrophobicContact CG2-CG2 4.28Å; I134-V138 WeakPolarHBondContact O-CB 3.38Å; I134-V138 WeakPolarHBondContact O-CG2 3.41Å; I134-V138 PolarHBondContact O-N 2.87Å
135	A	92.2	Very high	91.8	Very high	60 Å²	60	97.2 Å²	97.2	50%	0.496	50%	0.495	S	S	.	.	H	α-helix	trans	-59.1	-45.3	175.7	0	0	0	0	0	111.5	E131 E132 L137 V138 E139	E131-A135 WeakPolarHBondContact O-CB 3.1Å; E131-A135 PolarHBondContact O-N 3.46Å; E132-A135 PolarHBondContact O-N 3.09Å; A135-L137 VanDerWaalsContact C-N 3.28Å; A135-L137 PolarHBondContact O-N 3.34Å; A135-V138 PolarHBondContact O-N 2.9Å; A135-E139 VanDerWaalsContact O-CB 3.26Å; A135-E139 WeakPolarHBondContact O-CB 3.49Å; A135-E139 PolarHBondContact O-N 2.96Å
136	G	92.2	Very high	90.9	Very high	32 Å²	32	97.9 Å²	97.9	33%	0.33	50%	0.499	S	S	.	.	H	α-helix	trans	-68.1	-19.9	175.1	0	0	0	0	0	114.6	E132 Q133 I134 R140	E132-G136 PolarHBondContact O-N 2.93Å; Q133-G136 PolarHBondContact O-N 2.71Å; I134-G136 VanDerWaalsContact C-N 3.34Å; I134-G136 PolarHBondContact O-N 2.89Å; G136-R140 WeakPolarHBondContact O-CG 3.48Å; G136-R140 PolarHBondContact O-NE 3.33Å; G136-R140 PolarHBondContact O-NH2 2.94Å
137	L	92.6	Very high	89.6	Confident	91 Å²	91	99.9 Å²	99.9	48%	0.476	50%	0.504	S	S	.	.	H	α-helix	trans	-82	-47.6	169.7	-79.1	164.6	0	0	0	111.4	Q133 I134 A135 E139 R140 L141	Q133-L137 WeakPolarHBondContact O-CB 3.47Å; Q133-L137 VanDerWaalsContact O-CG 3.3Å; Q133-L137 WeakPolarHBondContact O-CG 3.47Å; Q133-L137 PolarHBondContact O-N 3.27Å; I134-L137 WeakPolarHBondContact O-CB 3.33Å; I134-L137 PolarHBondContact O-N 3.4Å; I134-L137 VanDerWaalsContact O-N 3.09Å; A135-L137 VanDerWaalsContact C-N 3.28Å; A135-L137 PolarHBondContact O-N 3.34Å; L137-E139 VanDerWaalsContact C-N 3.29Å; L137-E139 PolarHBondContact O-N 2.83Å; L137-R140 WeakPolarHBondContact O-CB 3.25Å; L137-R140 PolarHBondContact O-N 2.87Å; L137-L141 PolarHBondContact O-N 3.41Å
138	V	92.2	Very high	87.9	Confident	65 Å²	65	99.8 Å²	99.8	39%	0.394	51%	0.511	S	S	.	.	H	α-helix	trans	-58.5	-41.2	176.4	168.4	0	0	0	0	111.1	I134 A135 R140 L141 K142	I134-V138 HydrophobicContact CG2-CG2 4.28Å; I134-V138 WeakPolarHBondContact O-CB 3.38Å; I134-V138 WeakPolarHBondContact O-CG2 3.41Å; I134-V138 PolarHBondContact O-N 2.87Å; A135-V138 PolarHBondContact O-N 2.9Å; V138-R140 VanDerWaalsContact C-N 3.31Å; V138-R140 PolarHBondContact O-N 3.1Å; V138-L141 PolarHBondContact O-N 2.92Å; V138-K142 WeakPolarHBondContact O-CG 3.3Å; V138-K142 PolarHBondContact O-N 3.3Å
139	E	90.8	Very high	86.2	Confident	78 Å²	78	102 Å²	102	36%	0.364	52%	0.519	S	S	.	.	H	α-helix	trans	-69	-27.5	177.1	-178	55.3	-158	0	0	113.1	A135 L137 K142 K143	A135-E139 VanDerWaalsContact O-CB 3.26Å; A135-E139 WeakPolarHBondContact O-CB 3.49Å; A135-E139 PolarHBondContact O-N 2.96Å; L137-E139 VanDerWaalsContact C-N 3.29Å; L137-E139 PolarHBondContact O-N 2.83Å; E139-K142 IonicContact OE2-NZ 2.64Å; E139-K143 WeakPolarHBondContact O-CD 3.25Å; E139-K143 WeakPolarHBondContact O-CG 3.42Å; E139-K143 PolarHBondContact O-N 3.09Å; E139-K143 WeakPolarHBondContact OE1-CE 3.49Å; E139-K143 IonicContact OE1-NZ 3.37Å; E139-K143 PolarHBondContact OE1-NZ 3.22Å
140	R	89.2	Confident	84.3	Confident	139 Å²	139	103.6 Å²	103.6	53%	0.525	53%	0.527	S	S	.	.	H	α-helix	trans	-74.8	-40.2	169.4	-81	178.2	-74.4	172.6	-4.6	111.9	G136 L137 V138 K143 Y144	G136-R140 WeakPolarHBondContact O-CG 3.48Å; G136-R140 PolarHBondContact O-NE 3.33Å; G136-R140 PolarHBondContact O-NH2 2.94Å; L137-R140 WeakPolarHBondContact O-CB 3.25Å; L137-R140 PolarHBondContact O-N 2.87Å; V138-R140 VanDerWaalsContact C-N 3.31Å; V138-R140 PolarHBondContact O-N 3.1Å; R140-K143 WeakPolarHBondContact O-CB 3.28Å; R140-K143 PolarHBondContact O-N 3.25Å; R140-Y144 WeakPolarHBondContact O-CD2 3.47Å; R140-Y144 PolarHBondContact O-N 3.05Å; R140-Y144 VanDerWaalsContact O-N 3.08Å
141	L	89	Confident	82.4	Confident	103 Å²	103	106.2 Å²	106.2	54%	0.539	53%	0.534	S	S	.	.	H	α-helix	trans	-59.6	-50.6	175.3	-71	171.2	0	0	0	111.1	L137 V138 K143 Y144 D145	L137-L141 PolarHBondContact O-N 3.41Å; V138-L141 PolarHBondContact O-N 2.92Å; L141-K143 PolarHBondContact O-N 2.83Å; L141-K143 VanDerWaalsContact O-N 3.13Å; L141-Y144 CarbonylContact O-C 3.59Å; L141-Y144 WeakPolarHBondContact O-CA 3.21Å; L141-Y144 PolarHBondContact O-N 3.29Å; L141-D145 PolarHBondContact O-N 3.08Å
142	K	89	Confident	80.2	Confident	108 Å²	108	102.6 Å²	102.6	47%	0.47	53%	0.53	S	S	.	.	H	α-helix	trans	-51.4	-39.1	173.5	-71.6	173.5	-175.7	171.5	0	113.2	V138 E139 N146	V138-K142 WeakPolarHBondContact O-CG 3.3Å; V138-K142 PolarHBondContact O-N 3.3Å; E139-K142 IonicContact OE2-NZ 2.64Å; K142-N146 VanDerWaalsContact O-CB 3.27Å; K142-N146 WeakPolarHBondContact O-CB 3.46Å; K142-N146 PolarHBondContact O-N 2.88Å; K142-N146 PolarHBondContact O-ND2 3.17Å
143	K	85.8	Confident	78.1	Confident	120 Å²	120	100.6 Å²	100.6	52%	0.522	53%	0.527	S	S	.	.	H	α-helix	trans	-68.7	-38.6	178.1	-76.8	166.9	-179.2	147.9	0	112.1	E139 R140 L141 Q147	E139-K143 WeakPolarHBondContact O-CD 3.25Å; E139-K143 WeakPolarHBondContact O-CG 3.42Å; E139-K143 PolarHBondContact O-N 3.09Å; E139-K143 WeakPolarHBondContact OE1-CE 3.49Å; E139-K143 IonicContact OE1-NZ 3.37Å; E139-K143 PolarHBondContact OE1-NZ 3.22Å; R140-K143 WeakPolarHBondContact O-CB 3.28Å; R140-K143 PolarHBondContact O-N 3.25Å; L141-K143 PolarHBondContact O-N 2.83Å; L141-K143 VanDerWaalsContact O-N 3.13Å; K143-Q147 VanDerWaalsContact O-CB 3.24Å; K143-Q147 WeakPolarHBondContact O-CB 3.46Å; K143-Q147 PolarHBondContact O-N 3.24Å
144	Y	82.4	Confident	75.8	Confident	155 Å²	155	103.7 Å²	103.7	61%	0.608	54%	0.542	S	S	*	.	H	α-helix	trans	-69.2	-42.6	172.6	-71.5	-61	0	0	0	112.3	R140 L141 Q147 S148	R140-Y144 WeakPolarHBondContact O-CD2 3.47Å; R140-Y144 PolarHBondContact O-N 3.05Å; R140-Y144 VanDerWaalsContact O-N 3.08Å; L141-Y144 CarbonylContact O-C 3.59Å; L141-Y144 WeakPolarHBondContact O-CA 3.21Å; L141-Y144 PolarHBondContact O-N 3.29Å; Y144-Q147 PolarHBondContact O-N 3.23Å; Y144-S148 WeakPolarHBondContact O-CB 3.46Å; Y144-S148 PolarHBondContact O-N 2.72Å
145	D	83.6	Confident	73.4	Confident	97 Å²	97	105.7 Å²	105.7	52%	0.519	55%	0.552	S	S	.	*	H	α-helix	trans	-60.7	-49.7	177.1	-63.8	-31.3	0	0	0	110.8	L141 Q147 S148 V149	L141-D145 PolarHBondContact O-N 3.08Å; D145-Q147 VanDerWaalsContact C-N 3.31Å; D145-Q147 PolarHBondContact O-N 3.26Å; D145-S148 WeakPolarHBondContact O-CB 3.37Å; D145-S148 PolarHBondContact O-N 3.19Å; D145-S148 VanDerWaalsContact O-N 3.12Å; D145-V149 WeakPolarHBondContact O-CG2 3.43Å; D145-V149 PolarHBondContact O-N 3.46Å
146	N	76.6	Confident	71	Confident	110 Å²	110	111.2 Å²	111.2	59%	0.588	57%	0.565	S	S	*	*	H	α-helix	trans	-60.7	-38.1	176.2	-71.4	-21.6	0	0	0	112.5	K142 V149 M150	K142-N146 VanDerWaalsContact O-CB 3.27Å; K142-N146 WeakPolarHBondContact O-CB 3.46Å; K142-N146 PolarHBondContact O-N 2.88Å; K142-N146 PolarHBondContact O-ND2 3.17Å; N146-V149 PolarHBondContact O-N 3.42Å; N146-M150 WeakPolarHBondContact O-CG 3.22Å; N146-M150 PolarHBondContact O-N 3.18Å
147	Q	67.3	Low	68.5	Low	112 Å²	112	118.6 Å²	118.6	52%	0.523	59%	0.591	S	S	.	*	H	α-helix	trans	-72	-30.5	176.3	-173.7	170.6	82.8	0	0	112.4	K143 Y144 D145 K151	K143-Q147 VanDerWaalsContact O-CB 3.24Å; K143-Q147 WeakPolarHBondContact O-CB 3.46Å; K143-Q147 PolarHBondContact O-N 3.24Å; Y144-Q147 PolarHBondContact O-N 3.23Å; D145-Q147 VanDerWaalsContact C-N 3.31Å; D145-Q147 PolarHBondContact O-N 3.26Å; Q147-K151 WeakPolarHBondContact O-CG 3.45Å; Q147-K151 PolarHBondContact O-N 3.11Å
148	S	61.1	Low	66.4	Low	86 Å²	86	119.2 Å²	119.2	60%	0.601	60%	0.603	S	S	*	*	H	α-helix	trans	-70.1	-40.4	172.4	-167.7	0	0	0	0	111.6	Y144 D145 K151 G152	Y144-S148 WeakPolarHBondContact O-CB 3.46Å; Y144-S148 PolarHBondContact O-N 2.72Å; D145-S148 WeakPolarHBondContact O-CB 3.37Å; D145-S148 PolarHBondContact O-N 3.19Å; D145-S148 VanDerWaalsContact O-N 3.12Å; S148-K151 PolarHBondContact O-N 2.93Å; S148-G152 PolarHBondContact O-N 3.14Å; S148-G152 VanDerWaalsContact O-N 3.08Å
149	V	60.1	Low	64.1	Low	100 Å²	100	122.7 Å²	122.7	61%	0.606	62%	0.619	S	S	*	*	H	α-helix	trans	-63.2	-48.9	175.2	172.1	0	0	0	0	110.6	D145 N146 K151 G152 T153	D145-V149 WeakPolarHBondContact O-CG2 3.43Å; D145-V149 PolarHBondContact O-N 3.46Å; N146-V149 PolarHBondContact O-N 3.42Å; V149-K151 VanDerWaalsContact C-N 3.28Å; V149-K151 PolarHBondContact O-N 2.86Å; V149-G152 PolarHBondContact O-N 2.85Å; V149-T153 PolarHBondContact O-OG1 2.87Å
150	M	53.6	Low	62	Low	144 Å²	144	127.5 Å²	127.5	71%	0.709	64%	0.639	S	S	*	*	H	α-helix	trans	-61.3	-33.4	179.2	-75.7	-67.6	179.8	0	0	113.4	N146 T153	N146-M150 WeakPolarHBondContact O-CG 3.22Å; N146-M150 PolarHBondContact O-N 3.18Å; M150-T153 PolarHBondContact O-OG1 3.32Å
151	K	55.1	Low	59.7	Low	152 Å²	152	125.3 Å²	125.3	66%	0.661	65%	0.645	S	S	*	*	H	α-helix	trans	-80.5	-12.3	174	-72	-173.7	176.2	-175	0	114.3	Q147 S148 V149	Q147-K151 WeakPolarHBondContact O-CG 3.45Å; Q147-K151 PolarHBondContact O-N 3.11Å; S148-K151 PolarHBondContact O-N 2.93Å; V149-K151 VanDerWaalsContact C-N 3.28Å; V149-K151 PolarHBondContact O-N 2.86Å
152	G	50	Low	57.6	Low	47 Å²	47	125.6 Å²	125.6	49%	0.485	66%	0.656	S	S	.	*	H	α-helix	trans	-81.9	-16.9	178.7	0	0	0	0	0	114.5	S148 V149	S148-G152 PolarHBondContact O-N 3.14Å; S148-G152 VanDerWaalsContact O-N 3.08Å; V149-G152 PolarHBondContact O-N 2.85Å
153	T	49.9	Very low	55.5	Low	101 Å²	101	125.5 Å²	125.5	62%	0.62	67%	0.669	S	S	*	*	S	Bend	trans	-95.8	-8	-170.9	22.2	0	0	0	0	116.4	V149 M150	V149-T153 PolarHBondContact O-OG1 2.87Å; M150-T153 PolarHBondContact O-OG1 3.32Å
154	E	44.7	Very low	53.4	Low	177 Å²	177	125.8 Å²	125.8	83%	0.827	68%	0.681	S	S	*	*	S	Bend	trans	-107.7	9.2	-175.6	-65.2	-168.9	149.3	0	0	114.6
155	I	44.8	Very low	51.9	Low	142 Å²	142	123.9 Å²	123.9	73%	0.728	69%	0.69	S	S	*	*			trans	-120.9	68.9	-178.3	-46.1	-177.9	0	0	0	111
156	F	40.6	Very low	50.2	Low	177 Å²	177	124.5 Å²	124.5	78%	0.776	70%	0.702	S	S	*	*			trans	-139	58.2	174.3	-89.2	-76.7	0	0	0	112.2
157	H	40.8	Very low	48.8	Very low	187 Å²	187	125.1 Å²	125.1	87%	0.866	71%	0.712	S	S	*	*	S	Bend	trans	-165.6	140.2	157.1	-94.8	-64.5	0	0	0	110
158	S	47.5	Very low	47.7	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	73%	0.729	S	S	*	*			trans	62.9	146.3	-177.1	74.1	0	0	0	0	116.4
159	D	43.3	Very low	46.8	Very low	138 Å²	138	127.8 Å²	127.8	74%	0.738	74%	0.737	S	S	*	*			cis	-159.5	159.8	-25.8	-109.2	-42	0	0	0	111.5
160	F	46.7	Very low	46.6	Very low	178 Å²	178	129.4 Å²	129.4	78%	0.781	75%	0.747	S	S	*	*			trans	50.8	106	154.9	-83.7	-111.9	0	0	0	121.9
161	S	42.1	Very low	46.3	Very low	93 Å²	93	128.4 Å²	128.4	65%	0.65	75%	0.752	S	S	*	*				75.1	106.6	117.9	-59.7	0	0	0	0	123.2
162	S	45.1	Very low	45.9	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	76%	0.76	S	S	*	*				91.7	153.9	121.4	79.1	0	0	0	0	121.7
163	S	44.6	Very low	46.1	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	78%	0.775	S	S	*	*			trans	62	122.6	-175	65.1	0	0	0	0	116.3
164	T	42.3	Very low	46.1	Very low	127 Å²	127	133.7 Å²	133.7	78%	0.779	78%	0.783	S	S	*	*			cis	118.6	135.2	9.4	57.4	0	0	0	0	112.2
165	S	49.3	Very low	46.1	Very low	115 Å²	115	136.5 Å²	136.5	80%	0.804	79%	0.788	S	S	*	*			trans	68.2	147.3	-179	78.1	0	0	0	0	116.5
166	S	48.6	Very low	46	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	79%	0.791	S	S	*	*			cis	-158.6	148	-23.5	-95.3	0	0	0	0	108.9
167	P	48.1	Very low	46.2	Very low	123 Å²	123	142.9 Å²	142.9	80%	0.799	80%	0.797	S	S	*	*			trans	-85.1	148.2	-176.6	33.9	-35.1	0	0	0	113.1
168	T	44	Very low	46.3	Very low	143 Å²	143	141 Å²	141	88%	0.877	79%	0.789	S	S	*	*			trans	-148.9	142.2	160.4	-67.8	0	0	0	0	109.2
169	S	42.2	Very low	46.1	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	79%	0.794	S	S	*	*			trans	-99.4	144.5	-166.1	46.4	0	0	0	0	113.9
170	T	54.6	Low	46.2	Very low	133 Å²	133	142.6 Å²	142.6	82%	0.816	79%	0.788	S	S	*	*			trans	-141.5	127.9	164.1	51.1	0	0	0	0	110.3
171	P	47.8	Very low	45.8	Very low	124 Å²	124	142.4 Å²	142.4	81%	0.805	79%	0.789	S	S	*	*			trans	-85.1	176.8	-176.4	35.1	-36.7	0	0	0	114.1
172	L	47.9	Very low	45.8	Very low	159 Å²	159	148.2 Å²	148.2	83%	0.832	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-59.3	143.1	-172.9	-73	68.9	0	0	0	114.2
173	P	53.4	Low	45.5	Very low	122 Å²	122	148.2 Å²	148.2	79%	0.792	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-75.4	126.4	169.1	31	-33.2	0	0	0	111.7
174	T	48.8	Very low	45.4	Very low	130 Å²	130	148.9 Å²	148.9	80%	0.798	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.9	129.5	175.1	-50.6	0	0	0	0	111.7	R176	T174-R176 PolarHBondContact O-N 2.79Å
175	Y	46.1	Very low	45.2	Very low	236 Å²	236	148 Å²	148	93%	0.925	80%	0.804	S	S	*	*			trans	-69.5	98.5	169.8	-100.2	-92.8	0	0	0	111.1
176	R	42.3	Very low	44.8	Very low	212 Å²	212	150.2 Å²	150.2	80%	0.8	81%	0.805	S	S	*	*			trans	-145.9	91.3	170.3	-147.4	178.8	-163	-171.5	5.7	112.1	T174 H178	T174-R176 PolarHBondContact O-N 2.79Å; R176-H178 PolarHBondContact O-CD2 3.06Å
177	R	45.5	Very low	44.4	Very low	240 Å²	240	149.9 Å²	149.9	91%	0.906	80%	0.803	S	S	*	*			trans	-92.3	125.5	157.9	-80.5	-178.1	179.8	160.1	0	105.7
178	H	41.6	Very low	43.7	Very low	147 Å²	147	149.6 Å²	149.6	68%	0.681	80%	0.804	S	S	*	*				52	123.9	51.3	-67	-83.2	0	0	0	111.3	R176	R176-H178 PolarHBondContact O-CD2 3.06Å
179	L	43.7	Very low	43.4	Very low	160 Å²	160	148.2 Å²	148.2	84%	0.838	80%	0.8	S	S	*	*			cis	-141.7	178.7	36.6	-150	65.2	0	0	0	114
180	L	45.1	Very low	43.1	Very low	116 Å²	116	147.7 Å²	147.7	61%	0.607	80%	0.796	S	S	*	*			trans	-78.7	162.4	-166.3	-77.4	59.4	0	0	0	115.1
181	Q	39.4	Very low	42.4	Very low	174 Å²	174	147.7 Å²	147.7	81%	0.813	80%	0.796	S	S	*	*			trans	46.7	119.7	138.1	-66.1	165.8	-11.6	0	0	120
182	K	41.8	Very low	42	Very low	216 Å²	216	148.5 Å²	148.5	94%	0.939	79%	0.792	S	S	*	*				-147	131.2	126.6	-113	168.6	-174.2	178.3	0	110.3
183	S	38.5	Very low	41.6	Very low	109 Å²	109	151.7 Å²	151.7	76%	0.762	79%	0.793	S	S	*	*			trans	-99.5	137.6	-177.5	47.9	0	0	0	0	111.3
184	S	43.5	Very low	40.7	Very low	120 Å²	120	150.4 Å²	150.4	84%	0.839	79%	0.787	S	S	*	*			trans	-152.1	95.6	168.8	-64.1	0	0	0	0	111
185	P	37.6	Very low	40.4	Very low	107 Å²	107	149.5 Å²	149.5	70%	0.695	79%	0.786	S	S	*	*			trans	-86.9	174.7	157.9	38.2	-33.6	0	0	0	110.4
186	I	40.3	Very low	40	Very low	162 Å²	162	144.5 Å²	144.5	83%	0.831	78%	0.78	S	S	*	*			trans	67.6	102	169.4	-49.7	164	0	0	0	115.6
187	S	40.1	Very low	40	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	78%	0.783	S	S	*	*				-169.1	116.5	116.1	54.7	0	0	0	0	110.7
188	S	34.3	Very low	39.9	Very low	117 Å²	117	141.7 Å²	141.7	82%	0.818	78%	0.78	S	S	*	*			trans	-78.9	126.2	171.2	49.8	0	0	0	0	110.8
189	S	37.7	Very low	40	Very low	113 Å²	113	141.4 Å²	141.4	79%	0.79	78%	0.783	S	S	*	*			trans	-112.9	96	169.2	-70	0	0	0	0	110.5
190	S	35.6	Very low	39.7	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	78%	0.779	S	S	*	*			trans	-81.5	110.6	172.7	53	0	0	0	0	110.9	I192	S190-I192 PolarHBondContact O-N 3.31Å
191	T	38.9	Very low	39.4	Very low	133 Å²	133	141.4 Å²	141.4	82%	0.816	79%	0.789	S	S	*	*			trans	-96.8	84.5	167	-55	0	0	0	0	109.7	R193	T191-R193 PolarHBondContact O-N 2.86Å
192	I	39.1	Very low	39.2	Very low	142 Å²	142	138.9 Å²	138.9	73%	0.728	79%	0.785	S	S	*	*			trans	-67.8	115	166.7	-61.6	171.8	0	0	0	107.3	S190	S190-I192 PolarHBondContact O-N 3.31Å
193	R	39.6	Very low	39.2	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.849	78%	0.782	S	S	*	*			trans	-106.1	92.5	170.2	-168	174.8	-179.2	-168.1	-0.6	110.2	T191 S195	T191-R193 PolarHBondContact O-N 2.86Å; R193-S195 PolarHBondContact O-N 3.31Å
194	S	36.3	Very low	39.1	Very low	96 Å²	96	141.3 Å²	141.3	67%	0.671	78%	0.78	S	S	*	*			trans	-65.2	125.7	178.3	-49.8	0	0	0	0	111.9
195	S	42	Very low	39	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	78%	0.78	S	S	*	*			trans	-131.4	90.5	172.6	-68.5	0	0	0	0	109.8	R193	R193-S195 PolarHBondContact O-N 3.31Å
196	T	36.7	Very low	39.3	Very low	130 Å²	130	142.5 Å²	142.5	80%	0.798	78%	0.777	S	S	*	*			trans	-92.7	120.9	-173.5	51.4	0	0	0	0	113.6
197	K	43.4	Very low	38.9	Very low	200 Å²	200	140.2 Å²	140.2	87%	0.87	77%	0.77	S	S	*	*			trans	-166	117.9	150.6	-99.8	153	-175.8	-176.4	0	105.8
198	K	41.8	Very low	38.5	Very low	193 Å²	193	141.5 Å²	141.5	84%	0.839	77%	0.774	S	S	*	*				50.5	116.8	73.7	-76.2	-170.7	175.8	-176.8	0	110
199	I	44.7	Very low	38.6	Very low	142 Å²	142	142 Å²	142	73%	0.728	78%	0.776	S	S	*	*			cis	-158.7	154.7	41.7	-104.4	139.5	0	0	0	111.5
200	N	37	Very low	38.5	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	78%	0.775	S	S	*	*			trans	29.7	143.4	155.4	-52.5	-1.2	0	0	0	120.5
201	T	39.7	Very low	38.8	Very low	135 Å²	135	141.1 Å²	141.1	83%	0.828	78%	0.777	S	S	*	*				-158.7	149.6	53.3	-56.4	0	0	0	0	112.9
202	T	35.6	Very low	38.8	Very low	120 Å²	120	141 Å²	141	74%	0.736	77%	0.771	S	S	*	*			trans	-93.9	144.7	-177.5	-54.5	0	0	0	0	112.2
203	H	40.2	Very low	39	Very low	185 Å²	185	141.7 Å²	141.7	86%	0.856	78%	0.776	S	S	*	*			trans	-154.3	140.5	140.1	-99.7	-69.3	0	0	0	113.4
204	R	37.8	Very low	39.1	Very low	191 Å²	191	138.2 Å²	138.2	72%	0.721	78%	0.775	S	S	*	*			trans	-38.4	158.3	-179.5	-83.3	165.3	157.4	179.9	-7.7	118.1	I206	R204-I206 HydrophobicContact CB-CG1 4.41Å; R204-I206 HydrophobicContact CG-CG1 4.13Å
205	P	40.8	Very low	39.4	Very low	131 Å²	131	140.3 Å²	140.3	85%	0.851	78%	0.778	S	S	*	*				-108.2	172.1	91.6	31.8	-36.1	0	0	0	114.8
206	I	43	Very low	39.4	Very low	122 Å²	122	140.4 Å²	140.4	63%	0.626	77%	0.77	S	S	*	*			trans	-109.1	150.3	-178.6	-58.4	174.6	0	0	0	109.9	R204	R204-I206 HydrophobicContact CB-CG1 4.41Å; R204-I206 HydrophobicContact CG-CG1 4.13Å
207	T	33.1	Very low	39.6	Very low	113 Å²	113	140.6 Å²	140.6	69%	0.693	77%	0.766	S	S	*	*			trans	-98.9	172.1	-177.4	57.8	0	0	0	0	113.8
208	T	32.2	Very low	39.6	Very low	131 Å²	131	138.8 Å²	138.8	80%	0.804	77%	0.766	S	S	*	*			trans	61.8	106.5	149.4	48.2	0	0	0	0	120
209	C	35.5	Very low	39.5	Very low	129 Å²	129	136.1 Å²	136.1	87%	0.872	76%	0.761	S	S	*	*				-166.7	129.3	123.1	54.5	0	0	0	0	112.4
210	G	35.5	Very low	39.3	Very low	73 Å²	73	135.3 Å²	135.3	75%	0.753	76%	0.762	S	S	*	*			trans	62.5	147.8	156.4	0	0	0	0	0	119.6
211	T	41.3	Very low	39.2	Very low	121 Å²	121	135.2 Å²	135.2	74%	0.742	76%	0.762	S	S	*	*			cis	-159.1	149.8	-5.6	20.8	0	0	0	0	108.2
212	D	38.7	Very low	39.2	Very low	131 Å²	131	133.4 Å²	133.4	70%	0.701	76%	0.76	S	S	*	*			trans	33.1	124.7	144.8	-38	-33.8	0	0	0	118.4
213	N	43.6	Very low	39.2	Very low	156 Å²	156	135.8 Å²	135.8	83%	0.834	77%	0.767	S	S	*	*				-156.6	162.5	56.2	-83.2	-88.6	0	0	0	113.1
214	N	41.7	Very low	38.8	Very low	152 Å²	152	132.2 Å²	132.2	81%	0.813	76%	0.763	S	S	*	*			trans	-67.7	146.4	161	-73.5	-48.8	0	0	0	110.5
215	D	43.9	Very low	38.7	Very low	140 Å²	140	130 Å²	130	75%	0.749	77%	0.765	S	S	*	*				-162.1	136.8	112.3	-114.5	-12.6	0	0	0	115
216	N	41.9	Very low	38.5	Very low	112 Å²	112	133.4 Å²	133.4	60%	0.599	76%	0.761	S	S	*	*			trans	41	105.4	151.9	-64.4	-58.4	0	0	0	121.6
217	N	40.9	Very low	38	Very low	134 Å²	134	135.9 Å²	135.9	72%	0.717	78%	0.776	S	S	*	*				44.7	106.9	113.1	-58.8	-47.9	0	0	0	118.4
218	N	43.3	Very low	38	Very low	162 Å²	162	137 Å²	137	87%	0.866	77%	0.774	S	S	*	*				-159.1	134.7	113.8	-100.8	-47.6	0	0	0	112.4
219	N	38.3	Very low	38.2	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	78%	0.777	S	S	*	*			trans	-88.5	117.6	176.1	174.7	29.3	0	0	0	110.2
220	V	41.9	Very low	38.2	Very low	125 Å²	125	143.1 Å²	143.1	76%	0.758	78%	0.778	S	S	*	*			trans	-143.7	118.7	163.8	-166.2	0	0	0	0	109.9	A222	V220-A222 PolarHBondContact O-N 3.18Å
221	D	35	Very low	38.1	Very low	139 Å²	139	143.9 Å²	143.9	74%	0.743	77%	0.771	S	S	*	*			trans	-64.2	122	172.3	-73	-70.9	0	0	0	111.7
222	A	39.1	Very low	37.6	Very low	96 Å²	96	144 Å²	144	79%	0.793	77%	0.772	S	S	*	*			trans	-110.4	13.9	175.3	0	0	0	0	0	113.7	V220 S224	V220-A222 PolarHBondContact O-N 3.18Å; A222-S224 VanDerWaalsContact C-N 3.28Å; A222-S224 PolarHBondContact O-N 3.32Å; A222-S224 VanDerWaalsContact O-N 3.09Å
223	L	35.3	Very low	37.4	Very low	170 Å²	170	145.7 Å²	145.7	89%	0.89	78%	0.78	S	S	*	*			trans	-83.4	54.8	177.4	-74.2	178.1	0	0	0	113.5
224	S	33	Very low	37.1	Very low	110 Å²	110	144.7 Å²	144.7	77%	0.769	77%	0.774	S	S	*	*			trans	-175.6	103.4	157	169.6	0	0	0	0	112.9	A222	A222-S224 VanDerWaalsContact C-N 3.28Å; A222-S224 PolarHBondContact O-N 3.32Å; A222-S224 VanDerWaalsContact O-N 3.09Å
225	L	35	Very low	36.5	Very low	144 Å²	144	142.7 Å²	142.7	75%	0.754	77%	0.771	S	S	*	*			trans	-154.4	103.7	154.3	-107	175.4	0	0	0	111.4
226	R	35.7	Very low	36.3	Very low	204 Å²	204	145.5 Å²	145.5	77%	0.77	78%	0.777	S	S	*	*			trans	42.3	117.3	154.6	-55.2	170.7	-168.8	176.4	3.3	117.6	M228	R226-M228 HydrophobicContact CB-CB 4.22Å; R226-M228 HydrophobicContact CG-CB 4.24Å
227	N	33.7	Very low	35.9	Very low	174 Å²	174	147 Å²	147	93%	0.93	79%	0.785	S	S	*	*			cis	48.2	43.8	6.3	-104.4	-6.8	0	0	0	116.5
228	M	33.6	Very low	35.6	Very low	136 Å²	136	152.1 Å²	152.1	67%	0.67	80%	0.796	S	S	*	*			trans	-157.6	81.4	161.1	-89.1	-117	86.7	0	0	111.2	R226	R226-M228 HydrophobicContact CB-CB 4.22Å; R226-M228 HydrophobicContact CG-CB 4.24Å
229	H	36.3	Very low	35	Very low	184 Å²	184	150 Å²	150	85%	0.852	79%	0.794	S	S	*	*			trans	-149.3	55.3	160.8	-99.9	-70.2	0	0	0	111.2
230	K	34	Very low	34.8	Very low	204 Å²	204	146.4 Å²	146.4	89%	0.887	79%	0.789	S	S	*	*			trans	-131.9	77.5	165.4	-76.7	-172.3	177.3	175.9	0	109
231	S	33.2	Very low	34.6	Very low	89 Å²	89	151.3 Å²	151.3	62%	0.622	80%	0.796	S	S	*	*			trans	-128.6	87	-178.1	54.2	0	0	0	0	110.3	I233	S231-I233 PolarHBondContact O-N 2.83Å
232	T	31.8	Very low	34.5	Very low	125 Å²	125	153.3 Å²	153.3	77%	0.767	80%	0.798	S	S	*	*			trans	-9.2	110.4	154.9	-46.1	0	0	0	0	115.3	L234	T232-L234 HydrophobicContact CG2-CD1 4.27Å
233	I	35.3	Very low	34.5	Very low	166 Å²	166	155.6 Å²	155.6	85%	0.851	79%	0.79	S	S	*	*			trans	-93.6	123.6	157.7	-67.7	174.7	0	0	0	106.9	S231	S231-I233 PolarHBondContact O-N 2.83Å
234	L	35.5	Very low	34.4	Very low	135 Å²	135	154.4 Å²	154.4	71%	0.707	78%	0.78	S	S	*	*			trans	-64.9	138.8	-176.2	-87.4	65.4	0	0	0	111.6	T232 K236	T232-L234 HydrophobicContact CG2-CD1 4.27Å; L234-K236 PolarHBondContact O-N 3.07Å
235	S	30.5	Very low	34.8	Very low	109 Å²	109	159 Å²	159	76%	0.762	79%	0.786	S	S	*	*			trans	-57.9	114.8	158.1	51.5	0	0	0	0	109.8
236	K	38.6	Very low	34.7	Very low	199 Å²	199	160.1 Å²	160.1	87%	0.865	79%	0.791	S	S	*	*			trans	-94.1	129.2	166.3	-81	-174.6	173.4	-179.6	0	109.5	L234	L234-K236 PolarHBondContact O-N 3.07Å
237	N	33.3	Very low	34.9	Very low	144 Å²	144	160.3 Å²	160.3	77%	0.77	80%	0.797	S	S	*	*			trans	-70	135.6	-175.2	-55.4	-45.5	0	0	0	111.4
238	Y	35	Very low	35	Very low	242 Å²	242	157 Å²	157	95%	0.949	79%	0.788	S	S	*	*			trans	-126.5	102.9	149.8	-97.1	-85.9	0	0	0	107.9
239	S	31.4	Very low	35.2	Very low	118 Å²	118	160.3 Å²	160.3	83%	0.825	80%	0.799	S	S	*	*			trans	-125.1	130.3	179.1	172.2	0	0	0	0	109
240	G	33.7	Very low	35.1	Very low	62 Å²	62	157.1 Å²	157.1	64%	0.639	79%	0.794	S	S	*	*			trans	88	111.1	175.3	0	0	0	0	0	114.2
241	Y	36.9	Very low	35.2	Very low	228 Å²	228	155.4 Å²	155.4	89%	0.894	79%	0.792	S	S	*	*				-142.3	151.8	108.3	-106.1	-79.4	0	0	0	110.4
242	F	34.5	Very low	35.5	Very low	180 Å²	180	160.9 Å²	160.9	79%	0.789	80%	0.8	S	S	*	*			trans	-45.7	169.4	-177.3	-76.1	-118.8	0	0	0	116.6
243	K	39	Very low	35.4	Very low	144 Å²	144	161.2 Å²	161.2	63%	0.626	80%	0.797	S	S	*	*			cis	171.2	148	-22.4	-171.7	179.4	-176.4	-116.6	0	105.7
244	E	33	Very low	35.5	Very low	145 Å²	145	161.8 Å²	161.8	68%	0.678	80%	0.796	S	S	*	*			trans	50.2	116	160.7	-81.4	165.8	141.3	0	0	119.2
245	K	40.1	Very low	35.4	Very low	208 Å²	208	160.9 Å²	160.9	90%	0.904	79%	0.792	S	S	*	*				-163	134.9	79.3	-103.1	158.1	-174.5	165	0	113.3
246	I	34.4	Very low	35.8	Very low	166 Å²	166	163.7 Å²	163.7	85%	0.851	80%	0.798	S	S	*	*			trans	-79.1	135	164.8	-62.3	164.5	0	0	0	109
247	K	39.9	Very low	35.5	Very low	208 Å²	208	159.7 Å²	159.7	90%	0.904	79%	0.786	S	S	*	*			trans	-155.3	140.1	149	-115.6	169.8	-173	-178.2	0	111.3
248	S	34.7	Very low	35.6	Very low	105 Å²	105	162.7 Å²	162.7	73%	0.734	79%	0.792	S	S	*	*			trans	-97.5	157.6	-165.8	51.3	0	0	0	0	113.9
249	K	37.4	Very low	35.3	Very low	206 Å²	206	161 Å²	161	90%	0.896	78%	0.784	S	S	*	*			trans	-170.4	127.7	133.8	-107	169.5	-176.6	-174.6	0	111.6
250	P	34.7	Very low	35.5	Very low	117 Å²	117	166.6 Å²	166.6	76%	0.76	79%	0.789	S	S	*	*			trans	-94.3	155.3	170.7	36.5	-32.6	0	0	0	111.8
251	M	36.3	Very low	35.3	Very low	168 Å²	168	169 Å²	169	83%	0.828	79%	0.792	S	S	*	*			trans	-144.9	123.4	162.5	-87.1	-164.3	71.6	0	0	113.2
252	Y	38.5	Very low	34.9	Very low	203 Å²	203	164.9 Å²	164.9	80%	0.796	79%	0.785	S	S	*	*			trans	57.2	112.7	150.9	-73.6	-93.2	0	0	0	121.2
253	N	29.8	Very low	34.8	Very low	133 Å²	133	165 Å²	165	71%	0.711	79%	0.785	S	S	*	*			trans	-89.5	147.7	159.4	-177.3	-3.1	0	0	0	109.5
254	H	38.1	Very low	34.4	Very low	177 Å²	177	168.3 Å²	168.3	82%	0.819	80%	0.795	S	S	*	*			trans	-133.8	109.9	164.9	-116	43	0	0	0	111.5
255	N	32.5	Very low	34.3	Very low	116 Å²	116	166.4 Å²	166.4	62%	0.62	80%	0.798	S	S	*	*			trans	-61.8	147.6	174.5	-94.8	-45.8	0	0	0	111.9
256	N	39.4	Very low	33.7	Very low	168 Å²	168	162 Å²	162	90%	0.898	79%	0.794	S	S	*	*			trans	-144.3	108.9	138.6	-106.4	-44.1	0	0	0	110.6
257	N	32.1	Very low	33.5	Very low	115 Å²	115	160.1 Å²	160.1	62%	0.615	79%	0.789	S	S	*	*			trans	-76.9	137.3	178.2	-85.6	-80.6	0	0	0	111
258	K	37.1	Very low	32.9	Very low	207 Å²	207	156 Å²	156	90%	0.9	79%	0.786	S	S	*	*			trans	-141.9	107.2	145.2	-110.5	174.9	-175.7	177.1	0	110.1
259	R	28.6	Very low	32.8	Very low	208 Å²	208	158.6 Å²	158.6	79%	0.785	79%	0.791	S	S	*	*			trans	-75.4	139	174.5	-61.4	171.8	177.6	166.9	-3.7	109.5
260	Y	34.7	Very low	32.4	Very low	234 Å²	234	153.7 Å²	153.7	92%	0.918	78%	0.783	S	S	*	*			trans	-141	146.3	142.4	-93.9	-71.3	0	0	0	109
261	T	29.2	Very low	32.2	Very low	114 Å²	114	151.9 Å²	151.9	70%	0.699	79%	0.786	S	S	*	*			trans	-134.5	124	-166.4	51.7	0	0	0	0	111.5
262	N	29.6	Very low	32	Very low	140 Å²	140	154.4 Å²	154.4	75%	0.749	79%	0.787	S	S	*	*			trans	-157.8	133.1	144.1	-90.2	-29	0	0	0	106.4
263	K	31.2	Very low	31.9	Very low	184 Å²	184	153.4 Å²	153.4	80%	0.8	78%	0.782	S	S	*	*			cis	65.3	64.6	44.6	-71.3	-162.5	168.8	-170.9	0	114.7
264	Y	32.1	Very low	32.3	Very low	213 Å²	213	156.1 Å²	156.1	84%	0.835	79%	0.791	S	S	*	*			trans	-134	115.3	131.5	-71.6	-72.7	0	0	0	106
265	S	30	Very low	32.5	Very low	105 Å²	105	156.2 Å²	156.2	73%	0.734	79%	0.789	S	S	*	*				76.8	116.1	70.9	-165.2	0	0	0	0	111.1
266	S	27	Very low	32.7	Very low	116 Å²	116	154.4 Å²	154.4	81%	0.811	80%	0.798	S	S	*	*			trans	-62.7	129.6	-173.8	48.8	0	0	0	0	113.1
267	V	31.3	Very low	32.4	Very low	125 Å²	125	149.7 Å²	149.7	76%	0.758	79%	0.789	S	S	*	*			trans	-124.3	110.2	156.1	-179.6	0	0	0	0	107.8	L269	V267-L269 PolarHBondContact O-N 2.91Å
268	S	26.5	Very low	32.7	Very low	121 Å²	121	150.6 Å²	150.6	85%	0.846	79%	0.793	S	S	*	*			trans	-74.4	116.6	167.5	48.6	0	0	0	0	109
269	L	32.1	Very low	32.8	Very low	161 Å²	161	148.9 Å²	148.9	84%	0.843	79%	0.786	S	S	*	*			trans	-126.2	129.6	173.2	-149.3	73.9	0	0	0	110.8	V267	V267-L269 PolarHBondContact O-N 2.91Å
270	S	30	Very low	33.4	Very low	103 Å²	103	148 Å²	148	72%	0.72	79%	0.788	S	S	*	*			trans	-90.8	133.8	-169.6	54.6	0	0	0	0	113.2
271	G	29.1	Very low	33.8	Very low	79 Å²	79	143 Å²	143	81%	0.814	78%	0.776	S	S	*	*			trans	66.6	57.6	138.6	0	0	0	0	0	118
272	Y	34.1	Very low	34.3	Very low	220 Å²	220	143 Å²	143	86%	0.863	77%	0.771	S	S	*	*			trans	-112.4	126	155.9	-83.8	-87.2	0	0	0	110.9
273	R	34.6	Very low	35.3	Very low	182 Å²	182	141.9 Å²	141.9	69%	0.687	77%	0.766	S	S	*	*			trans	-91.8	99.3	177.5	-178.7	-175.3	-177.2	-139.1	0.5	108.2	K275	R273-K275 PolarHBondContact O-N 3.24Å; R273-K275 VanDerWaalsContact O-N 3.14Å
274	E	38.4	Very low	36	Very low	190 Å²	190	141.6 Å²	141.6	89%	0.888	77%	0.767	S	S	*	*			trans	-57.7	117.5	174.9	-64.5	-173.7	130.5	0	0	110.3
275	K	43.7	Very low	36.7	Very low	179 Å²	179	137.7 Å²	137.7	78%	0.778	76%	0.76	S	S	*	*			trans	-85.3	138.1	158.2	-79.4	-167.6	171.3	-166.6	0	107.7	R273 G277	R273-K275 PolarHBondContact O-N 3.24Å; R273-K275 VanDerWaalsContact O-N 3.14Å; K275-G277 PolarHBondContact O-N 3.46Å
276	G	35.4	Very low	37.5	Very low	79 Å²	79	139 Å²	139	81%	0.814	75%	0.752	S	S	*	*			trans	-59.9	111.1	171.7	0	0	0	0	0	110.3	L278	G276-L278 VanDerWaalsContact C-N 3.3Å; G276-L278 PolarHBondContact O-N 3.05Å
277	G	33.9	Very low	38.4	Very low	68 Å²	68	139.4 Å²	139.4	70%	0.701	75%	0.746	S	S	*	*			trans	-74.5	80.8	178.2	0	0	0	0	0	111.4	K275	K275-G277 PolarHBondContact O-N 3.46Å
278	L	38.5	Very low	39.1	Very low	135 Å²	135	140.8 Å²	140.8	71%	0.707	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-65.8	139.1	163.9	-151	74	0	0	0	108.4	G276 F280	G276-L278 VanDerWaalsContact C-N 3.3Å; G276-L278 PolarHBondContact O-N 3.05Å; L278-F280 PolarHBondContact O-N 3Å
279	F	38.1	Very low	39.9	Very low	171 Å²	171	140.4 Å²	140.4	75%	0.75	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-66.8	118	-177.6	-72.5	-97.5	0	0	0	110.3	I281	F279-I281 PolarHBondContact O-N 3.49Å
280	F	41.1	Very low	40.2	Very low	189 Å²	189	140.5 Å²	140.5	83%	0.829	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-62.9	129.8	160.1	-62.9	-84.7	0	0	0	108.2	L278	L278-F280 PolarHBondContact O-N 3Å
281	I	43.7	Very low	40.6	Very low	130 Å²	130	142.8 Å²	142.8	67%	0.667	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-93.4	122	151.7	-61.4	176.3	0	0	0	103.2	F279 D283	F279-I281 PolarHBondContact O-N 3.49Å; I281-D283 PolarHBondContact O-N 3.19Å; I281-D283 VanDerWaalsContact O-N 3.09Å
282	D	39.1	Very low	40.8	Very low	113 Å²	113	141.4 Å²	141.4	60%	0.604	73%	0.729	S	S	*	*			trans	-67	111	-176.5	-53.2	-57.6	0	0	0	109.5	E284 L285	D282-E284 PolarHBondContact O-N 2.71Å; D282-E284 VanDerWaalsContact O-N 3.15Å; D282-L285 WeakPolarHBondContact O-CB 3.45Å; D282-L285 PolarHBondContact O-N 2.93Å
283	D	51.2	Low	40.7	Very low	117 Å²	117	138 Å²	138	63%	0.626	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-60.4	-24.1	179.5	-71.3	-53.7	0	0	0	111.7	I281 L285 F286	I281-D283 PolarHBondContact O-N 3.19Å; I281-D283 VanDerWaalsContact O-N 3.09Å; D283-L285 PolarHBondContact O-N 3.45Å; D283-F286 PolarHBondContact O-N 2.87Å
284	E	47	Very low	40.7	Very low	178 Å²	178	133.8 Å²	133.8	83%	0.832	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-53.7	-20.5	170	-63.9	-168.5	161.2	0	0	113.8	D282 F286	D282-E284 PolarHBondContact O-N 2.71Å; D282-E284 VanDerWaalsContact O-N 3.15Å; E284-F286 VanDerWaalsContact C-N 3.25Å; E284-F286 PolarHBondContact O-N 3.25Å
285	L	45.6	Very low	40.4	Very low	131 Å²	131	129.7 Å²	129.7	69%	0.686	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-72.8	-17.1	176.1	-164.2	65.8	0	0	0	113.2	D282 D283	D282-L285 WeakPolarHBondContact O-CB 3.45Å; D282-L285 PolarHBondContact O-N 2.93Å; D283-L285 PolarHBondContact O-N 3.45Å
286	F	46.9	Very low	40	Very low	131 Å²	131	124.3 Å²	124.3	58%	0.575	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	-5	-176.8	-79.1	-77.3	0	0	0	115	R82 D283 E284 Q288	R82-F286 PolarHBondContact NH2-O 3.36Å; D283-F286 PolarHBondContact O-N 2.87Å; E284-F286 VanDerWaalsContact C-N 3.25Å; E284-F286 PolarHBondContact O-N 3.25Å; F286-Q288 PolarHBondContact O-N 3.13Å; F286-Q288 VanDerWaalsContact O-N 3.16Å
287	D	46.3	Very low	39.9	Very low	125 Å²	125	130 Å²	130	67%	0.668	72%	0.724	S	S	*	*			trans	-86.1	58	169.4	-78.3	-14.1	0	0	0	111.6
288	Q	46.2	Very low	40	Very low	154 Å²	154	131.8 Å²	131.8	72%	0.72	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-74.1	129.8	154.9	-66.3	-147.7	-35.6	0	0	108.4	F286	F286-Q288 PolarHBondContact O-N 3.13Å; F286-Q288 VanDerWaalsContact O-N 3.16Å
289	P	42.7	Very low	39.7	Very low	113 Å²	113	133.1 Å²	133.1	73%	0.734	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-63.5	148.8	178.6	28.2	-35.2	0	0	0	110.2	I291	P289-I291 PolarHBondContact O-N 2.76Å; P289-I291 VanDerWaalsContact O-N 3.09Å
290	D	39.6	Very low	39.6	Very low	164 Å²	164	130.7 Å²	130.7	88%	0.877	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-46.4	118.1	-178.7	-67.2	-60.3	0	0	0	111.5	G292	D290-G292 PolarHBondContact O-N 2.88Å
291	I	36.5	Very low	39.2	Very low	150 Å²	150	127.1 Å²	127.1	77%	0.769	74%	0.737	S	S	*	*			trans	-76.8	68.3	172.4	-52.8	-179.4	0	0	0	107.8	P289	P289-I291 PolarHBondContact O-N 2.76Å; P289-I291 VanDerWaalsContact O-N 3.09Å
292	G	33.4	Very low	38.7	Very low	51 Å²	51	128.9 Å²	128.9	53%	0.526	75%	0.746	S	S	.	*			trans	-57.2	143.8	170.2	0	0	0	0	0	110	D290 A294	D290-G292 PolarHBondContact O-N 2.88Å; G292-A294 PolarHBondContact O-N 3.47Å
293	V	33.1	Very low	38.5	Very low	149 Å²	149	131.6 Å²	131.6	90%	0.903	76%	0.759	S	S	*	*			trans	-71.7	73.8	-170.9	-174	0	0	0	0	111.6	S295	V293-S295 PolarHBondContact O-N 3.04Å
294	A	35	Very low	37.6	Very low	93 Å²	93	129.2 Å²	129.2	77%	0.769	76%	0.763	S	S	*	*			trans	-79.4	95.1	176.3	0	0	0	0	0	109.7	G292 G296	G292-A294 PolarHBondContact O-N 3.47Å; A294-G296 PolarHBondContact O-N 3.16Å
295	S	32.2	Very low	37.1	Very low	103 Å²	103	127 Å²	127	72%	0.72	77%	0.767	S	S	*	*			trans	-70.7	75.2	175.3	50.8	0	0	0	0	111.8	V293 K297	V293-S295 PolarHBondContact O-N 3.04Å; S295-K297 PolarHBondContact O-N 2.89Å
296	G	34.1	Very low	36.5	Very low	67 Å²	67	123.9 Å²	123.9	69%	0.691	77%	0.767	S	S	*	*			trans	-64.6	84.3	-176.3	0	0	0	0	0	113.9	A294 S298	A294-G296 PolarHBondContact O-N 3.16Å; G296-S298 PolarHBondContact O-N 3.41Å
297	K	33.6	Very low	36.1	Very low	198 Å²	198	124.6 Å²	124.6	86%	0.861	78%	0.776	S	S	*	*			trans	-66.7	100.2	169.9	-70.7	176.2	179.6	172.4	0	110.4	S295	S295-K297 PolarHBondContact O-N 2.89Å
298	S	37	Very low	35.4	Very low	105 Å²	105	126.8 Å²	126.8	73%	0.734	78%	0.783	S	S	*	*			trans	-135.2	77.6	172.8	60.8	0	0	0	0	112.7	G296	G296-S298 PolarHBondContact O-N 3.41Å
299	N	32.1	Very low	34.9	Very low	164 Å²	164	129 Å²	129	88%	0.877	79%	0.793	S	S	*	*			trans	32.3	92.6	141.7	-55.5	-13.8	0	0	0	118.3
300	S	35.4	Very low	34.4	Very low	120 Å²	120	132.2 Å²	132.2	84%	0.839	80%	0.795	S	S	*	*			trans	-120.4	116	143.2	62.3	0	0	0	0	108.8
301	S	31.9	Very low	34	Very low	114 Å²	114	132.3 Å²	132.3	80%	0.797	80%	0.795	S	S	*	*			trans	-74.3	137.1	-175.3	52.6	0	0	0	0	113.1
302	I	34.3	Very low	33.6	Very low	166 Å²	166	132.1 Å²	132.1	85%	0.851	80%	0.795	S	S	*	*			trans	-156.9	154.1	144.4	-102.1	147.1	0	0	0	108.7
303	L	35.4	Very low	33.6	Very low	170 Å²	170	141 Å²	141	89%	0.89	81%	0.812	S	S	*	*			trans	-67	154.9	-174.2	-70.8	57.8	0	0	0	111.6
304	G	32.2	Very low	33.5	Very low	68 Å²	68	139.5 Å²	139.5	70%	0.701	80%	0.804	S	S	*	*			cis	179	-166.6	0.8	0	0	0	0	0	113.4
305	S	35	Very low	33.4	Very low	130 Å²	130	141.9 Å²	141.9	91%	0.909	80%	0.804	S	S	*	*			trans	-19.6	140.9	172.9	52.1	0	0	0	0	118.8
306	G	33.1	Very low	33.4	Very low	67 Å²	67	142.5 Å²	142.5	69%	0.691	81%	0.808	S	S	*	*			cis	166.6	-163.5	3.4	0	0	0	0	0	113
307	N	38.3	Very low	33.2	Very low	145 Å²	145	148.7 Å²	148.7	78%	0.775	82%	0.816	S	S	*	*			trans	63.5	99.3	177.9	-59.5	-19.1	0	0	0	115.5
308	Q	32.7	Very low	33	Very low	171 Å²	171	144.8 Å²	144.8	80%	0.799	81%	0.814	S	S	*	*				61.3	107.6	85.1	-68.4	-171.6	53	0	0	114.5
309	Q	36.4	Very low	32.8	Very low	200 Å²	200	145.6 Å²	145.6	94%	0.935	82%	0.819	S	S	*	*				-160.8	159.4	99.2	-103.3	177.7	33.6	0	0	112.6
310	K	30.6	Very low	33	Very low	181 Å²	181	142 Å²	142	79%	0.787	81%	0.807	S	S	*	*			trans	-113.5	113.4	-171	167.6	-171.2	175.5	-177.5	0	108.5
311	L	32	Very low	32.8	Very low	166 Å²	166	144.3 Å²	144.3	87%	0.869	81%	0.808	S	S	*	*			trans	-130.4	105.1	170.6	-152.2	75.6	0	0	0	111.5
312	L	29.1	Very low	32.8	Very low	147 Å²	147	146.7 Å²	146.7	77%	0.77	81%	0.811	S	S	*	*			trans	-78.3	131	166.1	-70.7	160.2	0	0	0	108.6
313	R	31.9	Very low	32.8	Very low	237 Å²	237	146.1 Å²	146.1	89%	0.894	81%	0.805	S	S	*	*			trans	-145.6	123.6	151.6	-115.2	176.7	-168.1	-163.6	2	111.4
314	T	31	Very low	32.5	Very low	117 Å²	117	145.7 Å²	145.7	72%	0.718	80%	0.802	S	S	*	*			trans	-72.8	-177	162.5	54.7	0	0	0	0	110.1
315	N	32.5	Very low	32.5	Very low	144 Å²	144	146.8 Å²	146.8	77%	0.77	81%	0.805	S	S	*	*			trans	88.7	135	178.2	-46.5	-4.1	0	0	0	112
316	S	33.9	Very low	32.5	Very low	115 Å²	115	144.8 Å²	144.8	80%	0.804	79%	0.791	S	S	*	*			cis	-152.5	167.4	-1.3	-115.3	0	0	0	0	112.3
317	K	29.8	Very low	32.5	Very low	197 Å²	197	149.7 Å²	149.7	86%	0.857	80%	0.796	S	S	*	*			trans	-69.4	168.6	170.7	-63.3	175.2	178.5	176.8	0	111.3
318	S	29.1	Very low	32.4	Very low	117 Å²	117	151.5 Å²	151.5	82%	0.818	80%	0.797	S	S	*	*			trans	90.5	151.8	168.8	81.2	0	0	0	0	117.4
319	S	32.1	Very low	32.4	Very low	122 Å²	122	148.9 Å²	148.9	85%	0.853	79%	0.793	S	S	*	*			trans	66.1	127.3	-163.8	-143.9	0	0	0	0	114.1
320	S	35.9	Very low	32.3	Very low	88 Å²	88	143.5 Å²	143.5	62%	0.615	78%	0.777	S	S	*	*			cis	-138.6	95.9	2	45.8	0	0	0	0	112.5	L322	S320-L322 VanDerWaalsContact C-N 3.32Å; S320-L322 PolarHBondContact O-N 2.89Å
321	I	31.5	Very low	32.4	Very low	168 Å²	168	144.2 Å²	144.2	86%	0.862	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	89.2	161.6	-58.8	173.2	0	0	0	107.5
322	L	33	Very low	32.4	Very low	164 Å²	164	140 Å²	140	86%	0.859	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.9	3.3	163.6	-113.3	167.9	0	0	0	116.7	S320	S320-L322 VanDerWaalsContact C-N 3.32Å; S320-L322 PolarHBondContact O-N 2.89Å
323	Q	32.7	Very low	32.5	Very low	155 Å²	155	141.4 Å²	141.4	72%	0.724	77%	0.768	S	S	*	*			trans	-119.4	10.2	-171.1	-150.6	158.5	-16.2	0	0	115.3	A325	Q323-A325 VanDerWaalsContact C-N 3.32Å; Q323-A325 PolarHBondContact O-N 3.27Å
324	L	29.3	Very low	32.4	Very low	160 Å²	160	138 Å²	138	84%	0.838	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	23.8	-174.9	-81.5	163.7	0	0	0	115.3
325	A	32.7	Very low	32.4	Very low	92 Å²	92	135.1 Å²	135.1	76%	0.76	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	-16.9	-167.4	0	0	0	0	0	116	Q323	Q323-A325 VanDerWaalsContact C-N 3.32Å; Q323-A325 PolarHBondContact O-N 3.27Å
326	S	35.8	Very low	32.7	Very low	88 Å²	88	132 Å²	132	62%	0.615	74%	0.741	S	S	*	*	S	Bend	trans	-112.9	-10.7	-163.6	48.7	0	0	0	0	117.2
327	E	32.9	Very low	32.8	Very low	170 Å²	170	134.9 Å²	134.9	79%	0.794	74%	0.735	S	S	*	*			trans	-108.2	9.3	-172.3	-66.8	-175.4	132.6	0	0	114.9	T329	E327-T329 PolarHBondContact O-N 3.25Å
328	K	34.6	Very low	33.4	Very low	183 Å²	183	131.7 Å²	131.7	80%	0.796	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	3.7	-178.2	-72.4	-173	174.5	179.6	0	115.4
329	T	33.9	Very low	34.1	Very low	115 Å²	115	131.1 Å²	131.1	71%	0.706	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-13.8	-165.8	-1.5	0	0	0	0	115.1	E327	E327-T329 PolarHBondContact O-N 3.25Å
330	S	34.1	Very low	34.6	Very low	88 Å²	88	131.5 Å²	131.5	62%	0.615	70%	0.699	S	S	*	*	S	Bend	trans	-89.2	-15.9	-170.7	-162.6	0	0	0	0	115.8
331	Y	33	Very low	35.1	Very low	196 Å²	196	135.5 Å²	135.5	77%	0.769	71%	0.707	S	S	*	*	S	Bend	trans	-111.7	-2.5	-174.4	-68.1	-78.2	0	0	0	114.5	Q333	Y331-Q333 PolarHBondContact O-N 2.89Å
332	A	31.5	Very low	36	Very low	77 Å²	77	136.2 Å²	136.2	64%	0.636	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-0.1	178.5	0	0	0	0	0	114.5
333	Q	32	Very low	36.4	Very low	176 Å²	176	132.7 Å²	132.7	82%	0.822	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-8.1	-175.3	-75.5	-168.5	-37.4	0	0	115.2	Y331 S335	Y331-Q333 PolarHBondContact O-N 2.89Å; Q333-S335 PolarHBondContact O-N 2.92Å
334	L	29	Very low	37.2	Very low	165 Å²	165	129.9 Å²	129.9	86%	0.864	68%	0.679	S	S	*	*	S	Bend	trans	-75.3	61.5	158	-76.7	169.8	0	0	0	109.6
335	S	32	Very low	38.3	Very low	58 Å²	58	127.2 Å²	127.2	41%	0.406	66%	0.658	S	S	.	*			trans	-65	143.9	-173.3	178.6	0	0	0	0	111.9	Q333 Y337 N338	Q333-S335 PolarHBondContact O-N 2.92Å; S335-Y337 PolarHBondContact O-N 3.4Å; S335-N338 PolarHBondContact O-N 3.49Å
336	S	37.4	Very low	39.1	Very low	78 Å²	78	125.2 Å²	125.2	55%	0.545	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.8	-17	-176.2	-44.6	0	0	0	0	114.6	N338 L339 Y340	S336-N338 PolarHBondContact O-N 2.98Å; S336-N338 VanDerWaalsContact O-N 3.11Å; S336-L339 PolarHBondContact O-N 3.21Å; S336-Y340 WeakPolarHBondContact O-CD2 3.45Å; S336-Y340 PolarHBondContact O-N 3.31Å
337	Y	36.8	Very low	39.8	Very low	175 Å²	175	126.2 Å²	126.2	69%	0.686	63%	0.632	S	S	*	*	H	α-helix	trans	-43.7	-38.1	172.8	-94.4	-95.5	0	0	0	114.4	S335 L339 Y340	S335-Y337 PolarHBondContact O-N 3.4Å; Y337-L339 VanDerWaalsContact C-N 3.34Å; Y337-L339 PolarHBondContact O-N 3.2Å; Y337-Y340 PolarHBondContact O-N 2.92Å
338	N	42.2	Very low	40.5	Very low	131 Å²	131	123.9 Å²	123.9	70%	0.701	62%	0.622	S	S	*	*	H	α-helix	trans	-72.5	-18.6	-179.2	-89.8	-33.6	0	0	0	115	S335 S336	S335-N338 PolarHBondContact O-N 3.49Å; S336-N338 PolarHBondContact O-N 2.98Å; S336-N338 VanDerWaalsContact O-N 3.11Å
339	L	43.1	Very low	40.9	Very low	105 Å²	105	118 Å²	118	55%	0.55	60%	0.599	S	S	.	*	H	α-helix	trans	-86.1	-32.3	172.3	-95.4	74.6	0	0	0	112.4	S336 Y337 H341 K342 M343 M346	S336-L339 PolarHBondContact O-N 3.21Å; Y337-L339 VanDerWaalsContact C-N 3.34Å; Y337-L339 PolarHBondContact O-N 3.2Å; L339-H341 VanDerWaalsContact C-N 3.27Å; L339-H341 PolarHBondContact O-N 3.34Å; L339-K342 PolarHBondContact O-N 3.27Å; L339-M343 PolarHBondContact O-N 2.97Å; L339-M346 HydrophobicContact CB-CE 4.41Å
340	Y	42.8	Very low	41.3	Very low	129 Å²	129	118.7 Å²	118.7	51%	0.506	60%	0.598	S	S	.	*	H	α-helix	trans	-58.3	-35.2	-174	-80.2	-72	0	0	0	113.6	S336 Y337 L347	S336-Y340 WeakPolarHBondContact O-CD2 3.45Å; S336-Y340 PolarHBondContact O-N 3.31Å; Y337-Y340 PolarHBondContact O-N 2.92Å; Y340-L347 HydrophobicContact CE1-CD2 4.39Å
341	H	47.5	Very low	41.6	Very low	173 Å²	173	118.6 Å²	118.6	80%	0.801	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-17.4	176.4	-79.5	-85.2	0	0	0	114.6	L339	L339-H341 VanDerWaalsContact C-N 3.27Å; L339-H341 PolarHBondContact O-N 3.34Å
342	K	49.9	Very low	42	Very low	182 Å²	182	117.2 Å²	117.2	79%	0.791	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-22.8	-177.9	-97.3	-177.8	173.1	179.6	0	114.5	L339	L339-K342 PolarHBondContact O-N 3.27Å
343	M	41.9	Very low	42.4	Very low	90 Å²	90	121.9 Å²	121.9	44%	0.443	60%	0.602	S	S	.	*			trans	-139.9	74.8	-178.6	-72.7	-164	165.4	0	0	113.6	L339 W345 M346	L339-M343 PolarHBondContact O-N 2.97Å; M343-W345 HydrophobicContact CE-CZ2 4.23Å; M343-W345 PolarHBondContact O-N 3.06Å; M343-W345 VanDerWaalsContact O-N 3.14Å; M343-W345 HydrophobicContact SD-CZ2 3.75Å; M343-M346 HydrophobicContact CB-CB 4.34Å; M343-M346 VanDerWaalsContact O-CB 3.3Å; M343-M346 WeakPolarHBondContact O-CB 3.32Å; M343-M346 PolarHBondContact O-N 2.98Å; M343-M346 VanDerWaalsContact O-N 3.11Å
344	P	49.4	Very low	42.6	Very low	96 Å²	96	123.3 Å²	123.3	62%	0.623	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-30.6	179	-26.2	35.5	0	0	0	114.4	M346	P344-M346 PolarHBondContact O-N 2.92Å
345	W	52.8	Low	42.8	Very low	105 Å²	105	123 Å²	123	40%	0.398	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64	-22.6	179.2	67.3	-79.5	0	0	0	114	K88 M343 L347 M348 I349	K88-W345 HydrophobicContact CB-CH2 4.28Å; K88-W345 HydrophobicContact CD-CH2 4.21Å; K88-W345 HydrophobicContact CG-CH2 4.18Å; K88-W345 HydrophobicContact CG-CZ3 4.37Å; M343-W345 HydrophobicContact CE-CZ2 4.23Å; M343-W345 PolarHBondContact O-N 3.06Å; M343-W345 VanDerWaalsContact O-N 3.14Å; M343-W345 HydrophobicContact SD-CZ2 3.75Å; W345-L347 PolarHBondContact O-N 3.47Å; W345-M348 PolarHBondContact O-N 3.12Å; W345-M348 VanDerWaalsContact O-N 3.08Å; W345-I349 HydrophobicContact CE3-CD1 4.1Å; W345-I349 HydrophobicContact CH2-CD1 4.16Å; W345-I349 HydrophobicContact CZ3-CD1 3.64Å; W345-I349 HydrophobicContact CZ3-CG1 4.34Å
346	M	49.2	Very low	42.8	Very low	50 Å²	50	124 Å²	124	25%	0.246	62%	0.619	C	S	.	*	H	α-helix	trans	-62.1	-26.5	-175.8	-168.7	172.9	67.1	0	0	113.1	L339 M343 P344 M348 I349	L339-M346 HydrophobicContact CB-CE 4.41Å; M343-M346 HydrophobicContact CB-CB 4.34Å; M343-M346 VanDerWaalsContact O-CB 3.3Å; M343-M346 WeakPolarHBondContact O-CB 3.32Å; M343-M346 PolarHBondContact O-N 2.98Å; M343-M346 VanDerWaalsContact O-N 3.11Å; P344-M346 PolarHBondContact O-N 2.92Å; M346-M348 PolarHBondContact O-N 2.91Å; M346-I349 HydrophobicContact CG-CD1 4.29Å; M346-I349 PolarHBondContact O-N 3.38Å
347	L	49.8	Very low	42.6	Very low	109 Å²	109	128.8 Å²	128.8	57%	0.571	63%	0.632	S	S	*	*	H	α-helix	trans	-61.6	-24.3	175.5	-76.7	164.7	0	0	0	113.7	Y340 W345 S351	Y340-L347 HydrophobicContact CE1-CD2 4.39Å; W345-L347 PolarHBondContact O-N 3.47Å; L347-S351 PolarHBondContact O-OG 2.92Å
348	M	46.8	Very low	42.2	Very low	120 Å²	120	130.4 Å²	130.4	59%	0.591	64%	0.643	S	S	*	*	H	α-helix	trans	-75.3	-29.7	177.2	-62.9	-139.6	-63.6	0	0	112.8	W345 M346 S351 K352	W345-M348 PolarHBondContact O-N 3.12Å; W345-M348 VanDerWaalsContact O-N 3.08Å; M346-M348 PolarHBondContact O-N 2.91Å; M348-S351 PolarHBondContact O-N 3.46Å; M348-K352 PolarHBondContact O-N 2.84Å
349	I	45	Very low	41.6	Very low	60 Å²	60	128.8 Å²	128.8	31%	0.308	64%	0.641	S	S	.	*	H	α-helix	trans	-66.4	-49.9	-175.8	-53.6	171.4	0	0	0	110.3	L84 W345 M346 S351 K352	L84-I349 HydrophobicContact CD2-CD1 4.36Å; W345-I349 HydrophobicContact CE3-CD1 4.1Å; W345-I349 HydrophobicContact CH2-CD1 4.16Å; W345-I349 HydrophobicContact CZ3-CD1 3.64Å; W345-I349 HydrophobicContact CZ3-CG1 4.34Å; M346-I349 HydrophobicContact CG-CD1 4.29Å; M346-I349 PolarHBondContact O-N 3.38Å; I349-S351 PolarHBondContact O-N 3.34Å; I349-K352 PolarHBondContact O-N 3.3Å
350	N	40.5	Very low	40.9	Very low	130 Å²	130	129.7 Å²	129.7	70%	0.695	65%	0.651	S	S	*	*	H	α-helix	trans	-72.2	-16.8	-177.8	-67.9	-17.6	0	0	0	113.3
351	S	40.7	Very low	40.4	Very low	86 Å²	86	131 Å²	131	60%	0.601	67%	0.666	S	S	*	*	H	α-helix	trans	-83.3	-24.1	179.2	-61.4	0	0	0	0	113.1	L347 M348 I349	L347-S351 PolarHBondContact O-OG 2.92Å; M348-S351 PolarHBondContact O-N 3.46Å; I349-S351 PolarHBondContact O-N 3.34Å
352	K	41.2	Very low	39.5	Very low	166 Å²	166	129 Å²	129	72%	0.722	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	26.5	-167.8	-147	177.7	-177.3	-174.5	0	114.4	M348 I349	M348-K352 PolarHBondContact O-N 2.84Å; I349-K352 PolarHBondContact O-N 3.3Å
353	K	40.6	Very low	38.9	Very low	176 Å²	176	126 Å²	126	77%	0.765	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	20.1	-178.8	-116.3	-175.2	-177.1	-176.3	0	114.6
354	R	36.1	Very low	38.6	Very low	206 Å²	206	127.8 Å²	127.8	78%	0.777	67%	0.668	S	S	*	*			trans	-117.5	58.2	173.3	-79.2	-169	-69.4	135.8	-2.1	112
355	D	32.4	Very low	38.2	Very low	158 Å²	158	131.9 Å²	131.9	85%	0.845	68%	0.679	S	S	*	*			trans	-72.1	137.9	159.9	-67.4	-52.8	0	0	0	109.5
356	G	32	Very low	37.6	Very low	80 Å²	80	133.2 Å²	133.2	83%	0.825	69%	0.694	S	S	*	*	S	Bend	trans	93	29.3	161.6	0	0	0	0	0	119.3
357	Q	33.9	Very low	37.2	Very low	178 Å²	178	138 Å²	138	83%	0.832	72%	0.721	S	S	*	*			trans	-144.2	132.7	161	-116.4	171.8	24.5	0	0	114.7	C359	Q357-C359 PolarHBondContact O-N 3.43Å
358	K	28.2	Very low	36.7	Very low	208 Å²	208	139.8 Å²	139.8	90%	0.904	73%	0.731	S	S	*	*			trans	-77.7	94.3	170.7	-72.6	-179.4	177.9	178	0	109.6	T360	K358-T360 PolarHBondContact O-N 3.24Å
359	C	29.1	Very low	36.1	Very low	98 Å²	98	141 Å²	141	66%	0.662	74%	0.74	S	S	*	*			trans	-86.1	88.2	169.7	-63.9	0	0	0	0	110.5	Q357 L361	Q357-C359 PolarHBondContact O-N 3.43Å; C359-L361 PolarHBondContact O-N 3.49Å; C359-L361 VanDerWaalsContact O-N 3.13Å
360	T	30	Very low	35.8	Very low	124 Å²	124	144.7 Å²	144.7	76%	0.761	76%	0.764	S	S	*	*			trans	-67.1	99.7	159.1	44.6	0	0	0	0	108.3	K358 L362	K358-T360 PolarHBondContact O-N 3.24Å; T360-L362 PolarHBondContact O-N 3Å
361	L	31.2	Very low	35.3	Very low	156 Å²	156	146.4 Å²	146.4	82%	0.817	77%	0.774	S	S	*	*			trans	-77.2	104.3	174.5	-169.7	74.6	0	0	0	108.7	C359 T363	C359-L361 PolarHBondContact O-N 3.49Å; C359-L361 VanDerWaalsContact O-N 3.13Å; L361-T363 PolarHBondContact O-N 2.86Å
362	L	29.5	Very low	34.8	Very low	131 Å²	131	145 Å²	145	69%	0.686	77%	0.772	S	S	*	*			trans	-69.2	125.2	160	-82.4	81.4	0	0	0	108	T360	T360-L362 PolarHBondContact O-N 3Å
363	T	37.6	Very low	34.4	Very low	119 Å²	119	144.1 Å²	144.1	73%	0.73	78%	0.782	S	S	*	*			trans	-140.1	93.9	152.1	-49.8	0	0	0	0	106.4	L361 H365	L361-T363 PolarHBondContact O-N 2.86Å; T363-H365 PolarHBondContact O-N 3.34Å
364	D	34.6	Very low	34.1	Very low	127 Å²	127	143.4 Å²	143.4	68%	0.679	79%	0.785	S	S	*	*			trans	-72.9	120.1	178.3	-52.7	-63.6	0	0	0	109.8
365	H	41.5	Very low	33.9	Very low	183 Å²	183	139 Å²	139	85%	0.847	78%	0.777	S	S	*	*			trans	-163.9	122.8	143.3	-122.6	-62.2	0	0	0	111.1	T363	T363-H365 PolarHBondContact O-N 3.34Å
366	D	39	Very low	34	Very low	133 Å²	133	137.9 Å²	137.9	71%	0.711	78%	0.776	S	S	*	*			trans	-74.7	140.3	173.1	-48.3	-88.8	0	0	0	111.2
367	D	40.8	Very low	33.9	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	76%	0.759	S	S	*	*				173.1	147.3	108.5	-88	-29.3	0	0	0	113.3
368	D	40.4	Very low	33.8	Very low	145 Å²	145	133 Å²	133	78%	0.775	75%	0.749	S	S	*	*			trans	47.7	86.4	158.5	-71.8	-22.5	0	0	0	122.5
369	N	33.7	Very low	33.9	Very low	147 Å²	147	131.3 Å²	131.3	79%	0.786	75%	0.746	S	S	*	*				55.9	77.4	112.8	-173.5	27.5	0	0	0	119.6
370	V	38.5	Very low	34.1	Very low	136 Å²	136	132.7 Å²	132.7	82%	0.824	75%	0.746	S	S	*	*			trans	-136.3	139.1	143.4	-177.7	0	0	0	0	109.7	G372	V370-G372 PolarHBondContact O-N 3.07Å
371	N	31.2	Very low	34.3	Very low	166 Å²	166	134.7 Å²	134.7	89%	0.888	75%	0.747	S	S	*	*			trans	-55.9	107.4	175.7	-81.3	-50.5	0	0	0	111.9
372	G	30.3	Very low	34.4	Very low	56 Å²	56	138.4 Å²	138.4	58%	0.577	75%	0.75	S	S	*	*			trans	-148	54.3	-169.8	0	0	0	0	0	114.3	V370 L374	V370-G372 PolarHBondContact O-N 3.07Å; G372-L374 PolarHBondContact O-N 3.21Å
373	T	32.3	Very low	34.4	Very low	149 Å²	149	137.8 Å²	137.8	91%	0.914	75%	0.752	S	S	*	*			trans	-65.8	78.4	165	29.8	0	0	0	0	110.4	N375	T373-N375 VanDerWaalsContact C-N 3.32Å; T373-N375 PolarHBondContact O-N 2.88Å
374	L	32.8	Very low	34	Very low	161 Å²	161	139.8 Å²	139.8	84%	0.843	75%	0.751	S	S	*	*			trans	-66.6	92.1	174.2	-81.4	171.2	0	0	0	109.1	G372 T376	G372-L374 PolarHBondContact O-N 3.21Å; L374-T376 PolarHBondContact O-N 3.26Å
375	N	33.3	Very low	33.7	Very low	112 Å²	112	139.5 Å²	139.5	60%	0.599	76%	0.759	S	S	*	*			trans	-64.5	97.2	-175.9	-173.2	-1.7	0	0	0	110.4	T373 S377 S378	T373-N375 VanDerWaalsContact C-N 3.32Å; T373-N375 PolarHBondContact O-N 2.88Å; N375-S377 PolarHBondContact O-N 3.5Å; N375-S377 WeakPolarHBondContact OD1-CB 3.45Å; N375-S377 PolarHBondContact OD1-N 3.11Å; N375-S378 WeakPolarHBondContact O-CB 3.44Å; N375-S378 PolarHBondContact O-N 3.47Å
376	T	33.6	Very low	33.3	Very low	136 Å²	136	141 Å²	141	83%	0.834	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-62.4	-12.2	179.7	47.4	0	0	0	0	113.4	L374 S378	L374-T376 PolarHBondContact O-N 3.26Å; T376-S378 PolarHBondContact O-N 3.05Å
377	S	30.4	Very low	33.2	Very low	65 Å²	65	139.8 Å²	139.8	46%	0.455	76%	0.756	S	S	.	*	G	3₁₀ helix	trans	-71.2	-7.3	168.2	-164.6	0	0	0	0	114.2	N375	N375-S377 PolarHBondContact O-N 3.5Å; N375-S377 WeakPolarHBondContact OD1-CB 3.45Å; N375-S377 PolarHBondContact OD1-N 3.11Å
378	S	31.7	Very low	32.8	Very low	90 Å²	90	142.3 Å²	142.3	63%	0.629	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-70.4	-31.7	-173.1	-172.4	0	0	0	0	114.4	N375 T376	N375-S378 WeakPolarHBondContact O-CB 3.44Å; N375-S378 PolarHBondContact O-N 3.47Å; T376-S378 PolarHBondContact O-N 3.05Å
379	M	31.1	Very low	32.3	Very low	172 Å²	172	143 Å²	143	85%	0.847	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-85.1	-6.5	-173.2	-68.3	-153.2	73.4	0	0	115.5	H381	M379-H381 VanDerWaalsContact C-N 3.29Å; M379-H381 PolarHBondContact O-N 3Å
380	L	31.7	Very low	32	Very low	127 Å²	127	143.3 Å²	143.3	67%	0.665	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-82.1	2.5	-176.1	-68.5	173.8	0	0	0	114.8
381	H	34.4	Very low	31.8	Very low	166 Å²	166	143.4 Å²	143.4	77%	0.769	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-107.1	15.1	-171.1	-80.3	-72.8	0	0	0	116.1	M379	M379-H381 VanDerWaalsContact C-N 3.29Å; M379-H381 PolarHBondContact O-N 3Å
382	R	33.4	Very low	31.7	Very low	235 Å²	235	144.4 Å²	144.4	89%	0.887	75%	0.752	S	S	*	*	S	Bend	trans	-120.3	2	-173.8	-92.6	-170.7	175.9	-156.2	-1.5	118.3
383	T	30.6	Very low	31.8	Very low	118 Å²	118	146.4 Å²	146.4	72%	0.724	76%	0.757	S	S	*	*	S	Bend	trans	-134.9	44	-175.1	54.3	0	0	0	0	114.3
384	F	27.9	Very low	31.6	Very low	160 Å²	160	148.8 Å²	148.8	70%	0.702	76%	0.755	S	S	*	*			trans	-135.1	50.7	176.6	-73.4	-71.2	0	0	0	113.4	W386	F384-W386 PolarHBondContact O-N 3.4Å
385	S	30	Very low	31.7	Very low	121 Å²	121	148.6 Å²	148.6	85%	0.846	75%	0.753	S	S	*	*			trans	-95.2	72	173	-60.6	0	0	0	0	111.3
386	W	31.2	Very low	31.5	Very low	215 Å²	215	148.2 Å²	148.2	81%	0.814	76%	0.759	S	S	*	*			trans	-68.3	142	160.6	-78.3	81.4	0	0	0	109.2	F384 R388	F384-W386 PolarHBondContact O-N 3.4Å; W386-R388 PolarHBondContact O-N 3.36Å
387	P	37.9	Very low	31.4	Very low	107 Å²	107	149 Å²	149	70%	0.695	76%	0.757	S	S	*	*			trans	-60.8	118.4	178.5	-24.5	34.7	0	0	0	112.4	L389	P387-L389 VanDerWaalsContact C-N 3.31Å; P387-L389 HydrophobicContact CB-CG 4.46Å; P387-L389 PolarHBondContact O-N 3.11Å
388	R	32	Very low	31.6	Very low	205 Å²	205	153.7 Å²	153.7	77%	0.774	78%	0.778	S	S	*	*			trans	-72.1	82.6	169.4	-85	-165.8	174.4	-146.7	0.2	110.4	W386 N390 E391	W386-R388 PolarHBondContact O-N 3.36Å; R388-N390 VanDerWaalsContact C-N 3.28Å; R388-N390 PolarHBondContact O-N 2.87Å; R388-E391 IonicContact CZ-OE2 3.98Å; R388-E391 IonicContact NH1-OE1 2.68Å; R388-E391 IonicContact NH1-OE2 3.84Å; R388-E391 PolarHBondContact NH1-OE2 2.64Å
389	L	29.3	Very low	31.6	Very low	158 Å²	158	157.5 Å²	157.5	83%	0.827	79%	0.785	S	S	*	*			trans	-90.1	60	168.6	-68.5	178.9	0	0	0	111.5	P387	P387-L389 VanDerWaalsContact C-N 3.31Å; P387-L389 HydrophobicContact CB-CG 4.46Å; P387-L389 PolarHBondContact O-N 3.11Å
390	N	29.2	Very low	31.9	Very low	155 Å²	155	156.1 Å²	156.1	83%	0.829	79%	0.786	S	S	*	*	S	Bend	trans	-170.7	67.5	163.4	-108.2	-26.6	0	0	0	111.6	R388	R388-N390 VanDerWaalsContact C-N 3.28Å; R388-N390 PolarHBondContact O-N 2.87Å
391	E	32.5	Very low	31.8	Very low	137 Å²	137	157.4 Å²	157.4	64%	0.64	79%	0.794	S	S	*	*			trans	-173	77.7	164.5	-110.1	162.3	-174.7	0	0	110.1	R388	R388-E391 IonicContact CZ-OE2 3.98Å; R388-E391 IonicContact NH1-OE1 2.68Å; R388-E391 IonicContact NH1-OE2 3.84Å; R388-E391 PolarHBondContact NH1-OE2 2.64Å
392	M	29.6	Very low	31.8	Very low	188 Å²	188	155.4 Å²	155.4	93%	0.926	80%	0.799	S	S	*	*			trans	-110.8	93.1	161.4	-165.1	64.4	170.7	0	0	107.7	F394	M392-F394 PolarHBondContact O-N 3.27Å
393	S	32.9	Very low	31.6	Very low	97 Å²	97	149.5 Å²	149.5	68%	0.678	79%	0.794	S	S	*	*			trans	-64.2	127	-167.4	-52.6	0	0	0	0	112.5	I395	S393-I395 PolarHBondContact O-N 3.44Å; S393-I395 VanDerWaalsContact O-N 3.11Å
394	F	29.1	Very low	31.7	Very low	199 Å²	199	149.9 Å²	149.9	87%	0.873	80%	0.8	S	S	*	*			trans	-62.9	110.4	158.8	-84	-98.3	0	0	0	108.7	M392	M392-F394 PolarHBondContact O-N 3.27Å
395	I	34.7	Very low	31.9	Very low	157 Å²	157	149.6 Å²	149.6	81%	0.805	81%	0.805	S	S	*	*			trans	-84.1	117.1	156.8	-62.6	179.4	0	0	0	105.6	S393	S393-I395 PolarHBondContact O-N 3.44Å; S393-I395 VanDerWaalsContact O-N 3.11Å
396	C	28.8	Very low	31.8	Very low	105 Å²	105	152.2 Å²	152.2	71%	0.709	81%	0.809	S	S	*	*			trans	-72.8	136.2	172.8	-60.8	0	0	0	0	109.2
397	D	30.2	Very low	32	Very low	152 Å²	152	146.1 Å²	146.1	81%	0.813	80%	0.804	S	S	*	*			trans	-173.8	96.4	144.3	-93.6	-22.5	0	0	0	108.1
398	D	36.2	Very low	31.7	Very low	164 Å²	164	148 Å²	148	88%	0.877	81%	0.809	S	S	*	*			trans	-166.1	150	130.7	-118.4	-29.7	0	0	0	111.2
399	H	30.6	Very low	31.7	Very low	169 Å²	169	148.6 Å²	148.6	78%	0.782	81%	0.812	S	S	*	*			trans	-88.5	136.5	-173.9	-63.2	-92.8	0	0	0	112.6
400	T	37.1	Very low	31.7	Very low	143 Å²	143	148.6 Å²	148.6	88%	0.877	81%	0.813	S	S	*	*			trans	-164.3	130.2	138.2	1.8	0	0	0	0	111.5
401	D	30.2	Very low	32	Very low	155 Å²	155	148 Å²	148	83%	0.829	81%	0.81	S	S	*	*			trans	-74.3	131.3	178.2	-55.7	-86	0	0	0	112.1
402	S	33.8	Very low	31.8	Very low	124 Å²	124	146.3 Å²	146.3	87%	0.867	81%	0.814	S	S	*	*			trans	-163.5	116.9	149.1	-84.5	0	0	0	0	111.3
403	S	29.6	Very low	31.9	Very low	111 Å²	111	143 Å²	143	78%	0.776	81%	0.808	S	S	*	*			trans	-73.1	138.7	174.9	53.7	0	0	0	0	112.6
404	C	32.9	Very low	31.7	Very low	126 Å²	126	145.4 Å²	145.4	85%	0.851	81%	0.809	S	S	*	*			trans	-162	105.5	140.9	-103.4	0	0	0	0	114.3
405	N	31.9	Very low	31.7	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	81%	0.808	S	S	*	*			trans	16.3	118.7	147.3	-60.6	-27.7	0	0	0	121.6
406	L	27.5	Very low	31.5	Very low	176 Å²	176	144.6 Å²	144.6	92%	0.921	81%	0.806	S	S	*	*			trans	-44.6	132.7	149.4	-177.3	79.3	0	0	0	113.8
407	A	34.9	Very low	31.8	Very low	87 Å²	87	147.2 Å²	147.2	72%	0.719	81%	0.812	S	S	*	*			trans	-150.5	151.3	163.3	0	0	0	0	0	111.9
408	N	32.5	Very low	31.9	Very low	148 Å²	148	147.2 Å²	147.2	79%	0.791	81%	0.812	S	S	*	*			trans	-68.3	147.1	-173.5	-56.5	-38.6	0	0	0	113.7
409	Y	32.4	Very low	32	Very low	217 Å²	217	145 Å²	145	85%	0.851	81%	0.807	S	S	*	*			trans	-144.2	86.5	146.9	-90.3	-71.2	0	0	0	111.1
410	D	29.8	Very low	32.2	Very low	157 Å²	157	144.5 Å²	144.5	84%	0.84	81%	0.81	S	S	*	*			trans	-76	132	142.7	-84.7	-51.6	0	0	0	107.1
411	N	34.2	Very low	32.4	Very low	142 Å²	142	144.4 Å²	144.4	76%	0.759	80%	0.802	S	S	*	*			trans	-157.5	132.1	156.3	-112.1	-27.5	0	0	0	111.5
412	S	28.2	Very low	32.8	Very low	103 Å²	103	143.1 Å²	143.1	72%	0.72	80%	0.795	S	S	*	*			trans	-90.7	145.5	169.5	-172.3	0	0	0	0	109.3
413	S	33.3	Very low	33	Very low	117 Å²	117	143 Å²	143	82%	0.818	79%	0.785	S	S	*	*			trans	-142.2	118.6	167.8	-67.5	0	0	0	0	109.2
414	Q	27.3	Very low	33.3	Very low	149 Å²	149	144.1 Å²	144.1	70%	0.696	78%	0.782	S	S	*	*			trans	-97.3	-174.8	164.8	-65.7	-170.4	2.9	0	0	109.2
415	Y	29	Very low	33.5	Very low	213 Å²	213	145.1 Å²	145.1	84%	0.835	78%	0.779	S	S	*	*			trans	72.2	144.5	-178.1	-44.4	-76.9	0	0	0	112.8
416	T	30.5	Very low	33.9	Very low	126 Å²	126	145.3 Å²	145.3	77%	0.773	78%	0.778	S	S	*	*			cis	-133.6	147.3	14.5	-50.8	0	0	0	0	111.1
417	L	36.3	Very low	34.4	Very low	160 Å²	160	144.4 Å²	144.4	84%	0.838	77%	0.774	S	S	*	*			trans	-110.5	133	168.6	-105.4	167.6	0	0	0	108.7	P419	L417-P419 WeakPolarHBondContact O-CD 3.49Å
418	N	32.1	Very low	34.7	Very low	152 Å²	152	142.8 Å²	142.8	81%	0.813	77%	0.766	S	S	*	*			trans	-78.5	130.5	171.5	-69	-8.6	0	0	0	110.2
419	P	38.1	Very low	35.1	Very low	118 Å²	118	144.8 Å²	144.8	77%	0.766	77%	0.768	S	S	*	*			trans	-106.2	139.7	157.4	36	-26.1	0	0	0	110.4	L417	L417-P419 WeakPolarHBondContact O-CD 3.49Å
420	D	35.5	Very low	35.7	Very low	158 Å²	158	141 Å²	141	85%	0.845	76%	0.762	S	S	*	*			trans	-151.2	161.6	171.3	-140.1	-26.2	0	0	0	110.2
421	I	41	Very low	36.2	Very low	141 Å²	141	140 Å²	140	72%	0.723	76%	0.756	S	S	*	*			trans	72.7	87.7	176.3	-52.4	-179.9	0	0	0	116.2
422	N	37.7	Very low	36.7	Very low	127 Å²	127	142.4 Å²	142.4	68%	0.679	76%	0.763	S	S	*	*				90	133.9	125.3	-79.4	42	0	0	0	124.9
423	D	37.7	Very low	37	Very low	121 Å²	121	144.3 Å²	144.3	65%	0.647	77%	0.765	S	S	*	*			trans	86.9	99.2	133	-66.3	-17.8	0	0	0	122.8
424	N	36.5	Very low	37.2	Very low	135 Å²	135	145.7 Å²	145.7	72%	0.722	77%	0.769	S	S	*	*				94.5	101.1	124.6	-70.9	-44	0	0	0	121.7
425	L	36.5	Very low	37.6	Very low	148 Å²	148	143 Å²	143	78%	0.775	77%	0.766	S	S	*	*				108.2	140.5	115.4	-140.6	75.7	0	0	0	119.2
426	I	40	Very low	37.7	Very low	157 Å²	157	139.7 Å²	139.7	81%	0.805	76%	0.761	S	S	*	*			trans	70.6	136.7	167.2	-46.5	-179.8	0	0	0	115.6
427	D	39.2	Very low	37.8	Very low	157 Å²	157	143.5 Å²	143.5	84%	0.84	77%	0.768	S	S	*	*			cis	170.1	157.1	-32.5	177.1	30.1	0	0	0	106
428	G	40.3	Very low	37.4	Very low	53 Å²	53	140.5 Å²	140.5	55%	0.546	76%	0.76	S	S	.	*			trans	94.5	111.2	-178.7	0	0	0	0	0	113.5
429	K	42.1	Very low	37.5	Very low	190 Å²	190	141.4 Å²	141.4	83%	0.826	76%	0.762	S	S	*	*				66.8	132.7	72.6	-74.5	-171.9	174.9	-179.7	0	113.5
430	D	44.3	Very low	37.3	Very low	138 Å²	138	140 Å²	140	74%	0.738	76%	0.755	S	S	*	*			cis	-138.7	175.4	19.9	-88.9	-52.3	0	0	0	114.1
431	N	39.9	Very low	37.3	Very low	134 Å²	134	139.7 Å²	139.7	72%	0.717	75%	0.753	S	S	*	*			trans	-84.9	164	-176.9	-44.9	-74.3	0	0	0	113.6
432	H	44.7	Very low	36.9	Very low	193 Å²	193	139.4 Å²	139.4	89%	0.894	75%	0.753	S	S	*	*				-170.5	128.9	122.2	-103.4	-62.8	0	0	0	112.8
433	D	34.4	Very low	37	Very low	143 Å²	143	144.3 Å²	144.3	77%	0.765	76%	0.764	S	S	*	*			trans	-79.6	151.5	176.3	-45.2	-96.3	0	0	0	113.1
434	T	37.2	Very low	36.7	Very low	147 Å²	147	145.7 Å²	145.7	90%	0.902	77%	0.766	S	S	*	*			trans	-149.5	149.7	142.1	-46.9	0	0	0	0	109.8
435	S	36.5	Very low	36.6	Very low	92 Å²	92	145.7 Å²	145.7	64%	0.643	78%	0.775	S	S	*	*			trans	-101.3	148.6	-157.4	57.4	0	0	0	0	116.1
436	I	31.8	Very low	36.2	Very low	143 Å²	143	145 Å²	145	73%	0.733	77%	0.768	S	S	*	*			trans	46.4	120.6	132.5	-55.9	165.9	0	0	0	118
437	F	32.1	Very low	36	Very low	206 Å²	206	146.7 Å²	146.7	90%	0.904	77%	0.772	S	S	*	*			trans	-144.4	129.2	132.4	-124.8	-81.5	0	0	0	110.7
438	S	28.7	Very low	35.7	Very low	98 Å²	98	147.4 Å²	147.4	69%	0.685	77%	0.768	S	S	*	*			trans	-118.2	141.8	176.6	-58.3	0	0	0	0	109.5
439	M	34.1	Very low	35.4	Very low	170 Å²	170	149.5 Å²	149.5	84%	0.837	77%	0.774	S	S	*	*			trans	-137.8	111.8	160.7	-75.5	-151.9	72.5	0	0	109.6
440	S	32.2	Very low	35.1	Very low	90 Å²	90	147.9 Å²	147.9	63%	0.629	77%	0.774	S	S	*	*			trans	-77.7	160.4	164.2	-53	0	0	0	0	110.2
441	N	37.1	Very low	34.4	Very low	151 Å²	151	144.7 Å²	144.7	81%	0.807	77%	0.773	S	S	*	*			trans	-153	102.8	153.9	-104.2	-19.5	0	0	0	107.8
442	D	32.3	Very low	34.2	Very low	135 Å²	135	146.5 Å²	146.5	72%	0.722	78%	0.781	S	S	*	*			trans	-81.9	146.1	176.9	-56.8	-72.2	0	0	0	111
443	Y	40.2	Very low	33.4	Very low	229 Å²	229	144.6 Å²	144.6	90%	0.898	77%	0.772	S	S	*	*			trans	-138	107.9	156.1	-87.2	-71.4	0	0	0	110.4
444	H	30.8	Very low	33.4	Very low	150 Å²	150	144.2 Å²	144.2	69%	0.694	78%	0.775	S	S	*	*			trans	-72.1	147.4	172.8	-119.2	-94.8	0	0	0	111.1	E446	H444-E446 IonicContact CE1-OE1 3.96Å; H444-E446 PolarHBondContact CE1-OE1 3.04Å; H444-E446 IonicContact ND1-OE1 3.93Å
445	C	33.7	Very low	33.2	Very low	135 Å²	135	143.2 Å²	143.2	91%	0.912	76%	0.764	S	S	*	*			trans	-153.7	129.2	142.3	-107.4	0	0	0	0	108.2
446	E	28.3	Very low	33.3	Very low	133 Å²	133	144 Å²	144	62%	0.621	77%	0.768	S	S	*	*			trans	-104.6	153.7	178.7	-55.8	-177.8	149.8	0	0	110.2	H444	H444-E446 IonicContact CE1-OE1 3.96Å; H444-E446 PolarHBondContact CE1-OE1 3.04Å; H444-E446 IonicContact ND1-OE1 3.93Å
447	E	36.5	Very low	33.4	Very low	194 Å²	194	145.1 Å²	145.1	91%	0.907	77%	0.774	S	S	*	*			trans	-151.5	143.8	142.9	-127.1	170.4	-167.7	0	0	113.2
448	F	32.7	Very low	33.3	Very low	172 Å²	172	140.5 Å²	140.5	75%	0.754	77%	0.767	S	S	*	*			trans	-78.8	170.1	-175.5	-59.1	-104.9	0	0	0	110.8
449	C	34.8	Very low	33.6	Very low	97 Å²	97	145 Å²	145	66%	0.655	78%	0.777	S	S	*	*			cis	-159.2	176.6	-0.8	-132	0	0	0	0	107.1
450	N	35.3	Very low	33.3	Very low	155 Å²	155	142 Å²	142	83%	0.829	77%	0.773	S	S	*	*			cis	-127.2	-136	18.2	-58.1	-102.1	0	0	0	109.5
451	G	29.5	Very low	33.4	Very low	71 Å²	71	147 Å²	147	73%	0.732	79%	0.789	S	S	*	*			cis	97.8	137.2	13.1	0	0	0	0	0	112.8
452	I	34.8	Very low	33	Very low	172 Å²	172	145.8 Å²	145.8	88%	0.882	79%	0.787	S	S	*	*			cis	-117.5	152.2	9	-74.3	170.6	0	0	0	111.6
453	H	28.9	Very low	33.2	Very low	153 Å²	153	147.6 Å²	147.6	71%	0.708	80%	0.796	S	S	*	*			trans	-110.8	127	-175.4	163.6	-67.2	0	0	0	112.1
454	V	34.4	Very low	32.6	Very low	136 Å²	136	141.9 Å²	141.9	82%	0.824	79%	0.789	S	S	*	*			trans	-139.1	132.3	157.5	-168.4	0	0	0	0	108.2
455	N	31.8	Very low	32.8	Very low	125 Å²	125	143 Å²	143	67%	0.668	80%	0.801	S	S	*	*			trans	-129.3	-175.1	-177.9	-139.8	-6.5	0	0	0	109.2
456	P	39	Very low	32.6	Very low	110 Å²	110	141.9 Å²	141.9	71%	0.714	80%	0.795	S	S	*	*			trans	-101.5	175	-132.1	37.4	-22.9	0	0	0	113.5
457	L	33.7	Very low	32.8	Very low	165 Å²	165	143.2 Å²	143.2	86%	0.864	81%	0.805	S	S	*	*			trans	-126.8	129.2	160.6	-154.9	74.7	0	0	0	110.6
458	S	30.6	Very low	32.5	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	80%	0.8	S	S	*	*			trans	-83.4	142.1	171	52.8	0	0	0	0	110.6
459	E	34.6	Very low	32.6	Very low	193 Å²	193	140.1 Å²	140.1	90%	0.902	80%	0.8	S	S	*	*			trans	-141.9	135.8	158.2	-140.8	165.2	-131.2	0	0	110.8
460	S	29.3	Very low	32.5	Very low	108 Å²	108	141 Å²	141	76%	0.755	80%	0.802	S	S	*	*			trans	-112.7	133.9	-171.2	57.1	0	0	0	0	110.9
461	M	34.1	Very low	32.8	Very low	193 Å²	193	142.8 Å²	142.8	95%	0.951	81%	0.806	S	S	*	*			trans	-137.4	113.5	158.8	-104	-167.9	172.9	0	0	112.3
462	T	28.6	Very low	33	Very low	126 Å²	126	144.3 Å²	144.3	77%	0.773	81%	0.806	S	S	*	*			trans	-85.9	130	169.1	49.9	0	0	0	0	110.2
463	L	35.3	Very low	33.2	Very low	173 Å²	173	144.3 Å²	144.3	91%	0.906	80%	0.802	S	S	*	*			trans	-133.4	115.4	153.3	-77.3	-180	0	0	0	109.3
464	S	28.2	Very low	33.8	Very low	109 Å²	109	143 Å²	143	76%	0.762	80%	0.804	S	S	*	*			trans	-86.1	149.3	170.8	-61	0	0	0	0	109.7
465	N	35.7	Very low	34	Very low	174 Å²	174	142.2 Å²	142.2	93%	0.93	80%	0.795	S	S	*	*			trans	-143.8	116	155	-97.8	-42.3	0	0	0	109.3
466	S	29.2	Very low	34.1	Very low	112 Å²	112	147.4 Å²	147.4	78%	0.783	81%	0.806	S	S	*	*			trans	-102.1	142.6	-179.2	54.7	0	0	0	0	110.9
467	L	31.7	Very low	34.1	Very low	160 Å²	160	147.1 Å²	147.1	84%	0.838	80%	0.804	S	S	*	*			trans	-144.2	121.7	148.7	-156.9	70.2	0	0	0	111.3
468	L	30.7	Very low	34.2	Very low	152 Å²	152	146.4 Å²	146.4	80%	0.796	80%	0.801	S	S	*	*			trans	-91.7	135.3	166.5	-90	156.8	0	0	0	108.5	T470	L468-T470 HydrophobicContact CD2-CG2 4.34Å
469	I	35.5	Very low	34.4	Very low	150 Å²	150	145.3 Å²	145.3	77%	0.769	79%	0.793	S	S	*	*			trans	-132.8	128.2	149	-60.9	-176.4	0	0	0	107.2
470	T	31.4	Very low	34.4	Very low	114 Å²	114	146.9 Å²	146.9	70%	0.699	79%	0.791	S	S	*	*			trans	-115.7	134	177.2	50.4	0	0	0	0	109.1	L468	L468-T470 HydrophobicContact CD2-CG2 4.34Å
471	E	41.1	Very low	34.5	Very low	193 Å²	193	146.6 Å²	146.6	90%	0.902	79%	0.789	S	S	*	*			trans	-130.5	146.6	157.5	-70.7	-165.7	153.1	0	0	109.4
472	S	34.5	Very low	34.5	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	79%	0.785	S	S	*	*			trans	-151.4	170	-168.8	57.2	0	0	0	0	110.6
473	E	38.7	Very low	34.7	Very low	171 Å²	171	143.9 Å²	143.9	80%	0.799	79%	0.788	S	S	*	*			trans	73.2	152.3	-173.8	-45.7	-161.6	111.9	0	0	112
474	V	41	Very low	34.7	Very low	126 Å²	126	140.9 Å²	140.9	76%	0.764	78%	0.779	S	S	*	*			cis	-136.3	133.5	33.3	168.7	0	0	0	0	113.6
475	N	38.6	Very low	34.9	Very low	119 Å²	119	141.1 Å²	141.1	64%	0.636	78%	0.781	S	S	*	*			trans	18.8	116.1	147.6	-67.2	-64.1	0	0	0	119.5
476	R	34.8	Very low	34.7	Very low	235 Å²	235	141.1 Å²	141.1	89%	0.887	78%	0.775	S	S	*	*				101.7	155.9	70.6	-101.3	-161.1	156.8	-177.9	-3.3	112.7
477	P	38.8	Very low	35	Very low	103 Å²	103	142.6 Å²	142.6	67%	0.669	78%	0.779	S	S	*	*			trans	-117.4	179.4	-153	43.6	-36.1	0	0	0	114.9
478	N	36.6	Very low	34.9	Very low	150 Å²	150	142.4 Å²	142.4	80%	0.802	77%	0.774	S	S	*	*			trans	-166.3	133.1	138.4	-114.1	-43.7	0	0	0	118.4
479	S	33.5	Very low	35.4	Very low	86 Å²	86	143.8 Å²	143.8	60%	0.601	78%	0.776	S	S	*	*				59.9	131.8	129.3	-73.1	0	0	0	0	125.1
480	R	36.1	Very low	35.3	Very low	226 Å²	226	141.5 Å²	141.5	85%	0.853	77%	0.773	S	S	*	*			trans	69.7	122.8	147.2	-63.2	167.5	179.6	-175.6	-2.7	117.5
481	S	30	Very low	35.5	Very low	103 Å²	103	142.8 Å²	142.8	72%	0.72	78%	0.776	S	S	*	*			cis	77.2	100.6	39.7	83.9	0	0	0	0	115.4
482	S	35.5	Very low	35.3	Very low	125 Å²	125	143.2 Å²	143.2	87%	0.874	78%	0.778	S	S	*	*			trans	-178.9	108.4	145.6	-78.2	0	0	0	0	112.6
483	T	30.9	Very low	35.3	Very low	136 Å²	136	145.2 Å²	145.2	83%	0.834	78%	0.776	S	S	*	*			trans	-81.1	163.4	136	17.3	0	0	0	0	107.8
484	P	36.2	Very low	35.4	Very low	111 Å²	111	143.8 Å²	143.8	72%	0.721	77%	0.772	S	S	*	*			cis	-149	-166.9	39.8	39.1	-15.9	0	0	0	115.9
485	S	32.8	Very low	35.1	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	77%	0.771	S	S	*	*			trans	132.9	136.6	136	-60.2	0	0	0	0	115.2
486	Q	31.2	Very low	34.8	Very low	174 Å²	174	143.8 Å²	143.8	81%	0.813	78%	0.779	S	S	*	*			trans	-81.7	155.7	178.8	-57.4	153.4	-69.6	0	0	111.5
487	V	35.9	Very low	34.8	Very low	144 Å²	144	137.9 Å²	137.9	87%	0.873	77%	0.774	S	S	*	*			trans	-134.2	130.2	143.7	177.5	0	0	0	0	107.4
488	Q	30.1	Very low	34.5	Very low	156 Å²	156	139.6 Å²	139.6	73%	0.729	78%	0.778	S	S	*	*			trans	-88.9	163.8	173.8	-59.7	165.6	-88.9	0	0	109.8
489	H	40	Very low	34.8	Very low	180 Å²	180	141.5 Å²	141.5	83%	0.833	78%	0.781	S	S	*	*				-178.1	151.1	123.3	-101.3	-66.7	0	0	0	114.3
490	S	34.3	Very low	35	Very low	102 Å²	102	143.6 Å²	143.6	71%	0.713	79%	0.786	S	S	*	*			trans	59.3	96.7	155	52.8	0	0	0	0	119.2
491	D	35.5	Very low	34.9	Very low	142 Å²	142	139.6 Å²	139.6	76%	0.759	78%	0.781	S	S	*	*			trans	-35.1	151.9	143.3	-43.9	-104.2	0	0	0	116
492	E	35.8	Very low	35.3	Very low	202 Å²	202	143.1 Å²	143.1	94%	0.944	79%	0.792	S	S	*	*			trans	-143.5	162.5	131.1	-152.3	165.9	-155.7	0	0	109.2
493	Q	35.8	Very low	35.3	Very low	145 Å²	145	146 Å²	146	68%	0.678	79%	0.789	S	S	*	*			trans	-146.2	174.8	-150.8	-140.4	179.5	81.4	0	0	113
494	I	39.1	Very low	35.7	Very low	141 Å²	141	144.8 Å²	144.8	72%	0.723	79%	0.786	S	S	*	*			trans	78.7	143	154.8	-78.6	165.2	0	0	0	115.8
495	P	36.6	Very low	35.7	Very low	113 Å²	113	145.2 Å²	145.2	73%	0.734	78%	0.782	S	S	*	*				-138.5	-150	-79.8	34.7	-9	0	0	0	113.4
496	T	30.9	Very low	36	Very low	133 Å²	133	147 Å²	147	82%	0.816	78%	0.778	S	S	*	*			trans	-74.7	160	-179.7	48.1	0	0	0	0	115
497	S	35.2	Very low	36.4	Very low	111 Å²	111	145.4 Å²	145.4	78%	0.776	78%	0.775	S	S	*	*			trans	-137.5	123	160	-176.4	0	0	0	0	110.1
498	N	33.5	Very low	36.4	Very low	139 Å²	139	146.3 Å²	146.3	74%	0.743	77%	0.77	S	S	*	*			trans	-77.4	156.3	170.7	-70	-28.9	0	0	0	110.6
499	H	41.2	Very low	36.7	Very low	189 Å²	189	145.5 Å²	145.5	88%	0.875	77%	0.771	S	S	*	*			trans	-143.2	140.3	150.8	-126.2	-70.7	0	0	0	110.9
500	N	39.1	Very low	36.3	Very low	131 Å²	131	141.6 Å²	141.6	70%	0.701	76%	0.764	S	S	*	*			trans	-87.4	153.6	-165.6	-62.3	-45	0	0	0	113.9
501	N	33.5	Very low	36.4	Very low	142 Å²	142	143.9 Å²	143.9	76%	0.759	77%	0.767	S	S	*	*			trans	20.7	128.8	137	-52	-22.1	0	0	0	118.7
502	N	39.2	Very low	36.3	Very low	176 Å²	176	143.3 Å²	143.3	94%	0.941	77%	0.768	S	S	*	*			trans	-147.8	160.1	134.3	-108.5	-35.1	0	0	0	111.8
503	K	34.7	Very low	36.2	Very low	185 Å²	185	139.1 Å²	139.1	80%	0.804	76%	0.761	S	S	*	*			trans	-147.8	113.1	-156.3	176.9	-168.7	176.3	-172.9	0	112.1
504	S	40.1	Very low	36.1	Very low	111 Å²	111	135.3 Å²	135.3	78%	0.776	76%	0.761	S	S	*	*			trans	-163.8	121	166.1	50.3	0	0	0	0	108.2
505	N	34.8	Very low	35.9	Very low	120 Å²	120	138.2 Å²	138.2	64%	0.642	77%	0.769	S	S	*	*			cis	81.3	134.2	49.5	-87.2	40.7	0	0	0	115.9
506	E	39.2	Very low	35.5	Very low	151 Å²	151	138.9 Å²	138.9	71%	0.706	77%	0.77	S	S	*	*			trans	85.4	147.1	146.2	-73.3	151.2	-131.3	0	0	122.3
507	N	39.6	Very low	36	Very low	141 Å²	141	142.1 Å²	142.1	75%	0.754	77%	0.773	S	S	*	*			trans	72.8	104.9	175	-45.4	-62.2	0	0	0	114.7
508	E	36.2	Very low	35.6	Very low	163 Å²	163	144.6 Å²	144.6	76%	0.762	78%	0.778	S	S	*	*			cis	71.9	146.9	40.8	-55.6	-158.3	159.5	0	0	116.9
509	N	35.9	Very low	35.6	Very low	139 Å²	139	144.2 Å²	144.2	74%	0.743	78%	0.781	S	S	*	*			trans	73.5	143.5	158.8	-60	-48.8	0	0	0	116.4
510	S	33.1	Very low	35.1	Very low	98 Å²	98	140.9 Å²	140.9	69%	0.685	78%	0.778	S	S	*	*			cis	-161.2	-172.7	-2.7	-168.2	0	0	0	0	111.1
511	L	35.8	Very low	35.3	Very low	150 Å²	150	141.7 Å²	141.7	79%	0.785	78%	0.781	S	S	*	*			trans	67.6	117.3	177.9	-85.6	64	0	0	0	115.6
512	V	32.3	Very low	35.1	Very low	129 Å²	129	143.3 Å²	143.3	78%	0.782	78%	0.784	S	S	*	*			cis	80.8	133.8	11.3	-166.1	0	0	0	0	116.8
513	S	35.3	Very low	35.2	Very low	115 Å²	115	141.3 Å²	141.3	80%	0.804	78%	0.779	S	S	*	*			trans	75.7	142	-178.8	78.2	0	0	0	0	116.7
514	G	31.9	Very low	35.2	Very low	64 Å²	64	141.3 Å²	141.3	66%	0.66	78%	0.779	S	S	*	*			cis	172.3	-177.1	-7.4	0	0	0	0	0	114.4
515	F	35.4	Very low	35.2	Very low	203 Å²	203	142.1 Å²	142.1	89%	0.89	78%	0.779	S	S	*	*			trans	75.3	93.2	169.3	-60.5	-74	0	0	0	119.8
516	T	28.9	Very low	35.1	Very low	126 Å²	126	143.6 Å²	143.6	77%	0.773	79%	0.787	S	S	*	*			trans	-52.5	145.5	146.9	48.8	0	0	0	0	113.2
517	K	40.4	Very low	35.2	Very low	202 Å²	202	142.1 Å²	142.1	88%	0.878	79%	0.788	S	S	*	*			trans	-160.6	131.4	144.4	-116.4	166.5	-172.6	174.9	0	112.1
518	N	28	Very low	35.1	Very low	162 Å²	162	141.4 Å²	141.4	87%	0.866	79%	0.789	S	S	*	*			trans	-90.4	132.8	176.9	-56.6	-18	0	0	0	109.8
519	T	33.7	Very low	35.4	Very low	132 Å²	132	140.7 Å²	140.7	81%	0.81	79%	0.79	S	S	*	*			trans	-142.9	119.6	160.7	-48	0	0	0	0	109.5
520	S	30.4	Very low	35.7	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	80%	0.8	S	S	*	*			trans	-73.2	138.4	175.9	-48.3	0	0	0	0	111.4
521	I	42.1	Very low	36.6	Very low	149 Å²	149	147.1 Å²	147.1	76%	0.764	81%	0.808	S	S	*	*			trans	-133.5	119.6	159.5	-61.2	-177.5	0	0	0	107.8
522	E	31	Very low	37.6	Very low	175 Å²	175	147.6 Å²	147.6	82%	0.818	81%	0.81	S	S	*	*			trans	-77.5	129.7	170.2	-61.5	-179.2	111.1	0	0	110.2
523	T	40.1	Very low	38.6	Very low	134 Å²	134	150.9 Å²	150.9	82%	0.822	81%	0.814	S	S	*	*			trans	-133.6	120.9	155	42	0	0	0	0	109.4
524	K	34.2	Very low	39.8	Very low	186 Å²	186	149.1 Å²	149.1	81%	0.809	80%	0.8	S	S	*	*			trans	-80.7	139.4	177.9	-60.9	167	-179.2	170.3	0	109.5
525	T	40.5	Very low	41.7	Very low	127 Å²	127	155.3 Å²	155.3	78%	0.779	80%	0.803	S	S	*	*			trans	-178.3	100.7	137.8	17.8	0	0	0	0	112.1
526	D	33.2	Very low	43.6	Very low	152 Å²	152	151.8 Å²	151.8	81%	0.813	79%	0.792	S	S	*	*			trans	55.5	173.4	137	-55.2	-46.2	0	0	0	123.7
527	V	41.1	Very low	46	Very low	119 Å²	119	149 Å²	149	72%	0.721	78%	0.778	S	S	*	*			trans	77.5	69.4	169.9	-160	0	0	0	0	117.8
528	T	38	Very low	47.8	Very low	126 Å²	126	142.6 Å²	142.6	77%	0.773	75%	0.753	S	S	*	*			trans	35.1	111.4	131.1	60.4	0	0	0	0	119.9
529	N	41.3	Very low	50.3	Low	149 Å²	149	140 Å²	140	80%	0.797	74%	0.736	S	S	*	*			trans	-150.3	47.4	165	-106.3	-45.6	0	0	0	115.5	K531	N529-K531 VanDerWaalsContact C-N 3.31Å; N529-K531 PolarHBondContact O-N 3.38Å
530	D	43.6	Very low	52.8	Low	176 Å²	176	138 Å²	138	94%	0.941	72%	0.72	S	S	*	*			trans	-88.9	26.2	-174.9	-122.9	-15.4	0	0	0	114.6
531	K	51.6	Low	55.4	Low	196 Å²	196	136.2 Å²	136.2	85%	0.852	70%	0.701	S	S	*	*			trans	-114.5	4.5	-159.5	-95.3	-174	172.3	-177.2	0	117.6	N529	N529-K531 VanDerWaalsContact C-N 3.31Å; N529-K531 PolarHBondContact O-N 3.38Å
532	L	56	Low	57.5	Low	160 Å²	160	134.2 Å²	134.2	84%	0.838	69%	0.691	S	S	*	*			trans	-118.8	14.1	-167.8	-85.4	165	0	0	0	116.5
533	K	54	Low	60.2	Low	197 Å²	197	131 Å²	131	86%	0.857	68%	0.679	S	S	*	*	S	Bend	trans	-96.1	115.4	161.5	-94.3	178.1	175	172	0	109.3
534	P	59.8	Low	62.5	Low	78 Å²	78	128.5 Å²	128.5	51%	0.506	66%	0.66	S	S	.	*			trans	-59.2	141.2	166.6	27.4	-33.6	0	0	0	108.4
535	R	72.6	Confident	65	Low	194 Å²	194	124.8 Å²	124.8	73%	0.732	65%	0.649	S	S	*	*			trans	-69	151.2	173.2	-71.1	-179.4	164	-168.7	-4.9	108.4	S537 D538 Q539	R535-S537 PolarHBondContact O-N 3.47Å; R535-S537 VanDerWaalsContact O-N 3.11Å; R535-D538 WeakPolarHBondContact CB-OD2 3.43Å; R535-D538 PolarHBondContact N-OD2 3.31Å; R535-D538 WeakPolarHBondContact O-CB 3.47Å; R535-D538 PolarHBondContact O-N 2.95Å; R535-Q539 PolarHBondContact O-N 3.04Å
536	I	76.2	Confident	67.4	Low	130 Å²	130	123.8 Å²	123.8	67%	0.667	64%	0.639	S	S	*	*	H	α-helix	trans	-56.4	-29	171.8	-63.2	168.1	0	0	0	110.4	D538 I540	I536-D538 VanDerWaalsContact C-N 3.33Å; I536-D538 PolarHBondContact O-N 3.11Å; I536-I540 HydrophobicContact CG2-CD1 3.83Å; I536-I540 HydrophobicContact CG2-CG1 4.43Å; I536-I540 WeakPolarHBondContact O-CB 3.44Å; I536-I540 WeakPolarHBondContact O-CD1 3.44Å; I536-I540 VanDerWaalsContact O-CG1 3.22Å; I536-I540 WeakPolarHBondContact O-CG1 3.42Å; I536-I540 PolarHBondContact O-N 3.03Å
537	S	77.3	Confident	70	Confident	66 Å²	66	120.8 Å²	120.8	46%	0.462	62%	0.622	S	S	.	*	H	α-helix	trans	-62.3	-35.3	172.2	-164.7	0	0	0	0	113.9	R535 I540 N541	R535-S537 PolarHBondContact O-N 3.47Å; R535-S537 VanDerWaalsContact O-N 3.11Å; S537-I540 PolarHBondContact O-N 3.42Å; S537-N541 PolarHBondContact O-N 3.42Å; S537-N541 PolarHBondContact O-ND2 3.4Å; S537-N541 PolarHBondContact O-OD1 2.94Å
538	D	78.5	Confident	72.1	Confident	68 Å²	68	119.3 Å²	119.3	36%	0.364	61%	0.61	S	S	.	*	H	α-helix	trans	-72.6	-46.6	-176.6	-46.8	-29	0	0	0	108.5	R535 I536 I540 N541 D542	R535-D538 WeakPolarHBondContact CB-OD2 3.43Å; R535-D538 PolarHBondContact N-OD2 3.31Å; R535-D538 WeakPolarHBondContact O-CB 3.47Å; R535-D538 PolarHBondContact O-N 2.95Å; I536-D538 VanDerWaalsContact C-N 3.33Å; I536-D538 PolarHBondContact O-N 3.11Å; D538-I540 VanDerWaalsContact C-N 3.25Å; D538-I540 PolarHBondContact O-N 3.17Å; D538-N541 WeakPolarHBondContact O-CB 3.5Å; D538-N541 PolarHBondContact O-N 3.11Å; D538-D542 PolarHBondContact O-N 3.45Å
539	Q	81.9	Confident	74.3	Confident	109 Å²	109	119.3 Å²	119.3	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-61.6	-29.4	173.8	-62.7	-179.6	-23.7	0	0	113.7	R535 L543	R535-Q539 PolarHBondContact O-N 3.04Å; Q539-L543 WeakPolarHBondContact O-CB 3.49Å; Q539-L543 PolarHBondContact O-N 3.4Å
540	I	85.1	Confident	76.3	Confident	90 Å²	90	116 Å²	116	46%	0.462	58%	0.584	S	S	.	*	H	α-helix	trans	-74.2	-38.2	173.2	-74.7	168.2	0	0	0	110.8	I536 S537 D538 L544	I536-I540 HydrophobicContact CG2-CD1 3.83Å; I536-I540 HydrophobicContact CG2-CG1 4.43Å; I536-I540 WeakPolarHBondContact O-CB 3.44Å; I536-I540 WeakPolarHBondContact O-CD1 3.44Å; I536-I540 VanDerWaalsContact O-CG1 3.22Å; I536-I540 WeakPolarHBondContact O-CG1 3.42Å; I536-I540 PolarHBondContact O-N 3.03Å; S537-I540 PolarHBondContact O-N 3.42Å; D538-I540 VanDerWaalsContact C-N 3.25Å; D538-I540 PolarHBondContact O-N 3.17Å; I540-L544 HydrophobicContact CG2-CD1 3.93Å; I540-L544 HydrophobicContact CG2-CG 4.47Å; I540-L544 WeakPolarHBondContact O-CB 3.29Å; I540-L544 VanDerWaalsContact O-CG 3.25Å; I540-L544 WeakPolarHBondContact O-CG 3.3Å; I540-L544 PolarHBondContact O-N 3.25Å
541	N	85.4	Confident	78	Confident	80 Å²	80	110.6 Å²	110.6	43%	0.428	56%	0.561	S	S	.	*	H	α-helix	trans	-66.5	-48.5	176.8	-67.1	-20.1	0	0	0	111.1	S537 D538 L543 L544 D545	S537-N541 PolarHBondContact O-N 3.42Å; S537-N541 PolarHBondContact O-ND2 3.4Å; S537-N541 PolarHBondContact O-OD1 2.94Å; D538-N541 WeakPolarHBondContact O-CB 3.5Å; D538-N541 PolarHBondContact O-N 3.11Å; N541-L543 VanDerWaalsContact C-N 3.25Å; N541-L543 PolarHBondContact O-N 3.41Å; N541-L544 PolarHBondContact O-N 2.89Å; N541-D545 PolarHBondContact O-N 2.92Å
542	D	85.9	Confident	79.2	Confident	107 Å²	107	104.8 Å²	104.8	57%	0.572	54%	0.544	S	S	*	.	H	α-helix	trans	-52.9	-45.6	176.1	-63	-25.4	0	0	0	111.1	D538 D545 D546	D538-D542 PolarHBondContact O-N 3.45Å; D542-D545 PolarHBondContact O-N 2.89Å; D542-D546 PolarHBondContact O-N 3.24Å
543	L	88.7	Confident	80.2	Confident	107 Å²	107	100.2 Å²	100.2	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-72.7	-26.7	-179.4	-172	140.4	0	0	0	113.4	Q539 N541 I547	Q539-L543 WeakPolarHBondContact O-CB 3.49Å; Q539-L543 PolarHBondContact O-N 3.4Å; N541-L543 VanDerWaalsContact C-N 3.25Å; N541-L543 PolarHBondContact O-N 3.41Å; L543-I547 HydrophobicContact CD2-CD1 3.71Å; L543-I547 WeakPolarHBondContact O-CD1 3.5Å; L543-I547 VanDerWaalsContact O-CG1 3.22Å; L543-I547 WeakPolarHBondContact O-CG1 3.37Å; L543-I547 PolarHBondContact O-N 3.29Å
544	L	88.1	Confident	81.3	Confident	82 Å²	82	96 Å²	96	43%	0.429	51%	0.507	S	S	.	.	H	α-helix	trans	-73.4	-38.1	170.6	-75.8	168.3	0	0	0	111.5	I540 N541 I547 N548	I540-L544 HydrophobicContact CG2-CD1 3.93Å; I540-L544 HydrophobicContact CG2-CG 4.47Å; I540-L544 WeakPolarHBondContact O-CB 3.29Å; I540-L544 VanDerWaalsContact O-CG 3.25Å; I540-L544 WeakPolarHBondContact O-CG 3.3Å; I540-L544 PolarHBondContact O-N 3.25Å; N541-L544 PolarHBondContact O-N 2.89Å; L544-I547 PolarHBondContact O-N 2.86Å; L544-N548 WeakPolarHBondContact O-CB 3.45Å; L544-N548 VanDerWaalsContact O-CG 3.22Å; L544-N548 PolarHBondContact O-N 2.76Å; L544-N548 PolarHBondContact O-ND2 3.06Å; L544-N548 VanDerWaalsContact O-ND2 3.07Å
545	D	87.2	Confident	82	Confident	107 Å²	107	101.9 Å²	101.9	57%	0.572	52%	0.519	S	S	*	.	H	α-helix	trans	-68.9	-38.3	176.2	-77.9	-16.3	0	0	0	111.9	N541 D542 N548 F549	N541-D545 PolarHBondContact O-N 2.92Å; D542-D545 PolarHBondContact O-N 2.89Å; D545-N548 PolarHBondContact O-N 2.87Å; D545-F549 WeakPolarHBondContact O-CB 3.47Å; D545-F549 PolarHBondContact O-N 3.36Å
546	D	89.5	Confident	82.1	Confident	107 Å²	107	98.1 Å²	98.1	57%	0.572	51%	0.512	S	S	*	.	H	α-helix	trans	-58.6	-45.4	168.5	-88.7	-17.8	0	0	0	111.9	D542 F549 V550	D542-D546 PolarHBondContact O-N 3.24Å; D546-F549 PolarHBondContact O-N 3.25Å; D546-V550 WeakPolarHBondContact O-CG2 3.38Å; D546-V550 PolarHBondContact O-N 3.44Å
547	I	87.8	Confident	81.5	Confident	88 Å²	88	100.3 Å²	100.3	45%	0.451	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-40.7	177	-73.4	168	0	0	0	111.3	L543 L544 S551	L543-I547 HydrophobicContact CD2-CD1 3.71Å; L543-I547 WeakPolarHBondContact O-CD1 3.5Å; L543-I547 VanDerWaalsContact O-CG1 3.22Å; L543-I547 WeakPolarHBondContact O-CG1 3.37Å; L543-I547 PolarHBondContact O-N 3.29Å; L544-I547 PolarHBondContact O-N 2.86Å; I547-S551 VanDerWaalsContact O-CB 3.27Å; I547-S551 WeakPolarHBondContact O-CB 3.5Å; I547-S551 PolarHBondContact O-N 3.2Å; I547-S551 PolarHBondContact O-OG 2.9Å
548	N	84.6	Confident	80.7	Confident	88 Å²	88	100.1 Å²	100.1	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-64.6	-42.2	175.6	-73.9	-38.3	0	0	0	111.2	L544 D545 S551 C552	L544-N548 WeakPolarHBondContact O-CB 3.45Å; L544-N548 VanDerWaalsContact O-CG 3.22Å; L544-N548 PolarHBondContact O-N 2.76Å; L544-N548 PolarHBondContact O-ND2 3.06Å; L544-N548 VanDerWaalsContact O-ND2 3.07Å; D545-N548 PolarHBondContact O-N 2.87Å; N548-S551 PolarHBondContact O-N 2.86Å; N548-C552 PolarHBondContact O-N 2.67Å; N548-C552 PolarHBondContact O-SG 3.02Å; N548-C552 VanDerWaalsContact O-SG 3.37Å
549	F	85.9	Confident	79.7	Confident	127 Å²	127	101.5 Å²	101.5	56%	0.557	52%	0.52	S	S	*	.	H	α-helix	trans	-63.1	-48.2	177.2	177.3	-109.8	0	0	0	111.9	D545 D546 S551 C552 L553	D545-F549 WeakPolarHBondContact O-CB 3.47Å; D545-F549 PolarHBondContact O-N 3.36Å; D546-F549 PolarHBondContact O-N 3.25Å; F549-S551 VanDerWaalsContact C-N 3.34Å; F549-S551 PolarHBondContact O-N 3.43Å; F549-C552 WeakPolarHBondContact O-CB 3.39Å; F549-C552 PolarHBondContact O-N 2.88Å; F549-C552 VanDerWaalsContact O-N 3.15Å; F549-L553 HydrophobicContact CD1-CD1 4.22Å; F549-L553 HydrophobicContact CE1-CD1 3.7Å; F549-L553 HydrophobicContact CE1-CG 4.39Å; F549-L553 HydrophobicContact CZ-CD1 3.95Å; F549-L553 HydrophobicContact CZ-CD2 4.4Å; F549-L553 HydrophobicContact CZ-CG 4.32Å; F549-L553 PolarHBondContact O-N 3.42Å
550	V	82.7	Confident	78.3	Confident	78 Å²	78	103.2 Å²	103.2	47%	0.473	53%	0.527	S	S	.	.	H	α-helix	trans	-61.2	-42.5	174.4	172.9	0	0	0	0	111.1	D546 C552 L553 D554	D546-V550 WeakPolarHBondContact O-CG2 3.38Å; D546-V550 PolarHBondContact O-N 3.44Å; V550-C552 VanDerWaalsContact C-N 3.27Å; V550-C552 PolarHBondContact O-N 3.4Å; V550-L553 WeakPolarHBondContact O-CB 3.33Å; V550-L553 PolarHBondContact O-N 3.2Å; V550-L553 VanDerWaalsContact O-N 3.09Å; V550-D554 PolarHBondContact O-N 3.44Å
551	S	79.5	Confident	76.8	Confident	64 Å²	64	102.4 Å²	102.4	45%	0.448	52%	0.523	S	S	.	.	H	α-helix	trans	-62.8	-32.1	175.7	-59.1	0	0	0	0	112.8	I547 N548 F549 R555	I547-S551 VanDerWaalsContact O-CB 3.27Å; I547-S551 WeakPolarHBondContact O-CB 3.5Å; I547-S551 PolarHBondContact O-N 3.2Å; I547-S551 PolarHBondContact O-OG 2.9Å; N548-S551 PolarHBondContact O-N 2.86Å; F549-S551 VanDerWaalsContact C-N 3.34Å; F549-S551 PolarHBondContact O-N 3.43Å; S551-R555 WeakPolarHBondContact O-CB 3.34Å; S551-R555 PolarHBondContact O-N 3.36Å
552	C	77.4	Confident	75.1	Confident	73 Å²	73	106.1 Å²	106.1	49%	0.493	53%	0.531	S	S	.	.	H	α-helix	trans	-71.1	-39.7	171.4	-75.2	0	0	0	0	112.2	N548 F549 V550 R555 I556	N548-C552 PolarHBondContact O-N 2.67Å; N548-C552 PolarHBondContact O-SG 3.02Å; N548-C552 VanDerWaalsContact O-SG 3.37Å; F549-C552 WeakPolarHBondContact O-CB 3.39Å; F549-C552 PolarHBondContact O-N 2.88Å; F549-C552 VanDerWaalsContact O-N 3.15Å; V550-C552 VanDerWaalsContact C-N 3.27Å; V550-C552 PolarHBondContact O-N 3.4Å; C552-R555 PolarHBondContact O-N 3.41Å; C552-I556 WeakPolarHBondContact O-CD1 3.41Å; C552-I556 VanDerWaalsContact O-CG1 3.29Å; C552-I556 WeakPolarHBondContact O-CG1 3.39Å; C552-I556 PolarHBondContact O-N 2.94Å
553	L	76.9	Confident	73.3	Confident	64 Å²	64	104.5 Å²	104.5	34%	0.335	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-48.1	173.9	-66.7	178.1	0	0	0	111.6	F549 V550 R555 I556 Y557	F549-L553 HydrophobicContact CD1-CD1 4.22Å; F549-L553 HydrophobicContact CE1-CD1 3.7Å; F549-L553 HydrophobicContact CE1-CG 4.39Å; F549-L553 HydrophobicContact CZ-CD1 3.95Å; F549-L553 HydrophobicContact CZ-CD2 4.4Å; F549-L553 HydrophobicContact CZ-CG 4.32Å; F549-L553 PolarHBondContact O-N 3.42Å; V550-L553 WeakPolarHBondContact O-CB 3.33Å; V550-L553 PolarHBondContact O-N 3.2Å; V550-L553 VanDerWaalsContact O-N 3.09Å; L553-R555 PolarHBondContact O-N 3.49Å; L553-R555 VanDerWaalsContact O-N 3.14Å; L553-I556 PolarHBondContact O-N 3.04Å; L553-Y557 HydrophobicContact CD2-CD2 4.49Å; L553-Y557 HydrophobicContact CD2-CE2 4.22Å; L553-Y557 WeakPolarHBondContact O-CB 3.38Å; L553-Y557 WeakPolarHBondContact O-CD2 3.27Å; L553-Y557 PolarHBondContact O-N 2.96Å
554	D	75.6	Confident	71.6	Confident	108 Å²	108	107 Å²	107	58%	0.578	54%	0.537	S	S	*	.	H	α-helix	trans	-61.1	-23.1	176.5	-86.8	-4.5	0	0	0	113.2	V550 N558	V550-D554 PolarHBondContact O-N 3.44Å; D554-N558 VanDerWaalsContact O-CB 3.25Å; D554-N558 WeakPolarHBondContact O-CB 3.46Å; D554-N558 PolarHBondContact O-N 3.18Å; D554-N558 PolarHBondContact O-ND2 3.28Å
555	R	75.2	Confident	69.6	Low	202 Å²	202	109.5 Å²	109.5	76%	0.762	54%	0.542	S	S	*	.	H	α-helix	trans	-84.8	-27.6	175	-159.8	175.6	-166.3	175.8	4.8	113.1	S551 C552 L553 I561	S551-R555 WeakPolarHBondContact O-CB 3.34Å; S551-R555 PolarHBondContact O-N 3.36Å; C552-R555 PolarHBondContact O-N 3.41Å; L553-R555 PolarHBondContact O-N 3.49Å; L553-R555 VanDerWaalsContact O-N 3.14Å; R555-I561 VanDerWaalsContact O-CD1 3.23Å; R555-I561 WeakPolarHBondContact O-CD1 3.26Å
556	I	73.9	Confident	67.7	Low	115 Å²	115	109.3 Å²	109.3	59%	0.59	54%	0.538	S	S	*	.	H	α-helix	trans	-82.8	-44.1	175.8	-69.9	163.7	0	0	0	110.9	C552 L553 N558	C552-I556 WeakPolarHBondContact O-CD1 3.41Å; C552-I556 VanDerWaalsContact O-CG1 3.29Å; C552-I556 WeakPolarHBondContact O-CG1 3.39Å; C552-I556 PolarHBondContact O-N 2.94Å; L553-I556 PolarHBondContact O-N 3.04Å; I556-N558 VanDerWaalsContact C-N 3.32Å; I556-N558 PolarHBondContact O-N 3.18Å
557	Y	64.2	Low	65.7	Low	176 Å²	176	110.8 Å²	110.8	69%	0.69	55%	0.545	S	S	*	.	S	Bend	trans	-90.3	9.8	-177.1	-74	-84.7	0	0	0	113.7	L553	L553-Y557 HydrophobicContact CD2-CD2 4.49Å; L553-Y557 HydrophobicContact CD2-CE2 4.22Å; L553-Y557 WeakPolarHBondContact O-CB 3.38Å; L553-Y557 WeakPolarHBondContact O-CD2 3.27Å; L553-Y557 PolarHBondContact O-N 2.96Å
558	N	61.7	Low	63.8	Low	63 Å²	63	111.5 Å²	111.5	34%	0.337	55%	0.55	S	S	.	.			trans	-60.5	128.1	-174.4	-153.1	-83.2	0	0	0	111.9	D554 I556 H560 I561	D554-N558 VanDerWaalsContact O-CB 3.25Å; D554-N558 WeakPolarHBondContact O-CB 3.46Å; D554-N558 PolarHBondContact O-N 3.18Å; D554-N558 PolarHBondContact O-ND2 3.28Å; I556-N558 VanDerWaalsContact C-N 3.32Å; I556-N558 PolarHBondContact O-N 3.18Å; N558-H560 PolarHBondContact O-N 2.84Å; N558-H560 VanDerWaalsContact O-N 3.09Å; N558-H560 PolarHBondContact OD1-N 2.89Å; N558-I561 HydrophobicContact CB-CD1 4.41Å; N558-I561 HydrophobicContact CB-CG1 4.42Å; N558-I561 WeakPolarHBondContact O-CB 3.28Å; N558-I561 PolarHBondContact O-N 3Å
559	P	57	Low	62.2	Low	96 Å²	96	112.3 Å²	112.3	62%	0.623	55%	0.553	S	S	*	*	H	α-helix	trans	-61.5	-23.7	-175.7	22.2	-32.8	0	0	0	113.8	I561 R562 S563	P559-I561 VanDerWaalsContact C-N 3.3Å; P559-I561 PolarHBondContact O-N 3.02Å; P559-R562 WeakPolarHBondContact O-CB 3.29Å; P559-R562 PolarHBondContact O-N 3.28Å; P559-S563 PolarHBondContact O-N 2.83Å
560	H	52.4	Low	60.2	Low	145 Å²	145	113 Å²	113	67%	0.671	56%	0.563	S	S	*	*	H	α-helix	trans	-63.2	-32.8	172.4	-79.9	-47.1	0	0	0	113.5	N558 S563 Q564	N558-H560 PolarHBondContact O-N 2.84Å; N558-H560 VanDerWaalsContact O-N 3.09Å; N558-H560 PolarHBondContact OD1-N 2.89Å; H560-S563 PolarHBondContact O-N 3.42Å; H560-S563 PolarHBondContact O-OG 3.08Å; H560-Q564 PolarHBondContact O-N 3.07Å
561	I	52.6	Low	58.5	Low	74 Å²	74	115.4 Å²	115.4	38%	0.379	57%	0.572	S	S	.	*	H	α-helix	trans	-66.3	-45.7	173.4	-61.1	176.9	0	0	0	109.2	R555 N558 P559 S563 Q564 Y565	R555-I561 VanDerWaalsContact O-CD1 3.23Å; R555-I561 WeakPolarHBondContact O-CD1 3.26Å; N558-I561 HydrophobicContact CB-CD1 4.41Å; N558-I561 HydrophobicContact CB-CG1 4.42Å; N558-I561 WeakPolarHBondContact O-CB 3.28Å; N558-I561 PolarHBondContact O-N 3Å; P559-I561 VanDerWaalsContact C-N 3.3Å; P559-I561 PolarHBondContact O-N 3.02Å; I561-S563 VanDerWaalsContact C-N 3.27Å; I561-S563 PolarHBondContact O-N 3.28Å; I561-Q564 PolarHBondContact O-N 3.13Å; I561-Y565 HydrophobicContact CG2-CD2 3.9Å; I561-Y565 HydrophobicContact CG2-CE2 3.98Å; I561-Y565 WeakPolarHBondContact O-CD2 3.42Å; I561-Y565 PolarHBondContact O-N 3.21Å
562	R	49.3	Very low	56.7	Low	158 Å²	158	118.1 Å²	118.1	60%	0.596	58%	0.581	S	S	*	*	H	α-helix	trans	-54.6	-43.6	177.7	-160.2	173.9	-173.4	170.8	1.3	111.5	P559 Q564 Y565 Q566	P559-R562 WeakPolarHBondContact O-CB 3.29Å; P559-R562 PolarHBondContact O-N 3.28Å; R562-Q564 VanDerWaalsContact C-N 3.25Å; R562-Q564 PolarHBondContact O-N 3.05Å; R562-Y565 PolarHBondContact O-N 3.42Å; R562-Y565 VanDerWaalsContact O-N 3.1Å; R562-Q566 PolarHBondContact O-N 3.23Å; R562-Q566 PolarHBondContact O-OE1 3.31Å
563	S	49.7	Very low	55	Low	73 Å²	73	124.1 Å²	124.1	51%	0.51	60%	0.595	S	S	.	*	H	α-helix	trans	-64.1	-20.1	177.9	69.2	0	0	0	0	115.5	P559 H560 I561	P559-S563 PolarHBondContact O-N 2.83Å; H560-S563 PolarHBondContact O-N 3.42Å; H560-S563 PolarHBondContact O-OG 3.08Å; I561-S563 VanDerWaalsContact C-N 3.27Å; I561-S563 PolarHBondContact O-N 3.28Å
564	Q	51.6	Low	54	Low	159 Å²	159	128.3 Å²	128.3	74%	0.743	61%	0.611	S	S	*	*	H	α-helix	trans	-92.3	-9.3	174.5	-72.8	-168	-23.9	0	0	114.1	H560 I561 R562	H560-Q564 PolarHBondContact O-N 3.07Å; I561-Q564 PolarHBondContact O-N 3.13Å; R562-Q564 VanDerWaalsContact C-N 3.25Å; R562-Q564 PolarHBondContact O-N 3.05Å
565	Y	46.2	Very low	52.9	Low	134 Å²	134	126.4 Å²	126.4	53%	0.525	60%	0.604	S	S	.	*	S	Bend	trans	-113.1	9.8	177.4	-72.5	-77.1	0	0	0	113.2	I561 R562 D567 L568 I569	I561-Y565 HydrophobicContact CG2-CD2 3.9Å; I561-Y565 HydrophobicContact CG2-CE2 3.98Å; I561-Y565 WeakPolarHBondContact O-CD2 3.42Å; I561-Y565 PolarHBondContact O-N 3.21Å; R562-Y565 PolarHBondContact O-N 3.42Å; R562-Y565 VanDerWaalsContact O-N 3.1Å; Y565-D567 PolarHBondContact O-N 3.19Å; Y565-L568 HydrophobicContact CD1-CD1 4.15Å; Y565-L568 HydrophobicContact CD1-CD2 4.08Å; Y565-L568 HydrophobicContact CD1-CG 4.49Å; Y565-L568 HydrophobicContact CE1-CD2 4.46Å; Y565-L568 PolarHBondContact O-N 2.88Å; Y565-I569 PolarHBondContact O-N 3.27Å
566	Q	47.5	Very low	51.9	Low	104 Å²	104	120.3 Å²	120.3	49%	0.486	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-58.7	-34.1	-179.1	-149.6	74.2	17.5	0	0	112.4	R562 L568 I569	R562-Q566 PolarHBondContact O-N 3.23Å; R562-Q566 PolarHBondContact O-OE1 3.31Å; Q566-L568 VanDerWaalsContact C-N 3.32Å; Q566-L568 PolarHBondContact O-N 2.92Å; Q566-I569 PolarHBondContact O-N 3.18Å
567	D	48.5	Very low	51.1	Low	137 Å²	137	123.1 Å²	123.1	73%	0.733	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-72	-21	176.1	-63.1	-35.3	0	0	0	113.7	Y565	Y565-D567 PolarHBondContact O-N 3.19Å
568	L	47.2	Very low	50.8	Low	103 Å²	103	123 Å²	123	54%	0.539	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-85.6	-15.1	175.9	-82.2	80	0	0	0	112.8	Y565 Q566 N570 L571	Y565-L568 HydrophobicContact CD1-CD1 4.15Å; Y565-L568 HydrophobicContact CD1-CD2 4.08Å; Y565-L568 HydrophobicContact CD1-CG 4.49Å; Y565-L568 HydrophobicContact CE1-CD2 4.46Å; Y565-L568 PolarHBondContact O-N 2.88Å; Q566-L568 VanDerWaalsContact C-N 3.32Å; Q566-L568 PolarHBondContact O-N 2.92Å; L568-N570 PolarHBondContact O-N 2.83Å; L568-L571 PolarHBondContact O-N 2.88Å
569	I	50.3	Low	51.1	Low	105 Å²	105	127.2 Å²	127.2	54%	0.538	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71	-21.2	178.1	-66.2	172.6	0	0	0	111.5	Y565 Q566	Y565-I569 PolarHBondContact O-N 3.27Å; Q566-I569 PolarHBondContact O-N 3.18Å
570	N	45.9	Very low	51.9	Low	143 Å²	143	127.3 Å²	127.3	77%	0.765	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	1.1	174.8	-70.5	-30.3	0	0	0	114.1	L568	L568-N570 PolarHBondContact O-N 2.83Å
571	L	46.5	Very low	53	Low	128 Å²	128	127 Å²	127	67%	0.67	61%	0.609	S	S	*	*	S	Bend	trans	-95	105.4	167	-101	70.7	0	0	0	109.5	L568 Y573	L568-L571 PolarHBondContact O-N 2.88Å; L571-Y573 VanDerWaalsContact C-N 3.31Å; L571-Y573 PolarHBondContact O-N 3.46Å
572	D	41.8	Very low	54	Low	120 Å²	120	130.7 Å²	130.7	64%	0.642	62%	0.619	S	S	*	*			trans	-8.5	69.2	164.2	-160.7	21.7	0	0	0	116.5	K574	D572-K574 PolarHBondContact O-N 3.39Å; D572-K574 WeakPolarHBondContact OD1-CE 3.18Å; D572-K574 IonicContact OD1-NZ 3.1Å; D572-K574 PolarHBondContact OD1-NZ 2.95Å; D572-K574 WeakPolarHBondContact OD2-CD 3.5Å; D572-K574 VanDerWaalsContact OD2-CE 3.24Å; D572-K574 WeakPolarHBondContact OD2-CE 3.31Å; D572-K574 IonicContact OD2-NZ 3Å; D572-K574 PolarHBondContact OD2-NZ 2.85Å
573	Y	41.7	Very low	55.4	Low	200 Å²	200	129 Å²	129	78%	0.784	62%	0.618	S	S	*	*			trans	-78.7	58.5	-174.4	-160.6	-93.4	0	0	0	111.2	L571 P575	L571-Y573 VanDerWaalsContact C-N 3.31Å; L571-Y573 PolarHBondContact O-N 3.46Å; Y573-P575 WeakPolarHBondContact O-CD 3.26Å
574	K	54.4	Low	57	Low	152 Å²	152	128.9 Å²	128.9	66%	0.661	61%	0.614	S	S	*	*			trans	-57.5	118.4	174.4	-79.9	164.9	175.7	154.4	0	108.3	D572 A576	D572-K574 PolarHBondContact O-N 3.39Å; D572-K574 WeakPolarHBondContact OD1-CE 3.18Å; D572-K574 IonicContact OD1-NZ 3.1Å; D572-K574 PolarHBondContact OD1-NZ 2.95Å; D572-K574 WeakPolarHBondContact OD2-CD 3.5Å; D572-K574 VanDerWaalsContact OD2-CE 3.24Å; D572-K574 WeakPolarHBondContact OD2-CE 3.31Å; D572-K574 IonicContact OD2-NZ 3Å; D572-K574 PolarHBondContact OD2-NZ 2.85Å; K574-A576 PolarHBondContact O-N 3.37Å
575	P	52.4	Low	58.5	Low	67 Å²	67	126.8 Å²	126.8	44%	0.435	60%	0.603	S	S	.	*			trans	-70.8	108.8	-165.1	24.9	-33.6	0	0	0	110.5	Y573 Y577 R578	Y573-P575 WeakPolarHBondContact O-CD 3.26Å; P575-Y577 PolarHBondContact O-N 2.88Å; P575-R578 HydrophobicContact CG-CB 4.33Å; P575-R578 HydrophobicContact CG-CG 4.44Å; P575-R578 PolarHBondContact O-N 3.34Å
576	A	55.5	Low	60.2	Low	74 Å²	74	124 Å²	124	61%	0.612	60%	0.597	S	S	*	*	H	α-helix	trans	-51.7	-28.4	167.4	0	0	0	0	0	111.5	K574 R578 Q579 L580	K574-A576 PolarHBondContact O-N 3.37Å; A576-R578 VanDerWaalsContact C-N 3.31Å; A576-R578 PolarHBondContact O-N 2.88Å; A576-Q579 VanDerWaalsContact O-CB 3.29Å; A576-Q579 WeakPolarHBondContact O-CB 3.33Å; A576-Q579 PolarHBondContact O-N 2.88Å; A576-Q579 VanDerWaalsContact O-N 3.1Å; A576-L580 WeakPolarHBondContact O-CB 3.5Å; A576-L580 PolarHBondContact O-N 2.91Å
577	Y	56	Low	61.9	Low	174 Å²	174	125 Å²	125	68%	0.682	60%	0.603	S	S	*	*	H	α-helix	trans	-54.7	-34.3	169.4	-73.6	-79.7	0	0	0	114.8	P575 F581	P575-Y577 PolarHBondContact O-N 2.88Å; Y577-F581 WeakPolarHBondContact O-CB 3.5Å; Y577-F581 PolarHBondContact O-N 3.5Å
578	R	59.3	Low	63.6	Low	175 Å²	175	124.2 Å²	124.2	66%	0.66	60%	0.598	S	S	*	*	H	α-helix	trans	-66.3	-45.5	172.5	-103.9	-168.5	178.2	-161.1	2.2	110.8	P575 A576 F581 Y582	P575-R578 HydrophobicContact CG-CB 4.33Å; P575-R578 HydrophobicContact CG-CG 4.44Å; P575-R578 PolarHBondContact O-N 3.34Å; A576-R578 VanDerWaalsContact C-N 3.31Å; A576-R578 PolarHBondContact O-N 2.88Å; R578-F581 PolarHBondContact O-N 3.45Å; R578-Y582 VanDerWaalsContact O-CD2 3.28Å; R578-Y582 WeakPolarHBondContact O-CD2 3.47Å; R578-Y582 PolarHBondContact O-N 3.43Å
579	Q	67.6	Low	65.2	Low	150 Å²	150	124.6 Å²	124.6	70%	0.701	60%	0.596	S	S	*	*	H	α-helix	trans	-57.4	-52	176.2	-140.4	84.2	1.1	0	0	110.2	A576 F581 Y582 E583	A576-Q579 VanDerWaalsContact O-CB 3.29Å; A576-Q579 WeakPolarHBondContact O-CB 3.33Å; A576-Q579 PolarHBondContact O-N 2.88Å; A576-Q579 VanDerWaalsContact O-N 3.1Å; Q579-F581 VanDerWaalsContact C-N 3.35Å; Q579-F581 PolarHBondContact O-N 2.86Å; Q579-Y582 PolarHBondContact O-N 3.34Å; Q579-E583 WeakPolarHBondContact O-CB 3.39Å; Q579-E583 PolarHBondContact O-N 3.3Å
580	L	73.5	Confident	66.7	Low	98 Å²	98	124 Å²	124	51%	0.513	59%	0.593	S	S	.	*	H	α-helix	trans	-64	-36.8	-178.4	-150.6	76.6	0	0	0	112.4	A576 T584	A576-L580 WeakPolarHBondContact O-CB 3.5Å; A576-L580 PolarHBondContact O-N 2.91Å; L580-T584 WeakPolarHBondContact O-CB 3.38Å; L580-T584 WeakPolarHBondContact O-CG2 3.21Å; L580-T584 PolarHBondContact O-N 3.48Å; L580-T584 PolarHBondContact O-OG1 3.47Å
581	F	75.3	Confident	68.3	Low	140 Å²	140	121.8 Å²	121.8	61%	0.614	59%	0.585	S	S	*	*	H	α-helix	trans	-68.8	-44.8	175.1	-170.8	-90.8	0	0	0	111.8	Y577 R578 Q579 E583 T584 F585	Y577-F581 WeakPolarHBondContact O-CB 3.5Å; Y577-F581 PolarHBondContact O-N 3.5Å; R578-F581 PolarHBondContact O-N 3.45Å; Q579-F581 VanDerWaalsContact C-N 3.35Å; Q579-F581 PolarHBondContact O-N 2.86Å; F581-E583 VanDerWaalsContact C-N 3.33Å; F581-E583 PolarHBondContact O-N 3.43Å; F581-T584 PolarHBondContact O-OG1 3.46Å; F581-F585 WeakPolarHBondContact O-CB 3.31Å; F581-F585 PolarHBondContact O-N 3.41Å
582	Y	74.5	Confident	69.7	Low	150 Å²	150	125.2 Å²	125.2	59%	0.588	59%	0.589	S	S	*	*	H	α-helix	trans	-63.1	-38.7	174.3	-87	-67.3	0	0	0	112.4	R578 Q579 N586	R578-Y582 VanDerWaalsContact O-CD2 3.28Å; R578-Y582 WeakPolarHBondContact O-CD2 3.47Å; R578-Y582 PolarHBondContact O-N 3.43Å; Q579-Y582 PolarHBondContact O-N 3.34Å; Y582-N586 VanDerWaalsContact O-CB 3.31Å; Y582-N586 WeakPolarHBondContact O-CB 3.44Å; Y582-N586 VanDerWaalsContact O-CG 3.32Å; Y582-N586 PolarHBondContact O-N 3.39Å; Y582-N586 PolarHBondContact O-ND2 2.93Å
583	E	78.9	Confident	71.3	Confident	124 Å²	124	125.7 Å²	125.7	58%	0.579	59%	0.586	S	S	*	*	H	α-helix	trans	-68.3	-51.2	178.9	-172.5	167.5	-130	0	0	111.9	Q579 F581 F585 N586 M587	Q579-E583 WeakPolarHBondContact O-CB 3.39Å; Q579-E583 PolarHBondContact O-N 3.3Å; F581-E583 VanDerWaalsContact C-N 3.33Å; F581-E583 PolarHBondContact O-N 3.43Å; E583-F585 PolarHBondContact O-N 2.87Å; E583-N586 PolarHBondContact O-N 3.5Å; E583-M587 PolarHBondContact O-N 2.97Å
584	T	81.7	Confident	72.7	Confident	69 Å²	69	122.1 Å²	122.1	42%	0.423	58%	0.577	S	S	.	*	H	α-helix	trans	-63.3	-39.1	176.5	51.4	0	0	0	0	112.5	L580 F581 N586 M587 L588	L580-T584 WeakPolarHBondContact O-CB 3.38Å; L580-T584 WeakPolarHBondContact O-CG2 3.21Å; L580-T584 PolarHBondContact O-N 3.48Å; L580-T584 PolarHBondContact O-OG1 3.47Å; F581-T584 PolarHBondContact O-OG1 3.46Å; T584-N586 VanDerWaalsContact C-N 3.35Å; T584-N586 PolarHBondContact O-N 2.86Å; T584-M587 PolarHBondContact O-N 2.92Å; T584-L588 PolarHBondContact O-N 3.02Å
585	F	83.4	Confident	73.3	Confident	115 Å²	115	116.5 Å²	116.5	50%	0.504	56%	0.563	S	S	.	*	H	α-helix	trans	-64.5	-38.2	174.4	-168.6	-94.5	0	0	0	112	F581 E583 L588 K589	F581-F585 WeakPolarHBondContact O-CB 3.31Å; F581-F585 PolarHBondContact O-N 3.41Å; E583-F585 PolarHBondContact O-N 2.87Å; F585-L588 PolarHBondContact O-N 3.1Å; F585-K589 VanDerWaalsContact O-CB 3.3Å; F585-K589 WeakPolarHBondContact O-CB 3.45Å; F585-K589 PolarHBondContact O-N 2.96Å
586	N	82.3	Confident	73.6	Confident	76 Å²	76	119.5 Å²	119.5	41%	0.406	58%	0.575	S	S	.	*	H	α-helix	trans	-69.7	-37	173.5	-80.4	-38.7	0	0	0	112.7	Y582 E583 T584 K589 N590	Y582-N586 VanDerWaalsContact O-CB 3.31Å; Y582-N586 WeakPolarHBondContact O-CB 3.44Å; Y582-N586 VanDerWaalsContact O-CG 3.32Å; Y582-N586 PolarHBondContact O-N 3.39Å; Y582-N586 PolarHBondContact O-ND2 2.93Å; E583-N586 PolarHBondContact O-N 3.5Å; T584-N586 VanDerWaalsContact C-N 3.35Å; T584-N586 PolarHBondContact O-N 2.86Å; N586-K589 PolarHBondContact O-N 3.2Å; N586-N590 WeakPolarHBondContact O-CB 3.47Å; N586-N590 VanDerWaalsContact O-CG 3.29Å; N586-N590 PolarHBondContact O-N 3.39Å; N586-N590 PolarHBondContact O-ND2 3.42Å
587	M	84.3	Confident	73.8	Confident	126 Å²	126	126 Å²	126	62%	0.621	58%	0.584	S	S	*	*	H	α-helix	trans	-59.8	-48.9	170.2	-73.5	-162.8	77	0	0	111.4	E583 T584 K589 N590 V591	E583-M587 PolarHBondContact O-N 2.97Å; T584-M587 PolarHBondContact O-N 2.92Å; M587-K589 VanDerWaalsContact C-N 3.32Å; M587-K589 PolarHBondContact O-N 3.08Å; M587-N590 PolarHBondContact O-N 2.93Å; M587-N590 VanDerWaalsContact O-N 3.12Å; M587-V591 WeakPolarHBondContact O-CG2 3.46Å; M587-V591 PolarHBondContact O-N 3.33Å
588	L	82.4	Confident	73.6	Confident	119 Å²	119	124.4 Å²	124.4	62%	0.623	59%	0.586	S	S	*	*	H	α-helix	trans	-57.8	-42.6	175.4	-84.1	158.2	0	0	0	112.2	T584 F585 N590 V591 R592	T584-L588 PolarHBondContact O-N 3.02Å; F585-L588 PolarHBondContact O-N 3.1Å; L588-N590 VanDerWaalsContact C-N 3.32Å; L588-N590 PolarHBondContact O-N 2.89Å; L588-V591 PolarHBondContact O-N 3.02Å; L588-R592 WeakPolarHBondContact O-CB 3.48Å; L588-R592 PolarHBondContact O-N 3.41Å
589	K	82.4	Confident	72.8	Confident	112 Å²	112	127.4 Å²	127.4	49%	0.487	60%	0.604	S	S	.	*	H	α-helix	trans	-63.7	-36	176.1	-166.6	172.8	-174.6	175.9	0	112.2	F585 N586 M587 K593	F585-K589 VanDerWaalsContact O-CB 3.3Å; F585-K589 WeakPolarHBondContact O-CB 3.45Å; F585-K589 PolarHBondContact O-N 2.96Å; N586-K589 PolarHBondContact O-N 3.2Å; M587-K589 VanDerWaalsContact C-N 3.32Å; M587-K589 PolarHBondContact O-N 3.08Å; K589-K593 WeakPolarHBondContact O-CG 3.47Å; K589-K593 PolarHBondContact O-N 3.38Å; K589-K593 VanDerWaalsContact O-N 3.17Å
590	N	80.8	Confident	73.1	Confident	91 Å²	91	126.3 Å²	126.3	49%	0.487	60%	0.599	S	S	.	*	H	α-helix	trans	-75.5	-42	176.2	-72.7	-19.1	0	0	0	112.4	N586 M587 L588 R592 K593 M594	N586-N590 WeakPolarHBondContact O-CB 3.47Å; N586-N590 VanDerWaalsContact O-CG 3.29Å; N586-N590 PolarHBondContact O-N 3.39Å; N586-N590 PolarHBondContact O-ND2 3.42Å; M587-N590 PolarHBondContact O-N 2.93Å; M587-N590 VanDerWaalsContact O-N 3.12Å; L588-N590 VanDerWaalsContact C-N 3.32Å; L588-N590 PolarHBondContact O-N 2.89Å; N590-R592 VanDerWaalsContact C-N 3.3Å; N590-R592 PolarHBondContact O-N 3.1Å; N590-K593 WeakPolarHBondContact O-CB 3.48Å; N590-K593 PolarHBondContact O-N 3.23Å; N590-K593 VanDerWaalsContact O-N 3.11Å; N590-M594 WeakPolarHBondContact O-CG 3.23Å; N590-M594 PolarHBondContact O-N 3.35Å
591	V	79	Confident	73.1	Confident	98 Å²	98	127.7 Å²	127.7	59%	0.594	60%	0.603	S	S	*	*	H	α-helix	trans	-59.2	-41.8	172.5	171.6	0	0	0	0	110.7	M587 L588 K593 M594 G595	M587-V591 WeakPolarHBondContact O-CG2 3.46Å; M587-V591 PolarHBondContact O-N 3.33Å; L588-V591 PolarHBondContact O-N 3.02Å; V591-K593 VanDerWaalsContact C-N 3.32Å; V591-K593 PolarHBondContact O-N 3.09Å; V591-M594 PolarHBondContact O-N 3.39Å; V591-G595 PolarHBondContact O-N 3.03Å
592	R	75.8	Confident	72.9	Confident	199 Å²	199	127.1 Å²	127.1	75%	0.751	60%	0.603	S	S	*	*	H	α-helix	trans	-64.6	-33.5	175.6	-155.9	174.3	-158	156.2	5	112.9	L588 N590 N596	L588-R592 WeakPolarHBondContact O-CB 3.48Å; L588-R592 PolarHBondContact O-N 3.41Å; N590-R592 VanDerWaalsContact C-N 3.3Å; N590-R592 PolarHBondContact O-N 3.1Å; R592-N596 PolarHBondContact O-N 3.09Å
593	K	75.2	Confident	72.8	Confident	131 Å²	131	125.7 Å²	125.7	57%	0.57	60%	0.603	S	S	*	*	H	α-helix	trans	-71	-37.4	171.5	-77.8	177.4	173.4	-175.7	0	112.8	K589 N590 V591 N596	K589-K593 WeakPolarHBondContact O-CG 3.47Å; K589-K593 PolarHBondContact O-N 3.38Å; K589-K593 VanDerWaalsContact O-N 3.17Å; N590-K593 WeakPolarHBondContact O-CB 3.48Å; N590-K593 PolarHBondContact O-N 3.23Å; N590-K593 VanDerWaalsContact O-N 3.11Å; V591-K593 VanDerWaalsContact C-N 3.32Å; V591-K593 PolarHBondContact O-N 3.09Å; K593-N596 PolarHBondContact O-N 3.24Å
594	M	72.4	Confident	72.5	Confident	124 Å²	124	125.8 Å²	125.8	61%	0.611	61%	0.605	S	S	*	*	H	α-helix	trans	-68.8	-42.4	175.5	-69	-61.2	-160.3	0	0	111.8	N590 V591 N596 R597 I598	N590-M594 WeakPolarHBondContact O-CG 3.23Å; N590-M594 PolarHBondContact O-N 3.35Å; V591-M594 PolarHBondContact O-N 3.39Å; M594-N596 PolarHBondContact O-N 3.48Å; M594-R597 WeakPolarHBondContact O-CA 3.39Å; M594-R597 PolarHBondContact O-N 2.96Å; M594-I598 WeakPolarHBondContact O-CG1 3.47Å; M594-I598 PolarHBondContact O-N 2.89Å
595	G	66.5	Low	71.9	Confident	35 Å²	35	129.6 Å²	129.6	36%	0.361	62%	0.617	S	S	.	*	H	α-helix	trans	-60.6	-25.6	175.3	0	0	0	0	0	113.8	V591 R597	V591-G595 PolarHBondContact O-N 3.03Å; G595-R597 VanDerWaalsContact C-N 3.3Å
596	N	59.7	Low	71	Confident	130 Å²	130	130.6 Å²	130.6	70%	0.695	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	12.6	172.6	-69.3	5.6	0	0	0	113.6	R592 K593 M594	R592-N596 PolarHBondContact O-N 3.09Å; K593-N596 PolarHBondContact O-N 3.24Å; M594-N596 PolarHBondContact O-N 3.48Å
597	R	58.2	Low	70.2	Confident	209 Å²	209	134.8 Å²	134.8	79%	0.789	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	3.5	170.1	-69.9	-173.5	173	-155.5	-2.6	113.2	M594 G595	M594-R597 WeakPolarHBondContact O-CA 3.39Å; M594-R597 PolarHBondContact O-N 2.96Å; G595-R597 VanDerWaalsContact C-N 3.3Å
598	I	52.9	Low	69	Low	142 Å²	142	135.6 Å²	135.6	73%	0.728	64%	0.644	S	S	*	*			trans	-118.9	26	-179.8	-53	167.6	0	0	0	108.8	M594	M594-I598 WeakPolarHBondContact O-CG1 3.47Å; M594-I598 PolarHBondContact O-N 2.89Å
599	K	42.5	Very low	67.8	Low	237 Å²	237	137.1 Å²	137.1	100%	1.03	65%	0.646	S	S	*	*			trans	-149.5	0	173.3	-69.1	-170.9	178.8	-175.9	0	108.3

Retrieved 599 of 599 residues in 601.7 ms (Link to these results)

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