X2JD52_DROME Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession X2JD52, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG11929, Length 918 aa.

						>X2JD52_DROME|X2JD52|Dmel\CG11929
MSAPNKEIVKGSLTAQQIRQKHQYVRLIMLLRRVYFPRKTKSDYSLTRINFNSTDASMADSLPTGATATRLPAGATCSCRSISGRPKPAAIASESTQTIASTEDMGTQTVFQTDPNEDFDCGQDASTQSMLNMHDVETQSIPVSSKNLNSIQTQTDYEEPKTVRFPLKKYSKTEHEEKRPRKSNTSLRKCFFKRPLIVVKGGALISSDFTANIHQSRMENVSVTTRKEDKETQYENHFGTQSNSSDDQPSDPSTCSKILDRVQKLEAIMKRQELFLRDLQGSVKSWKVQECKPSDCRIIFQGKPEACELPKKLETSDQASQINDIHEERKLPIKPEGFNQSSQKKYTARSEEQKLPIQPEPFNQSSQKKYTARSEEQKLPIKPEPFNQSSQKIYTARSEERKLPRKPENVDQATQKKDTANCECKTLSKEFIQIFLKPETAQEKQKSNNSQRTTDTPINSENSTGLQCSRECNGSSSKDNRRCCKANGYEMHLKGDQFPTAKQCLKDTENFLEQFNRVFAKTKSEETLSDKSRNTSAFSANPTKQNDTEHGVENLLGEIVKKPKSKVSSTSCLEAKSSEQSNKSVEKELYKSFIEQLISHFTKSKSCENNQAQNAQSESYSFDRLLPEFVKMFTRSNSLEEDRPKKVSISEKKTILGANPMTSFNCSKTPHNIKSTALKSELKTSDMELDANGRRGSCQLEGESKPSAIFRNTQRMNNPPRGCQYCGDGSLPILDSLMDEIFRLIGQRPFDDVVLTILRQEDNVYHIKVREMATGKDLGCILGSGRAINQAIGIGLFEDIPTFCELDKNRQYDPRDCPLDELCRRQCGGEIAPDGSADKERVVEFCTRVLGLPAGQASRFFSVTNALKMGNRELTGRGAVTSSLVDNFSSKDLSDVAKTSSLFLRIISGQCNDVQDDE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	36.8	Very low	57.9	Low	250 Å²	250	134.3 Å²	134.3	100%	1.232	75%	0.749	S	S	*	*				0	137.1	0	-60.4	170.4	82.1	0	0	108
2	S	38.8	Very low	59.3	Low	122 Å²	122	129.7 Å²	129.7	85%	0.853	73%	0.733	S	S	*	*			trans	-142.6	146	172.6	51.6	0	0	0	0	109.2
3	A	43.9	Very low	60.9	Low	104 Å²	104	126.9 Å²	126.9	86%	0.86	71%	0.714	S	S	*	*			trans	-132.9	112.2	-173.3	0	0	0	0	0	110.7
4	P	61	Low	61.7	Low	99 Å²	99	123.4 Å²	123.4	64%	0.643	70%	0.697	S	S	*	*			trans	-111.8	-178.4	177.7	39.9	-32.3	0	0	0	113.6
5	N	52.4	Low	61.8	Low	114 Å²	114	118 Å²	118	61%	0.61	67%	0.674	S	S	*	*			trans	73.1	32.6	155.8	-58.6	-13.3	0	0	0	120.3
6	K	57.6	Low	62.7	Low	188 Å²	188	117.2 Å²	117.2	82%	0.817	66%	0.663	S	S	*	*	S	Bend	trans	-91.5	-19	166.3	-78.3	-169.3	176.2	-178.1	0	116.1
7	E	59.8	Low	63.8	Low	168 Å²	168	116.8 Å²	116.8	79%	0.785	65%	0.654	S	S	*	*	S	Bend	trans	-90.4	-41	-176	-65.6	-170.7	124.9	0	0	114	V9 K10 G11	E7-V9 PolarHBondContact O-N 3.03Å; E7-V9 VanDerWaalsContact O-N 3.16Å; E7-K10 WeakPolarHBondContact O-CB 3.01Å; E7-K10 PolarHBondContact O-N 3.21Å; E7-G11 PolarHBondContact O-N 3.26Å
8	I	64	Low	64.2	Low	130 Å²	130	115.7 Å²	115.7	67%	0.667	65%	0.646	S	S	*	*	H	α-helix	trans	-55.9	-37.7	-177.8	-60.9	173.1	0	0	0	111.5	K10 G11 S12	I8-K10 VanDerWaalsContact C-N 3.34Å; I8-K10 PolarHBondContact O-N 2.99Å; I8-G11 PolarHBondContact O-N 2.87Å; I8-S12 PolarHBondContact O-N 3.06Å
9	V	72.6	Confident	64.6	Low	99 Å²	99	119.2 Å²	119.2	60%	0.6	65%	0.648	S	S	*	*	H	α-helix	trans	-63.2	-36.5	178.3	-175.7	0	0	0	0	112.1	E7 S12 L13	E7-V9 PolarHBondContact O-N 3.03Å; E7-V9 VanDerWaalsContact O-N 3.16Å; V9-S12 PolarHBondContact O-N 3.27Å; V9-L13 PolarHBondContact O-N 3.12Å
10	K	74.9	Confident	65.3	Low	154 Å²	154	118.7 Å²	118.7	67%	0.67	64%	0.641	S	S	*	*	H	α-helix	trans	-66.4	-42.6	179.4	-69.2	-174	174.9	-176.7	0	111.9	E7 I8 S12 L13 T14	E7-K10 WeakPolarHBondContact O-CB 3.01Å; E7-K10 PolarHBondContact O-N 3.21Å; I8-K10 VanDerWaalsContact C-N 3.34Å; I8-K10 PolarHBondContact O-N 2.99Å; K10-S12 VanDerWaalsContact C-N 3.33Å; K10-S12 PolarHBondContact O-N 3.05Å; K10-L13 PolarHBondContact O-N 2.82Å; K10-T14 PolarHBondContact O-N 3.44Å; K10-T14 PolarHBondContact O-OG1 3.39Å
11	G	75	Confident	66	Low	49 Å²	49	120.3 Å²	120.3	51%	0.505	64%	0.642	S	S	.	*	H	α-helix	trans	-61.8	-40.6	178.2	0	0	0	0	0	112.7	E7 I8 A15	E7-G11 PolarHBondContact O-N 3.26Å; I8-G11 PolarHBondContact O-N 2.87Å; G11-A15 PolarHBondContact O-N 2.88Å
12	S	74.4	Confident	67.7	Low	79 Å²	79	111.2 Å²	111.2	55%	0.552	60%	0.596	S	S	*	*	H	α-helix	trans	-62.8	-44.9	176.4	-176.8	0	0	0	0	112.5	I8 V9 K10 A15 Q16	I8-S12 PolarHBondContact O-N 3.06Å; V9-S12 PolarHBondContact O-N 3.27Å; K10-S12 VanDerWaalsContact C-N 3.33Å; K10-S12 PolarHBondContact O-N 3.05Å; S12-A15 PolarHBondContact O-N 3.26Å; S12-Q16 PolarHBondContact O-N 2.9Å
13	L	80.5	Confident	69.5	Low	94 Å²	94	111.9 Å²	111.9	49%	0.492	59%	0.586	S	S	.	*	H	α-helix	trans	-63.5	-45.4	-179.3	-174.5	64.6	0	0	0	112.4	V9 K10 A15 Q16 Q17	V9-L13 PolarHBondContact O-N 3.12Å; K10-L13 PolarHBondContact O-N 2.82Å; L13-A15 VanDerWaalsContact C-N 3.34Å; L13-A15 PolarHBondContact O-N 3.48Å; L13-Q16 PolarHBondContact O-N 3.47Å; L13-Q17 WeakPolarHBondContact O-CG 3.37Å; L13-Q17 PolarHBondContact O-N 2.96Å
14	T	72.1	Confident	71.4	Confident	77 Å²	77	114.1 Å²	114.1	47%	0.472	57%	0.573	S	S	.	*	H	α-helix	trans	-61.5	-42.6	177.9	-53.1	0	0	0	0	111.5	K10 Q16 Q17 I18	K10-T14 PolarHBondContact O-N 3.44Å; K10-T14 PolarHBondContact O-OG1 3.39Å; T14-Q16 VanDerWaalsContact C-N 3.32Å; T14-Q16 PolarHBondContact O-N 3.38Å; T14-Q17 PolarHBondContact O-N 3.18Å; T14-I18 HydrophobicContact CG2-CD1 4.17Å; T14-I18 WeakPolarHBondContact O-CG1 3.39Å; T14-I18 PolarHBondContact O-N 3.13Å
15	A	63.1	Low	72	Confident	43 Å²	43	111.5 Å²	111.5	36%	0.355	56%	0.555	S	S	.	*	H	α-helix	trans	-63.6	-36.7	176.4	0	0	0	0	0	112.5	G11 S12 L13 R19	G11-A15 PolarHBondContact O-N 2.88Å; S12-A15 PolarHBondContact O-N 3.26Å; L13-A15 VanDerWaalsContact C-N 3.34Å; L13-A15 PolarHBondContact O-N 3.48Å; A15-R19 WeakPolarHBondContact O-CG 3.29Å; A15-R19 PolarHBondContact O-N 3.07Å; A15-R19 VanDerWaalsContact O-N 3.16Å
16	Q	76.3	Confident	73	Confident	105 Å²	105	111.8 Å²	111.8	49%	0.491	55%	0.548	S	S	.	.	H	α-helix	trans	-67.8	-42.4	175.5	-174.3	174.1	-1.9	0	0	112.2	S12 L13 T14 I18 R19 Q20	S12-Q16 PolarHBondContact O-N 2.9Å; L13-Q16 PolarHBondContact O-N 3.47Å; T14-Q16 VanDerWaalsContact C-N 3.32Å; T14-Q16 PolarHBondContact O-N 3.38Å; Q16-I18 VanDerWaalsContact C-N 3.35Å; Q16-I18 PolarHBondContact O-N 3.09Å; Q16-R19 PolarHBondContact O-N 3.25Å; Q16-Q20 PolarHBondContact O-N 3.26Å
17	Q	80.6	Confident	73.9	Confident	111 Å²	111	107.3 Å²	107.3	52%	0.519	53%	0.533	S	S	.	.	H	α-helix	trans	-62.8	-39.6	175.9	-72.9	178.7	-15.1	0	0	112.2	L13 T14 Q20 K21	L13-Q17 WeakPolarHBondContact O-CG 3.37Å; L13-Q17 PolarHBondContact O-N 2.96Å; T14-Q17 PolarHBondContact O-N 3.18Å; Q17-Q20 PolarHBondContact O-N 3.33Å; Q17-K21 WeakPolarHBondContact O-CB 3.46Å; Q17-K21 PolarHBondContact O-N 2.75Å
18	I	72.4	Confident	74.9	Confident	97 Å²	97	102.3 Å²	102.3	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-60.9	-45.6	173.9	-69.2	165.7	0	0	0	110.6	T14 Q16 K21 H22	T14-I18 HydrophobicContact CG2-CD1 4.17Å; T14-I18 WeakPolarHBondContact O-CG1 3.39Å; T14-I18 PolarHBondContact O-N 3.13Å; Q16-I18 VanDerWaalsContact C-N 3.35Å; Q16-I18 PolarHBondContact O-N 3.09Å; I18-K21 PolarHBondContact O-N 3.31Å; I18-H22 PolarHBondContact O-N 3.18Å
19	R	70.8	Confident	75.3	Confident	182 Å²	182	97.3 Å²	97.3	69%	0.687	48%	0.484	S	S	*	.	H	α-helix	trans	-62.7	-41.5	176.8	-70	176.1	-169.6	-164.5	3	113.1	A15 Q16 H22 Q23	A15-R19 WeakPolarHBondContact O-CG 3.29Å; A15-R19 PolarHBondContact O-N 3.07Å; A15-R19 VanDerWaalsContact O-N 3.16Å; Q16-R19 PolarHBondContact O-N 3.25Å; R19-H22 VanDerWaalsContact O-CB 3.24Å; R19-H22 WeakPolarHBondContact O-CB 3.36Å; R19-H22 PolarHBondContact O-N 2.82Å; R19-Q23 WeakPolarHBondContact O-CG 2.82Å; R19-Q23 PolarHBondContact O-N 3.24Å
20	Q	79.9	Confident	75.3	Confident	109 Å²	109	96.9 Å²	96.9	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-41.2	176.1	-74.9	178.8	-30.6	0	0	111.7	Q16 Q17 Q23 Y24	Q16-Q20 PolarHBondContact O-N 3.26Å; Q17-Q20 PolarHBondContact O-N 3.33Å; Q20-Q23 PolarHBondContact O-N 3.31Å; Q20-Y24 WeakPolarHBondContact O-CB 3.22Å; Q20-Y24 PolarHBondContact O-N 3.39Å
21	K	79.2	Confident	75.5	Confident	152 Å²	152	93.3 Å²	93.3	66%	0.661	47%	0.466	S	S	*	.	H	α-helix	trans	-62.5	-41.2	173.4	-171.6	178.1	178.4	-177.1	0	111.8	Q17 I18 Y24 V25	Q17-K21 WeakPolarHBondContact O-CB 3.46Å; Q17-K21 PolarHBondContact O-N 2.75Å; I18-K21 PolarHBondContact O-N 3.31Å; K21-Y24 PolarHBondContact O-N 3.04Å; K21-V25 WeakPolarHBondContact O-CG2 3.27Å; K21-V25 PolarHBondContact O-N 2.9Å
22	H	73.3	Confident	75.5	Confident	59 Å²	59	97.9 Å²	97.9	27%	0.273	47%	0.468	S	S	.	.	H	α-helix	trans	-54.5	-53.8	170.4	-112.6	-112.6	0	0	0	111.5	I18 R19 Y24 V25 R26 I794 G795	I18-H22 PolarHBondContact O-N 3.18Å; R19-H22 VanDerWaalsContact O-CB 3.24Å; R19-H22 WeakPolarHBondContact O-CB 3.36Å; R19-H22 PolarHBondContact O-N 2.82Å; H22-Y24 VanDerWaalsContact C-N 3.32Å; H22-Y24 PolarHBondContact O-N 3.48Å; H22-V25 PolarHBondContact O-N 2.91Å; H22-R26 WeakPolarHBondContact O-CB 3.09Å; H22-R26 PolarHBondContact O-N 3.49Å; H22-I794 PolarHBondContact CE1-O 3.45Å; H22-I794 PolarHBondContact ND1-O 3.45Å; H22-I794 PolarHBondContact NE2-O 3.46Å; H22-G795 WeakPolarHBondContact NE2-CA 3.4Å; H22-G795 PolarHBondContact NE2-N 3.26Å
23	Q	76.4	Confident	75.3	Confident	137 Å²	137	96.6 Å²	96.6	64%	0.64	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-39.3	-178.6	-74.1	177.9	-26.5	0	0	112.2	R19 Q20 R26 L27	R19-Q23 WeakPolarHBondContact O-CG 2.82Å; R19-Q23 PolarHBondContact O-N 3.24Å; Q20-Q23 PolarHBondContact O-N 3.31Å; Q23-R26 PolarHBondContact O-N 3.46Å; Q23-L27 WeakPolarHBondContact O-CB 3.31Å; Q23-L27 PolarHBondContact O-N 2.94Å
24	Y	82.9	Confident	74.8	Confident	150 Å²	150	97.4 Å²	97.4	59%	0.588	46%	0.46	S	S	*	.	H	α-helix	trans	-66.2	-42.8	175.3	-176.7	-105	0	0	0	112.6	Q20 K21 H22 L27 I28	Q20-Y24 WeakPolarHBondContact O-CB 3.22Å; Q20-Y24 PolarHBondContact O-N 3.39Å; K21-Y24 PolarHBondContact O-N 3.04Å; H22-Y24 VanDerWaalsContact C-N 3.32Å; H22-Y24 PolarHBondContact O-N 3.48Å; Y24-L27 PolarHBondContact O-N 3.33Å; Y24-I28 HydrophobicContact CD1-CD1 4.01Å; Y24-I28 HydrophobicContact CE1-CD1 3.39Å; Y24-I28 HydrophobicContact CE1-CG1 4.39Å; Y24-I28 HydrophobicContact CE2-CD1 4.32Å; Y24-I28 PolarHBondContact O-N 3.16Å
25	V	74.5	Confident	74.3	Confident	45 Å²	45	101.6 Å²	101.6	27%	0.273	47%	0.468	S	S	.	.	H	α-helix	trans	-63.2	-46.3	173.9	169.3	0	0	0	0	110.8	K21 H22 L27 I28 M29 I794	K21-V25 WeakPolarHBondContact O-CG2 3.27Å; K21-V25 PolarHBondContact O-N 2.9Å; H22-V25 PolarHBondContact O-N 2.91Å; V25-L27 VanDerWaalsContact C-N 3.33Å; V25-L27 PolarHBondContact O-N 3.47Å; V25-I28 PolarHBondContact O-N 3.15Å; V25-M29 HydrophobicContact CG1-CE 4.03Å; V25-M29 HydrophobicContact CG1-CG 4.41Å; V25-M29 HydrophobicContact CG1-SD 4Å; V25-M29 VanDerWaalsContact O-CG 3.31Å; V25-M29 WeakPolarHBondContact O-CG 3.26Å; V25-M29 PolarHBondContact O-N 3.26Å; V25-I794 HydrophobicContact CG1-CG2 4.29Å
26	R	73.6	Confident	73.6	Confident	119 Å²	119	107.2 Å²	107.2	45%	0.449	49%	0.485	S	S	.	.	H	α-helix	trans	-57.8	-44.5	176.3	-162	177.5	-170.8	-141.7	3.7	111.4	H22 Q23 M29 L30 D799	H22-R26 WeakPolarHBondContact O-CB 3.09Å; H22-R26 PolarHBondContact O-N 3.49Å; Q23-R26 PolarHBondContact O-N 3.46Å; R26-M29 PolarHBondContact O-N 3.34Å; R26-L30 WeakPolarHBondContact O-CG 3.44Å; R26-L30 PolarHBondContact O-N 3.25Å; R26-D799 IonicContact CZ-OD1 3.74Å; R26-D799 VanDerWaalsContact CZ-OD1 3.24Å; R26-D799 IonicContact CZ-OD2 3.27Å; R26-D799 IonicContact NE-OD1 2.6Å; R26-D799 PolarHBondContact NE-OD1 2.99Å; R26-D799 IonicContact NE-OD2 3.42Å; R26-D799 PolarHBondContact NE-OD2 2.85Å; R26-D799 IonicContact NH2-OD1 2.63Å; R26-D799 PolarHBondContact NH2-OD1 2.86Å; R26-D799 IonicContact NH2-OD2 3.23Å; R26-D799 PolarHBondContact NH2-OD2 2.69Å
27	L	76.6	Confident	72.1	Confident	95 Å²	95	107.6 Å²	107.6	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-46.2	174.7	-179.2	62	0	0	0	112.2	Q23 Y24 V25 M29 L30 L31	Q23-L27 WeakPolarHBondContact O-CB 3.31Å; Q23-L27 PolarHBondContact O-N 2.94Å; Y24-L27 PolarHBondContact O-N 3.33Å; V25-L27 VanDerWaalsContact C-N 3.33Å; V25-L27 PolarHBondContact O-N 3.47Å; L27-M29 VanDerWaalsContact C-N 3.3Å; L27-M29 PolarHBondContact O-N 3.03Å; L27-L30 PolarHBondContact O-N 2.99Å; L27-L31 HydrophobicContact CD1-CD1 4.31Å; L27-L31 HydrophobicContact CD1-CG 4.41Å; L27-L31 HydrophobicContact CG-CD1 4.08Å; L27-L31 WeakPolarHBondContact O-CB 3.4Å; L27-L31 VanDerWaalsContact O-CG 3.29Å; L27-L31 WeakPolarHBondContact O-CG 3.43Å; L27-L31 PolarHBondContact O-N 3.21Å
28	I	79.2	Confident	70.4	Confident	62 Å²	62	111.1 Å²	111.1	32%	0.318	51%	0.505	S	S	.	.	H	α-helix	trans	-60.6	-38.9	175.6	-78.3	-178.9	0	0	0	111.7	Y24 V25 L31 R32	Y24-I28 HydrophobicContact CD1-CD1 4.01Å; Y24-I28 HydrophobicContact CE1-CD1 3.39Å; Y24-I28 HydrophobicContact CE1-CG1 4.39Å; Y24-I28 HydrophobicContact CE2-CD1 4.32Å; Y24-I28 PolarHBondContact O-N 3.16Å; V25-I28 PolarHBondContact O-N 3.15Å; I28-L31 PolarHBondContact O-N 3.44Å; I28-R32 HydrophobicContact CG2-CG 4.44Å; I28-R32 WeakPolarHBondContact O-CB 3.46Å; I28-R32 WeakPolarHBondContact O-CG 3.45Å; I28-R32 PolarHBondContact O-N 2.91Å
29	M	72.6	Confident	69	Low	25 Å²	25	116.3 Å²	116.3	12%	0.123	52%	0.524	C	S	.	.	H	α-helix	trans	-71.1	-37.8	179.4	-67	-174.2	-44.5	0	0	112.3	V25 R26 L27 R32 R33 M738 F742	V25-M29 HydrophobicContact CG1-CE 4.03Å; V25-M29 HydrophobicContact CG1-CG 4.41Å; V25-M29 HydrophobicContact CG1-SD 4Å; V25-M29 VanDerWaalsContact O-CG 3.31Å; V25-M29 WeakPolarHBondContact O-CG 3.26Å; V25-M29 PolarHBondContact O-N 3.26Å; R26-M29 PolarHBondContact O-N 3.34Å; L27-M29 VanDerWaalsContact C-N 3.3Å; L27-M29 PolarHBondContact O-N 3.03Å; M29-R32 PolarHBondContact O-N 3.16Å; M29-R33 PolarHBondContact O-N 3.48Å; M29-M738 HydrophobicContact CE-CE 3.8Å; M29-M738 HydrophobicContact SD-CE 3.47Å; M29-M738 WeakPolarHBondContact SD-CE 3.33Å; M29-F742 HydrophobicContact CB-CE2 4.05Å; M29-F742 HydrophobicContact CB-CZ 3.76Å; M29-F742 HydrophobicContact CE-CZ 4.32Å; M29-F742 HydrophobicContact CG-CE2 3.98Å; M29-F742 HydrophobicContact CG-CZ 4.16Å; M29-F742 HydrophobicContact SD-CE2 3.65Å; M29-F742 HydrophobicContact SD-CZ 3.91Å
30	L	73.4	Confident	67.3	Low	90 Å²	90	113.2 Å²	113.2	47%	0.471	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-44.6	170.3	-70	170.5	0	0	0	111.4	R26 L27 R33 V34	R26-L30 WeakPolarHBondContact O-CG 3.44Å; R26-L30 PolarHBondContact O-N 3.25Å; L27-L30 PolarHBondContact O-N 2.99Å; L30-R33 PolarHBondContact O-N 3.33Å; L30-V34 PolarHBondContact O-N 3.2Å
31	L	78	Confident	65.4	Low	79 Å²	79	117.4 Å²	117.4	41%	0.414	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-44.1	175.7	-69.6	168.5	0	0	0	111.9	L27 I28 R33 V34 Y35	L27-L31 HydrophobicContact CD1-CD1 4.31Å; L27-L31 HydrophobicContact CD1-CG 4.41Å; L27-L31 HydrophobicContact CG-CD1 4.08Å; L27-L31 WeakPolarHBondContact O-CB 3.4Å; L27-L31 VanDerWaalsContact O-CG 3.29Å; L27-L31 WeakPolarHBondContact O-CG 3.43Å; L27-L31 PolarHBondContact O-N 3.21Å; I28-L31 PolarHBondContact O-N 3.44Å; L31-R33 VanDerWaalsContact C-N 3.26Å; L31-R33 PolarHBondContact O-N 3.19Å; L31-V34 WeakPolarHBondContact O-CB 3.29Å; L31-V34 PolarHBondContact O-N 2.75Å; L31-Y35 HydrophobicContact CB-CD2 4.46Å; L31-Y35 HydrophobicContact CD2-CE2 4.35Å; L31-Y35 VanDerWaalsContact O-CD2 3.26Å; L31-Y35 WeakPolarHBondContact O-CD2 3.32Å; L31-Y35 PolarHBondContact O-N 3.16Å; L31-Y35 VanDerWaalsContact O-N 3.08Å
32	R	75.9	Confident	63.7	Low	146 Å²	146	114.5 Å²	114.5	55%	0.551	54%	0.541	S	S	*	.	H	α-helix	trans	-55.4	-38.6	176.7	-82.8	-178	174.1	-161.8	-0.9	112.5	I28 M29 V34 Y35 F36 D739	I28-R32 HydrophobicContact CG2-CG 4.44Å; I28-R32 WeakPolarHBondContact O-CB 3.46Å; I28-R32 WeakPolarHBondContact O-CG 3.45Å; I28-R32 PolarHBondContact O-N 2.91Å; M29-R32 PolarHBondContact O-N 3.16Å; R32-V34 VanDerWaalsContact C-N 3.33Å; R32-V34 PolarHBondContact O-N 3.08Å; R32-Y35 PolarHBondContact O-N 3.15Å; R32-F36 WeakPolarHBondContact O-CD2 3.45Å; R32-D739 IonicContact NH1-OD1 2.75Å
33	R	70.5	Confident	62.3	Low	51 Å²	51	119.1 Å²	119.1	19%	0.192	57%	0.567	C	S	.	*	H	α-helix	trans	-62.5	-36.2	174.9	-83.4	177.4	144.5	159.1	-3.8	113.4	M29 L30 L31 F742 R748 F750	M29-R33 PolarHBondContact O-N 3.48Å; L30-R33 PolarHBondContact O-N 3.33Å; L31-R33 VanDerWaalsContact C-N 3.26Å; L31-R33 PolarHBondContact O-N 3.19Å; R33-F742 HydrophobicContact CG-CD1 4.36Å; R33-R748 PolarHBondContact NH2-O 3.46Å; R33-R748 VanDerWaalsContact NH2-O 3.11Å; R33-F750 VanDerWaalsContact NH2-CE1 3.34Å
34	V	69.6	Low	60.3	Low	112 Å²	112	122.7 Å²	122.7	68%	0.679	58%	0.577	S	S	*	*	H	α-helix	trans	-72.5	-35.2	177.5	-179.6	0	0	0	0	111.3	L30 L31 R32 F36	L30-V34 PolarHBondContact O-N 3.2Å; L31-V34 WeakPolarHBondContact O-CB 3.29Å; L31-V34 PolarHBondContact O-N 2.75Å; R32-V34 VanDerWaalsContact C-N 3.33Å; R32-V34 PolarHBondContact O-N 3.08Å; V34-F36 PolarHBondContact O-N 3.39Å
35	Y	61.9	Low	58.2	Low	164 Å²	164	121.3 Å²	121.3	64%	0.643	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	25.7	-174.2	-73.5	-69.5	0	0	0	115.8	L31 R32 P37	L31-Y35 HydrophobicContact CB-CD2 4.46Å; L31-Y35 HydrophobicContact CD2-CE2 4.35Å; L31-Y35 VanDerWaalsContact O-CD2 3.26Å; L31-Y35 WeakPolarHBondContact O-CD2 3.32Å; L31-Y35 PolarHBondContact O-N 3.16Å; L31-Y35 VanDerWaalsContact O-N 3.08Å; R32-Y35 PolarHBondContact O-N 3.15Å; Y35-P37 VanDerWaalsContact C-CD 3.49Å; Y35-P37 WeakPolarHBondContact O-CD 3.32Å
36	F	48.8	Very low	56.3	Low	161 Å²	161	126.6 Å²	126.6	71%	0.706	62%	0.615	S	S	*	*			trans	-99.6	87.4	166	-92.6	-77.6	0	0	0	111.2	R32 V34 R38	R32-F36 WeakPolarHBondContact O-CD2 3.45Å; V34-F36 PolarHBondContact O-N 3.39Å; F36-R38 PolarHBondContact O-N 3.42Å
37	P	44.4	Very low	54.6	Low	113 Å²	113	126.9 Å²	126.9	73%	0.734	63%	0.63	S	S	*	*			trans	-65.1	125.2	172.7	27.9	-34.2	0	0	0	109.8	Y35 K39	Y35-P37 VanDerWaalsContact C-CD 3.49Å; Y35-P37 WeakPolarHBondContact O-CD 3.32Å; P37-K39 PolarHBondContact O-N 3.08Å; P37-K39 VanDerWaalsContact O-N 3.09Å
38	R	43.9	Very low	52.4	Low	185 Å²	185	134 Å²	134	70%	0.698	65%	0.65	S	S	*	*			trans	-63.6	112.4	172.4	-67.9	-175.1	-179.1	-168.9	2.6	108.6	F36 T40	F36-R38 PolarHBondContact O-N 3.42Å; R38-T40 HydrophobicContact CB-CG2 4.3Å; R38-T40 PolarHBondContact O-N 3.34Å
39	K	43.1	Very low	50.3	Low	207 Å²	207	137.7 Å²	137.7	90%	0.9	67%	0.669	S	S	*	*			trans	-67.8	82.2	158.9	-77.7	-170.4	177	-177	0	108.4	P37 K41	P37-K39 PolarHBondContact O-N 3.08Å; P37-K39 VanDerWaalsContact O-N 3.09Å; K39-K41 PolarHBondContact O-N 3.06Å; K39-K41 VanDerWaalsContact O-N 3.09Å
40	T	36.1	Very low	48.2	Very low	116 Å²	116	143.3 Å²	143.3	71%	0.712	70%	0.7	S	S	*	*			trans	-63.1	107.8	169.9	46.9	0	0	0	0	108.5	R38 S42	R38-T40 HydrophobicContact CB-CG2 4.3Å; R38-T40 PolarHBondContact O-N 3.34Å; T40-S42 PolarHBondContact O-N 3.18Å; T40-S42 VanDerWaalsContact O-N 3.14Å
41	K	39.4	Very low	46.2	Very low	197 Å²	197	148 Å²	148	86%	0.857	72%	0.717	S	S	*	*			trans	-63.7	112.2	160.4	-74.2	-174.3	175.7	-176	0	106.5	K39	K39-K41 PolarHBondContact O-N 3.06Å; K39-K41 VanDerWaalsContact O-N 3.09Å
42	S	44	Very low	44	Very low	92 Å²	92	151.3 Å²	151.3	64%	0.643	74%	0.735	S	S	*	*			trans	-83.5	121.7	168.8	53	0	0	0	0	108.5	T40 Y44	T40-S42 PolarHBondContact O-N 3.18Å; T40-S42 VanDerWaalsContact O-N 3.14Å; S42-Y44 PolarHBondContact O-N 3.37Å
43	D	43.9	Very low	42	Very low	155 Å²	155	149.7 Å²	149.7	83%	0.829	75%	0.746	S	S	*	*			trans	-71.9	92.4	178.7	-63.8	-51.6	0	0	0	110.8
44	Y	33.6	Very low	40.2	Very low	212 Å²	212	153 Å²	153	83%	0.831	77%	0.772	S	S	*	*			trans	-122.3	72.7	172.6	-99.7	-80.2	0	0	0	110.3	S42	S42-Y44 PolarHBondContact O-N 3.37Å
45	S	39.4	Very low	38.4	Very low	121 Å²	121	154.7 Å²	154.7	85%	0.846	78%	0.777	S	S	*	*			trans	-109.9	76.7	168.9	60.2	0	0	0	0	110.2
46	L	33.8	Very low	37	Very low	156 Å²	156	151.4 Å²	151.4	82%	0.817	78%	0.784	S	S	*	*			trans	-122.5	119.8	173.9	-130.1	170.7	0	0	0	109.1
47	T	38.3	Very low	36.2	Very low	126 Å²	126	148.8 Å²	148.8	77%	0.773	79%	0.785	S	S	*	*			trans	-74.4	132.8	-168.7	31.8	0	0	0	0	112.6
48	R	31.2	Very low	35.6	Very low	243 Å²	243	151.9 Å²	151.9	92%	0.917	79%	0.793	S	S	*	*			trans	-126	113.4	152.4	-87.1	-167.5	172.2	-170.7	-1.8	109.7
49	I	33.7	Very low	35.1	Very low	141 Å²	141	146.8 Å²	146.8	72%	0.723	79%	0.79	S	S	*	*			trans	-78.9	122	166.1	-59.4	172.9	0	0	0	106.3	F51	I49-F51 HydrophobicContact CG2-CD2 3.94Å; I49-F51 HydrophobicContact CG2-CE2 3.9Å
50	N	29.3	Very low	34.5	Very low	142 Å²	142	144.5 Å²	144.5	76%	0.759	79%	0.787	S	S	*	*			trans	-98.6	113.6	168.7	-108.3	21.3	0	0	0	108.5
51	F	31.1	Very low	34.4	Very low	188 Å²	188	144.5 Å²	144.5	83%	0.825	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-83.2	124.6	162.5	-85.1	-93	0	0	0	108.9	I49	I49-F51 HydrophobicContact CG2-CD2 3.94Å; I49-F51 HydrophobicContact CG2-CE2 3.9Å
52	N	32.5	Very low	34.2	Very low	150 Å²	150	142.6 Å²	142.6	80%	0.802	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-88.1	132	159.7	-78.8	0.6	0	0	0	108.3
53	S	32.8	Very low	34.5	Very low	112 Å²	112	143.5 Å²	143.5	78%	0.783	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-98.2	140.7	175.7	-178.4	0	0	0	0	110.6
54	T	32.4	Very low	34	Very low	119 Å²	119	142.4 Å²	142.4	73%	0.73	79%	0.793	S	S	*	*			trans	-153.3	110.3	159.8	-51.3	0	0	0	0	108.2
55	D	32.8	Very low	33.9	Very low	149 Å²	149	135.5 Å²	135.5	80%	0.797	79%	0.787	S	S	*	*			trans	48.3	139.4	154	-44.9	-25.1	0	0	0	119.5
56	A	32.2	Very low	33.6	Very low	95 Å²	95	133.9 Å²	133.9	79%	0.785	78%	0.781	S	S	*	*			cis	-162.8	-178.4	24.4	0	0	0	0	0	113.3
57	S	31.8	Very low	33.4	Very low	105 Å²	105	133 Å²	133	73%	0.734	78%	0.782	S	S	*	*			trans	85.7	100.8	143.4	-171.8	0	0	0	0	121.6
58	M	31.8	Very low	33.1	Very low	179 Å²	179	130.9 Å²	130.9	88%	0.882	78%	0.777	S	S	*	*			trans	85.9	134.7	132.8	-66.3	-66.9	-174.4	0	0	123.5
59	A	32.8	Very low	33.2	Very low	78 Å²	78	125.7 Å²	125.7	65%	0.645	77%	0.773	S	S	*	*			trans	73.8	118.5	146.7	0	0	0	0	0	121.7
60	D	31	Very low	33	Very low	158 Å²	158	130.4 Å²	130.4	85%	0.845	78%	0.781	S	S	*	*				41.7	130.4	129.8	-46.1	-25.7	0	0	0	119.4
61	S	33.5	Very low	33.4	Very low	116 Å²	116	131.2 Å²	131.2	81%	0.811	79%	0.785	S	S	*	*			cis	-166.7	162.6	36.8	52.4	0	0	0	0	114.1
62	L	36.1	Very low	34.6	Very low	158 Å²	158	127.9 Å²	127.9	83%	0.827	78%	0.782	S	S	*	*			trans	-69	166.2	162.4	-84.8	164.9	0	0	0	111.4
63	P	51.3	Low	34.7	Very low	111 Å²	111	125.9 Å²	125.9	72%	0.721	79%	0.786	S	S	*	*			cis	-146.8	-179.3	33.5	42.5	-21.1	0	0	0	119.2
64	T	32.8	Very low	34.5	Very low	131 Å²	131	123.8 Å²	123.8	80%	0.804	78%	0.783	S	S	*	*			trans	11	140.1	140.8	-44.6	0	0	0	0	119.5
65	G	30.4	Very low	34.6	Very low	68 Å²	68	123 Å²	123	70%	0.701	79%	0.788	S	S	*	*			cis	151.2	-177.5	1	0	0	0	0	0	113.1
66	A	33.3	Very low	34.6	Very low	86 Å²	86	121.7 Å²	121.7	71%	0.711	79%	0.786	S	S	*	*			trans	65.4	109.4	153.8	0	0	0	0	0	123.6
67	T	30.8	Very low	34.6	Very low	137 Å²	137	123.1 Å²	123.1	84%	0.84	79%	0.789	S	S	*	*				62.6	123.2	127	59.4	0	0	0	0	125.3
68	A	32.2	Very low	34.7	Very low	82 Å²	82	122.7 Å²	122.7	68%	0.678	79%	0.786	S	S	*	*				87	126.3	122.6	0	0	0	0	0	124.4
69	T	31.6	Very low	34.8	Very low	135 Å²	135	119.5 Å²	119.5	83%	0.828	78%	0.78	S	S	*	*			trans	67.3	157.7	152.9	59.8	0	0	0	0	118.2
70	R	30.6	Very low	34.8	Very low	239 Å²	239	126.6 Å²	126.6	90%	0.902	79%	0.79	S	S	*	*			cis	-153.4	179.3	18.5	-140.9	165.6	-170.8	179.4	2.9	111.8
71	L	37.8	Very low	35	Very low	159 Å²	159	124.7 Å²	124.7	83%	0.832	79%	0.789	S	S	*	*			trans	-82.6	-172.3	176.9	-56.4	164	0	0	0	112.3
72	P	56.8	Low	35	Very low	118 Å²	118	127.2 Å²	127.2	77%	0.766	79%	0.792	S	S	*	*			cis	-138.3	-168.9	-8.5	29.7	-4.6	0	0	0	116.6
73	A	33.2	Very low	34.9	Very low	108 Å²	108	125.7 Å²	125.7	89%	0.893	79%	0.794	S	S	*	*			trans	84.1	146.7	155.1	0	0	0	0	0	120.2
74	G	30	Very low	33.9	Very low	69 Å²	69	123.8 Å²	123.8	71%	0.711	79%	0.794	S	S	*	*			cis	171.6	149.2	-11.8	0	0	0	0	0	116
75	A	34.5	Very low	34	Very low	102 Å²	102	129.4 Å²	129.4	84%	0.843	80%	0.801	S	S	*	*			trans	62.2	155.2	172.3	0	0	0	0	0	116.8
76	T	33	Very low	35	Very low	122 Å²	122	132 Å²	132	75%	0.748	81%	0.805	S	S	*	*			cis	-149.6	156.5	23.6	47.4	0	0	0	0	113.8
77	C	32.1	Very low	34.9	Very low	124 Å²	124	137.7 Å²	137.7	84%	0.838	81%	0.814	S	S	*	*			trans	45.9	150	134	-60.2	0	0	0	0	123.2
78	S	33.5	Very low	36.2	Very low	96 Å²	96	137 Å²	137	67%	0.671	81%	0.811	S	S	*	*			cis	-173.3	147.6	-11.9	178.8	0	0	0	0	111.3
79	C	34.3	Very low	36.2	Very low	112 Å²	112	138 Å²	138	76%	0.757	82%	0.82	S	S	*	*			trans	59.4	153.9	155.6	-84.1	0	0	0	0	120.7
80	R	32.8	Very low	36.3	Very low	228 Å²	228	136 Å²	136	86%	0.86	82%	0.817	S	S	*	*			cis	-160.7	155	-24.3	-138.2	179.9	-171.8	-173.8	2.8	108
81	S	35.4	Very low	36.3	Very low	118 Å²	118	132.1 Å²	132.1	83%	0.825	81%	0.812	S	S	*	*			trans	-123.8	149.7	175.4	-49.5	0	0	0	0	111.4
82	I	33.5	Very low	35.9	Very low	169 Å²	169	128.7 Å²	128.7	87%	0.867	81%	0.807	S	S	*	*			trans	-133.5	131.8	166.4	-59.6	-179	0	0	0	108.4
83	S	32.5	Very low	34.7	Very low	126 Å²	126	128.1 Å²	128.1	88%	0.881	81%	0.806	S	S	*	*			trans	-140.9	138.2	170.4	-178.7	0	0	0	0	107.9
84	G	31.3	Very low	34.6	Very low	70 Å²	70	132.2 Å²	132.2	72%	0.722	81%	0.807	S	S	*	*			trans	-149.3	114.5	-173	0	0	0	0	0	113.2
85	R	34.5	Very low	34.7	Very low	250 Å²	250	133.6 Å²	133.6	94%	0.943	81%	0.805	S	S	*	*			trans	-127.7	127.1	162.3	-83.9	-172	172.3	-164.5	-0.1	108.7
86	P	50.6	Low	34.7	Very low	121 Å²	121	134.3 Å²	134.3	79%	0.786	80%	0.799	S	S	*	*			trans	-113.3	142.4	172.2	36.9	-28.7	0	0	0	113.3
87	K	33	Very low	34.7	Very low	206 Å²	206	137.2 Å²	137.2	90%	0.896	80%	0.804	S	S	*	*			trans	170.4	160.2	153.7	-103.3	179.1	-177.6	-177.6	0	109.3
88	P	56.1	Low	34.8	Very low	122 Å²	122	137.2 Å²	137.2	79%	0.792	80%	0.801	S	S	*	*			cis	-130.5	179.4	-23.5	39.4	-24.2	0	0	0	113.1
89	A	32.3	Very low	34.5	Very low	104 Å²	104	140.8 Å²	140.8	86%	0.86	81%	0.811	S	S	*	*			trans	-146	160.4	160.5	0	0	0	0	0	110.2
90	A	34.6	Very low	34.5	Very low	92 Å²	92	139.5 Å²	139.5	76%	0.76	81%	0.808	S	S	*	*			trans	-99.8	177.1	179.1	0	0	0	0	0	111.1
91	I	31.1	Very low	34.4	Very low	158 Å²	158	133.9 Å²	133.9	81%	0.81	80%	0.804	S	S	*	*				-169.4	142.6	64.9	-77.9	165.4	0	0	0	110
92	A	28.3	Very low	34.2	Very low	88 Å²	88	134 Å²	134	73%	0.727	80%	0.799	S	S	*	*			trans	57.8	166.6	158.4	0	0	0	0	0	119.6
93	S	33.3	Very low	34.1	Very low	106 Å²	106	135 Å²	135	74%	0.741	80%	0.8	S	S	*	*			cis	-168.1	167.9	-34.9	-87.8	0	0	0	0	108.3
94	E	29.8	Very low	34.1	Very low	194 Å²	194	136.5 Å²	136.5	91%	0.907	80%	0.799	S	S	*	*			trans	67.5	162.1	171.6	-62.5	-178.9	-172.3	0	0	116.8
95	S	32.7	Very low	34.2	Very low	97 Å²	97	142.1 Å²	142.1	68%	0.678	81%	0.808	S	S	*	*			cis	-163.5	126.4	-37.9	-177.8	0	0	0	0	111.5
96	T	35.1	Very low	34.1	Very low	117 Å²	117	133.1 Å²	133.1	72%	0.718	79%	0.793	S	S	*	*			trans	61.5	143.2	148.7	-45.4	0	0	0	0	122.7
97	Q	32.1	Very low	33.4	Very low	183 Å²	183	134.5 Å²	134.5	86%	0.855	80%	0.8	S	S	*	*			trans	96.7	169	153.2	-110.8	164.5	67.2	0	0	121.1
98	T	34.2	Very low	33.3	Very low	124 Å²	124	133.1 Å²	133.1	76%	0.761	80%	0.797	S	S	*	*			trans	-141.6	146.8	-142.1	-44.9	0	0	0	0	111.1
99	I	28.2	Very low	32.2	Very low	172 Å²	172	134.3 Å²	134.3	88%	0.882	80%	0.802	S	S	*	*			trans	179.4	173.9	141.9	-94.2	154	0	0	0	108.7
100	A	33.2	Very low	32.1	Very low	85 Å²	85	134.7 Å²	134.7	70%	0.702	79%	0.793	S	S	*	*			trans	-136.4	-178.9	-162.6	0	0	0	0	0	113.9
101	S	31.1	Very low	31.9	Very low	110 Å²	110	140.3 Å²	140.3	77%	0.769	80%	0.801	S	S	*	*			trans	73.9	157.2	171.9	118.6	0	0	0	0	115.5
102	T	31.3	Very low	32	Very low	119 Å²	119	140.7 Å²	140.7	73%	0.73	80%	0.799	S	S	*	*			cis	-164.7	159	-21.9	16.9	0	0	0	0	108
103	E	31.6	Very low	32.2	Very low	190 Å²	190	143.2 Å²	143.2	89%	0.888	81%	0.806	S	S	*	*				161.5	158.3	123.5	-87.2	-170.1	149.8	0	0	113.5
104	D	32	Very low	32.3	Very low	158 Å²	158	145.2 Å²	145.2	85%	0.845	81%	0.808	S	S	*	*			trans	-91.9	163	-177.7	-71.9	-67.6	0	0	0	113.2
105	M	32.8	Very low	33.5	Very low	188 Å²	188	140.8 Å²	140.8	93%	0.926	80%	0.797	S	S	*	*			trans	-148.9	123.1	134.4	-94.6	-58.3	-82.5	0	0	108.5
106	G	33.3	Very low	33.9	Very low	61 Å²	61	143.2 Å²	143.2	63%	0.629	80%	0.802	S	S	*	*			trans	-111.8	-178.3	-176.7	0	0	0	0	0	113.9
107	T	34.4	Very low	34	Very low	150 Å²	150	146.9 Å²	146.9	92%	0.92	81%	0.811	S	S	*	*			trans	-147.6	134.8	167	-27.2	0	0	0	0	110.3
108	Q	32.4	Very low	34.5	Very low	177 Å²	177	145.6 Å²	145.6	83%	0.827	81%	0.81	S	S	*	*			trans	-97.9	151.8	174.7	-63.4	175	-6.8	0	0	110.3
109	T	32	Very low	34.5	Very low	148 Å²	148	150.2 Å²	150.2	91%	0.908	82%	0.82	S	S	*	*			trans	-151.4	135.5	138.3	2.3	0	0	0	0	109.5
110	V	30.4	Very low	35	Very low	111 Å²	111	149.2 Å²	149.2	67%	0.673	82%	0.816	S	S	*	*			trans	-125.8	138.7	175.4	167.1	0	0	0	0	106.1
111	F	30.2	Very low	35	Very low	210 Å²	210	151.3 Å²	151.3	92%	0.921	82%	0.824	S	S	*	*			trans	-161.5	156.4	137.6	-96.9	-59.5	0	0	0	110.9
112	Q	33.8	Very low	35	Very low	166 Å²	166	149.2 Å²	149.2	78%	0.776	82%	0.82	S	S	*	*			trans	-110.4	152.5	-176.1	-54.8	159	-50.4	0	0	109
113	T	32.3	Very low	35.3	Very low	142 Å²	142	151.7 Å²	151.7	87%	0.871	82%	0.824	S	S	*	*				-177.4	124.4	120.2	30.6	0	0	0	0	112.5
114	D	35.4	Very low	35.3	Very low	148 Å²	148	149.1 Å²	149.1	79%	0.791	82%	0.816	S	S	*	*			trans	-70.6	171.8	144.4	-102.5	-45.5	0	0	0	109.9
115	P	55.4	Low	35.4	Very low	101 Å²	101	146.6 Å²	146.6	66%	0.656	82%	0.817	S	S	*	*			cis	-139.4	178.8	17.4	42.9	-25.3	0	0	0	117.3
116	N	40.8	Very low	35.6	Very low	147 Å²	147	143.6 Å²	143.6	79%	0.786	82%	0.815	S	S	*	*			trans	39.4	125.3	145.9	-60.1	-4.9	0	0	0	121.7
117	E	36.2	Very low	35.8	Very low	195 Å²	195	147.3 Å²	147.3	91%	0.911	83%	0.825	S	S	*	*				-151.9	148.7	117	-77.5	-148.7	137.3	0	0	110.2
118	D	43.9	Very low	35.8	Very low	156 Å²	156	149.3 Å²	149.3	83%	0.834	82%	0.824	S	S	*	*			trans	-97.3	136.1	169.7	-71.7	-62.7	0	0	0	110
119	F	32.8	Very low	36	Very low	220 Å²	220	146.5 Å²	146.5	97%	0.965	82%	0.824	S	S	*	*			trans	-161.6	166.3	148.2	-113.7	-72.8	0	0	0	112.3
120	D	39.2	Very low	35.9	Very low	151 Å²	151	148 Å²	148	81%	0.807	82%	0.823	S	S	*	*			trans	-122	165.9	-157.8	-167.3	9	0	0	0	113.6
121	C	33.9	Very low	36.3	Very low	129 Å²	129	150.6 Å²	150.6	87%	0.872	83%	0.832	S	S	*	*			trans	77.2	133.5	165.4	-156.9	0	0	0	0	119.2
122	G	31.6	Very low	36.6	Very low	67 Å²	67	146.5 Å²	146.5	69%	0.691	82%	0.82	S	S	*	*			trans	153.9	63.3	163.2	0	0	0	0	0	121.6
123	Q	36.8	Very low	36.9	Very low	171 Å²	171	146.3 Å²	146.3	80%	0.799	82%	0.821	S	S	*	*			trans	45.2	139.6	146.7	-81.7	-178.2	-98.7	0	0	125.7
124	D	32.3	Very low	37.1	Very low	135 Å²	135	146 Å²	146	72%	0.722	81%	0.809	S	S	*	*			trans	62.5	107.7	139.3	-54.9	-16	0	0	0	123.1
125	A	33.9	Very low	37.3	Very low	106 Å²	106	145.3 Å²	145.3	88%	0.876	81%	0.805	S	S	*	*				178.8	125.7	111.2	0	0	0	0	0	114.1
126	S	36.9	Very low	36.5	Very low	125 Å²	125	147.1 Å²	147.1	87%	0.874	82%	0.815	S	S	*	*			trans	-171.1	161.7	138.1	-162.8	0	0	0	0	110.7
127	T	36.7	Very low	36.2	Very low	138 Å²	138	147 Å²	147	85%	0.847	81%	0.809	S	S	*	*			trans	-106.4	145.4	-158.3	45.5	0	0	0	0	116.2
128	Q	34.8	Very low	36.1	Very low	193 Å²	193	144.9 Å²	144.9	90%	0.902	81%	0.81	S	S	*	*			trans	-88.8	152.2	166.1	-129.9	178.4	11.9	0	0	110
129	S	36.3	Very low	35.7	Very low	117 Å²	117	144.9 Å²	144.9	82%	0.818	81%	0.805	S	S	*	*			trans	-140.9	124.4	168.2	-167.8	0	0	0	0	111.5
130	M	31.2	Very low	35.8	Very low	179 Å²	179	140.2 Å²	140.2	88%	0.882	80%	0.799	S	S	*	*			trans	-149.5	130	174	-93.3	-85.9	-73.4	0	0	105.9
131	L	37.1	Very low	35.6	Very low	167 Å²	167	140.4 Å²	140.4	87%	0.874	80%	0.799	S	S	*	*			trans	-144.4	141.1	174.1	-113.2	171.8	0	0	0	110.4
132	N	36.7	Very low	36.4	Very low	123 Å²	123	140 Å²	140	66%	0.658	79%	0.794	S	S	*	*			trans	-147	141.7	-170.4	-172.5	36	0	0	0	108.6
133	M	40.4	Very low	36.4	Very low	163 Å²	163	143 Å²	143	80%	0.803	80%	0.799	S	S	*	*			trans	-147.9	152.3	-172.9	-86.7	-64	-68.2	0	0	113.4
134	H	36.8	Very low	36	Very low	135 Å²	135	139.9 Å²	139.9	63%	0.625	80%	0.796	S	S	*	*			trans	-145.1	158.9	-166.9	-74.9	-95.6	0	0	0	109.4
135	D	40.4	Very low	36.1	Very low	133 Å²	133	137.3 Å²	137.3	71%	0.711	79%	0.789	S	S	*	*			cis	-156.9	171.4	-9	-132	-52.5	0	0	0	110
136	V	37.2	Very low	36.1	Very low	140 Å²	140	141.1 Å²	141.1	85%	0.848	79%	0.785	S	S	*	*			trans	-142	135.5	167.5	-178.7	0	0	0	0	112.8
137	E	35.7	Very low	35.8	Very low	145 Å²	145	141.3 Å²	141.3	68%	0.678	78%	0.777	S	S	*	*			trans	-79.3	163.6	-175.2	-51	167.1	77.1	0	0	115.5
138	T	32.8	Very low	35.6	Very low	149 Å²	149	141 Å²	141	91%	0.914	77%	0.769	S	S	*	*				-165.8	170.5	111.6	14.8	0	0	0	0	112.7
139	Q	36.3	Very low	35.5	Very low	156 Å²	156	138.8 Å²	138.8	73%	0.729	76%	0.763	S	S	*	*			trans	-119.4	154.3	-154.7	-53.6	165.5	8.7	0	0	113.7
140	S	34.3	Very low	35.4	Very low	122 Å²	122	138.3 Å²	138.3	85%	0.853	76%	0.76	S	S	*	*				167.2	155.5	123.3	49.2	0	0	0	0	114.2
141	I	35.8	Very low	35.6	Very low	155 Å²	155	136.9 Å²	136.9	80%	0.795	76%	0.755	S	S	*	*			trans	-136.8	144	175.1	-39.7	174.8	0	0	0	107.9
142	P	49.9	Very low	35.5	Very low	120 Å²	120	137 Å²	137	78%	0.779	75%	0.751	S	S	*	*				-141.7	123.2	123.2	23.3	-3.4	0	0	0	112.7
143	V	31.4	Very low	35.3	Very low	132 Å²	132	137.9 Å²	137.9	80%	0.8	76%	0.761	S	S	*	*				94.4	138.6	75.9	160.2	0	0	0	0	114.1
144	S	30.1	Very low	35	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	76%	0.76	S	S	*	*			trans	82.6	150	167.1	-165.4	0	0	0	0	118.6
145	S	33.5	Very low	34.9	Very low	80 Å²	80	138.2 Å²	138.2	56%	0.559	77%	0.77	S	S	*	*				-173.7	159.4	-52.2	56.9	0	0	0	0	109.9
146	K	33	Very low	34.6	Very low	186 Å²	186	139.2 Å²	139.2	81%	0.809	78%	0.775	S	S	*	*			trans	70.4	152.6	171.3	-58.3	165.6	-174.9	173.3	0	113.9
147	N	32.5	Very low	34.5	Very low	129 Å²	129	144 Å²	144	69%	0.69	78%	0.78	S	S	*	*			cis	-154.4	140.2	7.3	-127.3	1.7	0	0	0	112.7
148	L	32.2	Very low	34.6	Very low	132 Å²	132	144.2 Å²	144.2	69%	0.691	78%	0.781	S	S	*	*			trans	45.2	129.5	141.8	-64.1	169.2	0	0	0	123.8
149	N	32.4	Very low	35.1	Very low	146 Å²	146	145.5 Å²	145.5	78%	0.781	78%	0.776	S	S	*	*			trans	72.2	147.5	140.2	-62.5	-6.5	0	0	0	119.6
150	S	34.6	Very low	35.5	Very low	107 Å²	107	144.1 Å²	144.1	75%	0.748	78%	0.781	S	S	*	*			cis	-167.6	-176.5	-15.9	-173.8	0	0	0	0	109.7
151	I	35.3	Very low	35.7	Very low	150 Å²	150	145.3 Å²	145.3	77%	0.769	77%	0.771	S	S	*	*			trans	78.1	74.1	167.2	-45	179.2	0	0	0	117.1
152	Q	33.9	Very low	35.9	Very low	170 Å²	170	144.6 Å²	144.6	79%	0.794	77%	0.774	S	S	*	*				8.1	122	120	-179	-177.3	8.9	0	0	119
153	T	33	Very low	35.3	Very low	141 Å²	141	144.5 Å²	144.5	87%	0.865	77%	0.771	S	S	*	*			trans	-151.8	149.5	132	15.9	0	0	0	0	110.4
154	Q	34.8	Very low	35.6	Very low	169 Å²	169	149.7 Å²	149.7	79%	0.79	78%	0.776	S	S	*	*			trans	-96.2	147.3	171.3	-64.7	163.1	-85.1	0	0	109.9
155	T	35.1	Very low	36.4	Very low	136 Å²	136	153.5 Å²	153.5	83%	0.834	78%	0.78	S	S	*	*			trans	-148.6	136.2	156.2	34.7	0	0	0	0	108.9
156	D	33.3	Very low	36.7	Very low	153 Å²	153	155.5 Å²	155.5	82%	0.818	79%	0.791	S	S	*	*			trans	-76.1	158.3	-172.9	-54	-80.7	0	0	0	114
157	Y	34.8	Very low	37	Very low	242 Å²	242	154.6 Å²	154.6	95%	0.949	79%	0.794	S	S	*	*			trans	-83.8	112.9	166	-91.6	-104.4	0	0	0	109.9
158	E	38.6	Very low	37.3	Very low	148 Å²	148	157 Å²	157	69%	0.692	80%	0.798	S	S	*	*			trans	-94.7	138.8	155.4	-87.4	-141.1	134.3	0	0	110.3	K161	E158-K161 IonicContact OE1-NZ 2.64Å; E158-K161 PolarHBondContact OE1-NZ 3.36Å; E158-K161 IonicContact OE2-NZ 2.68Å; E158-K161 PolarHBondContact OE2-NZ 2.92Å
159	E	42.7	Very low	37.8	Very low	176 Å²	176	160.7 Å²	160.7	82%	0.822	81%	0.809	S	S	*	*			trans	-69	146.3	170.3	-72.6	-174.1	107.4	0	0	112.4	K161	E159-K161 PolarHBondContact O-N 3.27Å
160	P	44.9	Very low	38.1	Very low	127 Å²	127	164 Å²	164	83%	0.825	81%	0.812	S	S	*	*			trans	-71.2	96.3	-179.7	29	-35	0	0	0	112.4	T162	P160-T162 PolarHBondContact O-N 3.37Å
161	K	37	Very low	38.4	Very low	147 Å²	147	163.9 Å²	163.9	64%	0.639	81%	0.811	S	S	*	*			trans	-56.1	123.6	175.8	-69.8	158.8	-173.1	151.7	0	111.8	E158 E159 V163	E158-K161 IonicContact OE1-NZ 2.64Å; E158-K161 PolarHBondContact OE1-NZ 3.36Å; E158-K161 IonicContact OE2-NZ 2.68Å; E158-K161 PolarHBondContact OE2-NZ 2.92Å; E159-K161 PolarHBondContact O-N 3.27Å; K161-V163 PolarHBondContact O-N 3.34Å
162	T	40.7	Very low	38.6	Very low	140 Å²	140	165.6 Å²	165.6	86%	0.859	81%	0.813	S	S	*	*			trans	-65.8	121.2	-176.8	-29.6	0	0	0	0	112.3	P160 R164	P160-T162 PolarHBondContact O-N 3.37Å; T162-R164 PolarHBondContact O-N 3.32Å
163	V	37.3	Very low	38.7	Very low	119 Å²	119	163.5 Å²	163.5	72%	0.721	81%	0.812	S	S	*	*			trans	-72.6	111.3	179.3	179.1	0	0	0	0	111	K161	K161-V163 PolarHBondContact O-N 3.34Å
164	R	37	Very low	38.9	Very low	240 Å²	240	164.9 Å²	164.9	91%	0.906	81%	0.809	S	S	*	*			trans	-77.5	121.5	170.1	-75.7	-178.8	171.2	173.5	-1.8	110.9	T162	T162-R164 PolarHBondContact O-N 3.32Å
165	F	46.8	Very low	38.7	Very low	185 Å²	185	165.6 Å²	165.6	81%	0.811	81%	0.812	S	S	*	*			trans	-73.7	139.6	164.4	-71.7	-86	0	0	0	111	L167	F165-L167 PolarHBondContact O-N 2.83Å
166	P	41.7	Very low	38.8	Very low	122 Å²	122	166.9 Å²	166.9	79%	0.792	81%	0.808	S	S	*	*			trans	-77.2	109.9	-178.1	29.5	-33.8	0	0	0	112	K168	P166-K168 PolarHBondContact O-N 3.13Å
167	L	39.4	Very low	39	Very low	168 Å²	168	167.7 Å²	167.7	88%	0.88	81%	0.807	S	S	*	*			trans	-66	117.5	174.1	-171.7	71.1	0	0	0	110.6	F165 K169	F165-L167 PolarHBondContact O-N 2.83Å; L167-K169 PolarHBondContact O-N 3.36Å
168	K	38.7	Very low	39.1	Very low	179 Å²	179	165 Å²	165	78%	0.778	80%	0.8	S	S	*	*			trans	-64.5	119.7	174.6	-76.9	-175.5	176.8	178.5	0	110.3	P166 Y170	P166-K168 PolarHBondContact O-N 3.13Å; K168-Y170 PolarHBondContact O-N 2.96Å
169	K	41.6	Very low	39.4	Very low	209 Å²	209	168.2 Å²	168.2	91%	0.909	81%	0.806	S	S	*	*			trans	-69.5	113.1	170	-65.1	-179.2	-179.8	179.5	0	109.3	L167	L167-K169 PolarHBondContact O-N 3.36Å
170	Y	39.5	Very low	39.5	Very low	216 Å²	216	165.7 Å²	165.7	85%	0.847	81%	0.805	S	S	*	*			trans	-77.4	123.7	164.9	-79.8	-81.8	0	0	0	109.6	K168	K168-Y170 PolarHBondContact O-N 2.96Å
171	S	40.2	Very low	39.1	Very low	105 Å²	105	171.3 Å²	171.3	73%	0.734	81%	0.81	S	S	*	*			trans	-72.1	126.4	173.9	50.2	0	0	0	0	110.4	T173	S171-T173 PolarHBondContact O-N 3.32Å
172	K	39.5	Very low	39.3	Very low	185 Å²	185	174 Å²	174	80%	0.804	82%	0.821	S	S	*	*			trans	-65.5	99.4	176.4	-175.8	-169.2	180	-160.1	0	110.3	E174	K172-E174 PolarHBondContact O-N 2.9Å
173	T	35.2	Very low	39	Very low	127 Å²	127	172.1 Å²	172.1	78%	0.779	81%	0.814	S	S	*	*			trans	-72.7	117.6	169	44.5	0	0	0	0	109.9	S171	S171-T173 PolarHBondContact O-N 3.32Å
174	E	39	Very low	39.3	Very low	169 Å²	169	174.3 Å²	174.3	79%	0.79	82%	0.822	S	S	*	*			trans	-72.6	132.3	167.7	-60.3	-169.2	139.8	0	0	109.3	K172	K172-E174 PolarHBondContact O-N 2.9Å
175	H	30.1	Very low	39.2	Very low	185 Å²	185	168.7 Å²	168.7	86%	0.856	81%	0.814	S	S	*	*			trans	-94.4	101.2	-176.4	-166.6	-52.6	0	0	0	109.5	E177	H175-E177 PolarHBondContact O-N 3.42Å
176	E	36.1	Very low	38.7	Very low	163 Å²	163	165.2 Å²	165.2	76%	0.762	81%	0.813	S	S	*	*			trans	-56.2	135.5	176.9	-87.7	-161.3	131	0	0	112.3	K178	E176-K178 PolarHBondContact O-N 3.09Å; E176-K178 VanDerWaalsContact O-N 3.16Å
177	E	37.6	Very low	38.6	Very low	170 Å²	170	167.3 Å²	167.3	79%	0.794	82%	0.817	S	S	*	*			trans	-82.5	88.9	179.1	-170.7	-171.7	-127	0	0	110.6	H175 R179	H175-E177 PolarHBondContact O-N 3.42Å; E177-R179 PolarHBondContact O-N 3.24Å
178	K	38	Very low	38.4	Very low	186 Å²	186	170.1 Å²	170.1	81%	0.809	82%	0.815	S	S	*	*			trans	-68.9	88.1	175.8	-85.2	-177.8	176.3	169.4	0	112.2	E176 P180	E176-K178 PolarHBondContact O-N 3.09Å; E176-K178 VanDerWaalsContact O-N 3.16Å; K178-P180 WeakPolarHBondContact O-CD 3.4Å
179	R	43.9	Very low	38.4	Very low	215 Å²	215	170 Å²	170	81%	0.811	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-47.9	117.2	167.3	-71.6	-180	173	178	-2.1	111.5	E177	E177-R179 PolarHBondContact O-N 3.24Å
180	P	44.8	Very low	38.1	Very low	123 Å²	123	165 Å²	165	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67.9	138	168.9	27.8	-32.8	0	0	0	110.2	K178	K178-P180 WeakPolarHBondContact O-CD 3.4Å
181	R	37.8	Very low	38	Very low	244 Å²	244	163.4 Å²	163.4	92%	0.921	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.2	140.6	176.2	-75.7	-178.3	171.3	-178.2	-3.1	110.5	S183	R181-S183 PolarHBondContact O-N 3.43Å; R181-S183 VanDerWaalsContact O-N 3.11Å
182	K	39.8	Very low	37.7	Very low	204 Å²	204	167.9 Å²	167.9	89%	0.887	81%	0.809	S	S	*	*			trans	-62.1	109.4	173.5	-63.9	178.6	-179.6	179	0	110.6
183	S	34.4	Very low	37.7	Very low	100 Å²	100	168.4 Å²	168.4	70%	0.699	81%	0.812	S	S	*	*			trans	-89	117.5	163.8	51.3	0	0	0	0	109.7	R181 T185	R181-S183 PolarHBondContact O-N 3.43Å; R181-S183 VanDerWaalsContact O-N 3.11Å; S183-T185 PolarHBondContact O-N 3.33Å; S183-T185 VanDerWaalsContact O-N 3.07Å
184	N	44.8	Very low	37.8	Very low	166 Å²	166	173 Å²	173	89%	0.888	82%	0.815	S	S	*	*			trans	-74	96.3	179.8	-76.2	-23.5	0	0	0	111.4
185	T	34.5	Very low	37.7	Very low	121 Å²	121	170.8 Å²	170.8	74%	0.742	82%	0.815	S	S	*	*			trans	-103.9	121.3	167.9	52	0	0	0	0	110.6	S183	S183-T185 PolarHBondContact O-N 3.33Å; S183-T185 VanDerWaalsContact O-N 3.07Å
186	S	35.8	Very low	37.9	Very low	112 Å²	112	169.4 Å²	169.4	78%	0.783	81%	0.813	S	S	*	*			trans	-61	133.5	-173	-175.1	0	0	0	0	113.7	R188	S186-R188 PolarHBondContact O-N 3.08Å
187	L	39.7	Very low	38.2	Very low	167 Å²	167	168.8 Å²	168.8	87%	0.874	81%	0.813	S	S	*	*			trans	-71.2	84	177.8	-75.5	167.6	0	0	0	112.4	K189	L187-K189 PolarHBondContact O-N 3.22Å
188	R	36.3	Very low	37.9	Very low	226 Å²	226	166.4 Å²	166.4	85%	0.853	81%	0.81	S	S	*	*			trans	-78	101.3	161.9	-74.8	-166.1	174	-159.1	-1.2	110.3	S186 C190	S186-R188 PolarHBondContact O-N 3.08Å; R188-C190 PolarHBondContact O-N 3.06Å
189	K	38	Very low	37.8	Very low	178 Å²	178	163.3 Å²	163.3	77%	0.774	81%	0.807	S	S	*	*			trans	-58.1	99.3	174.8	-67.4	177.8	178.3	177.8	0	110.9	L187 F191	L187-K189 PolarHBondContact O-N 3.22Å; K189-F191 HydrophobicContact CB-CD2 4.31Å; K189-F191 HydrophobicContact CB-CE2 4.1Å; K189-F191 HydrophobicContact CD-CE2 4.45Å; K189-F191 PolarHBondContact O-N 3.13Å; K189-F191 VanDerWaalsContact O-N 3.1Å
190	C	34.6	Very low	37.2	Very low	102 Å²	102	162.5 Å²	162.5	69%	0.689	81%	0.809	S	S	*	*			trans	-78.5	90.8	173.3	-67.2	0	0	0	0	109.8	R188 F192	R188-C190 PolarHBondContact O-N 3.06Å; C190-F192 PolarHBondContact O-N 3.5Å; C190-F192 VanDerWaalsContact O-N 3.14Å
191	F	37.5	Very low	36.6	Very low	184 Å²	184	159.7 Å²	159.7	81%	0.807	80%	0.802	S	S	*	*			trans	-67.6	105.9	169.7	-76.5	-89.9	0	0	0	109.8	K189 K193	K189-F191 HydrophobicContact CB-CD2 4.31Å; K189-F191 HydrophobicContact CB-CE2 4.1Å; K189-F191 HydrophobicContact CD-CE2 4.45Å; K189-F191 PolarHBondContact O-N 3.13Å; K189-F191 VanDerWaalsContact O-N 3.1Å; F191-K193 PolarHBondContact O-N 2.9Å
192	F	34.7	Very low	36.4	Very low	198 Å²	198	151.7 Å²	151.7	87%	0.868	80%	0.796	S	S	*	*			trans	-70	81.4	168	-79	-81.7	0	0	0	110.4	C190 R194	C190-F192 PolarHBondContact O-N 3.5Å; C190-F192 VanDerWaalsContact O-N 3.14Å; F192-R194 PolarHBondContact O-N 2.91Å
193	K	38.7	Very low	36	Very low	197 Å²	197	146.5 Å²	146.5	86%	0.857	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67.3	118.7	171.6	-158.7	174.3	-172.7	179.6	0	108.1	F191	F191-K193 PolarHBondContact O-N 2.9Å
194	R	36.9	Very low	36.1	Very low	224 Å²	224	150.1 Å²	150.1	85%	0.845	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-54.1	139.9	-178.9	-66.9	-179.7	178.9	174.4	-1.2	110.6	F192 L196	F192-R194 PolarHBondContact O-N 2.91Å; R194-L196 PolarHBondContact O-N 2.94Å
195	P	38.5	Very low	35.6	Very low	122 Å²	122	150 Å²	150	79%	0.792	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-65.3	117.9	171.8	27.1	-32.8	0	0	0	109.7	I197	P195-I197 PolarHBondContact O-N 2.98Å
196	L	33.6	Very low	35.4	Very low	156 Å²	156	149.1 Å²	149.1	82%	0.817	80%	0.797	S	S	*	*			trans	-75	107.4	170.5	-98.4	158.7	0	0	0	108.7	R194 V198	R194-L196 PolarHBondContact O-N 2.94Å; L196-V198 VanDerWaalsContact C-N 3.31Å; L196-V198 PolarHBondContact O-N 3.36Å
197	I	41.5	Very low	35.4	Very low	149 Å²	149	148 Å²	148	76%	0.764	79%	0.789	S	S	*	*			trans	-74.3	90.1	169.3	-57.4	177.9	0	0	0	107.4	P195 V199	P195-I197 PolarHBondContact O-N 2.98Å; I197-V199 HydrophobicContact CG2-CG2 4.36Å; I197-V199 PolarHBondContact O-N 2.97Å
198	V	31.4	Very low	35	Very low	120 Å²	120	146.5 Å²	146.5	73%	0.727	78%	0.782	S	S	*	*			trans	-74	94.8	171.3	-179.2	0	0	0	0	108	L196 K200	L196-V198 VanDerWaalsContact C-N 3.31Å; L196-V198 PolarHBondContact O-N 3.36Å; V198-K200 PolarHBondContact O-N 3.3Å; V198-K200 VanDerWaalsContact O-N 3.14Å
199	V	36.2	Very low	34.7	Very low	122 Å²	122	145.9 Å²	145.9	74%	0.739	79%	0.786	S	S	*	*			trans	-63.4	113.2	166.4	179.6	0	0	0	0	107.3	I197 G201	I197-V199 HydrophobicContact CG2-CG2 4.36Å; I197-V199 PolarHBondContact O-N 2.97Å; V199-G201 PolarHBondContact O-N 3.17Å
200	K	32.4	Very low	34.5	Very low	198 Å²	198	143.8 Å²	143.8	86%	0.861	79%	0.788	S	S	*	*			trans	-74.5	94.8	178.1	-146.1	-177.2	-172.6	-171.1	0	108.1	V198 G202	V198-K200 PolarHBondContact O-N 3.3Å; V198-K200 VanDerWaalsContact O-N 3.14Å; K200-G202 PolarHBondContact O-N 2.85Å
201	G	31.4	Very low	34.3	Very low	64 Å²	64	142.6 Å²	142.6	66%	0.66	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-56.6	136.6	176.8	0	0	0	0	0	110.9	V199 A203	V199-G201 PolarHBondContact O-N 3.17Å; G201-A203 PolarHBondContact O-N 3.31Å
202	G	34.3	Very low	34	Very low	76 Å²	76	140.5 Å²	140.5	78%	0.784	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-64.6	126.1	174.6	0	0	0	0	0	110	K200 L204	K200-G202 PolarHBondContact O-N 2.85Å; G202-L204 PolarHBondContact O-N 3.23Å
203	A	31.7	Very low	33.9	Very low	94 Å²	94	139.3 Å²	139.3	78%	0.777	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71	127.9	172.4	0	0	0	0	0	109.3	G201 I205	G201-A203 PolarHBondContact O-N 3.31Å; A203-I205 PolarHBondContact O-N 3.18Å
204	L	35.9	Very low	33.6	Very low	176 Å²	176	137.2 Å²	137.2	92%	0.921	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-64.9	123.6	169.3	-66.2	165	0	0	0	108.4	G202	G202-L204 PolarHBondContact O-N 3.23Å
205	I	33.4	Very low	33.5	Very low	165 Å²	165	135.3 Å²	135.3	85%	0.846	78%	0.778	S	S	*	*			trans	-91.9	112.9	163.9	-62.1	179.9	0	0	0	106.1	A203	A203-I205 PolarHBondContact O-N 3.18Å
206	S	31.1	Very low	33.1	Very low	101 Å²	101	134.6 Å²	134.6	71%	0.706	78%	0.776	S	S	*	*			trans	-66.5	159.8	173.6	-172.9	0	0	0	0	110.7
207	S	35.7	Very low	33	Very low	88 Å²	88	136.5 Å²	136.5	62%	0.615	77%	0.772	S	S	*	*			trans	-65.8	177.7	160.3	63.1	0	0	0	0	111.4
208	D	32.2	Very low	32.7	Very low	136 Å²	136	135 Å²	135	73%	0.727	76%	0.763	S	S	*	*			trans	86.3	94.6	166	-48	-1.3	0	0	0	115.4
209	F	29.8	Very low	32.8	Very low	214 Å²	214	136.4 Å²	136.4	94%	0.939	76%	0.762	S	S	*	*				-155.6	132.8	117.6	-121.3	-79.4	0	0	0	111.3
210	T	32.6	Very low	32.8	Very low	133 Å²	133	138.4 Å²	138.4	82%	0.816	77%	0.768	S	S	*	*			trans	-106	168.2	-176.4	2.3	0	0	0	0	112.3
211	A	31.8	Very low	32.8	Very low	77 Å²	77	135 Å²	135	64%	0.636	76%	0.764	S	S	*	*			trans	84.4	125.3	157.3	0	0	0	0	0	119.9
212	N	31.1	Very low	32.8	Very low	141 Å²	141	137.3 Å²	137.3	75%	0.754	77%	0.77	S	S	*	*			trans	59.5	123.4	136.4	-55.7	-11.9	0	0	0	120.9
213	I	32.3	Very low	32.6	Very low	172 Å²	172	139.3 Å²	139.3	88%	0.882	77%	0.767	S	S	*	*				-158.3	159.8	94.5	-100.3	163.2	0	0	0	111.2
214	H	32.4	Very low	32.5	Very low	153 Å²	153	141 Å²	141	71%	0.708	77%	0.767	S	S	*	*			trans	-88.1	174.3	-168.2	-88	-101.7	0	0	0	115.3
215	Q	34.3	Very low	32.3	Very low	184 Å²	184	138.3 Å²	138.3	86%	0.86	76%	0.759	S	S	*	*			trans	74.4	149.1	146.7	-85.2	157.5	-14.2	0	0	116.5
216	S	30.4	Very low	32.1	Very low	108 Å²	108	139.9 Å²	139.9	76%	0.755	75%	0.754	S	S	*	*			cis	-158.4	174	3.8	84.6	0	0	0	0	108.8
217	R	32	Very low	32.3	Very low	196 Å²	196	143.6 Å²	143.6	74%	0.74	76%	0.757	S	S	*	*			cis	-176.3	156.7	-9.3	142.4	-176.1	168.9	-165.8	-6.3	108.1
218	M	34.3	Very low	32.5	Very low	117 Å²	117	145.7 Å²	145.7	58%	0.576	76%	0.758	S	S	*	*			trans	69.1	125.4	170	-79.8	165.1	164.9	0	0	116.1
219	E	33.6	Very low	32.6	Very low	149 Å²	149	145.4 Å²	145.4	70%	0.696	76%	0.756	S	S	*	*			cis	96.5	118.7	46	-80.6	166.9	-151.7	0	0	112.7
220	N	35.9	Very low	32.8	Very low	164 Å²	164	143.6 Å²	143.6	88%	0.877	75%	0.748	S	S	*	*				-172.2	163	115.7	-100.2	-62.7	0	0	0	112.2
221	V	32.6	Very low	33.3	Very low	127 Å²	127	144.4 Å²	144.4	77%	0.77	74%	0.742	S	S	*	*			trans	-132.2	126.6	-167.3	174.4	0	0	0	0	112.8	V223	V221-V223 HydrophobicContact CG1-CG2 4.3Å
222	S	31.3	Very low	33.7	Very low	113 Å²	113	147.4 Å²	147.4	79%	0.79	75%	0.753	S	S	*	*			trans	178.5	129.7	154.2	33.1	0	0	0	0	107.9
223	V	30.1	Very low	34.1	Very low	118 Å²	118	147.9 Å²	147.9	72%	0.715	75%	0.75	S	S	*	*			cis	89.1	136.2	27.9	-174.6	0	0	0	0	113.3	V221	V221-V223 HydrophobicContact CG1-CG2 4.3Å
224	T	29.2	Very low	34.1	Very low	128 Å²	128	150.8 Å²	150.8	79%	0.785	75%	0.752	S	S	*	*			trans	75.4	146.3	-171.4	70.1	0	0	0	0	115.4
225	T	32.1	Very low	34.1	Very low	121 Å²	121	150.8 Å²	150.8	74%	0.742	75%	0.752	S	S	*	*			cis	-156.5	135.6	-7.7	11.4	0	0	0	0	107.7
226	R	29.8	Very low	34.1	Very low	197 Å²	197	147.8 Å²	147.8	74%	0.743	74%	0.742	S	S	*	*				75.2	139	82.2	-165.6	175.4	-179.6	-176.1	1.9	116.7	E228	R226-E228 IonicContact CZ-OE1 2.81Å; R226-E228 IonicContact NE-OE1 3.02Å; R226-E228 PolarHBondContact NE-OE1 3.43Å; R226-E228 IonicContact NH2-OE1 2.75Å; R226-E228 PolarHBondContact NH2-OE1 2.96Å
227	K	34.7	Very low	34.1	Very low	179 Å²	179	149.6 Å²	149.6	78%	0.778	74%	0.739	S	S	*	*			trans	102	125.3	175.7	-63	-168.7	174.1	-172.4	0	113.6
228	E	40.4	Very low	34	Very low	132 Å²	132	149.4 Å²	149.4	62%	0.617	74%	0.743	S	S	*	*			cis	91.5	153.9	37.8	-65.3	159.2	-166.9	0	0	112.5	R226	R226-E228 IonicContact CZ-OE1 2.81Å; R226-E228 IonicContact NE-OE1 3.02Å; R226-E228 PolarHBondContact NE-OE1 3.43Å; R226-E228 IonicContact NH2-OE1 2.75Å; R226-E228 PolarHBondContact NH2-OE1 2.96Å
229	D	32.9	Very low	34	Very low	130 Å²	130	147 Å²	147	70%	0.695	75%	0.749	S	S	*	*			trans	73.9	140.1	-168.3	-71	-8.4	0	0	0	116.6
230	K	35.3	Very low	34	Very low	177 Å²	177	147 Å²	147	77%	0.77	76%	0.759	S	S	*	*			cis	-151.9	154.9	2	-126.4	159.8	-171	126.9	0	114
231	E	42.6	Very low	34.2	Very low	150 Å²	150	147.6 Å²	147.6	70%	0.701	76%	0.756	S	S	*	*			trans	-100.5	143.5	171.4	174.9	-173.6	-171.6	0	0	110.2
232	T	39.8	Very low	34.3	Very low	139 Å²	139	147.2 Å²	147.2	85%	0.853	76%	0.759	S	S	*	*			trans	-147.3	129.8	160.6	49.8	0	0	0	0	111.3
233	Q	39.6	Very low	34.6	Very low	151 Å²	151	148.5 Å²	148.5	71%	0.706	76%	0.757	S	S	*	*			trans	-86.9	166	174.8	-59.9	156.4	-2.7	0	0	111
234	Y	33.5	Very low	34.8	Very low	234 Å²	234	148.7 Å²	148.7	92%	0.918	76%	0.764	S	S	*	*			trans	-158.7	160.2	135.6	-111.3	-71.2	0	0	0	110.6
235	E	32.8	Very low	35.1	Very low	152 Å²	152	147.2 Å²	147.2	71%	0.71	76%	0.759	S	S	*	*			trans	-105.7	165.4	-161	-60.4	-178.4	83.7	0	0	114.9
236	N	32.8	Very low	35.7	Very low	121 Å²	121	149 Å²	149	65%	0.647	76%	0.764	S	S	*	*			trans	34.7	146.1	133	-59.8	-37.8	0	0	0	120
237	H	31.8	Very low	36.1	Very low	147 Å²	147	147.7 Å²	147.7	68%	0.681	77%	0.772	S	S	*	*				-177.9	175	51.6	-134.5	-10.9	0	0	0	113.3
238	F	30.1	Very low	36.9	Very low	191 Å²	191	147.9 Å²	147.9	84%	0.838	78%	0.776	S	S	*	*			trans	63.7	146.7	165.2	-65.8	-65.8	0	0	0	121.5
239	G	34.1	Very low	37.1	Very low	67 Å²	67	147.4 Å²	147.4	69%	0.691	78%	0.784	S	S	*	*			trans	-155.6	172.8	168.2	0	0	0	0	0	109.8
240	T	33	Very low	37.9	Very low	149 Å²	149	146.5 Å²	146.5	91%	0.914	79%	0.787	S	S	*	*			trans	-149.4	158	177.9	-49.6	0	0	0	0	110.8
241	Q	40.6	Very low	38.7	Very low	176 Å²	176	144.1 Å²	144.1	82%	0.822	78%	0.783	S	S	*	*			trans	-78	153.7	-175.1	-60.1	165.2	-22.3	0	0	113.7
242	S	34	Very low	39.4	Very low	119 Å²	119	142.3 Å²	142.3	83%	0.832	79%	0.785	S	S	*	*			trans	-153.3	140.2	150.6	57.5	0	0	0	0	110
243	N	37	Very low	40.7	Very low	140 Å²	140	137.8 Å²	137.8	75%	0.749	76%	0.758	S	S	*	*			trans	-102.6	161.7	-170.2	-63.2	-43.5	0	0	0	113.5
244	S	35.3	Very low	42.2	Very low	123 Å²	123	134.8 Å²	134.8	86%	0.86	75%	0.751	S	S	*	*			trans	68.1	152.8	164.5	75.2	0	0	0	0	116.6
245	S	35.2	Very low	44.1	Very low	96 Å²	96	127.9 Å²	127.9	67%	0.671	74%	0.736	S	S	*	*			cis	-148.8	147	5.5	53.6	0	0	0	0	112.3
246	D	45.1	Very low	46.4	Very low	159 Å²	159	123.8 Å²	123.8	85%	0.85	72%	0.724	S	S	*	*			trans	44.6	75.3	150.6	-56.2	-17	0	0	0	119.7
247	D	38.6	Very low	49	Very low	169 Å²	169	123.7 Å²	123.7	90%	0.904	72%	0.718	S	S	*	*			trans	-98.5	118	156.2	-104.9	-41.3	0	0	0	110.3
248	Q	50.2	Low	51.8	Low	184 Å²	184	121.5 Å²	121.5	86%	0.86	71%	0.71	S	S	*	*			trans	-84.7	127.5	179.8	-167.5	176.6	45.3	0	0	110.3	S250	Q248-S250 PolarHBondContact O-N 3.13Å
249	P	44.4	Very low	54.7	Low	121 Å²	121	117.3 Å²	117.3	79%	0.786	70%	0.696	S	S	*	*			trans	-67.9	110	-174.8	26.2	-34.3	0	0	0	111.6	D251	P249-D251 PolarHBondContact O-N 3.23Å
250	S	50.9	Low	57.5	Low	111 Å²	111	118.8 Å²	118.8	78%	0.776	69%	0.688	S	S	*	*			trans	-64.1	129.5	178.3	62.8	0	0	0	0	111.8	Q248	Q248-S250 PolarHBondContact O-N 3.13Å
251	D	52	Low	60.3	Low	127 Å²	127	120.6 Å²	120.6	68%	0.679	68%	0.678	S	S	*	*			trans	-46.6	122.7	-172.4	-92.9	-50.8	0	0	0	114.8	P249 S253	P249-D251 PolarHBondContact O-N 3.23Å; D251-S253 PolarHBondContact O-N 3.5Å
252	P	56.3	Low	62.9	Low	113 Å²	113	116.1 Å²	116.1	73%	0.734	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-3.1	174.8	28.1	-34.6	0	0	0	113.6	T254 C255	P252-T254 PolarHBondContact O-N 3.12Å; P252-T254 VanDerWaalsContact O-N 3.15Å; P252-C255 PolarHBondContact O-N 3Å
253	S	68.6	Low	65.8	Low	43 Å²	43	116.4 Å²	116.4	30%	0.301	65%	0.65	S	S	.	*	H	α-helix	trans	-61.7	-24.9	-173.6	82.4	0	0	0	0	114.5	D251 K257	D251-S253 PolarHBondContact O-N 3.5Å; S253-K257 VanDerWaalsContact O-CD 3.25Å; S253-K257 WeakPolarHBondContact O-CD 3.45Å; S253-K257 VanDerWaalsContact O-CG 3.23Å; S253-K257 WeakPolarHBondContact O-CG 3.43Å; S253-K257 PolarHBondContact O-N 3.29Å; S253-K257 PolarHBondContact OG-NZ 2.93Å
254	T	69.8	Low	68.7	Low	88 Å²	88	116.8 Å²	116.8	54%	0.54	65%	0.645	S	S	.	*	H	α-helix	trans	-71.5	-40.6	-176.4	-56.5	0	0	0	0	112.4	P252 K257 I258	P252-T254 PolarHBondContact O-N 3.12Å; P252-T254 VanDerWaalsContact O-N 3.15Å; T254-K257 PolarHBondContact O-N 3.17Å; T254-I258 HydrophobicContact CG2-CD1 4.45Å; T254-I258 WeakPolarHBondContact O-CG1 3.39Å; T254-I258 PolarHBondContact O-N 3.38Å
255	C	73.4	Confident	71.3	Confident	89 Å²	89	116.2 Å²	116.2	60%	0.601	63%	0.632	S	S	*	*	H	α-helix	trans	-68.5	-38.8	178.3	-67.5	0	0	0	0	111.8	P252 K257 I258 L259	P252-C255 PolarHBondContact O-N 3Å; C255-K257 PolarHBondContact O-N 2.63Å; C255-I258 PolarHBondContact O-N 3.13Å; C255-I258 VanDerWaalsContact O-N 3.16Å; C255-L259 PolarHBondContact O-N 3.35Å; C255-L259 VanDerWaalsContact O-N 3.08Å
256	S	81.9	Confident	74.3	Confident	66 Å²	66	115.9 Å²	115.9	46%	0.462	62%	0.62	S	S	.	*	H	α-helix	trans	-59.9	-46.1	175	-160.2	0	0	0	0	111.7	I258 L259 D260	S256-I258 PolarHBondContact O-N 3.48Å; S256-L259 PolarHBondContact O-N 2.94Å; S256-L259 VanDerWaalsContact O-N 3.13Å; S256-D260 PolarHBondContact O-N 2.6Å
257	K	87	Confident	76.6	Confident	120 Å²	120	110.8 Å²	110.8	52%	0.522	60%	0.6	S	S	.	*	H	α-helix	trans	-62.2	-23.4	177.4	-69.5	160.5	-172.4	159.8	0	113.6	S253 T254 C255 R261	S253-K257 VanDerWaalsContact O-CD 3.25Å; S253-K257 WeakPolarHBondContact O-CD 3.45Å; S253-K257 VanDerWaalsContact O-CG 3.23Å; S253-K257 WeakPolarHBondContact O-CG 3.43Å; S253-K257 PolarHBondContact O-N 3.29Å; S253-K257 PolarHBondContact OG-NZ 2.93Å; T254-K257 PolarHBondContact O-N 3.17Å; C255-K257 PolarHBondContact O-N 2.63Å; K257-R261 VanDerWaalsContact O-CG 3.32Å; K257-R261 WeakPolarHBondContact O-CG 3.49Å
258	I	89.9	Confident	79.3	Confident	100 Å²	100	106.5 Å²	106.5	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-80.1	-45	174.1	-67.1	166.7	0	0	0	110.1	T254 C255 S256 D260 R261 V262	T254-I258 HydrophobicContact CG2-CD1 4.45Å; T254-I258 WeakPolarHBondContact O-CG1 3.39Å; T254-I258 PolarHBondContact O-N 3.38Å; C255-I258 PolarHBondContact O-N 3.13Å; C255-I258 VanDerWaalsContact O-N 3.16Å; S256-I258 PolarHBondContact O-N 3.48Å; I258-D260 PolarHBondContact O-N 3.38Å; I258-R261 WeakPolarHBondContact O-CB 3.42Å; I258-R261 PolarHBondContact O-N 3.5Å; I258-V262 WeakPolarHBondContact O-CG2 3.28Å; I258-V262 PolarHBondContact O-N 3.45Å
259	L	92.1	Very high	81.3	Confident	104 Å²	104	104 Å²	104	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-59.9	-45.6	176.4	-74	164.3	0	0	0	112.1	C255 S256 R261 V262 Q263	C255-L259 PolarHBondContact O-N 3.35Å; C255-L259 VanDerWaalsContact O-N 3.08Å; S256-L259 PolarHBondContact O-N 2.94Å; S256-L259 VanDerWaalsContact O-N 3.13Å; L259-R261 VanDerWaalsContact C-N 3.26Å; L259-R261 PolarHBondContact O-N 3.23Å; L259-V262 PolarHBondContact O-N 2.93Å; L259-V262 VanDerWaalsContact O-N 3.12Å; L259-Q263 WeakPolarHBondContact O-CG 3.44Å; L259-Q263 PolarHBondContact O-N 3Å
260	D	92.4	Very high	83.8	Confident	97 Å²	97	103.8 Å²	103.8	52%	0.519	55%	0.552	S	S	.	*	H	α-helix	trans	-56.4	-40.1	174.7	-71.8	-8.8	0	0	0	112.2	S256 I258 K264	S256-D260 PolarHBondContact O-N 2.6Å; I258-D260 PolarHBondContact O-N 3.38Å; D260-K264 VanDerWaalsContact O-CB 3.24Å; D260-K264 WeakPolarHBondContact O-CB 3.39Å; D260-K264 PolarHBondContact O-N 3.42Å
261	R	91.9	Very high	85.9	Confident	188 Å²	188	107.8 Å²	107.8	71%	0.709	55%	0.55	S	S	*	*	H	α-helix	trans	-68.8	-38.8	177.8	-78.8	177.4	171.2	-157	-2	112.1	K257 I258 L259 L265	K257-R261 VanDerWaalsContact O-CG 3.32Å; K257-R261 WeakPolarHBondContact O-CG 3.49Å; I258-R261 WeakPolarHBondContact O-CB 3.42Å; I258-R261 PolarHBondContact O-N 3.5Å; L259-R261 VanDerWaalsContact C-N 3.26Å; L259-R261 PolarHBondContact O-N 3.23Å; R261-L265 WeakPolarHBondContact O-CG 3.25Å; R261-L265 PolarHBondContact O-N 3.24Å
262	V	95.7	Very high	88	Confident	81 Å²	81	107.4 Å²	107.4	49%	0.491	55%	0.545	S	S	.	.	H	α-helix	trans	-65.4	-49.6	175.8	172.7	0	0	0	0	110.5	I258 L259 K264 L265 E266	I258-V262 WeakPolarHBondContact O-CG2 3.28Å; I258-V262 PolarHBondContact O-N 3.45Å; L259-V262 PolarHBondContact O-N 2.93Å; L259-V262 VanDerWaalsContact O-N 3.12Å; V262-K264 VanDerWaalsContact C-N 3.3Å; V262-K264 PolarHBondContact O-N 3.19Å; V262-L265 PolarHBondContact O-N 3.02Å; V262-L265 VanDerWaalsContact O-N 3.13Å; V262-E266 PolarHBondContact O-N 2.97Å
263	Q	95.1	Very high	89.9	Confident	125 Å²	125	106.6 Å²	106.6	58%	0.584	53%	0.531	S	S	*	.	H	α-helix	trans	-59.8	-39.8	177	-68.5	-178.5	7.5	0	0	112	L259 L265 E266 A267	L259-Q263 WeakPolarHBondContact O-CG 3.44Å; L259-Q263 PolarHBondContact O-N 3Å; Q263-L265 PolarHBondContact O-N 2.99Å; Q263-E266 PolarHBondContact O-N 2.67Å; Q263-A267 WeakPolarHBondContact O-CB 3.39Å; Q263-A267 PolarHBondContact O-N 3.5Å
264	K	96	Very high	91.1	Very high	149 Å²	149	109.4 Å²	109.4	65%	0.648	54%	0.542	S	S	*	.	H	α-helix	trans	-63.9	-38.7	175.4	-174.2	173.3	-177.6	175.1	0	112.8	D260 V262 I268	D260-K264 VanDerWaalsContact O-CB 3.24Å; D260-K264 WeakPolarHBondContact O-CB 3.39Å; D260-K264 PolarHBondContact O-N 3.42Å; V262-K264 VanDerWaalsContact C-N 3.3Å; V262-K264 PolarHBondContact O-N 3.19Å; K264-I268 HydrophobicContact CG-CD1 4.43Å; K264-I268 WeakPolarHBondContact O-CD1 3.36Å; K264-I268 VanDerWaalsContact O-CG1 3.31Å; K264-I268 WeakPolarHBondContact O-CG1 3.36Å; K264-I268 PolarHBondContact O-N 3.04Å
265	L	92	Very high	92.3	Very high	110 Å²	110	111.8 Å²	111.8	58%	0.576	55%	0.545	S	S	*	.	H	α-helix	trans	-68.6	-42.8	175.4	-75.7	166.4	0	0	0	111.7	R261 V262 Q263 A267 I268 M269	R261-L265 WeakPolarHBondContact O-CG 3.25Å; R261-L265 PolarHBondContact O-N 3.24Å; V262-L265 PolarHBondContact O-N 3.02Å; V262-L265 VanDerWaalsContact O-N 3.13Å; Q263-L265 PolarHBondContact O-N 2.99Å; L265-A267 VanDerWaalsContact C-N 3.33Å; L265-A267 PolarHBondContact O-N 3.4Å; L265-I268 WeakPolarHBondContact O-CB 3.48Å; L265-I268 PolarHBondContact O-N 2.97Å; L265-I268 VanDerWaalsContact O-N 3.12Å; L265-M269 PolarHBondContact O-N 3.1Å
266	E	96.6	Very high	93.2	Very high	90 Å²	90	113 Å²	113	42%	0.421	55%	0.546	S	S	.	.	H	α-helix	trans	-60	-42.7	176.4	-165.1	-166.6	147.6	0	0	111.8	V262 Q263 I268 M269 K270	V262-E266 PolarHBondContact O-N 2.97Å; Q263-E266 PolarHBondContact O-N 2.67Å; E266-I268 VanDerWaalsContact C-N 3.3Å; E266-I268 PolarHBondContact O-N 3.4Å; E266-M269 PolarHBondContact O-N 3.37Å; E266-K270 HydrophobicContact CG-CD 4.38Å; E266-K270 WeakPolarHBondContact O-CG 3.23Å; E266-K270 PolarHBondContact O-N 3.28Å; E266-K270 VanDerWaalsContact OE1-CE 3.29Å; E266-K270 WeakPolarHBondContact OE1-CE 3.43Å; E266-K270 IonicContact OE1-NZ 3.27Å; E266-K270 PolarHBondContact OE1-NZ 3.12Å
267	A	94.1	Very high	93.5	Very high	51 Å²	51	117.6 Å²	117.6	42%	0.421	55%	0.553	S	S	.	*	H	α-helix	trans	-63.7	-32.4	175.4	0	0	0	0	0	113.1	Q263 L265 R271	Q263-A267 WeakPolarHBondContact O-CB 3.39Å; Q263-A267 PolarHBondContact O-N 3.5Å; L265-A267 VanDerWaalsContact C-N 3.33Å; L265-A267 PolarHBondContact O-N 3.4Å; A267-R271 WeakPolarHBondContact O-CG 3.27Å; A267-R271 PolarHBondContact O-N 3.43Å
268	I	95.2	Very high	93.7	Very high	79 Å²	79	117 Å²	117	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-70.7	-46.2	173.9	-69.4	163.8	0	0	0	110.4	K264 L265 E266 K270 R271 Q272	K264-I268 HydrophobicContact CG-CD1 4.43Å; K264-I268 WeakPolarHBondContact O-CD1 3.36Å; K264-I268 VanDerWaalsContact O-CG1 3.31Å; K264-I268 WeakPolarHBondContact O-CG1 3.36Å; K264-I268 PolarHBondContact O-N 3.04Å; L265-I268 WeakPolarHBondContact O-CB 3.48Å; L265-I268 PolarHBondContact O-N 2.97Å; L265-I268 VanDerWaalsContact O-N 3.12Å; E266-I268 VanDerWaalsContact C-N 3.3Å; E266-I268 PolarHBondContact O-N 3.4Å; I268-K270 PolarHBondContact O-N 3.3Å; I268-R271 PolarHBondContact O-N 2.93Å; I268-Q272 PolarHBondContact O-N 2.91Å
269	M	92.9	Very high	93.5	Very high	132 Å²	132	116.6 Å²	116.6	65%	0.65	55%	0.553	S	S	*	*	H	α-helix	trans	-61.1	-43.3	177.6	-71.3	-178.3	65.8	0	0	112.1	L265 E266 R271 Q272 E273	L265-M269 PolarHBondContact O-N 3.1Å; E266-M269 PolarHBondContact O-N 3.37Å; M269-R271 VanDerWaalsContact C-N 3.31Å; M269-R271 PolarHBondContact O-N 3.12Å; M269-Q272 PolarHBondContact O-N 2.77Å; M269-Q272 VanDerWaalsContact O-N 3.1Å; M269-E273 PolarHBondContact O-N 2.68Å
270	K	95.6	Very high	93.4	Very high	116 Å²	116	117 Å²	117	50%	0.504	55%	0.553	S	S	.	*	H	α-helix	trans	-61.4	-35.9	176.4	-76.8	173.7	169.6	173.1	0	112.9	E266 I268 L274	E266-K270 HydrophobicContact CG-CD 4.38Å; E266-K270 WeakPolarHBondContact O-CG 3.23Å; E266-K270 PolarHBondContact O-N 3.28Å; E266-K270 VanDerWaalsContact OE1-CE 3.29Å; E266-K270 WeakPolarHBondContact OE1-CE 3.43Å; E266-K270 IonicContact OE1-NZ 3.27Å; E266-K270 PolarHBondContact OE1-NZ 3.12Å; I268-K270 PolarHBondContact O-N 3.3Å; K270-L274 WeakPolarHBondContact O-CG 3.46Å; K270-L274 PolarHBondContact O-N 3.14Å; K270-L274 VanDerWaalsContact O-N 3.12Å
271	R	95.1	Very high	93	Very high	195 Å²	195	114.1 Å²	114.1	74%	0.736	55%	0.546	S	S	*	.	H	α-helix	trans	-67.6	-38.5	172.1	-73.7	178.7	-176.5	-174.1	1.7	112.7	A267 I268 M269 F275	A267-R271 WeakPolarHBondContact O-CG 3.27Å; A267-R271 PolarHBondContact O-N 3.43Å; I268-R271 PolarHBondContact O-N 2.93Å; M269-R271 VanDerWaalsContact C-N 3.31Å; M269-R271 PolarHBondContact O-N 3.12Å; R271-F275 WeakPolarHBondContact O-CB 3.48Å; R271-F275 PolarHBondContact O-N 2.99Å
272	Q	95.9	Very high	92.5	Very high	119 Å²	119	108.5 Å²	108.5	56%	0.556	54%	0.535	S	S	*	.	H	α-helix	trans	-67.1	-39.1	176.3	-71.4	176.4	-27.4	0	0	111.8	I268 M269 F275 L276	I268-Q272 PolarHBondContact O-N 2.91Å; M269-Q272 PolarHBondContact O-N 2.77Å; M269-Q272 VanDerWaalsContact O-N 3.1Å; Q272-F275 PolarHBondContact O-N 2.85Å; Q272-L276 WeakPolarHBondContact O-CG 3.41Å; Q272-L276 PolarHBondContact O-N 3.35Å
273	E	96	Very high	91.5	Very high	96 Å²	96	108.6 Å²	108.6	45%	0.449	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-45.4	175	-161.1	-157.2	142.1	0	0	111.9	M269 L276 R277	M269-E273 PolarHBondContact O-N 2.68Å; E273-L276 PolarHBondContact O-N 2.95Å; E273-R277 WeakPolarHBondContact O-CG 3.48Å; E273-R277 PolarHBondContact O-N 3.47Å; E273-R277 IonicContact OE1-CZ 3.58Å; E273-R277 IonicContact OE1-NE 2.66Å; E273-R277 PolarHBondContact OE1-NE 3.05Å; E273-R277 IonicContact OE1-NH2 3.76Å; E273-R277 PolarHBondContact OE1-NH2 3.08Å
274	L	94.8	Very high	90.6	Very high	103 Å²	103	108.6 Å²	108.6	54%	0.539	53%	0.534	S	S	.	.	H	α-helix	trans	-57.6	-49.5	174.8	-74.8	167.4	0	0	0	111.4	K270 L276 R277 D278	K270-L274 WeakPolarHBondContact O-CG 3.46Å; K270-L274 PolarHBondContact O-N 3.14Å; K270-L274 VanDerWaalsContact O-N 3.12Å; L274-L276 VanDerWaalsContact C-N 3.28Å; L274-L276 PolarHBondContact O-N 2.77Å; L274-R277 WeakPolarHBondContact O-CB 3.31Å; L274-R277 PolarHBondContact O-N 3.1Å; L274-D278 PolarHBondContact O-N 3.09Å
275	F	93.9	Very high	89.4	Confident	137 Å²	137	105 Å²	105	60%	0.601	53%	0.527	S	S	*	.	H	α-helix	trans	-59.4	-36.8	178.3	-169.6	-97.5	0	0	0	112.8	R271 Q272 L279	R271-F275 WeakPolarHBondContact O-CB 3.48Å; R271-F275 PolarHBondContact O-N 2.99Å; Q272-F275 PolarHBondContact O-N 2.85Å; F275-L279 WeakPolarHBondContact O-CB 3.29Å; F275-L279 PolarHBondContact O-N 2.84Å
276	L	92.5	Very high	87.8	Confident	116 Å²	116	109.3 Å²	109.3	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-70.3	-35	174.5	-72	170.1	0	0	0	112.9	Q272 E273 L274 Q280	Q272-L276 WeakPolarHBondContact O-CG 3.41Å; Q272-L276 PolarHBondContact O-N 3.35Å; E273-L276 PolarHBondContact O-N 2.95Å; L274-L276 VanDerWaalsContact C-N 3.28Å; L274-L276 PolarHBondContact O-N 2.77Å; L276-Q280 WeakPolarHBondContact O-CB 3.24Å; L276-Q280 PolarHBondContact O-N 2.95Å
277	R	88.6	Confident	86.1	Confident	162 Å²	162	112.7 Å²	112.7	61%	0.611	55%	0.549	S	S	*	.	H	α-helix	trans	-66.6	-43.8	172.9	-72.2	177.9	-178.9	-113.4	5.6	111.3	E273 L274 Q280 G281	E273-R277 WeakPolarHBondContact O-CG 3.48Å; E273-R277 PolarHBondContact O-N 3.47Å; E273-R277 IonicContact OE1-CZ 3.58Å; E273-R277 IonicContact OE1-NE 2.66Å; E273-R277 PolarHBondContact OE1-NE 3.05Å; E273-R277 IonicContact OE1-NH2 3.76Å; E273-R277 PolarHBondContact OE1-NH2 3.08Å; L274-R277 WeakPolarHBondContact O-CB 3.31Å; L274-R277 PolarHBondContact O-N 3.1Å; R277-Q280 PolarHBondContact O-N 3.29Å; R277-G281 PolarHBondContact O-N 2.95Å
278	D	90.9	Very high	84.4	Confident	106 Å²	106	116.5 Å²	116.5	57%	0.567	57%	0.567	S	S	*	*	H	α-helix	trans	-61.8	-46.9	176.9	-67.1	-23.6	0	0	0	111	L274 Q280 G281 S282	L274-D278 PolarHBondContact O-N 3.09Å; D278-Q280 VanDerWaalsContact C-N 3.3Å; D278-Q280 PolarHBondContact O-N 3.2Å; D278-G281 CarbonylContact O-C 3.56Å; D278-G281 WeakPolarHBondContact O-CA 3.48Å; D278-G281 PolarHBondContact O-N 3.39Å; D278-S282 PolarHBondContact O-N 3.24Å; D278-S282 PolarHBondContact O-OG 3.48Å
279	L	86.6	Confident	82.2	Confident	92 Å²	92	119.5 Å²	119.5	48%	0.482	58%	0.579	S	S	.	*	H	α-helix	trans	-59.4	-40.7	175.6	-152.6	83.1	0	0	0	111.7	F275 G281 S282 V283	F275-L279 WeakPolarHBondContact O-CB 3.29Å; F275-L279 PolarHBondContact O-N 2.84Å; L279-G281 VanDerWaalsContact C-N 3.29Å; L279-G281 PolarHBondContact O-N 3.19Å; L279-S282 PolarHBondContact O-N 2.96Å; L279-V283 WeakPolarHBondContact O-CG2 3.32Å; L279-V283 PolarHBondContact O-N 3.34Å
280	Q	89.4	Confident	79.9	Confident	113 Å²	113	121.2 Å²	121.2	53%	0.528	59%	0.586	S	S	.	*	H	α-helix	trans	-66.7	-30.8	174.5	-159.9	-167.2	73.6	0	0	112.1	L276 R277 D278 K284	L276-Q280 WeakPolarHBondContact O-CB 3.24Å; L276-Q280 PolarHBondContact O-N 2.95Å; R277-Q280 PolarHBondContact O-N 3.29Å; D278-Q280 VanDerWaalsContact C-N 3.3Å; D278-Q280 PolarHBondContact O-N 3.2Å; Q280-K284 WeakPolarHBondContact O-CD 3.31Å; Q280-K284 VanDerWaalsContact O-CG 3.26Å; Q280-K284 WeakPolarHBondContact O-CG 3.45Å; Q280-K284 PolarHBondContact O-N 3.44Å; Q280-K284 VanDerWaalsContact O-N 3.16Å
281	G	84.4	Confident	77.6	Confident	36 Å²	36	121 Å²	121	37%	0.371	60%	0.598	S	S	.	*	H	α-helix	trans	-64.5	-51.2	170.5	0	0	0	0	0	112.2	R277 D278 L279 V283 K284 S285	R277-G281 PolarHBondContact O-N 2.95Å; D278-G281 CarbonylContact O-C 3.56Å; D278-G281 WeakPolarHBondContact O-CA 3.48Å; D278-G281 PolarHBondContact O-N 3.39Å; L279-G281 VanDerWaalsContact C-N 3.29Å; L279-G281 PolarHBondContact O-N 3.19Å; G281-V283 PolarHBondContact O-N 3.46Å; G281-K284 WeakPolarHBondContact O-CB 3.36Å; G281-K284 PolarHBondContact O-N 3.06Å; G281-K284 VanDerWaalsContact O-N 3.15Å; G281-S285 PolarHBondContact O-N 3.03Å
282	S	80.8	Confident	75.7	Confident	70 Å²	70	119.9 Å²	119.9	49%	0.49	60%	0.598	S	S	.	*	H	α-helix	trans	-58.9	-44.6	177	-54.5	0	0	0	0	112.4	D278 L279 K284 S285 W286	D278-S282 PolarHBondContact O-N 3.24Å; D278-S282 PolarHBondContact O-OG 3.48Å; L279-S282 PolarHBondContact O-N 2.96Å; S282-K284 VanDerWaalsContact C-N 3.29Å; S282-K284 PolarHBondContact O-N 3.34Å; S282-S285 WeakPolarHBondContact O-CB 3.45Å; S282-S285 PolarHBondContact O-N 3.44Å; S282-S285 VanDerWaalsContact O-N 3.12Å; S282-W286 PolarHBondContact O-N 3.23Å
283	V	75.6	Confident	73.4	Confident	84 Å²	84	120.7 Å²	120.7	51%	0.509	61%	0.614	S	S	.	*	H	α-helix	trans	-64.5	-31.7	177.3	170.5	0	0	0	0	112.4	L279 G281	L279-V283 WeakPolarHBondContact O-CG2 3.32Å; L279-V283 PolarHBondContact O-N 3.34Å; G281-V283 PolarHBondContact O-N 3.46Å
284	K	76.3	Confident	71.1	Confident	125 Å²	125	119.8 Å²	119.8	54%	0.543	62%	0.618	S	S	.	*	H	α-helix	trans	-71.8	-40.5	171.1	-74.4	168.1	-173.1	165.6	0	111.7	Q280 G281 S282 K287	Q280-K284 WeakPolarHBondContact O-CD 3.31Å; Q280-K284 VanDerWaalsContact O-CG 3.26Å; Q280-K284 WeakPolarHBondContact O-CG 3.45Å; Q280-K284 PolarHBondContact O-N 3.44Å; Q280-K284 VanDerWaalsContact O-N 3.16Å; G281-K284 WeakPolarHBondContact O-CB 3.36Å; G281-K284 PolarHBondContact O-N 3.06Å; G281-K284 VanDerWaalsContact O-N 3.15Å; S282-K284 VanDerWaalsContact C-N 3.29Å; S282-K284 PolarHBondContact O-N 3.34Å; K284-K287 PolarHBondContact O-N 3.19Å
285	S	70.8	Confident	68.9	Low	72 Å²	72	121 Å²	121	50%	0.503	63%	0.625	S	S	.	*	H	α-helix	trans	-61.8	-45.9	178.7	-175.1	0	0	0	0	112.2	G281 S282 K287 V288	G281-S285 PolarHBondContact O-N 3.03Å; S282-S285 WeakPolarHBondContact O-CB 3.45Å; S282-S285 PolarHBondContact O-N 3.44Å; S282-S285 VanDerWaalsContact O-N 3.12Å; S285-K287 VanDerWaalsContact C-N 3.29Å; S285-K287 PolarHBondContact O-N 3.46Å; S285-V288 WeakPolarHBondContact O-CB 3.44Å; S285-V288 PolarHBondContact O-N 3.45Å
286	W	56.8	Low	66.6	Low	202 Å²	202	120.2 Å²	120.2	77%	0.765	64%	0.636	S	S	*	*	H	α-helix	trans	-60.6	-34.4	175.9	-80.2	7.1	0	0	0	113.5	S282 V288 Q289	S282-W286 PolarHBondContact O-N 3.23Å; W286-V288 PolarHBondContact O-N 3.42Å; W286-Q289 PolarHBondContact O-N 2.97Å; W286-Q289 VanDerWaalsContact O-N 3.08Å
287	K	62.8	Low	64.3	Low	161 Å²	161	126.1 Å²	126.1	70%	0.7	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-10.4	174.7	-80.3	-169.1	170.6	-170.9	0	115.1	K284 S285	K284-K287 PolarHBondContact O-N 3.19Å; S285-K287 VanDerWaalsContact C-N 3.29Å; S285-K287 PolarHBondContact O-N 3.46Å
288	V	57.6	Low	62.4	Low	131 Å²	131	125.7 Å²	125.7	79%	0.794	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-11.1	173.6	-180	0	0	0	0	111.3	S285 W286	S285-V288 WeakPolarHBondContact O-CB 3.44Å; S285-V288 PolarHBondContact O-N 3.45Å; W286-V288 PolarHBondContact O-N 3.42Å
289	Q	48.6	Very low	60.3	Low	141 Å²	141	127.4 Å²	127.4	66%	0.659	67%	0.666	S	S	*	*			trans	-108.9	16.7	-170.9	-147.7	169.8	12.3	0	0	114.5	W286 C291	W286-Q289 PolarHBondContact O-N 2.97Å; W286-Q289 VanDerWaalsContact O-N 3.08Å; Q289-C291 VanDerWaalsContact C-N 3.25Å; Q289-C291 PolarHBondContact O-N 3.35Å
290	E	45.4	Very low	58.1	Low	168 Å²	168	132.3 Å²	132.3	79%	0.785	68%	0.683	S	S	*	*			trans	-71.8	77.8	169.1	-71.1	-175	-175	0	0	110.8
291	C	47	Very low	56	Low	113 Å²	113	136.3 Å²	136.3	76%	0.764	70%	0.702	S	S	*	*			trans	-62.4	147.7	174.7	-72.3	0	0	0	0	112.2	Q289	Q289-C291 VanDerWaalsContact C-N 3.25Å; Q289-C291 PolarHBondContact O-N 3.35Å
292	K	53.8	Low	53.7	Low	171 Å²	171	138.1 Å²	138.1	74%	0.743	72%	0.721	S	S	*	*			trans	-67.7	140.4	-179.1	-63.8	174.5	-175.5	171.4	0	110.7	S294	K292-S294 PolarHBondContact O-N 3.02Å
293	P	48.9	Very low	51.6	Low	135 Å²	135	144.1 Å²	144.1	88%	0.877	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	21.6	-172	32.9	-38.2	0	0	0	114.9
294	S	47	Very low	50	Low	78 Å²	78	146.3 Å²	146.3	55%	0.545	75%	0.754	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.4	-28.7	-174.1	45.2	0	0	0	0	114.7	K292	K292-S294 PolarHBondContact O-N 3.02Å
295	D	48.2	Very low	48.3	Very low	127 Å²	127	149.5 Å²	149.5	68%	0.679	77%	0.771	S	S	*	*	S	Bend	trans	-99.1	-7	-154.6	-58.4	-5.5	0	0	0	114.1	R297	D295-R297 PolarHBondContact O-N 3.16Å
296	C	45.8	Very low	46.9	Very low	122 Å²	122	150.6 Å²	150.6	82%	0.824	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	18.2	-174.4	-57.4	0	0	0	0	115.4
297	R	44.5	Very low	45.8	Very low	239 Å²	239	147.3 Å²	147.3	90%	0.902	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	2.7	-167.1	-125.3	-178.7	-170	-164.4	2	116.8	D295	D295-R297 PolarHBondContact O-N 3.16Å
298	I	48.3	Very low	44.4	Very low	153 Å²	153	149 Å²	149	79%	0.785	80%	0.801	S	S	*	*	S	Bend	trans	-106.3	-17.4	-169.2	-66.2	176	0	0	0	113.9	F300	I298-F300 PolarHBondContact O-N 3.25Å
299	I	46.7	Very low	43.6	Very low	142 Å²	142	151 Å²	151	73%	0.728	81%	0.807	S	S	*	*	S	Bend	trans	-82.6	-14	-163.8	-65.2	177.2	0	0	0	114.9
300	F	41.5	Very low	43.3	Very low	195 Å²	195	149.7 Å²	149.7	86%	0.855	81%	0.811	S	S	*	*			trans	-124.6	68.9	-175.3	-73	-74.8	0	0	0	114.7	I298	I298-F300 PolarHBondContact O-N 3.25Å
301	Q	44.6	Very low	42.6	Very low	197 Å²	197	151.5 Å²	151.5	92%	0.921	82%	0.816	S	S	*	*			trans	-139.3	80.5	155.7	-74.1	-163.8	-13.6	0	0	110.9
302	G	37.2	Very low	42.2	Very low	75 Å²	75	155.4 Å²	155.4	77%	0.773	82%	0.82	S	S	*	*			trans	-110.1	135.9	166.5	0	0	0	0	0	110.2
303	K	36.8	Very low	41.1	Very low	196 Å²	196	155.3 Å²	155.3	85%	0.852	83%	0.827	S	S	*	*			trans	-78.7	150.2	175	-71.8	179	176.4	178.8	0	110.9
304	P	42.3	Very low	40.3	Very low	130 Å²	130	157.4 Å²	157.4	84%	0.844	83%	0.825	S	S	*	*			trans	-76.5	134.4	162.6	32.8	-31.8	0	0	0	109.9
305	E	39	Very low	39.7	Very low	191 Å²	191	160.2 Å²	160.2	89%	0.893	84%	0.839	S	S	*	*			trans	-140.3	138.4	171	-156.2	152.7	-118	0	0	107.6
306	A	41.8	Very low	38.9	Very low	96 Å²	96	159.6 Å²	159.6	79%	0.793	84%	0.844	S	S	*	*			trans	-90.2	148.3	-166.5	0	0	0	0	0	112.5
307	C	35	Very low	38.4	Very low	133 Å²	133	160.5 Å²	160.5	90%	0.899	84%	0.841	S	S	*	*			trans	-142.8	147.2	168.9	-84.4	0	0	0	0	110.2
308	E	33.1	Very low	37.9	Very low	195 Å²	195	158 Å²	158	91%	0.911	84%	0.839	S	S	*	*			trans	-100.7	165.7	-168.1	-59.5	-178.3	125.5	0	0	113.5
309	L	40	Very low	37.2	Very low	173 Å²	173	154.8 Å²	154.8	91%	0.906	84%	0.836	S	S	*	*			trans	-85.1	142.4	174.9	-80.9	163	0	0	0	112.6
310	P	41.8	Very low	36.7	Very low	115 Å²	115	152.9 Å²	152.9	75%	0.747	84%	0.835	S	S	*	*			trans	-125.6	109.1	150.6	32.7	-19.1	0	0	0	113.7
311	K	32.3	Very low	36.2	Very low	206 Å²	206	151.4 Å²	151.4	90%	0.896	83%	0.831	S	S	*	*			trans	36.9	145.2	135.5	-60.5	-179.4	-178	177.6	0	122.5
312	K	36.6	Very low	35.8	Very low	195 Å²	195	148.3 Å²	148.3	85%	0.848	82%	0.82	S	S	*	*			trans	-64.4	165.4	170.1	-52.8	176.4	177.7	-177	0	113.7
313	L	32	Very low	35.6	Very low	168 Å²	168	150.9 Å²	150.9	88%	0.88	82%	0.816	S	S	*	*			trans	-137.7	-176.8	138.8	-140.4	77.6	0	0	0	110.2
314	E	31.1	Very low	35.5	Very low	179 Å²	179	147.7 Å²	147.7	84%	0.836	81%	0.808	S	S	*	*			trans	-113.7	179.5	-149.6	-68.3	170.3	120.9	0	0	116.4
315	T	35.2	Very low	35.1	Very low	137 Å²	137	148.1 Å²	148.1	84%	0.84	80%	0.801	S	S	*	*			trans	-73	154.9	-175.6	46.5	0	0	0	0	115.7
316	S	31.7	Very low	34.8	Very low	114 Å²	114	146.2 Å²	146.2	80%	0.797	79%	0.792	S	S	*	*			trans	-162.4	147.2	139.1	-170.9	0	0	0	0	111.5
317	D	35.3	Very low	34.4	Very low	142 Å²	142	148.1 Å²	148.1	76%	0.759	79%	0.785	S	S	*	*			trans	-85.5	160.9	175.8	-44.3	-83	0	0	0	112.5
318	Q	32.8	Very low	34.4	Very low	185 Å²	185	146.7 Å²	146.7	86%	0.864	77%	0.765	S	S	*	*				169.7	126.6	106.9	-88.5	-167.9	9.7	0	0	114.8
319	A	33.8	Very low	34.6	Very low	86 Å²	86	145.9 Å²	145.9	71%	0.711	75%	0.753	S	S	*	*				50.5	135.3	128.9	0	0	0	0	0	124.5
320	S	36	Very low	34.5	Very low	102 Å²	102	145 Å²	145	71%	0.713	74%	0.742	S	S	*	*			trans	90.1	113.1	132.6	-72.2	0	0	0	0	123.3
321	Q	32.9	Very low	34.2	Very low	164 Å²	164	146.9 Å²	146.9	77%	0.766	75%	0.745	S	S	*	*				96.2	135.7	118.4	-79.6	-173.4	7.7	0	0	123.3
322	I	35.9	Very low	35.3	Very low	133 Å²	133	142 Å²	142	68%	0.682	74%	0.735	S	S	*	*			trans	78.8	98.3	142.8	-67.8	166.7	0	0	0	118.5
323	N	32.9	Very low	35.1	Very low	129 Å²	129	141 Å²	141	69%	0.69	74%	0.737	S	S	*	*				57	140	121.4	-72.6	41.1	0	0	0	124.9
324	D	33.5	Very low	35.3	Very low	129 Å²	129	142.5 Å²	142.5	69%	0.69	74%	0.736	S	S	*	*				91	135.6	128.5	-81.3	-40.9	0	0	0	123.8
325	I	33.6	Very low	36.4	Very low	138 Å²	138	139.5 Å²	139.5	71%	0.708	73%	0.732	S	S	*	*			trans	80.6	119.6	140.2	-74.8	166.8	0	0	0	121.3
326	H	32.8	Very low	36.2	Very low	152 Å²	152	142.2 Å²	142.2	70%	0.704	74%	0.735	S	S	*	*			trans	64.3	151.9	152.6	-86.4	-118	0	0	0	119.5
327	E	35	Very low	36.4	Very low	136 Å²	136	139.9 Å²	139.9	64%	0.636	73%	0.729	S	S	*	*			cis	-159.6	-177.4	-17.8	-143.9	-172.6	154.3	0	0	111
328	E	35.1	Very low	36.1	Very low	103 Å²	103	143.2 Å²	143.2	48%	0.481	74%	0.738	S	S	.	*			trans	12.5	134.3	143.6	-85.7	-155.3	114.6	0	0	119.1
329	R	36.1	Very low	36.4	Very low	177 Å²	177	140.3 Å²	140.3	67%	0.668	73%	0.728	S	S	*	*				177.6	156.2	55.9	-125.4	159.6	-162.9	170.8	24.3	112.8
330	K	38.1	Very low	36.6	Very low	154 Å²	154	144.3 Å²	144.3	67%	0.67	73%	0.732	S	S	*	*			trans	21.1	146.7	134.6	-60.8	172.5	-164.4	162.4	0	119.8
331	L	34.9	Very low	36.6	Very low	155 Å²	155	143.8 Å²	143.8	81%	0.812	73%	0.729	S	S	*	*			cis	-171.3	178.7	-1.4	-104.5	171.6	0	0	0	106.7
332	P	55.5	Low	36.8	Very low	105 Å²	105	141 Å²	141	68%	0.682	73%	0.727	S	S	*	*			trans	-97.4	178.6	-168.8	40.4	-38.7	0	0	0	114.6
333	I	33.7	Very low	36.9	Very low	174 Å²	174	142 Å²	142	89%	0.892	73%	0.729	S	S	*	*			trans	-163.8	169.1	133.6	-103.4	155	0	0	0	111.8
334	K	35.1	Very low	37	Very low	198 Å²	198	143.7 Å²	143.7	86%	0.861	73%	0.73	S	S	*	*			trans	-92.6	171.3	-170.9	-95.6	-177	176.1	-179.7	0	114.2
335	P	54.3	Low	37.2	Very low	116 Å²	116	144.4 Å²	144.4	75%	0.753	73%	0.727	S	S	*	*			trans	-106.7	168.3	-161.4	40.9	-37	0	0	0	116.6
336	E	31.9	Very low	37	Very low	194 Å²	194	146.9 Å²	146.9	91%	0.907	73%	0.729	S	S	*	*			trans	-121.7	159.2	154.7	-59.3	179.1	129.8	0	0	107.2
337	G	34.5	Very low	37	Very low	65 Å²	65	145.6 Å²	145.6	67%	0.67	73%	0.732	S	S	*	*			cis	111.5	87.2	0.9	0	0	0	0	0	113.3
338	F	30.6	Very low	36.9	Very low	213 Å²	213	143.5 Å²	143.5	93%	0.934	74%	0.738	S	S	*	*			trans	-155	-170.9	161.2	-127.3	-90.8	0	0	0	113
339	N	38.3	Very low	36.7	Very low	123 Å²	123	150 Å²	150	66%	0.658	76%	0.758	S	S	*	*			trans	-145.4	163.5	-140.8	-144.7	-24	0	0	0	114.2
340	Q	38.8	Very low	36.5	Very low	170 Å²	170	146.3 Å²	146.3	79%	0.794	76%	0.759	S	S	*	*			trans	68.5	158.4	157.6	-77.9	171.8	32	0	0	118.9
341	S	35.3	Very low	36.3	Very low	92 Å²	92	146.4 Å²	146.4	64%	0.643	76%	0.763	S	S	*	*			cis	-163.4	-179.7	-7.2	58.9	0	0	0	0	113
342	S	36.6	Very low	36.1	Very low	106 Å²	106	146.5 Å²	146.5	74%	0.741	76%	0.759	S	S	*	*			trans	80.4	160.5	146.7	-61.4	0	0	0	0	120.9
343	Q	38.6	Very low	35	Very low	153 Å²	153	148.4 Å²	148.4	72%	0.715	76%	0.758	S	S	*	*			cis	-173.6	165.2	-44	-142.5	-172	46.2	0	0	111.1
344	K	35.9	Very low	35.2	Very low	164 Å²	164	148.4 Å²	148.4	71%	0.713	75%	0.752	S	S	*	*			trans	76.9	154.5	163.1	-60.9	153.5	178.8	158.9	0	116.7
345	K	36.5	Very low	35	Very low	145 Å²	145	146 Å²	146	63%	0.63	75%	0.748	S	S	*	*			cis	-167.8	146.7	-9.5	-114.2	176.3	175.3	-171.9	0	112.7
346	Y	30.2	Very low	34.9	Very low	189 Å²	189	145.6 Å²	145.6	74%	0.741	75%	0.745	S	S	*	*			trans	61.8	156.9	143.1	-63	-18.8	0	0	0	121.2
347	T	32.4	Very low	34.9	Very low	125 Å²	125	144.6 Å²	144.6	77%	0.767	74%	0.744	S	S	*	*			cis	-164.8	162.7	-5.1	14.2	0	0	0	0	113.6
348	A	32.8	Very low	34.7	Very low	93 Å²	93	150.1 Å²	150.1	77%	0.769	75%	0.752	S	S	*	*			trans	68.7	142.6	160.5	0	0	0	0	0	119
349	R	30.6	Very low	35.5	Very low	238 Å²	238	145.9 Å²	145.9	90%	0.898	75%	0.746	S	S	*	*			cis	87	132.1	31.9	-154.1	-173.9	-174.5	-179.9	3.1	111.9
350	S	31.6	Very low	35.1	Very low	100 Å²	100	148.9 Å²	148.9	70%	0.699	76%	0.756	S	S	*	*			cis	-144.3	-168.5	25.9	59.6	0	0	0	0	115.9
351	E	35.3	Very low	36.2	Very low	157 Å²	157	145.3 Å²	145.3	73%	0.734	75%	0.748	S	S	*	*			trans	-66.7	177.4	173.9	-54.4	103.3	133.6	0	0	114.6
352	E	30.7	Very low	35.9	Very low	157 Å²	157	149.6 Å²	149.6	73%	0.734	76%	0.756	S	S	*	*			cis	-161.7	158.4	45.7	-82	-157.9	91	0	0	118.3
353	Q	32.5	Very low	35.7	Very low	144 Å²	144	150.1 Å²	150.1	67%	0.673	75%	0.75	S	S	*	*			trans	37.8	121.6	137.8	-58.9	-153.5	72.9	0	0	122.9
354	K	36	Very low	35.6	Very low	175 Å²	175	150.7 Å²	150.7	76%	0.761	75%	0.753	S	S	*	*				73.5	144.6	93.2	-109.6	-179.7	177.1	179.3	0	114.7
355	L	31.9	Very low	35.5	Very low	148 Å²	148	148 Å²	148	78%	0.775	76%	0.755	S	S	*	*			cis	-150.2	-159.3	29.2	-112.4	-176.5	0	0	0	111.7
356	P	52	Low	35.5	Very low	107 Å²	107	146.3 Å²	146.3	70%	0.695	76%	0.761	S	S	*	*			trans	-122.3	-175	-151.4	46.8	-32.9	0	0	0	116.9
357	I	32.9	Very low	35.8	Very low	172 Å²	172	145.6 Å²	145.6	88%	0.882	76%	0.764	S	S	*	*			trans	-154.8	159.5	162.7	-103.9	149.9	0	0	0	111.7
358	Q	30.3	Very low	36	Very low	181 Å²	181	148.9 Å²	148.9	85%	0.846	77%	0.768	S	S	*	*			trans	-96.8	162.2	177.1	-65.9	-178.3	-8.2	0	0	113.6
359	P	45.5	Very low	36.2	Very low	124 Å²	124	153.3 Å²	153.3	81%	0.805	77%	0.77	S	S	*	*			trans	-110.2	145.8	164.5	37.6	-28.4	0	0	0	114.4
360	E	31	Very low	36.1	Very low	186 Å²	186	153.1 Å²	153.1	87%	0.869	77%	0.771	S	S	*	*			trans	-142.8	-176.7	165.9	-131.1	-146.5	166.6	0	0	110.1
361	P	61.3	Low	36.2	Very low	95 Å²	95	154.3 Å²	154.3	62%	0.617	77%	0.774	S	S	*	*				-123.6	-147.3	-118.4	40.2	-20.6	0	0	0	115.5
362	F	29.4	Very low	36.2	Very low	183 Å²	183	151.9 Å²	151.9	80%	0.803	78%	0.781	S	S	*	*			trans	79.3	150.7	178.2	-94.5	-129.7	0	0	0	116.5
363	N	33.1	Very low	36.3	Very low	117 Å²	117	154.7 Å²	154.7	63%	0.626	79%	0.785	S	S	*	*			cis	-150.5	-172.9	-0.2	-154	0.2	0	0	0	114.3
364	Q	35.9	Very low	36.3	Very low	165 Å²	165	153.3 Å²	153.3	77%	0.771	79%	0.791	S	S	*	*			trans	-79.4	169.3	-169.3	-57.3	152.4	10.6	0	0	118.3
365	S	33.5	Very low	36.5	Very low	108 Å²	108	152 Å²	152	76%	0.755	79%	0.788	S	S	*	*				-177.4	143.8	118.8	46.9	0	0	0	0	116.8
366	S	36.3	Very low	36.6	Very low	109 Å²	109	152 Å²	152	76%	0.762	78%	0.784	S	S	*	*			trans	49.6	152.4	138	-66.7	0	0	0	0	124.5
367	Q	37.6	Very low	35.6	Very low	173 Å²	173	156.5 Å²	156.5	81%	0.808	80%	0.795	S	S	*	*			cis	-173.4	-179.8	-27	-125.2	-167.1	46.6	0	0	111
368	K	36.7	Very low	35.8	Very low	194 Å²	194	155.9 Å²	155.9	84%	0.843	79%	0.786	S	S	*	*			trans	80.7	125.3	175	-53.9	175.5	-177.7	174.9	0	116
369	K	36	Very low	36	Very low	186 Å²	186	155.5 Å²	155.5	81%	0.809	79%	0.789	S	S	*	*			cis	97.8	103.3	11.6	-163.9	-174.6	-178.6	-178.5	0	116.2
370	Y	29.1	Very low	35.8	Very low	235 Å²	235	155.3 Å²	155.3	92%	0.922	79%	0.788	S	S	*	*			trans	-145.3	164.1	151.6	-90.6	-65.7	0	0	0	110.6
371	T	33.5	Very low	35.9	Very low	124 Å²	124	154.4 Å²	154.4	76%	0.761	79%	0.787	S	S	*	*			trans	-123.8	143.7	-160.3	46.2	0	0	0	0	113.6
372	A	34.5	Very low	34.6	Very low	107 Å²	107	159.2 Å²	159.2	88%	0.884	80%	0.798	S	S	*	*			trans	-97	146.4	161.8	0	0	0	0	0	110.6
373	R	32.4	Very low	34.9	Very low	216 Å²	216	156.7 Å²	156.7	82%	0.815	80%	0.801	S	S	*	*			trans	-113.9	135.8	-174.8	-179.9	175.5	175.4	168.1	-4.8	110.1	E375	R373-E375 IonicContact CZ-OE1 3.11Å; R373-E375 IonicContact NE-OE1 2.74Å; R373-E375 PolarHBondContact NE-OE1 3.03Å; R373-E375 IonicContact NH2-OE1 2.66Å; R373-E375 PolarHBondContact NH2-OE1 3.27Å
374	S	34.1	Very low	34.9	Very low	115 Å²	115	159.9 Å²	159.9	80%	0.804	81%	0.812	S	S	*	*			trans	-126.4	135	177.6	56.9	0	0	0	0	110
375	E	38.6	Very low	35	Very low	147 Å²	147	158 Å²	158	69%	0.687	81%	0.814	S	S	*	*			trans	-129	127	174.1	-71.5	177.9	-171.3	0	0	109.7	R373	R373-E375 IonicContact CZ-OE1 3.11Å; R373-E375 IonicContact NE-OE1 2.74Å; R373-E375 PolarHBondContact NE-OE1 3.03Å; R373-E375 IonicContact NH2-OE1 2.66Å; R373-E375 PolarHBondContact NH2-OE1 3.27Å
376	E	35.1	Very low	34.8	Very low	149 Å²	149	163 Å²	163	70%	0.696	82%	0.822	S	S	*	*			trans	-88.3	153.1	171.8	-63	-170.1	131.5	0	0	110.1	K378	E376-K378 IonicContact OE1-NZ 2.74Å; E376-K378 PolarHBondContact OE1-NZ 2.95Å; E376-K378 IonicContact OE2-NZ 3.14Å; E376-K378 PolarHBondContact OE2-NZ 3.45Å
377	Q	31.5	Very low	34.7	Very low	201 Å²	201	165.1 Å²	165.1	94%	0.939	83%	0.825	S	S	*	*			trans	-129.7	141.7	148	-73.6	-167.3	-9.7	0	0	110
378	K	37.2	Very low	34.4	Very low	159 Å²	159	166 Å²	166	69%	0.691	83%	0.83	S	S	*	*			trans	-123.7	141.4	179.6	-75.7	173	174.5	130.8	0	109.5	E376	E376-K378 IonicContact OE1-NZ 2.74Å; E376-K378 PolarHBondContact OE1-NZ 2.95Å; E376-K378 IonicContact OE2-NZ 3.14Å; E376-K378 PolarHBondContact OE2-NZ 3.45Å
379	L	33.2	Very low	34.2	Very low	172 Å²	172	162.5 Å²	162.5	90%	0.901	83%	0.829	S	S	*	*			trans	-134.7	146	157.9	-74.1	177	0	0	0	109.6
380	P	42	Very low	34	Very low	121 Å²	121	159.3 Å²	159.3	79%	0.786	83%	0.83	S	S	*	*			trans	-98	144.6	-176	36.7	-33	0	0	0	113.1
381	I	32.9	Very low	34.2	Very low	167 Å²	167	157.3 Å²	157.3	86%	0.856	83%	0.829	S	S	*	*			trans	-134.7	138.8	168.9	-60.6	-178.4	0	0	0	108.9
382	K	33.5	Very low	34.2	Very low	195 Å²	195	161 Å²	161	85%	0.848	84%	0.835	S	S	*	*			trans	-80.4	145	175.4	-71.4	-179	176.7	177.1	0	111.2
383	P	36.3	Very low	34.1	Very low	131 Å²	131	163.8 Å²	163.8	85%	0.851	83%	0.833	S	S	*	*			trans	-84.5	143.3	166.2	34	-32.4	0	0	0	112
384	E	32.8	Very low	33.9	Very low	183 Å²	183	164.3 Å²	164.3	86%	0.855	84%	0.837	S	S	*	*			trans	-125.2	139.3	167.7	-172.6	171.3	-138.6	0	0	108.4
385	P	38.8	Very low	33.9	Very low	126 Å²	126	165.5 Å²	165.5	82%	0.818	84%	0.839	S	S	*	*			trans	-87	133.4	-171.1	32.8	-33.5	0	0	0	112.6
386	F	29.7	Very low	33.7	Very low	212 Å²	212	163.5 Å²	163.5	93%	0.93	85%	0.848	S	S	*	*			trans	-112.5	142.6	174.3	-150.6	-94.9	0	0	0	112.6
387	N	32.7	Very low	33.4	Very low	155 Å²	155	166.6 Å²	166.6	83%	0.829	85%	0.853	S	S	*	*			trans	-78.6	145.8	-176.6	-105.7	-49	0	0	0	112.4
388	Q	32.4	Very low	33.4	Very low	192 Å²	192	162.7 Å²	162.7	90%	0.897	85%	0.848	S	S	*	*			trans	-123.2	110.5	176.8	-145.6	175.6	40.5	0	0	110.6
389	S	31.8	Very low	33.4	Very low	119 Å²	119	162.5 Å²	162.5	83%	0.832	85%	0.849	S	S	*	*			trans	-97.5	142.9	176.8	56	0	0	0	0	111
390	S	33.1	Very low	33.3	Very low	119 Å²	119	163.6 Å²	163.6	83%	0.832	85%	0.85	S	S	*	*			trans	-89.4	129.4	-170.5	-42.9	0	0	0	0	112.7
391	Q	32.5	Very low	32.8	Very low	194 Å²	194	169.5 Å²	169.5	91%	0.907	86%	0.857	S	S	*	*			trans	-104.5	143.4	160.1	-70.5	-165.4	-3.4	0	0	111
392	K	32.5	Very low	32.9	Very low	201 Å²	201	171.5 Å²	171.5	87%	0.874	86%	0.859	S	S	*	*			trans	-95.8	136.6	-174.8	-61.3	171.1	-178.1	173.1	0	109.8
393	I	32.9	Very low	32.9	Very low	165 Å²	165	170.1 Å²	170.1	85%	0.846	86%	0.86	S	S	*	*			trans	-104.7	133.2	166.4	-64.3	178.3	0	0	0	108.4
394	Y	29.3	Very low	33.5	Very low	228 Å²	228	169.8 Å²	169.8	89%	0.894	86%	0.858	S	S	*	*			trans	-72.9	138	176.5	-76.1	-96	0	0	0	111.1
395	T	32.7	Very low	33.5	Very low	140 Å²	140	172.7 Å²	172.7	86%	0.859	86%	0.861	S	S	*	*			trans	-113.1	138.7	169	8.5	0	0	0	0	110.3	R397	T395-R397 PolarHBondContact O-N 2.88Å
396	A	34.9	Very low	33.3	Very low	104 Å²	104	173.8 Å²	173.8	86%	0.86	85%	0.853	S	S	*	*			trans	-83.4	108.8	-171.9	0	0	0	0	0	112.7
397	R	28.5	Very low	33.9	Very low	215 Å²	215	169.5 Å²	169.5	81%	0.811	85%	0.846	S	S	*	*			trans	-8.9	117.5	151.8	-170.6	-175.5	-166.7	141.9	1	116.1	T395 E399	T395-R397 PolarHBondContact O-N 2.88Å; R397-E399 HydrophobicContact CG-CG 4.43Å; R397-E399 IonicContact NE-OE1 2.74Å; R397-E399 PolarHBondContact NE-OE1 3.04Å; R397-E399 IonicContact NH2-OE1 2.67Å
398	S	32.2	Very low	33.9	Very low	118 Å²	118	168.6 Å²	168.6	83%	0.825	84%	0.837	S	S	*	*			trans	-98.3	154.3	150.4	52.9	0	0	0	0	109.6
399	E	36	Very low	33.8	Very low	156 Å²	156	166.4 Å²	166.4	73%	0.729	83%	0.831	S	S	*	*			trans	-109.9	127.9	-177	-59.4	-159.4	133.3	0	0	112.1	R397	R397-E399 HydrophobicContact CG-CG 4.43Å; R397-E399 IonicContact NE-OE1 2.74Å; R397-E399 PolarHBondContact NE-OE1 3.04Å; R397-E399 IonicContact NH2-OE1 2.67Å
400	E	31.7	Very low	33.9	Very low	194 Å²	194	166.9 Å²	166.9	91%	0.907	83%	0.829	S	S	*	*			trans	-104.8	144.1	177	-168.1	167.1	-141.5	0	0	111
401	R	32.2	Very low	33.8	Very low	246 Å²	246	167.6 Å²	167.6	93%	0.928	82%	0.823	S	S	*	*			trans	-86.8	144.9	-171.1	-71.6	-178.4	175.3	172.9	-1.7	112.5
402	K	34.5	Very low	33.7	Very low	208 Å²	208	166.1 Å²	166.1	90%	0.904	82%	0.817	S	S	*	*			trans	-75.5	143	-175	-60.4	169	-178	172.1	0	112.4
403	L	33.6	Very low	33.7	Very low	167 Å²	167	160.1 Å²	160.1	87%	0.874	80%	0.804	S	S	*	*			trans	-105.3	147	156.5	-82.1	166.7	0	0	0	110.1
404	P	49.7	Very low	33.8	Very low	123 Å²	123	158.3 Å²	158.3	80%	0.799	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-81.7	171.5	-177.7	33.5	-35.5	0	0	0	113.6
405	R	31.2	Very low	33.9	Very low	245 Å²	245	154.1 Å²	154.1	93%	0.925	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-96.2	156.2	-171.7	-73.2	178.5	172.6	166.6	-4.6	114.6
406	K	35.1	Very low	34	Very low	149 Å²	149	155.6 Å²	155.6	65%	0.648	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-60.3	144.2	165.3	-178.3	-167.2	-176.3	-161.1	0	113.2	E408	K406-E408 VanDerWaalsContact CE-OE1 3.31Å; K406-E408 WeakPolarHBondContact CE-OE1 3.49Å; K406-E408 WeakPolarHBondContact CE-OE2 3.41Å; K406-E408 IonicContact NZ-OE1 2.78Å; K406-E408 PolarHBondContact NZ-OE1 3.24Å; K406-E408 IonicContact NZ-OE2 3.66Å; K406-E408 PolarHBondContact NZ-OE2 2.9Å
407	P	42	Very low	34	Very low	121 Å²	121	159 Å²	159	79%	0.786	78%	0.779	S	S	*	*			trans	-104	161	155.9	37.4	-30.2	0	0	0	112.4
408	E	33.6	Very low	34.2	Very low	137 Å²	137	154 Å²	154	64%	0.64	77%	0.769	S	S	*	*			trans	-155.9	156.9	-175.8	-165.4	149.4	-127.7	0	0	111.3	K406	K406-E408 VanDerWaalsContact CE-OE1 3.31Å; K406-E408 WeakPolarHBondContact CE-OE1 3.49Å; K406-E408 WeakPolarHBondContact CE-OE2 3.41Å; K406-E408 IonicContact NZ-OE1 2.78Å; K406-E408 PolarHBondContact NZ-OE1 3.24Å; K406-E408 IonicContact NZ-OE2 3.66Å; K406-E408 PolarHBondContact NZ-OE2 2.9Å
409	N	30.7	Very low	34.3	Very low	146 Å²	146	154.7 Å²	154.7	78%	0.781	77%	0.769	S	S	*	*			trans	66.9	114.5	-176	-51.1	-24.3	0	0	0	114.6
410	V	32.7	Very low	34.3	Very low	128 Å²	128	151 Å²	151	78%	0.776	77%	0.765	S	S	*	*			cis	73.5	103.2	39	-171.7	0	0	0	0	114.2
411	D	31.6	Very low	34.4	Very low	134 Å²	134	149.3 Å²	149.3	72%	0.717	76%	0.762	S	S	*	*			trans	159.4	146.7	144.1	-92.5	-21.8	0	0	0	110.3
412	Q	30.7	Very low	34.5	Very low	164 Å²	164	142.2 Å²	142.2	77%	0.766	75%	0.749	S	S	*	*			cis	-162.5	167.7	-17.3	-142.1	177.4	88.7	0	0	111
413	A	31.8	Very low	34.4	Very low	75 Å²	75	140.7 Å²	140.7	62%	0.62	75%	0.745	S	S	*	*			trans	75.3	137.4	152.3	0	0	0	0	0	124.2
414	T	34.3	Very low	34.4	Very low	126 Å²	126	137.6 Å²	137.6	77%	0.773	74%	0.736	S	S	*	*			trans	64.2	151.1	151.6	48.8	0	0	0	0	121.7
415	Q	33.2	Very low	33.7	Very low	140 Å²	140	140.3 Å²	140.3	65%	0.654	74%	0.735	S	S	*	*			cis	-163.9	147.2	-34.7	-129.9	-170.7	78	0	0	109.6
416	K	34.1	Very low	33.9	Very low	171 Å²	171	134.4 Å²	134.4	74%	0.743	73%	0.727	S	S	*	*			trans	37.1	121.1	157.1	-60.3	169.5	-179.3	148.9	0	120.9
417	K	34.9	Very low	34	Very low	175 Å²	175	135.5 Å²	135.5	76%	0.761	74%	0.739	S	S	*	*				171.9	135	99.8	-99.8	-160.6	165.4	-121.5	0	115.7
418	D	33.6	Very low	34.2	Very low	111 Å²	111	134.8 Å²	134.8	59%	0.594	74%	0.737	S	S	*	*				48.1	106.8	126.5	-49	-3.3	0	0	0	122.6
419	T	34.3	Very low	34.3	Very low	133 Å²	133	137.9 Å²	137.9	82%	0.816	75%	0.748	S	S	*	*				91.7	120.1	112.8	-58.4	0	0	0	0	123.1
420	A	35	Very low	34.7	Very low	79 Å²	79	139.4 Å²	139.4	65%	0.653	75%	0.75	S	S	*	*			trans	84.1	136.8	144.9	0	0	0	0	0	123.7
421	N	34.5	Very low	35	Very low	157 Å²	157	142.6 Å²	142.6	84%	0.84	75%	0.754	S	S	*	*			trans	65.6	147.5	144.6	-73.3	7	0	0	0	120.4
422	C	33.3	Very low	35.4	Very low	97 Å²	97	144.4 Å²	144.4	66%	0.655	76%	0.762	S	S	*	*			cis	-162	163.8	-20.1	-158.2	0	0	0	0	109.1
423	E	33.6	Very low	35.7	Very low	176 Å²	176	145.6 Å²	145.6	82%	0.822	77%	0.768	S	S	*	*			trans	61.2	158.4	156.3	-86.2	172.3	-163.4	0	0	119.4
424	C	31.8	Very low	36.1	Very low	102 Å²	102	148.2 Å²	148.2	69%	0.689	77%	0.77	S	S	*	*			cis	-146.2	-167.1	-25.7	-149.4	0	0	0	0	111.4
425	K	35	Very low	36.2	Very low	180 Å²	180	151.5 Å²	151.5	78%	0.783	77%	0.774	S	S	*	*			trans	-74.4	175.2	-167	-61	156.5	-177.3	167.2	0	115
426	T	36.7	Very low	36.3	Very low	121 Å²	121	152.6 Å²	152.6	74%	0.742	78%	0.783	S	S	*	*			trans	69.2	99.8	152.5	35.9	0	0	0	0	119.8
427	L	36.8	Very low	36.4	Very low	173 Å²	173	154 Å²	154	91%	0.906	79%	0.79	S	S	*	*			trans	-138.8	99.7	133.5	-82.3	-174.4	0	0	0	110.3
428	S	45.3	Very low	36.7	Very low	106 Å²	106	151.2 Å²	151.2	74%	0.741	79%	0.789	S	S	*	*			trans	-134	71.9	176.7	60.9	0	0	0	0	109.9
429	K	36.8	Very low	36.6	Very low	201 Å²	201	155 Å²	155	87%	0.874	80%	0.803	S	S	*	*			trans	-154.3	-6.6	-176.7	-119.9	170.8	-176	-179.2	0	119.1
430	E	38.1	Very low	36.6	Very low	178 Å²	178	155.5 Å²	155.5	83%	0.832	81%	0.806	S	S	*	*			trans	-122.3	51.9	-166.5	-61.5	-167.2	151.2	0	0	115.4
431	F	39.3	Very low	36.7	Very low	195 Å²	195	156.3 Å²	156.3	86%	0.855	81%	0.813	S	S	*	*	S	Bend	trans	-138.3	12.5	173.9	-108.1	-81.4	0	0	0	116.4
432	I	41.1	Very low	36.5	Very low	173 Å²	173	157.1 Å²	157.1	89%	0.887	81%	0.812	S	S	*	*	S	Bend	trans	-132	56.1	175.7	-44.7	-178	0	0	0	110.6
433	Q	35.3	Very low	36.4	Very low	188 Å²	188	158.9 Å²	158.9	88%	0.879	81%	0.811	S	S	*	*			trans	-151.8	49.2	176.9	-157.5	173.8	-7.2	0	0	114
434	I	40.6	Very low	36.3	Very low	131 Å²	131	158.4 Å²	158.4	67%	0.672	81%	0.806	S	S	*	*	S	Bend	trans	-117.3	-19.6	179.9	-59.1	-178	0	0	0	113.6
435	F	36.7	Very low	36.2	Very low	194 Å²	194	162.2 Å²	162.2	85%	0.851	81%	0.813	S	S	*	*	S	Bend	trans	-134.4	49	-168.9	-69.6	-68	0	0	0	116.2
436	L	35.3	Very low	36.2	Very low	164 Å²	164	162.8 Å²	162.8	86%	0.859	82%	0.816	S	S	*	*	S	Bend	trans	-142.6	110.3	164.2	-82.7	-177.8	0	0	0	114.6
437	K	36.8	Very low	36	Very low	201 Å²	201	162.7 Å²	162.7	87%	0.874	82%	0.82	S	S	*	*			trans	74.7	161	151.9	-78.6	-167.5	172.8	-175.2	0	119.1
438	P	41.4	Very low	35.9	Very low	115 Å²	115	161.1 Å²	161.1	75%	0.747	81%	0.813	S	S	*	*			trans	-116.1	172.2	-141.3	43.1	-36	0	0	0	115.9
439	E	30.7	Very low	35.3	Very low	191 Å²	191	163.5 Å²	163.5	89%	0.893	82%	0.817	S	S	*	*			trans	-78.1	146.8	172.7	-67.8	179.1	116.4	0	0	114.1
440	T	34.1	Very low	35.1	Very low	144 Å²	144	158.5 Å²	158.5	88%	0.883	81%	0.808	S	S	*	*			trans	-136.7	157.2	156.6	41.4	0	0	0	0	108.3
441	A	37.2	Very low	34.9	Very low	96 Å²	96	158 Å²	158	79%	0.793	81%	0.805	S	S	*	*			trans	-89.9	-170.1	-154.7	0	0	0	0	0	116.3
442	Q	30.5	Very low	34.5	Very low	173 Å²	173	159.6 Å²	159.6	81%	0.808	81%	0.805	S	S	*	*			trans	91.8	145	179.3	-68.2	-164.7	-73.8	0	0	116.6
443	E	31.6	Very low	34	Very low	135 Å²	135	156.3 Å²	156.3	63%	0.631	79%	0.794	S	S	*	*			cis	-171	172.4	-24.9	-155.4	-169.9	113.4	0	0	109.2
444	K	30.7	Very low	33.9	Very low	166 Å²	166	152.9 Å²	152.9	72%	0.722	79%	0.786	S	S	*	*			trans	77.8	152.7	166	-57.7	164.8	-174.2	169.1	0	115.5
445	Q	30.8	Very low	33.3	Very low	181 Å²	181	153 Å²	153	85%	0.846	79%	0.787	S	S	*	*			cis	-145.1	170.6	3.2	-141.9	157.5	-22.6	0	0	113.6
446	K	34.9	Very low	33.1	Very low	192 Å²	192	149.2 Å²	149.2	84%	0.835	78%	0.781	S	S	*	*			trans	-86.4	156.6	-175.5	-54.1	169.9	179.3	175.6	0	113.6
447	S	32.5	Very low	33.8	Very low	120 Å²	120	146.2 Å²	146.2	84%	0.839	77%	0.771	S	S	*	*			trans	-157.5	169.9	133	55.7	0	0	0	0	110.9
448	N	33.8	Very low	33.6	Very low	139 Å²	139	143.4 Å²	143.4	74%	0.743	76%	0.764	S	S	*	*			trans	-121	176.4	-160.1	-61.6	-19.7	0	0	0	113.8
449	N	32.4	Very low	33.3	Very low	157 Å²	157	144.4 Å²	144.4	84%	0.84	76%	0.763	S	S	*	*			trans	106.2	146.5	161.1	-62.5	-14.7	0	0	0	116
450	S	32.7	Very low	33.3	Very low	96 Å²	96	140.6 Å²	140.6	67%	0.671	76%	0.758	S	S	*	*			cis	-167.7	174.3	-23.9	-167.3	0	0	0	0	109.7
451	Q	34.4	Very low	33.3	Very low	168 Å²	168	141.5 Å²	141.5	79%	0.785	75%	0.752	S	S	*	*			trans	70	130.4	173.4	-64.4	165.7	-78.8	0	0	114.8
452	R	31.9	Very low	33.1	Very low	227 Å²	227	142.8 Å²	142.8	86%	0.857	75%	0.746	S	S	*	*				68.3	134.9	60.9	-81.5	-170.9	170.3	-173.3	-1.5	112
453	T	30.4	Very low	33.2	Very low	104 Å²	104	140 Å²	140	64%	0.638	75%	0.745	S	S	*	*			cis	-160.9	161.6	21.2	-7.5	0	0	0	0	111.4
454	T	31.8	Very low	33.1	Very low	116 Å²	116	140.3 Å²	140.3	71%	0.712	76%	0.756	S	S	*	*			trans	48.8	151.2	146.1	55.6	0	0	0	0	121.8
455	D	29.1	Very low	33	Very low	133 Å²	133	135 Å²	135	71%	0.711	75%	0.749	S	S	*	*			cis	-163.9	167.8	-31	-124.2	-59.1	0	0	0	110.8
456	T	32.4	Very low	32.9	Very low	116 Å²	116	134 Å²	134	71%	0.712	75%	0.749	S	S	*	*			trans	-38.2	177.2	164.8	46.4	0	0	0	0	119
457	P	50.7	Low	32.6	Very low	101 Å²	101	132.9 Å²	132.9	66%	0.656	75%	0.746	S	S	*	*			cis	-149.9	-175.5	-32.3	38	-17	0	0	0	117.8
458	I	32.7	Very low	32.4	Very low	141 Å²	141	132.3 Å²	132.3	72%	0.723	74%	0.742	S	S	*	*			trans	89.4	126.9	130.3	-95.2	162.9	0	0	0	125.3
459	N	33.5	Very low	32.3	Very low	136 Å²	136	131 Å²	131	73%	0.727	74%	0.743	S	S	*	*			trans	71.5	153.6	141.2	-68.1	2.5	0	0	0	128
460	S	32.3	Very low	32.3	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	74%	0.744	S	S	*	*			trans	75.7	154.4	147.6	62.7	0	0	0	0	120.5
461	E	32.6	Very low	32.3	Very low	162 Å²	162	138.2 Å²	138.2	76%	0.757	75%	0.751	S	S	*	*			cis	-167.6	159.7	-37	-124.3	179.7	-138.3	0	0	111.3
462	N	33.3	Very low	32.1	Very low	124 Å²	124	135.1 Å²	135.1	66%	0.663	75%	0.747	S	S	*	*			trans	57.4	136.2	151.9	-58	-28.1	0	0	0	125.7
463	S	31.8	Very low	32.2	Very low	114 Å²	114	132 Å²	132	80%	0.797	75%	0.747	S	S	*	*			trans	70.2	153.4	150.1	78.8	0	0	0	0	118.4
464	T	30.3	Very low	32.3	Very low	141 Å²	141	130.6 Å²	130.6	87%	0.865	75%	0.754	S	S	*	*			cis	-149.7	-173	-5	-12	0	0	0	0	107.9
465	G	28.1	Very low	32.5	Very low	56 Å²	56	130.4 Å²	130.4	58%	0.577	76%	0.757	S	S	*	*			cis	162.9	175.1	3	0	0	0	0	0	111.4
466	L	29.6	Very low	32.6	Very low	160 Å²	160	129.3 Å²	129.3	84%	0.838	76%	0.76	S	S	*	*			trans	66.1	146.8	170.7	-66.1	161.7	0	0	0	117.3
467	Q	28.8	Very low	32.6	Very low	167 Å²	167	128.8 Å²	128.8	78%	0.78	76%	0.761	S	S	*	*			cis	-158.3	165.2	-19.2	-157.9	168.9	16.5	0	0	111.7
468	C	28.3	Very low	31.7	Very low	109 Å²	109	132 Å²	132	74%	0.736	77%	0.765	S	S	*	*			trans	-15.7	156.8	173.1	-57.6	0	0	0	0	121.6
469	S	31.3	Very low	31.6	Very low	111 Å²	111	131.3 Å²	131.3	78%	0.776	76%	0.762	S	S	*	*			cis	-162.7	155	48.8	-58.4	0	0	0	0	117.2
470	R	32.3	Very low	31.5	Very low	230 Å²	230	130.1 Å²	130.1	87%	0.868	76%	0.756	S	S	*	*			trans	16.4	151.3	143.2	-62.9	-177.8	172.3	158.4	-2	120.8
471	E	32.1	Very low	31.4	Very low	175 Å²	175	134.4 Å²	134.4	82%	0.818	76%	0.755	S	S	*	*			cis	-132.9	150	20.5	-68.8	-179.4	151.7	0	0	110.5
472	C	31.8	Very low	31.2	Very low	103 Å²	103	136.7 Å²	136.7	70%	0.696	76%	0.757	S	S	*	*				66.4	126.8	55.4	-69.3	0	0	0	0	113.1
473	N	32.5	Very low	31	Very low	161 Å²	161	136.3 Å²	136.3	86%	0.861	76%	0.762	S	S	*	*			cis	-137	177.1	2.4	-65.8	-57.5	0	0	0	108.4
474	G	34.1	Very low	31	Very low	75 Å²	75	136.5 Å²	136.5	77%	0.773	76%	0.763	S	S	*	*			cis	141.8	154.1	22.8	0	0	0	0	0	106.5
475	S	34.1	Very low	31.1	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	76%	0.764	S	S	*	*			cis	-156	140.3	10.1	53.4	0	0	0	0	112.5
476	S	31.8	Very low	31.4	Very low	111 Å²	111	141.7 Å²	141.7	78%	0.776	78%	0.776	S	S	*	*			trans	8.1	150.4	139.3	53.7	0	0	0	0	120.9
477	S	32.4	Very low	31.6	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	78%	0.779	S	S	*	*			cis	-153.1	138.7	47.3	-170	0	0	0	0	110.7
478	K	31.1	Very low	31.7	Very low	169 Å²	169	137.5 Å²	137.5	74%	0.735	78%	0.776	S	S	*	*				57.6	109	67.7	-74.8	-162.9	174.2	-176.1	0	113.1
479	D	32.5	Very low	32	Very low	126 Å²	126	143.7 Å²	143.7	67%	0.674	79%	0.785	S	S	*	*				90.7	148.2	89.7	-79.6	-38	0	0	0	111.9
480	N	30.2	Very low	31.9	Very low	111 Å²	111	146.7 Å²	146.7	59%	0.594	79%	0.787	S	S	*	*			cis	-161.3	156.1	-1.9	-130.7	-57.9	0	0	0	111.8
481	R	29.8	Very low	32.1	Very low	202 Å²	202	143.8 Å²	143.8	76%	0.762	79%	0.786	S	S	*	*			trans	60.5	136.8	144.6	-83.7	160.4	-169.2	-150	-1.3	125.3
482	R	28.7	Very low	32	Very low	209 Å²	209	143.9 Å²	143.9	79%	0.789	79%	0.786	S	S	*	*			trans	100.2	108.2	132.3	-83.2	176.3	176.4	-179.6	-1.5	122.8
483	C	30	Very low	32.3	Very low	116 Å²	116	146.9 Å²	146.9	78%	0.784	79%	0.794	S	S	*	*				63.6	110.8	124.4	-61	0	0	0	0	123.1
484	C	32	Very low	32.3	Very low	119 Å²	119	148.4 Å²	148.4	80%	0.804	79%	0.793	S	S	*	*				-162.7	119	116.1	-105.2	0	0	0	0	109.3
485	K	31.9	Very low	32.1	Very low	205 Å²	205	148.3 Å²	148.3	89%	0.891	79%	0.791	S	S	*	*				64.1	98.9	96.7	-78.5	-167.6	174.4	-174.7	0	115.8
486	A	34.6	Very low	32.3	Very low	100 Å²	100	150 Å²	150	83%	0.826	79%	0.792	S	S	*	*			trans	-149.9	151.5	151.4	0	0	0	0	0	109
487	N	32.8	Very low	32.9	Very low	171 Å²	171	153.7 Å²	153.7	91%	0.914	80%	0.797	S	S	*	*			trans	-92.6	159.9	-177.1	-54.1	-27.4	0	0	0	110.4
488	G	31	Very low	33.4	Very low	68 Å²	68	157.9 Å²	157.9	70%	0.701	80%	0.802	S	S	*	*			cis	138.4	69.5	-0	0	0	0	0	0	112.6
489	Y	34.5	Very low	34.1	Very low	239 Å²	239	154.2 Å²	154.2	94%	0.937	80%	0.796	S	S	*	*			trans	-144.9	96.5	168.7	-112.4	-83.4	0	0	0	108.9
490	E	29.8	Very low	35.5	Very low	174 Å²	174	153.6 Å²	153.6	81%	0.813	80%	0.796	S	S	*	*			trans	-120.2	120.3	-174	-172	171.7	-166.6	0	0	110.1	H492	E490-H492 PolarHBondContact O-N 3.03Å
491	M	37.3	Very low	36.4	Very low	170 Å²	170	152.1 Å²	152.1	84%	0.837	80%	0.8	S	S	*	*			trans	-83.1	109.4	178.4	-85.6	-72.4	169.9	0	0	110.3	L493	M491-L493 VanDerWaalsContact C-N 3.31Å; M491-L493 PolarHBondContact O-N 3.16Å
492	H	30.2	Very low	37.9	Very low	177 Å²	177	151 Å²	151	82%	0.819	80%	0.8	S	S	*	*			trans	-66.7	82.4	177.4	-94.6	-55.4	0	0	0	112.9	E490 K494	E490-H492 PolarHBondContact O-N 3.03Å; H492-K494 PolarHBondContact O-N 2.99Å
493	L	36.4	Very low	39.7	Very low	166 Å²	166	145 Å²	145	87%	0.869	78%	0.781	S	S	*	*			trans	-70.5	100.4	157.4	-88	158.9	0	0	0	108.9	M491 G495	M491-L493 VanDerWaalsContact C-N 3.31Å; M491-L493 PolarHBondContact O-N 3.16Å; L493-G495 PolarHBondContact O-N 2.94Å; L493-G495 VanDerWaalsContact O-N 3.13Å
494	K	34.3	Very low	40.9	Very low	193 Å²	193	143 Å²	143	84%	0.839	77%	0.768	S	S	*	*			trans	-62.6	113.2	165.6	-77.5	-174.4	175.9	-179.6	0	108.4	H492 D496	H492-K494 PolarHBondContact O-N 2.99Å; K494-D496 PolarHBondContact O-N 3.05Å
495	G	29.5	Very low	42.5	Very low	72 Å²	72	142.4 Å²	142.4	74%	0.742	76%	0.756	S	S	*	*			trans	-72.6	103.9	171.9	0	0	0	0	0	110.5	L493 Q497	L493-G495 PolarHBondContact O-N 2.94Å; L493-G495 VanDerWaalsContact O-N 3.13Å; G495-Q497 PolarHBondContact O-N 3.32Å
496	D	37.1	Very low	44.4	Very low	147 Å²	147	138.5 Å²	138.5	79%	0.786	74%	0.739	S	S	*	*			trans	-59.3	125	165.4	-74.9	-29.9	0	0	0	108.8	K494 F498	K494-D496 PolarHBondContact O-N 3.05Å; D496-F498 PolarHBondContact O-N 2.77Å; D496-F498 VanDerWaalsContact O-N 3.11Å
497	Q	44.3	Very low	46.1	Very low	189 Å²	189	137.2 Å²	137.2	88%	0.883	72%	0.719	S	S	*	*			trans	-67.2	113	175.8	-75.1	-173.9	-9	0	0	109.6	G495	G495-Q497 PolarHBondContact O-N 3.32Å
498	F	42.8	Very low	47.6	Very low	193 Å²	193	133.2 Å²	133.2	85%	0.846	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-56.4	127.4	167.2	-73.5	-87.5	0	0	0	109.3	D496 T500	D496-F498 PolarHBondContact O-N 2.77Å; D496-F498 VanDerWaalsContact O-N 3.11Å; F498-T500 PolarHBondContact O-N 2.88Å; F498-T500 VanDerWaalsContact O-N 3.13Å
499	P	47.3	Very low	50	Low	92 Å²	92	135.7 Å²	135.7	60%	0.597	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-60.5	122	176.5	24.5	-32.7	0	0	0	108.8	Q503	P499-Q503 HydrophobicContact CB-CB 4.27Å; P499-Q503 HydrophobicContact CB-CG 4.23Å
500	T	60.9	Low	51.8	Low	112 Å²	112	127.9 Å²	127.9	69%	0.687	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-57.9	147.3	-179.2	-21.2	0	0	0	0	109.3	F498 K502 Q503	F498-T500 PolarHBondContact O-N 2.88Å; F498-T500 VanDerWaalsContact O-N 3.13Å; T500-K502 PolarHBondContact O-N 3.37Å; T500-Q503 WeakPolarHBondContact O-CB 3.48Å; T500-Q503 PolarHBondContact O-N 3.32Å
501	A	49.7	Very low	54.4	Low	81 Å²	81	126.2 Å²	126.2	67%	0.669	66%	0.658	S	S	*	*	H	α-helix	trans	-52	-28.3	-172.5	0	0	0	0	0	114.9	L505	A501-L505 PolarHBondContact O-N 3.17Å; A501-L505 VanDerWaalsContact O-N 3.17Å
502	K	60.6	Low	55.6	Low	177 Å²	177	123 Å²	123	77%	0.77	64%	0.644	S	S	*	*	H	α-helix	trans	-64.1	-35.8	173.1	-65.3	-176.1	176.3	-177.2	0	113.9	T500 K506	T500-K502 PolarHBondContact O-N 3.37Å; K502-K506 PolarHBondContact O-N 3.44Å; K502-K506 VanDerWaalsContact O-N 3.08Å
503	Q	67.6	Low	58	Low	84 Å²	84	120.1 Å²	120.1	39%	0.393	63%	0.631	S	S	.	*	H	α-helix	trans	-69.6	-46	177.6	-176.5	56.2	40.2	0	0	110.6	P499 T500 L505 K506 D507	P499-Q503 HydrophobicContact CB-CB 4.27Å; P499-Q503 HydrophobicContact CB-CG 4.23Å; T500-Q503 WeakPolarHBondContact O-CB 3.48Å; T500-Q503 PolarHBondContact O-N 3.32Å; Q503-L505 VanDerWaalsContact C-N 3.28Å; Q503-L505 PolarHBondContact O-N 3.08Å; Q503-K506 PolarHBondContact O-N 3.41Å; Q503-D507 WeakPolarHBondContact CG-OD2 3.36Å; Q503-D507 PolarHBondContact NE2-OD1 2.92Å; Q503-D507 PolarHBondContact NE2-OD2 2.84Å; Q503-D507 VanDerWaalsContact O-CG 3.29Å; Q503-D507 PolarHBondContact O-N 3.47Å
504	C	53.9	Low	59.5	Low	73 Å²	73	118.5 Å²	118.5	49%	0.493	62%	0.619	S	S	.	*	H	α-helix	trans	-60.4	-36.3	176.2	-170.8	0	0	0	0	112.8	T508	C504-T508 WeakPolarHBondContact O-CB 3.48Å; C504-T508 PolarHBondContact O-N 3.34Å; C504-T508 VanDerWaalsContact O-N 3.1Å; C504-T508 PolarHBondContact O-OG1 3.42Å
505	L	67.1	Low	61.3	Low	108 Å²	108	114.3 Å²	114.3	57%	0.565	60%	0.601	S	S	*	*	H	α-helix	trans	-60.3	-52.4	168.9	-112.8	164.5	0	0	0	111.8	A501 Q503 D507 T508 E509	A501-L505 PolarHBondContact O-N 3.17Å; A501-L505 VanDerWaalsContact O-N 3.17Å; Q503-L505 VanDerWaalsContact C-N 3.28Å; Q503-L505 PolarHBondContact O-N 3.08Å; L505-D507 VanDerWaalsContact C-N 3.31Å; L505-D507 PolarHBondContact O-N 3.25Å; L505-T508 WeakPolarHBondContact O-CB 3.39Å; L505-T508 PolarHBondContact O-N 2.94Å; L505-T508 VanDerWaalsContact O-N 3.09Å; L505-E509 PolarHBondContact O-N 3.4Å
506	K	71.4	Confident	63.2	Low	122 Å²	122	115.4 Å²	115.4	53%	0.53	59%	0.59	S	S	.	*	H	α-helix	trans	-62.3	-34.6	-179.7	-169.5	175.5	-177.1	-179.3	0	113.3	K502 Q503 E509 N510	K502-K506 PolarHBondContact O-N 3.44Å; K502-K506 VanDerWaalsContact O-N 3.08Å; Q503-K506 PolarHBondContact O-N 3.41Å; K506-E509 PolarHBondContact O-N 3Å; K506-N510 WeakPolarHBondContact O-CB 3.26Å; K506-N510 PolarHBondContact O-N 3.29Å
507	D	70.8	Confident	64.7	Low	74 Å²	74	117.1 Å²	117.1	40%	0.396	59%	0.585	S	S	.	*	H	α-helix	trans	-72.2	-32.4	176	-66.1	-33.3	0	0	0	111.6	Q503 L505 F511	Q503-D507 WeakPolarHBondContact CG-OD2 3.36Å; Q503-D507 PolarHBondContact NE2-OD1 2.92Å; Q503-D507 PolarHBondContact NE2-OD2 2.84Å; Q503-D507 VanDerWaalsContact O-CG 3.29Å; Q503-D507 PolarHBondContact O-N 3.47Å; L505-D507 VanDerWaalsContact C-N 3.31Å; L505-D507 PolarHBondContact O-N 3.25Å; D507-F511 WeakPolarHBondContact O-CB 3.36Å; D507-F511 PolarHBondContact O-N 3.19Å
508	T	64.3	Low	65.7	Low	87 Å²	87	113.1 Å²	113.1	53%	0.534	57%	0.574	S	S	.	*	H	α-helix	trans	-68.7	-40.9	171.9	-55.3	0	0	0	0	111.5	C504 L505 F511 L512	C504-T508 WeakPolarHBondContact O-CB 3.48Å; C504-T508 PolarHBondContact O-N 3.34Å; C504-T508 VanDerWaalsContact O-N 3.1Å; C504-T508 PolarHBondContact O-OG1 3.42Å; L505-T508 WeakPolarHBondContact O-CB 3.39Å; L505-T508 PolarHBondContact O-N 2.94Å; L505-T508 VanDerWaalsContact O-N 3.09Å; T508-F511 PolarHBondContact O-N 3.34Å; T508-L512 WeakPolarHBondContact O-CB 3.29Å; T508-L512 PolarHBondContact O-N 2.9Å
509	E	80.3	Confident	66.4	Low	120 Å²	120	110.6 Å²	110.6	56%	0.561	56%	0.563	S	S	*	*	H	α-helix	trans	-64.5	-47.2	174.3	-70.6	172.3	163.8	0	0	111.5	L505 K506 F511 L512 E513	L505-E509 PolarHBondContact O-N 3.4Å; K506-E509 PolarHBondContact O-N 3Å; E509-F511 VanDerWaalsContact C-N 3.32Å; E509-F511 PolarHBondContact O-N 3.41Å; E509-L512 PolarHBondContact O-N 2.96Å; E509-E513 PolarHBondContact O-N 3.23Å
510	N	72.6	Confident	66.6	Low	74 Å²	74	110.3 Å²	110.3	40%	0.396	57%	0.568	S	S	.	*	H	α-helix	trans	-55.7	-43.5	173	-93.8	-36.2	0	0	0	112.5	K506 E513 Q514	K506-N510 WeakPolarHBondContact O-CB 3.26Å; K506-N510 PolarHBondContact O-N 3.29Å; N510-E513 PolarHBondContact O-N 2.91Å; N510-Q514 WeakPolarHBondContact O-CG 3.34Å; N510-Q514 PolarHBondContact O-N 3.32Å
511	F	83.6	Confident	65.9	Low	139 Å²	139	114 Å²	114	61%	0.61	57%	0.574	S	S	*	*	H	α-helix	trans	-63.7	-43.7	177.5	176.7	-95.7	0	0	0	111.7	D507 T508 E509 Q514 F515	D507-F511 WeakPolarHBondContact O-CB 3.36Å; D507-F511 PolarHBondContact O-N 3.19Å; T508-F511 PolarHBondContact O-N 3.34Å; E509-F511 VanDerWaalsContact C-N 3.32Å; E509-F511 PolarHBondContact O-N 3.41Å; F511-Q514 PolarHBondContact O-N 2.9Å; F511-F515 WeakPolarHBondContact O-CB 3.48Å; F511-F515 PolarHBondContact O-N 3.03Å
512	L	64.2	Low	65.6	Low	104 Å²	104	115.8 Å²	115.8	55%	0.545	58%	0.577	S	S	.	*	H	α-helix	trans	-66.4	-37.4	178.6	-165.3	68.1	0	0	0	111.9	T508 E509 F515 N516	T508-L512 WeakPolarHBondContact O-CB 3.29Å; T508-L512 PolarHBondContact O-N 2.9Å; E509-L512 PolarHBondContact O-N 2.96Å; L512-F515 PolarHBondContact O-N 2.95Å; L512-N516 VanDerWaalsContact O-CG 3.3Å; L512-N516 PolarHBondContact O-N 2.95Å; L512-N516 PolarHBondContact O-ND2 3.2Å; L512-N516 VanDerWaalsContact O-ND2 3.13Å
513	E	78.7	Confident	64.6	Low	115 Å²	115	117.2 Å²	117.2	54%	0.537	58%	0.583	S	S	.	*	H	α-helix	trans	-65.1	-46.9	173.2	-164	-169.6	147	0	0	111.4	E509 N510 F515 N516 R517	E509-E513 PolarHBondContact O-N 3.23Å; N510-E513 PolarHBondContact O-N 2.91Å; E513-F515 VanDerWaalsContact C-N 3.33Å; E513-F515 PolarHBondContact O-N 3.42Å; E513-N516 PolarHBondContact O-N 3.38Å; E513-R517 VanDerWaalsContact O-CB 3.31Å; E513-R517 WeakPolarHBondContact O-CB 3.46Å; E513-R517 PolarHBondContact O-N 2.94Å
514	Q	68.5	Low	63.1	Low	133 Å²	133	118.7 Å²	118.7	62%	0.621	60%	0.603	S	S	*	*	H	α-helix	trans	-59.9	-42.2	175.7	-74.7	-171.9	18.5	0	0	112.3	N510 F511 R517 V518	N510-Q514 WeakPolarHBondContact O-CG 3.34Å; N510-Q514 PolarHBondContact O-N 3.32Å; F511-Q514 PolarHBondContact O-N 2.9Å; Q514-R517 PolarHBondContact O-N 3.47Å; Q514-V518 WeakPolarHBondContact O-CG2 3.46Å; Q514-V518 PolarHBondContact O-N 2.83Å; Q514-V518 VanDerWaalsContact O-N 3.09Å
515	F	71.7	Confident	62.2	Low	105 Å²	105	124.6 Å²	124.6	46%	0.461	62%	0.623	S	S	.	*	H	α-helix	trans	-57.7	-52.3	176	-173.5	-90.6	0	0	0	111.1	F511 L512 E513 R517 V518 F519	F511-F515 WeakPolarHBondContact O-CB 3.48Å; F511-F515 PolarHBondContact O-N 3.03Å; L512-F515 PolarHBondContact O-N 2.95Å; E513-F515 VanDerWaalsContact C-N 3.33Å; E513-F515 PolarHBondContact O-N 3.42Å; F515-R517 VanDerWaalsContact C-N 3.29Å; F515-R517 PolarHBondContact O-N 3.23Å; F515-V518 PolarHBondContact O-N 3.37Å; F515-F519 HydrophobicContact CD1-CD2 4.12Å; F515-F519 HydrophobicContact CD1-CE2 4.32Å; F515-F519 HydrophobicContact CD2-CE2 4.31Å; F515-F519 AromaticContact CE1-CD2 3.85Å; F515-F519 HydrophobicContact CE1-CD2 3.85Å; F515-F519 AromaticContact CE1-CE2 3.77Å; F515-F519 HydrophobicContact CE1-CE2 3.77Å; F515-F519 HydrophobicContact CE2-CD2 4.48Å; F515-F519 AromaticContact CE2-CE2 3.77Å; F515-F519 HydrophobicContact CE2-CE2 3.77Å; F515-F519 HydrophobicContact CZ-CD2 4.04Å; F515-F519 AromaticContact CZ-CE2 3.47Å; F515-F519 HydrophobicContact CZ-CE2 3.47Å; F515-F519 VanDerWaalsContact CZ-CE2 3.47Å; F515-F519 HydrophobicContact CZ-CZ 4.28Å; F515-F519 WeakPolarHBondContact O-CD2 3.46Å; F515-F519 PolarHBondContact O-N 3.41Å
516	N	70.6	Confident	60.9	Low	94 Å²	94	128.3 Å²	128.3	50%	0.503	64%	0.638	S	S	.	*	H	α-helix	trans	-60.6	-37.4	177.2	-70.1	-31.1	0	0	0	112.3	L512 E513 V518 F519 A520	L512-N516 VanDerWaalsContact O-CG 3.3Å; L512-N516 PolarHBondContact O-N 2.95Å; L512-N516 PolarHBondContact O-ND2 3.2Å; L512-N516 VanDerWaalsContact O-ND2 3.13Å; E513-N516 PolarHBondContact O-N 3.38Å; N516-V518 VanDerWaalsContact C-N 3.3Å; N516-V518 PolarHBondContact O-N 3.31Å; N516-F519 PolarHBondContact O-N 3.16Å; N516-A520 WeakPolarHBondContact O-CB 3.33Å; N516-A520 PolarHBondContact O-N 3.49Å
517	R	67.4	Low	58.9	Low	183 Å²	183	129.6 Å²	129.6	69%	0.691	66%	0.656	S	S	*	*	H	α-helix	trans	-67.2	-26.5	178.9	-157.7	175.3	-161.3	165.3	5.6	113.5	E513 Q514 F515	E513-R517 VanDerWaalsContact O-CB 3.31Å; E513-R517 WeakPolarHBondContact O-CB 3.46Å; E513-R517 PolarHBondContact O-N 2.94Å; Q514-R517 PolarHBondContact O-N 3.47Å; F515-R517 VanDerWaalsContact C-N 3.29Å; F515-R517 PolarHBondContact O-N 3.23Å
518	V	66.8	Low	57.3	Low	106 Å²	106	134.3 Å²	134.3	64%	0.642	68%	0.681	S	S	*	*	H	α-helix	trans	-74.9	-44.3	173	170.7	0	0	0	0	111.1	Q514 F515 N516	Q514-V518 WeakPolarHBondContact O-CG2 3.46Å; Q514-V518 PolarHBondContact O-N 2.83Å; Q514-V518 VanDerWaalsContact O-N 3.09Å; F515-V518 PolarHBondContact O-N 3.37Å; N516-V518 VanDerWaalsContact C-N 3.3Å; N516-V518 PolarHBondContact O-N 3.31Å
519	F	55.8	Low	55.6	Low	140 Å²	140	136 Å²	136	61%	0.614	70%	0.695	S	S	*	*	H	α-helix	trans	-75.8	-22.8	-178.9	-78.8	-81.5	0	0	0	114.3	F515 N516 K521	F515-F519 HydrophobicContact CD1-CD2 4.12Å; F515-F519 HydrophobicContact CD1-CE2 4.32Å; F515-F519 HydrophobicContact CD2-CE2 4.31Å; F515-F519 AromaticContact CE1-CD2 3.85Å; F515-F519 HydrophobicContact CE1-CD2 3.85Å; F515-F519 AromaticContact CE1-CE2 3.77Å; F515-F519 HydrophobicContact CE1-CE2 3.77Å; F515-F519 HydrophobicContact CE2-CD2 4.48Å; F515-F519 AromaticContact CE2-CE2 3.77Å; F515-F519 HydrophobicContact CE2-CE2 3.77Å; F515-F519 HydrophobicContact CZ-CD2 4.04Å; F515-F519 AromaticContact CZ-CE2 3.47Å; F515-F519 HydrophobicContact CZ-CE2 3.47Å; F515-F519 VanDerWaalsContact CZ-CE2 3.47Å; F515-F519 HydrophobicContact CZ-CZ 4.28Å; F515-F519 WeakPolarHBondContact O-CD2 3.46Å; F515-F519 PolarHBondContact O-N 3.41Å; N516-F519 PolarHBondContact O-N 3.16Å; F519-K521 PolarHBondContact O-N 2.98Å
520	A	52.1	Low	53.2	Low	86 Å²	86	137 Å²	137	71%	0.711	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-6.6	179.4	0	0	0	0	0	115	N516	N516-A520 WeakPolarHBondContact O-CB 3.33Å; N516-A520 PolarHBondContact O-N 3.49Å
521	K	47.4	Very low	51.3	Low	188 Å²	188	142.6 Å²	142.6	82%	0.817	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	11.3	-162.3	-124.6	-173	-178.5	-167.8	0	117.1	F519	F519-K521 PolarHBondContact O-N 2.98Å
522	T	41.5	Very low	48.7	Very low	119 Å²	119	140.7 Å²	140.7	73%	0.73	73%	0.729	S	S	*	*			trans	-125.2	82.9	179.7	52.8	0	0	0	0	112.3
523	K	39.9	Very low	47.1	Very low	207 Å²	207	146.1 Å²	146.1	90%	0.9	74%	0.743	S	S	*	*			trans	-169.8	85.6	164.9	-112.7	168.7	-176.3	-177.7	0	113.1
524	S	37.7	Very low	44.7	Very low	116 Å²	116	147.1 Å²	147.1	81%	0.811	75%	0.752	S	S	*	*			trans	178	111	159.6	3.3	0	0	0	0	103.9
525	E	33.1	Very low	42.8	Very low	196 Å²	196	146.5 Å²	146.5	92%	0.916	76%	0.757	S	S	*	*			cis	76.4	128.8	43.7	-157.5	162.7	-144.2	0	0	112.6
526	E	40	Very low	40.8	Very low	187 Å²	187	146.8 Å²	146.8	87%	0.874	77%	0.772	S	S	*	*			trans	-89.9	164.1	-161.3	-58.9	168.6	109.7	0	0	113
527	T	30.9	Very low	38.8	Very low	149 Å²	149	146.3 Å²	146.3	91%	0.914	78%	0.782	S	S	*	*			trans	-158.9	141.5	151.7	-9.4	0	0	0	0	112.3
528	L	36.3	Very low	37	Very low	173 Å²	173	147.4 Å²	147.4	91%	0.906	79%	0.792	S	S	*	*			trans	-92.7	146.3	179	-72	155.2	0	0	0	112
529	S	28.4	Very low	35.1	Very low	121 Å²	121	147.4 Å²	147.4	85%	0.846	80%	0.797	S	S	*	*			trans	-166.3	151	144.3	-127.3	0	0	0	0	113.9
530	D	30.4	Very low	33.9	Very low	141 Å²	141	145.1 Å²	145.1	75%	0.754	80%	0.803	S	S	*	*			trans	-83.5	154.5	-177.7	-51.4	-91.1	0	0	0	114.5
531	K	31.6	Very low	32.9	Very low	193 Å²	193	148.3 Å²	148.3	84%	0.839	81%	0.809	S	S	*	*				175.8	129.4	106.4	-97.4	158.5	-173.2	166.4	0	118
532	S	30.2	Very low	33.2	Very low	98 Å²	98	144 Å²	144	69%	0.685	80%	0.8	S	S	*	*				73.2	122.8	128.8	75.1	0	0	0	0	124.3
533	R	29.8	Very low	32.8	Very low	218 Å²	218	143.2 Å²	143.2	82%	0.823	80%	0.795	S	S	*	*				86.1	121.1	126	-80.8	-178.5	176	176.8	-0.7	122.6
534	N	29.1	Very low	32.5	Very low	136 Å²	136	141.5 Å²	141.5	73%	0.727	79%	0.787	S	S	*	*			trans	72.9	154.9	142	-51.8	-0.8	0	0	0	116.7
535	T	28.6	Very low	32.3	Very low	120 Å²	120	142.1 Å²	142.1	74%	0.736	78%	0.777	S	S	*	*			cis	-156	153.6	13.4	-27.8	0	0	0	0	111.7
536	S	29.1	Very low	32.3	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	76%	0.761	S	S	*	*			trans	58.8	152.5	150.3	50.1	0	0	0	0	120.6
537	A	28.5	Very low	32	Very low	85 Å²	85	135.1 Å²	135.1	70%	0.702	75%	0.753	S	S	*	*			cis	-167.4	172.5	-11.6	0	0	0	0	0	110.7
538	F	29.5	Very low	32.2	Very low	205 Å²	205	134.1 Å²	134.1	90%	0.899	75%	0.746	S	S	*	*			trans	-3.4	152.8	156.3	-66.3	-91.4	0	0	0	120
539	S	28.1	Very low	32.1	Very low	107 Å²	107	133 Å²	133	75%	0.748	74%	0.737	S	S	*	*			cis	-167.2	-179.9	31.1	-153.4	0	0	0	0	114.8
540	A	30.1	Very low	32.2	Very low	91 Å²	91	135.8 Å²	135.8	75%	0.752	74%	0.736	S	S	*	*			trans	72.4	94.1	150	0	0	0	0	0	121.3
541	N	31.7	Very low	32.1	Very low	154 Å²	154	132 Å²	132	82%	0.824	73%	0.73	S	S	*	*			trans	-75.1	-175.6	141.6	-129	-8.1	0	0	0	109
542	P	52.4	Low	32.1	Very low	98 Å²	98	129.2 Å²	129.2	64%	0.636	73%	0.729	S	S	*	*			cis	-130.5	-141.5	-2.3	27.5	0.7	0	0	0	111.2
543	T	32.9	Very low	32.2	Very low	102 Å²	102	131.6 Å²	131.6	63%	0.626	73%	0.729	S	S	*	*			cis	-170.4	156	10.4	-6.4	0	0	0	0	111
544	K	34.2	Very low	32.4	Very low	170 Å²	170	127 Å²	127	74%	0.739	72%	0.721	S	S	*	*			trans	70.3	156.8	146.3	-68.1	176.8	161.4	-149.5	0	119.2
545	Q	32.7	Very low	32.5	Very low	129 Å²	129	127.2 Å²	127.2	60%	0.603	72%	0.722	S	S	*	*			cis	-160.4	157.4	-7.5	-115.4	-177.3	-106.5	0	0	111.8
546	N	33.1	Very low	32.7	Very low	106 Å²	106	129.4 Å²	129.4	57%	0.567	73%	0.728	S	S	*	*			trans	60.8	126.5	144.2	-67.8	41.8	0	0	0	121
547	D	34.4	Very low	32.7	Very low	131 Å²	131	128 Å²	128	70%	0.701	73%	0.731	S	S	*	*				90.7	152.9	86.1	-58.5	-11.1	0	0	0	112
548	T	34.3	Very low	33	Very low	127 Å²	127	132.4 Å²	132.4	78%	0.779	74%	0.737	S	S	*	*			cis	-148.8	172.7	4	-11.5	0	0	0	0	111.9
549	E	34	Very low	33	Very low	151 Å²	151	129.2 Å²	129.2	71%	0.706	73%	0.728	S	S	*	*			trans	-63.9	-178.8	-172.2	-57.1	167.2	111.7	0	0	120.1
550	H	30.6	Very low	33.2	Very low	178 Å²	178	129.2 Å²	129.2	82%	0.824	72%	0.723	S	S	*	*			trans	71.5	141.4	164.2	-60.3	-58.1	0	0	0	119
551	G	29.7	Very low	33.4	Very low	62 Å²	62	134.1 Å²	134.1	64%	0.639	73%	0.727	S	S	*	*			cis	150.9	160.3	-9	0	0	0	0	0	113.5
552	V	30.2	Very low	33.6	Very low	134 Å²	134	136.3 Å²	136.3	81%	0.812	73%	0.73	S	S	*	*			trans	68.5	139	163.2	178.5	0	0	0	0	115.7
553	E	32.5	Very low	33.2	Very low	148 Å²	148	137.1 Å²	137.1	69%	0.692	74%	0.735	S	S	*	*			cis	-168.1	159.3	-19.3	-109.1	-173.4	-169.1	0	0	108.2
554	N	34.8	Very low	33	Very low	121 Å²	121	141.6 Å²	141.6	65%	0.647	75%	0.746	S	S	*	*			trans	55.8	158.5	142.5	-66.5	-31.1	0	0	0	120.9
555	L	32	Very low	32.8	Very low	142 Å²	142	138.7 Å²	138.7	74%	0.743	75%	0.746	S	S	*	*			cis	-155.5	-178.2	-12.7	-117.4	167.7	0	0	0	110.5
556	L	32	Very low	32.7	Very low	165 Å²	165	141.4 Å²	141.4	86%	0.864	76%	0.756	S	S	*	*			trans	-41.6	153	179.1	-91.1	65.8	0	0	0	117.8
557	G	28.6	Very low	32.5	Very low	82 Å²	82	142.5 Å²	142.5	85%	0.845	77%	0.766	S	S	*	*			trans	-175.9	93.1	166.1	0	0	0	0	0	114.9
558	E	34.3	Very low	32.2	Very low	178 Å²	178	141.3 Å²	141.3	83%	0.832	77%	0.768	S	S	*	*			trans	-86.5	172.7	-165.6	-156.5	-161.1	-178.1	0	0	116.1
559	I	30.5	Very low	31.9	Very low	137 Å²	137	139.8 Å²	139.8	70%	0.703	76%	0.763	S	S	*	*			trans	80.8	133.4	154.1	-15.4	179.9	0	0	0	122.3
560	V	31.8	Very low	31.7	Very low	107 Å²	107	139 Å²	139	65%	0.648	77%	0.769	S	S	*	*			trans	118.3	126.3	140.2	-176.3	0	0	0	0	119.9
561	K	33.7	Very low	31.6	Very low	195 Å²	195	136.2 Å²	136.2	85%	0.848	77%	0.769	S	S	*	*			trans	71.2	108.7	157.1	-77.4	158.5	-158.8	163.5	0	122.5
562	K	36.4	Very low	31.5	Very low	200 Å²	200	139.3 Å²	139.3	87%	0.87	78%	0.779	S	S	*	*			trans	-63.8	157	143.8	-67	175.7	171.5	172.3	0	110.6
563	P	43.5	Very low	31.6	Very low	114 Å²	114	141.2 Å²	141.2	74%	0.74	78%	0.784	S	S	*	*				-151.3	148.7	89.7	37.7	-19.5	0	0	0	118.3
564	K	30.3	Very low	31.4	Very low	197 Å²	197	143.2 Å²	143.2	86%	0.857	79%	0.794	S	S	*	*			trans	42.3	122.5	142.9	-57.3	173.5	-179.2	176.8	0	120.3
565	S	30.5	Very low	31.3	Very low	108 Å²	108	142.1 Å²	142.1	76%	0.755	80%	0.802	S	S	*	*				166.6	165.6	92.3	61.1	0	0	0	0	114.4
566	K	29.8	Very low	31.3	Very low	186 Å²	186	145.1 Å²	145.1	81%	0.809	81%	0.809	S	S	*	*			trans	52.4	117.5	159.8	-70.7	175.2	176.4	178.9	0	118.8
567	V	28.4	Very low	31.2	Very low	129 Å²	129	142.7 Å²	142.7	78%	0.782	81%	0.806	S	S	*	*				80.7	133.8	63.5	169.9	0	0	0	0	112.9
568	S	27.8	Very low	31.4	Very low	106 Å²	106	144 Å²	144	74%	0.741	80%	0.802	S	S	*	*			trans	71.4	154.7	-179.8	-67.2	0	0	0	0	116.3
569	S	29.6	Very low	31.5	Very low	95 Å²	95	144.9 Å²	144.9	66%	0.664	81%	0.806	S	S	*	*			cis	-178.8	168.6	-28.9	-95.4	0	0	0	0	106.9
570	T	28.3	Very low	31.7	Very low	136 Å²	136	146.8 Å²	146.8	83%	0.834	81%	0.812	S	S	*	*			trans	51.3	115.5	158.5	50.6	0	0	0	0	119.3
571	S	28.2	Very low	32.1	Very low	118 Å²	118	146.4 Å²	146.4	83%	0.825	81%	0.814	S	S	*	*				-167	141.2	108.5	32.5	0	0	0	0	110.7
572	C	28.6	Very low	32.5	Very low	127 Å²	127	143.3 Å²	143.3	86%	0.858	81%	0.807	S	S	*	*			trans	-93.6	144.3	166.9	-58.9	0	0	0	0	108.3
573	L	31.9	Very low	33.1	Very low	174 Å²	174	142 Å²	142	91%	0.911	80%	0.801	S	S	*	*			trans	-118.7	133.1	163	-81.3	172.9	0	0	0	109.4
574	E	29.7	Very low	33.4	Very low	190 Å²	190	140.3 Å²	140.3	89%	0.888	79%	0.792	S	S	*	*			trans	-80.6	121.8	-176.3	-58.7	177.1	124.8	0	0	110.7
575	A	31.1	Very low	34.6	Very low	99 Å²	99	134.6 Å²	134.6	82%	0.818	77%	0.773	S	S	*	*			trans	-102.3	116.5	167.8	0	0	0	0	0	109.5	S577	A575-S577 PolarHBondContact O-N 2.99Å
576	K	31.9	Very low	35.8	Very low	204 Å²	204	135.4 Å²	135.4	89%	0.887	77%	0.765	S	S	*	*			trans	-75.9	105.2	-178.7	-66.9	174.7	-179.5	173.7	0	110.4	S578	K576-S578 PolarHBondContact O-N 3.35Å
577	S	29.9	Very low	37.7	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	76%	0.76	S	S	*	*			trans	-77.8	109	173	54.1	0	0	0	0	111.1	A575	A575-S577 PolarHBondContact O-N 2.99Å
578	S	32.9	Very low	39.7	Very low	109 Å²	109	134.2 Å²	134.2	76%	0.762	75%	0.751	S	S	*	*			trans	-72.5	125.4	169.2	-175.9	0	0	0	0	110.3	K576 Q580	K576-S578 PolarHBondContact O-N 3.35Å; S578-Q580 PolarHBondContact O-N 3.38Å
579	E	36.6	Very low	41.8	Very low	197 Å²	197	134.7 Å²	134.7	92%	0.921	75%	0.745	S	S	*	*			trans	-69.9	116.6	172.6	-68.3	-170.2	118.4	0	0	110.6
580	Q	34.7	Very low	43.2	Very low	177 Å²	177	137.7 Å²	137.7	83%	0.827	74%	0.743	S	S	*	*			trans	-133.2	138.6	169.7	-151.5	169.9	10.2	0	0	109.1	S578 N582	S578-Q580 PolarHBondContact O-N 3.38Å; Q580-N582 PolarHBondContact O-N 3.46Å
581	S	40.9	Very low	45.8	Very low	98 Å²	98	137 Å²	137	69%	0.685	73%	0.728	S	S	*	*			trans	-75.6	118.2	-156.3	61.1	0	0	0	0	114.6	K583	S581-K583 PolarHBondContact O-N 2.9Å
582	N	41.9	Very low	48.2	Very low	131 Å²	131	134.3 Å²	134.3	70%	0.701	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	10.1	-177.6	-78	-28.5	0	0	0	117.5	Q580 S584 V585	Q580-N582 PolarHBondContact O-N 3.46Å; N582-S584 PolarHBondContact O-N 2.96Å; N582-S584 VanDerWaalsContact O-N 3.13Å; N582-V585 PolarHBondContact O-N 3.15Å
583	K	48.1	Very low	50.5	Low	172 Å²	172	134.4 Å²	134.4	75%	0.748	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-11.5	179.8	-72.1	-175	174.8	179.4	0	114.8	S581	S581-K583 PolarHBondContact O-N 2.9Å
584	S	49.8	Very low	52.3	Low	78 Å²	78	130.5 Å²	130.5	55%	0.545	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	-47.3	174.2	-159.1	0	0	0	0	111.9	N582 E586 K587 E588	N582-S584 PolarHBondContact O-N 2.96Å; N582-S584 VanDerWaalsContact O-N 3.13Å; S584-E586 PolarHBondContact O-N 3.43Å; S584-K587 WeakPolarHBondContact O-CB 3.45Å; S584-K587 PolarHBondContact O-N 3.32Å; S584-K587 VanDerWaalsContact O-N 3.08Å; S584-E588 PolarHBondContact O-N 3.37Å
585	V	56.5	Low	54.7	Low	78 Å²	78	126.4 Å²	126.4	47%	0.473	66%	0.655	S	S	.	*	H	α-helix	trans	-65	-42.6	-170	-176.2	0	0	0	0	111.7	N582 K587 E588 L589	N582-V585 PolarHBondContact O-N 3.15Å; V585-K587 PolarHBondContact O-N 2.99Å; V585-E588 PolarHBondContact O-N 2.91Å; V585-L589 HydrophobicContact CG1-CD1 4.19Å; V585-L589 WeakPolarHBondContact O-CG 3.45Å; V585-L589 PolarHBondContact O-N 3.28Å
586	E	56	Low	56.8	Low	124 Å²	124	127.6 Å²	127.6	58%	0.579	64%	0.644	S	S	*	*	H	α-helix	trans	-58.5	-38.6	175.3	-64.8	-176.2	143.6	0	0	111.9	S584 L589 Y590	S584-E586 PolarHBondContact O-N 3.43Å; E586-L589 PolarHBondContact O-N 3.02Å; E586-Y590 VanDerWaalsContact O-CD2 3.28Å; E586-Y590 WeakPolarHBondContact O-CD2 3.47Å; E586-Y590 PolarHBondContact O-N 3.2Å
587	K	69.5	Low	58.2	Low	161 Å²	161	122.2 Å²	122.2	70%	0.7	62%	0.624	S	S	*	*	H	α-helix	trans	-69.1	-35	-178.7	-164.9	179.9	-179.8	-174	0	112.1	S584 V585 K591	S584-K587 WeakPolarHBondContact O-CB 3.45Å; S584-K587 PolarHBondContact O-N 3.32Å; S584-K587 VanDerWaalsContact O-N 3.08Å; V585-K587 PolarHBondContact O-N 2.99Å; K587-K591 WeakPolarHBondContact O-CB 3.42Å; K587-K591 PolarHBondContact O-N 3.12Å
588	E	69.8	Low	60.7	Low	130 Å²	130	121.6 Å²	121.6	61%	0.607	61%	0.611	S	S	*	*	H	α-helix	trans	-73	-38.4	173.8	-67.7	-172.2	121.9	0	0	112.2	S584 V585 K591 S592	S584-E588 PolarHBondContact O-N 3.37Å; V585-E588 PolarHBondContact O-N 2.91Å; E588-K591 PolarHBondContact O-N 3.29Å; E588-S592 WeakPolarHBondContact O-CB 3.48Å; E588-S592 PolarHBondContact O-N 3.3Å
589	L	71.3	Confident	62.6	Low	116 Å²	116	118 Å²	118	61%	0.607	59%	0.586	S	S	*	*	H	α-helix	trans	-61.2	-45.1	172.9	-69.9	171	0	0	0	111.8	V585 E586 S592 F593	V585-L589 HydrophobicContact CG1-CD1 4.19Å; V585-L589 WeakPolarHBondContact O-CG 3.45Å; V585-L589 PolarHBondContact O-N 3.28Å; E586-L589 PolarHBondContact O-N 3.02Å; L589-S592 PolarHBondContact O-N 3.46Å; L589-F593 WeakPolarHBondContact O-CB 3.38Å; L589-F593 PolarHBondContact O-N 3.44Å
590	Y	58.8	Low	63.8	Low	157 Å²	157	115.7 Å²	115.7	62%	0.616	58%	0.575	S	S	*	*	H	α-helix	trans	-62.7	-40.4	174	-88.9	-70	0	0	0	112.7	E586 I594	E586-Y590 VanDerWaalsContact O-CD2 3.28Å; E586-Y590 WeakPolarHBondContact O-CD2 3.47Å; E586-Y590 PolarHBondContact O-N 3.2Å; Y590-I594 WeakPolarHBondContact O-CG1 3.26Å; Y590-I594 PolarHBondContact O-N 3.14Å
591	K	83.8	Confident	64.7	Low	123 Å²	123	114.6 Å²	114.6	54%	0.535	57%	0.568	S	S	.	*	H	α-helix	trans	-63.4	-52.1	175.9	-177.3	-173.4	166.4	-168.2	0	111.1	K587 E588 F593 I594 E595	K587-K591 WeakPolarHBondContact O-CB 3.42Å; K587-K591 PolarHBondContact O-N 3.12Å; E588-K591 PolarHBondContact O-N 3.29Å; K591-F593 VanDerWaalsContact C-N 3.29Å; K591-F593 PolarHBondContact O-N 3.09Å; K591-I594 PolarHBondContact O-N 2.86Å; K591-I594 VanDerWaalsContact O-N 3.16Å; K591-E595 VanDerWaalsContact CE-CD 3.41Å; K591-E595 WeakPolarHBondContact CE-OE1 3.35Å; K591-E595 WeakPolarHBondContact CE-OE2 3.31Å; K591-E595 HydrophobicContact CG-CG 4.47Å; K591-E595 IonicContact NZ-OE1 3.62Å; K591-E595 WeakPolarHBondContact O-CG 3.33Å; K591-E595 PolarHBondContact O-N 3.31Å
592	S	79.6	Confident	65.9	Low	60 Å²	60	114.1 Å²	114.1	42%	0.42	56%	0.561	S	S	.	*	H	α-helix	trans	-58.9	-38.7	179.6	-177.7	0	0	0	0	112.3	E588 L589 E595 Q596	E588-S592 WeakPolarHBondContact O-CB 3.48Å; E588-S592 PolarHBondContact O-N 3.3Å; L589-S592 PolarHBondContact O-N 3.46Å; S592-E595 PolarHBondContact O-N 3.23Å; S592-Q596 WeakPolarHBondContact O-CB 3.38Å; S592-Q596 WeakPolarHBondContact O-CG 3.06Å; S592-Q596 PolarHBondContact O-N 2.97Å
593	F	75	Confident	66.5	Low	129 Å²	129	115 Å²	115	57%	0.566	56%	0.558	S	S	*	*	H	α-helix	trans	-66	-42.6	176.7	-178	-103.3	0	0	0	112.3	L589 K591 Q596 L597	L589-F593 WeakPolarHBondContact O-CB 3.38Å; L589-F593 PolarHBondContact O-N 3.44Å; K591-F593 VanDerWaalsContact C-N 3.29Å; K591-F593 PolarHBondContact O-N 3.09Å; F593-Q596 PolarHBondContact O-N 2.76Å; F593-L597 WeakPolarHBondContact O-CB 3.49Å; F593-L597 PolarHBondContact O-N 2.64Å
594	I	71.3	Confident	66.2	Low	93 Å²	93	111.1 Å²	111.1	48%	0.477	55%	0.553	S	S	.	*	H	α-helix	trans	-66.4	-41.1	176.1	-69.6	170	0	0	0	110.9	Y590 K591 L597 I598	Y590-I594 WeakPolarHBondContact O-CG1 3.26Å; Y590-I594 PolarHBondContact O-N 3.14Å; K591-I594 PolarHBondContact O-N 2.86Å; K591-I594 VanDerWaalsContact O-N 3.16Å; I594-L597 PolarHBondContact O-N 3.28Å; I594-I598 HydrophobicContact CG2-CD1 3.8Å; I594-I598 HydrophobicContact CG2-CG1 4.49Å; I594-I598 VanDerWaalsContact O-CG1 3.32Å; I594-I598 WeakPolarHBondContact O-CG1 3.45Å; I594-I598 PolarHBondContact O-N 3.32Å
595	E	79.9	Confident	66.1	Low	103 Å²	103	116.4 Å²	116.4	48%	0.481	57%	0.566	S	S	.	*	H	α-helix	trans	-67.5	-37.1	177.5	-72.5	175	163.2	0	0	112.3	K591 S592 S599	K591-E595 VanDerWaalsContact CE-CD 3.41Å; K591-E595 WeakPolarHBondContact CE-OE1 3.35Å; K591-E595 WeakPolarHBondContact CE-OE2 3.31Å; K591-E595 HydrophobicContact CG-CG 4.47Å; K591-E595 IonicContact NZ-OE1 3.62Å; K591-E595 WeakPolarHBondContact O-CG 3.33Å; K591-E595 PolarHBondContact O-N 3.31Å; S592-E595 PolarHBondContact O-N 3.23Å; E595-S599 VanDerWaalsContact O-CB 3.29Å; E595-S599 WeakPolarHBondContact O-CB 3.49Å; E595-S599 PolarHBondContact O-N 3.19Å
596	Q	74.8	Confident	65.3	Low	124 Å²	124	117.3 Å²	117.3	58%	0.579	58%	0.576	S	S	*	*	H	α-helix	trans	-62.6	-43.8	169	-80.6	-171.7	-6.8	0	0	112.2	S592 F593 S599 H600	S592-Q596 WeakPolarHBondContact O-CB 3.38Å; S592-Q596 WeakPolarHBondContact O-CG 3.06Å; S592-Q596 PolarHBondContact O-N 2.97Å; F593-Q596 PolarHBondContact O-N 2.76Å; Q596-S599 PolarHBondContact O-N 2.93Å; Q596-H600 PolarHBondContact O-N 3.09Å
597	L	61.4	Low	64.4	Low	91 Å²	91	117.3 Å²	117.3	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-61.8	-47.4	179.3	-158.6	81.8	0	0	0	111.1	F593 I594 H600 F601	F593-L597 WeakPolarHBondContact O-CB 3.49Å; F593-L597 PolarHBondContact O-N 2.64Å; I594-L597 PolarHBondContact O-N 3.28Å; L597-H600 PolarHBondContact O-N 2.6Å; L597-F601 HydrophobicContact CG-CD2 4.37Å; L597-F601 HydrophobicContact CG-CE2 4.15Å; L597-F601 VanDerWaalsContact O-CD2 3.32Å; L597-F601 WeakPolarHBondContact O-CD2 3.43Å; L597-F601 PolarHBondContact O-N 3.08Å
598	I	82.7	Confident	62.9	Low	102 Å²	102	118.9 Å²	118.9	52%	0.523	60%	0.598	S	S	.	*	H	α-helix	trans	-61.6	-43.4	174.8	-67.3	167.3	0	0	0	110.6	I594 H600 F601 T602	I594-I598 HydrophobicContact CG2-CD1 3.8Å; I594-I598 HydrophobicContact CG2-CG1 4.49Å; I594-I598 VanDerWaalsContact O-CG1 3.32Å; I594-I598 WeakPolarHBondContact O-CG1 3.45Å; I594-I598 PolarHBondContact O-N 3.32Å; I598-H600 VanDerWaalsContact C-N 3.26Å; I598-H600 PolarHBondContact O-N 3.21Å; I598-F601 PolarHBondContact O-N 2.85Å; I598-T602 HydrophobicContact CG2-CG2 4.39Å; I598-T602 WeakPolarHBondContact O-CG2 3.38Å; I598-T602 PolarHBondContact O-N 2.88Å; I598-T602 PolarHBondContact O-OG1 3.42Å
599	S	72.9	Confident	61.5	Low	34 Å²	34	120 Å²	120	24%	0.238	61%	0.609	C	S	.	*	H	α-helix	trans	-61.8	-31.9	176.1	-177.4	0	0	0	0	112.8	E595 Q596 T602 K603	E595-S599 VanDerWaalsContact O-CB 3.29Å; E595-S599 WeakPolarHBondContact O-CB 3.49Å; E595-S599 PolarHBondContact O-N 3.19Å; Q596-S599 PolarHBondContact O-N 2.93Å; S599-T602 WeakPolarHBondContact CA-OG1 3.38Å; S599-T602 PolarHBondContact O-OG1 3.09Å; S599-K603 VanDerWaalsContact O-CB 3.27Å; S599-K603 WeakPolarHBondContact O-CB 3.34Å; S599-K603 VanDerWaalsContact O-CG 3.26Å; S599-K603 WeakPolarHBondContact O-CG 3.24Å; S599-K603 PolarHBondContact O-N 3.13Å; S599-K603 WeakPolarHBondContact OG-CD 3.38Å; S599-K603 WeakPolarHBondContact OG-CE 3.46Å; S599-K603 PolarHBondContact OG-NZ 3.11Å
600	H	61.8	Low	60.2	Low	149 Å²	149	122 Å²	122	69%	0.69	62%	0.62	S	S	*	*	H	α-helix	trans	-70.9	-44.2	177.1	-113.1	-78.7	0	0	0	112.1	Q596 L597 I598 T602 S604	Q596-H600 PolarHBondContact O-N 3.09Å; L597-H600 PolarHBondContact O-N 2.6Å; I598-H600 VanDerWaalsContact C-N 3.26Å; I598-H600 PolarHBondContact O-N 3.21Å; H600-T602 VanDerWaalsContact C-N 3.33Å; H600-T602 PolarHBondContact O-N 2.91Å; H600-S604 PolarHBondContact O-N 3.25Å
601	F	53.6	Low	59	Low	153 Å²	153	124.3 Å²	124.3	67%	0.671	64%	0.636	S	S	*	*	H	α-helix	trans	-73.9	-19.8	178.6	-76.3	-69.2	0	0	0	114.2	L597 I598 S604	L597-F601 HydrophobicContact CG-CD2 4.37Å; L597-F601 HydrophobicContact CG-CE2 4.15Å; L597-F601 VanDerWaalsContact O-CD2 3.32Å; L597-F601 WeakPolarHBondContact O-CD2 3.43Å; L597-F601 PolarHBondContact O-N 3.08Å; I598-F601 PolarHBondContact O-N 2.85Å; F601-S604 PolarHBondContact O-OG 3.48Å
602	T	65.4	Low	56.7	Low	88 Å²	88	122.5 Å²	122.5	54%	0.54	64%	0.644	S	S	.	*	H	α-helix	trans	-88.7	-35.9	174.1	49	0	0	0	0	112.9	I598 S599 H600 S604	I598-T602 HydrophobicContact CG2-CG2 4.39Å; I598-T602 WeakPolarHBondContact O-CG2 3.38Å; I598-T602 PolarHBondContact O-N 2.88Å; I598-T602 PolarHBondContact O-OG1 3.42Å; S599-T602 WeakPolarHBondContact CA-OG1 3.38Å; S599-T602 PolarHBondContact O-OG1 3.09Å; H600-T602 VanDerWaalsContact C-N 3.33Å; H600-T602 PolarHBondContact O-N 2.91Å; T602-S604 VanDerWaalsContact C-N 3.31Å; T602-S604 PolarHBondContact O-N 2.85Å
603	K	54	Low	54.9	Low	149 Å²	149	127.7 Å²	127.7	65%	0.648	66%	0.662	S	S	*	*	H	α-helix	trans	-71.7	-20.4	177.5	-75.7	172.4	177.8	155.1	0	113.7	S599 K605	S599-K603 VanDerWaalsContact O-CB 3.27Å; S599-K603 WeakPolarHBondContact O-CB 3.34Å; S599-K603 VanDerWaalsContact O-CG 3.26Å; S599-K603 WeakPolarHBondContact O-CG 3.24Å; S599-K603 PolarHBondContact O-N 3.13Å; S599-K603 WeakPolarHBondContact OG-CD 3.38Å; S599-K603 WeakPolarHBondContact OG-CE 3.46Å; S599-K603 PolarHBondContact OG-NZ 3.11Å; K603-K605 PolarHBondContact O-N 3.31Å
604	S	43.1	Very low	53.3	Low	92 Å²	92	128.5 Å²	128.5	64%	0.643	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	31	175.4	70.9	0	0	0	0	114.5	H600 F601 T602	H600-S604 PolarHBondContact O-N 3.25Å; F601-S604 PolarHBondContact O-OG 3.48Å; T602-S604 VanDerWaalsContact C-N 3.31Å; T602-S604 PolarHBondContact O-N 2.85Å
605	K	47.7	Very low	51.7	Low	188 Å²	188	128.6 Å²	128.6	82%	0.817	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.7	0.9	-175.3	-98.6	-169.2	173.5	-172.4	0	115.4	K603	K603-K605 PolarHBondContact O-N 3.31Å
606	S	39	Very low	50.1	Low	98 Å²	98	133.5 Å²	133.5	69%	0.685	71%	0.709	S	S	*	*	S	Bend	trans	-112	20	-170.9	67.7	0	0	0	0	115.6
607	C	38.1	Very low	48.2	Very low	123 Å²	123	132.7 Å²	132.7	83%	0.831	72%	0.717	S	S	*	*			trans	-129.2	51.4	-175.1	-67.8	0	0	0	0	113.7
608	E	36.4	Very low	47.3	Very low	195 Å²	195	137 Å²	137	91%	0.911	74%	0.735	S	S	*	*			trans	-153.2	93.1	161.5	-143.4	166.4	-138	0	0	111.2
609	N	40.4	Very low	45.1	Very low	154 Å²	154	137.6 Å²	137.6	82%	0.824	75%	0.748	S	S	*	*			trans	-160.5	94	167.5	-141.3	-1	0	0	0	109.6
610	N	43.8	Very low	43.6	Very low	158 Å²	158	144.8 Å²	144.8	85%	0.845	77%	0.772	S	S	*	*			trans	163.6	61.9	157.8	-86.6	-22.3	0	0	0	112.9
611	Q	34.3	Very low	43	Very low	204 Å²	204	140.5 Å²	140.5	95%	0.953	76%	0.759	S	S	*	*			trans	-161.3	169.3	146.9	-116.5	171.3	12.5	0	0	113.2
612	A	36.1	Very low	42.4	Very low	85 Å²	85	140.1 Å²	140.1	70%	0.702	76%	0.757	S	S	*	*			trans	-92.3	140.5	-147	0	0	0	0	0	117
613	Q	41.8	Very low	41.7	Very low	169 Å²	169	142 Å²	142	79%	0.79	76%	0.764	S	S	*	*			trans	64.8	131.5	139.6	-71.4	-174.5	2.6	0	0	122.4
614	N	40.8	Very low	41.6	Very low	146 Å²	146	143.6 Å²	143.6	78%	0.781	77%	0.766	S	S	*	*			trans	72.6	71.7	140.6	-59.5	-11.4	0	0	0	120.3
615	A	37.3	Very low	42	Very low	95 Å²	95	143.8 Å²	143.8	79%	0.785	76%	0.759	S	S	*	*			trans	-147.8	140	135.6	0	0	0	0	0	110.3
616	Q	45.9	Very low	42.6	Very low	206 Å²	206	139.6 Å²	139.6	96%	0.963	75%	0.745	S	S	*	*			trans	-77.8	126	171.4	-76.3	-178.3	-23	0	0	110.2
617	S	35.2	Very low	43.4	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	74%	0.736	S	S	*	*			trans	-133.5	124.9	167.5	54.3	0	0	0	0	109.9	S619	S617-S619 PolarHBondContact O-N 3.11Å; S617-S619 VanDerWaalsContact O-N 3.12Å
618	E	42.6	Very low	44.4	Very low	183 Å²	183	137.1 Å²	137.1	86%	0.855	72%	0.717	S	S	*	*			trans	-72.3	104.3	175.3	-69.6	-170.4	128.3	0	0	109.7	Y620	E618-Y620 PolarHBondContact O-N 3.24Å
619	S	37.3	Very low	45.2	Very low	114 Å²	114	133.7 Å²	133.7	80%	0.797	70%	0.699	S	S	*	*			trans	-74.6	110	175.6	44.2	0	0	0	0	110.6	S617 S621	S617-S619 PolarHBondContact O-N 3.11Å; S617-S619 VanDerWaalsContact O-N 3.12Å; S619-S621 PolarHBondContact O-N 3.33Å; S619-S621 VanDerWaalsContact O-N 3.07Å
620	Y	42	Very low	46.5	Very low	184 Å²	184	130.3 Å²	130.3	72%	0.722	68%	0.684	S	S	*	*			trans	-66.1	105.7	171.1	-98.8	-107.5	0	0	0	110	E618	E618-Y620 PolarHBondContact O-N 3.24Å
621	S	47.2	Very low	47.1	Very low	60 Å²	60	128.9 Å²	128.9	42%	0.42	67%	0.67	S	S	.	*			trans	-69.6	139.5	177.5	67.4	0	0	0	0	111.9	S619 D623 R624	S619-S621 PolarHBondContact O-N 3.33Å; S619-S621 VanDerWaalsContact O-N 3.07Å; S621-D623 PolarHBondContact O-N 3.24Å; S621-R624 PolarHBondContact O-N 2.91Å; S621-R624 VanDerWaalsContact O-N 3.13Å
622	F	42	Very low	47.8	Very low	145 Å²	145	125.4 Å²	125.4	64%	0.636	66%	0.656	S	S	*	*	H	α-helix	trans	-64.1	-26.4	179.8	-166.6	-99.6	0	0	0	111.9	R624 L625 L626	F622-R624 PolarHBondContact O-N 2.67Å; F622-L625 WeakPolarHBondContact O-CB 3.32Å; F622-L625 PolarHBondContact O-N 3.25Å; F622-L626 PolarHBondContact O-N 3.33Å; F622-L626 VanDerWaalsContact O-N 3.09Å
623	D	50.8	Low	48.6	Very low	128 Å²	128	129 Å²	129	68%	0.684	66%	0.656	S	S	*	*	H	α-helix	trans	-63.2	-19.4	176.8	-41.6	-74.6	0	0	0	112.9	S621 P627	S621-D623 PolarHBondContact O-N 3.24Å; D623-P627 WeakPolarHBondContact O-CD 3.46Å; D623-P627 VanDerWaalsContact O-CG 3.29Å; D623-P627 WeakPolarHBondContact O-CG 3.32Å
624	R	51.1	Low	48.9	Very low	181 Å²	181	125.5 Å²	125.5	68%	0.683	65%	0.646	S	S	*	*	H	α-helix	trans	-89.8	-22.5	172.6	-151.1	178.1	-166.7	-176.5	5.9	113	S621 F622	S621-R624 PolarHBondContact O-N 2.91Å; S621-R624 VanDerWaalsContact O-N 3.13Å; F622-R624 PolarHBondContact O-N 2.67Å
625	L	52.2	Low	48.9	Very low	97 Å²	97	129.4 Å²	129.4	51%	0.508	65%	0.65	S	S	.	*	H	α-helix	trans	-81.7	-40.1	178.5	-96.4	165	0	0	0	112.6	F622 E628 F629	F622-L625 WeakPolarHBondContact O-CB 3.32Å; F622-L625 PolarHBondContact O-N 3.25Å; L625-E628 PolarHBondContact O-N 3.22Å; L625-F629 WeakPolarHBondContact O-CB 3.48Å; L625-F629 PolarHBondContact O-N 2.93Å
626	L	60.8	Low	48.9	Very low	100 Å²	100	129.7 Å²	129.7	52%	0.524	65%	0.646	S	S	.	*	H	α-helix	trans	-61.2	-41.8	-178.4	-168.8	66.5	0	0	0	113.1	F622 F629 V630	F622-L626 PolarHBondContact O-N 3.33Å; F622-L626 VanDerWaalsContact O-N 3.09Å; L626-F629 PolarHBondContact O-N 2.97Å; L626-V630 WeakPolarHBondContact O-CG2 3.33Å; L626-V630 PolarHBondContact O-N 3.29Å; L626-V630 VanDerWaalsContact O-N 3.08Å
627	P	54.8	Low	48.8	Very low	77 Å²	77	128.2 Å²	128.2	50%	0.5	65%	0.645	S	S	.	*	H	α-helix	trans	-66.9	-39.5	173.7	-21.8	34.8	0	0	0	113.4	D623 F629 V630 K631	D623-P627 WeakPolarHBondContact O-CD 3.46Å; D623-P627 VanDerWaalsContact O-CG 3.29Å; D623-P627 WeakPolarHBondContact O-CG 3.32Å; P627-F629 VanDerWaalsContact C-N 3.31Å; P627-F629 PolarHBondContact O-N 2.99Å; P627-V630 PolarHBondContact O-N 3.24Å; P627-K631 WeakPolarHBondContact O-CB 3.5Å; P627-K631 PolarHBondContact O-N 3.05Å
628	E	58.7	Low	48.9	Very low	91 Å²	91	128.3 Å²	128.3	43%	0.425	65%	0.645	S	S	.	*	H	α-helix	trans	-61	-41	174.1	-86.1	-75.1	114.9	0	0	111.3	L625 K631 M632	L625-E628 PolarHBondContact O-N 3.22Å; E628-K631 PolarHBondContact O-N 3.49Å; E628-K631 IonicContact OE1-NZ 3.03Å; E628-K631 PolarHBondContact OE1-NZ 3.48Å; E628-M632 PolarHBondContact O-N 2.8Å
629	F	54.2	Low	48.4	Very low	123 Å²	123	128 Å²	128	54%	0.539	65%	0.649	S	S	.	*	H	α-helix	trans	-62.2	-50.3	176.5	-155.7	-101.1	0	0	0	111.5	L625 L626 P627 K631 M632 F633	L625-F629 WeakPolarHBondContact O-CB 3.48Å; L625-F629 PolarHBondContact O-N 2.93Å; L626-F629 PolarHBondContact O-N 2.97Å; P627-F629 VanDerWaalsContact C-N 3.31Å; P627-F629 PolarHBondContact O-N 2.99Å; F629-K631 VanDerWaalsContact C-N 3.3Å; F629-K631 PolarHBondContact O-N 3.02Å; F629-M632 PolarHBondContact O-N 2.7Å; F629-F633 HydrophobicContact CD1-CD2 4.3Å; F629-F633 AromaticContact CD1-CE2 3.97Å; F629-F633 HydrophobicContact CD1-CE2 3.97Å; F629-F633 HydrophobicContact CE1-CD2 4.31Å; F629-F633 AromaticContact CE1-CE2 3.62Å; F629-F633 HydrophobicContact CE1-CE2 3.62Å; F629-F633 HydrophobicContact CE2-CE2 4.4Å; F629-F633 AromaticContact CZ-CE2 3.87Å; F629-F633 HydrophobicContact CZ-CE2 3.87Å; F629-F633 HydrophobicContact CZ-CZ 4.5Å; F629-F633 VanDerWaalsContact O-CD2 3.27Å; F629-F633 WeakPolarHBondContact O-CD2 3.47Å
630	V	68.4	Low	48.2	Very low	83 Å²	83	131.7 Å²	131.7	50%	0.503	65%	0.653	S	S	.	*	H	α-helix	trans	-61.2	-38.4	176.4	173.2	0	0	0	0	112	L626 P627 M632 F633 T634	L626-V630 WeakPolarHBondContact O-CG2 3.33Å; L626-V630 PolarHBondContact O-N 3.29Å; L626-V630 VanDerWaalsContact O-N 3.08Å; P627-V630 PolarHBondContact O-N 3.24Å; V630-M632 VanDerWaalsContact C-N 3.29Å; V630-M632 PolarHBondContact O-N 2.94Å; V630-F633 PolarHBondContact O-N 3.02Å; V630-F633 VanDerWaalsContact O-N 3.15Å; V630-T634 HydrophobicContact CG1-CG2 4.1Å; V630-T634 WeakPolarHBondContact O-CG2 2.96Å; V630-T634 PolarHBondContact O-N 2.73Å; V630-T634 VanDerWaalsContact O-N 3.16Å; V630-T634 PolarHBondContact O-OG1 2.97Å
631	K	55	Low	48.2	Very low	129 Å²	129	131.4 Å²	131.4	56%	0.561	66%	0.659	S	S	*	*	H	α-helix	trans	-66.9	-24.8	177.8	-177.2	179.1	168.2	-159.3	0	113.6	P627 E628 F629 T634	P627-K631 WeakPolarHBondContact O-CB 3.5Å; P627-K631 PolarHBondContact O-N 3.05Å; E628-K631 PolarHBondContact O-N 3.49Å; E628-K631 IonicContact OE1-NZ 3.03Å; E628-K631 PolarHBondContact OE1-NZ 3.48Å; F629-K631 VanDerWaalsContact C-N 3.3Å; F629-K631 PolarHBondContact O-N 3.02Å; K631-T634 WeakPolarHBondContact CA-OG1 3.1Å
632	M	49.4	Very low	47.5	Very low	130 Å²	130	136.2 Å²	136.2	64%	0.64	68%	0.68	S	S	*	*	H	α-helix	trans	-74.2	-28.2	171.4	-78	-174.9	-88	0	0	113.2	E628 F629 V630	E628-M632 PolarHBondContact O-N 2.8Å; F629-M632 PolarHBondContact O-N 2.7Å; V630-M632 VanDerWaalsContact C-N 3.29Å; V630-M632 PolarHBondContact O-N 2.94Å
633	F	54.1	Low	47.4	Very low	160 Å²	160	139.2 Å²	139.2	70%	0.702	69%	0.687	S	S	*	*	H	α-helix	trans	-95.4	-10.2	-179.8	-69	-74.4	0	0	0	115	F629 V630	F629-F633 HydrophobicContact CD1-CD2 4.3Å; F629-F633 AromaticContact CD1-CE2 3.97Å; F629-F633 HydrophobicContact CD1-CE2 3.97Å; F629-F633 HydrophobicContact CE1-CD2 4.31Å; F629-F633 AromaticContact CE1-CE2 3.62Å; F629-F633 HydrophobicContact CE1-CE2 3.62Å; F629-F633 HydrophobicContact CE2-CE2 4.4Å; F629-F633 AromaticContact CZ-CE2 3.87Å; F629-F633 HydrophobicContact CZ-CE2 3.87Å; F629-F633 HydrophobicContact CZ-CZ 4.5Å; F629-F633 VanDerWaalsContact O-CD2 3.27Å; F629-F633 WeakPolarHBondContact O-CD2 3.47Å; V630-F633 PolarHBondContact O-N 3.02Å; V630-F633 VanDerWaalsContact O-N 3.15Å
634	T	47.3	Very low	47.1	Very low	97 Å²	97	139.2 Å²	139.2	60%	0.595	69%	0.694	S	S	*	*	S	Bend	trans	-102.4	2.9	-174.8	43.5	0	0	0	0	114.6	V630 K631 S636	V630-T634 HydrophobicContact CG1-CG2 4.1Å; V630-T634 WeakPolarHBondContact O-CG2 2.96Å; V630-T634 PolarHBondContact O-N 2.73Å; V630-T634 VanDerWaalsContact O-N 3.16Å; V630-T634 PolarHBondContact O-OG1 2.97Å; K631-T634 WeakPolarHBondContact CA-OG1 3.1Å; T634-S636 PolarHBondContact O-N 3.14Å
635	R	39.9	Very low	46.3	Very low	227 Å²	227	140.3 Å²	140.3	86%	0.857	70%	0.704	S	S	*	*			trans	-86.4	93.8	-174.1	-153.1	172	-167.9	174	3.1	112.1
636	S	37.5	Very low	45.5	Very low	101 Å²	101	145.6 Å²	145.6	71%	0.706	72%	0.722	S	S	*	*			trans	-68.5	158.6	176.6	49	0	0	0	0	113.5	T634 S638	T634-S636 PolarHBondContact O-N 3.14Å; S636-S638 PolarHBondContact O-N 3.33Å
637	N	44.8	Very low	44	Very low	175 Å²	175	147.6 Å²	147.6	94%	0.936	74%	0.739	S	S	*	*			trans	-75.9	104.6	-177.2	-72.1	-35.9	0	0	0	112.4
638	S	36.3	Very low	43.1	Very low	109 Å²	109	149.1 Å²	149.1	76%	0.762	75%	0.751	S	S	*	*			trans	-150.4	119.9	156.2	57.2	0	0	0	0	109.5	S636	S636-S638 PolarHBondContact O-N 3.33Å
639	L	33.6	Very low	41.7	Very low	177 Å²	177	152.2 Å²	152.2	93%	0.927	77%	0.769	S	S	*	*			trans	-135.2	88	170.1	-167.9	99.6	0	0	0	108.1
640	E	31.4	Very low	40.7	Very low	191 Å²	191	151.2 Å²	151.2	89%	0.893	78%	0.777	S	S	*	*			trans	-77.8	145.6	172.2	-142.3	166.8	-171.1	0	0	109.4
641	E	42.1	Very low	39.2	Very low	179 Å²	179	155.9 Å²	155.9	84%	0.836	79%	0.793	S	S	*	*			trans	-77.9	132.9	172.9	-67.1	-168.3	124.3	0	0	110
642	D	34.3	Very low	38.2	Very low	160 Å²	160	159.3 Å²	159.3	86%	0.856	81%	0.808	S	S	*	*			trans	-125.8	140.6	167.7	-158	-2.4	0	0	0	112
643	R	38.6	Very low	37.4	Very low	208 Å²	208	162.1 Å²	162.1	79%	0.785	82%	0.817	S	S	*	*			trans	-115.8	125.4	-168	-70.6	178.6	175.1	173.6	-1	112.1
644	P	44.2	Very low	36.4	Very low	128 Å²	128	160.4 Å²	160.4	83%	0.831	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-73.6	155.6	159	-16	32	0	0	0	112.2
645	K	35.1	Very low	35.7	Very low	205 Å²	205	162.5 Å²	162.5	89%	0.891	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-96.4	166.9	-170.6	-69.5	168	177	166.3	0	113.6
646	K	36.2	Very low	35.4	Very low	207 Å²	207	159.7 Å²	159.7	90%	0.9	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-60	147.1	173.1	-59.3	175	179	178	0	112.4
647	V	28	Very low	35	Very low	143 Å²	143	158 Å²	158	87%	0.867	83%	0.826	S	S	*	*			trans	-136.6	150.1	153.3	-179.1	0	0	0	0	107.7
648	S	35.4	Very low	34.5	Very low	109 Å²	109	154.2 Å²	154.2	76%	0.762	82%	0.819	S	S	*	*			trans	-137.3	125.3	-167.9	54.1	0	0	0	0	113.8
649	I	30.5	Very low	34.5	Very low	156 Å²	156	156.7 Å²	156.7	80%	0.8	82%	0.823	S	S	*	*			trans	-151.7	128.9	173.5	-56.3	179.9	0	0	0	104.7
650	S	33.8	Very low	35.5	Very low	101 Å²	101	153 Å²	153	71%	0.706	81%	0.81	S	S	*	*			cis	126.6	106.4	1.8	70.3	0	0	0	0	110.9
651	E	36	Very low	35.7	Very low	182 Å²	182	152 Å²	152	85%	0.85	81%	0.807	S	S	*	*			trans	55.8	121.9	156	-55.5	-158.7	132.3	0	0	123.9
652	K	33.6	Very low	35.5	Very low	201 Å²	201	148.9 Å²	148.9	87%	0.874	80%	0.801	S	S	*	*				163.9	136.4	121.8	-88.7	163.2	-176.7	175.9	0	109
653	K	32.9	Very low	35.4	Very low	189 Å²	189	145.5 Å²	145.5	82%	0.822	79%	0.789	S	S	*	*			cis	109.5	84.2	12.8	-166.7	-173.2	177.7	179.5	0	114.9
654	T	32.7	Very low	35	Very low	123 Å²	123	144.6 Å²	144.6	76%	0.755	79%	0.792	S	S	*	*			trans	-157.2	129.6	155.5	22.9	0	0	0	0	106.4
655	I	33.6	Very low	34.4	Very low	141 Å²	141	144.8 Å²	144.8	72%	0.723	79%	0.785	S	S	*	*				71.4	124.1	62.9	-66.3	161.3	0	0	0	109.8
656	L	32.9	Very low	34.1	Very low	168 Å²	168	140.3 Å²	140.3	88%	0.88	78%	0.779	S	S	*	*			cis	-154.2	162.4	18.1	-139.9	162.9	0	0	0	111.8
657	G	30	Very low	34	Very low	66 Å²	66	135.1 Å²	135.1	68%	0.68	77%	0.769	S	S	*	*			trans	101.1	143.3	157.2	0	0	0	0	0	116.9
658	A	33.8	Very low	34.4	Very low	96 Å²	96	137.3 Å²	137.3	79%	0.793	77%	0.767	S	S	*	*			cis	172.4	101.9	-26.1	0	0	0	0	0	107
659	N	36.4	Very low	34.4	Very low	161 Å²	161	138.1 Å²	138.1	86%	0.861	77%	0.767	S	S	*	*			trans	25.3	158.7	136.9	-83.5	9.8	0	0	0	123.2
660	P	53.5	Low	35.6	Very low	99 Å²	99	135.9 Å²	135.9	64%	0.643	76%	0.763	S	S	*	*			cis	-144.2	-170.1	-11.7	40.3	-20	0	0	0	116.4
661	M	36.6	Very low	35.6	Very low	169 Å²	169	140.1 Å²	140.1	83%	0.833	77%	0.771	S	S	*	*			trans	74.4	147.8	152.6	-78.2	175.4	174.4	0	0	119.2
662	T	36.4	Very low	35.6	Very low	115 Å²	115	138.6 Å²	138.6	71%	0.706	77%	0.769	S	S	*	*			cis	-145.5	147.6	9.4	-15.1	0	0	0	0	113.7
663	S	33	Very low	35.8	Very low	88 Å²	88	137.2 Å²	137.2	62%	0.615	77%	0.769	S	S	*	*			trans	25.7	128.2	148.2	54.4	0	0	0	0	121.8
664	F	29.7	Very low	35.9	Very low	190 Å²	190	137.2 Å²	137.2	83%	0.833	77%	0.769	S	S	*	*				64.3	142.5	70.3	-70.5	-57	0	0	0	114.3
665	N	31.5	Very low	35.9	Very low	131 Å²	131	136.5 Å²	136.5	70%	0.701	77%	0.769	S	S	*	*			cis	-156.2	-171.6	6	-138	-30	0	0	0	114.4
666	C	29.5	Very low	35.9	Very low	111 Å²	111	136.5 Å²	136.5	75%	0.75	78%	0.776	S	S	*	*			trans	-58.2	176.9	174.7	-52	0	0	0	0	114.4
667	S	35	Very low	36	Very low	99 Å²	99	132.8 Å²	132.8	69%	0.692	77%	0.769	S	S	*	*			cis	-177.8	164.3	38.1	66.5	0	0	0	0	116.3
668	K	34.7	Very low	36.2	Very low	189 Å²	189	137.6 Å²	137.6	82%	0.822	78%	0.779	S	S	*	*			trans	53.9	116.9	140.9	-70.5	170.7	-179.4	-179.8	0	123
669	T	35.7	Very low	36.2	Very low	126 Å²	126	140.9 Å²	140.9	77%	0.773	78%	0.775	S	S	*	*				18	162	123.6	58.6	0	0	0	0	122.3
670	P	56.9	Low	36.3	Very low	108 Å²	108	138.9 Å²	138.9	70%	0.701	77%	0.774	S	S	*	*			cis	-135.7	-174	-36.3	41	-25	0	0	0	112.1
671	H	33.1	Very low	35.4	Very low	191 Å²	191	141.5 Å²	141.5	88%	0.884	78%	0.777	S	S	*	*			trans	-169.9	158.2	147.4	-113.2	-78.7	0	0	0	115.2
672	N	37.1	Very low	35.2	Very low	150 Å²	150	142 Å²	142	80%	0.802	78%	0.782	S	S	*	*			trans	-98.9	158.4	171.8	-93	-54.2	0	0	0	111.9
673	I	36.4	Very low	35.4	Very low	171 Å²	171	145.1 Å²	145.1	88%	0.877	79%	0.786	S	S	*	*			trans	-168.7	167.6	142.1	-102.7	153	0	0	0	111.6
674	K	35.4	Very low	35.4	Very low	190 Å²	190	147.7 Å²	147.7	83%	0.826	80%	0.798	S	S	*	*			trans	-114.1	170.1	-165.5	-56.6	174.3	178.3	176.1	0	114.3
675	S	33.6	Very low	36	Very low	107 Å²	107	143.7 Å²	143.7	75%	0.748	79%	0.794	S	S	*	*			trans	75.4	160.1	155.6	-49.2	0	0	0	0	116.4
676	T	32.1	Very low	36.2	Very low	141 Å²	141	144.6 Å²	144.6	87%	0.865	80%	0.799	S	S	*	*			cis	-147.5	171.5	8.2	-25	0	0	0	0	112.2
677	A	36	Very low	36.7	Very low	90 Å²	90	147.9 Å²	147.9	74%	0.744	81%	0.805	S	S	*	*			trans	-92.4	158.9	-175.8	0	0	0	0	0	115.9
678	L	34.1	Very low	37.1	Very low	168 Å²	168	152 Å²	152	88%	0.88	81%	0.813	S	S	*	*			trans	-166.5	127.4	153.9	-95.6	163.4	0	0	0	104.2
679	K	34.5	Very low	37.4	Very low	165 Å²	165	150.7 Å²	150.7	72%	0.717	81%	0.814	S	S	*	*			cis	78.6	93.6	25.7	-153.1	-167.3	-178.1	-163.6	0	115.4	E681	K679-E681 IonicContact NZ-OE2 2.75Å
680	S	37.5	Very low	37.8	Very low	119 Å²	119	152 Å²	152	83%	0.832	82%	0.817	S	S	*	*			trans	-146.6	139	155.2	53.7	0	0	0	0	109.7
681	E	34.5	Very low	36.9	Very low	153 Å²	153	151.5 Å²	151.5	72%	0.715	82%	0.822	S	S	*	*			trans	-110.8	152	177.9	-63.8	154.2	121	0	0	108.8	K679	K679-E681 IonicContact NZ-OE2 2.75Å
682	L	33.4	Very low	37.4	Very low	179 Å²	179	150.3 Å²	150.3	94%	0.937	82%	0.822	S	S	*	*			trans	-154.4	156.8	147.5	-135.7	76.5	0	0	0	110.4
683	K	39.3	Very low	37.1	Very low	182 Å²	182	147 Å²	147	79%	0.791	82%	0.823	S	S	*	*			trans	-125.6	-178.1	-174.4	-76.6	-176.3	172.7	-178.1	0	110.6
684	T	34.3	Very low	37.4	Very low	141 Å²	141	150 Å²	150	87%	0.865	82%	0.824	S	S	*	*			trans	79.3	145.4	162.9	72.3	0	0	0	0	115.4
685	S	41	Very low	37.5	Very low	107 Å²	107	151.9 Å²	151.9	75%	0.748	83%	0.826	S	S	*	*			cis	-143.8	164.9	0.3	54.4	0	0	0	0	112.4
686	D	37	Very low	37.4	Very low	150 Å²	150	150.6 Å²	150.6	80%	0.802	83%	0.829	S	S	*	*			trans	-68.6	161.4	173.6	-42.1	-92.9	0	0	0	113.4
687	M	40	Very low	38	Very low	179 Å²	179	149.2 Å²	149.2	88%	0.882	83%	0.825	S	S	*	*			trans	-162.8	103.7	141.8	-112.4	-172.8	74.8	0	0	110.6
688	E	43.6	Very low	37.9	Very low	186 Å²	186	151.1 Å²	151.1	87%	0.869	83%	0.832	S	S	*	*			trans	-83	155.5	158.1	-64	-178.7	130	0	0	109.7
689	L	41	Very low	38.2	Very low	161 Å²	161	152 Å²	152	84%	0.843	83%	0.831	S	S	*	*			trans	-162.3	124.7	146.8	-114.7	173.6	0	0	0	111.6
690	D	43	Very low	38.4	Very low	154 Å²	154	152.3 Å²	152.3	82%	0.824	84%	0.84	S	S	*	*			trans	-78.4	149.6	172.7	-111.9	-35.2	0	0	0	112
691	A	38.2	Very low	38.6	Very low	98 Å²	98	155.5 Å²	155.5	81%	0.81	84%	0.841	S	S	*	*			trans	-158.4	125.1	154.7	0	0	0	0	0	112.7
692	N	43.2	Very low	38.7	Very low	166 Å²	166	151.3 Å²	151.3	89%	0.888	84%	0.839	S	S	*	*			trans	-79.8	144.1	171.4	-88.4	-89	0	0	0	111.8
693	G	32.2	Very low	39.4	Very low	80 Å²	80	151.7 Å²	151.7	83%	0.825	84%	0.836	S	S	*	*			trans	-141.3	122.6	171.7	0	0	0	0	0	112.2
694	R	41.2	Very low	39.2	Very low	235 Å²	235	148 Å²	148	89%	0.887	83%	0.833	S	S	*	*			trans	-100	147.1	-176.1	-86	-174	171.2	-167.7	-0.3	113
695	R	38.6	Very low	39.8	Very low	229 Å²	229	150.5 Å²	150.5	86%	0.864	83%	0.832	S	S	*	*			trans	53.3	109.8	139.8	-175.5	-171.7	-73.3	-157.7	-4.2	117.5
696	G	31.3	Very low	39.8	Very low	80 Å²	80	150.9 Å²	150.9	83%	0.825	83%	0.832	S	S	*	*			trans	-150.2	127.5	157.8	0	0	0	0	0	110.3
697	S	43.3	Very low	40.1	Very low	112 Å²	112	149.4 Å²	149.4	78%	0.783	83%	0.834	S	S	*	*			trans	-123.5	124.8	-177.2	54	0	0	0	0	110.6
698	C	34.5	Very low	39.8	Very low	130 Å²	130	144.5 Å²	144.5	88%	0.878	82%	0.822	S	S	*	*			trans	-128.9	122.8	166.8	-67.2	0	0	0	0	109.3
699	Q	40.1	Very low	39.7	Very low	187 Å²	187	143.1 Å²	143.1	87%	0.874	82%	0.819	S	S	*	*			trans	-69.4	148	152.7	-67.2	162.2	-88.1	0	0	108
700	L	39.9	Very low	39.4	Very low	171 Å²	171	144.5 Å²	144.5	90%	0.895	82%	0.818	S	S	*	*			trans	-150.7	126.2	149.9	-116.4	168.5	0	0	0	108
701	E	42	Very low	39	Very low	185 Å²	185	147.7 Å²	147.7	86%	0.864	82%	0.819	S	S	*	*			trans	-74.9	149.2	176.6	-64.4	173.2	135.8	0	0	109.7
702	G	35.2	Very low	38.7	Very low	65 Å²	65	149.6 Å²	149.6	67%	0.67	82%	0.815	S	S	*	*			trans	-158.2	60.5	-170.2	0	0	0	0	0	111.9	S704	G702-S704 PolarHBondContact O-N 3.1Å; G702-S704 VanDerWaalsContact O-N 3.08Å
703	E	47.6	Very low	38.4	Very low	187 Å²	187	147.8 Å²	147.8	87%	0.874	81%	0.81	S	S	*	*			trans	-54.8	114.6	174.5	-73.4	-155.9	117.1	0	0	111.1
704	S	36.5	Very low	38.6	Very low	104 Å²	104	151 Å²	151	73%	0.727	80%	0.804	S	S	*	*			trans	-145	120.8	166.3	49.3	0	0	0	0	109	G702 P706	G702-S704 PolarHBondContact O-N 3.1Å; G702-S704 VanDerWaalsContact O-N 3.08Å; S704-P706 WeakPolarHBondContact O-CD 3.5Å
705	K	47.4	Very low	38.3	Very low	194 Å²	194	150.6 Å²	150.6	84%	0.843	80%	0.802	S	S	*	*			trans	-95.7	113.4	-178.2	-67.1	171.6	-177.8	167.1	0	109.7
706	P	39.3	Very low	38	Very low	115 Å²	115	146.3 Å²	146.3	75%	0.747	79%	0.794	S	S	*	*			trans	-91.1	116.5	165.5	6	14.5	0	0	0	108.9	S704 A708	S704-P706 WeakPolarHBondContact O-CD 3.5Å; P706-A708 VanDerWaalsContact C-N 3.26Å; P706-A708 PolarHBondContact O-N 3.26Å
707	S	43.3	Very low	38.4	Very low	119 Å²	119	150 Å²	150	83%	0.832	80%	0.795	S	S	*	*			trans	-74.1	71.8	179.5	39.3	0	0	0	0	112.5	I709	S707-I709 PolarHBondContact O-N 2.96Å; S707-I709 VanDerWaalsContact O-N 3.09Å
708	A	34.5	Very low	38.4	Very low	77 Å²	77	150.3 Å²	150.3	64%	0.636	79%	0.788	S	S	*	*			trans	-77.1	91.4	-179.6	0	0	0	0	0	112.3	P706 F710	P706-A708 VanDerWaalsContact C-N 3.26Å; P706-A708 PolarHBondContact O-N 3.26Å; A708-F710 HydrophobicContact CB-CD2 4.46Å; A708-F710 PolarHBondContact O-N 3.32Å
709	I	41.7	Very low	39.1	Very low	157 Å²	157	149 Å²	149	81%	0.805	78%	0.778	S	S	*	*			trans	-74	68.3	169.1	-51.1	179.3	0	0	0	109.9	S707 R711	S707-I709 PolarHBondContact O-N 2.96Å; S707-I709 VanDerWaalsContact O-N 3.09Å; I709-R711 PolarHBondContact O-N 3.13Å
710	F	34.1	Very low	39.9	Very low	189 Å²	189	146 Å²	146	83%	0.829	78%	0.775	S	S	*	*			trans	-78.4	106.9	160.3	-95	-87	0	0	0	108.4	A708 N712	A708-F710 HydrophobicContact CB-CD2 4.46Å; A708-F710 PolarHBondContact O-N 3.32Å; F710-N712 PolarHBondContact O-N 3.17Å
711	R	34.3	Very low	40.8	Very low	221 Å²	221	149.4 Å²	149.4	83%	0.834	78%	0.775	S	S	*	*			trans	-64.2	91.1	165.3	-75.9	-175.7	176	174.3	-0.9	108.4	I709 T713	I709-R711 PolarHBondContact O-N 3.13Å; R711-T713 PolarHBondContact O-N 3.46Å; R711-T713 PolarHBondContact O-OG1 3.19Å
712	N	33.5	Very low	42.3	Very low	139 Å²	139	143.1 Å²	143.1	74%	0.743	76%	0.76	S	S	*	*			trans	-66	87.3	175.7	-169.5	4.9	0	0	0	108.7	F710 Q714	F710-N712 PolarHBondContact O-N 3.17Å; N712-Q714 PolarHBondContact O-N 2.8Å
713	T	36	Very low	44.4	Very low	127 Å²	127	141.6 Å²	141.6	78%	0.779	74%	0.739	S	S	*	*			trans	-72.4	87.1	176.6	5	0	0	0	0	106.9	R711 R715	R711-T713 PolarHBondContact O-N 3.46Å; R711-T713 PolarHBondContact O-OG1 3.19Å; T713-R715 VanDerWaalsContact C-N 3.32Å; T713-R715 PolarHBondContact O-N 2.75Å
714	Q	36.4	Very low	45.8	Very low	149 Å²	149	141 Å²	141	70%	0.696	74%	0.736	S	S	*	*			trans	-52.8	104.6	161.6	-75.6	-175.9	-14.9	0	0	107.1	N712 M716	N712-Q714 PolarHBondContact O-N 2.8Å; Q714-M716 PolarHBondContact O-N 2.9Å
715	R	34.9	Very low	47.8	Very low	225 Å²	225	140.8 Å²	140.8	85%	0.849	72%	0.72	S	S	*	*			trans	-58.1	100.1	152.5	-86.6	-175.2	168.4	-171	-4.2	104.8	T713 N717	T713-R715 VanDerWaalsContact C-N 3.32Å; T713-R715 PolarHBondContact O-N 2.75Å; R715-N717 PolarHBondContact O-N 2.89Å
716	M	32.3	Very low	49.5	Very low	140 Å²	140	132.2 Å²	132.2	69%	0.69	68%	0.684	S	S	*	*			trans	-48	116.4	160.3	-79.6	-72.3	-177.7	0	0	106	Q714 N718	Q714-M716 PolarHBondContact O-N 2.9Å; M716-N718 PolarHBondContact O-N 3.02Å
717	N	39.1	Very low	51.4	Low	156 Å²	156	129.3 Å²	129.3	83%	0.834	68%	0.675	S	S	*	*			trans	-73.5	60.4	172.7	-72.9	-32.5	0	0	0	108.3	R715 P719	R715-N717 PolarHBondContact O-N 2.89Å; N717-P719 WeakPolarHBondContact O-CD 3.36Å; N717-P719 VanDerWaalsContact O-N 3.11Å
718	N	43.4	Very low	53	Low	119 Å²	119	130.5 Å²	130.5	64%	0.636	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-51.6	118.1	162	-74.3	-31.4	0	0	0	105.4	M716	M716-N718 PolarHBondContact O-N 3.02Å
719	P	50.3	Low	55	Low	103 Å²	103	129 Å²	129	67%	0.669	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-54.1	136.6	175.4	23.1	-32.5	0	0	0	107.4	N717 R721	N717-P719 WeakPolarHBondContact O-CD 3.36Å; N717-P719 VanDerWaalsContact O-N 3.11Å; P719-R721 PolarHBondContact O-N 3.44Å; P719-R721 VanDerWaalsContact O-N 3.08Å
720	P	56.3	Low	57.1	Low	125 Å²	125	126 Å²	126	81%	0.812	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-52.5	125.7	-178.8	22.4	-32.8	0	0	0	107.5	G722	P720-G722 PolarHBondContact O-N 2.96Å
721	R	59.7	Low	60	Low	242 Å²	242	119.4 Å²	119.4	91%	0.913	63%	0.63	S	S	*	*			trans	-69.6	78.2	-174.2	-70.2	-170.1	-179.9	-152.4	0.5	109.4	P719	P719-R721 PolarHBondContact O-N 3.44Å; P719-R721 VanDerWaalsContact O-N 3.08Å
722	G	72.3	Confident	62.9	Low	53 Å²	53	113.1 Å²	113.1	55%	0.546	62%	0.618	S	S	.	*			trans	-56.3	141.4	178.5	0	0	0	0	0	109.7	P720 Q724	P720-G722 PolarHBondContact O-N 2.96Å; G722-Q724 PolarHBondContact O-N 3.44Å
723	C	79.9	Confident	66	Low	32 Å²	32	111.2 Å²	111.2	22%	0.216	61%	0.607	C	S	.	*			trans	-63.8	129.9	170.4	-169.7	0	0	0	0	107.8	Y725 C726 G727 C780	C723-Y725 PolarHBondContact O-N 3.43Å; C723-C726 HydrophobicContact CB-CB 4.16Å; C723-C726 WeakPolarHBondContact O-CA 3.36Å; C723-C726 WeakPolarHBondContact O-CB 3.42Å; C723-C726 PolarHBondContact O-N 2.81Å; C723-G727 PolarHBondContact O-N 2.78Å; C723-C780 VanDerWaalsContact SG-SG 3.64Å
724	Q	76.2	Confident	68.9	Low	174 Å²	174	107 Å²	107	81%	0.813	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.1	-30.4	-177.2	-68.1	168.3	-19.4	0	0	112.9	G722	G722-Q724 PolarHBondContact O-N 3.44Å
725	Y	79.4	Confident	71.8	Confident	101 Å²	101	103.6 Å²	103.6	40%	0.396	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.7	-11.5	178.2	-56.2	-84	0	0	0	114.8	C723 D777	C723-Y725 PolarHBondContact O-N 3.43Å; Y725-D777 HydrophobicContact CD2-CB 4.21Å; Y725-D777 HydrophobicContact CE1-CB 4.18Å; Y725-D777 HydrophobicContact CE2-CB 3.54Å; Y725-D777 VanDerWaalsContact CE2-OD2 3.27Å; Y725-D777 WeakPolarHBondContact CE2-OD2 3.34Å
726	C	82.1	Confident	74.8	Confident	14 Å²	14	94.8 Å²	94.8	10%	0.095	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-9.7	171.6	-66.1	0	0	0	0	112.9	C723 D728 G729 L731 H766	C723-C726 HydrophobicContact CB-CB 4.16Å; C723-C726 WeakPolarHBondContact O-CA 3.36Å; C723-C726 WeakPolarHBondContact O-CB 3.42Å; C723-C726 PolarHBondContact O-N 2.81Å; C726-D728 PolarHBondContact O-N 3.27Å; C726-G729 WeakPolarHBondContact O-CA 3.41Å; C726-G729 PolarHBondContact O-N 3.34Å; C726-L731 HydrophobicContact CB-CD1 4.12Å; C726-H766 PolarHBondContact SG-CD2 2.75Å; C726-H766 PolarHBondContact SG-NE2 2.66Å
727	G	80.4	Confident	77.9	Confident	53 Å²	53	88.2 Å²	88.2	55%	0.546	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	-131.6	-176.9	0	0	0	0	0	112.6	C723 G729	C723-G727 PolarHBondContact O-N 2.78Å; G727-G729 PolarHBondContact O-N 2.66Å
728	D	76.6	Confident	80.6	Confident	144 Å²	144	81.2 Å²	81.2	77%	0.77	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	3.3	174.4	60.1	-7.7	0	0	0	114.3	C726 S730	C726-D728 PolarHBondContact O-N 3.27Å; D728-S730 WeakPolarHBondContact OD1-CB 3.27Å; D728-S730 PolarHBondContact OD1-N 3.02Å; D728-S730 PolarHBondContact OD1-OG 2.81Å
729	G	76.3	Confident	83.1	Confident	47 Å²	47	80.6 Å²	80.6	49%	0.485	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	6.8	-176.9	0	0	0	0	0	114.3	C726 G727 L731	C726-G729 WeakPolarHBondContact O-CA 3.41Å; C726-G729 PolarHBondContact O-N 3.34Å; G727-G729 PolarHBondContact O-N 2.66Å; G729-L731 PolarHBondContact O-N 2.89Å; G729-L731 VanDerWaalsContact O-N 3.13Å
730	S	86.4	Confident	85.4	Confident	93 Å²	93	77.4 Å²	77.4	65%	0.65	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	5.2	-177.4	55.6	0	0	0	0	116.4	D728	D728-S730 WeakPolarHBondContact OD1-CB 3.27Å; D728-S730 PolarHBondContact OD1-N 3.02Å; D728-S730 PolarHBondContact OD1-OG 2.81Å
731	L	94.3	Very high	87.3	Confident	50 Å²	50	71.5 Å²	71.5	26%	0.262	40%	0.403	S	S	.	.			trans	-63.6	136	177	-71.5	-175.8	0	0	0	111.8	C726 G729 I733 C780 L782	C726-L731 HydrophobicContact CB-CD1 4.12Å; G729-L731 PolarHBondContact O-N 2.89Å; G729-L731 VanDerWaalsContact O-N 3.13Å; L731-I733 PolarHBondContact O-N 3.25Å; L731-C780 HydrophobicContact CD1-CB 4.15Å; L731-L782 HydrophobicContact CB-CD1 3.98Å; L731-L782 HydrophobicContact CB-CG 3.91Å; L731-L782 HydrophobicContact CD1-CG 4.39Å
732	P	96	Very high	89.1	Confident	90 Å²	90	61.7 Å²	61.7	58%	0.584	37%	0.367	S	S	*	.			trans	-69.1	132.2	177.3	28.7	-34.3	0	0	0	111	L734	P732-L734 HydrophobicContact CB-CD2 4.28Å; P732-L734 HydrophobicContact CG-CD2 4.17Å; P732-L734 PolarHBondContact O-N 3.45Å
733	I	97.3	Very high	90.3	Very high	98 Å²	98	67.7 Å²	67.7	50%	0.503	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	109.3	171.5	-59.1	163.8	0	0	0	108.1	L731 V764 L782	L731-I733 PolarHBondContact O-N 3.25Å; I733-V764 HydrophobicContact CD1-CG1 4.37Å; I733-V764 HydrophobicContact CD1-CG2 3.69Å; I733-V764 HydrophobicContact CG1-CG1 4.13Å; I733-V764 HydrophobicContact CG1-CG2 4.3Å; I733-V764 HydrophobicContact CG2-CG2 4.5Å; I733-L782 WeakPolarHBondContact CA-O 3.04Å; I733-L782 HydrophobicContact CG1-CB 4.14Å; I733-L782 HydrophobicContact CG1-CD1 4.37Å
734	L	97.7	Very high	91.1	Very high	40 Å²	40	68 Å²	68	21%	0.209	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138	-178.5	-57.3	-172.5	0	0	0	111.4	P732 S736 E740 I781 L782 G783 S784 A787	P732-L734 HydrophobicContact CB-CD2 4.28Å; P732-L734 HydrophobicContact CG-CD2 4.17Å; P732-L734 PolarHBondContact O-N 3.45Å; L734-S736 VanDerWaalsContact C-N 3.35Å; L734-E740 HydrophobicContact CD1-CB 3.5Å; L734-E740 VanDerWaalsContact CD1-CB 3.5Å; L734-E740 HydrophobicContact CD1-CG 3.74Å; L734-I781 HydrophobicContact CD1-CG2 3.82Å; L734-I781 HydrophobicContact CG-CG2 4.31Å; L734-L782 PolarHBondContact N-O 3.29Å; L734-G783 WeakPolarHBondContact O-CA 3.5Å; L734-S784 PolarHBondContact O-N 3.27Å; L734-A787 VanDerWaalsContact O-CB 3.22Å; L734-A787 WeakPolarHBondContact O-CB 3.38Å
735	D	97.6	Very high	92.1	Very high	76 Å²	76	59.8 Å²	59.8	41%	0.406	34%	0.335	S	S	.	.	S	Bend	trans	-91	-3.6	175.4	-129.9	23.6	0	0	0	112.8	S784 R786 A787	D735-S784 WeakPolarHBondContact OD1-CB 3.18Å; D735-S784 PolarHBondContact OD1-OG 2.94Å; D735-R786 VanDerWaalsContact CG-CD 3.47Å; D735-R786 WeakPolarHBondContact OD2-CD 3.44Å; D735-R786 IonicContact OD2-CZ 3.28Å; D735-R786 IonicContact OD2-NE 3.48Å; D735-R786 IonicContact OD2-NH1 3.89Å; D735-R786 PolarHBondContact OD2-NH1 2.88Å; D735-A787 VanDerWaalsContact C-CB 3.47Å
736	S	97.3	Very high	93	Very high	41 Å²	41	56.6 Å²	56.6	29%	0.287	33%	0.333	S	S	.	.			trans	-143.4	128.5	170.1	-167.3	0	0	0	0	109.6	L734 Q790	L734-S736 VanDerWaalsContact C-N 3.35Å; S736-Q790 VanDerWaalsContact OG-CD 3.31Å; S736-Q790 PolarHBondContact OG-NE2 3.04Å; S736-Q790 PolarHBondContact OG-OE1 3.08Å
737	L	97.1	Very high	93.6	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	36%	0.357	C	S	.	.			trans	-83.3	-19.4	-177.2	-66.1	175.8	0	0	0	114	E740 I741 I767 I781 A787 I788 A791 F797	L737-E740 PolarHBondContact O-N 3.07Å; L737-I741 HydrophobicContact CB-CD1 3.83Å; L737-I741 HydrophobicContact CB-CG1 4.4Å; L737-I741 HydrophobicContact CD1-CD1 4.41Å; L737-I741 WeakPolarHBondContact O-CB 3.31Å; L737-I741 WeakPolarHBondContact O-CG1 3.32Å; L737-I741 PolarHBondContact O-N 3.1Å; L737-I767 HydrophobicContact CD1-CD1 3.35Å; L737-I767 HydrophobicContact CD2-CD1 3.68Å; L737-I767 HydrophobicContact CG-CD1 4.16Å; L737-I781 HydrophobicContact CD2-CG2 3.95Å; L737-A787 HydrophobicContact CD2-CB 4.1Å; L737-A787 HydrophobicContact CG-CB 3.77Å; L737-I788 HydrophobicContact CD1-CD1 4.17Å; L737-A791 HydrophobicContact CD1-CB 3.87Å; L737-F797 HydrophobicContact CD1-CZ 4.15Å
738	M	95.8	Very high	94.4	Very high	10 Å²	10	63.3 Å²	63.3	5%	0.049	35%	0.345	C	S	.	.	H	α-helix	trans	-72.6	-50.9	-155.1	-67.7	-52.3	-74	0	0	114.3	M29 E740 I741 F742 I794 L796	M29-M738 HydrophobicContact CE-CE 3.8Å; M29-M738 HydrophobicContact SD-CE 3.47Å; M29-M738 WeakPolarHBondContact SD-CE 3.33Å; M738-E740 PolarHBondContact O-N 3.02Å; M738-I741 PolarHBondContact O-N 2.94Å; M738-F742 HydrophobicContact CB-CD2 4.47Å; M738-F742 HydrophobicContact CB-CE2 4.4Å; M738-F742 HydrophobicContact CE-CD2 4.4Å; M738-F742 HydrophobicContact CE-CE2 3.5Å; M738-F742 VanDerWaalsContact CE-CE2 3.5Å; M738-F742 HydrophobicContact CE-CZ 3.79Å; M738-F742 WeakPolarHBondContact O-CB 3.39Å; M738-F742 WeakPolarHBondContact O-CD2 3.08Å; M738-F742 PolarHBondContact O-N 3.17Å; M738-I794 HydrophobicContact CE-CD1 3.75Å; M738-I794 HydrophobicContact CG-CD1 3.45Å; M738-I794 VanDerWaalsContact CG-CD1 3.45Å; M738-I794 HydrophobicContact SD-CD1 3.41Å; M738-I794 WeakPolarHBondContact SD-CD1 3.45Å; M738-I794 HydrophobicContact SD-CG1 4.49Å; M738-L796 HydrophobicContact CE-CD1 3.67Å; M738-L796 HydrophobicContact SD-CB 4.48Å; M738-L796 HydrophobicContact SD-CD1 3.92Å; M738-L796 HydrophobicContact SD-CD2 3.66Å; M738-L796 HydrophobicContact SD-CG 4.23Å
739	D	96.3	Very high	95.4	Very high	106 Å²	106	59.2 Å²	59.2	57%	0.567	33%	0.326	S	S	*	.	H	α-helix	trans	-64.3	-28.1	-178.3	-55.4	-74.9	0	0	0	111.2	R32 R743	R32-D739 IonicContact NH1-OD1 2.75Å; D739-R743 VanDerWaalsContact O-CB 3.29Å; D739-R743 WeakPolarHBondContact O-CB 3.39Å; D739-R743 PolarHBondContact O-N 2.91Å; D739-R743 VanDerWaalsContact O-N 3.09Å
740	E	97.7	Very high	96.4	Very high	36 Å²	36	58.2 Å²	58.2	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-77.3	-45.5	174.7	-165.5	63.5	-124	0	0	113	L734 L737 M738 F742 R743 L744 I781	L734-E740 HydrophobicContact CD1-CB 3.5Å; L734-E740 VanDerWaalsContact CD1-CB 3.5Å; L734-E740 HydrophobicContact CD1-CG 3.74Å; L737-E740 PolarHBondContact O-N 3.07Å; M738-E740 PolarHBondContact O-N 3.02Å; E740-F742 VanDerWaalsContact C-N 3.31Å; E740-F742 PolarHBondContact O-N 2.8Å; E740-R743 WeakPolarHBondContact O-CA 3.23Å; E740-R743 WeakPolarHBondContact O-CB 3.29Å; E740-R743 PolarHBondContact O-N 2.86Å; E740-R743 IonicContact OE1-CZ 3.19Å; E740-R743 IonicContact OE1-NE 2.64Å; E740-R743 PolarHBondContact OE1-NE 2.85Å; E740-R743 IonicContact OE1-NH2 3.94Å; E740-R743 PolarHBondContact OE1-NH2 2.97Å; E740-R743 IonicContact OE2-CZ 3.52Å; E740-R743 IonicContact OE2-NE 2.76Å; E740-R743 PolarHBondContact OE2-NE 3.24Å; E740-R743 IonicContact OE2-NH2 2.69Å; E740-R743 PolarHBondContact OE2-NH2 3.08Å; E740-L744 PolarHBondContact O-N 2.74Å; E740-I781 HydrophobicContact CB-CD1 3.96Å; E740-I781 HydrophobicContact CG-CD1 3.61Å; E740-I781 HydrophobicContact CG-CG1 3.71Å; E740-I781 HydrophobicContact CG-CG2 4.2Å
741	I	97.6	Very high	96.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-41.7	175.5	-73.7	178.9	0	0	0	110.3	L737 M738 R743 L744 I745 L755 I781 L796 I800	L737-I741 HydrophobicContact CB-CD1 3.83Å; L737-I741 HydrophobicContact CB-CG1 4.4Å; L737-I741 HydrophobicContact CD1-CD1 4.41Å; L737-I741 WeakPolarHBondContact O-CB 3.31Å; L737-I741 WeakPolarHBondContact O-CG1 3.32Å; L737-I741 PolarHBondContact O-N 3.1Å; M738-I741 PolarHBondContact O-N 2.94Å; I741-R743 VanDerWaalsContact C-N 3.31Å; I741-R743 PolarHBondContact O-N 3.04Å; I741-L744 PolarHBondContact O-N 2.96Å; I741-I745 HydrophobicContact CG2-CD1 3.57Å; I741-I745 HydrophobicContact CG2-CG1 4.31Å; I741-I745 WeakPolarHBondContact O-CB 3.46Å; I741-I745 WeakPolarHBondContact O-CG1 3.36Å; I741-I745 PolarHBondContact O-N 3.19Å; I741-L755 HydrophobicContact CD1-CD1 4.41Å; I741-I781 HydrophobicContact CB-CD1 4.37Å; I741-I781 HydrophobicContact CD1-CD1 4.33Å; I741-I781 HydrophobicContact CG1-CD1 3.34Å; I741-L796 HydrophobicContact CD1-CD2 3.61Å; I741-I800 HydrophobicContact CG2-CD1 4.15Å
742	F	96.6	Very high	97.1	Very high	36 Å²	36	60.3 Å²	60.3	16%	0.158	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-32.7	172.3	-73.5	-56.9	0	0	0	113.2	M29 R33 M738 E740 G746 F750	M29-F742 HydrophobicContact CB-CE2 4.05Å; M29-F742 HydrophobicContact CB-CZ 3.76Å; M29-F742 HydrophobicContact CE-CZ 4.32Å; M29-F742 HydrophobicContact CG-CE2 3.98Å; M29-F742 HydrophobicContact CG-CZ 4.16Å; M29-F742 HydrophobicContact SD-CE2 3.65Å; M29-F742 HydrophobicContact SD-CZ 3.91Å; R33-F742 HydrophobicContact CG-CD1 4.36Å; M738-F742 HydrophobicContact CB-CD2 4.47Å; M738-F742 HydrophobicContact CB-CE2 4.4Å; M738-F742 HydrophobicContact CE-CD2 4.4Å; M738-F742 HydrophobicContact CE-CE2 3.5Å; M738-F742 VanDerWaalsContact CE-CE2 3.5Å; M738-F742 HydrophobicContact CE-CZ 3.79Å; M738-F742 WeakPolarHBondContact O-CB 3.39Å; M738-F742 WeakPolarHBondContact O-CD2 3.08Å; M738-F742 PolarHBondContact O-N 3.17Å; E740-F742 VanDerWaalsContact C-N 3.31Å; E740-F742 PolarHBondContact O-N 2.8Å; F742-G746 WeakPolarHBondContact O-CA 3.4Å; F742-G746 PolarHBondContact O-N 2.84Å; F742-F750 HydrophobicContact CD1-CE1 4.47Å; F742-F750 AromaticContact CE1-CE1 3.8Å; F742-F750 HydrophobicContact CE1-CE1 3.8Å; F742-F750 AromaticContact CE1-CZ 3.54Å; F742-F750 HydrophobicContact CE1-CZ 3.54Å; F742-F750 AromaticContact CZ-CZ 3.99Å; F742-F750 HydrophobicContact CZ-CZ 3.99Å
743	R	97.3	Very high	97.2	Very high	180 Å²	180	56 Å²	56	68%	0.679	29%	0.285	S	S	*	.	H	α-helix	trans	-68.3	-43	175.8	-172.7	168.3	75.2	170.1	10.1	112.5	D739 E740 I741	D739-R743 VanDerWaalsContact O-CB 3.29Å; D739-R743 WeakPolarHBondContact O-CB 3.39Å; D739-R743 PolarHBondContact O-N 2.91Å; D739-R743 VanDerWaalsContact O-N 3.09Å; E740-R743 WeakPolarHBondContact O-CA 3.23Å; E740-R743 WeakPolarHBondContact O-CB 3.29Å; E740-R743 PolarHBondContact O-N 2.86Å; E740-R743 IonicContact OE1-CZ 3.19Å; E740-R743 IonicContact OE1-NE 2.64Å; E740-R743 PolarHBondContact OE1-NE 2.85Å; E740-R743 IonicContact OE1-NH2 3.94Å; E740-R743 PolarHBondContact OE1-NH2 2.97Å; E740-R743 IonicContact OE2-CZ 3.52Å; E740-R743 IonicContact OE2-NE 2.76Å; E740-R743 PolarHBondContact OE2-NE 3.24Å; E740-R743 IonicContact OE2-NH2 2.69Å; E740-R743 PolarHBondContact OE2-NH2 3.08Å; I741-R743 VanDerWaalsContact C-N 3.31Å; I741-R743 PolarHBondContact O-N 3.04Å
744	L	97.5	Very high	97.2	Very high	37 Å²	37	52 Å²	52	19%	0.194	27%	0.265	C	S	.	.	H	α-helix	trans	-72.4	-37.3	177.7	-65.3	-173	0	0	0	113.1	E740 I741 V769 I781	E740-L744 PolarHBondContact O-N 2.74Å; I741-L744 PolarHBondContact O-N 2.96Å; L744-V769 HydrophobicContact CD1-CB 4.28Å; L744-V769 HydrophobicContact CD1-CG2 3.82Å; L744-I781 HydrophobicContact CD1-CD1 3.88Å; L744-I781 HydrophobicContact CD1-CG1 3.66Å
745	I	97.6	Very high	97.3	Very high	3 Å²	3	50 Å²	50	2%	0.015	26%	0.255	C	S	.	.	H	α-helix	trans	-75.9	-35.3	177	-63.5	177.3	0	0	0	111.5	I741 Q747 R748 F750 V753 V769 I800	I741-I745 HydrophobicContact CG2-CD1 3.57Å; I741-I745 HydrophobicContact CG2-CG1 4.31Å; I741-I745 WeakPolarHBondContact O-CB 3.46Å; I741-I745 WeakPolarHBondContact O-CG1 3.36Å; I741-I745 PolarHBondContact O-N 3.19Å; I745-Q747 PolarHBondContact O-N 3.39Å; I745-R748 HydrophobicContact CG2-CB 3.89Å; I745-R748 WeakPolarHBondContact CG2-O 3.31Å; I745-R748 WeakPolarHBondContact O-CB 3.22Å; I745-R748 PolarHBondContact O-N 2.88Å; I745-F750 HydrophobicContact CD1-CD1 4.2Å; I745-F750 HydrophobicContact CD1-CE1 4.28Å; I745-V753 HydrophobicContact CD1-CB 4.32Å; I745-V753 HydrophobicContact CD1-CG1 3.84Å; I745-V753 HydrophobicContact CD1-CG2 4.32Å; I745-V753 HydrophobicContact CG1-CG1 3.98Å; I745-V753 HydrophobicContact CG1-CG2 4.09Å; I745-V753 HydrophobicContact CG2-CG2 3.92Å; I745-V769 HydrophobicContact CG1-CG1 4.02Å; I745-I800 HydrophobicContact CD1-CD1 3.87Å
746	G	96.9	Very high	97.3	Very high	34 Å²	34	48.2 Å²	48.2	35%	0.351	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	-125.7	-175.6	0	0	0	0	0	112.3	F742	F742-G746 WeakPolarHBondContact O-CA 3.4Å; F742-G746 PolarHBondContact O-N 2.84Å
747	Q	96.4	Very high	97.3	Very high	130 Å²	130	46.3 Å²	46.3	61%	0.607	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	2.4	-177.2	-65.3	-176	-49.1	0	0	114.2	I745	I745-Q747 PolarHBondContact O-N 3.39Å
748	R	97.2	Very high	97.2	Very high	78 Å²	78	48.6 Å²	48.6	29%	0.294	25%	0.245	S	C	.	.	S	Bend	trans	-71.5	144.2	178.4	-66.2	166	172.1	-151.2	-23.3	110.7	R33 I745 V753 E771	R33-R748 PolarHBondContact NH2-O 3.46Å; R33-R748 VanDerWaalsContact NH2-O 3.11Å; I745-R748 HydrophobicContact CG2-CB 3.89Å; I745-R748 WeakPolarHBondContact CG2-O 3.31Å; I745-R748 WeakPolarHBondContact O-CB 3.22Å; I745-R748 PolarHBondContact O-N 2.88Å; R748-V753 HydrophobicContact CB-CG2 4.47Å; R748-E771 IonicContact CZ-OE1 2.78Å; R748-E771 IonicContact CZ-OE2 3.45Å; R748-E771 IonicContact NE-OE1 3.82Å; R748-E771 IonicContact NH1-OE1 3.78Å; R748-E771 PolarHBondContact NH1-OE1 3.2Å; R748-E771 IonicContact NH1-OE2 3.2Å; R748-E771 PolarHBondContact NH1-OE2 2.9Å; R748-E771 IonicContact NH2-OE1 2.76Å; R748-E771 PolarHBondContact NH2-OE1 2.8Å; R748-E771 IonicContact NH2-OE2 2.99Å; R748-E771 PolarHBondContact NH2-OE2 3.45Å
749	P	96.6	Very high	97.2	Very high	58 Å²	58	49.8 Å²	49.8	38%	0.377	25%	0.248	S	C	.	.			trans	-65.6	161.7	172.4	31.8	-35.2	0	0	0	109.8	D751 D752	P749-D751 VanDerWaalsContact C-N 3.31Å; P749-D752 VanDerWaalsContact CD-OD2 3.27Å; P749-D752 WeakPolarHBondContact CD-OD2 3.33Å; P749-D752 HydrophobicContact CG-CB 3.87Å; P749-D752 WeakPolarHBondContact CG-OD2 3.22Å
750	F	97.2	Very high	97	Very high	26 Å²	26	48.5 Å²	48.5	11%	0.114	24%	0.239	C	C	.	.	S	Bend	trans	-68.7	-32.9	177	-71.3	-41.2	0	0	0	112.3	R33 F742 I745 D752 V753 D799 I800	R33-F750 VanDerWaalsContact NH2-CE1 3.34Å; F742-F750 HydrophobicContact CD1-CE1 4.47Å; F742-F750 AromaticContact CE1-CE1 3.8Å; F742-F750 HydrophobicContact CE1-CE1 3.8Å; F742-F750 AromaticContact CE1-CZ 3.54Å; F742-F750 HydrophobicContact CE1-CZ 3.54Å; F742-F750 AromaticContact CZ-CZ 3.99Å; F742-F750 HydrophobicContact CZ-CZ 3.99Å; I745-F750 HydrophobicContact CD1-CD1 4.2Å; I745-F750 HydrophobicContact CD1-CE1 4.28Å; F750-D752 PolarHBondContact O-N 3.46Å; F750-V753 PolarHBondContact O-N 2.75Å; F750-D799 WeakPolarHBondContact CB-O 3.26Å; F750-D799 HydrophobicContact CD2-CB 4.2Å; F750-D799 HydrophobicContact CE2-CB 4.26Å; F750-I800 HydrophobicContact CB-CG1 4.03Å; F750-I800 HydrophobicContact CD1-CD1 3.53Å; F750-I800 HydrophobicContact CD1-CG1 3.51Å; F750-I800 HydrophobicContact CD2-CG1 4.43Å; F750-I800 HydrophobicContact CE1-CD1 3.57Å; F750-I800 HydrophobicContact CE1-CG1 3.91Å; F750-I800 HydrophobicContact CG-CD1 4.32Å; F750-I800 HydrophobicContact CG-CG1 3.79Å; F750-I800 HydrophobicContact CZ-CD1 4.37Å
751	D	97.4	Very high	96.7	Very high	118 Å²	118	54.5 Å²	54.5	63%	0.631	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.9	-179.4	-48.9	-63.5	0	0	0	113.3	P749 V753 M772	P749-D751 VanDerWaalsContact C-N 3.31Å; D751-V753 VanDerWaalsContact C-N 3.32Å; D751-M772 WeakPolarHBondContact O-CE 3.14Å
752	D	97.8	Very high	96.5	Very high	68 Å²	68	62 Å²	62	36%	0.364	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	0.3	174.9	-74.9	-23.1	0	0	0	113.1	P749 F750 E771 M772	P749-D752 VanDerWaalsContact CD-OD2 3.27Å; P749-D752 WeakPolarHBondContact CD-OD2 3.33Å; P749-D752 HydrophobicContact CG-CB 3.87Å; P749-D752 WeakPolarHBondContact CG-OD2 3.22Å; F750-D752 PolarHBondContact O-N 3.46Å; D752-E771 CarbonylContact O-C 3.55Å; D752-E771 WeakPolarHBondContact O-CA 3.42Å; D752-M772 PolarHBondContact O-N 3.44Å
753	V	98.3	Very high	96.4	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.6	-172.9	176.5	0	0	0	0	111.7	I745 R748 F750 D751 V769 R770 L778 I800 P801	I745-V753 HydrophobicContact CD1-CB 4.32Å; I745-V753 HydrophobicContact CD1-CG1 3.84Å; I745-V753 HydrophobicContact CD1-CG2 4.32Å; I745-V753 HydrophobicContact CG1-CG1 3.98Å; I745-V753 HydrophobicContact CG1-CG2 4.09Å; I745-V753 HydrophobicContact CG2-CG2 3.92Å; R748-V753 HydrophobicContact CB-CG2 4.47Å; F750-V753 PolarHBondContact O-N 2.75Å; D751-V753 VanDerWaalsContact C-N 3.32Å; V753-V769 HydrophobicContact CG1-CG1 3.75Å; V753-R770 CarbonylContact C-O 3.58Å; V753-R770 WeakPolarHBondContact CA-O 3.38Å; V753-L778 HydrophobicContact CG2-CD1 4.28Å; V753-I800 HydrophobicContact CB-CG2 4.29Å; V753-I800 HydrophobicContact CG1-CG2 4.13Å; V753-I800 WeakPolarHBondContact O-CG2 3.42Å; V753-P801 WeakPolarHBondContact O-CD 3.26Å
754	V	98.1	Very high	96.3	Very high	13 Å²	13	56.5 Å²	56.5	8%	0.079	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.9	171.1	61.8	0	0	0	0	110.6	R770 M772 P801 F803	V754-R770 HydrophobicContact CG1-CB 3.75Å; V754-R770 HydrophobicContact CG1-CG 3.76Å; V754-R770 PolarHBondContact N-O 2.81Å; V754-R770 PolarHBondContact O-N 3.41Å; V754-M772 HydrophobicContact CB-CG 3.94Å; V754-M772 HydrophobicContact CB-SD 4.22Å; V754-M772 HydrophobicContact CG1-CG 4.05Å; V754-P801 CarbonylContact C-O 3.59Å; V754-P801 WeakPolarHBondContact CA-O 3.26Å; V754-F803 HydrophobicContact CG2-CD2 3.4Å; V754-F803 HydrophobicContact CG2-CE2 3.5Å; V754-F803 VanDerWaalsContact CG2-CE2 3.5Å
755	L	98.3	Very high	96.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.4	170.2	-57.3	-178.1	0	0	0	110	I741 I767 K768 V769 F797 I800 P801 T802 F803	I741-L755 HydrophobicContact CD1-CD1 4.41Å; L755-I767 HydrophobicContact CB-CG2 4.45Å; L755-I767 HydrophobicContact CD2-CG2 4.31Å; L755-K768 WeakPolarHBondContact CA-O 3.35Å; L755-V769 HydrophobicContact CD2-CB 4.29Å; L755-V769 HydrophobicContact CD2-CG1 4.06Å; L755-V769 HydrophobicContact CD2-CG2 3.86Å; L755-F797 HydrophobicContact CD1-CD1 4Å; L755-F797 HydrophobicContact CD1-CE1 3.98Å; L755-I800 HydrophobicContact CD1-CB 4.26Å; L755-I800 HydrophobicContact CD1-CD1 4.23Å; L755-I800 HydrophobicContact CD1-CG2 4.28Å; L755-I800 HydrophobicContact CG-CB 4.4Å; L755-I800 HydrophobicContact CG-CG2 3.89Å; L755-P801 PolarHBondContact N-O 2.99Å; L755-T802 HydrophobicContact CB-CG2 4.28Å; L755-T802 WeakPolarHBondContact O-CA 3.45Å; L755-F803 PolarHBondContact O-N 3.29Å
756	T	97.6	Very high	96.2	Very high	37 Å²	37	55.1 Å²	55.1	23%	0.227	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	116.8	168.2	-49.6	0	0	0	0	109.5	I767 K768 F803	T756-I767 WeakPolarHBondContact O-CA 3.36Å; T756-K768 PolarHBondContact N-O 2.99Å; T756-K768 PolarHBondContact O-N 2.95Å; T756-F803 CarbonylContact C-O 3.33Å; T756-F803 VanDerWaalsContact CA-O 3.31Å; T756-F803 WeakPolarHBondContact CA-O 3.36Å
757	I	97.3	Very high	96.3	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	120.9	-175	-53.1	178.6	0	0	0	109.7	Y765 I767 I788 F797 T802 F803 E805 L819	I757-Y765 HydrophobicContact CG2-CD1 3.85Å; I757-I767 HydrophobicContact CG1-CG1 4.23Å; I757-I767 HydrophobicContact CG1-CG2 4.29Å; I757-I767 HydrophobicContact CG2-CG1 4.33Å; I757-I788 HydrophobicContact CD1-CD1 4.34Å; I757-I788 HydrophobicContact CG2-CD1 4.29Å; I757-F797 HydrophobicContact CD1-CD1 3.97Å; I757-F797 HydrophobicContact CD1-CE1 3.52Å; I757-F797 HydrophobicContact CD1-CZ 3.9Å; I757-T802 HydrophobicContact CD1-CG2 3.57Å; I757-T802 HydrophobicContact CG1-CG2 4.03Å; I757-F803 PolarHBondContact N-O 2.84Å; I757-E805 PolarHBondContact O-N 3.28Å; I757-L819 HydrophobicContact CD1-CD2 4.48Å; I757-L819 HydrophobicContact CG2-CD1 3.86Å
758	L	95.8	Very high	96.3	Very high	49 Å²	49	49.1 Å²	49.1	26%	0.257	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	112.8	175.1	-78.1	157	0	0	0	108.9	Q760 H766 E805	L758-Q760 PolarHBondContact O-N 2.92Å; L758-H766 HydrophobicContact CB-CB 4.26Å; L758-H766 PolarHBondContact N-O 3.42Å; L758-H766 PolarHBondContact O-N 2.9Å; L758-E805 HydrophobicContact CD2-CB 3.7Å; L758-E805 HydrophobicContact CD2-CG 3.79Å; L758-E805 HydrophobicContact CG-CB 4.32Å
759	R	95.1	Very high	96.4	Very high	35 Å²	35	45.4 Å²	45.4	13%	0.132	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	117	174.8	-169.9	-178	-179.2	-176.2	3.9	109.3	N763 Y765 R810 D816 C817	R759-N763 PolarHBondContact NH2-OD1 3.48Å; R759-Y765 HydrophobicContact CB-CD1 3.97Å; R759-Y765 HydrophobicContact CB-CE1 3.81Å; R759-Y765 HydrophobicContact CG-CD1 4.01Å; R759-Y765 HydrophobicContact CG-CE1 3.54Å; R759-Y765 HydrophobicContact CG-CE2 4.42Å; R759-Y765 PolarHBondContact NE-OH 3.49Å; R759-R810 VanDerWaalsContact C-NH2 3.26Å; R759-R810 PolarHBondContact O-NH2 3.32Å; R759-D816 PolarHBondContact NH1-O 3.28Å; R759-D816 PolarHBondContact NH2-O 2.82Å; R759-C817 VanDerWaalsContact NH1-CA 3.34Å; R759-C817 VanDerWaalsContact NH1-CB 3.31Å
760	Q	93.2	Very high	96.5	Very high	80 Å²	80	46.5 Å²	46.5	37%	0.374	23%	0.231	S	C	.	.			trans	-91.6	-177.7	173.1	-69.2	-179.6	-31	0	0	110.9	L758 V764 H766 R810	L758-Q760 PolarHBondContact O-N 2.92Å; Q760-V764 WeakPolarHBondContact CA-O 3.39Å; Q760-V764 HydrophobicContact CB-CB 4.26Å; Q760-V764 PolarHBondContact N-O 2.83Å; Q760-H766 HydrophobicContact CG-CB 4.15Å; Q760-R810 PolarHBondContact O-NH2 3.08Å
761	E	91.4	Very high	96.5	Very high	161 Å²	161	46.3 Å²	46.3	75%	0.752	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-63.1	168.7	175.2	-61.2	-175.8	164.2	0	0	111.2	N763 V764	E761-N763 PolarHBondContact O-N 3.5Å; E761-V764 PolarHBondContact O-N 3.38Å
762	D	93.3	Very high	96.5	Very high	157 Å²	157	45.4 Å²	45.4	84%	0.84	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	52.4	20.5	179.5	-61	-26.3	0	0	0	117.3	V764	D762-V764 VanDerWaalsContact C-N 3.25Å; D762-V764 PolarHBondContact O-N 3.38Å
763	N	94.1	Very high	96.4	Very high	83 Å²	83	46.1 Å²	46.1	44%	0.444	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	61.7	31.2	-173.8	-51.9	-69.2	0	0	0	113.8	R759 E761 Y765 G785	R759-N763 PolarHBondContact NH2-OD1 3.48Å; E761-N763 PolarHBondContact O-N 3.5Å; N763-Y765 HydrophobicContact CB-CE2 4.36Å; N763-Y765 VanDerWaalsContact O-CD2 3.26Å; N763-Y765 WeakPolarHBondContact O-CD2 3.48Å; N763-Y765 VanDerWaalsContact O-CE2 3.26Å; N763-Y765 WeakPolarHBondContact O-CE2 3.42Å; N763-G785 PolarHBondContact O-N 2.75Å
764	V	95.6	Very high	96.3	Very high	19 Å²	19	50.1 Å²	50.1	12%	0.115	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	144	161.7	-174.9	0	0	0	0	109	I733 Q760 E761 D762 L782 G783	I733-V764 HydrophobicContact CD1-CG1 4.37Å; I733-V764 HydrophobicContact CD1-CG2 3.69Å; I733-V764 HydrophobicContact CG1-CG1 4.13Å; I733-V764 HydrophobicContact CG1-CG2 4.3Å; I733-V764 HydrophobicContact CG2-CG2 4.5Å; Q760-V764 WeakPolarHBondContact CA-O 3.39Å; Q760-V764 HydrophobicContact CB-CB 4.26Å; Q760-V764 PolarHBondContact N-O 2.83Å; E761-V764 PolarHBondContact O-N 3.38Å; D762-V764 VanDerWaalsContact C-N 3.25Å; D762-V764 PolarHBondContact O-N 3.38Å; V764-L782 HydrophobicContact CG1-CB 4.08Å; V764-L782 HydrophobicContact CG1-CD1 4.5Å; V764-L782 HydrophobicContact CG1-CD2 4.42Å; V764-G783 CarbonylContact C-O 3.57Å
765	Y	96.8	Very high	96.2	Very high	1 Å²	1	51.2 Å²	51.2	0%	0.004	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	113.5	179.3	-66.9	-101.4	0	0	0	108.5	I757 R759 N763 I767 G783 I788 P818 L819	I757-Y765 HydrophobicContact CG2-CD1 3.85Å; R759-Y765 HydrophobicContact CB-CD1 3.97Å; R759-Y765 HydrophobicContact CB-CE1 3.81Å; R759-Y765 HydrophobicContact CG-CD1 4.01Å; R759-Y765 HydrophobicContact CG-CE1 3.54Å; R759-Y765 HydrophobicContact CG-CE2 4.42Å; R759-Y765 PolarHBondContact NE-OH 3.49Å; N763-Y765 HydrophobicContact CB-CE2 4.36Å; N763-Y765 VanDerWaalsContact O-CD2 3.26Å; N763-Y765 WeakPolarHBondContact O-CD2 3.48Å; N763-Y765 VanDerWaalsContact O-CE2 3.26Å; N763-Y765 WeakPolarHBondContact O-CE2 3.42Å; Y765-I767 PolarHBondContact O-N 3.29Å; Y765-G783 PolarHBondContact N-O 2.88Å; Y765-G783 PolarHBondContact O-N 2.83Å; Y765-I788 HydrophobicContact CD1-CD1 4.03Å; Y765-I788 HydrophobicContact CD1-CG1 3.85Å; Y765-I788 HydrophobicContact CD2-CD1 4.49Å; Y765-I788 HydrophobicContact CD2-CG1 3.59Å; Y765-I788 HydrophobicContact CE1-CG1 4.29Å; Y765-I788 HydrophobicContact CE2-CG1 4.08Å; Y765-I788 HydrophobicContact CG-CD1 3.89Å; Y765-I788 HydrophobicContact CG-CG1 3.48Å; Y765-I788 VanDerWaalsContact CG-CG1 3.48Å; Y765-P818 WeakPolarHBondContact OH-CD 3.46Å; Y765-L819 HydrophobicContact CD1-CD1 3.92Å; Y765-L819 HydrophobicContact CE1-CD1 3.62Å; Y765-L819 HydrophobicContact CE1-CG 4.26Å
766	H	96.8	Very high	96.1	Very high	9 Å²	9	57.8 Å²	57.8	4%	0.042	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	114.4	172.1	167.8	-130.3	0	0	0	108.7	C726 L758 Q760 C780 L782	C726-H766 PolarHBondContact SG-CD2 2.75Å; C726-H766 PolarHBondContact SG-NE2 2.66Å; L758-H766 HydrophobicContact CB-CB 4.26Å; L758-H766 PolarHBondContact N-O 3.42Å; L758-H766 PolarHBondContact O-N 2.9Å; Q760-H766 HydrophobicContact CG-CB 4.15Å; H766-C780 WeakPolarHBondContact NE2-CB 3.45Å; H766-C780 PolarHBondContact NE2-SG 3.14Å; H766-L782 HydrophobicContact CB-CD2 3.73Å
767	I	97.6	Very high	96.1	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	112.4	-178.1	-52.4	-178	0	0	0	108.2	L737 L755 T756 I757 Y765 C780 I781 I788	L737-I767 HydrophobicContact CD1-CD1 3.35Å; L737-I767 HydrophobicContact CD2-CD1 3.68Å; L737-I767 HydrophobicContact CG-CD1 4.16Å; L755-I767 HydrophobicContact CB-CG2 4.45Å; L755-I767 HydrophobicContact CD2-CG2 4.31Å; T756-I767 WeakPolarHBondContact O-CA 3.36Å; I757-I767 HydrophobicContact CG1-CG1 4.23Å; I757-I767 HydrophobicContact CG1-CG2 4.29Å; I757-I767 HydrophobicContact CG2-CG1 4.33Å; Y765-I767 PolarHBondContact O-N 3.29Å; I767-C780 CarbonylContact O-C 3.59Å; I767-C780 WeakPolarHBondContact O-CA 3.26Å; I767-I781 HydrophobicContact CB-CB 4.49Å; I767-I781 PolarHBondContact N-O 3.01Å; I767-I781 PolarHBondContact O-N 3.27Å; I767-I788 HydrophobicContact CD1-CD1 3.81Å
768	K	97.6	Very high	96.1	Very high	39 Å²	39	59 Å²	59	17%	0.17	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	129	173.2	-168.6	174.8	-163.2	-156.7	0	109.3	L755 T756 D777	L755-K768 WeakPolarHBondContact CA-O 3.35Å; T756-K768 PolarHBondContact N-O 2.99Å; T756-K768 PolarHBondContact O-N 2.95Å; K768-D777 WeakPolarHBondContact CE-OD1 3.16Å; K768-D777 WeakPolarHBondContact CE-OD2 3.29Å; K768-D777 IonicContact NZ-OD1 2.66Å; K768-D777 PolarHBondContact NZ-OD1 2.88Å; K768-D777 IonicContact NZ-OD2 2.89Å; K768-D777 PolarHBondContact NZ-OD2 2.96Å
769	V	98	Very high	96.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.5	177	-170.1	0	0	0	0	108.2	L744 I745 V753 L755 L778 G779 I781	L744-V769 HydrophobicContact CD1-CB 4.28Å; L744-V769 HydrophobicContact CD1-CG2 3.82Å; I745-V769 HydrophobicContact CG1-CG1 4.02Å; V753-V769 HydrophobicContact CG1-CG1 3.75Å; L755-V769 HydrophobicContact CD2-CB 4.29Å; L755-V769 HydrophobicContact CD2-CG1 4.06Å; L755-V769 HydrophobicContact CD2-CG2 3.86Å; V769-L778 HydrophobicContact CB-CB 4.2Å; V769-L778 HydrophobicContact CG1-CB 4.05Å; V769-L778 HydrophobicContact CG1-CD1 4.07Å; V769-L778 PolarHBondContact O-N 3.11Å; V769-G779 PolarHBondContact N-O 3.27Å; V769-G779 PolarHBondContact O-N 3.47Å; V769-I781 HydrophobicContact CG2-CD1 4.26Å
770	R	98.1	Very high	96.3	Very high	81 Å²	81	56.1 Å²	56.1	31%	0.306	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	145	-176.2	163.9	-179.3	-67.9	-162.3	-12.7	111.3	V753 V754 G775 K776 D777	V753-R770 CarbonylContact C-O 3.58Å; V753-R770 WeakPolarHBondContact CA-O 3.38Å; V754-R770 HydrophobicContact CG1-CB 3.75Å; V754-R770 HydrophobicContact CG1-CG 3.76Å; V754-R770 PolarHBondContact N-O 2.81Å; V754-R770 PolarHBondContact O-N 3.41Å; R770-G775 PolarHBondContact NE-O 3.24Å; R770-K776 WeakPolarHBondContact CA-O 3.11Å; R770-D777 IonicContact CZ-OD1 3.19Å; R770-D777 IonicContact NE-OD1 3.93Å; R770-D777 PolarHBondContact NE-OD1 2.88Å; R770-D777 IonicContact NH2-OD1 3.87Å; R770-D777 PolarHBondContact NH2-OD1 2.83Å; R770-D777 IonicContact NH2-OD2 3.32Å; R770-D777 PolarHBondContact NH2-OD2 2.86Å
771	E	98.1	Very high	96.5	Very high	22 Å²	22	52.5 Å²	52.5	10%	0.103	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	128	168.7	175.3	174	-137.8	0	0	110.2	R748 D752 A773 T774 G775 K776	R748-E771 IonicContact CZ-OE1 2.78Å; R748-E771 IonicContact CZ-OE2 3.45Å; R748-E771 IonicContact NE-OE1 3.82Å; R748-E771 IonicContact NH1-OE1 3.78Å; R748-E771 PolarHBondContact NH1-OE1 3.2Å; R748-E771 IonicContact NH1-OE2 3.2Å; R748-E771 PolarHBondContact NH1-OE2 2.9Å; R748-E771 IonicContact NH2-OE1 2.76Å; R748-E771 PolarHBondContact NH2-OE1 2.8Å; R748-E771 IonicContact NH2-OE2 2.99Å; R748-E771 PolarHBondContact NH2-OE2 3.45Å; D752-E771 CarbonylContact O-C 3.55Å; D752-E771 WeakPolarHBondContact O-CA 3.42Å; E771-A773 HydrophobicContact CG-CB 4.46Å; E771-T774 WeakPolarHBondContact CB-OG1 3.4Å; E771-T774 HydrophobicContact CG-CG2 4.23Å; E771-T774 WeakPolarHBondContact CG-OG1 3.31Å; E771-T774 VanDerWaalsContact OE2-CG2 3.31Å; E771-T774 WeakPolarHBondContact OE2-CG2 3.37Å; E771-T774 PolarHBondContact OE2-OG1 2.79Å; E771-G775 CarbonylContact O-C 3.54Å; E771-G775 VanDerWaalsContact O-CA 3.26Å; E771-G775 WeakPolarHBondContact O-CA 3.23Å; E771-G775 PolarHBondContact O-N 2.74Å; E771-K776 PolarHBondContact N-O 2.78Å
772	M	96.8	Very high	96.8	Very high	99 Å²	99	45.6 Å²	45.6	49%	0.488	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-44	-178.3	-57.1	-155.6	-40.6	0	0	111.9	D751 D752 V754 T774 G775 P801	D751-M772 WeakPolarHBondContact O-CE 3.14Å; D752-M772 PolarHBondContact O-N 3.44Å; V754-M772 HydrophobicContact CB-CG 3.94Å; V754-M772 HydrophobicContact CB-SD 4.22Å; V754-M772 HydrophobicContact CG1-CG 4.05Å; M772-T774 VanDerWaalsContact C-N 3.28Å; M772-T774 PolarHBondContact O-N 3.09Å; M772-G775 PolarHBondContact O-N 3.22Å; M772-P801 HydrophobicContact SD-CB 4.48Å; M772-P801 HydrophobicContact SD-CG 4.42Å
773	A	95.7	Very high	97	Very high	83 Å²	83	38.1 Å²	38.1	69%	0.686	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-27.1	-173.3	0	0	0	0	0	114.1	E771	E771-A773 HydrophobicContact CG-CB 4.46Å
774	T	97.1	Very high	97.2	Very high	84 Å²	84	35 Å²	35	52%	0.515	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113	-10.9	-178.5	62.8	0	0	0	0	113.3	E771 M772 K776	E771-T774 WeakPolarHBondContact CB-OG1 3.4Å; E771-T774 HydrophobicContact CG-CG2 4.23Å; E771-T774 WeakPolarHBondContact CG-OG1 3.31Å; E771-T774 VanDerWaalsContact OE2-CG2 3.31Å; E771-T774 WeakPolarHBondContact OE2-CG2 3.37Å; E771-T774 PolarHBondContact OE2-OG1 2.79Å; M772-T774 VanDerWaalsContact C-N 3.28Å; M772-T774 PolarHBondContact O-N 3.09Å; T774-K776 PolarHBondContact O-N 2.9Å; T774-K776 VanDerWaalsContact O-N 3.11Å; T774-K776 WeakPolarHBondContact OG1-CB 3.45Å; T774-K776 PolarHBondContact OG1-N 2.59Å; T774-K776 VanDerWaalsContact OG1-N 3.09Å
775	G	96	Very high	97.2	Very high	35 Å²	35	34.8 Å²	34.8	36%	0.361	20%	0.199	S	C	.	.			trans	64.8	0.2	-165.9	0	0	0	0	0	114.6	R770 E771 M772 D777	R770-G775 PolarHBondContact NE-O 3.24Å; E771-G775 CarbonylContact O-C 3.54Å; E771-G775 VanDerWaalsContact O-CA 3.26Å; E771-G775 WeakPolarHBondContact O-CA 3.23Å; E771-G775 PolarHBondContact O-N 2.74Å; M772-G775 PolarHBondContact O-N 3.22Å; G775-D777 PolarHBondContact O-N 2.84Å
776	K	97	Very high	97.3	Very high	138 Å²	138	43 Å²	43	60%	0.6	23%	0.23	S	C	*	.			trans	-72.3	128	-171.9	-173.5	175.4	178.8	176.4	0	110.9	R770 E771 T774 L778	R770-K776 WeakPolarHBondContact CA-O 3.11Å; E771-K776 PolarHBondContact N-O 2.78Å; T774-K776 PolarHBondContact O-N 2.9Å; T774-K776 VanDerWaalsContact O-N 3.11Å; T774-K776 WeakPolarHBondContact OG1-CB 3.45Å; T774-K776 PolarHBondContact OG1-N 2.59Å; T774-K776 VanDerWaalsContact OG1-N 3.09Å; K776-L778 PolarHBondContact O-N 3.02Å
777	D	97.1	Very high	97.3	Very high	20 Å²	20	42.6 Å²	42.6	11%	0.107	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	127.9	171.4	-57.9	-41.6	0	0	0	109.8	Y725 K768 R770 G775	Y725-D777 HydrophobicContact CD2-CB 4.21Å; Y725-D777 HydrophobicContact CE1-CB 4.18Å; Y725-D777 HydrophobicContact CE2-CB 3.54Å; Y725-D777 VanDerWaalsContact CE2-OD2 3.27Å; Y725-D777 WeakPolarHBondContact CE2-OD2 3.34Å; K768-D777 WeakPolarHBondContact CE-OD1 3.16Å; K768-D777 WeakPolarHBondContact CE-OD2 3.29Å; K768-D777 IonicContact NZ-OD1 2.66Å; K768-D777 PolarHBondContact NZ-OD1 2.88Å; K768-D777 IonicContact NZ-OD2 2.89Å; K768-D777 PolarHBondContact NZ-OD2 2.96Å; R770-D777 IonicContact CZ-OD1 3.19Å; R770-D777 IonicContact NE-OD1 3.93Å; R770-D777 PolarHBondContact NE-OD1 2.88Å; R770-D777 IonicContact NH2-OD1 3.87Å; R770-D777 PolarHBondContact NH2-OD1 2.83Å; R770-D777 IonicContact NH2-OD2 3.32Å; R770-D777 PolarHBondContact NH2-OD2 2.86Å; G775-D777 PolarHBondContact O-N 2.84Å
778	L	97.1	Very high	97.3	Very high	45 Å²	45	42.6 Å²	42.6	24%	0.236	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-26.8	178.8	-82.5	170.9	0	0	0	112.3	V753 V769 K776	V753-L778 HydrophobicContact CG2-CD1 4.28Å; V769-L778 HydrophobicContact CB-CB 4.2Å; V769-L778 HydrophobicContact CG1-CB 4.05Å; V769-L778 HydrophobicContact CG1-CD1 4.07Å; V769-L778 PolarHBondContact O-N 3.11Å; K776-L778 PolarHBondContact O-N 3.02Å
779	G	97.1	Very high	97.2	Very high	9 Å²	9	44.6 Å²	44.6	9%	0.093	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.2	-178	177.3	0	0	0	0	0	111.7	V769	V769-G779 PolarHBondContact N-O 3.27Å; V769-G779 PolarHBondContact O-N 3.47Å
780	C	97.7	Very high	97.2	Very high	14 Å²	14	48.4 Å²	48.4	10%	0.095	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	151	176.4	-71.2	0	0	0	0	111	C723 L731 H766 I767	C723-C780 VanDerWaalsContact SG-SG 3.64Å; L731-C780 HydrophobicContact CD1-CB 4.15Å; H766-C780 WeakPolarHBondContact NE2-CB 3.45Å; H766-C780 PolarHBondContact NE2-SG 3.14Å; I767-C780 CarbonylContact O-C 3.59Å; I767-C780 WeakPolarHBondContact O-CA 3.26Å
781	I	97.6	Very high	97.1	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.9	179.3	-52.5	173.4	0	0	0	107.6	L734 L737 E740 I741 L744 I767 V769	L734-I781 HydrophobicContact CD1-CG2 3.82Å; L734-I781 HydrophobicContact CG-CG2 4.31Å; L737-I781 HydrophobicContact CD2-CG2 3.95Å; E740-I781 HydrophobicContact CB-CD1 3.96Å; E740-I781 HydrophobicContact CG-CD1 3.61Å; E740-I781 HydrophobicContact CG-CG1 3.71Å; E740-I781 HydrophobicContact CG-CG2 4.2Å; I741-I781 HydrophobicContact CB-CD1 4.37Å; I741-I781 HydrophobicContact CD1-CD1 4.33Å; I741-I781 HydrophobicContact CG1-CD1 3.34Å; L744-I781 HydrophobicContact CD1-CD1 3.88Å; L744-I781 HydrophobicContact CD1-CG1 3.66Å; I767-I781 HydrophobicContact CB-CB 4.49Å; I767-I781 PolarHBondContact N-O 3.01Å; I767-I781 PolarHBondContact O-N 3.27Å; V769-I781 HydrophobicContact CG2-CD1 4.26Å
782	L	97.3	Very high	97	Very high	15 Å²	15	45.6 Å²	45.6	8%	0.079	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.7	162.7	-59.5	-172.2	0	0	0	108.2	L731 I733 L734 V764 H766	L731-L782 HydrophobicContact CB-CD1 3.98Å; L731-L782 HydrophobicContact CB-CG 3.91Å; L731-L782 HydrophobicContact CD1-CG 4.39Å; I733-L782 WeakPolarHBondContact CA-O 3.04Å; I733-L782 HydrophobicContact CG1-CB 4.14Å; I733-L782 HydrophobicContact CG1-CD1 4.37Å; L734-L782 PolarHBondContact N-O 3.29Å; V764-L782 HydrophobicContact CG1-CB 4.08Å; V764-L782 HydrophobicContact CG1-CD1 4.5Å; V764-L782 HydrophobicContact CG1-CD2 4.42Å; H766-L782 HydrophobicContact CB-CD2 3.73Å
783	G	97.7	Very high	97	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	143.6	176.5	0	0	0	0	0	111.7	L734 V764 Y765	L734-G783 WeakPolarHBondContact O-CA 3.5Å; V764-G783 CarbonylContact C-O 3.57Å; Y765-G783 PolarHBondContact N-O 2.88Å; Y765-G783 PolarHBondContact O-N 2.83Å
784	S	97.8	Very high	97	Very high	19 Å²	19	40.3 Å²	40.3	13%	0.133	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	162.4	166.7	78.5	0	0	0	0	110.9	L734 D735 R786 A787 I788	L734-S784 PolarHBondContact O-N 3.27Å; D735-S784 WeakPolarHBondContact OD1-CB 3.18Å; D735-S784 PolarHBondContact OD1-OG 2.94Å; S784-R786 PolarHBondContact O-N 3.36Å; S784-R786 VanDerWaalsContact O-N 3.14Å; S784-R786 WeakPolarHBondContact OG-CB 3.46Å; S784-R786 PolarHBondContact OG-N 3.06Å; S784-A787 WeakPolarHBondContact O-CA 3.47Å; S784-A787 WeakPolarHBondContact O-CB 3.17Å; S784-A787 PolarHBondContact O-N 2.99Å; S784-A787 PolarHBondContact OG-N 3.41Å; S784-I788 PolarHBondContact O-N 3.46Å; S784-I788 VanDerWaalsContact O-N 3.07Å
785	G	97	Very high	97	Very high	14 Å²	14	36.4 Å²	36.4	14%	0.144	20%	0.2	C	C	.	.	H	α-helix	trans	-56.4	-25.2	169.4	0	0	0	0	0	113.9	N763 N789	N763-G785 PolarHBondContact O-N 2.75Å; G785-N789 WeakPolarHBondContact O-CB 3.42Å; G785-N789 PolarHBondContact O-N 2.84Å; G785-N789 PolarHBondContact O-ND2 3.42Å
786	R	97.2	Very high	97	Very high	173 Å²	173	35 Å²	35	65%	0.653	18%	0.183	S	C	*	.	H	α-helix	trans	-67.7	-42	171.7	-171.8	-164.2	-176.9	-175.7	-2.2	111.2	D735 S784 N789 Q790	D735-R786 VanDerWaalsContact CG-CD 3.47Å; D735-R786 WeakPolarHBondContact OD2-CD 3.44Å; D735-R786 IonicContact OD2-CZ 3.28Å; D735-R786 IonicContact OD2-NE 3.48Å; D735-R786 IonicContact OD2-NH1 3.89Å; D735-R786 PolarHBondContact OD2-NH1 2.88Å; S784-R786 PolarHBondContact O-N 3.36Å; S784-R786 VanDerWaalsContact O-N 3.14Å; S784-R786 WeakPolarHBondContact OG-CB 3.46Å; S784-R786 PolarHBondContact OG-N 3.06Å; R786-N789 PolarHBondContact O-N 3.16Å; R786-Q790 PolarHBondContact O-N 3.2Å
787	A	97.5	Very high	97	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.2	-38.9	179.3	0	0	0	0	0	111.9	L734 D735 L737 S784 Q790 A791	L734-A787 VanDerWaalsContact O-CB 3.22Å; L734-A787 WeakPolarHBondContact O-CB 3.38Å; D735-A787 VanDerWaalsContact C-CB 3.47Å; L737-A787 HydrophobicContact CD2-CB 4.1Å; L737-A787 HydrophobicContact CG-CB 3.77Å; S784-A787 WeakPolarHBondContact O-CA 3.47Å; S784-A787 WeakPolarHBondContact O-CB 3.17Å; S784-A787 PolarHBondContact O-N 2.99Å; S784-A787 PolarHBondContact OG-N 3.41Å; A787-Q790 PolarHBondContact O-N 2.96Å; A787-A791 PolarHBondContact O-N 2.69Å
788	I	97.8	Very high	97	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-52.3	168.3	-68.5	-69.1	0	0	0	110.8	L737 I757 Y765 I767 S784 Q790 A791 I792 F797 L819	L737-I788 HydrophobicContact CD1-CD1 4.17Å; I757-I788 HydrophobicContact CD1-CD1 4.34Å; I757-I788 HydrophobicContact CG2-CD1 4.29Å; Y765-I788 HydrophobicContact CD1-CD1 4.03Å; Y765-I788 HydrophobicContact CD1-CG1 3.85Å; Y765-I788 HydrophobicContact CD2-CD1 4.49Å; Y765-I788 HydrophobicContact CD2-CG1 3.59Å; Y765-I788 HydrophobicContact CE1-CG1 4.29Å; Y765-I788 HydrophobicContact CE2-CG1 4.08Å; Y765-I788 HydrophobicContact CG-CD1 3.89Å; Y765-I788 HydrophobicContact CG-CG1 3.48Å; Y765-I788 VanDerWaalsContact CG-CG1 3.48Å; I767-I788 HydrophobicContact CD1-CD1 3.81Å; S784-I788 PolarHBondContact O-N 3.46Å; S784-I788 VanDerWaalsContact O-N 3.07Å; I788-Q790 PolarHBondContact O-N 3.35Å; I788-A791 PolarHBondContact O-N 3.46Å; I788-I792 HydrophobicContact CG2-CD1 3.95Å; I788-I792 HydrophobicContact CG2-CG1 4.39Å; I788-I792 WeakPolarHBondContact O-CG1 3.32Å; I788-I792 PolarHBondContact O-N 3.47Å; I788-F797 HydrophobicContact CD1-CZ 4.06Å; I788-L819 HydrophobicContact CG2-CD2 3.63Å; I788-L819 HydrophobicContact CG2-CG 4.08Å
789	N	96.6	Very high	96.9	Very high	82 Å²	82	33.1 Å²	33.1	44%	0.439	18%	0.176	S	C	.	.	H	α-helix	trans	-60.5	-33.7	-179.6	-71.6	-16.3	0	0	0	112.7	G785 R786 G793 P818	G785-N789 WeakPolarHBondContact O-CB 3.42Å; G785-N789 PolarHBondContact O-N 2.84Å; G785-N789 PolarHBondContact O-ND2 3.42Å; R786-N789 PolarHBondContact O-N 3.16Å; N789-G793 PolarHBondContact O-N 3.39Å; N789-P818 WeakPolarHBondContact OD1-CB 3.49Å
790	Q	96.8	Very high	97	Very high	80 Å²	80	32.7 Å²	32.7	37%	0.374	17%	0.172	S	C	.	.	H	α-helix	trans	-66.1	-42.7	172.1	-172.8	-173.9	3.8	0	0	111.8	S736 R786 A787 I788 G793 I794	S736-Q790 VanDerWaalsContact OG-CD 3.31Å; S736-Q790 PolarHBondContact OG-NE2 3.04Å; S736-Q790 PolarHBondContact OG-OE1 3.08Å; R786-Q790 PolarHBondContact O-N 3.2Å; A787-Q790 PolarHBondContact O-N 2.96Å; I788-Q790 PolarHBondContact O-N 3.35Å; Q790-G793 CarbonylContact O-C 3.44Å; Q790-G793 PolarHBondContact O-N 2.89Å; Q790-I794 WeakPolarHBondContact O-CD1 3.45Å; Q790-I794 VanDerWaalsContact O-CG1 3.31Å; Q790-I794 WeakPolarHBondContact O-CG1 3.4Å; Q790-I794 PolarHBondContact O-N 3.11Å
791	A	96.8	Very high	97	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-69.2	-35.6	179.6	0	0	0	0	0	113.1	L737 A787 I788 I794 G795 L796 F797	L737-A791 HydrophobicContact CD1-CB 3.87Å; A787-A791 PolarHBondContact O-N 2.69Å; I788-A791 PolarHBondContact O-N 3.46Å; A791-I794 WeakPolarHBondContact O-CG1 3.43Å; A791-G795 PolarHBondContact O-N 3.21Å; A791-L796 HydrophobicContact CB-CB 4.02Å; A791-L796 HydrophobicContact CB-CD2 3.76Å; A791-L796 WeakPolarHBondContact O-CB 3.36Å; A791-L796 PolarHBondContact O-N 3.25Å; A791-F797 HydrophobicContact CB-CD2 4.19Å; A791-F797 HydrophobicContact CB-CE1 4.34Å; A791-F797 HydrophobicContact CB-CE2 3.33Å; A791-F797 HydrophobicContact CB-CZ 3.43Å; A791-F797 VanDerWaalsContact CB-CZ 3.43Å
792	I	96.6	Very high	97	Very high	43 Å²	43	36.1 Å²	36.1	22%	0.221	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-51.9	165.2	-58.2	169.1	0	0	0	109.2	I788 I794 G795 F797 L819 L822	I788-I792 HydrophobicContact CG2-CD1 3.95Å; I788-I792 HydrophobicContact CG2-CG1 4.39Å; I788-I792 WeakPolarHBondContact O-CG1 3.32Å; I788-I792 PolarHBondContact O-N 3.47Å; I792-I794 PolarHBondContact O-N 3.07Å; I792-G795 PolarHBondContact O-N 2.99Å; I792-F797 HydrophobicContact CG1-CD2 3.93Å; I792-F797 HydrophobicContact CG1-CE2 3.95Å; I792-L819 HydrophobicContact CD1-CD2 4.39Å; I792-L822 HydrophobicContact CD1-CD1 4.39Å; I792-L822 HydrophobicContact CG1-CD1 3.85Å; I792-L822 HydrophobicContact CG1-CG 4.45Å
793	G	96.2	Very high	96.9	Very high	47 Å²	47	41.1 Å²	41.1	49%	0.485	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	11	-177.2	0	0	0	0	0	117	N789 Q790	N789-G793 PolarHBondContact O-N 3.39Å; Q790-G793 CarbonylContact O-C 3.44Å; Q790-G793 PolarHBondContact O-N 2.89Å
794	I	96	Very high	96.8	Very high	24 Å²	24	42.9 Å²	42.9	12%	0.123	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.8	-0.1	170.8	63.8	-163.9	0	0	0	113.1	H22 V25 M738 Q790 A791 I792 L796	H22-I794 PolarHBondContact CE1-O 3.45Å; H22-I794 PolarHBondContact ND1-O 3.45Å; H22-I794 PolarHBondContact NE2-O 3.46Å; V25-I794 HydrophobicContact CG1-CG2 4.29Å; M738-I794 HydrophobicContact CE-CD1 3.75Å; M738-I794 HydrophobicContact CG-CD1 3.45Å; M738-I794 VanDerWaalsContact CG-CD1 3.45Å; M738-I794 HydrophobicContact SD-CD1 3.41Å; M738-I794 WeakPolarHBondContact SD-CD1 3.45Å; M738-I794 HydrophobicContact SD-CG1 4.49Å; Q790-I794 WeakPolarHBondContact O-CD1 3.45Å; Q790-I794 VanDerWaalsContact O-CG1 3.31Å; Q790-I794 WeakPolarHBondContact O-CG1 3.4Å; Q790-I794 PolarHBondContact O-N 3.11Å; A791-I794 WeakPolarHBondContact O-CG1 3.43Å; I792-I794 PolarHBondContact O-N 3.07Å; I794-L796 HydrophobicContact CG1-CB 4.42Å
795	G	96	Very high	96.5	Very high	3 Å²	3	46.4 Å²	46.4	3%	0.031	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	23.5	174.9	0	0	0	0	0	115.1	H22 A791 I792 F797 E798 D799	H22-G795 WeakPolarHBondContact NE2-CA 3.4Å; H22-G795 PolarHBondContact NE2-N 3.26Å; A791-G795 PolarHBondContact O-N 3.21Å; I792-G795 PolarHBondContact O-N 2.99Å; G795-F797 PolarHBondContact O-N 3.16Å; G795-E798 VanDerWaalsContact CA-OE2 3.23Å; G795-E798 WeakPolarHBondContact CA-OE2 3.44Å; G795-E798 PolarHBondContact O-N 3.46Å; G795-D799 WeakPolarHBondContact O-CB 3.44Å; G795-D799 PolarHBondContact O-N 3.49Å
796	L	96.6	Very high	95.7	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-39	-173.1	-175.8	67.4	0	0	0	112.9	M738 I741 A791 I794 E798 D799 I800	M738-L796 HydrophobicContact CE-CD1 3.67Å; M738-L796 HydrophobicContact SD-CB 4.48Å; M738-L796 HydrophobicContact SD-CD1 3.92Å; M738-L796 HydrophobicContact SD-CD2 3.66Å; M738-L796 HydrophobicContact SD-CG 4.23Å; I741-L796 HydrophobicContact CD1-CD2 3.61Å; A791-L796 HydrophobicContact CB-CB 4.02Å; A791-L796 HydrophobicContact CB-CD2 3.76Å; A791-L796 WeakPolarHBondContact O-CB 3.36Å; A791-L796 PolarHBondContact O-N 3.25Å; I794-L796 HydrophobicContact CG1-CB 4.42Å; L796-E798 VanDerWaalsContact C-N 3.28Å; L796-D799 PolarHBondContact O-N 2.81Å; L796-I800 HydrophobicContact CD1-CD1 3.52Å; L796-I800 HydrophobicContact CD1-CG1 4.12Å; L796-I800 HydrophobicContact CG-CD1 4.1Å; L796-I800 PolarHBondContact O-N 3.45Å
797	F	97.1	Very high	94.7	Very high	16 Å²	16	44.4 Å²	44.4	7%	0.07	24%	0.24	C	C	.	.	H	α-helix	trans	-83.6	-11.9	-173.5	-55.4	-59.1	0	0	0	112.1	L737 L755 I757 I788 A791 I792 G795 T802 L822	L737-F797 HydrophobicContact CD1-CZ 4.15Å; L755-F797 HydrophobicContact CD1-CD1 4Å; L755-F797 HydrophobicContact CD1-CE1 3.98Å; I757-F797 HydrophobicContact CD1-CD1 3.97Å; I757-F797 HydrophobicContact CD1-CE1 3.52Å; I757-F797 HydrophobicContact CD1-CZ 3.9Å; I788-F797 HydrophobicContact CD1-CZ 4.06Å; A791-F797 HydrophobicContact CB-CD2 4.19Å; A791-F797 HydrophobicContact CB-CE1 4.34Å; A791-F797 HydrophobicContact CB-CE2 3.33Å; A791-F797 HydrophobicContact CB-CZ 3.43Å; A791-F797 VanDerWaalsContact CB-CZ 3.43Å; I792-F797 HydrophobicContact CG1-CD2 3.93Å; I792-F797 HydrophobicContact CG1-CE2 3.95Å; G795-F797 PolarHBondContact O-N 3.16Å; F797-T802 HydrophobicContact CB-CG2 4.31Å; F797-T802 HydrophobicContact CD1-CG2 3.76Å; F797-T802 HydrophobicContact CE1-CG2 4.48Å; F797-T802 HydrophobicContact CG-CG2 4.32Å; F797-L822 HydrophobicContact CB-CD1 3.67Å; F797-L822 HydrophobicContact CB-CD2 4.46Å; F797-L822 HydrophobicContact CD2-CD1 3.55Å; F797-L822 HydrophobicContact CE2-CD1 4.45Å; F797-L822 HydrophobicContact CG-CD1 3.89Å
798	E	96.2	Very high	93.4	Very high	113 Å²	113	53 Å²	53	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-88	-29.3	165.9	-53.1	96.8	119.4	0	0	112.1	G795 L796	G795-E798 VanDerWaalsContact CA-OE2 3.23Å; G795-E798 WeakPolarHBondContact CA-OE2 3.44Å; G795-E798 PolarHBondContact O-N 3.46Å; L796-E798 VanDerWaalsContact C-N 3.28Å
799	D	96.6	Very high	91.9	Very high	35 Å²	35	59.6 Å²	59.6	19%	0.187	31%	0.312	C	S	.	.	H	α-helix	trans	-83.2	-21.8	175.9	-91.1	17.1	0	0	0	113.9	R26 F750 G795 L796	R26-D799 IonicContact CZ-OD1 3.74Å; R26-D799 VanDerWaalsContact CZ-OD1 3.24Å; R26-D799 IonicContact CZ-OD2 3.27Å; R26-D799 IonicContact NE-OD1 2.6Å; R26-D799 PolarHBondContact NE-OD1 2.99Å; R26-D799 IonicContact NE-OD2 3.42Å; R26-D799 PolarHBondContact NE-OD2 2.85Å; R26-D799 IonicContact NH2-OD1 2.63Å; R26-D799 PolarHBondContact NH2-OD1 2.86Å; R26-D799 IonicContact NH2-OD2 3.23Å; R26-D799 PolarHBondContact NH2-OD2 2.69Å; F750-D799 WeakPolarHBondContact CB-O 3.26Å; F750-D799 HydrophobicContact CD2-CB 4.2Å; F750-D799 HydrophobicContact CE2-CB 4.26Å; G795-D799 WeakPolarHBondContact O-CB 3.44Å; G795-D799 PolarHBondContact O-N 3.49Å; L796-D799 PolarHBondContact O-N 2.81Å
800	I	97.6	Very high	90.3	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	31%	0.305	C	S	.	.	S	Bend	trans	-128.9	126.4	179.5	-47.7	178	0	0	0	109.8	I741 I745 F750 V753 L755 L796 T802	I741-I800 HydrophobicContact CG2-CD1 4.15Å; I745-I800 HydrophobicContact CD1-CD1 3.87Å; F750-I800 HydrophobicContact CB-CG1 4.03Å; F750-I800 HydrophobicContact CD1-CD1 3.53Å; F750-I800 HydrophobicContact CD1-CG1 3.51Å; F750-I800 HydrophobicContact CD2-CG1 4.43Å; F750-I800 HydrophobicContact CE1-CD1 3.57Å; F750-I800 HydrophobicContact CE1-CG1 3.91Å; F750-I800 HydrophobicContact CG-CD1 4.32Å; F750-I800 HydrophobicContact CG-CG1 3.79Å; F750-I800 HydrophobicContact CZ-CD1 4.37Å; V753-I800 HydrophobicContact CB-CG2 4.29Å; V753-I800 HydrophobicContact CG1-CG2 4.13Å; V753-I800 WeakPolarHBondContact O-CG2 3.42Å; L755-I800 HydrophobicContact CD1-CB 4.26Å; L755-I800 HydrophobicContact CD1-CD1 4.23Å; L755-I800 HydrophobicContact CD1-CG2 4.28Å; L755-I800 HydrophobicContact CG-CB 4.4Å; L755-I800 HydrophobicContact CG-CG2 3.89Å; L796-I800 HydrophobicContact CD1-CD1 3.52Å; L796-I800 HydrophobicContact CD1-CG1 4.12Å; L796-I800 HydrophobicContact CG-CD1 4.1Å; L796-I800 PolarHBondContact O-N 3.45Å; I800-T802 PolarHBondContact O-N 2.78Å; I800-T802 VanDerWaalsContact O-N 3.08Å; I800-T802 PolarHBondContact O-OG1 2.76Å
801	P	97.5	Very high	88.4	Confident	52 Å²	52	64.6 Å²	64.6	34%	0.338	33%	0.33	S	S	.	.			trans	-45.6	115.2	172.3	-30.6	35.1	0	0	0	112.9	V753 V754 L755 M772	V753-P801 WeakPolarHBondContact O-CD 3.26Å; V754-P801 CarbonylContact C-O 3.59Å; V754-P801 WeakPolarHBondContact CA-O 3.26Å; L755-P801 PolarHBondContact N-O 2.99Å; M772-P801 HydrophobicContact SD-CB 4.48Å; M772-P801 HydrophobicContact SD-CG 4.42Å
802	T	97.4	Very high	86.6	Confident	38 Å²	38	73.6 Å²	73.6	23%	0.233	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.8	-169.8	-64.3	0	0	0	0	111.8	L755 I757 F797 I800	L755-T802 HydrophobicContact CB-CG2 4.28Å; L755-T802 WeakPolarHBondContact O-CA 3.45Å; I757-T802 HydrophobicContact CD1-CG2 3.57Å; I757-T802 HydrophobicContact CG1-CG2 4.03Å; F797-T802 HydrophobicContact CB-CG2 4.31Å; F797-T802 HydrophobicContact CD1-CG2 3.76Å; F797-T802 HydrophobicContact CE1-CG2 4.48Å; F797-T802 HydrophobicContact CG-CG2 4.32Å; I800-T802 PolarHBondContact O-N 2.78Å; I800-T802 VanDerWaalsContact O-N 3.08Å; I800-T802 PolarHBondContact O-OG1 2.76Å
803	F	96.8	Very high	84.5	Confident	119 Å²	119	74.8 Å²	74.8	52%	0.522	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.2	174.2	-64.7	-94.6	0	0	0	109.9	V754 L755 T756 I757	V754-F803 HydrophobicContact CG2-CD2 3.4Å; V754-F803 HydrophobicContact CG2-CE2 3.5Å; V754-F803 VanDerWaalsContact CG2-CE2 3.5Å; L755-F803 PolarHBondContact O-N 3.29Å; T756-F803 CarbonylContact C-O 3.33Å; T756-F803 VanDerWaalsContact CA-O 3.31Å; T756-F803 WeakPolarHBondContact CA-O 3.36Å; I757-F803 PolarHBondContact N-O 2.84Å
804	C	95.3	Very high	82.6	Confident	37 Å²	37	75.6 Å²	75.6	25%	0.25	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	109.4	174.3	-64.7	0	0	0	0	109.6	L806	C804-L806 PolarHBondContact O-N 3.47Å
805	E	91.8	Very high	80.9	Confident	94 Å²	94	83.5 Å²	83.5	44%	0.439	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	108.2	171.3	-177.9	163.8	-158	0	0	109.3	I757 L758 D807	I757-E805 PolarHBondContact O-N 3.28Å; L758-E805 HydrophobicContact CD2-CB 3.7Å; L758-E805 HydrophobicContact CD2-CG 3.79Å; L758-E805 HydrophobicContact CG-CB 4.32Å; E805-D807 PolarHBondContact O-N 3.27Å
806	L	80.1	Confident	79.6	Confident	86 Å²	86	89 Å²	89	45%	0.45	43%	0.425	S	S	.	.			trans	-74.4	116.2	172.8	-66.1	173.4	0	0	0	109	C804 K808	C804-L806 PolarHBondContact O-N 3.47Å; L806-K808 PolarHBondContact O-N 2.98Å; L806-K808 VanDerWaalsContact O-N 3.11Å
807	D	75.3	Confident	78.3	Confident	59 Å²	59	89.2 Å²	89.2	32%	0.316	43%	0.427	S	S	.	.			trans	-56.3	115.9	174.2	167.5	28.7	0	0	0	110.9	E805 N809 R810	E805-D807 PolarHBondContact O-N 3.27Å; D807-N809 PolarHBondContact O-N 2.91Å; D807-N809 WeakPolarHBondContact OD1-CB 3.5Å; D807-N809 PolarHBondContact OD1-N 2.82Å; D807-N809 PolarHBondContact OD1-ND2 2.84Å; D807-R810 HydrophobicContact CB-CG 4.14Å; D807-R810 PolarHBondContact O-N 2.8Å; D807-R810 WeakPolarHBondContact OD2-CG 3.31Å; D807-R810 IonicContact OD2-NE 3.13Å
808	K	70.4	Confident	77	Confident	181 Å²	181	90.9 Å²	90.9	79%	0.787	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-13.4	-175.1	-63.2	166.8	-174.5	157.8	0	113.1	L806	L806-K808 PolarHBondContact O-N 2.98Å; L806-K808 VanDerWaalsContact O-N 3.11Å
809	N	66.1	Low	76	Confident	138 Å²	138	85.9 Å²	85.9	74%	0.738	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.7	-177.3	-54.4	-73.1	0	0	0	113.5	D807 Q811	D807-N809 PolarHBondContact O-N 2.91Å; D807-N809 WeakPolarHBondContact OD1-CB 3.5Å; D807-N809 PolarHBondContact OD1-N 2.82Å; D807-N809 PolarHBondContact OD1-ND2 2.84Å; N809-Q811 PolarHBondContact O-N 2.76Å
810	R	62.8	Low	74.9	Confident	74 Å²	74	86 Å²	86	28%	0.279	42%	0.417	S	S	.	.			trans	-70.8	127.2	-176.2	-70.9	-179.7	173.9	-93.2	-15.5	112.8	R759 Q760 D807	R759-R810 VanDerWaalsContact C-NH2 3.26Å; R759-R810 PolarHBondContact O-NH2 3.32Å; Q760-R810 PolarHBondContact O-NH2 3.08Å; D807-R810 HydrophobicContact CB-CG 4.14Å; D807-R810 PolarHBondContact O-N 2.8Å; D807-R810 WeakPolarHBondContact OD2-CG 3.31Å; D807-R810 IonicContact OD2-NE 3.13Å
811	Q	56.8	Low	73.5	Confident	193 Å²	193	92.6 Å²	92.6	90%	0.902	45%	0.448	S	S	*	.			trans	-88.9	-2.2	169.9	-65.4	-176.7	-15.6	0	0	113.7	N809	N809-Q811 PolarHBondContact O-N 2.76Å
812	Y	58.9	Low	71.8	Confident	189 Å²	189	93 Å²	93	74%	0.741	45%	0.447	S	S	*	.	S	Bend	trans	-91.8	149.3	-178.5	-69	-82.3	0	0	0	112.1
813	D	53.2	Low	69.9	Low	68 Å²	68	92.7 Å²	92.7	36%	0.364	45%	0.446	S	S	.	.			trans	-61.2	129.2	179.9	-164.3	-50.5	0	0	0	110.9	R815 D816	D813-R815 PolarHBondContact O-N 2.85Å; D813-R815 VanDerWaalsContact O-N 3.08Å; D813-R815 VanDerWaalsContact OD1-CB 3.29Å; D813-R815 WeakPolarHBondContact OD1-CB 3.45Å; D813-R815 VanDerWaalsContact OD1-CG 3.31Å; D813-R815 WeakPolarHBondContact OD1-CG 3.44Å; D813-R815 IonicContact OD1-CZ 2.68Å; D813-R815 PolarHBondContact OD1-N 3.39Å; D813-R815 IonicContact OD1-NE 3.49Å; D813-R815 PolarHBondContact OD1-NE 2.88Å; D813-R815 IonicContact OD1-NH2 3.41Å; D813-R815 IonicContact OD2-CZ 2.7Å; D813-R815 IonicContact OD2-NE 3.19Å; D813-R815 PolarHBondContact OD2-NE 3.31Å; D813-R815 IonicContact OD2-NH2 2.73Å; D813-R815 PolarHBondContact OD2-NH2 2.98Å; D813-D816 PolarHBondContact O-N 3.07Å
814	P	56.3	Low	67.6	Low	64 Å²	64	96.2 Å²	96.2	42%	0.416	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-53.6	-28.9	177.1	-28.9	36.1	0	0	0	114.3	D816 C817	P814-D816 PolarHBondContact O-N 3.45Å; P814-D816 VanDerWaalsContact O-N 3.13Å; P814-C817 WeakPolarHBondContact O-CB 3.39Å; P814-C817 PolarHBondContact O-N 3.13Å
815	R	60.1	Low	65.1	Low	189 Å²	189	102.7 Å²	102.7	71%	0.713	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-64.8	-17.6	-175.1	-67.4	175.4	-77	-171.6	-0.1	114.2	D813 C817	D813-R815 PolarHBondContact O-N 2.85Å; D813-R815 VanDerWaalsContact O-N 3.08Å; D813-R815 VanDerWaalsContact OD1-CB 3.29Å; D813-R815 WeakPolarHBondContact OD1-CB 3.45Å; D813-R815 VanDerWaalsContact OD1-CG 3.31Å; D813-R815 WeakPolarHBondContact OD1-CG 3.44Å; D813-R815 IonicContact OD1-CZ 2.68Å; D813-R815 PolarHBondContact OD1-N 3.39Å; D813-R815 IonicContact OD1-NE 3.49Å; D813-R815 PolarHBondContact OD1-NE 2.88Å; D813-R815 IonicContact OD1-NH2 3.41Å; D813-R815 IonicContact OD2-CZ 2.7Å; D813-R815 IonicContact OD2-NE 3.19Å; D813-R815 PolarHBondContact OD2-NE 3.31Å; D813-R815 IonicContact OD2-NH2 2.73Å; D813-R815 PolarHBondContact OD2-NH2 2.98Å; R815-C817 PolarHBondContact O-N 2.89Å
816	D	68	Low	62.8	Low	119 Å²	119	105.1 Å²	105.1	64%	0.636	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-86.2	25.9	170.8	-63.7	-37.9	0	0	0	112.4	R759 D813 P814	R759-D816 PolarHBondContact NH1-O 3.28Å; R759-D816 PolarHBondContact NH2-O 2.82Å; D813-D816 PolarHBondContact O-N 3.07Å; P814-D816 PolarHBondContact O-N 3.45Å; P814-D816 VanDerWaalsContact O-N 3.13Å
817	C	70.8	Confident	60.8	Low	9 Å²	9	104.1 Å²	104.1	6%	0.061	49%	0.486	C	S	.	.			trans	-107.9	120	172.2	-159.6	0	0	0	0	110.2	R759 P814 R815 L819 D820	R759-C817 VanDerWaalsContact NH1-CA 3.34Å; R759-C817 VanDerWaalsContact NH1-CB 3.31Å; P814-C817 WeakPolarHBondContact O-CB 3.39Å; P814-C817 PolarHBondContact O-N 3.13Å; R815-C817 PolarHBondContact O-N 2.89Å; C817-L819 PolarHBondContact O-N 2.98Å; C817-D820 WeakPolarHBondContact O-CB 3.3Å; C817-D820 PolarHBondContact O-N 3.08Å
818	P	69.3	Low	59.1	Low	51 Å²	51	105.7 Å²	105.7	33%	0.331	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-59.9	-19	173.3	-23.5	33.4	0	0	0	114.2	Y765 N789 D820	Y765-P818 WeakPolarHBondContact OH-CD 3.46Å; N789-P818 WeakPolarHBondContact OD1-CB 3.49Å; P818-D820 VanDerWaalsContact C-N 3.34Å
819	L	75.6	Confident	57.5	Low	7 Å²	7	99.3 Å²	99.3	4%	0.037	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-77.6	-11.8	174	-62.7	170.9	0	0	0	113.4	I757 Y765 I788 I792 C817 E821 L822 C823	I757-L819 HydrophobicContact CD1-CD2 4.48Å; I757-L819 HydrophobicContact CG2-CD1 3.86Å; Y765-L819 HydrophobicContact CD1-CD1 3.92Å; Y765-L819 HydrophobicContact CE1-CD1 3.62Å; Y765-L819 HydrophobicContact CE1-CG 4.26Å; I788-L819 HydrophobicContact CG2-CD2 3.63Å; I788-L819 HydrophobicContact CG2-CG 4.08Å; I792-L819 HydrophobicContact CD1-CD2 4.39Å; C817-L819 PolarHBondContact O-N 2.98Å; L819-E821 PolarHBondContact O-N 2.83Å; L819-L822 HydrophobicContact CD2-CD1 4.01Å; L819-L822 PolarHBondContact O-N 2.79Å; L819-C823 WeakPolarHBondContact O-CB 3.33Å; L819-C823 PolarHBondContact O-N 2.92Å; L819-C823 PolarHBondContact O-SG 3.47Å; L819-C823 VanDerWaalsContact O-SG 3.41Å
820	D	72.9	Confident	56.2	Low	37 Å²	37	99.2 Å²	99.2	20%	0.198	50%	0.497	C	S	.	.	G	3₁₀ helix	trans	-63.4	-24.5	-176.6	-111.8	39.9	0	0	0	112.9	C817 P818 C823	C817-D820 WeakPolarHBondContact O-CB 3.3Å; C817-D820 PolarHBondContact O-N 3.08Å; P818-D820 VanDerWaalsContact C-N 3.34Å; D820-C823 CarbonylContact O-C 3.53Å
821	E	67.4	Low	55.1	Low	141 Å²	141	101.6 Å²	101.6	66%	0.659	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-78.5	-28.3	173.8	-176.1	142.3	-125.3	0	0	113.6	L819 R824	L819-E821 PolarHBondContact O-N 2.83Å; E821-R824 WeakPolarHBondContact O-CG 3.36Å; E821-R824 IonicContact OE1-CZ 3.15Å; E821-R824 IonicContact OE1-NE 2.69Å; E821-R824 IonicContact OE1-NH2 2.77Å; E821-R824 PolarHBondContact OE1-NH2 2.91Å
822	L	61.5	Low	54.7	Low	61 Å²	61	96.1 Å²	96.1	32%	0.319	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-40.7	164.8	-76.7	177.6	0	0	0	110.9	I792 F797 L819 R824	I792-L822 HydrophobicContact CD1-CD1 4.39Å; I792-L822 HydrophobicContact CG1-CD1 3.85Å; I792-L822 HydrophobicContact CG1-CG 4.45Å; F797-L822 HydrophobicContact CB-CD1 3.67Å; F797-L822 HydrophobicContact CB-CD2 4.46Å; F797-L822 HydrophobicContact CD2-CD1 3.55Å; F797-L822 HydrophobicContact CE2-CD1 4.45Å; F797-L822 HydrophobicContact CG-CD1 3.89Å; L819-L822 HydrophobicContact CD2-CD1 4.01Å; L819-L822 PolarHBondContact O-N 2.79Å; L822-R824 PolarHBondContact O-N 3.46Å
823	C	58	Low	54.4	Low	31 Å²	31	89.5 Å²	89.5	21%	0.209	48%	0.481	C	S	.	.			trans	-75.2	46.8	176.1	-64.1	0	0	0	0	112.4	L819 D820 R825	L819-C823 WeakPolarHBondContact O-CB 3.33Å; L819-C823 PolarHBondContact O-N 2.92Å; L819-C823 PolarHBondContact O-SG 3.47Å; L819-C823 VanDerWaalsContact O-SG 3.41Å; D820-C823 CarbonylContact O-C 3.53Å; C823-R825 VanDerWaalsContact O-CG 3.3Å; C823-R825 WeakPolarHBondContact O-CG 3.46Å; C823-R825 PolarHBondContact O-N 3.37Å
824	R	49	Very low	54.3	Low	193 Å²	193	94.2 Å²	94.2	73%	0.728	51%	0.507	S	S	*	.			trans	-70	58.8	161.5	-76.7	-177.6	-175.4	-141.7	6.2	111.2	E821 L822	E821-R824 WeakPolarHBondContact O-CG 3.36Å; E821-R824 IonicContact OE1-CZ 3.15Å; E821-R824 IonicContact OE1-NE 2.69Å; E821-R824 IonicContact OE1-NH2 2.77Å; E821-R824 PolarHBondContact OE1-NH2 2.91Å; L822-R824 PolarHBondContact O-N 3.46Å
825	R	43.5	Very low	55.1	Low	173 Å²	173	92.7 Å²	92.7	65%	0.653	50%	0.503	S	S	*	.	S	Bend	trans	22.1	86.4	164.9	-50.4	-163.4	175.6	-173.2	-1.6	117.4	C823 C827	C823-R825 VanDerWaalsContact O-CG 3.3Å; C823-R825 WeakPolarHBondContact O-CG 3.46Å; C823-R825 PolarHBondContact O-N 3.37Å; R825-C827 HydrophobicContact CB-CB 4.26Å; R825-C827 VanDerWaalsContact CD-SG 3.57Å; R825-C827 WeakPolarHBondContact CG-SG 3.4Å
826	Q	42.3	Very low	55.7	Low	145 Å²	145	88.2 Å²	88.2	68%	0.678	50%	0.5	S	S	*	.				-87.8	68.9	122.1	-73.7	-173	-15.7	0	0	108.9	G828	Q826-G828 PolarHBondContact O-N 3.18Å
827	C	38.8	Very low	55.9	Low	65 Å²	65	84.7 Å²	84.7	44%	0.439	49%	0.487	S	S	.	.			trans	-72.9	124	172.1	-76.4	0	0	0	0	109.4	R825 G829	R825-C827 HydrophobicContact CB-CB 4.26Å; R825-C827 VanDerWaalsContact CD-SG 3.57Å; R825-C827 WeakPolarHBondContact CG-SG 3.4Å; C827-G829 PolarHBondContact O-N 2.66Å
828	G	38.8	Very low	56.4	Low	92 Å²	92	86 Å²	86	95%	0.948	49%	0.494	S	S	*	.			trans	-70.1	42.9	166.3	0	0	0	0	0	113.4	Q826	Q826-G828 PolarHBondContact O-N 3.18Å
829	G	37.3	Very low	57.1	Low	47 Å²	47	89.1 Å²	89.1	49%	0.485	50%	0.502	S	S	.	.	S	Bend	trans	-79.2	163.5	167.8	0	0	0	0	0	110.8	C827 I831	C827-G829 PolarHBondContact O-N 2.66Å; G829-I831 VanDerWaalsContact C-N 3.29Å; G829-I831 PolarHBondContact O-N 2.81Å
830	E	38.9	Very low	57.6	Low	136 Å²	136	95.7 Å²	95.7	64%	0.636	53%	0.533	S	S	*	.			trans	-72.8	79.1	-177.4	-169.4	166.9	-148.1	0	0	111.9	A832 K868 R872	E830-A832 PolarHBondContact O-N 3.19Å; E830-K868 WeakPolarHBondContact OE1-CE 3.47Å; E830-K868 IonicContact OE1-NZ 3.46Å; E830-K868 PolarHBondContact OE1-NZ 3.47Å; E830-R872 IonicContact OE1-NH2 2.8Å; E830-R872 PolarHBondContact OE1-NH2 3.48Å
831	I	40.5	Very low	58.2	Low	124 Å²	124	100.9 Å²	100.9	64%	0.636	55%	0.55	S	S	*	.			trans	-67.9	108.9	159.6	-58.7	172.5	0	0	0	106.5	G829 P833	G829-I831 VanDerWaalsContact C-N 3.29Å; G829-I831 PolarHBondContact O-N 2.81Å; I831-P833 VanDerWaalsContact O-CD 3.32Å; I831-P833 WeakPolarHBondContact O-CD 3.33Å
832	A	47.3	Very low	58.8	Low	78 Å²	78	96.5 Å²	96.5	65%	0.645	53%	0.532	S	S	*	.			trans	-68.5	115.2	157.5	0	0	0	0	0	107	E830 D834	E830-A832 PolarHBondContact O-N 3.19Å; A832-D834 VanDerWaalsContact C-N 3.35Å; A832-D834 PolarHBondContact O-N 2.83Å
833	P	52.6	Low	60	Low	49 Å²	49	94.6 Å²	94.6	32%	0.318	52%	0.523	S	S	.	.			trans	-80.1	84.2	-172.1	32.4	-34.3	0	0	0	109.9	I831 G835 D838 F861	I831-P833 VanDerWaalsContact O-CD 3.32Å; I831-P833 WeakPolarHBondContact O-CD 3.33Å; P833-G835 PolarHBondContact O-N 3.08Å; P833-D838 HydrophobicContact CB-CB 3.94Å; P833-F861 HydrophobicContact CG-CZ 4.38Å
834	D	51.4	Low	61.4	Low	168 Å²	168	97.4 Å²	97.4	90%	0.898	53%	0.533	S	S	*	.			trans	-76.4	28.4	-174.2	-153.5	27.2	0	0	0	113.3	A832	A832-D834 VanDerWaalsContact C-N 3.35Å; A832-D834 PolarHBondContact O-N 2.83Å
835	G	74.2	Confident	63.1	Low	32 Å²	32	92.1 Å²	92.1	33%	0.33	52%	0.516	S	S	.	.	S	Bend	trans	-177.7	160.3	-177.4	0	0	0	0	0	114.3	P833 A837 D838	P833-G835 PolarHBondContact O-N 3.08Å; G835-A837 VanDerWaalsContact C-N 3.32Å; G835-A837 PolarHBondContact O-N 2.93Å; G835-D838 PolarHBondContact O-N 2.92Å
836	S	71.6	Confident	64.9	Low	94 Å²	94	84.4 Å²	84.4	66%	0.657	49%	0.488	S	S	*	.	H	α-helix	trans	-61.8	-37.3	176.2	47.8	0	0	0	0	113.1	D838 K839 E840	S836-D838 PolarHBondContact O-N 2.58Å; S836-K839 WeakPolarHBondContact O-CB 3.35Å; S836-K839 PolarHBondContact O-N 3.18Å; S836-E840 PolarHBondContact O-N 3.13Å
837	A	72.5	Confident	66.8	Low	45 Å²	45	79.5 Å²	79.5	37%	0.372	47%	0.468	S	S	.	.	H	α-helix	trans	-62.1	-25.1	-177.9	0	0	0	0	0	114	G835 R841	G835-A837 VanDerWaalsContact C-N 3.32Å; G835-A837 PolarHBondContact O-N 2.93Å; A837-R841 PolarHBondContact O-N 3.4Å
838	D	80.7	Confident	68.5	Low	37 Å²	37	84.2 Å²	84.2	20%	0.198	48%	0.477	C	S	.	.	H	α-helix	trans	-81.1	-28.6	174.5	-67.4	-32.2	0	0	0	111.7	P833 G835 S836 E840 R841 V842	P833-D838 HydrophobicContact CB-CB 3.94Å; G835-D838 PolarHBondContact O-N 2.92Å; S836-D838 PolarHBondContact O-N 2.58Å; D838-E840 VanDerWaalsContact C-N 3.35Å; D838-R841 PolarHBondContact O-N 3.47Å; D838-R841 IonicContact OD1-CZ 3.77Å; D838-R841 VanDerWaalsContact OD1-CZ 3.23Å; D838-R841 IonicContact OD1-NH1 3.16Å; D838-R841 PolarHBondContact OD1-NH1 2.81Å; D838-R841 IonicContact OD1-NH2 2.8Å; D838-R841 PolarHBondContact OD1-NH2 2.99Å; D838-V842 WeakPolarHBondContact O-CG2 3.31Å; D838-V842 PolarHBondContact O-N 3.31Å
839	K	84.9	Confident	70	Confident	116 Å²	116	83.2 Å²	83.2	50%	0.504	45%	0.452	S	S	.	.	H	α-helix	trans	-62.8	-43	171.4	-55.6	-170.6	177.8	179.6	0	110.9	S836 V842 V843 F861	S836-K839 WeakPolarHBondContact O-CB 3.35Å; S836-K839 PolarHBondContact O-N 3.18Å; K839-V842 PolarHBondContact O-N 2.71Å; K839-V843 WeakPolarHBondContact O-CB 3.33Å; K839-V843 VanDerWaalsContact O-CG2 3.31Å; K839-V843 WeakPolarHBondContact O-CG2 3.49Å; K839-V843 PolarHBondContact O-N 2.99Å; K839-F861 HydrophobicContact CB-CE1 4.36Å; K839-F861 HydrophobicContact CG-CE1 4.06Å
840	E	85.9	Confident	71.7	Confident	145 Å²	145	84.1 Å²	84.1	68%	0.678	45%	0.446	S	S	*	.	H	α-helix	trans	-61.3	-44.9	176.2	-68	-177.8	161.2	0	0	111.9	S836 D838 V842 V843 E844	S836-E840 PolarHBondContact O-N 3.13Å; D838-E840 VanDerWaalsContact C-N 3.35Å; E840-V842 PolarHBondContact O-N 2.98Å; E840-V843 PolarHBondContact O-N 3.31Å; E840-E844 WeakPolarHBondContact O-CB 3.46Å; E840-E844 PolarHBondContact O-N 3.01Å
841	R	84.8	Confident	73.6	Confident	147 Å²	147	80.8 Å²	80.8	56%	0.555	45%	0.447	S	S	*	.	H	α-helix	trans	-66.1	-35.8	176.8	-68.2	-173.6	-136.5	128.5	14.4	113.4	A837 D838 E844 F845	A837-R841 PolarHBondContact O-N 3.4Å; D838-R841 PolarHBondContact O-N 3.47Å; D838-R841 IonicContact OD1-CZ 3.77Å; D838-R841 VanDerWaalsContact OD1-CZ 3.23Å; D838-R841 IonicContact OD1-NH1 3.16Å; D838-R841 PolarHBondContact OD1-NH1 2.81Å; D838-R841 IonicContact OD1-NH2 2.8Å; D838-R841 PolarHBondContact OD1-NH2 2.99Å; R841-E844 PolarHBondContact O-N 3.33Å; R841-F845 WeakPolarHBondContact O-CB 3.38Å; R841-F845 PolarHBondContact O-N 3.45Å
842	V	81.4	Confident	75.7	Confident	48 Å²	48	77 Å²	77	29%	0.291	43%	0.428	S	S	.	.	H	α-helix	trans	-72.3	-35	175.2	177.7	0	0	0	0	111.2	D838 K839 E840 F845 C846 F861	D838-V842 WeakPolarHBondContact O-CG2 3.31Å; D838-V842 PolarHBondContact O-N 3.31Å; K839-V842 PolarHBondContact O-N 2.71Å; E840-V842 PolarHBondContact O-N 2.98Å; V842-F845 PolarHBondContact O-N 3.29Å; V842-C846 WeakPolarHBondContact O-CB 3.27Å; V842-C846 PolarHBondContact O-N 2.73Å; V842-C846 PolarHBondContact O-SG 2.93Å; V842-C846 VanDerWaalsContact O-SG 3.36Å; V842-F861 HydrophobicContact CB-CD2 4.28Å; V842-F861 HydrophobicContact CB-CE2 4.11Å; V842-F861 HydrophobicContact CB-CZ 4.46Å; V842-F861 HydrophobicContact CG1-CD2 3.4Å; V842-F861 VanDerWaalsContact CG1-CD2 3.4Å; V842-F861 HydrophobicContact CG1-CE2 3.56Å; V842-F861 HydrophobicContact CG1-CG 4.1Å; V842-F861 HydrophobicContact CG1-CZ 4.36Å; V842-F861 HydrophobicContact CG2-CE2 4.34Å
843	V	86.1	Confident	77.5	Confident	22 Å²	22	77 Å²	77	13%	0.133	42%	0.422	C	S	.	.	H	α-helix	trans	-63.6	-46	170.1	169	0	0	0	0	110.8	K839 E840 F845 C846 T847 A854 A857	K839-V843 WeakPolarHBondContact O-CB 3.33Å; K839-V843 VanDerWaalsContact O-CG2 3.31Å; K839-V843 WeakPolarHBondContact O-CG2 3.49Å; K839-V843 PolarHBondContact O-N 2.99Å; E840-V843 PolarHBondContact O-N 3.31Å; V843-F845 PolarHBondContact O-N 3.36Å; V843-C846 PolarHBondContact O-N 3.31Å; V843-T847 HydrophobicContact CG1-CG2 4.31Å; V843-T847 WeakPolarHBondContact O-CG2 3.47Å; V843-T847 PolarHBondContact O-N 2.99Å; V843-A854 HydrophobicContact CG1-CB 4.04Å; V843-A857 HydrophobicContact CG1-CB 4.14Å
844	E	87.6	Confident	79.1	Confident	90 Å²	90	77.5 Å²	77.5	42%	0.421	43%	0.429	S	S	.	.	H	α-helix	trans	-58.2	-46.5	174.9	-168.6	-160.1	146.6	0	0	111.5	E840 R841 T847 R848	E840-E844 WeakPolarHBondContact O-CB 3.46Å; E840-E844 PolarHBondContact O-N 3.01Å; R841-E844 PolarHBondContact O-N 3.33Å; E844-T847 PolarHBondContact O-N 2.96Å; E844-T847 PolarHBondContact O-OG1 2.69Å; E844-R848 WeakPolarHBondContact O-CB 3.32Å; E844-R848 PolarHBondContact O-N 3.28Å; E844-R848 IonicContact OE1-CZ 2.68Å; E844-R848 IonicContact OE1-NH1 3.24Å; E844-R848 PolarHBondContact OE1-NH1 3.41Å; E844-R848 IonicContact OE1-NH2 3.4Å; E844-R848 PolarHBondContact OE1-NH2 3.43Å
845	F	84.8	Confident	80.9	Confident	82 Å²	82	71.9 Å²	71.9	36%	0.36	41%	0.412	S	S	.	.	H	α-helix	trans	-57.9	-50.8	174.3	174.6	-93.2	0	0	0	111.8	R841 V842 V843 T847 R848 V849	R841-F845 WeakPolarHBondContact O-CB 3.38Å; R841-F845 PolarHBondContact O-N 3.45Å; V842-F845 PolarHBondContact O-N 3.29Å; V843-F845 PolarHBondContact O-N 3.36Å; F845-T847 VanDerWaalsContact C-N 3.32Å; F845-T847 PolarHBondContact O-N 3.29Å; F845-R848 PolarHBondContact O-N 2.97Å; F845-V849 HydrophobicContact CD2-CG2 3.92Å; F845-V849 HydrophobicContact CE1-CB 4.47Å; F845-V849 HydrophobicContact CE1-CG2 4.43Å; F845-V849 HydrophobicContact CE2-CG2 3.69Å; F845-V849 HydrophobicContact CG-CG2 4.4Å; F845-V849 HydrophobicContact CZ-CB 4.35Å; F845-V849 HydrophobicContact CZ-CG1 4.35Å; F845-V849 HydrophobicContact CZ-CG2 3.96Å; F845-V849 WeakPolarHBondContact O-CB 3.37Å; F845-V849 WeakPolarHBondContact O-CG2 3.36Å; F845-V849 PolarHBondContact O-N 2.98Å
846	C	81.6	Confident	81.6	Confident	10 Å²	10	75.5 Å²	75.5	7%	0.068	42%	0.42	C	S	.	.	H	α-helix	trans	-62.6	-35.8	177.9	-75	0	0	0	0	112.5	V842 V843 L850 A857	V842-C846 WeakPolarHBondContact O-CB 3.27Å; V842-C846 PolarHBondContact O-N 2.73Å; V842-C846 PolarHBondContact O-SG 2.93Å; V842-C846 VanDerWaalsContact O-SG 3.36Å; V843-C846 PolarHBondContact O-N 3.31Å; C846-L850 HydrophobicContact CB-CD1 4.26Å; C846-L850 WeakPolarHBondContact O-CA 3.17Å; C846-L850 VanDerWaalsContact O-CB 3.23Å; C846-L850 WeakPolarHBondContact O-CB 3.1Å; C846-L850 PolarHBondContact O-N 3.45Å; C846-A857 HydrophobicContact CB-CB 3.68Å
847	T	80.5	Confident	82.4	Confident	43 Å²	43	71 Å²	71	26%	0.264	39%	0.389	S	S	.	.	H	α-helix	trans	-67	-40.6	174.3	65.5	0	0	0	0	112.1	V843 E844 F845 G851 L852 A854 A857	V843-T847 HydrophobicContact CG1-CG2 4.31Å; V843-T847 WeakPolarHBondContact O-CG2 3.47Å; V843-T847 PolarHBondContact O-N 2.99Å; E844-T847 PolarHBondContact O-N 2.96Å; E844-T847 PolarHBondContact O-OG1 2.69Å; F845-T847 VanDerWaalsContact C-N 3.32Å; F845-T847 PolarHBondContact O-N 3.29Å; T847-G851 VanDerWaalsContact O-CA 3.31Å; T847-G851 WeakPolarHBondContact O-CA 3.41Å; T847-G851 PolarHBondContact O-N 2.88Å; T847-L852 VanDerWaalsContact CA-O 3.26Å; T847-L852 WeakPolarHBondContact CA-O 3.1Å; T847-L852 VanDerWaalsContact CB-O 3.29Å; T847-L852 WeakPolarHBondContact CB-O 3.31Å; T847-L852 WeakPolarHBondContact CG2-O 3.29Å; T847-A854 HydrophobicContact CG2-CB 3.99Å; T847-A857 HydrophobicContact CG2-CB 3.87Å
848	R	74.6	Confident	83.2	Confident	164 Å²	164	71.5 Å²	71.5	62%	0.619	39%	0.389	S	S	*	.	H	α-helix	trans	-74.4	-37.8	-178.2	-177.1	176.1	-68.3	124.1	5.2	113	E844 F845	E844-R848 WeakPolarHBondContact O-CB 3.32Å; E844-R848 PolarHBondContact O-N 3.28Å; E844-R848 IonicContact OE1-CZ 2.68Å; E844-R848 IonicContact OE1-NH1 3.24Å; E844-R848 PolarHBondContact OE1-NH1 3.41Å; E844-R848 IonicContact OE1-NH2 3.4Å; E844-R848 PolarHBondContact OE1-NH2 3.43Å; F845-R848 PolarHBondContact O-N 2.97Å
849	V	70.9	Confident	83.6	Confident	71 Å²	71	79 Å²	79	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-96.5	-32.8	-172.1	178	0	0	0	0	112.8	F845	F845-V849 HydrophobicContact CD2-CG2 3.92Å; F845-V849 HydrophobicContact CE1-CB 4.47Å; F845-V849 HydrophobicContact CE1-CG2 4.43Å; F845-V849 HydrophobicContact CE2-CG2 3.69Å; F845-V849 HydrophobicContact CG-CG2 4.4Å; F845-V849 HydrophobicContact CZ-CB 4.35Å; F845-V849 HydrophobicContact CZ-CG1 4.35Å; F845-V849 HydrophobicContact CZ-CG2 3.96Å; F845-V849 WeakPolarHBondContact O-CB 3.37Å; F845-V849 WeakPolarHBondContact O-CG2 3.36Å; F845-V849 PolarHBondContact O-N 2.98Å
850	L	72.9	Confident	83.7	Confident	66 Å²	66	76.9 Å²	76.9	35%	0.346	41%	0.406	S	S	.	.	H	α-helix	trans	-103.7	-1.3	-179.9	-49.7	176.4	0	0	0	113	C846 L852 F860 F903	C846-L850 HydrophobicContact CB-CD1 4.26Å; C846-L850 WeakPolarHBondContact O-CA 3.17Å; C846-L850 VanDerWaalsContact O-CB 3.23Å; C846-L850 WeakPolarHBondContact O-CB 3.1Å; C846-L850 PolarHBondContact O-N 3.45Å; L850-L852 HydrophobicContact CB-CD1 4.06Å; L850-L852 HydrophobicContact CB-CG 3.9Å; L850-L852 HydrophobicContact CD1-CD1 4.06Å; L850-L852 PolarHBondContact O-N 2.98Å; L850-L852 VanDerWaalsContact O-N 3.1Å; L850-F860 HydrophobicContact CD1-CD1 4.33Å; L850-F860 HydrophobicContact CD1-CE1 4.08Å; L850-F903 HydrophobicContact CD2-CZ 4.05Å
851	G	78.9	Confident	83.7	Confident	65 Å²	65	71.5 Å²	71.5	67%	0.67	38%	0.38	S	S	*	.			trans	66.6	5.6	-176.8	0	0	0	0	0	115	T847	T847-G851 VanDerWaalsContact O-CA 3.31Å; T847-G851 WeakPolarHBondContact O-CA 3.41Å; T847-G851 PolarHBondContact O-N 2.88Å
852	L	85.3	Confident	83.8	Confident	46 Å²	46	67.8 Å²	67.8	24%	0.241	38%	0.377	C	S	.	.			trans	-72.1	138.1	-174.4	-66.2	177.2	0	0	0	111.5	T847 L850 Q856 A857 F860	T847-L852 VanDerWaalsContact CA-O 3.26Å; T847-L852 WeakPolarHBondContact CA-O 3.1Å; T847-L852 VanDerWaalsContact CB-O 3.29Å; T847-L852 WeakPolarHBondContact CB-O 3.31Å; T847-L852 WeakPolarHBondContact CG2-O 3.29Å; L850-L852 HydrophobicContact CB-CD1 4.06Å; L850-L852 HydrophobicContact CB-CG 3.9Å; L850-L852 HydrophobicContact CD1-CD1 4.06Å; L850-L852 PolarHBondContact O-N 2.98Å; L850-L852 VanDerWaalsContact O-N 3.1Å; L852-Q856 HydrophobicContact CB-CB 4.34Å; L852-A857 HydrophobicContact CB-CB 4.17Å; L852-F860 HydrophobicContact CD1-CB 4.37Å; L852-F860 HydrophobicContact CD1-CG 4.47Å
853	P	85.1	Confident	84.1	Confident	78 Å²	78	68.4 Å²	68.4	51%	0.506	38%	0.38	S	S	.	.			trans	-55.5	146.1	165.1	-24.5	34	0	0	0	111.6	G855 Q856 A857	P853-G855 VanDerWaalsContact C-N 3.26Å; P853-G855 PolarHBondContact O-N 3.41Å; P853-G855 VanDerWaalsContact O-N 3.08Å; P853-Q856 WeakPolarHBondContact O-CA 3.44Å; P853-Q856 WeakPolarHBondContact O-CB 3.41Å; P853-Q856 PolarHBondContact O-N 3.38Å; P853-A857 PolarHBondContact O-N 2.99Å
854	A	85.8	Confident	83.8	Confident	58 Å²	58	70.6 Å²	70.6	48%	0.479	39%	0.394	S	S	.	.	H	α-helix	trans	-54	-37.3	-172.5	0	0	0	0	0	114.3	V843 T847 Q856 A857 S858	V843-A854 HydrophobicContact CG1-CB 4.04Å; T847-A854 HydrophobicContact CG2-CB 3.99Å; A854-Q856 PolarHBondContact O-N 2.97Å; A854-A857 PolarHBondContact O-N 3.36Å; A854-S858 WeakPolarHBondContact O-CB 3.16Å; A854-S858 PolarHBondContact O-N 2.72Å
855	G	89.4	Confident	83.1	Confident	51 Å²	51	69 Å²	69	53%	0.526	39%	0.388	S	S	.	.	H	α-helix	trans	-66.2	-33.1	174.2	0	0	0	0	0	114.1	P853 R859	P853-G855 VanDerWaalsContact C-N 3.26Å; P853-G855 PolarHBondContact O-N 3.41Å; P853-G855 VanDerWaalsContact O-N 3.08Å; G855-R859 WeakPolarHBondContact O-CG 3.19Å; G855-R859 PolarHBondContact O-N 3.15Å
856	Q	89.4	Confident	82.8	Confident	108 Å²	108	68 Å²	68	51%	0.505	40%	0.396	S	S	.	.	H	α-helix	trans	-76.9	-42.5	174.1	-66.9	-174.5	-2.9	0	0	111.2	L852 P853 A854 S858 R859 F860	L852-Q856 HydrophobicContact CB-CB 4.34Å; P853-Q856 WeakPolarHBondContact O-CA 3.44Å; P853-Q856 WeakPolarHBondContact O-CB 3.41Å; P853-Q856 PolarHBondContact O-N 3.38Å; A854-Q856 PolarHBondContact O-N 2.97Å; Q856-S858 VanDerWaalsContact C-N 3.3Å; Q856-S858 PolarHBondContact O-N 2.98Å; Q856-R859 PolarHBondContact O-N 3.39Å; Q856-R859 VanDerWaalsContact O-N 3.16Å; Q856-F860 WeakPolarHBondContact O-CB 3.34Å; Q856-F860 PolarHBondContact O-N 3.17Å
857	A	88.4	Confident	82.4	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-57.4	-41.6	173.2	0	0	0	0	0	112.3	V843 C846 T847 L852 P853 A854 F860 F861	V843-A857 HydrophobicContact CG1-CB 4.14Å; C846-A857 HydrophobicContact CB-CB 3.68Å; T847-A857 HydrophobicContact CG2-CB 3.87Å; L852-A857 HydrophobicContact CB-CB 4.17Å; P853-A857 PolarHBondContact O-N 2.99Å; A854-A857 PolarHBondContact O-N 3.36Å; A857-F860 PolarHBondContact O-N 3.11Å; A857-F861 WeakPolarHBondContact O-CB 3.42Å; A857-F861 PolarHBondContact O-N 2.69Å
858	S	87.8	Confident	81.9	Confident	54 Å²	54	74.7 Å²	74.7	38%	0.378	42%	0.424	S	S	.	.	H	α-helix	trans	-66.9	-38.5	175	-172.5	0	0	0	0	112.9	A854 Q856 S862	A854-S858 WeakPolarHBondContact O-CB 3.16Å; A854-S858 PolarHBondContact O-N 2.72Å; Q856-S858 VanDerWaalsContact C-N 3.3Å; Q856-S858 PolarHBondContact O-N 2.98Å; S858-S862 PolarHBondContact O-N 2.95Å; S858-S862 VanDerWaalsContact O-N 3.08Å; S858-S862 PolarHBondContact O-OG 3.41Å; S858-S862 VanDerWaalsContact O-OG 3.04Å
859	R	88.9	Confident	81.6	Confident	194 Å²	194	72.8 Å²	72.8	73%	0.732	42%	0.423	S	S	*	.	H	α-helix	trans	-65.2	-45.8	173.6	-75.4	175.4	-178.4	-166.3	0.2	111.4	G855 Q856 F861 S862 V863	G855-R859 WeakPolarHBondContact O-CG 3.19Å; G855-R859 PolarHBondContact O-N 3.15Å; Q856-R859 PolarHBondContact O-N 3.39Å; Q856-R859 VanDerWaalsContact O-N 3.16Å; R859-F861 PolarHBondContact O-N 3.37Å; R859-S862 PolarHBondContact O-N 3.48Å; R859-V863 WeakPolarHBondContact O-CG2 3.32Å; R859-V863 PolarHBondContact O-N 3.38Å
860	F	88.3	Confident	81.4	Confident	72 Å²	72	71.2 Å²	71.2	32%	0.316	42%	0.422	S	S	.	.	H	α-helix	trans	-57.5	-47.8	177.7	-178.7	-95.3	0	0	0	111.7	L850 L852 Q856 A857 S862 V863 T864 F903	L850-F860 HydrophobicContact CD1-CD1 4.33Å; L850-F860 HydrophobicContact CD1-CE1 4.08Å; L852-F860 HydrophobicContact CD1-CB 4.37Å; L852-F860 HydrophobicContact CD1-CG 4.47Å; Q856-F860 WeakPolarHBondContact O-CB 3.34Å; Q856-F860 PolarHBondContact O-N 3.17Å; A857-F860 PolarHBondContact O-N 3.11Å; F860-S862 PolarHBondContact O-N 3.03Å; F860-V863 PolarHBondContact O-N 2.98Å; F860-T864 WeakPolarHBondContact O-CB 3.15Å; F860-T864 PolarHBondContact O-N 3.22Å; F860-T864 PolarHBondContact O-OG1 3.38Å; F860-F903 HydrophobicContact CE2-CD1 4.45Å; F860-F903 HydrophobicContact CE2-CE1 4.33Å; F860-F903 HydrophobicContact CZ-CD1 4.16Å; F860-F903 AromaticContact CZ-CE1 3.7Å; F860-F903 HydrophobicContact CZ-CE1 3.7Å; F860-F903 HydrophobicContact CZ-CZ 4.4Å
861	F	86.1	Confident	80.6	Confident	32 Å²	32	74 Å²	74	14%	0.14	44%	0.437	C	S	.	.	H	α-helix	trans	-61.4	-41.6	175.3	179.7	-110.8	0	0	0	112.5	P833 K839 V842 A857 R859 N865	P833-F861 HydrophobicContact CG-CZ 4.38Å; K839-F861 HydrophobicContact CB-CE1 4.36Å; K839-F861 HydrophobicContact CG-CE1 4.06Å; V842-F861 HydrophobicContact CB-CD2 4.28Å; V842-F861 HydrophobicContact CB-CE2 4.11Å; V842-F861 HydrophobicContact CB-CZ 4.46Å; V842-F861 HydrophobicContact CG1-CD2 3.4Å; V842-F861 VanDerWaalsContact CG1-CD2 3.4Å; V842-F861 HydrophobicContact CG1-CE2 3.56Å; V842-F861 HydrophobicContact CG1-CG 4.1Å; V842-F861 HydrophobicContact CG1-CZ 4.36Å; V842-F861 HydrophobicContact CG2-CE2 4.34Å; A857-F861 WeakPolarHBondContact O-CB 3.42Å; A857-F861 PolarHBondContact O-N 2.69Å; R859-F861 PolarHBondContact O-N 3.37Å; F861-N865 WeakPolarHBondContact CD2-ND2 3.44Å; F861-N865 VanDerWaalsContact CE1-ND2 3.34Å; F861-N865 WeakPolarHBondContact CE1-ND2 3.25Å; F861-N865 WeakPolarHBondContact CE2-ND2 3.48Å; F861-N865 WeakPolarHBondContact CZ-ND2 3.35Å; F861-N865 PolarHBondContact O-N 3.22Å; F861-N865 VanDerWaalsContact O-N 3.08Å; F861-N865 PolarHBondContact O-ND2 3.35Å
862	S	85.4	Confident	79.1	Confident	70 Å²	70	78.1 Å²	78.1	49%	0.49	43%	0.432	S	S	.	.	H	α-helix	trans	-63.6	-45.3	175.8	-64.7	0	0	0	0	112.7	S858 R859 F860 N865 A866	S858-S862 PolarHBondContact O-N 2.95Å; S858-S862 VanDerWaalsContact O-N 3.08Å; S858-S862 PolarHBondContact O-OG 3.41Å; S858-S862 VanDerWaalsContact O-OG 3.04Å; R859-S862 PolarHBondContact O-N 3.48Å; F860-S862 PolarHBondContact O-N 3.03Å; S862-N865 PolarHBondContact O-N 3.44Å; S862-A866 WeakPolarHBondContact O-CB 3.48Å; S862-A866 PolarHBondContact O-N 2.81Å
863	V	87.7	Confident	77.2	Confident	60 Å²	60	83.6 Å²	83.6	36%	0.364	46%	0.457	S	S	.	.	H	α-helix	trans	-63.7	-44.9	177.7	171.5	0	0	0	0	111.1	R859 F860 N865 A866 L867 V896	R859-V863 WeakPolarHBondContact O-CG2 3.32Å; R859-V863 PolarHBondContact O-N 3.38Å; F860-V863 PolarHBondContact O-N 2.98Å; V863-N865 VanDerWaalsContact C-N 3.31Å; V863-N865 PolarHBondContact O-N 2.68Å; V863-A866 PolarHBondContact O-N 2.95Å; V863-L867 HydrophobicContact CG1-CD1 3.88Å; V863-L867 HydrophobicContact CG1-CG 4.4Å; V863-L867 WeakPolarHBondContact O-CG 3.48Å; V863-L867 PolarHBondContact O-N 2.98Å; V863-V896 HydrophobicContact CG1-CG1 4.49Å
864	T	79.6	Confident	75.2	Confident	68 Å²	68	87 Å²	87	42%	0.417	47%	0.47	S	S	.	.	H	α-helix	trans	-60.9	-40.4	178.6	-52.2	0	0	0	0	111.6	F860 K868	F860-T864 WeakPolarHBondContact O-CB 3.15Å; F860-T864 PolarHBondContact O-N 3.22Å; F860-T864 PolarHBondContact O-OG1 3.38Å; T864-K868 WeakPolarHBondContact O-CB 3.46Å; T864-K868 PolarHBondContact O-N 3.25Å
865	N	74.3	Confident	73	Confident	56 Å²	56	90.6 Å²	90.6	30%	0.299	49%	0.486	S	S	.	.	H	α-helix	trans	-70	-40.3	175.8	-74.6	-55.1	0	0	0	112.7	F861 S862 V863 K868 M869	F861-N865 WeakPolarHBondContact CD2-ND2 3.44Å; F861-N865 VanDerWaalsContact CE1-ND2 3.34Å; F861-N865 WeakPolarHBondContact CE1-ND2 3.25Å; F861-N865 WeakPolarHBondContact CE2-ND2 3.48Å; F861-N865 WeakPolarHBondContact CZ-ND2 3.35Å; F861-N865 PolarHBondContact O-N 3.22Å; F861-N865 VanDerWaalsContact O-N 3.08Å; F861-N865 PolarHBondContact O-ND2 3.35Å; S862-N865 PolarHBondContact O-N 3.44Å; V863-N865 VanDerWaalsContact C-N 3.31Å; V863-N865 PolarHBondContact O-N 2.68Å; N865-K868 PolarHBondContact O-N 2.68Å; N865-M869 WeakPolarHBondContact O-CG 3.49Å; N865-M869 PolarHBondContact O-N 3.33Å
866	A	78.1	Confident	70.3	Confident	63 Å²	63	91 Å²	91	52%	0.521	49%	0.491	S	S	.	.	H	α-helix	trans	-59.8	-47.4	176.3	0	0	0	0	0	111.6	S862 V863 K868 M869 G870	S862-A866 WeakPolarHBondContact O-CB 3.48Å; S862-A866 PolarHBondContact O-N 2.81Å; V863-A866 PolarHBondContact O-N 2.95Å; A866-K868 VanDerWaalsContact C-N 3.34Å; A866-K868 PolarHBondContact O-N 3.44Å; A866-M869 PolarHBondContact O-N 3.18Å; A866-G870 PolarHBondContact O-N 3.42Å
867	L	72.7	Confident	68	Low	99 Å²	99	98.6 Å²	98.6	52%	0.518	52%	0.515	S	S	.	.	H	α-helix	trans	-62.6	-38.5	175.5	-67.2	171.2	0	0	0	112.3	V863 M869 N871	V863-L867 HydrophobicContact CG1-CD1 3.88Å; V863-L867 HydrophobicContact CG1-CG 4.4Å; V863-L867 WeakPolarHBondContact O-CG 3.48Å; V863-L867 PolarHBondContact O-N 2.98Å; L867-M869 VanDerWaalsContact C-N 3.31Å; L867-M869 PolarHBondContact O-N 3.01Å; L867-N871 PolarHBondContact O-N 2.83Å
868	K	70.9	Confident	65.3	Low	94 Å²	94	101.9 Å²	101.9	41%	0.409	55%	0.549	S	S	.	.	H	α-helix	trans	-65.1	-32.4	175.3	-174.9	178.9	176.5	-174.5	0	112.8	E830 T864 N865 A866	E830-K868 WeakPolarHBondContact OE1-CE 3.47Å; E830-K868 IonicContact OE1-NZ 3.46Å; E830-K868 PolarHBondContact OE1-NZ 3.47Å; T864-K868 WeakPolarHBondContact O-CB 3.46Å; T864-K868 PolarHBondContact O-N 3.25Å; N865-K868 PolarHBondContact O-N 2.68Å; A866-K868 VanDerWaalsContact C-N 3.34Å; A866-K868 PolarHBondContact O-N 3.44Å
869	M	68.6	Low	63.1	Low	123 Å²	123	104.4 Å²	104.4	61%	0.606	57%	0.573	S	S	*	*	H	α-helix	trans	-76.4	-47.9	177.4	-69.1	-59	-66.1	0	0	111.9	N865 A866 L867 N871 R872	N865-M869 WeakPolarHBondContact O-CG 3.49Å; N865-M869 PolarHBondContact O-N 3.33Å; A866-M869 PolarHBondContact O-N 3.18Å; L867-M869 VanDerWaalsContact C-N 3.31Å; L867-M869 PolarHBondContact O-N 3.01Å; M869-N871 VanDerWaalsContact C-N 3.26Å; M869-N871 PolarHBondContact O-N 3.16Å; M869-R872 PolarHBondContact O-N 3.28Å
870	G	66.6	Low	60.3	Low	39 Å²	39	102 Å²	102	40%	0.402	58%	0.579	S	S	.	*	H	α-helix	trans	-58.2	-36.4	179.3	0	0	0	0	0	113.5	A866 R872 E873	A866-G870 PolarHBondContact O-N 3.42Å; G870-R872 PolarHBondContact O-N 3.45Å; G870-R872 VanDerWaalsContact O-N 3.11Å; G870-E873 PolarHBondContact O-N 2.85Å
871	N	54.8	Low	57.6	Low	123 Å²	123	104.8 Å²	104.8	66%	0.658	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-2.1	176	-80.2	-12.4	0	0	0	115.1	L867 M869	L867-N871 PolarHBondContact O-N 2.83Å; M869-N871 VanDerWaalsContact C-N 3.26Å; M869-N871 PolarHBondContact O-N 3.16Å
872	R	47.7	Very low	55.3	Low	152 Å²	152	108.8 Å²	108.8	57%	0.574	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-15.8	175.2	-74.5	-173.4	170	178.9	-0.1	114.4	E830 M869 G870	E830-R872 IonicContact OE1-NH2 2.8Å; E830-R872 PolarHBondContact OE1-NH2 3.48Å; M869-R872 PolarHBondContact O-N 3.28Å; G870-R872 PolarHBondContact O-N 3.45Å; G870-R872 VanDerWaalsContact O-N 3.11Å
873	E	46.5	Very low	53	Low	162 Å²	162	110.8 Å²	110.8	76%	0.757	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-26.6	-179.5	-67.4	-177	120.6	0	0	113	G870 T875 G876	G870-E873 PolarHBondContact O-N 2.85Å; E873-T875 PolarHBondContact O-N 3.18Å; E873-G876 PolarHBondContact O-N 3.41Å; E873-G876 VanDerWaalsContact O-N 3.11Å
874	L	42.8	Very low	50.4	Low	150 Å²	150	116 Å²	116	79%	0.785	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	1.8	-175.2	-78.6	166.5	0	0	0	116.3
875	T	38.7	Very low	48.3	Very low	132 Å²	132	119.6 Å²	119.6	81%	0.81	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	2.3	172.1	47	0	0	0	0	114.3	E873	E873-T875 PolarHBondContact O-N 3.18Å
876	G	33	Very low	46.3	Very low	61 Å²	61	123.9 Å²	123.9	63%	0.629	72%	0.718	S	S	*	*			trans	-91.9	105	176.1	0	0	0	0	0	113.6	E873 G878	E873-G876 PolarHBondContact O-N 3.41Å; E873-G876 VanDerWaalsContact O-N 3.11Å; G876-G878 PolarHBondContact O-N 3.45Å; G876-G878 VanDerWaalsContact O-N 3.12Å
877	R	41.7	Very low	44.2	Very low	266 Å²	266	128.2 Å²	128.2	100%	1.004	73%	0.733	S	S	*	*			trans	-74	97.1	164.7	-99.3	-167.6	174	-153.4	-0.5	110
878	G	31.7	Very low	42.3	Very low	69 Å²	69	132.5 Å²	132.5	71%	0.711	75%	0.747	S	S	*	*			trans	-164.9	128.4	170.8	0	0	0	0	0	110.8	G876	G876-G878 PolarHBondContact O-N 3.45Å; G876-G878 VanDerWaalsContact O-N 3.12Å
879	A	40	Very low	40.7	Very low	108 Å²	108	131.3 Å²	131.3	89%	0.893	75%	0.751	S	S	*	*			trans	-86.4	117.3	-174.3	0	0	0	0	0	111.8
880	V	30.2	Very low	39.4	Very low	142 Å²	142	130.3 Å²	130.3	86%	0.861	76%	0.756	S	S	*	*			trans	-138	150.7	163.9	-177.9	0	0	0	0	108
881	T	32.9	Very low	38.1	Very low	131 Å²	131	136.6 Å²	136.6	80%	0.804	77%	0.772	S	S	*	*			trans	-80.3	154.1	-164.9	46.7	0	0	0	0	115.6
882	S	38.1	Very low	37.6	Very low	116 Å²	116	136.3 Å²	136.3	81%	0.811	77%	0.77	S	S	*	*			trans	-40	130.1	168.2	51.3	0	0	0	0	116.5
883	S	36.4	Very low	37.3	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	77%	0.769	S	S	*	*			trans	176.5	91	135.4	-176.8	0	0	0	0	111.3
884	L	33	Very low	37.2	Very low	169 Å²	169	128.2 Å²	128.2	89%	0.885	75%	0.746	S	S	*	*			trans	-171.8	34.9	163.8	-117.3	161.5	0	0	0	116.3
885	V	34.8	Very low	37.2	Very low	144 Å²	144	125.8 Å²	125.8	87%	0.873	73%	0.734	S	S	*	*			trans	-133.6	67.5	174.8	-165.4	0	0	0	0	111.8
886	D	32.2	Very low	37.4	Very low	145 Å²	145	122.7 Å²	122.7	78%	0.775	72%	0.715	S	S	*	*			trans	-126	149.9	162.2	-78.7	-60.7	0	0	0	108.9
887	N	35.5	Very low	37.9	Very low	155 Å²	155	122.7 Å²	122.7	83%	0.829	71%	0.709	S	S	*	*	S	Bend	trans	85.6	31.5	-180	-48.2	-71.5	0	0	0	119
888	F	31.6	Very low	38.1	Very low	188 Å²	188	116.5 Å²	116.5	83%	0.825	69%	0.689	S	S	*	*			trans	-129.2	128	157.4	-77.9	-75.9	0	0	0	112.4	S890 L893	F888-S890 PolarHBondContact O-N 3.05Å; F888-L893 HydrophobicContact CB-CD1 4.28Å
889	S	38.7	Very low	38.7	Very low	69 Å²	69	117.3 Å²	117.3	48%	0.483	68%	0.681	S	S	.	*			trans	-67.5	126.5	177	176.8	0	0	0	0	110.8	K891 D892	S889-K891 PolarHBondContact O-N 3.38Å; S889-D892 PolarHBondContact O-N 3.08Å
890	S	40	Very low	38.8	Very low	102 Å²	102	113.8 Å²	113.8	71%	0.713	65%	0.65	S	S	*	*	H	α-helix	trans	-63.7	-21.7	-177.6	54.7	0	0	0	0	114	F888	F888-S890 PolarHBondContact O-N 3.05Å
891	K	40.2	Very low	39.3	Very low	172 Å²	172	109.5 Å²	109.5	75%	0.748	63%	0.626	S	S	*	*	H	α-helix	trans	-72.4	-37.8	179.5	-76.2	-176.4	174.7	176.5	0	113.5	S889 L893	S889-K891 PolarHBondContact O-N 3.38Å; K891-L893 VanDerWaalsContact C-N 3.34Å; K891-L893 PolarHBondContact O-N 3.22Å
892	D	43.3	Very low	39.6	Very low	116 Å²	116	108.2 Å²	108.2	62%	0.62	61%	0.614	S	S	*	*	H	α-helix	trans	-74.1	-27.6	-177.3	-62.3	-49.4	0	0	0	112.4	S889 V896	S889-D892 PolarHBondContact O-N 3.08Å; D892-V896 WeakPolarHBondContact O-CG2 3.23Å; D892-V896 PolarHBondContact O-N 3.37Å
893	L	41.8	Very low	39.8	Very low	102 Å²	102	106.1 Å²	106.1	53%	0.534	59%	0.59	S	S	.	*	H	α-helix	trans	-70.8	-30.8	179	-79.4	162.5	0	0	0	113.3	F888 K891 D895 A897	F888-L893 HydrophobicContact CB-CD1 4.28Å; K891-L893 VanDerWaalsContact C-N 3.34Å; K891-L893 PolarHBondContact O-N 3.22Å; L893-D895 VanDerWaalsContact C-N 3.33Å; L893-D895 PolarHBondContact O-N 3.41Å; L893-A897 WeakPolarHBondContact O-CB 3.4Å; L893-A897 PolarHBondContact O-N 2.97Å
894	S	45.2	Very low	40.1	Very low	42 Å²	42	106.1 Å²	106.1	29%	0.294	58%	0.581	S	S	.	*	H	α-helix	trans	-49.9	-54.2	173.9	161.4	0	0	0	0	111.4	A897 K898	S894-A897 PolarHBondContact O-N 3.04Å; S894-K898 WeakPolarHBondContact O-CB 3.35Å; S894-K898 WeakPolarHBondContact O-CD 3.36Å; S894-K898 VanDerWaalsContact O-CG 3.24Å; S894-K898 WeakPolarHBondContact O-CG 3.37Å; S894-K898 PolarHBondContact O-N 3.11Å; S894-K898 PolarHBondContact OG-NZ 3.25Å
895	D	41.8	Very low	40.6	Very low	99 Å²	99	105.6 Å²	105.6	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-88.2	-28.5	-164.1	-65.3	1.2	0	0	0	111.1	L893 K898 T899	L893-D895 VanDerWaalsContact C-N 3.33Å; L893-D895 PolarHBondContact O-N 3.41Å; D895-K898 IonicContact OD1-NZ 3.87Å; D895-T899 WeakPolarHBondContact O-CB 3.49Å; D895-T899 WeakPolarHBondContact O-CG2 3.37Å; D895-T899 PolarHBondContact O-N 3.27Å; D895-T899 PolarHBondContact O-OG1 3.29Å
896	V	42.7	Very low	40.9	Very low	67 Å²	67	104 Å²	104	41%	0.406	55%	0.552	S	S	.	*	H	α-helix	trans	-65.6	-40.3	166.5	176.4	0	0	0	0	111.2	V863 D892 T899 S900	V863-V896 HydrophobicContact CG1-CG1 4.49Å; D892-V896 WeakPolarHBondContact O-CG2 3.23Å; D892-V896 PolarHBondContact O-N 3.37Å; V896-T899 WeakPolarHBondContact CA-OG1 3.43Å; V896-T899 PolarHBondContact O-OG1 3.25Å; V896-S900 VanDerWaalsContact O-CB 3.23Å; V896-S900 WeakPolarHBondContact O-CB 3.5Å; V896-S900 PolarHBondContact O-N 3.28Å; V896-S900 PolarHBondContact O-OG 2.96Å
897	A	44.9	Very low	41.2	Very low	61 Å²	61	102.7 Å²	102.7	50%	0.504	54%	0.544	S	S	.	.	H	α-helix	trans	-67.3	-44.9	175.8	0	0	0	0	0	112	L893 S894 S900 S901	L893-A897 WeakPolarHBondContact O-CB 3.4Å; L893-A897 PolarHBondContact O-N 2.97Å; S894-A897 PolarHBondContact O-N 3.04Å; A897-S900 PolarHBondContact O-N 2.76Å; A897-S901 VanDerWaalsContact O-CB 3.3Å; A897-S901 WeakPolarHBondContact O-CB 3.3Å; A897-S901 PolarHBondContact O-N 3.11Å
898	K	45.9	Very low	41.4	Very low	136 Å²	136	98.5 Å²	98.5	59%	0.591	53%	0.527	S	S	*	.	H	α-helix	trans	-60.4	-47.9	177.1	-74.2	162.6	-178.7	165.5	0	112.2	S894 D895 S901 L902	S894-K898 WeakPolarHBondContact O-CB 3.35Å; S894-K898 WeakPolarHBondContact O-CD 3.36Å; S894-K898 VanDerWaalsContact O-CG 3.24Å; S894-K898 WeakPolarHBondContact O-CG 3.37Å; S894-K898 PolarHBondContact O-N 3.11Å; S894-K898 PolarHBondContact OG-NZ 3.25Å; D895-K898 IonicContact OD1-NZ 3.87Å; K898-S901 PolarHBondContact O-N 3.49Å; K898-L902 WeakPolarHBondContact O-CB 3.24Å; K898-L902 PolarHBondContact O-N 3.34Å
899	T	44.4	Very low	41.5	Very low	87 Å²	87	92.6 Å²	92.6	53%	0.534	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-39.8	177.1	49.6	0	0	0	0	112.6	D895 V896 L902 F903	D895-T899 WeakPolarHBondContact O-CB 3.49Å; D895-T899 WeakPolarHBondContact O-CG2 3.37Å; D895-T899 PolarHBondContact O-N 3.27Å; D895-T899 PolarHBondContact O-OG1 3.29Å; V896-T899 WeakPolarHBondContact CA-OG1 3.43Å; V896-T899 PolarHBondContact O-OG1 3.25Å; T899-L902 PolarHBondContact O-N 3.21Å; T899-F903 WeakPolarHBondContact O-CB 3.4Å; T899-F903 PolarHBondContact O-N 2.87Å
900	S	41.3	Very low	41.4	Very low	34 Å²	34	96.1 Å²	96.1	24%	0.238	53%	0.528	C	S	.	.	H	α-helix	trans	-64.4	-41.8	175.5	-59.1	0	0	0	0	112.3	V896 A897 F903 L904	V896-S900 VanDerWaalsContact O-CB 3.23Å; V896-S900 WeakPolarHBondContact O-CB 3.5Å; V896-S900 PolarHBondContact O-N 3.28Å; V896-S900 PolarHBondContact O-OG 2.96Å; A897-S900 PolarHBondContact O-N 2.76Å; S900-F903 PolarHBondContact O-N 2.84Å; S900-L904 WeakPolarHBondContact O-CB 3.17Å; S900-L904 WeakPolarHBondContact O-CG 3.42Å; S900-L904 PolarHBondContact O-N 2.74Å
901	S	40.5	Very low	41.3	Very low	51 Å²	51	97.2 Å²	97.2	36%	0.357	53%	0.534	S	S	.	.	H	α-helix	trans	-62.5	-47.7	175.5	-177.9	0	0	0	0	111.6	A897 K898 F903 L904 R905	A897-S901 VanDerWaalsContact O-CB 3.3Å; A897-S901 WeakPolarHBondContact O-CB 3.3Å; A897-S901 PolarHBondContact O-N 3.11Å; K898-S901 PolarHBondContact O-N 3.49Å; S901-F903 VanDerWaalsContact C-N 3.34Å; S901-F903 PolarHBondContact O-N 3.12Å; S901-L904 PolarHBondContact O-N 2.96Å; S901-R905 WeakPolarHBondContact O-CG 3.41Å; S901-R905 PolarHBondContact O-N 2.87Å
902	L	39.3	Very low	41.1	Very low	105 Å²	105	95.7 Å²	95.7	55%	0.55	53%	0.534	S	S	.	.	H	α-helix	trans	-58.7	-44.7	176.4	-168.9	74.3	0	0	0	111.6	K898 T899 R905 I906	K898-L902 WeakPolarHBondContact O-CB 3.24Å; K898-L902 PolarHBondContact O-N 3.34Å; T899-L902 PolarHBondContact O-N 3.21Å; L902-R905 PolarHBondContact O-N 3.01Å; L902-I906 HydrophobicContact CG-CD1 4.23Å; L902-I906 WeakPolarHBondContact O-CG1 3.38Å; L902-I906 PolarHBondContact O-N 2.74Å
903	F	41.7	Very low	41.1	Very low	71 Å²	71	98.4 Å²	98.4	31%	0.311	55%	0.549	S	S	.	.	H	α-helix	trans	-65.6	-39.6	178.8	-170.3	-108.3	0	0	0	112.6	L850 F860 T899 S900 S901 I906 I907	L850-F903 HydrophobicContact CD2-CZ 4.05Å; F860-F903 HydrophobicContact CE2-CD1 4.45Å; F860-F903 HydrophobicContact CE2-CE1 4.33Å; F860-F903 HydrophobicContact CZ-CD1 4.16Å; F860-F903 AromaticContact CZ-CE1 3.7Å; F860-F903 HydrophobicContact CZ-CE1 3.7Å; F860-F903 HydrophobicContact CZ-CZ 4.4Å; T899-F903 WeakPolarHBondContact O-CB 3.4Å; T899-F903 PolarHBondContact O-N 2.87Å; S900-F903 PolarHBondContact O-N 2.84Å; S901-F903 VanDerWaalsContact C-N 3.34Å; S901-F903 PolarHBondContact O-N 3.12Å; F903-I906 PolarHBondContact O-N 2.68Å; F903-I907 HydrophobicContact CD1-CD1 3.9Å; F903-I907 HydrophobicContact CE1-CD1 3.34Å; F903-I907 HydrophobicContact CE1-CG1 4.4Å; F903-I907 HydrophobicContact CE2-CD1 4.37Å; F903-I907 HydrophobicContact CZ-CD1 3.63Å; F903-I907 HydrophobicContact CZ-CG1 4.48Å; F903-I907 PolarHBondContact O-N 2.83Å
904	L	43.8	Very low	40.7	Very low	114 Å²	114	99.3 Å²	99.3	60%	0.597	56%	0.558	S	S	*	*	H	α-helix	trans	-67.6	-33.6	174.2	-72.7	170.6	0	0	0	112.6	S900 S901 S908	S900-L904 WeakPolarHBondContact O-CB 3.17Å; S900-L904 WeakPolarHBondContact O-CG 3.42Å; S900-L904 PolarHBondContact O-N 2.74Å; S901-L904 PolarHBondContact O-N 2.96Å; L904-S908 VanDerWaalsContact O-CB 3.25Å; L904-S908 WeakPolarHBondContact O-CB 3.49Å; L904-S908 PolarHBondContact O-N 3.37Å; L904-S908 PolarHBondContact O-OG 3.33Å
905	R	43.7	Very low	40.4	Very low	157 Å²	157	105.6 Å²	105.6	59%	0.592	58%	0.583	S	S	*	*	H	α-helix	trans	-63.8	-45.1	169.9	-69.6	177.2	-172.1	-173.3	0	111.5	S901 L902 I907 S908 G909	S901-R905 WeakPolarHBondContact O-CG 3.41Å; S901-R905 PolarHBondContact O-N 2.87Å; L902-R905 PolarHBondContact O-N 3.01Å; R905-I907 PolarHBondContact O-N 2.8Å; R905-S908 PolarHBondContact O-N 3.31Å; R905-S908 PolarHBondContact O-OG 2.66Å; R905-G909 PolarHBondContact O-N 2.84Å
906	I	41	Very low	40.5	Very low	111 Å²	111	108.9 Å²	108.9	57%	0.569	60%	0.6	S	S	*	*	H	α-helix	trans	-60.9	-42.2	177.9	-69.2	163.9	0	0	0	111.8	L902 F903	L902-I906 HydrophobicContact CG-CD1 4.23Å; L902-I906 WeakPolarHBondContact O-CG1 3.38Å; L902-I906 PolarHBondContact O-N 2.74Å; F903-I906 PolarHBondContact O-N 2.68Å
907	I	38.4	Very low	40.1	Very low	117 Å²	117	112.7 Å²	112.7	60%	0.6	62%	0.618	S	S	*	*	H	α-helix	trans	-74.3	-37.1	178	-71.3	-179.6	0	0	0	112.5	F903 R905 G909	F903-I907 HydrophobicContact CD1-CD1 3.9Å; F903-I907 HydrophobicContact CE1-CD1 3.34Å; F903-I907 HydrophobicContact CE1-CG1 4.4Å; F903-I907 HydrophobicContact CE2-CD1 4.37Å; F903-I907 HydrophobicContact CZ-CD1 3.63Å; F903-I907 HydrophobicContact CZ-CG1 4.48Å; F903-I907 PolarHBondContact O-N 2.83Å; R905-I907 PolarHBondContact O-N 2.8Å; I907-G909 VanDerWaalsContact C-N 3.34Å
908	S	40.1	Very low	39.8	Very low	68 Å²	68	123.1 Å²	123.1	48%	0.476	66%	0.657	S	S	.	*	H	α-helix	trans	-79.9	-12.5	-179.4	59.7	0	0	0	0	114.3	L904 R905 Q910	L904-S908 VanDerWaalsContact O-CB 3.25Å; L904-S908 WeakPolarHBondContact O-CB 3.49Å; L904-S908 PolarHBondContact O-N 3.37Å; L904-S908 PolarHBondContact O-OG 3.33Å; R905-S908 PolarHBondContact O-N 3.31Å; R905-S908 PolarHBondContact O-OG 2.66Å; S908-Q910 VanDerWaalsContact C-N 3.26Å; S908-Q910 PolarHBondContact O-N 2.64Å
909	G	32.6	Very low	39.5	Very low	63 Å²	63	122.5 Å²	122.5	65%	0.649	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.5	19.3	176.1	0	0	0	0	0	114.5	R905 I907 C911	R905-G909 PolarHBondContact O-N 2.84Å; I907-G909 VanDerWaalsContact C-N 3.34Å; G909-C911 PolarHBondContact O-N 2.85Å
910	Q	37.6	Very low	39.3	Very low	143 Å²	143	124.4 Å²	124.4	67%	0.668	67%	0.667	S	S	*	*			trans	-89.4	90.8	-179.8	-65.7	-170.9	1.8	0	0	111.2	S908	S908-Q910 VanDerWaalsContact C-N 3.26Å; S908-Q910 PolarHBondContact O-N 2.64Å
911	C	36.8	Very low	39.2	Very low	126 Å²	126	129.4 Å²	129.4	85%	0.851	69%	0.691	S	S	*	*			trans	-96.5	99.5	158.4	-70	0	0	0	0	108.6	G909	G909-C911 PolarHBondContact O-N 2.85Å
912	N	36.6	Very low	39.1	Very low	139 Å²	139	134 Å²	134	74%	0.743	71%	0.71	S	S	*	*			trans	-114.3	129.5	157.3	-76.6	0.2	0	0	0	106.5	V914	N912-V914 PolarHBondContact O-N 3.09Å
913	D	43.3	Very low	39.1	Very low	174 Å²	174	135.8 Å²	135.8	93%	0.93	72%	0.72	S	S	*	*			trans	-71.9	120.3	166.2	-59.6	-56	0	0	0	108.4
914	V	34	Very low	38.9	Very low	121 Å²	121	140.1 Å²	140.1	73%	0.733	75%	0.748	S	S	*	*			trans	-126.2	132.6	167.2	179.9	0	0	0	0	104.7	N912	N912-V914 PolarHBondContact O-N 3.09Å
915	Q	38.1	Very low	38.5	Very low	173 Å²	173	142 Å²	142	81%	0.808	76%	0.759	S	S	*	*			trans	-66.8	135.9	177.3	-69.6	175.8	-114.5	0	0	109.6	D917	Q915-D917 PolarHBondContact O-N 3.08Å
916	D	43.6	Very low	38.1	Very low	168 Å²	168	140.8 Å²	140.8	90%	0.898	77%	0.771	S	S	*	*			trans	-74.2	102	168.4	-61.7	-58.3	0	0	0	108.3
917	D	34.9	Very low	37.9	Very low	147 Å²	147	143.3 Å²	143.3	79%	0.786	79%	0.788	S	S	*	*			trans	-106.8	150	154.2	-72.5	-50.6	0	0	0	107.4	Q915	Q915-D917 PolarHBondContact O-N 3.08Å
918	E	38.7	Very low	37.8	Very low	281 Å²	281	145.7 Å²	145.7	100%	1.313	81%	0.805	S	S	*	*			trans	-56.8	0	-152.6	-59.5	-173.7	116.8	0	0	118.6

Retrieved 918 of 918 residues in 173.9 ms (Link to these results)

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