A0A5K4F7N1_SCHMA Loading...

AF4/FMR2 family member lilli

AlphaFold DB , UniProt , Accession A0A5K4F7N1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,163 aa.

						>A0A5K4F7N1_SCHMA|A0A5K4F7N1
MKSLQSDNLTSNYHEHFKRINDFSRFYTSLPISLYPENSPVVMKDMCKSKKYMPTTIIAPDGYVPNSPVRVKLIPLGKKEFSDENANKILSSIVSTNNDLLTVNVLNKLPDIMSNMKTEEIDDSGREAGTISKQSCRNMNKDDFINEQTTIHLVKAFKLNQSDKRQTTSQYFEKKMQGDIDVNGMNRKILAESENQQETTRVEDNNLIDYLKRNNEKATLKKKRRLKDDNSLKKLNEDKIKKRILSGTIEQLKHSNIKHNKLNTLHTMSKCSKDDIVQTELKSVEITDNIEDGGFKNVTENITEFDKTENFRSKPSTEETSKGNQIHKPCNKRSEGLIVNHELRANETGRTPEITIGGTREKRKQHNDLKSEELHLKKERKEANKDNELAENPLVKQGVPVETVEKETIQVECETFQPNTFIRYTADFEDPGTNTYDILLKLYKLNDQCKKHIQNYAEQHFLKWYHFVKERQNISQEIKEDAFVQALSALTILSNFNMNVDDQIKKLKETVKQSNQFDMNNLTSKDTTRQDKLNTSRLCKILDIIFQLDEVFQEGRADELDKMQQNEMKLQTNGLIKVNKWRQTNRNKMPDEILKIIGSSSFKEKDVGLHKYSIEAFSKVKTGDKTEKFDENIESFESSRDKLTCKNLDTSQSIHIESDALENNKIKAYLVGQQLRLSTSKITPQGQTQMKEFLSNPKEVLAKRVQELPKAPFPSLSLKSLELSYDDSVRPAKNGGNLVMLKRNTMANETTKMLISRKNSLNKQRTSKKEEVNVIKAQHFTKYKENLMNNRQHLPKSTAINLTNSIINKPCFVKDSLTSRSEQSLFETALLTKSGPINRELFPLTSVQTLPKIRELRKQENLSRTPSFTNLVMNFMYTKSKQIKRQNSGFNFSVETLYELPSLHNQAKQETRKVEVNKMNRTNGLRYKKQTLETPKIQIEPSLTITSLPKIGSILTIQPTSSIISRPAYKVIQHKPHKIQKKAIRPSENPSDTDIRDFDLNFDTQKILQRFDKALEANIIPSYKQEGLMPTPKLQKDRISALKLLYEIYWGSSDVNQGILKQPHCGLMFKQKLLMELSNSLSIKRKQPKNEKPSTLPMVNILTKNVSYQISTSKSMTKKQENFLFDNMNDLCKIIHHSQDKLSPKESTGIKIDHQKASNTVDL
					

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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	33	Very low	29.5	Very low	230 Å²	230	146.4 Å²	146.4	100%	1.133	79%	0.793	S	S	*	*				0	131.5	0	-67.2	176	177.9	0	0	106.3
2	K	27.6	Very low	29.7	Very low	201 Å²	201	141.9 Å²	141.9	87%	0.874	77%	0.768	S	S	*	*				57.2	120.4	65.2	-61.2	-172.9	178.1	-174	0	110.3
3	S	24.7	Very low	30	Very low	110 Å²	110	143.6 Å²	143.6	77%	0.769	76%	0.759	S	S	*	*			cis	-162.2	137.4	-1.4	45.3	0	0	0	0	110.8
4	L	30.5	Very low	30.2	Very low	171 Å²	171	143.8 Å²	143.8	90%	0.895	75%	0.753	S	S	*	*			trans	-174.7	74.4	153.9	-103.8	164.9	0	0	0	108.4
5	Q	28.4	Very low	30.5	Very low	190 Å²	190	140.7 Å²	140.7	89%	0.888	73%	0.733	S	S	*	*			trans	-98.3	155.2	155.4	-80.4	-179.8	-74.3	0	0	107.5
6	S	28.2	Very low	30.7	Very low	93 Å²	93	139.1 Å²	139.1	65%	0.65	72%	0.721	S	S	*	*			trans	67.3	145.9	-166.6	97.6	0	0	0	0	113
7	D	27.2	Very low	30.8	Very low	129 Å²	129	138.6 Å²	138.6	69%	0.69	71%	0.712	S	S	*	*			cis	-123.1	142.6	15.7	-57.2	-47.3	0	0	0	115.2	L9	D7-L9 PolarHBondContact O-N 2.97Å
8	N	29	Very low	31.2	Very low	149 Å²	149	138.6 Å²	138.6	80%	0.797	71%	0.706	S	S	*	*			trans	2.4	78.8	151.9	-58.9	-12.8	0	0	0	118.9
9	L	29.7	Very low	31.3	Very low	123 Å²	123	139.1 Å²	139.1	64%	0.644	70%	0.698	S	S	*	*			trans	-106.7	5.4	177.8	-101	163.7	0	0	0	115.6	D7	D7-L9 PolarHBondContact O-N 2.97Å
10	T	31.1	Very low	31.6	Very low	131 Å²	131	136.1 Å²	136.1	80%	0.804	68%	0.683	S	S	*	*	S	Bend	trans	-86	-21.6	-169.1	41.3	0	0	0	0	116.3
11	S	34.8	Very low	31.7	Very low	83 Å²	83	133.8 Å²	133.8	58%	0.58	67%	0.673	S	S	*	*	S	Bend	trans	-88.4	-40.5	-176.9	57.5	0	0	0	0	114.4	Y13 H14	S11-Y13 VanDerWaalsContact C-N 3.28Å; S11-Y13 PolarHBondContact O-N 3.24Å; S11-H14 PolarHBondContact O-N 3.1Å
12	N	32.3	Very low	31.9	Very low	93 Å²	93	126 Å²	126	50%	0.497	64%	0.636	S	S	.	*	H	α-helix	trans	-61	-30.4	-172.1	-84.8	-57.9	0	0	0	114.3	H14 E15 H16	N12-H14 PolarHBondContact O-N 3.47Å; N12-E15 PolarHBondContact O-N 3.2Å; N12-H16 PolarHBondContact O-N 3.35Å
13	Y	33.2	Very low	32.2	Very low	164 Å²	164	120.3 Å²	120.3	64%	0.643	61%	0.612	S	S	*	*	H	α-helix	trans	-64.1	-39.4	178.9	-88.1	-82.6	0	0	0	112.7	S11 H16 F17	S11-Y13 VanDerWaalsContact C-N 3.28Å; S11-Y13 PolarHBondContact O-N 3.24Å; Y13-H16 PolarHBondContact O-N 3.02Å; Y13-F17 WeakPolarHBondContact O-CD2 3.43Å; Y13-F17 PolarHBondContact O-N 2.87Å; Y13-F17 VanDerWaalsContact O-N 3.1Å
14	H	33.6	Very low	32.8	Very low	146 Å²	146	118.6 Å²	118.6	68%	0.676	60%	0.599	S	S	*	*	H	α-helix	trans	-71.1	-35.7	-178.7	-147.4	77.3	0	0	0	111.5	S11 N12 F17 K18	S11-H14 PolarHBondContact O-N 3.1Å; N12-H14 PolarHBondContact O-N 3.47Å; H14-F17 PolarHBondContact O-N 3.45Å; H14-K18 PolarHBondContact O-N 3.1Å; H14-K18 VanDerWaalsContact O-N 3.08Å
15	E	33.5	Very low	32.9	Very low	97 Å²	97	119.5 Å²	119.5	45%	0.453	59%	0.591	S	S	.	*	H	α-helix	trans	-66.4	-39.7	172	-122.8	-150.6	-135.9	0	0	112.4	N12 F17 K18 R19	N12-E15 PolarHBondContact O-N 3.2Å; E15-F17 PolarHBondContact O-N 2.86Å; E15-K18 PolarHBondContact O-N 3.42Å; E15-R19 VanDerWaalsContact O-CG 3.28Å; E15-R19 WeakPolarHBondContact O-CG 3.48Å; E15-R19 PolarHBondContact O-N 3.27Å; E15-R19 IonicContact OE1-NH2 2.71Å; E15-R19 IonicContact OE2-CZ 2.77Å; E15-R19 IonicContact OE2-NE 3.99Å; E15-R19 PolarHBondContact OE2-NE 3.35Å; E15-R19 IonicContact OE2-NH2 3.12Å; E15-R19 PolarHBondContact OE2-NH2 3.37Å
16	H	34	Very low	33.2	Very low	116 Å²	116	118.6 Å²	118.6	54%	0.537	58%	0.584	S	S	.	*	H	α-helix	trans	-61.8	-42.4	175.6	-113.5	-83.7	0	0	0	112.3	N12 Y13 R19 I20	N12-H16 PolarHBondContact O-N 3.35Å; Y13-H16 PolarHBondContact O-N 3.02Å; H16-R19 PolarHBondContact O-N 3.01Å; H16-I20 VanDerWaalsContact O-CG1 3.31Å; H16-I20 WeakPolarHBondContact O-CG1 3.31Å; H16-I20 PolarHBondContact O-N 3.3Å
17	F	33.4	Very low	33.1	Very low	131 Å²	131	118.9 Å²	118.9	58%	0.575	57%	0.572	S	S	*	*	H	α-helix	trans	-66.6	-39.4	175.2	-91.2	-79.9	0	0	0	113	Y13 H14 E15 I20 N21	Y13-F17 WeakPolarHBondContact O-CD2 3.43Å; Y13-F17 PolarHBondContact O-N 2.87Å; Y13-F17 VanDerWaalsContact O-N 3.1Å; H14-F17 PolarHBondContact O-N 3.45Å; E15-F17 PolarHBondContact O-N 2.86Å; F17-I20 PolarHBondContact O-N 3.19Å; F17-N21 PolarHBondContact O-N 3.19Å
18	K	36.8	Very low	33.1	Very low	138 Å²	138	116.6 Å²	116.6	60%	0.6	56%	0.563	S	S	*	*	H	α-helix	trans	-57.3	-51.9	170.8	-94.5	-175.4	173.4	178.6	0	111.4	H14 E15 I20 N21 D22	H14-K18 PolarHBondContact O-N 3.1Å; H14-K18 VanDerWaalsContact O-N 3.08Å; E15-K18 PolarHBondContact O-N 3.42Å; K18-I20 VanDerWaalsContact C-N 3.27Å; K18-I20 PolarHBondContact O-N 3.48Å; K18-N21 PolarHBondContact O-N 3.21Å; K18-N21 VanDerWaalsContact O-N 3.11Å; K18-D22 PolarHBondContact O-N 2.99Å
19	R	33.7	Very low	33.2	Very low	148 Å²	148	115.7 Å²	115.7	56%	0.558	57%	0.568	S	S	*	*	H	α-helix	trans	-57.9	-35.8	179.9	-69.5	167.3	-175.7	-95.6	2	112.9	E15 H16 F23	E15-R19 VanDerWaalsContact O-CG 3.28Å; E15-R19 WeakPolarHBondContact O-CG 3.48Å; E15-R19 PolarHBondContact O-N 3.27Å; E15-R19 IonicContact OE1-NH2 2.71Å; E15-R19 IonicContact OE2-CZ 2.77Å; E15-R19 IonicContact OE2-NE 3.99Å; E15-R19 PolarHBondContact OE2-NE 3.35Å; E15-R19 IonicContact OE2-NH2 3.12Å; E15-R19 PolarHBondContact OE2-NH2 3.37Å; H16-R19 PolarHBondContact O-N 3.01Å; R19-F23 WeakPolarHBondContact O-CB 3.44Å; R19-F23 PolarHBondContact O-N 3.35Å
20	I	37	Very low	33.1	Very low	78 Å²	78	116.2 Å²	116.2	40%	0.4	57%	0.571	S	S	.	*	H	α-helix	trans	-71.3	-43.1	176	-69.2	164.8	0	0	0	111.5	H16 F17 K18 D22 F23 S24	H16-I20 VanDerWaalsContact O-CG1 3.31Å; H16-I20 WeakPolarHBondContact O-CG1 3.31Å; H16-I20 PolarHBondContact O-N 3.3Å; F17-I20 PolarHBondContact O-N 3.19Å; K18-I20 VanDerWaalsContact C-N 3.27Å; K18-I20 PolarHBondContact O-N 3.48Å; I20-D22 VanDerWaalsContact C-N 3.32Å; I20-D22 PolarHBondContact O-N 3.3Å; I20-F23 WeakPolarHBondContact O-CB 3.23Å; I20-F23 PolarHBondContact O-N 2.93Å; I20-S24 PolarHBondContact O-N 2.72Å
21	N	34.1	Very low	33.1	Very low	88 Å²	88	113 Å²	113	47%	0.471	55%	0.552	S	S	.	*	H	α-helix	trans	-66.8	-31.7	176	-77.2	-18.6	0	0	0	112.7	F17 K18 S24 R25	F17-N21 PolarHBondContact O-N 3.19Å; K18-N21 PolarHBondContact O-N 3.21Å; K18-N21 VanDerWaalsContact O-N 3.11Å; N21-S24 PolarHBondContact O-OG 3.45Å; N21-R25 WeakPolarHBondContact O-CD 3.42Å; N21-R25 VanDerWaalsContact O-CG 3.26Å; N21-R25 WeakPolarHBondContact O-CG 3.33Å; N21-R25 PolarHBondContact O-N 3.34Å
22	D	37.4	Very low	32.8	Very low	66 Å²	66	114.1 Å²	114.1	35%	0.353	55%	0.55	S	S	.	*	H	α-helix	trans	-74	-33.7	171.9	-64.7	-35.5	0	0	0	111.1	K18 I20 S24 R25 F26	K18-D22 PolarHBondContact O-N 2.99Å; I20-D22 VanDerWaalsContact C-N 3.32Å; I20-D22 PolarHBondContact O-N 3.3Å; D22-S24 VanDerWaalsContact C-N 3.35Å; D22-S24 PolarHBondContact O-N 3.1Å; D22-R25 WeakPolarHBondContact O-CB 3.41Å; D22-R25 PolarHBondContact O-N 3.31Å; D22-R25 VanDerWaalsContact O-N 3.11Å; D22-R25 IonicContact OD1-CZ 2.6Å; D22-R25 IonicContact OD1-NH1 2.67Å; D22-R25 PolarHBondContact OD1-NH1 3.33Å; D22-F26 VanDerWaalsContact O-CD2 3.28Å; D22-F26 WeakPolarHBondContact O-CD2 3.34Å; D22-F26 PolarHBondContact O-N 3.24Å; D22-F26 VanDerWaalsContact O-N 3.13Å
23	F	33.6	Very low	32.8	Very low	83 Å²	83	112.5 Å²	112.5	36%	0.364	55%	0.547	S	S	.	.	H	α-helix	trans	-59.7	-41.8	171.9	-135.1	-91.7	0	0	0	112.7	R19 I20 R25 F26 Y27 I57 L73	R19-F23 WeakPolarHBondContact O-CB 3.44Å; R19-F23 PolarHBondContact O-N 3.35Å; I20-F23 WeakPolarHBondContact O-CB 3.23Å; I20-F23 PolarHBondContact O-N 2.93Å; F23-R25 VanDerWaalsContact C-N 3.28Å; F23-R25 PolarHBondContact O-N 3.05Å; F23-F26 PolarHBondContact O-N 3.34Å; F23-Y27 HydrophobicContact CD1-CD2 4.23Å; F23-Y27 HydrophobicContact CD1-CE2 4.05Å; F23-Y27 HydrophobicContact CE1-CD2 4.22Å; F23-Y27 AromaticContact CE1-CE2 3.58Å; F23-Y27 HydrophobicContact CE1-CE2 3.58Å; F23-Y27 HydrophobicContact CZ-CE2 4.28Å; F23-I57 HydrophobicContact CE1-CD1 3.73Å; F23-I57 HydrophobicContact CZ-CD1 3.56Å; F23-L73 HydrophobicContact CE2-CD1 4.35Å
24	S	36.6	Very low	32.6	Very low	73 Å²	73	110.3 Å²	110.3	51%	0.51	55%	0.545	S	S	.	.	H	α-helix	trans	-70.8	-21.5	175.8	66.3	0	0	0	0	113.4	I20 N21 D22	I20-S24 PolarHBondContact O-N 2.72Å; N21-S24 PolarHBondContact O-OG 3.45Å; D22-S24 VanDerWaalsContact C-N 3.35Å; D22-S24 PolarHBondContact O-N 3.1Å
25	R	34.2	Very low	32.4	Very low	190 Å²	190	110.3 Å²	110.3	72%	0.717	54%	0.54	S	S	*	.	H	α-helix	trans	-78.7	-27.2	173.2	-71.9	162.8	168.3	178.2	-8.4	113.7	N21 D22 F23	N21-R25 WeakPolarHBondContact O-CD 3.42Å; N21-R25 VanDerWaalsContact O-CG 3.26Å; N21-R25 WeakPolarHBondContact O-CG 3.33Å; N21-R25 PolarHBondContact O-N 3.34Å; D22-R25 WeakPolarHBondContact O-CB 3.41Å; D22-R25 PolarHBondContact O-N 3.31Å; D22-R25 VanDerWaalsContact O-N 3.11Å; D22-R25 IonicContact OD1-CZ 2.6Å; D22-R25 IonicContact OD1-NH1 2.67Å; D22-R25 PolarHBondContact OD1-NH1 3.33Å; F23-R25 VanDerWaalsContact C-N 3.28Å; F23-R25 PolarHBondContact O-N 3.05Å
26	F	33.2	Very low	32.4	Very low	171 Å²	171	111.2 Å²	111.2	75%	0.75	56%	0.555	S	S	*	*	H	α-helix	trans	-78.8	-23.1	179.6	-87.7	-74.2	0	0	0	114.1	D22 F23 T28	D22-F26 VanDerWaalsContact O-CD2 3.28Å; D22-F26 WeakPolarHBondContact O-CD2 3.34Å; D22-F26 PolarHBondContact O-N 3.24Å; D22-F26 VanDerWaalsContact O-N 3.13Å; F23-F26 PolarHBondContact O-N 3.34Å; F26-T28 PolarHBondContact O-N 3.44Å
27	Y	26.6	Very low	32.1	Very low	100 Å²	100	113.5 Å²	113.5	39%	0.392	57%	0.566	S	S	.	*	S	Bend	trans	-95.4	88.6	-177.3	-82.9	-94.6	0	0	0	113.7	F23 I32	F23-Y27 HydrophobicContact CD1-CD2 4.23Å; F23-Y27 HydrophobicContact CD1-CE2 4.05Å; F23-Y27 HydrophobicContact CE1-CD2 4.22Å; F23-Y27 AromaticContact CE1-CE2 3.58Å; F23-Y27 HydrophobicContact CE1-CE2 3.58Å; F23-Y27 HydrophobicContact CZ-CE2 4.28Å; Y27-I32 HydrophobicContact CD1-CD1 4.34Å; Y27-I32 HydrophobicContact CG-CD1 4.27Å
28	T	28	Very low	32.1	Very low	81 Å²	81	113.7 Å²	113.7	50%	0.497	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	33.7	93.9	143.7	55.5	0	0	0	0	119.4	F26 L30	F26-T28 PolarHBondContact O-N 3.44Å; T28-L30 PolarHBondContact O-N 3.19Å
29	S	30.4	Very low	31.8	Very low	129 Å²	129	109.4 Å²	109.4	90%	0.902	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.9	-7.4	142.8	52	0	0	0	0	121.5
30	L	28.1	Very low	31.5	Very low	134 Å²	134	107.6 Å²	107.6	70%	0.702	57%	0.567	S	S	*	*	S	Bend	trans	-135.6	137.5	-179.3	-72	168.5	0	0	0	108.4	T28 I32	T28-L30 PolarHBondContact O-N 3.19Å; L30-I32 PolarHBondContact O-N 2.9Å
31	P	29.9	Very low	31.1	Very low	64 Å²	64	108 Å²	108	42%	0.416	57%	0.573	S	S	.	*			trans	-75.2	99.4	-177.2	28.9	-33.2	0	0	0	111.7	S33 V1055	P31-S33 PolarHBondContact O-N 2.98Å; P31-V1055 HydrophobicContact CB-CB 4.39Å; P31-V1055 HydrophobicContact CB-CG2 3.58Å; P31-V1055 HydrophobicContact CG-CG2 4.12Å
32	I	29.9	Very low	30.7	Very low	106 Å²	106	109 Å²	109	54%	0.544	58%	0.582	S	S	.	*			trans	-67.3	101.7	171.4	-56.7	179.2	0	0	0	108.8	Y27 L30 L34	Y27-I32 HydrophobicContact CD1-CD1 4.34Å; Y27-I32 HydrophobicContact CG-CD1 4.27Å; L30-I32 PolarHBondContact O-N 2.9Å; I32-L34 HydrophobicContact CG2-CD2 4.09Å; I32-L34 HydrophobicContact CG2-CG 4.2Å; I32-L34 PolarHBondContact O-N 3.18Å
33	S	31.2	Very low	30.4	Very low	60 Å²	60	112.8 Å²	112.8	42%	0.42	60%	0.6	S	S	.	*			trans	-78.9	85.5	-178.8	-63.7	0	0	0	0	110.8	P31 Y35	P31-S33 PolarHBondContact O-N 2.98Å; S33-Y35 VanDerWaalsContact C-N 3.25Å; S33-Y35 WeakPolarHBondContact O-CD2 3.21Å; S33-Y35 PolarHBondContact O-N 3.5Å
34	L	28.9	Very low	30.2	Very low	117 Å²	117	117.5 Å²	117.5	61%	0.613	62%	0.62	S	S	*	*			trans	-69.9	74.6	177.9	-69.4	175.1	0	0	0	112.1	I32 P36	I32-L34 HydrophobicContact CG2-CD2 4.09Å; I32-L34 HydrophobicContact CG2-CG 4.2Å; I32-L34 PolarHBondContact O-N 3.18Å; L34-P36 VanDerWaalsContact O-CD 3.28Å; L34-P36 WeakPolarHBondContact O-CD 3.18Å
35	Y	29.9	Very low	29.9	Very low	147 Å²	147	120.8 Å²	120.8	58%	0.576	63%	0.632	S	S	*	*			trans	-69.6	116	169.3	-76.9	-78.3	0	0	0	110.4	S33 E37 N38	S33-Y35 VanDerWaalsContact C-N 3.25Å; S33-Y35 WeakPolarHBondContact O-CD2 3.21Å; S33-Y35 PolarHBondContact O-N 3.5Å; Y35-E37 PolarHBondContact O-N 2.86Å; Y35-N38 PolarHBondContact O-N 3.2Å
36	P	32.6	Very low	29.6	Very low	116 Å²	116	117.9 Å²	117.9	75%	0.753	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-7.6	-174.8	-22.3	34.9	0	0	0	115.4	L34	L34-P36 VanDerWaalsContact O-CD 3.28Å; L34-P36 WeakPolarHBondContact O-CD 3.18Å
37	E	29.5	Very low	29.4	Very low	164 Å²	164	113.1 Å²	113.1	77%	0.766	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-15.1	-173.8	-56.8	-173.3	144.7	0	0	113.1	Y35	Y35-E37 PolarHBondContact O-N 2.86Å
38	N	33.3	Very low	29.7	Very low	135 Å²	135	118.5 Å²	118.5	72%	0.722	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	2.5	-171.8	-64.6	-43.5	0	0	0	114.6	Y35	Y35-N38 PolarHBondContact O-N 3.2Å
39	S	28.7	Very low	30	Very low	47 Å²	47	116.9 Å²	116.9	33%	0.329	63%	0.633	S	S	.	*			trans	-82.8	134.1	176.5	-178.2	0	0	0	0	111.3	V41	S39-V41 PolarHBondContact O-N 2.94Å; S39-V41 VanDerWaalsContact O-N 3.07Å; S39-V41 PolarHBondContact OG-N 2.83Å
40	P	27.4	Very low	30.4	Very low	110 Å²	110	119.4 Å²	119.4	71%	0.714	63%	0.627	S	S	*	*	S	Bend	trans	-60.5	-13.5	170.7	-24.5	34.9	0	0	0	114.3	V42	P40-V42 PolarHBondContact O-N 2.86Å
41	V	30	Very low	30.7	Very low	88 Å²	88	122 Å²	122	53%	0.533	63%	0.633	S	S	.	*			trans	-76.4	87.4	173.2	-172	0	0	0	0	109.4	S39 M43	S39-V41 PolarHBondContact O-N 2.94Å; S39-V41 VanDerWaalsContact O-N 3.07Å; S39-V41 PolarHBondContact OG-N 2.83Å; V41-M43 HydrophobicContact CG1-CB 4.24Å; V41-M43 HydrophobicContact CG1-CG 4.38Å; V41-M43 PolarHBondContact O-N 3.36Å
42	V	25.8	Very low	31	Very low	108 Å²	108	125.8 Å²	125.8	66%	0.655	64%	0.64	S	S	*	*			trans	-69.3	75.5	174.7	-174.7	0	0	0	0	110.4	P40 K44	P40-V42 PolarHBondContact O-N 2.86Å; V42-K44 PolarHBondContact O-N 3.28Å
43	M	30.5	Very low	31.2	Very low	146 Å²	146	126.6 Å²	126.6	72%	0.719	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	19.9	-175.9	-136.2	177.3	72.3	0	0	113.7	V41	V41-M43 HydrophobicContact CG1-CB 4.24Å; V41-M43 HydrophobicContact CG1-CG 4.38Å; V41-M43 PolarHBondContact O-N 3.36Å
44	K	28.9	Very low	31.2	Very low	182 Å²	182	128 Å²	128	79%	0.791	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-22.4	-179	-88.4	-179.7	174.2	171.2	0	114.9	V42	V42-K44 PolarHBondContact O-N 3.28Å
45	D	30	Very low	31.5	Very low	142 Å²	142	129 Å²	129	76%	0.759	66%	0.662	S	S	*	*	S	Bend	trans	-117.5	-13.3	-176.2	-75.5	-70.2	0	0	0	115.2	C47	D45-C47 PolarHBondContact O-N 3.09Å
46	M	28.9	Very low	31.6	Very low	129 Å²	129	127 Å²	127	64%	0.635	67%	0.665	S	S	*	*			trans	-102.7	73.6	-172.1	-67.7	-163.3	72.7	0	0	114.5
47	C	28.7	Very low	31.7	Very low	70 Å²	70	126 Å²	126	47%	0.473	65%	0.652	S	S	.	*			trans	-175.3	75.3	141.2	-113.5	0	0	0	0	114.3	D45 S49	D45-C47 PolarHBondContact O-N 3.09Å; C47-S49 PolarHBondContact O-N 2.87Å; C47-S49 PolarHBondContact SG-O 3.26Å
48	K	34	Very low	31.8	Very low	213 Å²	213	124.3 Å²	124.3	93%	0.926	65%	0.647	S	S	*	*	S	Bend	trans	-70.4	-8.4	164.8	-72.9	-174.7	179.1	177.5	0	113.9
49	S	33.4	Very low	31.7	Very low	48 Å²	48	119.8 Å²	119.8	34%	0.336	63%	0.628	S	S	.	*	S	Bend	trans	-158.8	164.3	167.9	82.2	0	0	0	0	111.8	C47 K51 Y52	C47-S49 PolarHBondContact O-N 2.87Å; C47-S49 PolarHBondContact SG-O 3.26Å; S49-K51 PolarHBondContact O-N 2.89Å; S49-K51 PolarHBondContact OG-N 3.32Å; S49-Y52 PolarHBondContact O-N 2.87Å; S49-Y52 WeakPolarHBondContact OG-CD2 3.44Å; S49-Y52 WeakPolarHBondContact OG-CE2 3.4Å
50	K	38.6	Very low	31.8	Very low	182 Å²	182	123.3 Å²	123.3	79%	0.791	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-59.6	-12.5	173.8	-72.7	-175.4	174.8	179.9	0	114.6	Y52	K50-Y52 VanDerWaalsContact C-N 3.29Å; K50-Y52 PolarHBondContact O-N 2.95Å
51	K	35.3	Very low	32.2	Very low	189 Å²	189	123.5 Å²	123.5	82%	0.822	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-72.6	-16.5	176.7	-70.7	-173.3	175	-178.7	0	114.2	S49	S49-K51 PolarHBondContact O-N 2.89Å; S49-K51 PolarHBondContact OG-N 3.32Å
52	Y	35	Very low	32.1	Very low	142 Å²	142	121.8 Å²	121.8	56%	0.557	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-104.5	6.5	-173.3	-59.9	-74.4	0	0	0	114.2	S49 K50	S49-Y52 PolarHBondContact O-N 2.87Å; S49-Y52 WeakPolarHBondContact OG-CD2 3.44Å; S49-Y52 WeakPolarHBondContact OG-CE2 3.4Å; K50-Y52 VanDerWaalsContact C-N 3.29Å; K50-Y52 PolarHBondContact O-N 2.95Å
53	M	34	Very low	32.3	Very low	124 Å²	124	124.8 Å²	124.8	61%	0.611	65%	0.646	S	S	*	*			trans	-71.2	124.7	178.5	-176.1	175.6	176.4	0	0	110.1	T55	M53-T55 PolarHBondContact O-N 3.03Å
54	P	32	Very low	32.5	Very low	90 Å²	90	123.2 Å²	123.2	58%	0.584	64%	0.644	S	S	*	*			trans	-66.5	125.9	-179.8	26.1	-33.4	0	0	0	110.9	T56	P54-T56 VanDerWaalsContact C-N 3.28Å
55	T	35.4	Very low	32.5	Very low	137 Å²	137	117.9 Å²	117.9	84%	0.84	63%	0.628	S	S	*	*	S	Bend	trans	-83.4	-3.7	178.9	46.6	0	0	0	0	113.8	M53	M53-T55 PolarHBondContact O-N 3.03Å
56	T	32.7	Very low	32.4	Very low	104 Å²	104	118.4 Å²	118.4	64%	0.638	63%	0.631	S	S	*	*			trans	-137.3	130.9	178.2	-53.5	0	0	0	0	108.2	P54 I58	P54-T56 VanDerWaalsContact C-N 3.28Å; T56-I58 HydrophobicContact CG2-CG1 4.37Å
57	I	33.2	Very low	32.4	Very low	97 Å²	97	115.4 Å²	115.4	50%	0.497	62%	0.623	S	S	.	*			trans	-112.7	129.6	169.5	-59	179.8	0	0	0	107.2	F23	F23-I57 HydrophobicContact CE1-CD1 3.73Å; F23-I57 HydrophobicContact CZ-CD1 3.56Å
58	I	31.6	Very low	32.2	Very low	127 Å²	127	118.1 Å²	118.1	65%	0.651	64%	0.64	S	S	*	*			trans	-105.8	131.6	173.5	-55	176.7	0	0	0	106.3	T56	T56-I58 HydrophobicContact CG2-CG1 4.37Å
59	A	32.7	Very low	31.9	Very low	40 Å²	40	112.9 Å²	112.9	33%	0.331	63%	0.625	S	S	.	*			trans	-71.6	151.3	176.9	0	0	0	0	0	110.6	D61 G62	A59-D61 WeakPolarHBondContact CB-OD1 3.28Å; A59-D61 PolarHBondContact O-N 3.04Å; A59-D61 VanDerWaalsContact O-N 3.1Å; A59-G62 PolarHBondContact O-N 2.97Å
60	P	30.7	Very low	31.4	Very low	121 Å²	121	120.8 Å²	120.8	79%	0.786	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-19.9	-173.9	-23.8	35	0	0	0	114.9
61	D	34.4	Very low	31	Very low	115 Å²	115	117 Å²	117	62%	0.615	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	0.7	177	56.7	5.6	0	0	0	113.4	A59 Y63	A59-D61 WeakPolarHBondContact CB-OD1 3.28Å; A59-D61 PolarHBondContact O-N 3.04Å; A59-D61 VanDerWaalsContact O-N 3.1Å; D61-Y63 PolarHBondContact O-N 2.95Å; D61-Y63 WeakPolarHBondContact OD1-CB 3.42Å; D61-Y63 PolarHBondContact OD1-N 3.5Å
62	G	28.7	Very low	30.6	Very low	51 Å²	51	116.6 Å²	116.6	53%	0.526	64%	0.638	S	S	.	*			trans	68.4	4	-173.4	0	0	0	0	0	114.5	A59 V64	A59-G62 PolarHBondContact O-N 2.97Å; G62-V64 PolarHBondContact O-N 3Å
63	Y	29	Very low	30.3	Very low	172 Å²	172	115.7 Å²	115.7	68%	0.675	64%	0.642	S	S	*	*			trans	-80.5	107.3	-172.1	-127.9	-95	0	0	0	110.4	D61 P65	D61-Y63 PolarHBondContact O-N 2.95Å; D61-Y63 WeakPolarHBondContact OD1-CB 3.42Å; D61-Y63 PolarHBondContact OD1-N 3.5Å; Y63-P65 WeakPolarHBondContact O-CD 3.3Å
64	V	35	Very low	29.9	Very low	112 Å²	112	115.6 Å²	115.6	68%	0.679	64%	0.643	S	S	*	*			trans	-87.8	111	166.6	-179.6	0	0	0	0	107.6	G62 N66	G62-V64 PolarHBondContact O-N 3Å; V64-N66 PolarHBondContact O-N 3.36Å
65	P	29.1	Very low	29.6	Very low	70 Å²	70	116.4 Å²	116.4	46%	0.455	65%	0.648	S	S	.	*			trans	-64.3	134.8	178.7	-19.9	33.5	0	0	0	110.1	Y63 S67	Y63-P65 WeakPolarHBondContact O-CD 3.3Å; P65-S67 PolarHBondContact O-N 2.92Å
66	N	29	Very low	29.3	Very low	153 Å²	153	117.4 Å²	117.4	82%	0.818	65%	0.647	S	S	*	*			trans	-73.3	50.2	175.7	-76.4	-53.6	0	0	0	112.3	V64	V64-N66 PolarHBondContact O-N 3.36Å
67	S	28.1	Very low	29	Very low	67 Å²	67	114.7 Å²	114.7	47%	0.469	64%	0.64	S	S	.	*			trans	-84.7	134.4	173.9	-179.8	0	0	0	0	110.2	P65 V69	P65-S67 PolarHBondContact O-N 2.92Å; S67-V69 PolarHBondContact O-N 2.98Å; S67-V69 WeakPolarHBondContact OG-CG2 3.23Å
68	P	24.8	Very low	28.8	Very low	127 Å²	127	120.6 Å²	120.6	83%	0.825	66%	0.662	S	S	*	*	S	Bend	trans	-63.1	-9.4	175.9	-24.7	35.3	0	0	0	115.3	R70	P68-R70 VanDerWaalsContact C-N 3.31Å; P68-R70 PolarHBondContact O-N 3Å
69	V	26.8	Very low	28.7	Very low	102 Å²	102	123 Å²	123	62%	0.618	67%	0.668	S	S	*	*			trans	-78.5	70.4	-168.7	-172.7	0	0	0	0	111.9	S67 V71	S67-V69 PolarHBondContact O-N 2.98Å; S67-V69 WeakPolarHBondContact OG-CG2 3.23Å; V69-V71 HydrophobicContact CG1-CB 4.48Å; V69-V71 HydrophobicContact CG1-CG2 3.63Å; V69-V71 PolarHBondContact O-N 2.92Å
70	R	24.5	Very low	28.5	Very low	214 Å²	214	130.7 Å²	130.7	81%	0.808	70%	0.696	S	S	*	*			trans	-74.4	62.8	168.2	-74.8	-166	178.4	-168.9	4	111.9	P68 K72	P68-R70 VanDerWaalsContact C-N 3.31Å; P68-R70 PolarHBondContact O-N 3Å; R70-K72 PolarHBondContact O-N 2.86Å; R70-K72 VanDerWaalsContact O-N 3.1Å
71	V	29.4	Very low	28.4	Very low	103 Å²	103	131 Å²	131	62%	0.624	69%	0.686	S	S	*	*			trans	-70.9	104.8	169.9	171.4	0	0	0	0	108.9	V69 L73	V69-V71 HydrophobicContact CG1-CB 4.48Å; V69-V71 HydrophobicContact CG1-CG2 3.63Å; V69-V71 PolarHBondContact O-N 2.92Å; V71-L73 HydrophobicContact CG1-CD2 4.24Å; V71-L73 PolarHBondContact O-N 2.97Å; V71-L73 VanDerWaalsContact O-N 3.15Å
72	K	27.8	Very low	28.5	Very low	181 Å²	181	128.5 Å²	128.5	79%	0.787	68%	0.677	S	S	*	*			trans	-64.4	110.4	161	-81	-175.9	173.9	-179.8	0	107.8	R70 I74	R70-K72 PolarHBondContact O-N 2.86Å; R70-K72 VanDerWaalsContact O-N 3.1Å; K72-I74 HydrophobicContact CB-CG1 4.26Å; K72-I74 PolarHBondContact O-N 3.12Å
73	L	26.8	Very low	29	Very low	123 Å²	123	132.2 Å²	132.2	64%	0.644	69%	0.685	S	S	*	*			trans	-69	82.8	166.6	-69.8	174.1	0	0	0	109.2	F23 V71 P75	F23-L73 HydrophobicContact CE2-CD1 4.35Å; V71-L73 HydrophobicContact CG1-CD2 4.24Å; V71-L73 PolarHBondContact O-N 2.97Å; V71-L73 VanDerWaalsContact O-N 3.15Å; L73-P75 WeakPolarHBondContact O-CD 3.27Å
74	I	26.3	Very low	29.4	Very low	122 Å²	122	129.7 Å²	129.7	63%	0.626	68%	0.68	S	S	*	*			trans	-69.3	125	171.7	-61.3	176.3	0	0	0	107.4	K72 L76	K72-I74 HydrophobicContact CB-CG1 4.26Å; K72-I74 PolarHBondContact O-N 3.12Å; I74-L76 PolarHBondContact O-N 3.05Å; I74-L76 VanDerWaalsContact O-N 3.08Å
75	P	26.8	Very low	29.7	Very low	106 Å²	106	128 Å²	128	69%	0.688	67%	0.666	S	S	*	*			trans	-64.5	114	173.4	-19.4	32.3	0	0	0	109.6	L73 G77	L73-P75 WeakPolarHBondContact O-CD 3.27Å; P75-G77 PolarHBondContact O-N 2.68Å
76	L	27.3	Very low	30.1	Very low	158 Å²	158	126.7 Å²	126.7	83%	0.827	66%	0.662	S	S	*	*			trans	-70.3	74.3	167.6	-69	173.3	0	0	0	109.4	I74	I74-L76 PolarHBondContact O-N 3.05Å; I74-L76 VanDerWaalsContact O-N 3.08Å
77	G	26.9	Very low	30.7	Very low	47 Å²	47	123.9 Å²	123.9	49%	0.485	65%	0.647	S	S	.	*			trans	-83.3	152.1	160.3	0	0	0	0	0	109.9	P75 K79	P75-G77 PolarHBondContact O-N 2.68Å; G77-K79 PolarHBondContact O-N 3.33Å
78	K	29.6	Very low	31.5	Very low	221 Å²	221	126 Å²	126	96%	0.961	65%	0.648	S	S	*	*	S	Bend	trans	-54.6	102.9	-177.1	-62.7	-174.5	177.9	-170.8	0	111.5
79	K	28.7	Very low	32.2	Very low	178 Å²	178	124.8 Å²	124.8	77%	0.774	63%	0.633	S	S	*	*			trans	-145.1	135.8	162.4	-91.5	-162.2	168.8	-166.5	0	107.7	G77 F81	G77-K79 PolarHBondContact O-N 3.33Å; K79-F81 HydrophobicContact CB-CE2 4.46Å; K79-F81 PolarHBondContact O-N 2.96Å
80	E	28.8	Very low	32.6	Very low	201 Å²	201	123.4 Å²	123.4	94%	0.939	62%	0.622	S	S	*	*			trans	-65.4	106.8	173.5	-64.6	126.1	-179.1	0	0	109.1
81	F	28.8	Very low	33.4	Very low	127 Å²	127	116.8 Å²	116.8	56%	0.557	61%	0.608	S	S	*	*			trans	-92.6	113.4	162.1	-82.8	-87.8	0	0	0	107	K79 N85	K79-F81 HydrophobicContact CB-CE2 4.46Å; K79-F81 PolarHBondContact O-N 2.96Å; F81-N85 HydrophobicContact CD1-CB 4.27Å
82	S	37.8	Very low	33.8	Very low	63 Å²	63	115.3 Å²	115.3	44%	0.441	60%	0.602	S	S	.	*			trans	-59.8	147.8	171.9	56.5	0	0	0	0	110.7	E84 N85 A86	S82-E84 PolarHBondContact O-N 2.81Å; S82-N85 PolarHBondContact O-N 2.86Å; S82-A86 PolarHBondContact O-N 3.44Å
83	D	37.7	Very low	34	Very low	129 Å²	129	110.5 Å²	110.5	69%	0.69	59%	0.585	S	S	*	*	H	α-helix	trans	-53.8	-30.3	178.6	-58.3	-59.9	0	0	0	111.9	N85 A86 N87	D83-N85 VanDerWaalsContact C-N 3.34Å; D83-N85 PolarHBondContact O-N 3.35Å; D83-A86 PolarHBondContact O-N 3.21Å; D83-N87 VanDerWaalsContact O-CB 3.25Å; D83-N87 WeakPolarHBondContact O-CB 3.49Å; D83-N87 PolarHBondContact O-N 2.97Å; D83-N87 PolarHBondContact O-ND2 3.45Å; D83-N87 VanDerWaalsContact O-ND2 3.15Å
84	E	38.7	Very low	34.5	Very low	120 Å²	120	108.4 Å²	108.4	56%	0.561	58%	0.577	S	S	*	*	H	α-helix	trans	-60.9	-36.6	176.2	-153.5	-164	166	0	0	113.6	S82 K88	S82-E84 PolarHBondContact O-N 2.81Å; E84-K88 VanDerWaalsContact CD-NZ 3.3Å; E84-K88 WeakPolarHBondContact O-CB 3.34Å; E84-K88 VanDerWaalsContact O-CG 3.31Å; E84-K88 WeakPolarHBondContact O-CG 3.36Å; E84-K88 PolarHBondContact O-N 3.23Å; E84-K88 IonicContact OE1-NZ 3.89Å; E84-K88 PolarHBondContact OE1-NZ 3.24Å; E84-K88 IonicContact OE2-NZ 3.96Å
85	N	40.3	Very low	35	Very low	75 Å²	75	107 Å²	107	40%	0.401	58%	0.577	S	S	.	*	H	α-helix	trans	-77.6	-36.7	175.5	-97.5	-22.3	0	0	0	111.9	F81 S82 D83 N87 K88 I89	F81-N85 HydrophobicContact CD1-CB 4.27Å; S82-N85 PolarHBondContact O-N 2.86Å; D83-N85 VanDerWaalsContact C-N 3.34Å; D83-N85 PolarHBondContact O-N 3.35Å; N85-N87 VanDerWaalsContact C-N 3.35Å; N85-K88 PolarHBondContact O-N 2.87Å; N85-I89 WeakPolarHBondContact O-CG1 3.5Å; N85-I89 PolarHBondContact O-N 3.27Å; N85-I89 VanDerWaalsContact O-N 3.09Å
86	A	36.9	Very low	35.5	Very low	43 Å²	43	106.5 Å²	106.5	36%	0.355	57%	0.573	S	S	.	*	H	α-helix	trans	-60.5	-46.9	171	0	0	0	0	0	110.6	S82 D83 K88 I89 L90	S82-A86 PolarHBondContact O-N 3.44Å; D83-A86 PolarHBondContact O-N 3.21Å; A86-K88 PolarHBondContact O-N 3.36Å; A86-I89 PolarHBondContact O-N 3.46Å; A86-L90 WeakPolarHBondContact O-CB 3.36Å; A86-L90 VanDerWaalsContact O-CG 3.32Å; A86-L90 WeakPolarHBondContact O-CG 3.49Å; A86-L90 PolarHBondContact O-N 3.29Å
87	N	41.4	Very low	35.7	Very low	94 Å²	94	102.9 Å²	102.9	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-64.1	-36.8	177.7	-73.7	-29.5	0	0	0	113.1	D83 N85 S91	D83-N87 VanDerWaalsContact O-CB 3.25Å; D83-N87 WeakPolarHBondContact O-CB 3.49Å; D83-N87 PolarHBondContact O-N 2.97Å; D83-N87 PolarHBondContact O-ND2 3.45Å; D83-N87 VanDerWaalsContact O-ND2 3.15Å; N85-N87 VanDerWaalsContact C-N 3.35Å; N87-S91 VanDerWaalsContact O-CB 3.27Å; N87-S91 WeakPolarHBondContact O-CB 3.33Å; N87-S91 PolarHBondContact O-N 3.25Å; N87-S91 PolarHBondContact O-OG 2.91Å
88	K	45.3	Very low	35.8	Very low	113 Å²	113	108.4 Å²	108.4	49%	0.491	57%	0.573	S	S	.	*	H	α-helix	trans	-65	-40.5	173	-79.3	166.3	-173.3	160	0	112.1	E84 N85 A86 S92	E84-K88 VanDerWaalsContact CD-NZ 3.3Å; E84-K88 WeakPolarHBondContact O-CB 3.34Å; E84-K88 VanDerWaalsContact O-CG 3.31Å; E84-K88 WeakPolarHBondContact O-CG 3.36Å; E84-K88 PolarHBondContact O-N 3.23Å; E84-K88 IonicContact OE1-NZ 3.89Å; E84-K88 PolarHBondContact OE1-NZ 3.24Å; E84-K88 IonicContact OE2-NZ 3.96Å; N85-K88 PolarHBondContact O-N 2.87Å; A86-K88 PolarHBondContact O-N 3.36Å; K88-S92 WeakPolarHBondContact O-CB 3.25Å; K88-S92 PolarHBondContact O-N 3.47Å; K88-S92 VanDerWaalsContact O-N 3.14Å
89	I	39	Very low	36	Very low	100 Å²	100	103 Å²	103	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-67.8	-47	176.4	-68.3	167.9	0	0	0	110.6	N85 A86 S91 S92 I93	N85-I89 WeakPolarHBondContact O-CG1 3.5Å; N85-I89 PolarHBondContact O-N 3.27Å; N85-I89 VanDerWaalsContact O-N 3.09Å; A86-I89 PolarHBondContact O-N 3.46Å; I89-S91 PolarHBondContact O-N 2.94Å; I89-S92 WeakPolarHBondContact O-CB 3.26Å; I89-S92 PolarHBondContact O-N 3.48Å; I89-I93 HydrophobicContact CG2-CD1 3.86Å; I89-I93 WeakPolarHBondContact O-CG1 3.5Å; I89-I93 PolarHBondContact O-N 2.95Å; I89-I93 VanDerWaalsContact O-N 3.08Å
90	L	35.5	Very low	36.3	Very low	74 Å²	74	100 Å²	100	39%	0.387	55%	0.546	S	S	.	.	H	α-helix	trans	-59.4	-45.1	175.7	-70.8	166.8	0	0	0	112	A86 S92 I93 V94 L106	A86-L90 WeakPolarHBondContact O-CB 3.36Å; A86-L90 VanDerWaalsContact O-CG 3.32Å; A86-L90 WeakPolarHBondContact O-CG 3.49Å; A86-L90 PolarHBondContact O-N 3.29Å; L90-S92 VanDerWaalsContact C-N 3.29Å; L90-S92 PolarHBondContact O-N 3.09Å; L90-I93 PolarHBondContact O-N 3.09Å; L90-I93 VanDerWaalsContact O-N 3.14Å; L90-V94 WeakPolarHBondContact O-CB 3.37Å; L90-V94 WeakPolarHBondContact O-CG2 3.5Å; L90-V94 PolarHBondContact O-N 3.38Å; L90-L106 HydrophobicContact CD2-CD2 4.24Å
91	S	41.1	Very low	36.4	Very low	74 Å²	74	97 Å²	97	52%	0.517	54%	0.536	S	S	.	.	H	α-helix	trans	-60.4	-36	176.4	-58.7	0	0	0	0	113	N87 I89 S95	N87-S91 VanDerWaalsContact O-CB 3.27Å; N87-S91 WeakPolarHBondContact O-CB 3.33Å; N87-S91 PolarHBondContact O-N 3.25Å; N87-S91 PolarHBondContact O-OG 2.91Å; I89-S91 PolarHBondContact O-N 2.94Å; S91-S95 WeakPolarHBondContact O-CB 3.46Å; S91-S95 PolarHBondContact O-N 3.47Å; S91-S95 PolarHBondContact O-OG 3.38Å
92	S	37.7	Very low	36.7	Very low	72 Å²	72	93.3 Å²	93.3	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-69.4	-36.4	176.1	-170.7	0	0	0	0	112.3	K88 I89 L90 S95 T96	K88-S92 WeakPolarHBondContact O-CB 3.25Å; K88-S92 PolarHBondContact O-N 3.47Å; K88-S92 VanDerWaalsContact O-N 3.14Å; I89-S92 WeakPolarHBondContact O-CB 3.26Å; I89-S92 PolarHBondContact O-N 3.48Å; L90-S92 VanDerWaalsContact C-N 3.29Å; L90-S92 PolarHBondContact O-N 3.09Å; S92-S95 PolarHBondContact O-OG 3.3Å; S92-T96 WeakPolarHBondContact O-CG2 3.42Å; S92-T96 PolarHBondContact O-OG1 3.32Å
93	I	32.6	Very low	36.4	Very low	81 Å²	81	93.7 Å²	93.7	42%	0.415	52%	0.523	S	S	.	.	H	α-helix	trans	-73.3	-38.7	176.5	-66.6	165.7	0	0	0	111.3	I89 L90 T96 N97	I89-I93 HydrophobicContact CG2-CD1 3.86Å; I89-I93 WeakPolarHBondContact O-CG1 3.5Å; I89-I93 PolarHBondContact O-N 2.95Å; I89-I93 VanDerWaalsContact O-N 3.08Å; L90-I93 PolarHBondContact O-N 3.09Å; L90-I93 VanDerWaalsContact O-N 3.14Å; I93-T96 PolarHBondContact O-OG1 3.13Å; I93-N97 PolarHBondContact O-ND2 3.09Å
94	V	37	Very low	36.3	Very low	78 Å²	78	92.2 Å²	92.2	47%	0.473	52%	0.515	S	S	.	.	H	α-helix	trans	-69.4	-42.9	178.2	168.7	0	0	0	0	111.8	L90 T96 L106	L90-V94 WeakPolarHBondContact O-CB 3.37Å; L90-V94 WeakPolarHBondContact O-CG2 3.5Å; L90-V94 PolarHBondContact O-N 3.38Å; V94-T96 PolarHBondContact O-N 3.11Å; V94-L106 HydrophobicContact CG2-CD1 4.14Å
95	S	37.5	Very low	36.1	Very low	92 Å²	92	91.3 Å²	91.3	64%	0.643	52%	0.518	S	S	*	.	H	α-helix	trans	-70	-16.6	-179.3	62.3	0	0	0	0	114.4	S91 S92	S91-S95 WeakPolarHBondContact O-CB 3.46Å; S91-S95 PolarHBondContact O-N 3.47Å; S91-S95 PolarHBondContact O-OG 3.38Å; S92-S95 PolarHBondContact O-OG 3.3Å
96	T	37.1	Very low	35.8	Very low	96 Å²	96	90.3 Å²	90.3	59%	0.589	51%	0.512	S	S	*	.	H	α-helix	trans	-98.4	-14.6	-177.7	46.4	0	0	0	0	114.6	S92 I93 V94	S92-T96 WeakPolarHBondContact O-CG2 3.42Å; S92-T96 PolarHBondContact O-OG1 3.32Å; I93-T96 PolarHBondContact O-OG1 3.13Å; V94-T96 PolarHBondContact O-N 3.11Å
97	N	32	Very low	35.9	Very low	83 Å²	83	93.2 Å²	93.2	44%	0.444	52%	0.522	S	S	.	.			trans	-137.6	83.2	-173.8	-60.7	-83.5	0	0	0	112.3	I93 D99	I93-N97 PolarHBondContact O-ND2 3.09Å; N97-D99 PolarHBondContact O-N 3.38Å
98	N	29.6	Very low	35.7	Very low	162 Å²	162	95.4 Å²	95.4	87%	0.866	53%	0.527	S	S	*	.			trans	-67.9	18.5	175.1	-92.3	-22.2	0	0	0	114.8	L100	N98-L100 PolarHBondContact O-N 2.89Å
99	D	33	Very low	35.2	Very low	107 Å²	107	93.9 Å²	93.9	57%	0.572	52%	0.524	S	S	*	.			trans	-80.1	118.9	178.8	-90	-45.8	0	0	0	111.8	N97 L101 T102	N97-D99 PolarHBondContact O-N 3.38Å; D99-L101 PolarHBondContact O-N 2.92Å; D99-T102 WeakPolarHBondContact O-CB 3.17Å; D99-T102 PolarHBondContact O-N 3.24Å; D99-T102 PolarHBondContact O-OG1 3.32Å
100	L	34.2	Very low	34.9	Very low	117 Å²	117	92.9 Å²	92.9	61%	0.613	52%	0.523	S	S	*	.	H	α-helix	trans	-54.1	-12.1	177.4	-79	138.3	0	0	0	115.3	N98	N98-L100 PolarHBondContact O-N 2.89Å
101	L	32.4	Very low	34.9	Very low	137 Å²	137	94 Å²	94	72%	0.717	53%	0.53	S	S	*	.	H	α-helix	trans	-74.9	-34.5	173.4	-72.5	166.8	0	0	0	112.3	D99	D99-L101 PolarHBondContact O-N 2.92Å
102	T	33.4	Very low	34.5	Very low	49 Å²	49	95.2 Å²	95.2	30%	0.301	53%	0.53	S	S	.	.	H	α-helix	trans	-67.6	-40.3	-179.7	-42.7	0	0	0	0	111.1	D99 N104 V105 L106	D99-T102 WeakPolarHBondContact O-CB 3.17Å; D99-T102 PolarHBondContact O-N 3.24Å; D99-T102 PolarHBondContact O-OG1 3.32Å; T102-N104 PolarHBondContact O-N 2.81Å; T102-V105 PolarHBondContact O-N 2.81Å; T102-L106 HydrophobicContact CG2-CD1 4.07Å; T102-L106 WeakPolarHBondContact O-CG 3.44Å; T102-L106 PolarHBondContact O-N 3.17Å
103	V	32.4	Very low	34.2	Very low	71 Å²	71	97.9 Å²	97.9	43%	0.43	54%	0.535	S	S	.	.	H	α-helix	trans	-62	-42.8	-179	-177.1	0	0	0	0	111.8	V105 L106 N107	V103-V105 VanDerWaalsContact C-N 3.25Å; V103-V105 PolarHBondContact O-N 2.78Å; V103-L106 PolarHBondContact O-N 3.02Å; V103-N107 WeakPolarHBondContact O-CB 3.39Å; V103-N107 PolarHBondContact O-N 3.31Å; V103-N107 PolarHBondContact O-OD1 2.9Å
104	N	35.4	Very low	34.2	Very low	98 Å²	98	97.7 Å²	97.7	52%	0.524	54%	0.542	S	S	.	.	H	α-helix	trans	-69.8	-18.4	179	-82.5	-14.2	0	0	0	114.2	T102	T102-N104 PolarHBondContact O-N 2.81Å
105	V	34.6	Very low	34	Very low	101 Å²	101	100.5 Å²	100.5	61%	0.612	55%	0.554	S	S	*	*	H	α-helix	trans	-85.4	-41.3	171.6	178.9	0	0	0	0	110.4	T102 V103 N107 K108	T102-V105 PolarHBondContact O-N 2.81Å; V103-V105 VanDerWaalsContact C-N 3.25Å; V103-V105 PolarHBondContact O-N 2.78Å; V105-N107 VanDerWaalsContact C-N 3.34Å; V105-N107 PolarHBondContact O-N 3.34Å; V105-K108 PolarHBondContact O-N 2.76Å
106	L	33	Very low	33.6	Very low	54 Å²	54	103 Å²	103	28%	0.283	56%	0.557	S	S	.	*	H	α-helix	trans	-61.5	-40.2	175	-72.3	166.9	0	0	0	112.2	L90 V94 T102 V103 K108 L109 P110	L90-L106 HydrophobicContact CD2-CD2 4.24Å; V94-L106 HydrophobicContact CG2-CD1 4.14Å; T102-L106 HydrophobicContact CG2-CD1 4.07Å; T102-L106 WeakPolarHBondContact O-CG 3.44Å; T102-L106 PolarHBondContact O-N 3.17Å; V103-L106 PolarHBondContact O-N 3.02Å; L106-K108 PolarHBondContact O-N 3.38Å; L106-K108 VanDerWaalsContact O-N 3.08Å; L106-L109 HydrophobicContact CD2-CD1 4.19Å; L106-L109 PolarHBondContact O-N 2.85Å; L106-L109 VanDerWaalsContact O-N 3.13Å; L106-P110 WeakPolarHBondContact O-CD 3.46Å
107	N	39.3	Very low	33.2	Very low	104 Å²	104	107.1 Å²	107.1	56%	0.556	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-11.1	178.4	-72	-3.8	0	0	0	114.5	V103 V105	V103-N107 WeakPolarHBondContact O-CB 3.39Å; V103-N107 PolarHBondContact O-N 3.31Å; V103-N107 PolarHBondContact O-OD1 2.9Å; V105-N107 VanDerWaalsContact C-N 3.34Å; V105-N107 PolarHBondContact O-N 3.34Å
108	K	38.4	Very low	33.1	Very low	141 Å²	141	108.9 Å²	108.9	61%	0.613	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-3.4	175.7	-71.3	-158.7	170	-154.2	0	114.5	V105 L106 I112	V105-K108 PolarHBondContact O-N 2.76Å; L106-K108 PolarHBondContact O-N 3.38Å; L106-K108 VanDerWaalsContact O-N 3.08Å; K108-I112 WeakPolarHBondContact O-CG1 3.39Å
109	L	33.2	Very low	33	Very low	81 Å²	81	110.4 Å²	110.4	42%	0.424	58%	0.583	S	S	.	*	H	α-helix	trans	-73	-33.6	176.2	-83.4	162.6	0	0	0	114.6	L106 D111 I112 M113	L106-L109 HydrophobicContact CD2-CD1 4.19Å; L106-L109 PolarHBondContact O-N 2.85Å; L106-L109 VanDerWaalsContact O-N 3.13Å; L109-D111 VanDerWaalsContact C-N 3.35Å; L109-D111 PolarHBondContact O-N 3.48Å; L109-I112 PolarHBondContact O-N 3.41Å; L109-M113 PolarHBondContact O-N 3.13Å; L109-M113 VanDerWaalsContact O-N 3.1Å
110	P	34.4	Very low	32.8	Very low	78 Å²	78	114.6 Å²	114.6	51%	0.506	60%	0.599	S	S	.	*	H	α-helix	trans	-58	-43.4	174.6	-27.1	36.3	0	0	0	113.1	L106 I112 M113 S114	L106-P110 WeakPolarHBondContact O-CD 3.46Å; P110-I112 VanDerWaalsContact C-N 3.29Å; P110-I112 PolarHBondContact O-N 3.04Å; P110-M113 PolarHBondContact O-N 3.3Å; P110-M113 VanDerWaalsContact O-N 3.1Å; P110-S114 PolarHBondContact O-N 3.16Å
111	D	34.3	Very low	32.8	Very low	97 Å²	97	117 Å²	117	52%	0.519	61%	0.61	S	S	.	*	H	α-helix	trans	-61.8	-37.8	-179.3	-54	-27.1	0	0	0	111.9	L109 S114 N115	L109-D111 VanDerWaalsContact C-N 3.35Å; L109-D111 PolarHBondContact O-N 3.48Å; D111-S114 PolarHBondContact O-N 2.96Å; D111-N115 PolarHBondContact O-N 3.05Å; D111-N115 PolarHBondContact O-ND2 2.89Å
112	I	32.3	Very low	32.6	Very low	101 Å²	101	118 Å²	118	52%	0.518	62%	0.616	S	S	.	*	H	α-helix	trans	-71.4	-33.8	177.5	-62.3	170	0	0	0	111	K108 L109 P110 M116	K108-I112 WeakPolarHBondContact O-CG1 3.39Å; L109-I112 PolarHBondContact O-N 3.41Å; P110-I112 VanDerWaalsContact C-N 3.29Å; P110-I112 PolarHBondContact O-N 3.04Å; I112-M116 WeakPolarHBondContact O-CE 3.48Å
113	M	31.5	Very low	32.5	Very low	127 Å²	127	122.7 Å²	122.7	63%	0.626	64%	0.64	S	S	*	*	H	α-helix	trans	-76.7	-27.9	175.3	-77.1	169.5	47.6	0	0	113.5	L109 P110	L109-M113 PolarHBondContact O-N 3.13Å; L109-M113 VanDerWaalsContact O-N 3.1Å; P110-M113 PolarHBondContact O-N 3.3Å; P110-M113 VanDerWaalsContact O-N 3.1Å
114	S	33.4	Very low	32.3	Very low	78 Å²	78	124.6 Å²	124.6	55%	0.545	66%	0.656	S	S	.	*	H	α-helix	trans	-69.9	-43.2	176.7	-153.5	0	0	0	0	111.3	P110 D111 M116 K117	P110-S114 PolarHBondContact O-N 3.16Å; D111-S114 PolarHBondContact O-N 2.96Å; S114-M116 PolarHBondContact O-N 3.39Å; S114-K117 PolarHBondContact O-N 2.98Å
115	N	32.6	Very low	32	Very low	137 Å²	137	123.2 Å²	123.2	73%	0.733	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	21.1	-176.9	-63.6	-15	0	0	0	114.6	D111	D111-N115 PolarHBondContact O-N 3.05Å; D111-N115 PolarHBondContact O-ND2 2.89Å
116	M	29.4	Very low	31.7	Very low	145 Å²	145	128.9 Å²	128.9	71%	0.714	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	22.6	174.3	-65.1	-168.8	-67.9	0	0	112.4	I112 S114	I112-M116 WeakPolarHBondContact O-CE 3.48Å; S114-M116 PolarHBondContact O-N 3.39Å
117	K	29.4	Very low	31.4	Very low	181 Å²	181	134.4 Å²	134.4	79%	0.787	70%	0.7	S	S	*	*	S	Bend	trans	-124	7.7	-175	-87.1	-169.7	170.9	-174.4	0	116.2	S114	S114-K117 PolarHBondContact O-N 2.98Å
118	T	28.6	Very low	30.8	Very low	120 Å²	120	134.7 Å²	134.7	74%	0.736	72%	0.717	S	S	*	*			trans	-142.2	69.3	-172.5	55	0	0	0	0	113.4
119	E	27.5	Very low	30.3	Very low	195 Å²	195	131.4 Å²	131.4	91%	0.911	72%	0.724	S	S	*	*	S	Bend	trans	-170.9	84.7	156.9	-113.9	169.9	-156.8	0	0	110.1
120	E	28.8	Very low	29.9	Very low	194 Å²	194	133.9 Å²	133.9	91%	0.907	74%	0.742	S	S	*	*			trans	169.1	83.3	152.9	-99.2	177.7	-173.8	0	0	108.6
121	I	34	Very low	29.6	Very low	167 Å²	167	138.2 Å²	138.2	86%	0.856	76%	0.759	S	S	*	*			trans	-129.3	106.8	155.7	-63.6	-179.7	0	0	0	105.3	D123	I121-D123 PolarHBondContact O-N 2.97Å
122	D	28.8	Very low	29.3	Very low	158 Å²	158	138.8 Å²	138.8	85%	0.845	77%	0.771	S	S	*	*			trans	-62.6	124.4	162.3	-71.3	-57.5	0	0	0	108.4
123	D	32.3	Very low	29	Very low	149 Å²	149	143 Å²	143	80%	0.797	79%	0.786	S	S	*	*				-162.4	163.4	113.2	-133.2	-46.8	0	0	0	113.5	I121	I121-D123 PolarHBondContact O-N 2.97Å
124	S	27.7	Very low	28.9	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	80%	0.801	S	S	*	*			trans	-57.8	151.8	-176.8	55.3	0	0	0	0	117.3
125	G	29.2	Very low	28.4	Very low	70 Å²	70	148.1 Å²	148.1	72%	0.722	81%	0.811	S	S	*	*			trans	155.5	89.6	152.2	0	0	0	0	0	120.3
126	R	27.5	Very low	28.1	Very low	220 Å²	220	147.3 Å²	147.3	83%	0.83	82%	0.815	S	S	*	*			trans	41.5	119.3	141.2	-81.2	-179.8	-84.1	-160.9	-9	122.7
127	E	26.8	Very low	28	Very low	169 Å²	169	151.4 Å²	151.4	79%	0.79	82%	0.823	S	S	*	*				63.4	135.3	119.5	-62.4	176.9	122.5	0	0	122.7
128	A	26.8	Very low	28.1	Very low	110 Å²	110	150.6 Å²	150.6	91%	0.909	83%	0.827	S	S	*	*			trans	66.1	150.1	160.9	0	0	0	0	0	117.6
129	G	27.2	Very low	27.9	Very low	73 Å²	73	152.5 Å²	152.5	75%	0.753	83%	0.83	S	S	*	*			cis	-172.1	171.8	-2	0	0	0	0	0	113.1
130	T	26.5	Very low	28.1	Very low	133 Å²	133	150 Å²	150	82%	0.816	82%	0.822	S	S	*	*			trans	-56.2	141.8	177.7	48.6	0	0	0	0	114.6
131	I	28	Very low	28.4	Very low	168 Å²	168	148.9 Å²	148.9	86%	0.862	81%	0.814	S	S	*	*			trans	154.7	141.3	153.5	-88.1	153.7	0	0	0	107.6
132	S	27.4	Very low	28.3	Very low	109 Å²	109	145.5 Å²	145.5	76%	0.762	80%	0.798	S	S	*	*			cis	-159.3	167.8	-23.8	-176.6	0	0	0	0	108.2
133	K	26.2	Very low	28.5	Very low	191 Å²	191	144.5 Å²	144.5	83%	0.83	79%	0.793	S	S	*	*			trans	-75.4	124.1	176.6	-70	179.6	177.2	178.9	0	111
134	Q	28.3	Very low	28.5	Very low	201 Å²	201	144.4 Å²	144.4	94%	0.939	79%	0.786	S	S	*	*			trans	-143.8	138.6	159.2	-129.6	169.7	1.4	0	0	111.3
135	S	24.3	Very low	28.7	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	78%	0.775	S	S	*	*			trans	-115.2	117.1	-173.8	-175.6	0	0	0	0	111.1
136	C	26.2	Very low	29.3	Very low	121 Å²	121	145.8 Å²	145.8	82%	0.818	77%	0.767	S	S	*	*			trans	-142.6	115.1	154.9	-79.3	0	0	0	0	105.3
137	R	26.4	Very low	29.6	Very low	230 Å²	230	141.2 Å²	141.2	87%	0.868	76%	0.755	S	S	*	*				42.1	80.8	72.2	-69	-168.2	179.8	-177.7	2.1	112.6
138	N	30.8	Very low	30.1	Very low	165 Å²	165	139 Å²	139	88%	0.882	75%	0.745	S	S	*	*			trans	-150.1	149	137.1	-101.8	-29.9	0	0	0	109.7
139	M	24.9	Very low	30.7	Very low	160 Å²	160	137 Å²	137	79%	0.788	72%	0.721	S	S	*	*			trans	-93.5	125.3	-176.9	-55.7	171.9	-66.9	0	0	109.8
140	N	33	Very low	31.1	Very low	142 Å²	142	137.2 Å²	137.2	76%	0.759	71%	0.708	S	S	*	*			trans	-96.7	147.7	152.1	-94.1	14.7	0	0	0	108.8	D142	N140-D142 WeakPolarHBondContact CB-OD2 3.35Å
141	K	33.8	Very low	31.8	Very low	170 Å²	170	135.1 Å²	135.1	74%	0.739	69%	0.691	S	S	*	*	S	Bend	trans	-98.7	9.4	-162.4	-67.3	177	179.2	172.7	0	113.5
142	D	32.6	Very low	32.5	Very low	97 Å²	97	133 Å²	133	52%	0.519	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-28.9	-159.9	-50.9	-61.6	0	0	0	112.8	N140 F144 I145	N140-D142 WeakPolarHBondContact CB-OD2 3.35Å; D142-F144 PolarHBondContact O-N 3.4Å; D142-I145 WeakPolarHBondContact O-CB 3.37Å; D142-I145 PolarHBondContact O-N 3.31Å; D142-I145 VanDerWaalsContact O-N 3.14Å
143	D	32.8	Very low	33	Very low	136 Å²	136	132.5 Å²	132.5	73%	0.727	67%	0.665	S	S	*	*	H	α-helix	trans	-61.4	-28.6	176.1	-70.3	-45.8	0	0	0	113.4	I145 N146	D143-I145 PolarHBondContact O-N 3.14Å; D143-N146 PolarHBondContact O-N 2.65Å
144	F	31.8	Very low	33.5	Very low	148 Å²	148	126.9 Å²	126.9	65%	0.649	65%	0.647	S	S	*	*	H	α-helix	trans	-70.3	-17.7	-179.5	-144.4	-93.2	0	0	0	112.9	D142	D142-F144 PolarHBondContact O-N 3.4Å
145	I	33.2	Very low	34.4	Very low	104 Å²	104	123.5 Å²	123.5	53%	0.533	63%	0.629	S	S	.	*	H	α-helix	trans	-73.3	-33.2	176.6	-60.5	177	0	0	0	110.5	D142 D143 E147 T149	D142-I145 WeakPolarHBondContact O-CB 3.37Å; D142-I145 PolarHBondContact O-N 3.31Å; D142-I145 VanDerWaalsContact O-N 3.14Å; D143-I145 PolarHBondContact O-N 3.14Å; I145-E147 PolarHBondContact O-N 2.92Å; I145-T149 VanDerWaalsContact O-CB 3.24Å; I145-T149 WeakPolarHBondContact O-CB 3.36Å; I145-T149 PolarHBondContact O-N 3.26Å; I145-T149 PolarHBondContact O-OG1 2.97Å
146	N	40.8	Very low	35.2	Very low	105 Å²	105	120.2 Å²	120.2	56%	0.561	61%	0.608	S	S	*	*	H	α-helix	trans	-64.4	-36.6	-179.7	-83.6	-39.1	0	0	0	112.8	D143 T150	D143-N146 PolarHBondContact O-N 2.65Å; N146-T150 VanDerWaalsContact O-CB 3.27Å; N146-T150 WeakPolarHBondContact O-CB 3.35Å; N146-T150 PolarHBondContact O-N 3.25Å; N146-T150 PolarHBondContact O-OG1 3.5Å
147	E	33.9	Very low	35.6	Very low	124 Å²	124	120.3 Å²	120.3	58%	0.579	60%	0.595	S	S	*	*	H	α-helix	trans	-72.8	-45.5	-179.7	-167.5	169.2	-144.8	0	0	112.1	I145 T149 T150 I151	I145-E147 PolarHBondContact O-N 2.92Å; E147-T149 VanDerWaalsContact C-N 3.35Å; E147-T149 PolarHBondContact O-N 2.98Å; E147-T150 PolarHBondContact O-N 3.44Å; E147-I151 HydrophobicContact CG-CD1 4.18Å; E147-I151 WeakPolarHBondContact O-CG1 3.49Å; E147-I151 PolarHBondContact O-N 3.35Å
148	Q	37.7	Very low	36.2	Very low	123 Å²	123	116.5 Å²	116.5	58%	0.575	59%	0.585	S	S	*	*	H	α-helix	trans	-63	-40.8	173.4	-74.6	-156.5	9.8	0	0	112.3	T150 I151 H152	Q148-T150 VanDerWaalsContact C-N 3.33Å; Q148-T150 PolarHBondContact O-N 3Å; Q148-I151 PolarHBondContact O-N 3.11Å; Q148-H152 WeakPolarHBondContact O-CB 3.47Å; Q148-H152 PolarHBondContact O-N 3.02Å
149	T	38.3	Very low	36.7	Very low	66 Å²	66	113.4 Å²	113.4	41%	0.405	57%	0.568	S	S	.	*	H	α-helix	trans	-63.5	-40.5	177.1	-55.6	0	0	0	0	110.8	I145 E147 H152 L153	I145-T149 VanDerWaalsContact O-CB 3.24Å; I145-T149 WeakPolarHBondContact O-CB 3.36Å; I145-T149 PolarHBondContact O-N 3.26Å; I145-T149 PolarHBondContact O-OG1 2.97Å; E147-T149 VanDerWaalsContact C-N 3.35Å; E147-T149 PolarHBondContact O-N 2.98Å; T149-H152 PolarHBondContact O-N 2.74Å; T149-L153 HydrophobicContact CG2-CD1 4.06Å; T149-L153 HydrophobicContact CG2-CG 4.47Å; T149-L153 WeakPolarHBondContact O-CB 3.41Å; T149-L153 VanDerWaalsContact O-CG 3.29Å; T149-L153 WeakPolarHBondContact O-CG 3.44Å; T149-L153 PolarHBondContact O-N 3.48Å
150	T	36.4	Very low	37.3	Very low	79 Å²	79	109.8 Å²	109.8	49%	0.485	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-42.7	174.2	-60.3	0	0	0	0	111.9	N146 E147 Q148 H152 L153 V154	N146-T150 VanDerWaalsContact O-CB 3.27Å; N146-T150 WeakPolarHBondContact O-CB 3.35Å; N146-T150 PolarHBondContact O-N 3.25Å; N146-T150 PolarHBondContact O-OG1 3.5Å; E147-T150 PolarHBondContact O-N 3.44Å; Q148-T150 VanDerWaalsContact C-N 3.33Å; Q148-T150 PolarHBondContact O-N 3Å; T150-H152 PolarHBondContact O-N 3.06Å; T150-L153 PolarHBondContact O-N 3.48Å; T150-V154 HydrophobicContact CG2-CG2 4.48Å; T150-V154 WeakPolarHBondContact O-CB 3.12Å; T150-V154 WeakPolarHBondContact O-CG2 3.5Å; T150-V154 PolarHBondContact O-N 3.14Å
151	I	40.6	Very low	37.6	Very low	88 Å²	88	107.8 Å²	107.8	45%	0.451	54%	0.538	S	S	.	.	H	α-helix	trans	-64.6	-39.8	176.2	-69.2	166.4	0	0	0	111.3	E147 Q148 K155	E147-I151 HydrophobicContact CG-CD1 4.18Å; E147-I151 WeakPolarHBondContact O-CG1 3.49Å; E147-I151 PolarHBondContact O-N 3.35Å; Q148-I151 PolarHBondContact O-N 3.11Å; I151-K155 WeakPolarHBondContact O-CB 3.43Å; I151-K155 PolarHBondContact O-N 3.47Å
152	H	43.4	Very low	37.8	Very low	124 Å²	124	102.1 Å²	102.1	57%	0.574	52%	0.52	S	S	*	.	H	α-helix	trans	-66.4	-42.9	173.9	-95.1	-98.3	0	0	0	112.3	Q148 T149 T150 K155 A156	Q148-H152 WeakPolarHBondContact O-CB 3.47Å; Q148-H152 PolarHBondContact O-N 3.02Å; T149-H152 PolarHBondContact O-N 2.74Å; T150-H152 PolarHBondContact O-N 3.06Å; H152-K155 PolarHBondContact O-N 3.3Å; H152-A156 VanDerWaalsContact O-CB 3.3Å; H152-A156 WeakPolarHBondContact O-CB 3.38Å; H152-A156 PolarHBondContact O-N 2.87Å
153	L	36.7	Very low	38	Very low	99 Å²	99	101 Å²	101	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-62.6	-41.5	174.7	-75.9	168.1	0	0	0	111.8	T149 T150 A156 F157	T149-L153 HydrophobicContact CG2-CD1 4.06Å; T149-L153 HydrophobicContact CG2-CG 4.47Å; T149-L153 WeakPolarHBondContact O-CB 3.41Å; T149-L153 VanDerWaalsContact O-CG 3.29Å; T149-L153 WeakPolarHBondContact O-CG 3.44Å; T149-L153 PolarHBondContact O-N 3.48Å; T150-L153 PolarHBondContact O-N 3.48Å; L153-A156 PolarHBondContact O-N 3.37Å; L153-F157 WeakPolarHBondContact O-CB 3.2Å; L153-F157 PolarHBondContact O-N 3.4Å
154	V	38.7	Very low	38.2	Very low	72 Å²	72	99.5 Å²	99.5	44%	0.436	50%	0.5	S	S	.	.	H	α-helix	trans	-67.9	-37.4	176.1	170.5	0	0	0	0	111.7	T150 K158	T150-V154 HydrophobicContact CG2-CG2 4.48Å; T150-V154 WeakPolarHBondContact O-CB 3.12Å; T150-V154 WeakPolarHBondContact O-CG2 3.5Å; T150-V154 PolarHBondContact O-N 3.14Å; V154-K158 HydrophobicContact CG1-CD 4.44Å; V154-K158 WeakPolarHBondContact O-CB 3.34Å; V154-K158 WeakPolarHBondContact O-CG 3.39Å; V154-K158 PolarHBondContact O-N 3Å
155	K	45.6	Very low	38.3	Very low	130 Å²	130	100.8 Å²	100.8	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-63.8	-46.3	170.2	-83.9	-178.1	174.8	176.8	0	111.6	I151 H152 F157 K158 L159	I151-K155 WeakPolarHBondContact O-CB 3.43Å; I151-K155 PolarHBondContact O-N 3.47Å; H152-K155 PolarHBondContact O-N 3.3Å; K155-F157 VanDerWaalsContact C-N 3.35Å; K155-F157 PolarHBondContact O-N 2.75Å; K155-K158 PolarHBondContact O-N 2.91Å; K155-K158 VanDerWaalsContact O-N 3.16Å; K155-L159 PolarHBondContact O-N 2.85Å
156	A	40.7	Very low	38.7	Very low	41 Å²	41	101.8 Å²	101.8	34%	0.339	50%	0.504	S	S	.	.	H	α-helix	trans	-64	-37	178.4	0	0	0	0	0	112.3	H152 L153 N160	H152-A156 VanDerWaalsContact O-CB 3.3Å; H152-A156 WeakPolarHBondContact O-CB 3.38Å; H152-A156 PolarHBondContact O-N 2.87Å; L153-A156 PolarHBondContact O-N 3.37Å; A156-N160 VanDerWaalsContact O-CB 3.31Å; A156-N160 WeakPolarHBondContact O-CB 3.16Å; A156-N160 PolarHBondContact O-N 2.72Å; A156-N160 PolarHBondContact O-ND2 3.32Å
157	F	36	Very low	38.6	Very low	124 Å²	124	100.8 Å²	100.8	54%	0.544	50%	0.501	S	S	.	.	H	α-helix	trans	-67.9	-36.1	172.2	-104.2	-85.1	0	0	0	112.6	L153 K155 Q161	L153-F157 WeakPolarHBondContact O-CB 3.2Å; L153-F157 PolarHBondContact O-N 3.4Å; K155-F157 VanDerWaalsContact C-N 3.35Å; K155-F157 PolarHBondContact O-N 2.75Å; F157-Q161 WeakPolarHBondContact O-CB 3.32Å; F157-Q161 WeakPolarHBondContact O-CG 3.34Å; F157-Q161 PolarHBondContact O-N 3.47Å
158	K	38.6	Very low	38.7	Very low	149 Å²	149	98.5 Å²	98.5	65%	0.648	50%	0.496	S	S	*	.	H	α-helix	trans	-69.3	-41.7	175.1	-77.3	178.3	178	-179.6	0	112	V154 K155 Q161 S162	V154-K158 HydrophobicContact CG1-CD 4.44Å; V154-K158 WeakPolarHBondContact O-CB 3.34Å; V154-K158 WeakPolarHBondContact O-CG 3.39Å; V154-K158 PolarHBondContact O-N 3Å; K155-K158 PolarHBondContact O-N 2.91Å; K155-K158 VanDerWaalsContact O-N 3.16Å; K158-Q161 PolarHBondContact O-N 3.24Å; K158-S162 PolarHBondContact O-N 3.48Å
159	L	42.1	Very low	38.8	Very low	100 Å²	100	95.5 Å²	95.5	52%	0.524	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-52.6	171.7	-84.3	156	0	0	0	111.5	K155 Q161 S162 D163	K155-L159 PolarHBondContact O-N 2.85Å; L159-Q161 PolarHBondContact O-N 3.34Å; L159-S162 WeakPolarHBondContact CA-OG 3.48Å; L159-S162 PolarHBondContact O-N 2.99Å; L159-S162 PolarHBondContact O-OG 3.17Å; L159-D163 WeakPolarHBondContact O-CB 3.38Å; L159-D163 PolarHBondContact O-N 2.99Å; L159-D163 VanDerWaalsContact O-OD1 3.08Å
160	N	36.4	Very low	39.2	Very low	84 Å²	84	97.4 Å²	97.4	45%	0.449	49%	0.493	S	S	.	.	H	α-helix	trans	-59.5	-25.1	175.4	-82.1	-81.7	0	0	0	113.1	A156 K164	A156-N160 VanDerWaalsContact O-CB 3.31Å; A156-N160 WeakPolarHBondContact O-CB 3.16Å; A156-N160 PolarHBondContact O-N 2.72Å; A156-N160 PolarHBondContact O-ND2 3.32Å; N160-K164 WeakPolarHBondContact O-CB 3.44Å; N160-K164 WeakPolarHBondContact O-CG 3.33Å; N160-K164 PolarHBondContact O-N 2.88Å; N160-K164 VanDerWaalsContact O-N 3.11Å
161	Q	38.5	Very low	39.3	Very low	101 Å²	101	101 Å²	101	47%	0.472	50%	0.499	S	S	.	.	H	α-helix	trans	-80.7	-34	170.7	-79.2	-171.3	50.7	0	0	114.1	F157 K158 L159 D163 R165	F157-Q161 WeakPolarHBondContact O-CB 3.32Å; F157-Q161 WeakPolarHBondContact O-CG 3.34Å; F157-Q161 PolarHBondContact O-N 3.47Å; K158-Q161 PolarHBondContact O-N 3.24Å; L159-Q161 PolarHBondContact O-N 3.34Å; Q161-D163 VanDerWaalsContact C-N 3.33Å; Q161-R165 WeakPolarHBondContact O-CB 3.38Å; Q161-R165 WeakPolarHBondContact O-CD 3.41Å; Q161-R165 WeakPolarHBondContact O-CG 3.47Å; Q161-R165 PolarHBondContact O-N 3.43Å; Q161-R165 VanDerWaalsContact O-N 3.08Å
162	S	39.2	Very low	39.2	Very low	51 Å²	51	102.7 Å²	102.7	36%	0.357	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-41.8	170.2	51.9	0	0	0	0	110.9	K158 L159 R165 Q166	K158-S162 PolarHBondContact O-N 3.48Å; L159-S162 WeakPolarHBondContact CA-OG 3.48Å; L159-S162 PolarHBondContact O-N 2.99Å; L159-S162 PolarHBondContact O-OG 3.17Å; S162-R165 CarbonylContact O-C 3.6Å; S162-R165 WeakPolarHBondContact O-CB 3.42Å; S162-R165 PolarHBondContact O-N 3.48Å; S162-R165 VanDerWaalsContact O-N 3.15Å; S162-Q166 PolarHBondContact O-N 3.24Å
163	D	36.8	Very low	39.2	Very low	74 Å²	74	102.5 Å²	102.5	40%	0.396	50%	0.502	S	S	.	.	H	α-helix	trans	-78.8	-36.3	-170.3	-54.8	-2	0	0	0	110.2	L159 Q161 R165 Q166 T167	L159-D163 WeakPolarHBondContact O-CB 3.38Å; L159-D163 PolarHBondContact O-N 2.99Å; L159-D163 VanDerWaalsContact O-OD1 3.08Å; Q161-D163 VanDerWaalsContact C-N 3.33Å; D163-R165 VanDerWaalsContact C-N 3.34Å; D163-Q166 PolarHBondContact O-N 3.05Å; D163-T167 WeakPolarHBondContact O-CB 3.48Å; D163-T167 PolarHBondContact O-N 3.31Å; D163-T167 PolarHBondContact O-OG1 2.88Å
164	K	35.9	Very low	40	Very low	103 Å²	103	105.7 Å²	105.7	45%	0.448	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-32.4	166.3	-73.8	-178.6	179.2	-168.4	0	112.6	N160 T167 T168	N160-K164 WeakPolarHBondContact O-CB 3.44Å; N160-K164 WeakPolarHBondContact O-CG 3.33Å; N160-K164 PolarHBondContact O-N 2.88Å; N160-K164 VanDerWaalsContact O-N 3.11Å; K164-T167 WeakPolarHBondContact CA-OG1 3.28Å; K164-T167 PolarHBondContact O-OG1 3.01Å; K164-T168 WeakPolarHBondContact O-CB 3.31Å; K164-T168 PolarHBondContact O-N 3.18Å; K164-T168 PolarHBondContact O-OG1 2.97Å
165	R	34.5	Very low	40.2	Very low	176 Å²	176	107.5 Å²	107.5	66%	0.664	51%	0.514	S	S	*	.	H	α-helix	trans	-70.4	-42.8	172.5	-77.2	173.2	-169.1	-155.7	6.6	111.8	Q161 S162 D163 S169	Q161-R165 WeakPolarHBondContact O-CB 3.38Å; Q161-R165 WeakPolarHBondContact O-CD 3.41Å; Q161-R165 WeakPolarHBondContact O-CG 3.47Å; Q161-R165 PolarHBondContact O-N 3.43Å; Q161-R165 VanDerWaalsContact O-N 3.08Å; S162-R165 CarbonylContact O-C 3.6Å; S162-R165 WeakPolarHBondContact O-CB 3.42Å; S162-R165 PolarHBondContact O-N 3.48Å; S162-R165 VanDerWaalsContact O-N 3.15Å; D163-R165 VanDerWaalsContact C-N 3.34Å; R165-S169 WeakPolarHBondContact O-CB 3.3Å; R165-S169 PolarHBondContact O-N 3.48Å
166	Q	42.1	Very low	39.9	Very low	125 Å²	125	107 Å²	107	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-64.2	-48.9	176.2	-79	-169.1	-15.6	0	0	111.9	S162 D163 T168 S169 Q170	S162-Q166 PolarHBondContact O-N 3.24Å; D163-Q166 PolarHBondContact O-N 3.05Å; Q166-T168 PolarHBondContact O-N 2.67Å; Q166-S169 PolarHBondContact O-N 2.93Å; Q166-Q170 WeakPolarHBondContact O-CB 3.45Å; Q166-Q170 WeakPolarHBondContact O-CG 3.25Å; Q166-Q170 PolarHBondContact O-N 3.22Å
167	T	38.6	Very low	40.1	Very low	84 Å²	84	109.9 Å²	109.9	52%	0.515	52%	0.521	S	S	.	.	H	α-helix	trans	-65.1	-38.1	177.9	47.2	0	0	0	0	112.5	D163 K164 Y171	D163-T167 WeakPolarHBondContact O-CB 3.48Å; D163-T167 PolarHBondContact O-N 3.31Å; D163-T167 PolarHBondContact O-OG1 2.88Å; K164-T167 WeakPolarHBondContact CA-OG1 3.28Å; K164-T167 PolarHBondContact O-OG1 3.01Å; T167-Y171 VanDerWaalsContact O-CB 3.31Å; T167-Y171 WeakPolarHBondContact O-CB 3.42Å; T167-Y171 PolarHBondContact O-N 2.98Å
168	T	36.5	Very low	40.1	Very low	75 Å²	75	105.5 Å²	105.5	46%	0.46	51%	0.511	S	S	.	.	H	α-helix	trans	-66.9	-41.2	173.9	-55.4	0	0	0	0	111.5	K164 Q166 Y171 F172	K164-T168 WeakPolarHBondContact O-CB 3.31Å; K164-T168 PolarHBondContact O-N 3.18Å; K164-T168 PolarHBondContact O-OG1 2.97Å; Q166-T168 PolarHBondContact O-N 2.67Å; T168-Y171 PolarHBondContact O-N 3.48Å; T168-F172 HydrophobicContact CG2-CD2 3.98Å; T168-F172 HydrophobicContact CG2-CE2 4.08Å; T168-F172 WeakPolarHBondContact O-CD2 3.5Å; T168-F172 PolarHBondContact O-N 3.18Å
169	S	39.3	Very low	40	Very low	61 Å²	61	102.2 Å²	102.2	43%	0.427	50%	0.501	S	S	.	.	H	α-helix	trans	-64.6	-46.4	175.8	-162.8	0	0	0	0	111	R165 Q166 Y171 F172 E173	R165-S169 WeakPolarHBondContact O-CB 3.3Å; R165-S169 PolarHBondContact O-N 3.48Å; Q166-S169 PolarHBondContact O-N 2.93Å; S169-Y171 VanDerWaalsContact C-N 3.28Å; S169-Y171 PolarHBondContact O-N 2.74Å; S169-F172 CarbonylContact O-C 3.51Å; S169-F172 PolarHBondContact O-N 3.12Å; S169-E173 WeakPolarHBondContact O-CB 3.43Å; S169-E173 WeakPolarHBondContact O-CG 3.21Å; S169-E173 PolarHBondContact O-N 3.05Å
170	Q	47.2	Very low	40	Very low	106 Å²	106	101.8 Å²	101.8	50%	0.495	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-31.4	174.8	-74.4	-179.8	0.9	0	0	112.7	Q166 K174	Q166-Q170 WeakPolarHBondContact O-CB 3.45Å; Q166-Q170 WeakPolarHBondContact O-CG 3.25Å; Q166-Q170 PolarHBondContact O-N 3.22Å; Q170-K174 VanDerWaalsContact O-CB 3.29Å; Q170-K174 WeakPolarHBondContact O-CB 3.34Å; Q170-K174 WeakPolarHBondContact O-CG 3.29Å; Q170-K174 PolarHBondContact O-N 3.01Å
171	Y	38.6	Very low	40.4	Very low	155 Å²	155	102.2 Å²	102.2	61%	0.608	50%	0.5	S	S	*	.	H	α-helix	trans	-69.3	-44.3	172.7	-176.6	-92	0	0	0	111.4	T167 T168 S169 K174 K175	T167-Y171 VanDerWaalsContact O-CB 3.31Å; T167-Y171 WeakPolarHBondContact O-CB 3.42Å; T167-Y171 PolarHBondContact O-N 2.98Å; T168-Y171 PolarHBondContact O-N 3.48Å; S169-Y171 VanDerWaalsContact C-N 3.28Å; S169-Y171 PolarHBondContact O-N 2.74Å; Y171-K174 PolarHBondContact O-N 3.5Å; Y171-K175 HydrophobicContact CE1-CD 4.42Å; Y171-K175 VanDerWaalsContact O-CB 3.26Å; Y171-K175 WeakPolarHBondContact O-CB 3.48Å; Y171-K175 PolarHBondContact O-N 2.78Å
172	F	37.6	Very low	40.6	Very low	122 Å²	122	101 Å²	101	54%	0.535	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-37.6	173.1	-89	-75.9	0	0	0	112.6	T168 S169 K175 M176	T168-F172 HydrophobicContact CG2-CD2 3.98Å; T168-F172 HydrophobicContact CG2-CE2 4.08Å; T168-F172 WeakPolarHBondContact O-CD2 3.5Å; T168-F172 PolarHBondContact O-N 3.18Å; S169-F172 CarbonylContact O-C 3.51Å; S169-F172 PolarHBondContact O-N 3.12Å; F172-K175 PolarHBondContact O-N 2.99Å; F172-M176 VanDerWaalsContact O-CB 3.28Å; F172-M176 WeakPolarHBondContact O-CB 3.37Å; F172-M176 WeakPolarHBondContact O-CG 3.43Å; F172-M176 PolarHBondContact O-N 3.48Å
173	E	44.8	Very low	40.9	Very low	121 Å²	121	102.5 Å²	102.5	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-65.5	-47	173.7	-74.5	173.8	152.5	0	0	111.3	S169 K175 M176 Q177	S169-E173 WeakPolarHBondContact O-CB 3.43Å; S169-E173 WeakPolarHBondContact O-CG 3.21Å; S169-E173 PolarHBondContact O-N 3.05Å; E173-K175 VanDerWaalsContact C-N 3.29Å; E173-K175 PolarHBondContact O-N 2.93Å; E173-M176 PolarHBondContact O-N 3.24Å; E173-Q177 WeakPolarHBondContact O-CB 3.41Å; E173-Q177 PolarHBondContact O-N 2.97Å
174	K	52.6	Low	41.3	Very low	165 Å²	165	100.6 Å²	100.6	72%	0.717	50%	0.501	S	S	*	.	H	α-helix	trans	-61.4	-36.7	173.5	-81.4	-177.8	174.2	178.7	0	112.5	Q170 Y171 G178	Q170-K174 VanDerWaalsContact O-CB 3.29Å; Q170-K174 WeakPolarHBondContact O-CB 3.34Å; Q170-K174 WeakPolarHBondContact O-CG 3.29Å; Q170-K174 PolarHBondContact O-N 3.01Å; Y171-K174 PolarHBondContact O-N 3.5Å; K174-G178 PolarHBondContact O-N 3.12Å
175	K	42.9	Very low	41.8	Very low	110 Å²	110	102 Å²	102	48%	0.478	51%	0.511	S	S	.	.	H	α-helix	trans	-71.5	-46	177.5	-169.6	170.4	-178.3	177.3	0	111.8	Y171 F172 E173 Q177 G178 D179	Y171-K175 HydrophobicContact CE1-CD 4.42Å; Y171-K175 VanDerWaalsContact O-CB 3.26Å; Y171-K175 WeakPolarHBondContact O-CB 3.48Å; Y171-K175 PolarHBondContact O-N 2.78Å; F172-K175 PolarHBondContact O-N 2.99Å; E173-K175 VanDerWaalsContact C-N 3.29Å; E173-K175 PolarHBondContact O-N 2.93Å; K175-Q177 VanDerWaalsContact C-N 3.33Å; K175-Q177 PolarHBondContact O-N 3.36Å; K175-G178 PolarHBondContact O-N 2.89Å; K175-D179 WeakPolarHBondContact O-CB 3.47Å; K175-D179 PolarHBondContact O-N 2.96Å
176	M	39.8	Very low	42.2	Very low	119 Å²	119	97.8 Å²	97.8	59%	0.586	50%	0.502	S	S	*	.	H	α-helix	trans	-59.1	-42.9	172.1	-73.9	-75.1	-171.7	0	0	111.4	F172 E173 D179 I180	F172-M176 VanDerWaalsContact O-CB 3.28Å; F172-M176 WeakPolarHBondContact O-CB 3.37Å; F172-M176 WeakPolarHBondContact O-CG 3.43Å; F172-M176 PolarHBondContact O-N 3.48Å; E173-M176 PolarHBondContact O-N 3.24Å; M176-D179 PolarHBondContact O-N 3.42Å; M176-I180 VanDerWaalsContact O-CB 3.3Å; M176-I180 WeakPolarHBondContact O-CB 3.4Å; M176-I180 WeakPolarHBondContact O-CD1 3.49Å; M176-I180 WeakPolarHBondContact O-CG1 3.22Å; M176-I180 PolarHBondContact O-N 3.44Å
177	Q	44.8	Very low	42.4	Very low	102 Å²	102	99.8 Å²	99.8	48%	0.477	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-41.6	177.2	-168.7	63.7	41.3	0	0	111.2	E173 K175 I180 D181	E173-Q177 WeakPolarHBondContact O-CB 3.41Å; E173-Q177 PolarHBondContact O-N 2.97Å; K175-Q177 VanDerWaalsContact C-N 3.33Å; K175-Q177 PolarHBondContact O-N 3.36Å; Q177-I180 PolarHBondContact O-N 3.46Å; Q177-D181 WeakPolarHBondContact O-CB 3.39Å; Q177-D181 PolarHBondContact O-N 3.18Å
178	G	34.7	Very low	43.1	Very low	32 Å²	32	102.3 Å²	102.3	33%	0.33	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-43.7	172.8	0	0	0	0	0	113	K174 K175 I180 D181 V182	K174-G178 PolarHBondContact O-N 3.12Å; K175-G178 PolarHBondContact O-N 2.89Å; G178-I180 VanDerWaalsContact C-N 3.3Å; G178-I180 PolarHBondContact O-N 3.46Å; G178-D181 PolarHBondContact O-N 3.13Å; G178-V182 WeakPolarHBondContact O-CB 3.43Å; G178-V182 VanDerWaalsContact O-CG2 3.3Å; G178-V182 WeakPolarHBondContact O-CG2 3.31Å; G178-V182 PolarHBondContact O-N 3.24Å
179	D	37.1	Very low	43.6	Very low	80 Å²	80	103.7 Å²	103.7	43%	0.428	51%	0.511	S	S	.	.	H	α-helix	trans	-66.4	-32.1	174.8	-71.2	-33.3	0	0	0	111.2	K175 M176 N183	K175-D179 WeakPolarHBondContact O-CB 3.47Å; K175-D179 PolarHBondContact O-N 2.96Å; M176-D179 PolarHBondContact O-N 3.42Å; D179-N183 VanDerWaalsContact O-CB 3.26Å; D179-N183 WeakPolarHBondContact O-CB 3.27Å; D179-N183 PolarHBondContact O-N 2.72Å; D179-N183 PolarHBondContact O-ND2 2.77Å
180	I	41.7	Very low	44	Very low	92 Å²	92	105.6 Å²	105.6	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-69.6	-44.2	172.3	-74.6	163.6	0	0	0	111.1	M176 Q177 G178 N183 G184	M176-I180 VanDerWaalsContact O-CB 3.3Å; M176-I180 WeakPolarHBondContact O-CB 3.4Å; M176-I180 WeakPolarHBondContact O-CD1 3.49Å; M176-I180 WeakPolarHBondContact O-CG1 3.22Å; M176-I180 PolarHBondContact O-N 3.44Å; Q177-I180 PolarHBondContact O-N 3.46Å; G178-I180 VanDerWaalsContact C-N 3.3Å; G178-I180 PolarHBondContact O-N 3.46Å; I180-N183 CarbonylContact O-C 3.6Å; I180-N183 PolarHBondContact O-N 2.89Å; I180-G184 PolarHBondContact O-N 3.39Å
181	D	45.1	Very low	44.1	Very low	92 Å²	92	102.4 Å²	102.4	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-70	-36.3	178.2	-78.8	-30.5	0	0	0	111.9	Q177 G178 G184 M185	Q177-D181 WeakPolarHBondContact O-CB 3.39Å; Q177-D181 PolarHBondContact O-N 3.18Å; G178-D181 PolarHBondContact O-N 3.13Å; D181-G184 CarbonylContact O-C 3.58Å; D181-G184 WeakPolarHBondContact O-CA 3.25Å; D181-G184 PolarHBondContact O-N 3.11Å; D181-G184 VanDerWaalsContact O-N 3.08Å; D181-M185 PolarHBondContact O-N 3.49Å
182	V	43.7	Very low	44.5	Very low	76 Å²	76	99.6 Å²	99.6	46%	0.461	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-42.9	170.2	169.1	0	0	0	0	110.6	G178 G184 N186	G178-V182 WeakPolarHBondContact O-CB 3.43Å; G178-V182 VanDerWaalsContact O-CG2 3.3Å; G178-V182 WeakPolarHBondContact O-CG2 3.31Å; G178-V182 PolarHBondContact O-N 3.24Å; V182-G184 PolarHBondContact O-N 2.92Å; V182-N186 VanDerWaalsContact O-CB 3.22Å; V182-N186 WeakPolarHBondContact O-CB 3.24Å; V182-N186 PolarHBondContact O-N 3.3Å; V182-N186 PolarHBondContact O-ND2 3.1Å
183	N	45.2	Very low	45	Very low	83 Å²	83	95.9 Å²	95.9	44%	0.444	49%	0.489	S	S	.	.	H	α-helix	trans	-71.9	-12.3	171.5	-76.6	-64.1	0	0	0	113.5	D179 I180 R187	D179-N183 VanDerWaalsContact O-CB 3.26Å; D179-N183 WeakPolarHBondContact O-CB 3.27Å; D179-N183 PolarHBondContact O-N 2.72Å; D179-N183 PolarHBondContact O-ND2 2.77Å; I180-N183 CarbonylContact O-C 3.6Å; I180-N183 PolarHBondContact O-N 2.89Å; N183-R187 WeakPolarHBondContact O-CB 3.31Å; N183-R187 WeakPolarHBondContact O-CG 3.28Å; N183-R187 PolarHBondContact O-N 3.38Å; N183-R187 PolarHBondContact O-NE 3.22Å
184	G	43.8	Very low	44.9	Very low	33 Å²	33	95.1 Å²	95.1	34%	0.34	49%	0.486	S	S	.	.	H	α-helix	trans	-81.3	-53.4	170.9	0	0	0	0	0	110.8	I180 D181 V182 R187 K188	I180-G184 PolarHBondContact O-N 3.39Å; D181-G184 CarbonylContact O-C 3.58Å; D181-G184 WeakPolarHBondContact O-CA 3.25Å; D181-G184 PolarHBondContact O-N 3.11Å; D181-G184 VanDerWaalsContact O-N 3.08Å; V182-G184 PolarHBondContact O-N 2.92Å; G184-R187 PolarHBondContact O-N 3.41Å; G184-K188 WeakPolarHBondContact O-CB 3.16Å; G184-K188 PolarHBondContact O-N 3.49Å
185	M	46.4	Very low	44.6	Very low	133 Å²	133	92.3 Å²	92.3	66%	0.655	48%	0.479	S	S	*	.	H	α-helix	trans	-58.5	-46.5	172.9	-71.5	-168.8	179.4	0	0	111.4	D181 R187 K188 I189	D181-M185 PolarHBondContact O-N 3.49Å; M185-R187 VanDerWaalsContact C-N 3.32Å; M185-R187 PolarHBondContact O-N 2.9Å; M185-K188 PolarHBondContact O-N 3.1Å; M185-K188 VanDerWaalsContact O-N 3.08Å; M185-I189 WeakPolarHBondContact O-CB 3.42Å; M185-I189 VanDerWaalsContact O-CG1 3.29Å; M185-I189 WeakPolarHBondContact O-CG1 3.24Å; M185-I189 PolarHBondContact O-N 3.2Å
186	N	44.4	Very low	44.6	Very low	87 Å²	87	93.6 Å²	93.6	47%	0.465	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-40.3	176.1	-74.9	-22.4	0	0	0	111.8	V182 L190	V182-N186 VanDerWaalsContact O-CB 3.22Å; V182-N186 WeakPolarHBondContact O-CB 3.24Å; V182-N186 PolarHBondContact O-N 3.3Å; V182-N186 PolarHBondContact O-ND2 3.1Å; N186-L190 VanDerWaalsContact O-CB 3.27Å; N186-L190 WeakPolarHBondContact O-CB 3.29Å; N186-L190 PolarHBondContact O-N 2.85Å
187	R	46.2	Very low	44.7	Very low	168 Å²	168	92.4 Å²	92.4	63%	0.634	48%	0.48	S	S	*	.	H	α-helix	trans	-70.2	-31	173.9	-85.4	-179.9	-76.5	-161.6	-4	113.2	N183 G184 M185 A191	N183-R187 WeakPolarHBondContact O-CB 3.31Å; N183-R187 WeakPolarHBondContact O-CG 3.28Å; N183-R187 PolarHBondContact O-N 3.38Å; N183-R187 PolarHBondContact O-NE 3.22Å; G184-R187 PolarHBondContact O-N 3.41Å; M185-R187 VanDerWaalsContact C-N 3.32Å; M185-R187 PolarHBondContact O-N 2.9Å; R187-A191 VanDerWaalsContact O-CB 3.29Å; R187-A191 WeakPolarHBondContact O-CB 3.31Å; R187-A191 PolarHBondContact O-N 2.78Å
188	K	52.6	Low	44.3	Very low	136 Å²	136	92.9 Å²	92.9	59%	0.591	48%	0.482	S	S	*	.	H	α-helix	trans	-72.4	-44.5	176.4	-153	-173.9	179.1	-163.4	0	111.5	G184 M185 L190 A191 E192	G184-K188 WeakPolarHBondContact O-CB 3.16Å; G184-K188 PolarHBondContact O-N 3.49Å; M185-K188 PolarHBondContact O-N 3.1Å; M185-K188 VanDerWaalsContact O-N 3.08Å; K188-L190 VanDerWaalsContact C-N 3.32Å; K188-L190 PolarHBondContact O-N 3.26Å; K188-A191 PolarHBondContact O-N 3.2Å; K188-E192 WeakPolarHBondContact CE-OE1 3.39Å; K188-E192 IonicContact NZ-OE1 2.72Å; K188-E192 WeakPolarHBondContact O-CB 3.12Å; K188-E192 VanDerWaalsContact O-CG 3.31Å; K188-E192 WeakPolarHBondContact O-CG 3.15Å; K188-E192 PolarHBondContact O-N 3.26Å
189	I	48	Very low	44.5	Very low	104 Å²	104	95.8 Å²	95.8	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-62.5	-39.9	171.7	-66.5	164.6	0	0	0	110.3	M185 E192 S193	M185-I189 WeakPolarHBondContact O-CB 3.42Å; M185-I189 VanDerWaalsContact O-CG1 3.29Å; M185-I189 WeakPolarHBondContact O-CG1 3.24Å; M185-I189 PolarHBondContact O-N 3.2Å; I189-E192 PolarHBondContact O-N 3.48Å; I189-S193 VanDerWaalsContact O-CB 3.3Å; I189-S193 WeakPolarHBondContact O-CB 3.41Å; I189-S193 PolarHBondContact O-N 2.96Å; I189-S193 PolarHBondContact O-OG 3.11Å
190	L	46.7	Very low	44.5	Very low	101 Å²	101	95.6 Å²	95.6	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-62.8	-49.5	174.1	-149.5	77.3	0	0	0	110.6	N186 K188 E192 S193 E194	N186-L190 VanDerWaalsContact O-CB 3.27Å; N186-L190 WeakPolarHBondContact O-CB 3.29Å; N186-L190 PolarHBondContact O-N 2.85Å; K188-L190 VanDerWaalsContact C-N 3.32Å; K188-L190 PolarHBondContact O-N 3.26Å; L190-E192 PolarHBondContact O-N 3.39Å; L190-S193 CarbonylContact O-C 3.39Å; L190-S193 PolarHBondContact O-N 3.24Å; L190-S193 VanDerWaalsContact O-N 3.15Å; L190-S193 PolarHBondContact O-OG 3.42Å; L190-E194 WeakPolarHBondContact O-CB 3.4Å; L190-E194 WeakPolarHBondContact O-CG 3.27Å; L190-E194 PolarHBondContact O-N 3.27Å
191	A	48.5	Very low	44.3	Very low	40 Å²	40	96 Å²	96	33%	0.331	49%	0.491	S	S	.	.	H	α-helix	trans	-64.2	-34.5	178.2	0	0	0	0	0	113.5	R187 K188 E194 N195	R187-A191 VanDerWaalsContact O-CB 3.29Å; R187-A191 WeakPolarHBondContact O-CB 3.31Å; R187-A191 PolarHBondContact O-N 2.78Å; K188-A191 PolarHBondContact O-N 3.2Å; A191-E194 PolarHBondContact O-N 3.48Å; A191-N195 WeakPolarHBondContact O-CB 3.35Å; A191-N195 PolarHBondContact O-N 2.77Å; A191-N195 PolarHBondContact O-ND2 2.92Å
192	E	48.9	Very low	44.1	Very low	96 Å²	96	95.6 Å²	95.6	45%	0.449	49%	0.491	S	S	.	.	H	α-helix	trans	-70.2	-38.4	173.4	-73.9	166.9	-165.7	0	0	110.6	K188 I189 L190 N195 Q196	K188-E192 WeakPolarHBondContact CE-OE1 3.39Å; K188-E192 IonicContact NZ-OE1 2.72Å; K188-E192 WeakPolarHBondContact O-CB 3.12Å; K188-E192 VanDerWaalsContact O-CG 3.31Å; K188-E192 WeakPolarHBondContact O-CG 3.15Å; K188-E192 PolarHBondContact O-N 3.26Å; I189-E192 PolarHBondContact O-N 3.48Å; L190-E192 PolarHBondContact O-N 3.39Å; E192-N195 PolarHBondContact O-N 3.45Å; E192-Q196 WeakPolarHBondContact O-CG 3.32Å; E192-Q196 PolarHBondContact O-N 2.71Å
193	S	46.8	Very low	44	Very low	43 Å²	43	99 Å²	99	30%	0.301	50%	0.502	S	S	.	.	H	α-helix	trans	-69.5	-30.8	171.7	82.4	0	0	0	0	113.3	I189 L190 Q197	I189-S193 VanDerWaalsContact O-CB 3.3Å; I189-S193 WeakPolarHBondContact O-CB 3.41Å; I189-S193 PolarHBondContact O-N 2.96Å; I189-S193 PolarHBondContact O-OG 3.11Å; L190-S193 CarbonylContact O-C 3.39Å; L190-S193 PolarHBondContact O-N 3.24Å; L190-S193 VanDerWaalsContact O-N 3.15Å; L190-S193 PolarHBondContact O-OG 3.42Å; S193-Q197 WeakPolarHBondContact O-CB 3.48Å; S193-Q197 WeakPolarHBondContact O-CG 3.23Å; S193-Q197 PolarHBondContact O-N 3.37Å
194	E	42.6	Very low	43.8	Very low	106 Å²	106	99.6 Å²	99.6	50%	0.495	51%	0.505	S	S	.	.	H	α-helix	trans	-73.8	-39.3	174.7	-76.4	-173.7	134.2	0	0	110.7	L190 A191 Q197 E198	L190-E194 WeakPolarHBondContact O-CB 3.4Å; L190-E194 WeakPolarHBondContact O-CG 3.27Å; L190-E194 PolarHBondContact O-N 3.27Å; A191-E194 PolarHBondContact O-N 3.48Å; E194-Q197 CarbonylContact O-C 3.55Å; E194-Q197 PolarHBondContact O-N 2.81Å; E194-E198 WeakPolarHBondContact O-CB 3Å; E194-E198 PolarHBondContact O-N 3.47Å
195	N	47.5	Very low	43.9	Very low	105 Å²	105	102.1 Å²	102.1	56%	0.561	51%	0.511	S	S	*	.	H	α-helix	trans	-63.3	-39.2	170.5	-81.3	-67.8	0	0	0	112.4	A191 E192 E198 T199	A191-N195 WeakPolarHBondContact O-CB 3.35Å; A191-N195 PolarHBondContact O-N 2.77Å; A191-N195 PolarHBondContact O-ND2 2.92Å; E192-N195 PolarHBondContact O-N 3.45Å; N195-E198 WeakPolarHBondContact O-CB 3.37Å; N195-E198 PolarHBondContact O-N 3.26Å; N195-E198 VanDerWaalsContact O-N 3.15Å; N195-T199 PolarHBondContact O-N 3.28Å; N195-T199 PolarHBondContact O-OG1 3.39Å
196	Q	43	Very low	44.2	Very low	138 Å²	138	100.7 Å²	100.7	65%	0.645	51%	0.506	S	S	*	.	H	α-helix	trans	-70.3	-30.9	173	-71.5	-179.1	5.6	0	0	112.9	E192 E198 T199 T200	E192-Q196 WeakPolarHBondContact O-CG 3.32Å; E192-Q196 PolarHBondContact O-N 2.71Å; Q196-E198 VanDerWaalsContact C-N 3.35Å; Q196-T199 PolarHBondContact O-OG1 3.18Å; Q196-T200 PolarHBondContact O-N 2.91Å; Q196-T200 PolarHBondContact O-OG1 2.96Å
197	Q	40.6	Very low	44.3	Very low	94 Å²	94	101.2 Å²	101.2	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-70.6	-29.5	166.2	-79.2	-170.8	41.6	0	0	112.3	S193 E194 T200 R201	S193-Q197 WeakPolarHBondContact O-CB 3.48Å; S193-Q197 WeakPolarHBondContact O-CG 3.23Å; S193-Q197 PolarHBondContact O-N 3.37Å; E194-Q197 CarbonylContact O-C 3.55Å; E194-Q197 PolarHBondContact O-N 2.81Å; Q197-T200 WeakPolarHBondContact CA-OG1 3.3Å; Q197-T200 PolarHBondContact O-OG1 2.65Å; Q197-R201 WeakPolarHBondContact O-CB 3.29Å; Q197-R201 WeakPolarHBondContact O-CD 3.29Å; Q197-R201 WeakPolarHBondContact O-CG 3.37Å; Q197-R201 PolarHBondContact O-N 3.3Å
198	E	35.8	Very low	44.6	Very low	111 Å²	111	96.7 Å²	96.7	52%	0.519	50%	0.496	S	S	.	.	H	α-helix	trans	-71.7	-43.1	179	-155.9	99.3	-89.1	0	0	110.7	E194 N195 Q196 R201 V202	E194-E198 WeakPolarHBondContact O-CB 3Å; E194-E198 PolarHBondContact O-N 3.47Å; N195-E198 WeakPolarHBondContact O-CB 3.37Å; N195-E198 PolarHBondContact O-N 3.26Å; N195-E198 VanDerWaalsContact O-N 3.15Å; Q196-E198 VanDerWaalsContact C-N 3.35Å; E198-R201 CarbonylContact O-C 3.22Å; E198-R201 PolarHBondContact O-N 3.18Å; E198-R201 IonicContact OE1-NH1 2.69Å; E198-V202 WeakPolarHBondContact O-CG2 3.41Å; E198-V202 PolarHBondContact O-N 2.98Å
199	T	39.1	Very low	44.7	Very low	93 Å²	93	93.3 Å²	93.3	57%	0.571	48%	0.484	S	S	*	.	H	α-helix	trans	-65.2	-46.7	174.9	52.3	0	0	0	0	112.1	N195 Q196 R201 V202 E203	N195-T199 PolarHBondContact O-N 3.28Å; N195-T199 PolarHBondContact O-OG1 3.39Å; Q196-T199 PolarHBondContact O-OG1 3.18Å; T199-R201 VanDerWaalsContact C-N 3.33Å; T199-R201 PolarHBondContact O-N 2.73Å; T199-V202 WeakPolarHBondContact O-CB 3.34Å; T199-V202 PolarHBondContact O-N 3.29Å; T199-E203 PolarHBondContact O-N 2.98Å
200	T	39.1	Very low	44.9	Very low	76 Å²	76	95.1 Å²	95.1	47%	0.466	49%	0.486	S	S	.	.	H	α-helix	trans	-65.2	-34.3	174.2	48.2	0	0	0	0	112.4	Q196 Q197 V202 E203 D204	Q196-T200 PolarHBondContact O-N 2.91Å; Q196-T200 PolarHBondContact O-OG1 2.96Å; Q197-T200 WeakPolarHBondContact CA-OG1 3.3Å; Q197-T200 PolarHBondContact O-OG1 2.65Å; T200-V202 VanDerWaalsContact C-N 3.31Å; T200-V202 PolarHBondContact O-N 3.31Å; T200-E203 PolarHBondContact O-N 3.33Å; T200-D204 WeakPolarHBondContact O-CB 3.46Å; T200-D204 PolarHBondContact O-N 3.23Å
201	R	37.5	Very low	45.1	Very low	101 Å²	101	94.7 Å²	94.7	38%	0.381	48%	0.483	S	S	.	.	H	α-helix	trans	-64.2	-29.7	169.4	-77.6	164.3	-165.5	175.6	7.5	112.8	Q197 E198 T199 N205	Q197-R201 WeakPolarHBondContact O-CB 3.29Å; Q197-R201 WeakPolarHBondContact O-CD 3.29Å; Q197-R201 WeakPolarHBondContact O-CG 3.37Å; Q197-R201 PolarHBondContact O-N 3.3Å; E198-R201 CarbonylContact O-C 3.22Å; E198-R201 PolarHBondContact O-N 3.18Å; E198-R201 IonicContact OE1-NH1 2.69Å; T199-R201 VanDerWaalsContact C-N 3.33Å; T199-R201 PolarHBondContact O-N 2.73Å; R201-N205 WeakPolarHBondContact O-CA 3.28Å; R201-N205 WeakPolarHBondContact O-CB 3.38Å; R201-N205 PolarHBondContact O-N 3.02Å; R201-N205 PolarHBondContact O-ND2 3.38Å
202	V	39.2	Very low	45.3	Very low	83 Å²	83	97.9 Å²	97.9	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-68	-38.4	175.4	166	0	0	0	0	110.9	E198 T199 T200 N206	E198-V202 WeakPolarHBondContact O-CG2 3.41Å; E198-V202 PolarHBondContact O-N 2.98Å; T199-V202 WeakPolarHBondContact O-CB 3.34Å; T199-V202 PolarHBondContact O-N 3.29Å; T200-V202 VanDerWaalsContact C-N 3.31Å; T200-V202 PolarHBondContact O-N 3.31Å; V202-N206 PolarHBondContact O-N 3.34Å; V202-N206 VanDerWaalsContact O-N 3.15Å; V202-N206 PolarHBondContact O-ND2 2.91Å; V202-N206 VanDerWaalsContact O-ND2 3.12Å
203	E	41.3	Very low	45.7	Very low	148 Å²	148	99.9 Å²	99.9	69%	0.692	49%	0.493	S	S	*	.	H	α-helix	trans	-70.8	-47.5	174	-62.1	-170.2	145.6	0	0	111.8	T199 T200 N205 N206 L207	T199-E203 PolarHBondContact O-N 2.98Å; T200-E203 PolarHBondContact O-N 3.33Å; E203-N205 VanDerWaalsContact C-N 3.33Å; E203-N205 PolarHBondContact O-N 3.08Å; E203-N206 WeakPolarHBondContact O-CB 3.37Å; E203-N206 PolarHBondContact O-N 3.07Å; E203-L207 PolarHBondContact O-N 3.28Å
204	D	42.6	Very low	46.1	Very low	96 Å²	96	100.9 Å²	100.9	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-60.9	-38.4	174.8	-101.7	-16.1	0	0	0	112.1	T200 L207 I208	T200-D204 WeakPolarHBondContact O-CB 3.46Å; T200-D204 PolarHBondContact O-N 3.23Å; D204-L207 PolarHBondContact O-N 2.72Å; D204-I208 VanDerWaalsContact O-CB 3.26Å; D204-I208 WeakPolarHBondContact O-CB 3.39Å; D204-I208 WeakPolarHBondContact O-CD1 3.38Å; D204-I208 WeakPolarHBondContact O-CG1 3.5Å; D204-I208 PolarHBondContact O-N 3.33Å
205	N	44.8	Very low	46.6	Very low	86 Å²	86	100.7 Å²	100.7	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-66.9	-37.3	176.7	-78.5	-39.1	0	0	0	111.6	R201 E203 I208 D209	R201-N205 WeakPolarHBondContact O-CA 3.28Å; R201-N205 WeakPolarHBondContact O-CB 3.38Å; R201-N205 PolarHBondContact O-N 3.02Å; R201-N205 PolarHBondContact O-ND2 3.38Å; E203-N205 VanDerWaalsContact C-N 3.33Å; E203-N205 PolarHBondContact O-N 3.08Å; N205-I208 PolarHBondContact O-N 2.96Å; N205-D209 WeakPolarHBondContact O-CB 3.23Å; N205-D209 PolarHBondContact O-N 2.84Å
206	N	52.2	Low	46.7	Very low	102 Å²	102	101.2 Å²	101.2	55%	0.545	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-42.9	172.1	-85.3	-47.9	0	0	0	111.4	V202 E203 D209 Y210	V202-N206 PolarHBondContact O-N 3.34Å; V202-N206 VanDerWaalsContact O-N 3.15Å; V202-N206 PolarHBondContact O-ND2 2.91Å; V202-N206 VanDerWaalsContact O-ND2 3.12Å; E203-N206 WeakPolarHBondContact O-CB 3.37Å; E203-N206 PolarHBondContact O-N 3.07Å; N206-D209 PolarHBondContact O-N 3.29Å; N206-Y210 WeakPolarHBondContact O-CB 3.47Å; N206-Y210 PolarHBondContact O-N 2.64Å
207	L	47.8	Very low	47.2	Very low	98 Å²	98	101.7 Å²	101.7	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-65.9	-42.9	176	-166.3	70.2	0	0	0	111.8	E203 D204 Y210 L211	E203-L207 PolarHBondContact O-N 3.28Å; D204-L207 PolarHBondContact O-N 2.72Å; L207-Y210 PolarHBondContact O-N 3.47Å; L207-L211 HydrophobicContact CG-CD1 4.21Å; L207-L211 WeakPolarHBondContact O-CB 3.45Å; L207-L211 VanDerWaalsContact O-CG 3.27Å; L207-L211 WeakPolarHBondContact O-CG 3.35Å; L207-L211 PolarHBondContact O-N 3.08Å
208	I	51.3	Low	47.5	Very low	73 Å²	73	99.8 Å²	99.8	37%	0.374	50%	0.497	S	S	.	.	H	α-helix	trans	-62.8	-40.9	175.8	-74.3	165.1	0	0	0	111	D204 N205 L211 K212	D204-I208 VanDerWaalsContact O-CB 3.26Å; D204-I208 WeakPolarHBondContact O-CB 3.39Å; D204-I208 WeakPolarHBondContact O-CD1 3.38Å; D204-I208 WeakPolarHBondContact O-CG1 3.5Å; D204-I208 PolarHBondContact O-N 3.33Å; N205-I208 PolarHBondContact O-N 2.96Å; I208-L211 PolarHBondContact O-N 2.9Å; I208-K212 HydrophobicContact CG2-CD 4.42Å; I208-K212 VanDerWaalsContact CG2-CE 3.49Å; I208-K212 WeakPolarHBondContact O-CB 3.42Å; I208-K212 VanDerWaalsContact O-CG 3.3Å; I208-K212 WeakPolarHBondContact O-CG 3.37Å; I208-K212 PolarHBondContact O-N 3.22Å
209	D	55.4	Low	48.2	Very low	66 Å²	66	97.4 Å²	97.4	35%	0.353	49%	0.49	S	S	.	.	H	α-helix	trans	-77.9	-21.6	177.7	-81.9	4.9	0	0	0	113.1	N205 N206 K212 R213	N205-D209 WeakPolarHBondContact O-CB 3.23Å; N205-D209 PolarHBondContact O-N 2.84Å; N206-D209 PolarHBondContact O-N 3.29Å; D209-K212 WeakPolarHBondContact OD1-CD 3.22Å; D209-K212 WeakPolarHBondContact OD1-CE 3.46Å; D209-K212 IonicContact OD1-NZ 3.54Å; D209-K212 PolarHBondContact OD1-NZ 3.06Å; D209-R213 WeakPolarHBondContact O-CB 3.47Å; D209-R213 VanDerWaalsContact O-CG 3.27Å; D209-R213 WeakPolarHBondContact O-CG 3.38Å; D209-R213 PolarHBondContact O-N 2.89Å; D209-R213 PolarHBondContact O-NE 3.16Å
210	Y	51.6	Low	48.7	Very low	142 Å²	142	98 Å²	98	56%	0.557	49%	0.489	S	S	*	.	H	α-helix	trans	-71.7	-45.6	166	-170.3	-106.9	0	0	0	111.1	N206 L207 R213 N214	N206-Y210 WeakPolarHBondContact O-CB 3.47Å; N206-Y210 PolarHBondContact O-N 2.64Å; L207-Y210 PolarHBondContact O-N 3.47Å; Y210-R213 PolarHBondContact O-N 3.32Å; Y210-N214 VanDerWaalsContact CE1-ND2 3.29Å; Y210-N214 WeakPolarHBondContact CE1-ND2 3.44Å; Y210-N214 PolarHBondContact O-N 2.79Å
211	L	51.1	Low	49	Very low	92 Å²	92	102.5 Å²	102.5	48%	0.482	50%	0.502	S	S	.	.	H	α-helix	trans	-65.4	-37.3	175.5	-71.6	169.4	0	0	0	112.3	L207 I208 N215	L207-L211 HydrophobicContact CG-CD1 4.21Å; L207-L211 WeakPolarHBondContact O-CB 3.45Å; L207-L211 VanDerWaalsContact O-CG 3.27Å; L207-L211 WeakPolarHBondContact O-CG 3.35Å; L207-L211 PolarHBondContact O-N 3.08Å; I208-L211 PolarHBondContact O-N 2.9Å; L211-N215 VanDerWaalsContact O-CB 3.28Å; L211-N215 WeakPolarHBondContact O-CB 3.34Å; L211-N215 PolarHBondContact O-N 3.03Å; L211-N215 PolarHBondContact O-ND2 3.42Å; L211-N215 VanDerWaalsContact O-ND2 3.09Å
212	K	54.2	Low	49.3	Very low	106 Å²	106	104.7 Å²	104.7	46%	0.461	51%	0.514	S	S	.	.	H	α-helix	trans	-62.2	-53	168.9	-76.3	177.1	-156.7	148.3	0	110.8	I208 D209 N214 N215 E216	I208-K212 HydrophobicContact CG2-CD 4.42Å; I208-K212 VanDerWaalsContact CG2-CE 3.49Å; I208-K212 WeakPolarHBondContact O-CB 3.42Å; I208-K212 VanDerWaalsContact O-CG 3.3Å; I208-K212 WeakPolarHBondContact O-CG 3.37Å; I208-K212 PolarHBondContact O-N 3.22Å; D209-K212 WeakPolarHBondContact OD1-CD 3.22Å; D209-K212 WeakPolarHBondContact OD1-CE 3.46Å; D209-K212 IonicContact OD1-NZ 3.54Å; D209-K212 PolarHBondContact OD1-NZ 3.06Å; K212-N214 PolarHBondContact O-N 3.38Å; K212-N215 CarbonylContact O-C 3.6Å; K212-N215 PolarHBondContact O-N 3.15Å; K212-N215 VanDerWaalsContact O-N 3.08Å; K212-E216 WeakPolarHBondContact O-CB 3.4Å; K212-E216 WeakPolarHBondContact O-CG 3.37Å; K212-E216 PolarHBondContact O-N 3.47Å
213	R	56.8	Low	49.7	Very low	138 Å²	138	107.4 Å²	107.4	52%	0.521	52%	0.519	S	S	.	.	H	α-helix	trans	-58.6	-34.9	-179	-80.4	177.1	-81.3	-172.9	-6.9	112.8	D209 Y210 K217	D209-R213 WeakPolarHBondContact O-CB 3.47Å; D209-R213 VanDerWaalsContact O-CG 3.27Å; D209-R213 WeakPolarHBondContact O-CG 3.38Å; D209-R213 PolarHBondContact O-N 2.89Å; D209-R213 PolarHBondContact O-NE 3.16Å; Y210-R213 PolarHBondContact O-N 3.32Å; R213-K217 WeakPolarHBondContact O-CG 3.41Å; R213-K217 PolarHBondContact O-N 2.88Å
214	N	54.5	Low	49.8	Very low	65 Å²	65	109 Å²	109	35%	0.348	52%	0.519	S	S	.	.	H	α-helix	trans	-75.2	-40.4	173.7	-75.2	-28.6	0	0	0	113	Y210 K212 E216 K217 A218	Y210-N214 VanDerWaalsContact CE1-ND2 3.29Å; Y210-N214 WeakPolarHBondContact CE1-ND2 3.44Å; Y210-N214 PolarHBondContact O-N 2.79Å; K212-N214 PolarHBondContact O-N 3.38Å; N214-E216 VanDerWaalsContact C-N 3.33Å; N214-E216 PolarHBondContact O-N 3.04Å; N214-K217 PolarHBondContact O-N 3.05Å; N214-A218 WeakPolarHBondContact O-CB 3.41Å; N214-A218 PolarHBondContact O-N 3.05Å
215	N	53.2	Low	49.9	Very low	102 Å²	102	113.6 Å²	113.6	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-67.1	-30.3	172.7	-81.2	-45.6	0	0	0	113.1	L211 K212 T219	L211-N215 VanDerWaalsContact O-CB 3.28Å; L211-N215 WeakPolarHBondContact O-CB 3.34Å; L211-N215 PolarHBondContact O-N 3.03Å; L211-N215 PolarHBondContact O-ND2 3.42Å; L211-N215 VanDerWaalsContact O-ND2 3.09Å; K212-N215 CarbonylContact O-C 3.6Å; K212-N215 PolarHBondContact O-N 3.15Å; K212-N215 VanDerWaalsContact O-N 3.08Å; N215-T219 VanDerWaalsContact O-CB 3.3Å; N215-T219 WeakPolarHBondContact O-CB 3.31Å; N215-T219 VanDerWaalsContact O-CG2 3.29Å; N215-T219 WeakPolarHBondContact O-CG2 3.37Å; N215-T219 PolarHBondContact O-N 3.07Å; N215-T219 PolarHBondContact O-OG1 2.73Å
216	E	50.3	Low	49.8	Very low	115 Å²	115	113.8 Å²	113.8	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-71.7	-42.9	172.9	-75.1	-176.4	149	0	0	111.1	K212 N214 A218 T219 L220	K212-E216 WeakPolarHBondContact O-CB 3.4Å; K212-E216 WeakPolarHBondContact O-CG 3.37Å; K212-E216 PolarHBondContact O-N 3.47Å; N214-E216 VanDerWaalsContact C-N 3.33Å; N214-E216 PolarHBondContact O-N 3.04Å; E216-A218 VanDerWaalsContact C-N 3.34Å; E216-A218 PolarHBondContact O-N 3.07Å; E216-T219 WeakPolarHBondContact CA-OG1 3.24Å; E216-T219 PolarHBondContact O-N 3.08Å; E216-T219 PolarHBondContact O-OG1 2.9Å; E216-L220 WeakPolarHBondContact O-CB 3.4Å; E216-L220 WeakPolarHBondContact O-CD1 3.49Å; E216-L220 VanDerWaalsContact O-CG 3.29Å; E216-L220 WeakPolarHBondContact O-CG 3.3Å; E216-L220 PolarHBondContact O-N 3.25Å
217	K	52.1	Low	49.5	Very low	149 Å²	149	116.6 Å²	116.6	65%	0.648	54%	0.537	S	S	*	.	H	α-helix	trans	-59.9	-43	170.2	-76.9	176.5	178	178.8	0	112	R213 N214 K221	R213-K217 WeakPolarHBondContact O-CG 3.41Å; R213-K217 PolarHBondContact O-N 2.88Å; N214-K217 PolarHBondContact O-N 3.05Å; K217-K221 PolarHBondContact O-N 2.82Å; K217-K221 VanDerWaalsContact O-N 3.1Å
218	A	48.9	Very low	49.3	Very low	53 Å²	53	116.6 Å²	116.6	44%	0.438	54%	0.538	S	S	.	.	H	α-helix	trans	-66.2	-47	177.2	0	0	0	0	0	112.1	N214 E216 L220 K221 K222	N214-A218 WeakPolarHBondContact O-CB 3.41Å; N214-A218 PolarHBondContact O-N 3.05Å; E216-A218 VanDerWaalsContact C-N 3.34Å; E216-A218 PolarHBondContact O-N 3.07Å; A218-L220 VanDerWaalsContact C-N 3.35Å; A218-L220 PolarHBondContact O-N 3.15Å; A218-K221 PolarHBondContact O-N 2.88Å; A218-K222 PolarHBondContact O-N 2.9Å
219	T	48.8	Very low	49.1	Very low	62 Å²	62	117.7 Å²	117.7	38%	0.38	54%	0.544	S	S	.	.	H	α-helix	trans	-73.3	-22.5	178	55.8	0	0	0	0	113.1	N215 E216 K223	N215-T219 VanDerWaalsContact O-CB 3.3Å; N215-T219 WeakPolarHBondContact O-CB 3.31Å; N215-T219 VanDerWaalsContact O-CG2 3.29Å; N215-T219 WeakPolarHBondContact O-CG2 3.37Å; N215-T219 PolarHBondContact O-N 3.07Å; N215-T219 PolarHBondContact O-OG1 2.73Å; E216-T219 WeakPolarHBondContact CA-OG1 3.24Å; E216-T219 PolarHBondContact O-N 3.08Å; E216-T219 PolarHBondContact O-OG1 2.9Å; T219-K223 WeakPolarHBondContact O-CA 3.48Å; T219-K223 WeakPolarHBondContact O-CB 3.42Å; T219-K223 WeakPolarHBondContact O-CG 3.42Å; T219-K223 PolarHBondContact O-N 3.2Å
220	L	49.3	Very low	48.7	Very low	104 Å²	104	118.7 Å²	118.7	55%	0.545	55%	0.55	S	S	.	.	H	α-helix	trans	-69.5	-43.2	167.2	-83.2	163.4	0	0	0	111.6	E216 A218 K222 R224	E216-L220 WeakPolarHBondContact O-CB 3.4Å; E216-L220 WeakPolarHBondContact O-CD1 3.49Å; E216-L220 VanDerWaalsContact O-CG 3.29Å; E216-L220 WeakPolarHBondContact O-CG 3.3Å; E216-L220 PolarHBondContact O-N 3.25Å; A218-L220 VanDerWaalsContact C-N 3.35Å; A218-L220 PolarHBondContact O-N 3.15Å; L220-K222 VanDerWaalsContact C-N 3.34Å; L220-R224 WeakPolarHBondContact O-CG 3.4Å; L220-R224 PolarHBondContact O-N 3.44Å
221	K	45.8	Very low	48.6	Very low	171 Å²	171	115.2 Å²	115.2	74%	0.743	55%	0.546	S	S	*	.	H	α-helix	trans	-60.6	-42.8	170.1	-99.9	-175.4	174	-179.6	0	111.4	K217 A218 R225	K217-K221 PolarHBondContact O-N 2.82Å; K217-K221 VanDerWaalsContact O-N 3.1Å; A218-K221 PolarHBondContact O-N 2.88Å; K221-R225 PolarHBondContact O-N 3.48Å
222	K	44.6	Very low	48.4	Very low	148 Å²	148	116.4 Å²	116.4	64%	0.643	55%	0.552	S	S	*	*	H	α-helix	trans	-70.1	-39.9	179.4	-145.8	175.9	-177.1	-180	0	112.8	A218 L220 L226	A218-K222 PolarHBondContact O-N 2.9Å; L220-K222 VanDerWaalsContact C-N 3.34Å; K222-L226 HydrophobicContact CG-CD1 4.21Å; K222-L226 WeakPolarHBondContact O-CB 3.46Å; K222-L226 PolarHBondContact O-N 3.02Å
223	K	46.5	Very low	48.1	Very low	140 Å²	140	118.6 Å²	118.6	61%	0.609	56%	0.562	S	S	*	*	H	α-helix	trans	-74.1	-18.9	176.4	-76.5	176.3	175.8	176.5	0	114.3	T219 K227	T219-K223 WeakPolarHBondContact O-CA 3.48Å; T219-K223 WeakPolarHBondContact O-CB 3.42Å; T219-K223 WeakPolarHBondContact O-CG 3.42Å; T219-K223 PolarHBondContact O-N 3.2Å; K223-K227 WeakPolarHBondContact O-CG 3.33Å; K223-K227 PolarHBondContact O-N 3.09Å
224	R	44.6	Very low	47.7	Very low	182 Å²	182	119.1 Å²	119.1	69%	0.687	57%	0.568	S	S	*	*	H	α-helix	trans	-70.9	-57.9	166.7	-77.2	-178.9	177.9	-176.4	-1.2	109.7	L220 L226 K227 D228	L220-R224 WeakPolarHBondContact O-CG 3.4Å; L220-R224 PolarHBondContact O-N 3.44Å; R224-L226 PolarHBondContact O-N 3.17Å; R224-K227 WeakPolarHBondContact O-CA 3.43Å; R224-K227 WeakPolarHBondContact O-CB 3.37Å; R224-K227 PolarHBondContact O-N 3.38Å; R224-D228 VanDerWaalsContact O-CG 3.28Å; R224-D228 PolarHBondContact O-N 3.06Å; R224-D228 VanDerWaalsContact O-N 3.17Å; R224-D228 VanDerWaalsContact O-OD2 3.07Å
225	R	44.1	Very low	47.4	Very low	192 Å²	192	121.1 Å²	121.1	73%	0.725	58%	0.578	S	S	*	*	H	α-helix	trans	-53.4	-48.7	175.5	-68.3	-174.3	173.1	-172.1	-4.7	113	K221 K227 D228 D229	K221-R225 PolarHBondContact O-N 3.48Å; R225-K227 PolarHBondContact O-N 3.08Å; R225-K227 VanDerWaalsContact O-N 3.13Å; R225-D228 PolarHBondContact O-N 3.45Å; R225-D229 VanDerWaalsContact O-CG 3.27Å; R225-D229 PolarHBondContact O-N 2.76Å; R225-D229 VanDerWaalsContact O-OD2 3.08Å
226	L	43.9	Very low	47.4	Very low	89 Å²	89	120.5 Å²	120.5	47%	0.466	57%	0.574	S	S	.	*	H	α-helix	trans	-66.6	-9.8	175	-91.1	151.4	0	0	0	115.4	K222 R224 N230	K222-L226 HydrophobicContact CG-CD1 4.21Å; K222-L226 WeakPolarHBondContact O-CB 3.46Å; K222-L226 PolarHBondContact O-N 3.02Å; R224-L226 PolarHBondContact O-N 3.17Å; L226-N230 WeakPolarHBondContact O-CB 3.39Å; L226-N230 PolarHBondContact O-ND2 3.39Å
227	K	44	Very low	47.5	Very low	162 Å²	162	119.5 Å²	119.5	70%	0.704	57%	0.57	S	S	*	*	H	α-helix	trans	-83.7	-42.6	165.6	-89.8	-171.4	169.8	-165.3	0	110.9	K223 R224 R225 N230 S231	K223-K227 WeakPolarHBondContact O-CG 3.33Å; K223-K227 PolarHBondContact O-N 3.09Å; R224-K227 WeakPolarHBondContact O-CA 3.43Å; R224-K227 WeakPolarHBondContact O-CB 3.37Å; R224-K227 PolarHBondContact O-N 3.38Å; R225-K227 PolarHBondContact O-N 3.08Å; R225-K227 VanDerWaalsContact O-N 3.13Å; K227-N230 PolarHBondContact O-N 3.42Å; K227-S231 PolarHBondContact O-N 2.88Å; K227-S231 PolarHBondContact O-OG 2.89Å
228	D	44.8	Very low	47.5	Very low	98 Å²	98	117 Å²	117	52%	0.524	56%	0.564	S	S	.	*	H	α-helix	trans	-65.8	-42.7	-179.9	-47.9	-36.4	0	0	0	111	R224 R225 N230 S231 L232	R224-D228 VanDerWaalsContact O-CG 3.28Å; R224-D228 PolarHBondContact O-N 3.06Å; R224-D228 VanDerWaalsContact O-N 3.17Å; R224-D228 VanDerWaalsContact O-OD2 3.07Å; R225-D228 PolarHBondContact O-N 3.45Å; D228-N230 PolarHBondContact O-N 3.24Å; D228-S231 PolarHBondContact O-N 2.91Å; D228-S231 PolarHBondContact O-OG 3.16Å; D228-L232 PolarHBondContact O-N 3.32Å; D228-L232 VanDerWaalsContact O-N 3.11Å
229	D	47.5	Very low	48.1	Very low	96 Å²	96	120.5 Å²	120.5	51%	0.513	57%	0.569	S	S	.	*	H	α-helix	trans	-65.4	-38.2	175.9	-61.7	-39.6	0	0	0	112.3	R225 L232 K233	R225-D229 VanDerWaalsContact O-CG 3.27Å; R225-D229 PolarHBondContact O-N 2.76Å; R225-D229 VanDerWaalsContact O-OD2 3.08Å; D229-L232 PolarHBondContact O-N 2.85Å; D229-K233 PolarHBondContact O-N 3.18Å
230	N	46.2	Very low	48.3	Very low	87 Å²	87	122.3 Å²	122.3	47%	0.465	58%	0.575	S	S	.	*	H	α-helix	trans	-76.8	-28.8	179.8	-86.4	-58.1	0	0	0	113	L226 K227 D228 K234	L226-N230 WeakPolarHBondContact O-CB 3.39Å; L226-N230 PolarHBondContact O-ND2 3.39Å; K227-N230 PolarHBondContact O-N 3.42Å; D228-N230 PolarHBondContact O-N 3.24Å; N230-K234 WeakPolarHBondContact O-CB 3.43Å; N230-K234 PolarHBondContact O-N 3.11Å; N230-K234 VanDerWaalsContact O-N 3.09Å
231	S	49.3	Very low	48.3	Very low	68 Å²	68	122.7 Å²	122.7	48%	0.476	57%	0.573	S	S	.	*	H	α-helix	trans	-68.7	-37.8	168.2	53.5	0	0	0	0	110.9	K227 D228 L235	K227-S231 PolarHBondContact O-N 2.88Å; K227-S231 PolarHBondContact O-OG 2.89Å; D228-S231 PolarHBondContact O-N 2.91Å; D228-S231 PolarHBondContact O-OG 3.16Å; S231-L235 WeakPolarHBondContact O-CB 3.32Å; S231-L235 PolarHBondContact O-N 2.94Å
232	L	46.5	Very low	48.9	Very low	118 Å²	118	122 Å²	122	62%	0.618	57%	0.57	S	S	*	*	H	α-helix	trans	-63	-48	173.1	-119.2	74.5	0	0	0	113	D228 D229 K234 L235 N236	D228-L232 PolarHBondContact O-N 3.32Å; D228-L232 VanDerWaalsContact O-N 3.11Å; D229-L232 PolarHBondContact O-N 2.85Å; L232-K234 PolarHBondContact O-N 3.36Å; L232-L235 PolarHBondContact O-N 2.85Å; L232-N236 PolarHBondContact O-N 3.01Å; L232-N236 VanDerWaalsContact O-N 3.09Å
233	K	49	Very low	49.5	Very low	151 Å²	151	124.8 Å²	124.8	66%	0.657	58%	0.576	S	S	*	*	H	α-helix	trans	-59.7	-45.5	176.5	-86.2	-165.6	172.6	-172.8	0	111.9	D229 L235 N236 E237	D229-K233 PolarHBondContact O-N 3.18Å; K233-L235 PolarHBondContact O-N 3.09Å; K233-N236 PolarHBondContact O-N 2.76Å; K233-E237 PolarHBondContact O-N 2.91Å
234	K	48.1	Very low	49.6	Very low	150 Å²	150	123.1 Å²	123.1	65%	0.652	57%	0.573	S	S	*	*	H	α-helix	trans	-63.3	-39.3	175.6	-79.8	-164.4	170	-166.2	0	113.4	N230 L232 N236 E237 D238	N230-K234 WeakPolarHBondContact O-CB 3.43Å; N230-K234 PolarHBondContact O-N 3.11Å; N230-K234 VanDerWaalsContact O-N 3.09Å; L232-K234 PolarHBondContact O-N 3.36Å; K234-N236 PolarHBondContact O-N 3.48Å; K234-E237 PolarHBondContact O-N 3.18Å; K234-D238 PolarHBondContact O-N 2.96Å
235	L	47.5	Very low	50	Low	106 Å²	106	119.7 Å²	119.7	56%	0.555	57%	0.567	S	S	*	*	H	α-helix	trans	-65.1	-30.3	178.2	-151.6	101.7	0	0	0	112.3	S231 L232 K233 K239	S231-L235 WeakPolarHBondContact O-CB 3.32Å; S231-L235 PolarHBondContact O-N 2.94Å; L232-L235 PolarHBondContact O-N 2.85Å; K233-L235 PolarHBondContact O-N 3.09Å; L235-K239 WeakPolarHBondContact O-CB 3.35Å; L235-K239 WeakPolarHBondContact O-CD 3.19Å; L235-K239 VanDerWaalsContact O-CG 3.25Å; L235-K239 WeakPolarHBondContact O-CG 3.42Å; L235-K239 PolarHBondContact O-N 3.27Å
236	N	54.4	Low	50.7	Low	89 Å²	89	113.1 Å²	113.1	48%	0.476	55%	0.551	S	S	.	*	H	α-helix	trans	-79.5	-41.5	173.3	-79.5	-10.2	0	0	0	112.5	L232 K233 K234 D238 K239 I240	L232-N236 PolarHBondContact O-N 3.01Å; L232-N236 VanDerWaalsContact O-N 3.09Å; K233-N236 PolarHBondContact O-N 2.76Å; K234-N236 PolarHBondContact O-N 3.48Å; N236-D238 PolarHBondContact O-N 3.32Å; N236-K239 PolarHBondContact O-N 2.81Å; N236-I240 WeakPolarHBondContact O-CB 3.37Å; N236-I240 VanDerWaalsContact O-CG1 3.26Å; N236-I240 WeakPolarHBondContact O-CG1 3.39Å; N236-I240 PolarHBondContact O-N 3.45Å
237	E	50.9	Low	51	Low	94 Å²	94	110 Å²	110	44%	0.439	54%	0.541	S	S	.	.	H	α-helix	trans	-58.5	-45.3	173.7	-84.3	-170.7	-136.1	0	0	112.6	K233 K234 K239 I240 K241	K233-E237 PolarHBondContact O-N 2.91Å; K234-E237 PolarHBondContact O-N 3.18Å; E237-K239 VanDerWaalsContact C-N 3.3Å; E237-K239 PolarHBondContact O-N 3.46Å; E237-I240 PolarHBondContact O-N 3.27Å; E237-K241 WeakPolarHBondContact O-CB 3.29Å; E237-K241 WeakPolarHBondContact O-CG 3.41Å; E237-K241 PolarHBondContact O-N 2.98Å; E237-K241 IonicContact OE2-NZ 2.68Å; E237-K241 PolarHBondContact OE2-NZ 2.9Å
238	D	53.5	Low	51.4	Low	98 Å²	98	105.3 Å²	105.3	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-67.4	-31.3	178.1	-81.7	-5.1	0	0	0	112	K234 N236 K242	K234-D238 PolarHBondContact O-N 2.96Å; N236-D238 PolarHBondContact O-N 3.32Å; D238-K242 VanDerWaalsContact O-CB 3.27Å; D238-K242 WeakPolarHBondContact O-CB 3.41Å; D238-K242 VanDerWaalsContact O-CG 3.23Å; D238-K242 WeakPolarHBondContact O-CG 3.33Å; D238-K242 PolarHBondContact O-N 2.89Å
239	K	60.8	Low	52.1	Low	125 Å²	125	104 Å²	104	54%	0.543	52%	0.518	S	S	.	.	H	α-helix	trans	-68.4	-41.5	171.1	-80.5	175	179	-179.9	0	112.1	L235 N236 E237 K242 R243	L235-K239 WeakPolarHBondContact O-CB 3.35Å; L235-K239 WeakPolarHBondContact O-CD 3.19Å; L235-K239 VanDerWaalsContact O-CG 3.25Å; L235-K239 WeakPolarHBondContact O-CG 3.42Å; L235-K239 PolarHBondContact O-N 3.27Å; N236-K239 PolarHBondContact O-N 2.81Å; E237-K239 VanDerWaalsContact C-N 3.3Å; E237-K239 PolarHBondContact O-N 3.46Å; K239-K242 PolarHBondContact O-N 3.02Å; K239-R243 WeakPolarHBondContact O-CB 3.3Å; K239-R243 PolarHBondContact O-N 3.37Å
240	I	52.8	Low	52.6	Low	100 Å²	100	104.6 Å²	104.6	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-66.4	-49.1	177.6	-69.1	165.8	0	0	0	109.8	N236 E237 K242 R243 I244	N236-I240 WeakPolarHBondContact O-CB 3.37Å; N236-I240 VanDerWaalsContact O-CG1 3.26Å; N236-I240 WeakPolarHBondContact O-CG1 3.39Å; N236-I240 PolarHBondContact O-N 3.45Å; E237-I240 PolarHBondContact O-N 3.27Å; I240-K242 VanDerWaalsContact C-N 3.31Å; I240-K242 PolarHBondContact O-N 3Å; I240-R243 PolarHBondContact O-N 2.96Å; I240-R243 VanDerWaalsContact O-N 3.12Å; I240-I244 HydrophobicContact CG2-CD1 3.8Å; I240-I244 HydrophobicContact CG2-CG1 4.43Å; I240-I244 WeakPolarHBondContact O-CG1 3.46Å; I240-I244 PolarHBondContact O-N 2.89Å
241	K	49.8	Very low	53	Low	113 Å²	113	107.1 Å²	107.1	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-59.1	-40.1	176.3	-73.3	161.8	178.8	162	0	111.7	E237 L245	E237-K241 WeakPolarHBondContact O-CB 3.29Å; E237-K241 WeakPolarHBondContact O-CG 3.41Å; E237-K241 PolarHBondContact O-N 2.98Å; E237-K241 IonicContact OE2-NZ 2.68Å; E237-K241 PolarHBondContact OE2-NZ 2.9Å; K241-L245 VanDerWaalsContact O-CB 3.3Å; K241-L245 WeakPolarHBondContact O-CB 3.25Å; K241-L245 PolarHBondContact O-N 3.36Å
242	K	58.9	Low	53.1	Low	157 Å²	157	106.7 Å²	106.7	68%	0.683	52%	0.518	S	S	*	.	H	α-helix	trans	-67.4	-39.1	173	-77.6	177.7	178.1	-176.8	0	113.8	D238 K239 I240 S246	D238-K242 VanDerWaalsContact O-CB 3.27Å; D238-K242 WeakPolarHBondContact O-CB 3.41Å; D238-K242 VanDerWaalsContact O-CG 3.23Å; D238-K242 WeakPolarHBondContact O-CG 3.33Å; D238-K242 PolarHBondContact O-N 2.89Å; K239-K242 PolarHBondContact O-N 3.02Å; I240-K242 VanDerWaalsContact C-N 3.31Å; I240-K242 PolarHBondContact O-N 3Å; K242-S246 WeakPolarHBondContact O-CB 3.47Å; K242-S246 PolarHBondContact O-N 2.91Å; K242-S246 PolarHBondContact O-OG 3.37Å
243	R	56.2	Low	53.5	Low	205 Å²	205	107.8 Å²	107.8	77%	0.774	52%	0.518	S	S	*	.	H	α-helix	trans	-66.4	-41.3	174.8	-89.5	-174.4	169.6	177.3	-3.9	112.7	K239 I240 S246 G247	K239-R243 WeakPolarHBondContact O-CB 3.3Å; K239-R243 PolarHBondContact O-N 3.37Å; I240-R243 PolarHBondContact O-N 2.96Å; I240-R243 VanDerWaalsContact O-N 3.12Å; R243-S246 PolarHBondContact O-OG 3.05Å; R243-S246 VanDerWaalsContact O-OG 3.09Å; R243-G247 PolarHBondContact O-N 2.64Å
244	I	48	Very low	53.7	Low	106 Å²	106	108.5 Å²	108.5	54%	0.544	52%	0.523	S	S	.	.	H	α-helix	trans	-62.6	-51.7	174.6	-67.1	169.4	0	0	0	108.8	I240 S246 G247 T248	I240-I244 HydrophobicContact CG2-CD1 3.8Å; I240-I244 HydrophobicContact CG2-CG1 4.43Å; I240-I244 WeakPolarHBondContact O-CG1 3.46Å; I240-I244 PolarHBondContact O-N 2.89Å; I244-S246 VanDerWaalsContact C-N 3.34Å; I244-S246 PolarHBondContact O-N 3.23Å; I244-G247 PolarHBondContact O-N 2.9Å; I244-T248 PolarHBondContact O-N 3.44Å; I244-T248 PolarHBondContact O-OG1 3.46Å
245	L	53.3	Low	53.6	Low	109 Å²	109	103.1 Å²	103.1	57%	0.571	51%	0.505	S	S	*	.	H	α-helix	trans	-61.8	-38.9	-179.5	-160.3	77.1	0	0	0	112.6	K241 I249	K241-L245 VanDerWaalsContact O-CB 3.3Å; K241-L245 WeakPolarHBondContact O-CB 3.25Å; K241-L245 PolarHBondContact O-N 3.36Å; L245-I249 HydrophobicContact CD2-CD1 4.45Å; L245-I249 HydrophobicContact CG-CD1 4.05Å; L245-I249 WeakPolarHBondContact O-CB 3.46Å; L245-I249 WeakPolarHBondContact O-CD1 3.26Å; L245-I249 WeakPolarHBondContact O-CG1 3.09Å; L245-I249 PolarHBondContact O-N 3.46Å
246	S	59.5	Low	53.5	Low	55 Å²	55	106.5 Å²	106.5	39%	0.385	52%	0.524	S	S	.	.	H	α-helix	trans	-66.8	-44.6	175	69.4	0	0	0	0	111.8	K242 R243 I244 T248 I249 E250	K242-S246 WeakPolarHBondContact O-CB 3.47Å; K242-S246 PolarHBondContact O-N 2.91Å; K242-S246 PolarHBondContact O-OG 3.37Å; R243-S246 PolarHBondContact O-OG 3.05Å; R243-S246 VanDerWaalsContact O-OG 3.09Å; I244-S246 VanDerWaalsContact C-N 3.34Å; I244-S246 PolarHBondContact O-N 3.23Å; S246-T248 PolarHBondContact O-N 3.06Å; S246-I249 CarbonylContact O-C 3.55Å; S246-I249 PolarHBondContact O-N 2.86Å; S246-E250 WeakPolarHBondContact O-CG 3.49Å; S246-E250 PolarHBondContact O-N 3.19Å
247	G	50.7	Low	52.9	Low	24 Å²	24	106.5 Å²	106.5	25%	0.247	52%	0.522	C	S	.	.	H	α-helix	trans	-62.4	-41.8	177.5	0	0	0	0	0	112.8	R243 I244 E250 Q251	R243-G247 PolarHBondContact O-N 2.64Å; I244-G247 PolarHBondContact O-N 2.9Å; G247-E250 PolarHBondContact O-N 3.21Å; G247-Q251 WeakPolarHBondContact O-CB 3.38Å; G247-Q251 VanDerWaalsContact O-CG 3.28Å; G247-Q251 WeakPolarHBondContact O-CG 3.22Å; G247-Q251 PolarHBondContact O-N 2.86Å
248	T	52.4	Low	52.4	Low	62 Å²	62	110.9 Å²	110.9	38%	0.38	54%	0.54	S	S	.	.	H	α-helix	trans	-67	-36.5	173.8	-47.4	0	0	0	0	111.6	I244 S246 L252	I244-T248 PolarHBondContact O-N 3.44Å; I244-T248 PolarHBondContact O-OG1 3.46Å; S246-T248 PolarHBondContact O-N 3.06Å; T248-L252 HydrophobicContact CG2-CD1 4.1Å; T248-L252 HydrophobicContact CG2-CG 4.5Å; T248-L252 VanDerWaalsContact O-CB 3.31Å; T248-L252 WeakPolarHBondContact O-CB 3.26Å; T248-L252 WeakPolarHBondContact O-CG 3.24Å; T248-L252 PolarHBondContact O-N 2.82Å
249	I	58.7	Low	51.8	Low	71 Å²	71	112.9 Å²	112.9	36%	0.364	55%	0.546	S	S	.	.	H	α-helix	trans	-68	-36.2	174.6	-73.6	167.8	0	0	0	111.5	L245 S246 K253	L245-I249 HydrophobicContact CD2-CD1 4.45Å; L245-I249 HydrophobicContact CG-CD1 4.05Å; L245-I249 WeakPolarHBondContact O-CB 3.46Å; L245-I249 WeakPolarHBondContact O-CD1 3.26Å; L245-I249 WeakPolarHBondContact O-CG1 3.09Å; L245-I249 PolarHBondContact O-N 3.46Å; S246-I249 CarbonylContact O-C 3.55Å; S246-I249 PolarHBondContact O-N 2.86Å; I249-K253 HydrophobicContact CG2-CD 4.27Å; I249-K253 WeakPolarHBondContact O-CB 3.28Å; I249-K253 VanDerWaalsContact O-CG 3.23Å; I249-K253 WeakPolarHBondContact O-CG 3.29Å; I249-K253 PolarHBondContact O-N 3.27Å
250	E	58	Low	51	Low	108 Å²	108	113.5 Å²	113.5	51%	0.505	56%	0.555	S	S	.	*	H	α-helix	trans	-68.2	-47.6	173.3	-74.1	173.8	146.6	0	0	111.4	S246 G247 L252 K253 H254	S246-E250 WeakPolarHBondContact O-CG 3.49Å; S246-E250 PolarHBondContact O-N 3.19Å; G247-E250 PolarHBondContact O-N 3.21Å; E250-L252 VanDerWaalsContact C-N 3.28Å; E250-L252 PolarHBondContact O-N 2.81Å; E250-K253 WeakPolarHBondContact O-CB 3.39Å; E250-K253 PolarHBondContact O-N 2.77Å; E250-K253 VanDerWaalsContact O-N 3.1Å; E250-H254 PolarHBondContact O-CD2 3.26Å; E250-H254 PolarHBondContact O-N 3.43Å
251	Q	54.2	Low	50.7	Low	140 Å²	140	116.3 Å²	116.3	65%	0.654	56%	0.564	S	S	*	*	H	α-helix	trans	-56.1	-41.6	173.3	-73.7	171.1	-18.3	0	0	112.2	G247 H254 S255	G247-Q251 WeakPolarHBondContact O-CB 3.38Å; G247-Q251 VanDerWaalsContact O-CG 3.28Å; G247-Q251 WeakPolarHBondContact O-CG 3.22Å; G247-Q251 PolarHBondContact O-N 2.86Å; Q251-H254 PolarHBondContact O-N 2.85Å; Q251-S255 PolarHBondContact O-N 2.95Å
252	L	52.9	Low	50.5	Low	59 Å²	59	113.6 Å²	113.6	31%	0.309	55%	0.554	S	S	.	*	H	α-helix	trans	-70	-35.4	175.9	-72.9	169.4	0	0	0	112.9	T248 E250 H254 S255 I257	T248-L252 HydrophobicContact CG2-CD1 4.1Å; T248-L252 HydrophobicContact CG2-CG 4.5Å; T248-L252 VanDerWaalsContact O-CB 3.31Å; T248-L252 WeakPolarHBondContact O-CB 3.26Å; T248-L252 WeakPolarHBondContact O-CG 3.24Å; T248-L252 PolarHBondContact O-N 2.82Å; E250-L252 VanDerWaalsContact C-N 3.28Å; E250-L252 PolarHBondContact O-N 2.81Å; L252-H254 VanDerWaalsContact C-N 3.28Å; L252-H254 PolarHBondContact O-N 3.29Å; L252-S255 PolarHBondContact O-N 3.41Å; L252-S255 PolarHBondContact O-OG 3.12Å; L252-I257 HydrophobicContact CD2-CD1 4.19Å
253	K	54.7	Low	50	Low	141 Å²	141	110.8 Å²	110.8	61%	0.613	55%	0.547	S	S	*	.	H	α-helix	trans	-64.7	-29.6	171.9	-78.3	169.2	177.8	-179.6	0	113.2	I249 E250 S255	I249-K253 HydrophobicContact CG2-CD 4.27Å; I249-K253 WeakPolarHBondContact O-CB 3.28Å; I249-K253 VanDerWaalsContact O-CG 3.23Å; I249-K253 WeakPolarHBondContact O-CG 3.29Å; I249-K253 PolarHBondContact O-N 3.27Å; E250-K253 WeakPolarHBondContact O-CB 3.39Å; E250-K253 PolarHBondContact O-N 2.77Å; E250-K253 VanDerWaalsContact O-N 3.1Å; K253-S255 VanDerWaalsContact C-N 3.35Å
254	H	53.3	Low	49.5	Very low	166 Å²	166	105.1 Å²	105.1	77%	0.769	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	0.3	175.3	-65.6	-59.7	0	0	0	113.6	E250 Q251 L252	E250-H254 PolarHBondContact O-CD2 3.26Å; E250-H254 PolarHBondContact O-N 3.43Å; Q251-H254 PolarHBondContact O-N 2.85Å; L252-H254 VanDerWaalsContact C-N 3.28Å; L252-H254 PolarHBondContact O-N 3.29Å
255	S	44.9	Very low	49.2	Very low	38 Å²	38	105.2 Å²	105.2	27%	0.266	54%	0.536	S	S	.	.	S	Bend	trans	-94.9	142.8	177.6	77.8	0	0	0	0	111.9	Q251 L252 K253 I257	Q251-S255 PolarHBondContact O-N 2.95Å; L252-S255 PolarHBondContact O-N 3.41Å; L252-S255 PolarHBondContact O-OG 3.12Å; K253-S255 VanDerWaalsContact C-N 3.35Å; S255-I257 PolarHBondContact O-N 3.09Å; S255-I257 WeakPolarHBondContact OG-CD1 3.47Å; S255-I257 WeakPolarHBondContact OG-CG1 3.49Å
256	N	45.1	Very low	48.6	Very low	177 Å²	177	105.5 Å²	105.5	95%	0.947	53%	0.534	S	S	*	.			trans	-72.2	28.7	175.5	-81.5	-28.5	0	0	0	113.7	K258	N256-K258 PolarHBondContact O-N 3.4Å
257	I	42.8	Very low	47.8	Very low	88 Å²	88	107.2 Å²	107.2	45%	0.451	54%	0.543	S	S	.	.			trans	-83.3	117.3	-173.9	-63.1	178.2	0	0	0	109.9	L252 S255 K261	L252-I257 HydrophobicContact CD2-CD1 4.19Å; S255-I257 PolarHBondContact O-N 3.09Å; S255-I257 WeakPolarHBondContact OG-CD1 3.47Å; S255-I257 WeakPolarHBondContact OG-CG1 3.49Å; I257-K261 HydrophobicContact CG2-CD 4.49Å
258	K	39.4	Very low	47.4	Very low	186 Å²	186	112.9 Å²	112.9	81%	0.809	56%	0.564	S	S	*	*			trans	-47.7	134.8	-168.3	-67.3	179.9	177.9	177.8	0	114.1	N256 N260 K261	N256-K258 PolarHBondContact O-N 3.4Å; K258-N260 PolarHBondContact O-N 3.38Å; K258-K261 PolarHBondContact O-N 3.41Å
259	H	40.8	Very low	46.7	Very low	141 Å²	141	114.1 Å²	114.1	65%	0.653	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.1	-30.9	-165.9	-146.5	-32.8	0	0	0	116.6	K261 L262	H259-K261 VanDerWaalsContact C-N 3.33Å; H259-K261 PolarHBondContact O-N 2.86Å; H259-L262 PolarHBondContact O-N 2.65Å
260	N	45.3	Very low	45.7	Very low	137 Å²	137	118.9 Å²	118.9	73%	0.733	59%	0.593	S	S	*	*	H	α-helix	trans	-70.4	-19.5	-174.9	-67.7	0.3	0	0	0	114.6	K258	K258-N260 PolarHBondContact O-N 3.38Å
261	K	46	Very low	44.5	Very low	160 Å²	160	117.8 Å²	117.8	70%	0.696	60%	0.597	S	S	*	*	H	α-helix	trans	-81.1	-24.8	175.1	-75.2	-170.4	175.4	-175.7	0	113.5	I257 K258 H259	I257-K261 HydrophobicContact CG2-CD 4.49Å; K258-K261 PolarHBondContact O-N 3.41Å; H259-K261 VanDerWaalsContact C-N 3.33Å; H259-K261 PolarHBondContact O-N 2.86Å
262	L	45	Very low	43.6	Very low	55 Å²	55	115.4 Å²	115.4	29%	0.288	60%	0.596	S	S	.	*	H	α-helix	trans	-73.7	-37.6	-179	-98.5	128.7	0	0	0	113	H259 T264 L265 H266	H259-L262 PolarHBondContact O-N 2.65Å; L262-T264 VanDerWaalsContact C-N 3.34Å; L262-T264 PolarHBondContact O-N 2.87Å; L262-L265 PolarHBondContact O-N 2.92Å; L262-H266 PolarHBondContact O-N 3.27Å
263	N	48	Very low	42.8	Very low	98 Å²	98	122.2 Å²	122.2	52%	0.524	62%	0.623	S	S	.	*	H	α-helix	trans	-61.4	-39.8	-178.3	-78	-9.9	0	0	0	112.8	L265 H266 T267	N263-L265 PolarHBondContact O-N 3.44Å; N263-H266 PolarHBondContact O-N 2.86Å; N263-H266 VanDerWaalsContact O-N 3.1Å; N263-T267 PolarHBondContact O-N 3.3Å; N263-T267 PolarHBondContact O-OG1 2.64Å
264	T	46.5	Very low	41.9	Very low	87 Å²	87	122 Å²	122	53%	0.534	63%	0.629	S	S	.	*	H	α-helix	trans	-63.5	-39.4	179.4	-40.3	0	0	0	0	112.5	L262 H266 T267 M268	L262-T264 VanDerWaalsContact C-N 3.34Å; L262-T264 PolarHBondContact O-N 2.87Å; T264-H266 VanDerWaalsContact C-N 3.35Å; T264-T267 PolarHBondContact O-OG1 2.9Å; T264-M268 WeakPolarHBondContact O-CG 3.45Å; T264-M268 PolarHBondContact O-N 3.24Å
265	L	41.1	Very low	40.9	Very low	107 Å²	107	121 Å²	121	56%	0.56	63%	0.629	S	S	*	*	H	α-helix	trans	-68.7	-36.7	172.6	-74.1	164.1	0	0	0	111.2	L262 N263 T267 M268 S269	L262-L265 PolarHBondContact O-N 2.92Å; N263-L265 PolarHBondContact O-N 3.44Å; L265-T267 PolarHBondContact O-N 2.86Å; L265-M268 PolarHBondContact O-N 3.03Å; L265-S269 PolarHBondContact O-N 3.44Å
266	H	40.5	Very low	40.3	Very low	115 Å²	115	124.9 Å²	124.9	53%	0.532	65%	0.645	S	S	.	*	H	α-helix	trans	-71.3	-29.2	-177.3	-146.6	-28	0	0	0	113.6	L262 N263 T264	L262-H266 PolarHBondContact O-N 3.27Å; N263-H266 PolarHBondContact O-N 2.86Å; N263-H266 VanDerWaalsContact O-N 3.1Å; T264-H266 VanDerWaalsContact C-N 3.35Å
267	T	44.4	Very low	39.8	Very low	92 Å²	92	123.3 Å²	123.3	56%	0.564	64%	0.642	S	S	*	*	H	α-helix	trans	-72	-41	170.4	40.2	0	0	0	0	112.4	N263 T264 L265 S269 K270	N263-T267 PolarHBondContact O-N 3.3Å; N263-T267 PolarHBondContact O-OG1 2.64Å; T264-T267 PolarHBondContact O-OG1 2.9Å; L265-T267 PolarHBondContact O-N 2.86Å; T267-S269 PolarHBondContact O-N 3.34Å; T267-K270 PolarHBondContact O-N 3.26Å; T267-K270 VanDerWaalsContact O-N 3.1Å
268	M	41.5	Very low	39.2	Very low	143 Å²	143	127.6 Å²	127.6	70%	0.704	66%	0.66	S	S	*	*	H	α-helix	trans	-61.5	-26	176.5	-69.4	-174.4	72.3	0	0	113.1	T264 L265 K270	T264-M268 WeakPolarHBondContact O-CG 3.45Å; T264-M268 PolarHBondContact O-N 3.24Å; L265-M268 PolarHBondContact O-N 3.03Å; M268-K270 PolarHBondContact O-N 3.32Å
269	S	37.8	Very low	38.8	Very low	87 Å²	87	124.5 Å²	124.5	61%	0.608	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-4.8	175.8	-174	0	0	0	0	115.2	L265 T267	L265-S269 PolarHBondContact O-N 3.44Å; T267-S269 PolarHBondContact O-N 3.34Å
270	K	37.2	Very low	38.2	Very low	171 Å²	171	126 Å²	126	74%	0.743	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	-2.1	-171.4	-75.6	-172.7	174.2	-178.5	0	115.9	T267 M268	T267-K270 PolarHBondContact O-N 3.26Å; T267-K270 VanDerWaalsContact O-N 3.1Å; M268-K270 PolarHBondContact O-N 3.32Å
271	C	32.6	Very low	37.4	Very low	85 Å²	85	126.6 Å²	126.6	57%	0.574	67%	0.666	S	S	*	*			trans	-81.1	146.2	-178.1	-64.7	0	0	0	0	112.8	I276	C271-I276 HydrophobicContact CB-CD1 3.73Å
272	S	35	Very low	36.7	Very low	90 Å²	90	127.8 Å²	127.8	63%	0.629	67%	0.671	S	S	*	*			trans	-74.5	168.1	-173.9	-162.8	0	0	0	0	113.4	D274	S272-D274 VanDerWaalsContact C-N 3.29Å; S272-D274 PolarHBondContact O-N 3.1Å
273	K	36.9	Very low	36.1	Very low	202 Å²	202	130.2 Å²	130.2	88%	0.878	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-12.4	-165.1	-70.6	-177.8	176.1	174.7	0	116.4
274	D	35.5	Very low	35.1	Very low	138 Å²	138	131.3 Å²	131.3	74%	0.738	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	-11.6	-161.3	-59.2	-71	0	0	0	115	S272	S272-D274 VanDerWaalsContact C-N 3.29Å; S272-D274 PolarHBondContact O-N 3.1Å
275	D	33	Very low	34.3	Very low	145 Å²	145	135 Å²	135	78%	0.775	71%	0.714	S	S	*	*	S	Bend	trans	-121.1	31	-163.7	-70.3	-58.3	0	0	0	116.5
276	I	32.9	Very low	33.7	Very low	118 Å²	118	135.8 Å²	135.8	61%	0.605	72%	0.718	S	S	*	*			trans	-141.8	81.2	176.5	-42.9	176.4	0	0	0	114.7	C271	C271-I276 HydrophobicContact CB-CD1 3.73Å
277	V	33.4	Very low	33.2	Very low	144 Å²	144	135.5 Å²	135.5	87%	0.873	72%	0.724	S	S	*	*			trans	-154.4	93.2	145.3	-169.7	0	0	0	0	111.7
278	Q	30.7	Very low	32.7	Very low	178 Å²	178	137.1 Å²	137.1	83%	0.832	73%	0.729	S	S	*	*				-170.5	34.8	128.8	-112.7	-172.6	-7.2	0	0	114.5	E280	Q278-E280 PolarHBondContact O-N 3.25Å
279	T	29.9	Very low	32.2	Very low	121 Å²	121	137.3 Å²	137.3	74%	0.742	73%	0.733	S	S	*	*			trans	-81.8	96.3	160.7	-43.6	0	0	0	0	108	L281	T279-L281 VanDerWaalsContact C-N 3.27Å; T279-L281 PolarHBondContact O-N 3.14Å
280	E	29.7	Very low	32.1	Very low	173 Å²	173	140.2 Å²	140.2	81%	0.808	74%	0.74	S	S	*	*			trans	-65.9	93.7	165	-75.5	-172.9	161.9	0	0	108.3	Q278 K282	Q278-E280 PolarHBondContact O-N 3.25Å; E280-K282 VanDerWaalsContact C-N 3.25Å; E280-K282 PolarHBondContact O-N 3.12Å
281	L	28	Very low	31.8	Very low	150 Å²	150	140.2 Å²	140.2	79%	0.785	74%	0.743	S	S	*	*			trans	-61.1	95.6	161.9	-83.2	167.1	0	0	0	107.1	T279 S283	T279-L281 VanDerWaalsContact C-N 3.27Å; T279-L281 PolarHBondContact O-N 3.14Å; L281-S283 PolarHBondContact O-N 2.98Å
282	K	31.8	Very low	31.8	Very low	184 Å²	184	144.1 Å²	144.1	80%	0.8	76%	0.758	S	S	*	*			trans	-45.2	132.8	165.5	-67.6	-178.8	178.2	-179.6	0	107.8	E280 V284	E280-K282 VanDerWaalsContact C-N 3.25Å; E280-K282 PolarHBondContact O-N 3.12Å; K282-V284 PolarHBondContact O-N 3.17Å
283	S	31	Very low	31.6	Very low	106 Å²	106	143.3 Å²	143.3	74%	0.741	76%	0.764	S	S	*	*			trans	-49.5	110.3	179.2	44.5	0	0	0	0	110	L281 E285	L281-S283 PolarHBondContact O-N 2.98Å; S283-E285 VanDerWaalsContact C-N 3.32Å; S283-E285 PolarHBondContact O-N 3.31Å
284	V	27.6	Very low	31.1	Very low	121 Å²	121	137.2 Å²	137.2	73%	0.733	76%	0.758	S	S	*	*			trans	-68.5	100.2	162.4	175.2	0	0	0	0	105.2	K282 I286	K282-V284 PolarHBondContact O-N 3.17Å; V284-I286 VanDerWaalsContact C-N 3.35Å; V284-I286 HydrophobicContact CG1-CG1 4.19Å; V284-I286 PolarHBondContact O-N 3.18Å
285	E	29.6	Very low	30.9	Very low	164 Å²	164	139.9 Å²	139.9	77%	0.766	76%	0.764	S	S	*	*			trans	-64.2	101.4	167.7	-71.4	-178.1	133.5	0	0	107.2	S283 T287	S283-E285 VanDerWaalsContact C-N 3.32Å; S283-E285 PolarHBondContact O-N 3.31Å; E285-T287 PolarHBondContact O-N 3.23Å
286	I	29.6	Very low	30.8	Very low	125 Å²	125	141.9 Å²	141.9	64%	0.641	77%	0.766	S	S	*	*			trans	-75.5	90	166.4	-57.8	179.3	0	0	0	105.5	V284 D288	V284-I286 VanDerWaalsContact C-N 3.35Å; V284-I286 HydrophobicContact CG1-CG1 4.19Å; V284-I286 PolarHBondContact O-N 3.18Å; I286-D288 WeakPolarHBondContact CG2-OD1 3.32Å; I286-D288 PolarHBondContact O-N 2.91Å
287	T	29.9	Very low	30.6	Very low	108 Å²	108	143.4 Å²	143.4	66%	0.663	78%	0.775	S	S	*	*			trans	-71.3	85.6	166.3	52.5	0	0	0	0	108	E285 N289	E285-T287 PolarHBondContact O-N 3.23Å; T287-N289 VanDerWaalsContact C-N 3.28Å; T287-N289 PolarHBondContact O-N 3.03Å
288	D	34.1	Very low	30.5	Very low	126 Å²	126	143.3 Å²	143.3	67%	0.674	78%	0.775	S	S	*	*			trans	-68.4	89.9	170.5	-78.4	-36.1	0	0	0	109	I286 I290	I286-D288 WeakPolarHBondContact CG2-OD1 3.32Å; I286-D288 PolarHBondContact O-N 2.91Å; D288-I290 VanDerWaalsContact C-N 3.33Å; D288-I290 PolarHBondContact O-N 3.43Å
289	N	29.6	Very low	30.3	Very low	147 Å²	147	140.3 Å²	140.3	79%	0.786	77%	0.768	S	S	*	*			trans	-66.8	93.4	166.4	-71.7	-4.5	0	0	0	108.4	T287	T287-N289 VanDerWaalsContact C-N 3.28Å; T287-N289 PolarHBondContact O-N 3.03Å
290	I	36.4	Very low	30.3	Very low	148 Å²	148	142.1 Å²	142.1	76%	0.759	77%	0.768	S	S	*	*			trans	-113.2	102.7	166.9	-59.4	-179.9	0	0	0	106.8	D288	D288-I290 VanDerWaalsContact C-N 3.33Å; D288-I290 PolarHBondContact O-N 3.43Å
291	E	30.1	Very low	30.2	Very low	171 Å²	171	140.7 Å²	140.7	80%	0.799	77%	0.766	S	S	*	*			trans	-76.7	164.5	171.4	-64.5	174.3	123.4	0	0	110.5
292	D	32.8	Very low	30.4	Very low	168 Å²	168	141.5 Å²	141.5	90%	0.898	77%	0.77	S	S	*	*			trans	64.2	150.9	172.6	-59.4	-29.6	0	0	0	119.3
293	G	30.3	Very low	30.2	Very low	73 Å²	73	138.5 Å²	138.5	75%	0.753	77%	0.767	S	S	*	*			trans	162.2	-56.8	160.6	0	0	0	0	0	118.9
294	G	27.5	Very low	30.2	Very low	73 Å²	73	142 Å²	142	75%	0.753	77%	0.771	S	S	*	*			trans	73.7	-167.5	176.9	0	0	0	0	0	117.7
295	F	31.5	Very low	30.3	Very low	194 Å²	194	145.1 Å²	145.1	85%	0.851	78%	0.776	S	S	*	*			trans	56.3	95.5	-180	-61.5	-84.5	0	0	0	116.8
296	K	30.3	Very low	30.3	Very low	187 Å²	187	142 Å²	142	81%	0.813	77%	0.765	S	S	*	*				56.4	118	71.7	-77.5	-170.3	172	178.9	0	116.2
297	N	28	Very low	30.3	Very low	150 Å²	150	144 Å²	144	80%	0.802	77%	0.768	S	S	*	*			trans	48.5	129	145.5	-58.5	13.9	0	0	0	120.2
298	V	31.9	Very low	30.4	Very low	143 Å²	143	144.6 Å²	144.6	87%	0.867	77%	0.772	S	S	*	*				-154.3	152.5	112.1	134.1	0	0	0	0	109.5
299	T	26.4	Very low	30.2	Very low	114 Å²	114	146.1 Å²	146.1	70%	0.699	78%	0.775	S	S	*	*			trans	-96.8	-160.4	-178.1	36.7	0	0	0	0	112
300	E	30.7	Very low	30.2	Very low	159 Å²	159	145.1 Å²	145.1	74%	0.743	77%	0.77	S	S	*	*			trans	85.2	112.5	169.7	-67.8	151.3	-133.6	0	0	114.7
301	N	27.1	Very low	29.8	Very low	143 Å²	143	146.8 Å²	146.8	77%	0.765	77%	0.772	S	S	*	*				82.2	124	61.6	-71.5	-22.7	0	0	0	111.8
302	I	31.8	Very low	29.7	Very low	167 Å²	167	149.6 Å²	149.6	86%	0.856	78%	0.775	S	S	*	*				179.8	132.9	119.1	-90.9	156.2	0	0	0	109.1
303	T	27.5	Very low	29.4	Very low	121 Å²	121	146.2 Å²	146.2	74%	0.742	77%	0.765	S	S	*	*			trans	-85.5	144.2	174	47.1	0	0	0	0	111.5
304	E	32.3	Very low	29.4	Very low	179 Å²	179	152.1 Å²	152.1	84%	0.836	77%	0.77	S	S	*	*			trans	-174.9	157.9	152.9	-101.9	178	178.2	0	0	109.4
305	F	29.5	Very low	29.6	Very low	187 Å²	187	154.2 Å²	154.2	82%	0.82	77%	0.77	S	S	*	*			cis	-153.6	175.5	-41.5	-140.2	-97.4	0	0	0	109.4
306	D	30.1	Very low	29.4	Very low	100 Å²	100	150.5 Å²	150.5	54%	0.535	77%	0.768	S	S	.	*			trans	-65.4	144.5	-174.9	-112.3	-34.3	0	0	0	117.5
307	K	29.2	Very low	29.3	Very low	165 Å²	165	147.1 Å²	147.1	72%	0.717	76%	0.763	S	S	*	*			trans	63.8	161.8	144.5	-64.1	153.5	-171.3	144.7	0	117.1
308	T	31	Very low	29.4	Very low	121 Å²	121	148 Å²	148	74%	0.742	76%	0.762	S	S	*	*			cis	-150	173.2	17	-22.3	0	0	0	0	111.3
309	E	29.4	Very low	29.3	Very low	159 Å²	159	148.5 Å²	148.5	74%	0.743	76%	0.755	S	S	*	*			trans	-20.4	144.1	165.9	-53.1	167.2	169.3	0	0	117.8
310	N	31.4	Very low	29.4	Very low	125 Å²	125	148.4 Å²	148.4	67%	0.668	76%	0.755	S	S	*	*				-169.7	173.5	65.9	-109	-59.2	0	0	0	115.9
311	F	27.8	Very low	29.3	Very low	184 Å²	184	146 Å²	146	81%	0.807	76%	0.755	S	S	*	*			trans	-31.6	152	-174.4	-76.6	-91.3	0	0	0	124.1
312	R	27.4	Very low	29.4	Very low	229 Å²	229	148.3 Å²	148.3	86%	0.864	76%	0.759	S	S	*	*			trans	90.4	91.4	142.3	-90.4	-178.5	176.5	-176.2	-0.1	122.1
313	S	26.4	Very low	29.2	Very low	97 Å²	97	143.8 Å²	143.8	68%	0.678	75%	0.753	S	S	*	*				79.9	108.8	122.6	58.3	0	0	0	0	123.5
314	K	29.8	Very low	29.4	Very low	198 Å²	198	142.9 Å²	142.9	86%	0.861	74%	0.743	S	S	*	*			trans	75.4	154.2	138.6	-72.3	-175.9	174.9	178.3	0	119.1
315	P	32.6	Very low	29.3	Very low	117 Å²	117	139.7 Å²	139.7	76%	0.76	73%	0.728	S	S	*	*				-144.4	137.4	-51.3	37.1	-18.2	0	0	0	114.9
316	S	26.6	Very low	29.3	Very low	116 Å²	116	136.7 Å²	136.7	81%	0.811	72%	0.72	S	S	*	*			trans	-154.5	149.3	171.7	51.3	0	0	0	0	115.4
317	T	28.3	Very low	29.2	Very low	115 Å²	115	138.7 Å²	138.7	71%	0.706	73%	0.726	S	S	*	*			trans	9.2	153.3	151.5	50.1	0	0	0	0	122.1
318	E	29.5	Very low	29.3	Very low	169 Å²	169	139.3 Å²	139.3	79%	0.79	73%	0.728	S	S	*	*			cis	-175.7	169.3	-16.3	-112.5	168.1	168.9	0	0	105.9
319	E	30	Very low	29.3	Very low	154 Å²	154	138.7 Å²	138.7	72%	0.72	73%	0.727	S	S	*	*			cis	-108.7	-153.7	-3	-87.5	-129.5	66.9	0	0	109.5
320	T	28.6	Very low	29.2	Very low	112 Å²	112	136.6 Å²	136.6	69%	0.687	73%	0.728	S	S	*	*			cis	72	152.2	12.7	15.1	0	0	0	0	117
321	S	29.2	Very low	29.2	Very low	107 Å²	107	137.1 Å²	137.1	75%	0.748	73%	0.731	S	S	*	*			cis	-149.3	169.3	-5.1	69.2	0	0	0	0	113.9
322	K	28.2	Very low	29.4	Very low	193 Å²	193	135.8 Å²	135.8	84%	0.839	73%	0.725	S	S	*	*			trans	-108.4	146.6	171.7	-64.1	178.1	178.7	-180	0	111.4
323	G	27.6	Very low	29.4	Very low	71 Å²	71	134.3 Å²	134.3	73%	0.732	72%	0.719	S	S	*	*				95.3	133.4	119.8	0	0	0	0	0	121.7
324	N	31.8	Very low	29.6	Very low	102 Å²	102	134.6 Å²	134.6	55%	0.545	72%	0.721	S	S	.	*			trans	58.3	113.5	131.4	-79.5	7.2	0	0	0	123.5	G889	N324-G889 PolarHBondContact ND2-O 3.44Å
325	Q	31.5	Very low	29.7	Very low	112 Å²	112	133.8 Å²	133.8	52%	0.523	72%	0.72	S	S	.	*				80.2	134.6	114.7	-70.7	-174.3	1.4	0	0	123.4
326	I	28.7	Very low	29.7	Very low	124 Å²	124	131.7 Å²	131.7	64%	0.636	72%	0.72	S	S	*	*				101.7	122.5	126.4	-85.6	171.9	0	0	0	122.6
327	H	28.9	Very low	29.9	Very low	143 Å²	143	133.8 Å²	133.8	66%	0.662	72%	0.722	S	S	*	*			trans	67.9	118.8	145.9	-78.4	1.8	0	0	0	124.4
328	K	30.1	Very low	29.9	Very low	177 Å²	177	134.5 Å²	134.5	77%	0.77	72%	0.72	S	S	*	*				53.4	161.6	106.5	-80.9	-179.1	179.9	179	0	120.2
329	P	32.4	Very low	30.1	Very low	109 Å²	109	133.1 Å²	133.1	71%	0.708	72%	0.722	S	S	*	*			cis	-140.7	175	-9.5	34.2	-12.6	0	0	0	117.9
330	C	27.4	Very low	30.1	Very low	114 Å²	114	132.1 Å²	132.1	77%	0.77	72%	0.722	S	S	*	*			trans	69.7	103.2	140.1	-77.8	0	0	0	0	125.3
331	N	30.4	Very low	30.4	Very low	136 Å²	136	135.7 Å²	135.7	73%	0.727	73%	0.731	S	S	*	*				73.5	120.6	99.7	-167.4	10.2	0	0	0	122.4
332	K	31.3	Very low	30.4	Very low	157 Å²	157	138.2 Å²	138.2	68%	0.683	73%	0.731	S	S	*	*			trans	-166.8	168.5	136.4	-107.6	158.5	-175.2	169.6	0	113.6	N759	K332-N759 PolarHBondContact NZ-OD1 3.04Å
333	R	28.7	Very low	30.7	Very low	197 Å²	197	137.3 Å²	137.3	74%	0.743	73%	0.734	S	S	*	*			trans	-112.7	156.7	-163	-63.3	173	169.9	165.3	-6	116.8
334	S	31	Very low	30.8	Very low	103 Å²	103	144 Å²	144	72%	0.72	74%	0.737	S	S	*	*			trans	-169.3	130	135.6	45.5	0	0	0	0	108.2
335	E	31.1	Very low	30.9	Very low	181 Å²	181	143.9 Å²	143.9	85%	0.846	75%	0.75	S	S	*	*			cis	95.9	120.4	42.1	-84.5	-178.1	-160.9	0	0	115.1
336	G	31.9	Very low	31	Very low	74 Å²	74	144.8 Å²	144.8	76%	0.763	76%	0.759	S	S	*	*			trans	110.9	151.1	174.2	0	0	0	0	0	115.1
337	L	31.6	Very low	31.2	Very low	160 Å²	160	147 Å²	147	84%	0.838	77%	0.766	S	S	*	*			cis	-159.5	145.5	-12.7	-108.4	171.4	0	0	0	110.7
338	I	28.4	Very low	31.3	Very low	129 Å²	129	146.8 Å²	146.8	66%	0.662	78%	0.775	S	S	*	*			trans	13.5	128.9	159	-59.2	166.4	0	0	0	121
339	V	33.7	Very low	31.4	Very low	140 Å²	140	142.2 Å²	142.2	85%	0.848	78%	0.779	S	S	*	*				-140.2	140.6	128.5	179.9	0	0	0	0	108.6
340	N	30.1	Very low	31.3	Very low	133 Å²	133	148.8 Å²	148.8	71%	0.711	79%	0.789	S	S	*	*			trans	-100	155.9	177.6	-70.8	-24.5	0	0	0	112
341	H	34.8	Very low	31.3	Very low	187 Å²	187	150 Å²	150	87%	0.866	79%	0.794	S	S	*	*			trans	-152.5	117	145.1	-113.1	-74.6	0	0	0	110.6
342	E	29.5	Very low	31.4	Very low	161 Å²	161	148.4 Å²	148.4	75%	0.752	79%	0.791	S	S	*	*			trans	-91.3	145.9	163.8	-69.7	-173.8	109.2	0	0	109.7
343	L	33.8	Very low	31.2	Very low	174 Å²	174	150 Å²	150	91%	0.911	80%	0.801	S	S	*	*			trans	-139.7	121.8	151.1	-80.2	179.7	0	0	0	108.7
344	R	28.9	Very low	31.4	Very low	210 Å²	210	147.3 Å²	147.3	79%	0.792	80%	0.799	S	S	*	*			trans	-90.2	147.9	168	-68.9	-176.8	179.5	-172.3	0.1	109.8
345	A	35.3	Very low	31.2	Very low	100 Å²	100	149.1 Å²	149.1	83%	0.826	81%	0.806	S	S	*	*			trans	-134.9	142.7	150.7	0	0	0	0	0	107.8
346	N	32.2	Very low	31.3	Very low	132 Å²	132	147.7 Å²	147.7	71%	0.706	80%	0.803	S	S	*	*			trans	-102.9	-163.4	-176	-72.5	-27.4	0	0	0	110.9
347	E	33.7	Very low	31.1	Very low	169 Å²	169	147.8 Å²	147.8	79%	0.79	80%	0.804	S	S	*	*			trans	92.3	84.1	152.4	-68.4	163.5	-136.4	0	0	118.9
348	T	31	Very low	31.2	Very low	139 Å²	139	144 Å²	144	85%	0.853	80%	0.804	S	S	*	*				32.7	112.8	118.7	55.2	0	0	0	0	119.1
349	G	31.5	Very low	31.2	Very low	81 Å²	81	144.5 Å²	144.5	84%	0.835	81%	0.813	S	S	*	*			trans	-152.9	128	168.2	0	0	0	0	0	113.1
350	R	31.8	Very low	31.1	Very low	247 Å²	247	148.9 Å²	148.9	93%	0.932	81%	0.814	S	S	*	*			trans	-66.1	159.6	-174.5	-65.1	169.8	176.5	155.4	-2.1	114.2
351	T	26.6	Very low	31.1	Very low	140 Å²	140	150.6 Å²	150.6	86%	0.859	82%	0.818	S	S	*	*			trans	-62.6	153.3	158.9	39.9	0	0	0	0	112.4
352	P	32.7	Very low	31	Very low	103 Å²	103	151 Å²	151	67%	0.669	82%	0.817	S	S	*	*			trans	-129.3	124.3	151.5	35.2	-22	0	0	0	112.6	I354	P352-I354 HydrophobicContact CB-CD1 4.47Å; P352-I354 HydrophobicContact CB-CG1 4.28Å
353	E	26.2	Very low	31.1	Very low	191 Å²	191	154.2 Å²	154.2	89%	0.893	82%	0.822	S	S	*	*			trans	-78.9	135	149	-69.4	-178.3	119.5	0	0	107.9
354	I	32.9	Very low	31	Very low	139 Å²	139	155.3 Å²	155.3	71%	0.713	82%	0.82	S	S	*	*			trans	-135.4	119.5	169.5	-62.1	-177.6	0	0	0	108.9	P352 I356	P352-I354 HydrophobicContact CB-CD1 4.47Å; P352-I354 HydrophobicContact CB-CG1 4.28Å; I354-I356 HydrophobicContact CG2-CD1 4.22Å; I354-I356 HydrophobicContact CG2-CG1 4.14Å
355	T	26.9	Very low	31.1	Very low	142 Å²	142	153.9 Å²	153.9	87%	0.871	82%	0.822	S	S	*	*			trans	-109.8	106.2	177.1	-56.2	0	0	0	0	110.2
356	I	34.6	Very low	31	Very low	151 Å²	151	157.1 Å²	157.1	77%	0.774	82%	0.82	S	S	*	*			trans	-143.8	133.5	167.3	-51.3	176.8	0	0	0	105.7	I354	I354-I356 HydrophobicContact CG2-CD1 4.22Å; I354-I356 HydrophobicContact CG2-CG1 4.14Å
357	G	27.9	Very low	31.1	Very low	75 Å²	75	156.2 Å²	156.2	77%	0.773	82%	0.815	S	S	*	*			cis	125.3	82.1	8.1	0	0	0	0	0	109.9
358	G	31.7	Very low	31	Very low	82 Å²	82	154.1 Å²	154.1	85%	0.845	81%	0.809	S	S	*	*			trans	-170.4	87.9	-172.5	0	0	0	0	0	114.9
359	T	29.3	Very low	31	Very low	139 Å²	139	154.9 Å²	154.9	85%	0.853	81%	0.807	S	S	*	*			trans	-89.3	133.8	171	46	0	0	0	0	111.5
360	R	31.8	Very low	31.2	Very low	232 Å²	232	160.3 Å²	160.3	88%	0.875	81%	0.808	S	S	*	*			trans	-164.9	128	145.9	-120.3	172	-175.1	171.6	4	113.8
361	E	29.9	Very low	31.3	Very low	168 Å²	168	152.8 Å²	152.8	79%	0.785	79%	0.793	S	S	*	*			trans	-69.5	155.3	156.6	-57.2	169.8	91.1	0	0	110.6
362	K	33.7	Very low	31.4	Very low	197 Å²	197	154.4 Å²	154.4	86%	0.857	79%	0.791	S	S	*	*				-165.7	146.4	129	-109.1	162.5	-174.3	-176.6	0	112.9
363	R	29.8	Very low	31.4	Very low	227 Å²	227	157.7 Å²	157.7	86%	0.857	80%	0.797	S	S	*	*			trans	-87.7	146.5	177.1	-56	171.4	-176.5	163.4	-0.5	111.1
364	K	33.2	Very low	31.9	Very low	198 Å²	198	154.5 Å²	154.5	86%	0.861	79%	0.786	S	S	*	*			trans	-176.2	128.3	150.4	-99.7	167.5	-177.3	-166	0	105.7
365	Q	29.4	Very low	32	Very low	179 Å²	179	155.4 Å²	155.4	84%	0.836	79%	0.787	S	S	*	*			cis	59.9	94.4	43.8	-75.2	-173.1	-36.9	0	0	114.3
366	H	33.6	Very low	32.3	Very low	168 Å²	168	155 Å²	155	78%	0.778	78%	0.778	S	S	*	*			trans	-162.4	131.4	135.4	-107.7	-94.9	0	0	0	105.1
367	N	34.3	Very low	32.2	Very low	114 Å²	114	156.3 Å²	156.3	61%	0.61	78%	0.778	S	S	*	*				67.9	141.9	79.9	-65.7	51.2	0	0	0	112.7
368	D	33.2	Very low	32.5	Very low	125 Å²	125	159.7 Å²	159.7	67%	0.668	77%	0.772	S	S	*	*			cis	-163.6	165.3	-0.7	-107.5	-22.4	0	0	0	112.7
369	L	29.8	Very low	32.5	Very low	154 Å²	154	162.3 Å²	162.3	81%	0.806	76%	0.762	S	S	*	*			trans	45.7	121.7	146.5	-64.2	166	0	0	0	122.4
370	K	35.4	Very low	32.6	Very low	196 Å²	196	166.9 Å²	166.9	85%	0.852	76%	0.764	S	S	*	*			trans	175.9	113.8	130	-94.9	167.9	-179.9	-177.9	0	108.7
371	S	33.4	Very low	32.7	Very low	89 Å²	89	164.5 Å²	164.5	62%	0.622	76%	0.76	S	S	*	*				69.3	134.6	75.9	78	0	0	0	0	113
372	E	30.4	Very low	32.7	Very low	173 Å²	173	164.2 Å²	164.2	81%	0.808	76%	0.758	S	S	*	*			cis	-166.5	-175.2	-6.4	-126.9	165.9	135.2	0	0	109.2
373	E	32.4	Very low	32.4	Very low	172 Å²	172	159.2 Å²	159.2	80%	0.804	75%	0.754	S	S	*	*			trans	65.7	159.2	166.2	-68.7	-171.9	123	0	0	118
374	L	35.5	Very low	32.6	Very low	124 Å²	124	154.9 Å²	154.9	65%	0.649	75%	0.748	S	S	*	*			cis	-149.9	122.5	1.4	-133.1	152.3	0	0	0	110.7
375	H	36.1	Very low	32.5	Very low	159 Å²	159	153.4 Å²	153.4	74%	0.736	74%	0.742	S	S	*	*			trans	49.3	127.7	152	-74	-131.8	0	0	0	121.5
376	L	32.4	Very low	32.5	Very low	133 Å²	133	151 Å²	151	70%	0.696	73%	0.734	S	S	*	*				96.8	133.2	53.2	-96.8	164.8	0	0	0	115.2
377	K	32.4	Very low	32.3	Very low	178 Å²	178	149.9 Å²	149.9	77%	0.774	73%	0.734	S	S	*	*			trans	76.9	145.4	165.8	-63.2	167.5	-175.8	172.9	0	115.8
378	K	34.1	Very low	32.2	Very low	146 Å²	146	153.8 Å²	153.8	64%	0.635	75%	0.749	S	S	*	*			cis	-156.5	148.7	8.3	-132.4	172.2	-175.2	-84.7	0	114
379	E	32.5	Very low	32	Very low	138 Å²	138	156 Å²	156	65%	0.645	76%	0.759	S	S	*	*			trans	34.9	120.2	141.1	-74	153.6	-147.3	0	0	121.3
380	R	30.6	Very low	31.9	Very low	234 Å²	234	153 Å²	153	88%	0.883	76%	0.758	S	S	*	*				77.6	113.2	74	-82.4	-174.8	169.2	176.4	-4.8	115.7
381	K	34.1	Very low	31.7	Very low	182 Å²	182	152.6 Å²	152.6	79%	0.791	76%	0.758	S	S	*	*				174.7	118.6	128.8	-95.6	176.5	174.7	-170.3	0	108.7
382	E	30	Very low	31.5	Very low	162 Å²	162	156.1 Å²	156.1	76%	0.757	77%	0.77	S	S	*	*				62.8	104.6	81	-64.6	175.1	142	0	0	111.3
383	A	28.3	Very low	31.5	Very low	93 Å²	93	152.5 Å²	152.5	77%	0.769	76%	0.762	S	S	*	*				81	90.7	57	0	0	0	0	0	113.6
384	N	34.4	Very low	31.4	Very low	136 Å²	136	151.2 Å²	151.2	73%	0.727	76%	0.76	S	S	*	*			trans	-163.5	137.3	155.7	-96.8	-38.1	0	0	0	105.7
385	K	29.9	Very low	31.1	Very low	167 Å²	167	151.4 Å²	151.4	73%	0.726	77%	0.766	S	S	*	*				55	136.6	81.8	-61.1	-170.7	-170.4	-179.5	0	113.4
386	D	29.6	Very low	30.8	Very low	127 Å²	127	152.5 Å²	152.5	68%	0.679	77%	0.768	S	S	*	*			cis	-157.8	-174.4	-13	-92.3	-34.7	0	0	0	105.5
387	N	29.9	Very low	30.7	Very low	145 Å²	145	155 Å²	155	78%	0.775	78%	0.776	S	S	*	*			trans	8.1	123.5	157.2	-52.6	-28.3	0	0	0	118.8
388	E	31	Very low	30.5	Very low	197 Å²	197	150.1 Å²	150.1	92%	0.921	78%	0.777	S	S	*	*				-170	162.9	100.2	-102.2	174.1	176.6	0	0	112.7
389	L	29.6	Very low	30.2	Very low	170 Å²	170	149.5 Å²	149.5	89%	0.89	79%	0.785	S	S	*	*			trans	-129.1	157.1	-171.8	-109.7	168	0	0	0	109.8
390	A	29	Very low	30	Very low	93 Å²	93	148.7 Å²	148.7	77%	0.769	79%	0.792	S	S	*	*			trans	69.1	167.9	174.5	0	0	0	0	0	113.8
391	E	29.9	Very low	30	Very low	186 Å²	186	143.5 Å²	143.5	87%	0.869	79%	0.786	S	S	*	*			cis	-123.9	159	9.7	-62.8	-174	130.8	0	0	113.9
392	N	28.5	Very low	29.8	Very low	163 Å²	163	143.6 Å²	143.6	87%	0.872	79%	0.789	S	S	*	*			trans	-144.2	110.5	178.8	-170.5	13.1	0	0	0	109.6
393	P	31.8	Very low	29.5	Very low	97 Å²	97	141.6 Å²	141.6	63%	0.63	79%	0.788	S	S	*	*			trans	-109	132.6	-179	4	17.9	0	0	0	114.9
394	L	29.8	Very low	29.5	Very low	146 Å²	146	142.7 Å²	142.7	76%	0.764	79%	0.785	S	S	*	*			trans	57.7	113.1	140.6	-56.9	165.8	0	0	0	117.8
395	V	29.7	Very low	29	Very low	127 Å²	127	144.7 Å²	144.7	77%	0.77	79%	0.79	S	S	*	*			cis	67.5	92.1	29.9	-165.8	0	0	0	0	115.8
396	K	28.6	Very low	28.9	Very low	182 Å²	182	144.7 Å²	144.7	79%	0.791	79%	0.79	S	S	*	*			trans	171.8	146.9	144.1	-90.6	146.4	-166.5	170.5	0	107.3
397	Q	31.6	Very low	28.7	Very low	186 Å²	186	147.7 Å²	147.7	87%	0.869	80%	0.8	S	S	*	*			cis	-158.3	140.3	25	-137.2	164.7	10.2	0	0	111.6
398	G	27.2	Very low	28.5	Very low	76 Å²	76	144 Å²	144	78%	0.784	78%	0.783	S	S	*	*			trans	62.7	112.4	146	0	0	0	0	0	122.7
399	V	29	Very low	28.4	Very low	132 Å²	132	140 Å²	140	80%	0.8	77%	0.766	S	S	*	*				-174.2	142.3	125.4	147.7	0	0	0	0	107.2
400	P	28.3	Very low	28.3	Very low	122 Å²	122	140 Å²	140	79%	0.792	76%	0.762	S	S	*	*			trans	-75.5	141.8	176.2	-8.5	25.4	0	0	0	111.7
401	V	29.3	Very low	28.6	Very low	124 Å²	124	136.9 Å²	136.9	75%	0.752	73%	0.733	S	S	*	*			trans	-101.9	121	170.4	176.5	0	0	0	0	108.7	T403	V401-T403 PolarHBondContact O-N 2.97Å
402	E	29.9	Very low	28.9	Very low	184 Å²	184	132.9 Å²	132.9	86%	0.86	71%	0.714	S	S	*	*			trans	-74	103	167.5	-68.7	-174	138.5	0	0	109.5	V404	E402-V404 PolarHBondContact O-N 3.49Å
403	T	25.1	Very low	29.4	Very low	121 Å²	121	126.1 Å²	126.1	74%	0.742	68%	0.68	S	S	*	*			trans	-73	91.6	173.1	42.5	0	0	0	0	110.5	V401 E405	V401-T403 PolarHBondContact O-N 2.97Å; T403-E405 PolarHBondContact O-N 3.24Å; T403-E405 VanDerWaalsContact O-N 3.16Å
404	V	26.7	Very low	29.8	Very low	116 Å²	116	127.6 Å²	127.6	70%	0.703	68%	0.678	S	S	*	*			trans	-72.1	101.1	164.7	-179	0	0	0	0	108.5	E402 K406	E402-V404 PolarHBondContact O-N 3.49Å; V404-K406 VanDerWaalsContact C-N 3.34Å; V404-K406 HydrophobicContact CG1-CG 4.34Å; V404-K406 PolarHBondContact O-N 3.11Å
405	E	25	Very low	30.2	Very low	178 Å²	178	125.5 Å²	125.5	83%	0.832	67%	0.672	S	S	*	*			trans	-67.1	88.7	173.9	-67.8	-174.6	133.1	0	0	110.5	T403 E407	T403-E405 PolarHBondContact O-N 3.24Å; T403-E405 VanDerWaalsContact O-N 3.16Å; E405-E407 VanDerWaalsContact C-N 3.35Å; E405-E407 PolarHBondContact O-N 2.86Å
406	K	27.8	Very low	31	Very low	166 Å²	166	121 Å²	121	72%	0.722	64%	0.642	S	S	*	*			trans	-74.2	89.7	166.7	-73.7	-170.8	175.3	-177.3	0	109.2	V404 T408	V404-K406 VanDerWaalsContact C-N 3.34Å; V404-K406 HydrophobicContact CG1-CG 4.34Å; V404-K406 PolarHBondContact O-N 3.11Å; K406-T408 PolarHBondContact O-N 3.17Å; K406-T408 PolarHBondContact O-OG1 3.46Å
407	E	26	Very low	32.1	Very low	190 Å²	190	118.7 Å²	118.7	89%	0.888	63%	0.634	S	S	*	*			trans	-41.8	110.8	170.7	-72.1	-172.7	143.2	0	0	110	E405	E405-E407 VanDerWaalsContact C-N 3.35Å; E405-E407 PolarHBondContact O-N 2.86Å
408	T	25.1	Very low	32.9	Very low	68 Å²	68	110.3 Å²	110.3	42%	0.417	60%	0.595	S	S	.	*			trans	-107.1	93.3	-173.1	-71.1	0	0	0	0	108.2	K406 Q410 K444	K406-T408 PolarHBondContact O-N 3.17Å; K406-T408 PolarHBondContact O-OG1 3.46Å; T408-Q410 PolarHBondContact O-N 3.27Å; T408-K444 HydrophobicContact CG2-CD 3.64Å; T408-K444 PolarHBondContact OG1-NZ 3.43Å
409	I	27.4	Very low	34.1	Very low	113 Å²	113	110.6 Å²	110.6	58%	0.579	58%	0.579	S	S	*	*			trans	-68.2	103.8	177.4	-55.8	176.3	0	0	0	108.8	V411	I409-V411 HydrophobicContact CG2-CG2 4.09Å; I409-V411 PolarHBondContact O-N 3.16Å
410	Q	28.3	Very low	35.1	Very low	170 Å²	170	107.2 Å²	107.2	79%	0.794	56%	0.559	S	S	*	*			trans	-78.8	109	163.9	-70.4	-167.8	3	0	0	108.5	T408 E412	T408-Q410 PolarHBondContact O-N 3.27Å; Q410-E412 PolarHBondContact O-N 3.32Å
411	V	34.5	Very low	36.1	Very low	27 Å²	27	102.1 Å²	102.1	16%	0.164	52%	0.524	C	S	.	.			trans	-78.6	114.2	173.1	-178	0	0	0	0	109.1	I409 C413 F416 Y443	I409-V411 HydrophobicContact CG2-CG2 4.09Å; I409-V411 PolarHBondContact O-N 3.16Å; V411-C413 PolarHBondContact O-N 2.75Å; V411-F416 HydrophobicContact CG1-CB 4.31Å; V411-F416 HydrophobicContact CG1-CD2 4.4Å; V411-Y443 HydrophobicContact CG2-CD1 3.55Å; V411-Y443 HydrophobicContact CG2-CE1 4.3Å; V411-Y443 HydrophobicContact CG2-CG 4.21Å
412	E	37.9	Very low	37.1	Very low	102 Å²	102	96.3 Å²	96.3	48%	0.477	49%	0.489	S	S	.	.			trans	-64.5	131.2	167.9	-67.1	-160.7	132.9	0	0	110.1	Q410 E414 T415	Q410-E412 PolarHBondContact O-N 3.32Å; E412-E414 PolarHBondContact O-N 3.04Å; E412-T415 PolarHBondContact O-N 2.9Å; E412-T415 VanDerWaalsContact O-N 3.17Å; E412-T415 PolarHBondContact O-OG1 2.04Å; E412-T415 VanDerWaalsContact O-OG1 3.12Å
413	C	38.9	Very low	38	Very low	21 Å²	21	95.4 Å²	95.4	14%	0.142	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-9.7	-171.3	-45.5	0	0	0	0	114.3	V411 N446 C449	V411-C413 PolarHBondContact O-N 2.75Å; C413-N446 PolarHBondContact SG-ND2 3.25Å; C413-N446 PolarHBondContact SG-OD1 3.2Å; C413-N446 VanDerWaalsContact SG-OD1 3.34Å; C413-C449 WeakPolarHBondContact CA-SG 3.45Å; C413-C449 HydrophobicContact CB-CB 4.19Å; C413-C449 WeakPolarHBondContact CB-SG 3.45Å; C413-C449 WeakPolarHBondContact SG-CA 3.43Å; C413-C449 WeakPolarHBondContact SG-CB 3.32Å; C413-C449 PolarHBondContact SG-N 2.77Å; C413-C449 CovalentContact SG-SG 2.04Å; C413-C449 PolarHBondContact SG-SG 3.34Å
414	E	39.5	Very low	38.9	Very low	128 Å²	128	95.2 Å²	95.2	60%	0.598	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-19.7	178.1	-58.1	-161.7	167.4	0	0	113.1	E412 Q674	E412-E414 PolarHBondContact O-N 3.04Å; E414-Q674 PolarHBondContact OE1-NE2 2.64Å
415	T	38.7	Very low	39.9	Very low	103 Å²	103	91.5 Å²	91.5	63%	0.632	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-20.1	175.4	62	0	0	0	0	113.4	E412 Q417	E412-T415 PolarHBondContact O-N 2.9Å; E412-T415 VanDerWaalsContact O-N 3.17Å; E412-T415 PolarHBondContact O-OG1 2.04Å; E412-T415 VanDerWaalsContact O-OG1 3.12Å; T415-Q417 PolarHBondContact O-N 3.45Å
416	F	45.2	Very low	40.7	Very low	33 Å²	33	84.2 Å²	84.2	15%	0.145	41%	0.412	C	S	.	.			trans	-69.3	117.7	-178.9	-171.5	-82.6	0	0	0	111.2	V411 P418 F421 L445 I453	V411-F416 HydrophobicContact CG1-CB 4.31Å; V411-F416 HydrophobicContact CG1-CD2 4.4Å; F416-P418 HydrophobicContact CD1-CG 4.18Å; F416-P418 HydrophobicContact CE1-CB 4.46Å; F416-P418 HydrophobicContact CE1-CG 4.32Å; F416-P418 WeakPolarHBondContact O-CD 3.16Å; F416-F421 HydrophobicContact CE1-CB 4.12Å; F416-F421 HydrophobicContact CE1-CG 4.3Å; F416-F421 HydrophobicContact CE2-CD2 4.23Å; F416-F421 HydrophobicContact CZ-CB 3.85Å; F416-F421 HydrophobicContact CZ-CD1 4.26Å; F416-F421 AromaticContact CZ-CD2 3.63Å; F416-F421 HydrophobicContact CZ-CD2 3.63Å; F416-F421 HydrophobicContact CZ-CE2 4.17Å; F416-F421 AromaticContact CZ-CG 3.68Å; F416-F421 HydrophobicContact CZ-CG 3.68Å; F416-L445 HydrophobicContact CD2-CD2 4.3Å; F416-L445 HydrophobicContact CE2-CD2 4.18Å; F416-I453 HydrophobicContact CD1-CD1 4.38Å; F416-I453 HydrophobicContact CD1-CG1 4.21Å; F416-I453 HydrophobicContact CE1-CD1 3.61Å; F416-I453 HydrophobicContact CE1-CG1 3.57Å; F416-I453 HydrophobicContact CE2-CD1 4.3Å; F416-I453 HydrophobicContact CZ-CD1 3.55Å; F416-I453 HydrophobicContact CZ-CG1 4.06Å
417	Q	52	Low	41.3	Very low	133 Å²	133	80.9 Å²	80.9	62%	0.621	40%	0.402	S	S	*	.			trans	-98.1	107.1	175.2	-67.2	-163.9	6.1	0	0	111.7	T415 N419 T420	T415-Q417 PolarHBondContact O-N 3.45Å; Q417-N419 VanDerWaalsContact C-N 3.25Å; Q417-N419 PolarHBondContact O-N 3.23Å; Q417-T420 PolarHBondContact O-N 2.98Å
418	P	49.1	Very low	42	Very low	9 Å²	9	77.3 Å²	77.3	6%	0.058	38%	0.384	C	S	.	.	H	α-helix	trans	-62.1	-31.9	-178.3	-23.6	35.4	0	0	0	113.3	F416 T420 F421 I422 Y456	F416-P418 HydrophobicContact CD1-CG 4.18Å; F416-P418 HydrophobicContact CE1-CB 4.46Å; F416-P418 HydrophobicContact CE1-CG 4.32Å; F416-P418 WeakPolarHBondContact O-CD 3.16Å; P418-T420 PolarHBondContact O-N 3.27Å; P418-F421 WeakPolarHBondContact O-CB 3.45Å; P418-F421 PolarHBondContact O-N 3.09Å; P418-F421 VanDerWaalsContact O-N 3.11Å; P418-I422 VanDerWaalsContact O-CG1 3.32Å; P418-I422 WeakPolarHBondContact O-CG1 3.33Å; P418-I422 PolarHBondContact O-N 3.24Å; P418-Y456 HydrophobicContact CB-CD1 3.44Å; P418-Y456 VanDerWaalsContact CB-CD1 3.44Å; P418-Y456 HydrophobicContact CB-CD2 3.8Å; P418-Y456 HydrophobicContact CB-CE1 3.92Å; P418-Y456 HydrophobicContact CB-CE2 4.2Å; P418-Y456 HydrophobicContact CB-CG 3.4Å; P418-Y456 VanDerWaalsContact CB-CG 3.4Å; P418-Y456 HydrophobicContact CG-CD1 4.44Å; P418-Y456 HydrophobicContact CG-CD2 4.03Å; P418-Y456 HydrophobicContact CG-CG 3.92Å
419	N	51.7	Low	42.5	Very low	83 Å²	83	80.8 Å²	80.8	44%	0.444	40%	0.395	S	S	.	.	H	α-helix	trans	-52.1	-42.7	176.5	-58.7	22.7	0	0	0	112.4	Q417 R423 Y456	Q417-N419 VanDerWaalsContact C-N 3.25Å; Q417-N419 PolarHBondContact O-N 3.23Å; N419-R423 WeakPolarHBondContact O-CG 3.49Å; N419-R423 PolarHBondContact O-N 3.41Å; N419-Y456 VanDerWaalsContact CG-OH 3.31Å; N419-Y456 VanDerWaalsContact OD1-CE2 3.23Å; N419-Y456 WeakPolarHBondContact OD1-CE2 3.43Å; N419-Y456 PolarHBondContact OD1-OH 2.93Å
420	T	49.9	Very low	42.9	Very low	61 Å²	61	80.7 Å²	80.7	37%	0.374	40%	0.396	S	S	.	.	H	α-helix	trans	-72	-39.8	-178.2	-42.9	0	0	0	0	110.3	Q417 P418 R423 Y424	Q417-T420 PolarHBondContact O-N 2.98Å; P418-T420 PolarHBondContact O-N 3.27Å; T420-R423 WeakPolarHBondContact O-CB 3.4Å; T420-R423 PolarHBondContact O-N 3.23Å; T420-Y424 HydrophobicContact CG2-CD2 4.15Å; T420-Y424 HydrophobicContact CG2-CE2 3.68Å; T420-Y424 WeakPolarHBondContact O-CD2 3.48Å; T420-Y424 PolarHBondContact O-N 3.45Å
421	F	50.7	Low	43.2	Very low	14 Å²	14	76.6 Å²	76.6	6%	0.061	38%	0.384	C	S	.	.	H	α-helix	trans	-65.9	-41.4	177.2	-171.7	-98	0	0	0	112.5	F416 P418 R423 Y424 T425 Y436 L439 I453	F416-F421 HydrophobicContact CE1-CB 4.12Å; F416-F421 HydrophobicContact CE1-CG 4.3Å; F416-F421 HydrophobicContact CE2-CD2 4.23Å; F416-F421 HydrophobicContact CZ-CB 3.85Å; F416-F421 HydrophobicContact CZ-CD1 4.26Å; F416-F421 AromaticContact CZ-CD2 3.63Å; F416-F421 HydrophobicContact CZ-CD2 3.63Å; F416-F421 HydrophobicContact CZ-CE2 4.17Å; F416-F421 AromaticContact CZ-CG 3.68Å; F416-F421 HydrophobicContact CZ-CG 3.68Å; P418-F421 WeakPolarHBondContact O-CB 3.45Å; P418-F421 PolarHBondContact O-N 3.09Å; P418-F421 VanDerWaalsContact O-N 3.11Å; F421-R423 VanDerWaalsContact C-N 3.32Å; F421-R423 PolarHBondContact O-N 2.89Å; F421-Y424 PolarHBondContact O-N 3.39Å; F421-T425 PolarHBondContact O-N 3.48Å; F421-T425 VanDerWaalsContact O-N 3.12Å; F421-T425 PolarHBondContact O-OG1 2.94Å; F421-Y436 HydrophobicContact CD1-CE2 4.48Å; F421-Y436 HydrophobicContact CE1-CD2 4.31Å; F421-Y436 AromaticContact CE1-CE2 3.34Å; F421-Y436 HydrophobicContact CE1-CE2 3.34Å; F421-Y436 AromaticContact CE1-CZ 3.62Å; F421-Y436 WeakPolarHBondContact CE1-OH 3.36Å; F421-Y436 HydrophobicContact CZ-CD2 4.12Å; F421-Y436 AromaticContact CZ-CE2 3.52Å; F421-Y436 HydrophobicContact CZ-CE2 3.52Å; F421-Y436 AromaticContact CZ-CZ 3.8Å; F421-L439 HydrophobicContact CD2-CD1 4.39Å; F421-L439 HydrophobicContact CE2-CB 4.05Å; F421-L439 HydrophobicContact CE2-CD1 3.76Å; F421-L439 HydrophobicContact CE2-CG 4.4Å; F421-L439 HydrophobicContact CZ-CD1 4.42Å; F421-I453 HydrophobicContact CD1-CG2 4.19Å; F421-I453 HydrophobicContact CE1-CG2 4.12Å
422	I	50.5	Low	43	Very low	2 Å²	2	78.7 Å²	78.7	1%	0.01	41%	0.411	C	S	.	.	H	α-helix	trans	-62.9	-39.5	172.2	-55.8	-136.1	0	0	0	111.3	P418 T425 A426 Y456 A457 H460 I492	P418-I422 VanDerWaalsContact O-CG1 3.32Å; P418-I422 WeakPolarHBondContact O-CG1 3.33Å; P418-I422 PolarHBondContact O-N 3.24Å; I422-T425 WeakPolarHBondContact CA-OG1 3.07Å; I422-T425 PolarHBondContact O-N 3.41Å; I422-T425 PolarHBondContact O-OG1 3.48Å; I422-A426 PolarHBondContact O-N 2.86Å; I422-A426 VanDerWaalsContact O-N 3.16Å; I422-Y456 HydrophobicContact CD1-CD1 3.78Å; I422-Y456 HydrophobicContact CD1-CE1 3.59Å; I422-Y456 HydrophobicContact CG1-CD1 4.19Å; I422-Y456 HydrophobicContact CG1-CE1 3.87Å; I422-A457 HydrophobicContact CD1-CB 4.47Å; I422-H460 HydrophobicContact CD1-CB 4.08Å; I422-I492 HydrophobicContact CB-CD1 3.99Å; I422-I492 HydrophobicContact CD1-CD1 3.5Å; I422-I492 HydrophobicContact CG1-CD1 3.5Å; I422-I492 VanDerWaalsContact CG1-CD1 3.5Å; I422-I492 HydrophobicContact CG2-CD1 4.13Å
423	R	48.1	Very low	43	Very low	166 Å²	166	77 Å²	77	63%	0.626	41%	0.408	S	S	*	.	H	α-helix	trans	-63.6	-46.3	175.5	-76.4	175.8	175	-174	-3.3	112.2	N419 T420 F421 T425 A426 D427	N419-R423 WeakPolarHBondContact O-CG 3.49Å; N419-R423 PolarHBondContact O-N 3.41Å; T420-R423 WeakPolarHBondContact O-CB 3.4Å; T420-R423 PolarHBondContact O-N 3.23Å; F421-R423 VanDerWaalsContact C-N 3.32Å; F421-R423 PolarHBondContact O-N 2.89Å; R423-T425 VanDerWaalsContact C-N 3.3Å; R423-T425 PolarHBondContact O-N 3.12Å; R423-A426 CarbonylContact O-C 3.58Å; R423-A426 WeakPolarHBondContact O-CA 3.48Å; R423-A426 PolarHBondContact O-N 3.15Å; R423-D427 WeakPolarHBondContact O-CB 3.06Å; R423-D427 PolarHBondContact O-N 2.78Å
424	Y	44.8	Very low	43.4	Very low	116 Å²	116	80 Å²	80	46%	0.455	42%	0.423	S	S	.	.	H	α-helix	trans	-52.4	-48	172.7	-77.5	-60.6	0	0	0	111.6	T420 F421 A426 D427 F428	T420-Y424 HydrophobicContact CG2-CD2 4.15Å; T420-Y424 HydrophobicContact CG2-CE2 3.68Å; T420-Y424 WeakPolarHBondContact O-CD2 3.48Å; T420-Y424 PolarHBondContact O-N 3.45Å; F421-Y424 PolarHBondContact O-N 3.39Å; Y424-A426 PolarHBondContact O-N 2.93Å; Y424-A426 VanDerWaalsContact O-N 3.15Å; Y424-D427 PolarHBondContact O-N 3.15Å; Y424-D427 VanDerWaalsContact O-N 3.17Å; Y424-F428 HydrophobicContact CD1-CE2 4.49Å; Y424-F428 WeakPolarHBondContact O-CD2 3.41Å; Y424-F428 PolarHBondContact O-N 3.12Å; Y424-F428 VanDerWaalsContact O-N 3.17Å
425	T	46.9	Very low	43.5	Very low	38 Å²	38	75.6 Å²	75.6	23%	0.233	41%	0.405	C	S	.	.	H	α-helix	trans	-65.8	-13.3	176.5	55.9	0	0	0	0	115.4	F421 I422 R423 Y436 I492	F421-T425 PolarHBondContact O-N 3.48Å; F421-T425 VanDerWaalsContact O-N 3.12Å; F421-T425 PolarHBondContact O-OG1 2.94Å; I422-T425 WeakPolarHBondContact CA-OG1 3.07Å; I422-T425 PolarHBondContact O-N 3.41Å; I422-T425 PolarHBondContact O-OG1 3.48Å; R423-T425 VanDerWaalsContact C-N 3.3Å; R423-T425 PolarHBondContact O-N 3.12Å; T425-Y436 HydrophobicContact CG2-CD2 4.01Å; T425-Y436 HydrophobicContact CG2-CE2 4.09Å; T425-I492 HydrophobicContact CG2-CD1 4.47Å; T425-I492 HydrophobicContact CG2-CG1 4.27Å
426	A	42.3	Very low	44	Very low	25 Å²	25	71 Å²	71	21%	0.207	38%	0.375	C	S	.	.	H	α-helix	trans	-101.6	-14.7	175.3	0	0	0	0	0	113.6	I422 R423 Y424	I422-A426 PolarHBondContact O-N 2.86Å; I422-A426 VanDerWaalsContact O-N 3.16Å; R423-A426 CarbonylContact O-C 3.58Å; R423-A426 WeakPolarHBondContact O-CA 3.48Å; R423-A426 PolarHBondContact O-N 3.15Å; Y424-A426 PolarHBondContact O-N 2.93Å; Y424-A426 VanDerWaalsContact O-N 3.15Å
427	D	39.5	Very low	44.2	Very low	97 Å²	97	72.2 Å²	72.2	52%	0.519	38%	0.384	S	S	.	.	H	α-helix	trans	-103.5	-18.6	-176.2	-74	-39.7	0	0	0	113.6	R423 Y424	R423-D427 WeakPolarHBondContact O-CB 3.06Å; R423-D427 PolarHBondContact O-N 2.78Å; Y424-D427 PolarHBondContact O-N 3.15Å; Y424-D427 VanDerWaalsContact O-N 3.17Å
428	F	41.1	Very low	43.9	Very low	114 Å²	114	69.8 Å²	69.8	50%	0.5	37%	0.374	S	S	.	.			trans	-65.8	131	173.3	-88.6	-71.7	0	0	0	112.2	Y424 T435	Y424-F428 HydrophobicContact CD1-CE2 4.49Å; Y424-F428 WeakPolarHBondContact O-CD2 3.41Å; Y424-F428 PolarHBondContact O-N 3.12Å; Y424-F428 VanDerWaalsContact O-N 3.17Å; F428-T435 HydrophobicContact CD1-CG2 4.32Å; F428-T435 HydrophobicContact CD2-CG2 4.4Å; F428-T435 HydrophobicContact CE1-CG2 4.13Å; F428-T435 HydrophobicContact CE2-CG2 4.23Å; F428-T435 HydrophobicContact CG-CG2 4.48Å; F428-T435 HydrophobicContact CZ-CG2 4.09Å
429	E	35.6	Very low	43.7	Very low	141 Å²	141	71 Å²	71	66%	0.659	38%	0.38	S	S	*	.			trans	-101.2	-2.4	-177.4	-52.2	-151.9	125.7	0	0	114.3	R537	E429-R537 IonicContact OE1-CZ 2.88Å; E429-R537 IonicContact OE1-NE 2.88Å; E429-R537 IonicContact OE1-NH2 2.64Å; E429-R537 PolarHBondContact OE1-NH2 2.89Å
430	D	36.6	Very low	43.8	Very low	111 Å²	111	68.9 Å²	68.9	59%	0.594	37%	0.368	S	S	*	.			trans	-109.4	108.3	-166.2	-151.6	-25.3	0	0	0	111.2	G432	D430-G432 PolarHBondContact O-N 3.47Å
431	P	32.9	Very low	43.9	Very low	84 Å²	84	72.8 Å²	72.8	55%	0.545	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-16.3	-165.5	31.8	-36.9	0	0	0	114.6	I544	P431-I544 HydrophobicContact CB-CD1 3.86Å; P431-I544 HydrophobicContact CB-CG1 3.83Å
432	G	32.1	Very low	43.2	Very low	71 Å²	71	77.5 Å²	77.5	73%	0.732	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-11.7	-168.8	0	0	0	0	0	115.7	D430	D430-G432 PolarHBondContact O-N 3.47Å
433	T	38.2	Very low	43	Very low	67 Å²	67	81.9 Å²	81.9	41%	0.411	42%	0.422	S	S	.	.	S	Bend	trans	-97.1	125.9	176.3	44.9	0	0	0	0	110.7	T435	T433-T435 PolarHBondContact O-N 3.47Å
434	N	45.2	Very low	43.2	Very low	84 Å²	84	80 Å²	80	45%	0.449	42%	0.419	S	S	.	.			trans	-72.4	69.3	164.6	-170.1	-7.5	0	0	0	109.1	Y436 D437 I438	N434-Y436 PolarHBondContact O-N 3.17Å; N434-Y436 VanDerWaalsContact O-N 3.16Å; N434-Y436 WeakPolarHBondContact OD1-CB 3.48Å; N434-Y436 PolarHBondContact OD1-N 3.47Å; N434-D437 HydrophobicContact CB-CB 4.06Å; N434-D437 VanDerWaalsContact CG-CB 3.45Å; N434-D437 WeakPolarHBondContact ND2-CB 3.36Å; N434-D437 PolarHBondContact ND2-OD1 2.94Å; N434-D437 WeakPolarHBondContact O-CB 2.93Å; N434-D437 PolarHBondContact O-N 2.91Å; N434-D437 VanDerWaalsContact O-N 3.13Å; N434-D437 PolarHBondContact OD1-N 2.88Å; N434-I438 WeakPolarHBondContact O-CG1 3.44Å; N434-I438 PolarHBondContact O-N 3.23Å
435	T	43.5	Very low	43.9	Very low	36 Å²	36	74.9 Å²	74.9	22%	0.221	40%	0.399	C	S	.	.	H	α-helix	trans	-54.1	-28.6	174.7	34.2	0	0	0	0	111.4	F428 T433 I438 L439	F428-T435 HydrophobicContact CD1-CG2 4.32Å; F428-T435 HydrophobicContact CD2-CG2 4.4Å; F428-T435 HydrophobicContact CE1-CG2 4.13Å; F428-T435 HydrophobicContact CE2-CG2 4.23Å; F428-T435 HydrophobicContact CG-CG2 4.48Å; F428-T435 HydrophobicContact CZ-CG2 4.09Å; T433-T435 PolarHBondContact O-N 3.47Å; T435-I438 PolarHBondContact O-N 3.18Å; T435-L439 WeakPolarHBondContact O-CB 3.44Å; T435-L439 WeakPolarHBondContact O-CD1 3.44Å; T435-L439 WeakPolarHBondContact O-CG 3.34Å; T435-L439 PolarHBondContact O-N 3.1Å
436	Y	49	Very low	44.7	Very low	5 Å²	5	76.6 Å²	76.6	2%	0.02	41%	0.407	C	S	.	.	H	α-helix	trans	-67.9	-47.9	176.2	-146.6	-93.8	0	0	0	112.8	F421 T425 N434 I438 L439 L440 I492 N495 F496	F421-Y436 HydrophobicContact CD1-CE2 4.48Å; F421-Y436 HydrophobicContact CE1-CD2 4.31Å; F421-Y436 AromaticContact CE1-CE2 3.34Å; F421-Y436 HydrophobicContact CE1-CE2 3.34Å; F421-Y436 AromaticContact CE1-CZ 3.62Å; F421-Y436 WeakPolarHBondContact CE1-OH 3.36Å; F421-Y436 HydrophobicContact CZ-CD2 4.12Å; F421-Y436 AromaticContact CZ-CE2 3.52Å; F421-Y436 HydrophobicContact CZ-CE2 3.52Å; F421-Y436 AromaticContact CZ-CZ 3.8Å; T425-Y436 HydrophobicContact CG2-CD2 4.01Å; T425-Y436 HydrophobicContact CG2-CE2 4.09Å; N434-Y436 PolarHBondContact O-N 3.17Å; N434-Y436 VanDerWaalsContact O-N 3.16Å; N434-Y436 WeakPolarHBondContact OD1-CB 3.48Å; N434-Y436 PolarHBondContact OD1-N 3.47Å; Y436-I438 VanDerWaalsContact C-N 3.29Å; Y436-I438 PolarHBondContact O-N 3.41Å; Y436-L439 PolarHBondContact O-N 3Å; Y436-L440 HydrophobicContact CD1-CD1 3.63Å; Y436-L440 HydrophobicContact CE1-CD1 3.77Å; Y436-L440 WeakPolarHBondContact O-CB 3.16Å; Y436-L440 PolarHBondContact O-N 3.28Å; Y436-I492 HydrophobicContact CE2-CG1 3.83Å; Y436-I492 WeakPolarHBondContact OH-CG2 3.31Å; Y436-N495 WeakPolarHBondContact CB-ND2 3.26Å; Y436-N495 HydrophobicContact CD1-CB 3.26Å; Y436-N495 HydrophobicContact CD2-CB 4.37Å; Y436-N495 WeakPolarHBondContact CD2-ND2 3.29Å; Y436-N495 HydrophobicContact CE1-CB 3.41Å; Y436-N495 VanDerWaalsContact CE1-CB 3.41Å; Y436-N495 HydrophobicContact CE2-CB 4.5Å; Y436-N495 HydrophobicContact CG-CB 3.76Å; Y436-F496 HydrophobicContact CE1-CE1 4.31Å; Y436-F496 HydrophobicContact CE1-CE2 4.29Å; Y436-F496 HydrophobicContact CE1-CZ 4.14Å; Y436-F496 WeakPolarHBondContact OH-CE2 3.33Å; Y436-F496 VanDerWaalsContact OH-CZ 3.29Å; Y436-F496 WeakPolarHBondContact OH-CZ 3.43Å
437	D	49.2	Very low	46	Very low	59 Å²	59	80.1 Å²	80.1	32%	0.316	42%	0.423	S	S	.	.	H	α-helix	trans	-57.3	-43.4	169.2	-106.3	31.2	0	0	0	111.5	N434 L439 L440 K441	N434-D437 HydrophobicContact CB-CB 4.06Å; N434-D437 VanDerWaalsContact CG-CB 3.45Å; N434-D437 WeakPolarHBondContact ND2-CB 3.36Å; N434-D437 PolarHBondContact ND2-OD1 2.94Å; N434-D437 WeakPolarHBondContact O-CB 2.93Å; N434-D437 PolarHBondContact O-N 2.91Å; N434-D437 VanDerWaalsContact O-N 3.13Å; N434-D437 PolarHBondContact OD1-N 2.88Å; D437-L439 VanDerWaalsContact C-N 3.34Å; D437-L439 PolarHBondContact O-N 2.75Å; D437-L440 PolarHBondContact O-N 3.01Å; D437-K441 HydrophobicContact CB-CD 4.34Å; D437-K441 WeakPolarHBondContact O-CB 3.21Å; D437-K441 WeakPolarHBondContact O-CD 3.47Å; D437-K441 WeakPolarHBondContact O-CG 3.43Å; D437-K441 PolarHBondContact O-N 3.18Å; D437-K441 WeakPolarHBondContact OD2-CE 3.26Å; D437-K441 IonicContact OD2-NZ 2.73Å; D437-K441 PolarHBondContact OD2-NZ 3.44Å
438	I	44.2	Very low	47.3	Very low	83 Å²	83	82.4 Å²	82.4	43%	0.426	43%	0.43	S	S	.	.	H	α-helix	trans	-60.6	-46.4	179.7	-67.1	167.1	0	0	0	109.5	N434 T435 Y436 K441 L442	N434-I438 WeakPolarHBondContact O-CG1 3.44Å; N434-I438 PolarHBondContact O-N 3.23Å; T435-I438 PolarHBondContact O-N 3.18Å; Y436-I438 VanDerWaalsContact C-N 3.29Å; Y436-I438 PolarHBondContact O-N 3.41Å; I438-K441 PolarHBondContact O-N 2.93Å; I438-L442 HydrophobicContact CG2-CD1 3.67Å; I438-L442 HydrophobicContact CG2-CG 4.26Å; I438-L442 VanDerWaalsContact O-CB 3.25Å; I438-L442 WeakPolarHBondContact O-CB 3.39Å; I438-L442 WeakPolarHBondContact O-CG 3.46Å; I438-L442 PolarHBondContact O-N 2.84Å
439	L	46.3	Very low	48.2	Very low	35 Å²	35	77.1 Å²	77.1	18%	0.183	41%	0.407	C	S	.	.	H	α-helix	trans	-65.8	-40.6	176.8	-67.8	163.3	0	0	0	112.4	F421 T435 Y436 D437 Y443	F421-L439 HydrophobicContact CD2-CD1 4.39Å; F421-L439 HydrophobicContact CE2-CB 4.05Å; F421-L439 HydrophobicContact CE2-CD1 3.76Å; F421-L439 HydrophobicContact CE2-CG 4.4Å; F421-L439 HydrophobicContact CZ-CD1 4.42Å; T435-L439 WeakPolarHBondContact O-CB 3.44Å; T435-L439 WeakPolarHBondContact O-CD1 3.44Å; T435-L439 WeakPolarHBondContact O-CG 3.34Å; T435-L439 PolarHBondContact O-N 3.1Å; Y436-L439 PolarHBondContact O-N 3Å; D437-L439 VanDerWaalsContact C-N 3.34Å; D437-L439 PolarHBondContact O-N 2.75Å; L439-Y443 HydrophobicContact CD2-CD2 4.23Å; L439-Y443 HydrophobicContact CD2-CE2 3.71Å; L439-Y443 WeakPolarHBondContact O-CD2 3.32Å; L439-Y443 PolarHBondContact O-N 3.39Å
440	L	53.2	Low	49.7	Very low	37 Å²	37	73.6 Å²	73.6	19%	0.194	39%	0.389	C	S	.	.	H	α-helix	trans	-63.9	-41.1	174.6	-96.5	151.1	0	0	0	112.7	Y436 D437 K444 L445 F496	Y436-L440 HydrophobicContact CD1-CD1 3.63Å; Y436-L440 HydrophobicContact CE1-CD1 3.77Å; Y436-L440 WeakPolarHBondContact O-CB 3.16Å; Y436-L440 PolarHBondContact O-N 3.28Å; D437-L440 PolarHBondContact O-N 3.01Å; L440-K444 PolarHBondContact O-N 2.77Å; L440-L445 HydrophobicContact CD2-CB 4.44Å; L440-L445 HydrophobicContact CD2-CD1 4.3Å; L440-L445 HydrophobicContact CG-CD1 4.46Å; L440-F496 HydrophobicContact CD1-CE1 4.4Å; L440-F496 HydrophobicContact CD2-CE1 4.44Å
441	K	51.4	Low	51.6	Low	144 Å²	144	74.3 Å²	74.3	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-72.8	-38.8	179	-73	163.5	178.6	166.7	0	111.9	D437 I438	D437-K441 HydrophobicContact CB-CD 4.34Å; D437-K441 WeakPolarHBondContact O-CB 3.21Å; D437-K441 WeakPolarHBondContact O-CD 3.47Å; D437-K441 WeakPolarHBondContact O-CG 3.43Å; D437-K441 PolarHBondContact O-N 3.18Å; D437-K441 WeakPolarHBondContact OD2-CE 3.26Å; D437-K441 IonicContact OD2-NZ 2.73Å; D437-K441 PolarHBondContact OD2-NZ 3.44Å; I438-K441 PolarHBondContact O-N 2.93Å
442	L	37.7	Very low	53.3	Low	113 Å²	113	74.4 Å²	74.4	59%	0.592	38%	0.38	S	S	*	.	H	α-helix	trans	-68.4	-49.7	177.5	-75.9	172.2	0	0	0	112.4	I438	I438-L442 HydrophobicContact CG2-CD1 3.67Å; I438-L442 HydrophobicContact CG2-CG 4.26Å; I438-L442 VanDerWaalsContact O-CB 3.25Å; I438-L442 WeakPolarHBondContact O-CB 3.39Å; I438-L442 WeakPolarHBondContact O-CG 3.46Å; I438-L442 PolarHBondContact O-N 2.84Å
443	Y	45.2	Very low	55.1	Low	93 Å²	93	71.1 Å²	71.1	37%	0.365	35%	0.346	S	S	.	.	H	α-helix	trans	-91.8	-0.2	-172.4	-66	-63.5	0	0	0	114.8	V411 L439 L445	V411-Y443 HydrophobicContact CG2-CD1 3.55Å; V411-Y443 HydrophobicContact CG2-CE1 4.3Å; V411-Y443 HydrophobicContact CG2-CG 4.21Å; L439-Y443 HydrophobicContact CD2-CD2 4.23Å; L439-Y443 HydrophobicContact CD2-CE2 3.71Å; L439-Y443 WeakPolarHBondContact O-CD2 3.32Å; L439-Y443 PolarHBondContact O-N 3.39Å; Y443-L445 PolarHBondContact O-N 2.72Å
444	K	52.1	Low	57.1	Low	127 Å²	127	70 Å²	70	55%	0.552	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	37.5	47.2	-177.4	-65.3	-170.5	-170	162.3	0	113.1	T408 L440 N446	T408-K444 HydrophobicContact CG2-CD 3.64Å; T408-K444 PolarHBondContact OG1-NZ 3.43Å; L440-K444 PolarHBondContact O-N 2.77Å; K444-N446 PolarHBondContact O-N 2.92Å; K444-N446 VanDerWaalsContact O-N 3.11Å
445	L	60.1	Low	58.8	Low	9 Å²	9	70.1 Å²	70.1	5%	0.047	34%	0.337	C	S	.	.			trans	-53.1	118.9	-169.6	-65.6	171.7	0	0	0	110.7	F416 L440 Y443 C449 K450 I453	F416-L445 HydrophobicContact CD2-CD2 4.3Å; F416-L445 HydrophobicContact CE2-CD2 4.18Å; L440-L445 HydrophobicContact CD2-CB 4.44Å; L440-L445 HydrophobicContact CD2-CD1 4.3Å; L440-L445 HydrophobicContact CG-CD1 4.46Å; Y443-L445 PolarHBondContact O-N 2.72Å; L445-C449 HydrophobicContact CB-CB 4.27Å; L445-C449 HydrophobicContact CD2-CB 4.23Å; L445-K450 HydrophobicContact CB-CG 4.4Å; L445-K450 WeakPolarHBondContact O-CE 3.19Å; L445-I453 HydrophobicContact CD1-CD1 3.8Å
446	N	64.4	Low	60.5	Low	74 Å²	74	70.9 Å²	70.9	40%	0.396	34%	0.336	S	S	.	.			trans	-66.3	162.2	178.4	69.4	55.4	0	0	0	110.9	C413 K444 Q448 C449 K450	C413-N446 PolarHBondContact SG-ND2 3.25Å; C413-N446 PolarHBondContact SG-OD1 3.2Å; C413-N446 VanDerWaalsContact SG-OD1 3.34Å; K444-N446 PolarHBondContact O-N 2.92Å; K444-N446 VanDerWaalsContact O-N 3.11Å; N446-Q448 PolarHBondContact O-N 2.74Å; N446-Q448 VanDerWaalsContact O-N 3.12Å; N446-Q448 WeakPolarHBondContact OD1-CA 3.27Å; N446-Q448 WeakPolarHBondContact OD1-CB 3.38Å; N446-Q448 PolarHBondContact OD1-N 3.04Å; N446-C449 WeakPolarHBondContact O-CA 3.44Å; N446-C449 WeakPolarHBondContact O-CB 3.12Å; N446-C449 PolarHBondContact O-N 2.98Å; N446-C449 PolarHBondContact OD1-N 3.42Å; N446-K450 PolarHBondContact O-N 3.14Å
447	D	69.2	Low	61.9	Low	99 Å²	99	70.7 Å²	70.7	53%	0.529	34%	0.335	S	S	.	.	H	α-helix	trans	-67	-17.2	-173.2	-60.7	-35.4	0	0	0	114.1	K450 K451	D447-K450 WeakPolarHBondContact OD1-CD 3.49Å; D447-K450 WeakPolarHBondContact OD1-CE 3.44Å; D447-K450 IonicContact OD1-NZ 3.61Å; D447-K450 PolarHBondContact OD1-NZ 3.14Å; D447-K451 WeakPolarHBondContact O-CB 3.33Å; D447-K451 WeakPolarHBondContact O-CD 3.33Å; D447-K451 VanDerWaalsContact O-CG 3.24Å; D447-K451 WeakPolarHBondContact O-CG 3.4Å; D447-K451 PolarHBondContact O-N 3.27Å; D447-K451 VanDerWaalsContact O-N 3.15Å
448	Q	65.6	Low	63.6	Low	145 Å²	145	71.6 Å²	71.6	68%	0.678	34%	0.338	S	S	*	.	H	α-helix	trans	-74.9	-41.4	170.2	177	177.4	-24.1	0	0	110.8	N446 K451 H452	N446-Q448 PolarHBondContact O-N 2.74Å; N446-Q448 VanDerWaalsContact O-N 3.12Å; N446-Q448 WeakPolarHBondContact OD1-CA 3.27Å; N446-Q448 WeakPolarHBondContact OD1-CB 3.38Å; N446-Q448 PolarHBondContact OD1-N 3.04Å; Q448-K451 PolarHBondContact O-N 3.27Å; Q448-H452 WeakPolarHBondContact O-CB 3.36Å; Q448-H452 PolarHBondContact O-N 3.3Å
449	C	61	Low	65.6	Low	2 Å²	2	74.1 Å²	74.1	1%	0.014	35%	0.347	C	S	.	.	H	α-helix	trans	-64.3	-45.3	172.5	-70.6	0	0	0	0	110.9	C413 L445 N446 K451 H452 I453	C413-C449 WeakPolarHBondContact CA-SG 3.45Å; C413-C449 HydrophobicContact CB-CB 4.19Å; C413-C449 WeakPolarHBondContact CB-SG 3.45Å; C413-C449 WeakPolarHBondContact SG-CA 3.43Å; C413-C449 WeakPolarHBondContact SG-CB 3.32Å; C413-C449 PolarHBondContact SG-N 2.77Å; C413-C449 CovalentContact SG-SG 2.04Å; C413-C449 PolarHBondContact SG-SG 3.34Å; L445-C449 HydrophobicContact CB-CB 4.27Å; L445-C449 HydrophobicContact CD2-CB 4.23Å; N446-C449 WeakPolarHBondContact O-CA 3.44Å; N446-C449 WeakPolarHBondContact O-CB 3.12Å; N446-C449 PolarHBondContact O-N 2.98Å; N446-C449 PolarHBondContact OD1-N 3.42Å; C449-K451 PolarHBondContact O-N 3.27Å; C449-H452 WeakPolarHBondContact O-CB 3.39Å; C449-H452 PolarHBondContact O-N 3.01Å; C449-H452 VanDerWaalsContact O-N 3.11Å; C449-I453 WeakPolarHBondContact O-CG1 3.48Å; C449-I453 PolarHBondContact O-N 2.97Å
450	K	67.2	Low	67.4	Low	67 Å²	67	73.3 Å²	73.3	29%	0.291	34%	0.343	S	S	.	.	H	α-helix	trans	-54.5	-51.1	174.7	-64.6	178.9	-167.8	155.5	0	111.3	L445 N446 D447 H452 I453 Q454 F496	L445-K450 HydrophobicContact CB-CG 4.4Å; L445-K450 WeakPolarHBondContact O-CE 3.19Å; N446-K450 PolarHBondContact O-N 3.14Å; D447-K450 WeakPolarHBondContact OD1-CD 3.49Å; D447-K450 WeakPolarHBondContact OD1-CE 3.44Å; D447-K450 IonicContact OD1-NZ 3.61Å; D447-K450 PolarHBondContact OD1-NZ 3.14Å; K450-H452 VanDerWaalsContact C-N 3.3Å; K450-H452 PolarHBondContact O-N 2.86Å; K450-I453 PolarHBondContact O-N 3.33Å; K450-Q454 WeakPolarHBondContact O-CG 3.34Å; K450-Q454 PolarHBondContact O-N 3.25Å; K450-F496 HydrophobicContact CB-CE1 4.16Å; K450-F496 HydrophobicContact CG-CE1 4.13Å
451	K	75.2	Confident	69.2	Low	127 Å²	127	72.2 Å²	72.2	55%	0.552	34%	0.336	S	S	*	.	H	α-helix	trans	-61.6	-34.8	176.6	-75	170.2	-177.4	170.8	0	113.1	D447 Q448 C449 N455	D447-K451 WeakPolarHBondContact O-CB 3.33Å; D447-K451 WeakPolarHBondContact O-CD 3.33Å; D447-K451 VanDerWaalsContact O-CG 3.24Å; D447-K451 WeakPolarHBondContact O-CG 3.4Å; D447-K451 PolarHBondContact O-N 3.27Å; D447-K451 VanDerWaalsContact O-N 3.15Å; Q448-K451 PolarHBondContact O-N 3.27Å; C449-K451 PolarHBondContact O-N 3.27Å; K451-N455 VanDerWaalsContact O-CB 3.29Å; K451-N455 WeakPolarHBondContact O-CB 3.44Å; K451-N455 PolarHBondContact O-N 2.8Å; K451-N455 PolarHBondContact O-ND2 3.26Å
452	H	69.2	Low	70.9	Confident	86 Å²	86	69.4 Å²	69.4	40%	0.398	33%	0.328	S	S	.	.	H	α-helix	trans	-65.4	-43.9	174.7	-174.2	78	0	0	0	111.7	Q448 C449 K450 Y456	Q448-H452 WeakPolarHBondContact O-CB 3.36Å; Q448-H452 PolarHBondContact O-N 3.3Å; C449-H452 WeakPolarHBondContact O-CB 3.39Å; C449-H452 PolarHBondContact O-N 3.01Å; C449-H452 VanDerWaalsContact O-N 3.11Å; K450-H452 VanDerWaalsContact C-N 3.3Å; K450-H452 PolarHBondContact O-N 2.86Å; H452-Y456 WeakPolarHBondContact O-CB 3.33Å; H452-Y456 PolarHBondContact O-N 3.34Å
453	I	70.9	Confident	73.3	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-69	-42.1	178.1	-55.2	163.8	0	0	0	110.8	F416 F421 L445 C449 K450 Y456 A457 I492 F496	F416-I453 HydrophobicContact CD1-CD1 4.38Å; F416-I453 HydrophobicContact CD1-CG1 4.21Å; F416-I453 HydrophobicContact CE1-CD1 3.61Å; F416-I453 HydrophobicContact CE1-CG1 3.57Å; F416-I453 HydrophobicContact CE2-CD1 4.3Å; F416-I453 HydrophobicContact CZ-CD1 3.55Å; F416-I453 HydrophobicContact CZ-CG1 4.06Å; F421-I453 HydrophobicContact CD1-CG2 4.19Å; F421-I453 HydrophobicContact CE1-CG2 4.12Å; L445-I453 HydrophobicContact CD1-CD1 3.8Å; C449-I453 WeakPolarHBondContact O-CG1 3.48Å; C449-I453 PolarHBondContact O-N 2.97Å; K450-I453 PolarHBondContact O-N 3.33Å; I453-Y456 PolarHBondContact O-N 3.08Å; I453-A457 VanDerWaalsContact O-CB 3.31Å; I453-A457 WeakPolarHBondContact O-CB 3.43Å; I453-A457 PolarHBondContact O-N 3.23Å; I453-I492 HydrophobicContact CG2-CG2 4.2Å; I453-F496 HydrophobicContact CB-CE2 3.86Å; I453-F496 HydrophobicContact CB-CZ 3.91Å; I453-F496 HydrophobicContact CD1-CZ 4.17Å; I453-F496 HydrophobicContact CG2-CE2 3.61Å; I453-F496 HydrophobicContact CG2-CZ 3.94Å
454	Q	78.7	Confident	75.2	Confident	43 Å²	43	68.3 Å²	68.3	20%	0.201	32%	0.319	C	S	.	.	H	α-helix	trans	-55.1	-56.8	172.4	-72.3	172.7	-53.8	0	0	111.1	K450 Y456 A457 E458 F496 M498	K450-Q454 WeakPolarHBondContact O-CG 3.34Å; K450-Q454 PolarHBondContact O-N 3.25Å; Q454-Y456 VanDerWaalsContact C-N 3.27Å; Q454-Y456 PolarHBondContact O-N 3.12Å; Q454-A457 PolarHBondContact O-N 3.43Å; Q454-A457 VanDerWaalsContact O-N 3.09Å; Q454-E458 PolarHBondContact O-N 3.3Å; Q454-F496 HydrophobicContact CG-CB 3.93Å; Q454-F496 HydrophobicContact CG-CD1 4.48Å; Q454-F496 HydrophobicContact CG-CD2 3.56Å; Q454-F496 HydrophobicContact CG-CE2 4.11Å; Q454-F496 HydrophobicContact CG-CG 3.77Å; Q454-M498 HydrophobicContact CB-SD 4.18Å; Q454-M498 HydrophobicContact CG-SD 3.85Å; Q454-M498 PolarHBondContact NE2-SD 2.91Å; Q454-M498 VanDerWaalsContact NE2-SD 3.44Å
455	N	81.7	Confident	76.9	Confident	87 Å²	87	63.3 Å²	63.3	47%	0.465	30%	0.297	S	S	.	.	H	α-helix	trans	-57.6	-39	178.7	-72.3	-22.6	0	0	0	112.5	K451 Q459	K451-N455 VanDerWaalsContact O-CB 3.29Å; K451-N455 WeakPolarHBondContact O-CB 3.44Å; K451-N455 PolarHBondContact O-N 2.8Å; K451-N455 PolarHBondContact O-ND2 3.26Å; N455-Q459 VanDerWaalsContact O-CG 3.31Å; N455-Q459 WeakPolarHBondContact O-CG 3.44Å; N455-Q459 PolarHBondContact O-N 3.45Å
456	Y	78.4	Confident	78.1	Confident	53 Å²	53	66.9 Å²	66.9	21%	0.208	31%	0.313	C	S	.	.	H	α-helix	trans	-66.6	-44.2	176.4	-178.9	-84.1	0	0	0	111.4	P418 N419 I422 H452 I453 Q454 Q459 H460	P418-Y456 HydrophobicContact CB-CD1 3.44Å; P418-Y456 VanDerWaalsContact CB-CD1 3.44Å; P418-Y456 HydrophobicContact CB-CD2 3.8Å; P418-Y456 HydrophobicContact CB-CE1 3.92Å; P418-Y456 HydrophobicContact CB-CE2 4.2Å; P418-Y456 HydrophobicContact CB-CG 3.4Å; P418-Y456 VanDerWaalsContact CB-CG 3.4Å; P418-Y456 HydrophobicContact CG-CD1 4.44Å; P418-Y456 HydrophobicContact CG-CD2 4.03Å; P418-Y456 HydrophobicContact CG-CG 3.92Å; N419-Y456 VanDerWaalsContact CG-OH 3.31Å; N419-Y456 VanDerWaalsContact OD1-CE2 3.23Å; N419-Y456 WeakPolarHBondContact OD1-CE2 3.43Å; N419-Y456 PolarHBondContact OD1-OH 2.93Å; I422-Y456 HydrophobicContact CD1-CD1 3.78Å; I422-Y456 HydrophobicContact CD1-CE1 3.59Å; I422-Y456 HydrophobicContact CG1-CD1 4.19Å; I422-Y456 HydrophobicContact CG1-CE1 3.87Å; H452-Y456 WeakPolarHBondContact O-CB 3.33Å; H452-Y456 PolarHBondContact O-N 3.34Å; I453-Y456 PolarHBondContact O-N 3.08Å; Q454-Y456 VanDerWaalsContact C-N 3.27Å; Q454-Y456 PolarHBondContact O-N 3.12Å; Y456-Q459 PolarHBondContact O-N 3.12Å; Y456-H460 HydrophobicContact CD1-CB 4.4Å; Y456-H460 HydrophobicContact CE1-CB 4.03Å; Y456-H460 AromaticContact CE1-CD2 3.95Å; Y456-H460 WeakPolarHBondContact O-CB 3.39Å; Y456-H460 PolarHBondContact O-N 3.12Å
457	A	79.8	Confident	79	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-68.1	-38	-179.1	0	0	0	0	0	112.4	I422 I453 Q454 Q459 H460 F461 I492 L493	I422-A457 HydrophobicContact CD1-CB 4.47Å; I453-A457 VanDerWaalsContact O-CB 3.31Å; I453-A457 WeakPolarHBondContact O-CB 3.43Å; I453-A457 PolarHBondContact O-N 3.23Å; Q454-A457 PolarHBondContact O-N 3.43Å; Q454-A457 VanDerWaalsContact O-N 3.09Å; A457-Q459 PolarHBondContact O-N 3.06Å; A457-H460 PolarHBondContact O-N 2.87Å; A457-F461 WeakPolarHBondContact O-CB 3.17Å; A457-F461 PolarHBondContact O-N 3.41Å; A457-I492 HydrophobicContact CB-CB 4.21Å; A457-I492 HydrophobicContact CB-CG2 3.35Å; A457-L493 HydrophobicContact CB-CD1 4.42Å; A457-L493 HydrophobicContact CB-CD2 3.91Å; A457-L493 HydrophobicContact CB-CG 3.88Å
458	E	84.6	Confident	79.5	Confident	79 Å²	79	61.1 Å²	61.1	37%	0.369	28%	0.281	S	S	.	.	H	α-helix	trans	-57.8	-47.2	169.5	-71.2	-170.5	157.3	0	0	111.5	Q454 H460 F461 L462 L493 M498	Q454-E458 PolarHBondContact O-N 3.3Å; E458-H460 VanDerWaalsContact C-N 3.34Å; E458-H460 PolarHBondContact O-N 3.49Å; E458-F461 PolarHBondContact O-N 2.85Å; E458-L462 WeakPolarHBondContact O-CB 3.43Å; E458-L462 VanDerWaalsContact O-CG 3.28Å; E458-L462 WeakPolarHBondContact O-CG 3.45Å; E458-L462 PolarHBondContact O-N 2.92Å; E458-L493 HydrophobicContact CG-CD1 4.19Å; E458-L493 HydrophobicContact CG-CD2 3.81Å; E458-M498 WeakPolarHBondContact OE1-CE 3.22Å
459	Q	85.6	Confident	80.3	Confident	135 Å²	135	59.1 Å²	59.1	63%	0.631	27%	0.269	S	S	*	.	H	α-helix	trans	-65.5	-36.9	177.3	-70.9	176.6	30.6	0	0	112.3	N455 Y456 A457 K463	N455-Q459 VanDerWaalsContact O-CG 3.31Å; N455-Q459 WeakPolarHBondContact O-CG 3.44Å; N455-Q459 PolarHBondContact O-N 3.45Å; Y456-Q459 PolarHBondContact O-N 3.12Å; A457-Q459 PolarHBondContact O-N 3.06Å; Q459-K463 VanDerWaalsContact O-CB 3.25Å; Q459-K463 WeakPolarHBondContact O-CB 3.41Å; Q459-K463 PolarHBondContact O-N 3.46Å
460	H	84.7	Confident	81	Confident	19 Å²	19	65.2 Å²	65.2	9%	0.088	30%	0.298	C	S	.	.	H	α-helix	trans	-66.9	-47.6	176.8	-160.8	-104	0	0	0	111	I422 Y456 A457 E458 K463 W464 Q485 A489	I422-H460 HydrophobicContact CD1-CB 4.08Å; Y456-H460 HydrophobicContact CD1-CB 4.4Å; Y456-H460 HydrophobicContact CE1-CB 4.03Å; Y456-H460 AromaticContact CE1-CD2 3.95Å; Y456-H460 WeakPolarHBondContact O-CB 3.39Å; Y456-H460 PolarHBondContact O-N 3.12Å; A457-H460 PolarHBondContact O-N 2.87Å; E458-H460 VanDerWaalsContact C-N 3.34Å; E458-H460 PolarHBondContact O-N 3.49Å; H460-K463 PolarHBondContact O-N 2.96Å; H460-W464 AromaticContact CD2-NE1 3.69Å; H460-W464 AromaticContact CE1-CD1 3.39Å; H460-W464 AromaticContact CE1-NE1 3.08Å; H460-W464 PolarHBondContact CE1-NE1 2.86Å; H460-W464 AromaticContact CG-CD1 3.91Å; H460-W464 AromaticContact ND1-CD1 3.51Å; H460-W464 AromaticContact ND1-NE1 3.68Å; H460-W464 AromaticContact NE2-CD1 3.67Å; H460-W464 AromaticContact NE2-NE1 3.02Å; H460-W464 PolarHBondContact NE2-NE1 2.99Å; H460-W464 PolarHBondContact O-N 2.97Å; H460-W464 VanDerWaalsContact O-N 3.11Å; H460-Q485 PolarHBondContact CE1-OE1 3.36Å; H460-Q485 PolarHBondContact ND1-O 2.83Å; H460-A489 HydrophobicContact CB-CB 4.19Å
461	F	89.9	Confident	81.2	Confident	13 Å²	13	66.7 Å²	66.7	6%	0.057	30%	0.302	C	S	.	.	H	α-helix	trans	-56.6	-52.5	173.2	169.8	-110.2	0	0	0	111	A457 E458 K463 W464 Y465 A486 A489 L490 Q503	A457-F461 WeakPolarHBondContact O-CB 3.17Å; A457-F461 PolarHBondContact O-N 3.41Å; E458-F461 PolarHBondContact O-N 2.85Å; F461-K463 VanDerWaalsContact C-N 3.35Å; F461-K463 PolarHBondContact O-N 3.14Å; F461-W464 PolarHBondContact O-N 3.22Å; F461-Y465 HydrophobicContact CE2-CD2 4.42Å; F461-Y465 HydrophobicContact CE2-CG 4.49Å; F461-Y465 HydrophobicContact CZ-CD2 4.05Å; F461-Y465 HydrophobicContact CZ-CG 4.06Å; F461-Y465 WeakPolarHBondContact O-CB 3.42Å; F461-Y465 PolarHBondContact O-N 2.84Å; F461-A486 HydrophobicContact CD2-CB 4.09Å; F461-A486 HydrophobicContact CE2-CB 4.34Å; F461-A489 HydrophobicContact CB-CB 3.81Å; F461-L490 HydrophobicContact CB-CD2 4.39Å; F461-L490 HydrophobicContact CD1-CD2 4.08Å; F461-L490 HydrophobicContact CD2-CD1 3.99Å; F461-L490 HydrophobicContact CD2-CD2 3.55Å; F461-L490 HydrophobicContact CD2-CG 3.61Å; F461-L490 HydrophobicContact CE1-CD2 4.29Å; F461-L490 HydrophobicContact CE2-CD1 3.69Å; F461-L490 HydrophobicContact CE2-CD2 3.8Å; F461-L490 HydrophobicContact CE2-CG 3.85Å; F461-L490 HydrophobicContact CG-CD2 3.71Å; F461-L490 HydrophobicContact CG-CG 4.24Å; F461-L490 HydrophobicContact CZ-CD1 4.38Å; F461-L490 HydrophobicContact CZ-CD2 4.16Å; F461-Q503 HydrophobicContact CE1-CB 3.93Å; F461-Q503 HydrophobicContact CE1-CG 4.27Å; F461-Q503 HydrophobicContact CZ-CB 3.9Å
462	L	87.5	Confident	80.5	Confident	86 Å²	86	67.9 Å²	67.9	45%	0.45	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-44.9	-179.5	-74.5	170.6	0	0	0	112	E458 W464 Y465 H466	E458-L462 WeakPolarHBondContact O-CB 3.43Å; E458-L462 VanDerWaalsContact O-CG 3.28Å; E458-L462 WeakPolarHBondContact O-CG 3.45Å; E458-L462 PolarHBondContact O-N 2.92Å; L462-W464 PolarHBondContact O-N 3.32Å; L462-Y465 PolarHBondContact O-N 2.88Å; L462-H466 WeakPolarHBondContact O-CB 3.43Å; L462-H466 PolarHBondContact O-CD2 3.44Å; L462-H466 VanDerWaalsContact O-CD2 3.28Å; L462-H466 PolarHBondContact O-N 3.2Å
463	K	87.4	Confident	80.1	Confident	129 Å²	129	71.8 Å²	71.8	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-56.3	-49.3	177.2	177.4	-171.9	174.8	-170.6	0	111.9	Q459 H460 F461 F467	Q459-K463 VanDerWaalsContact O-CB 3.25Å; Q459-K463 WeakPolarHBondContact O-CB 3.41Å; Q459-K463 PolarHBondContact O-N 3.46Å; H460-K463 PolarHBondContact O-N 2.96Å; F461-K463 VanDerWaalsContact C-N 3.35Å; F461-K463 PolarHBondContact O-N 3.14Å; K463-F467 PolarHBondContact O-N 3.45Å; K463-F467 VanDerWaalsContact O-N 3.13Å
464	W	86.7	Confident	80	Confident	53 Å²	53	73.6 Å²	73.6	20%	0.201	34%	0.342	C	S	.	.	H	α-helix	trans	-78.6	-33.2	-177.4	-69.2	114.9	0	0	0	112.9	H460 F461 L462 F467 V468 A482 Q485 A486	H460-W464 AromaticContact CD2-NE1 3.69Å; H460-W464 AromaticContact CE1-CD1 3.39Å; H460-W464 AromaticContact CE1-NE1 3.08Å; H460-W464 PolarHBondContact CE1-NE1 2.86Å; H460-W464 AromaticContact CG-CD1 3.91Å; H460-W464 AromaticContact ND1-CD1 3.51Å; H460-W464 AromaticContact ND1-NE1 3.68Å; H460-W464 AromaticContact NE2-CD1 3.67Å; H460-W464 AromaticContact NE2-NE1 3.02Å; H460-W464 PolarHBondContact NE2-NE1 2.99Å; H460-W464 PolarHBondContact O-N 2.97Å; H460-W464 VanDerWaalsContact O-N 3.11Å; F461-W464 PolarHBondContact O-N 3.22Å; L462-W464 PolarHBondContact O-N 3.32Å; W464-F467 HydrophobicContact CE3-CB 4.29Å; W464-F467 HydrophobicContact CE3-CG 4.3Å; W464-F467 WeakPolarHBondContact O-CB 3.45Å; W464-F467 PolarHBondContact O-N 2.61Å; W464-V468 WeakPolarHBondContact O-CG2 3.21Å; W464-V468 PolarHBondContact O-N 3.41Å; W464-A482 HydrophobicContact CE3-CB 3.57Å; W464-A482 HydrophobicContact CZ3-CB 3.96Å; W464-Q485 HydrophobicContact CB-CB 4.42Å; W464-Q485 HydrophobicContact CD2-CB 3.69Å; W464-Q485 HydrophobicContact CD2-CG 4.37Å; W464-Q485 HydrophobicContact CE3-CB 4.4Å; W464-Q485 HydrophobicContact CG-CB 3.69Å; W464-Q485 HydrophobicContact CH2-CG 4.44Å; W464-Q485 HydrophobicContact CZ2-CB 4.13Å; W464-Q485 HydrophobicContact CZ2-CG 3.97Å; W464-A486 HydrophobicContact CB-CB 3.94Å
465	Y	87.3	Confident	79.5	Confident	23 Å²	23	74.5 Å²	74.5	9%	0.09	35%	0.353	C	S	.	.	H	α-helix	trans	-58.7	-47.8	170	174.8	-101.6	0	0	0	111.8	F461 L462 F467 V468 K469 K506 L507 T510	F461-Y465 HydrophobicContact CE2-CD2 4.42Å; F461-Y465 HydrophobicContact CE2-CG 4.49Å; F461-Y465 HydrophobicContact CZ-CD2 4.05Å; F461-Y465 HydrophobicContact CZ-CG 4.06Å; F461-Y465 WeakPolarHBondContact O-CB 3.42Å; F461-Y465 PolarHBondContact O-N 2.84Å; L462-Y465 PolarHBondContact O-N 2.88Å; Y465-F467 VanDerWaalsContact C-N 3.32Å; Y465-F467 PolarHBondContact O-N 2.92Å; Y465-V468 PolarHBondContact O-N 3.44Å; Y465-K469 HydrophobicContact CE1-CD 3.82Å; Y465-K469 VanDerWaalsContact O-CB 3.24Å; Y465-K469 WeakPolarHBondContact O-CB 3.43Å; Y465-K469 PolarHBondContact O-N 3.12Å; Y465-K469 PolarHBondContact OH-NZ 3.15Å; Y465-K506 HydrophobicContact CE2-CB 4.15Å; Y465-L507 HydrophobicContact CD2-CD1 3.94Å; Y465-T510 HydrophobicContact CE2-CG2 4.35Å; Y465-T510 VanDerWaalsContact CE2-OG1 3.24Å; Y465-T510 WeakPolarHBondContact CE2-OG1 3.29Å; Y465-T510 PolarHBondContact OH-OG1 2.98Å
466	H	85.3	Confident	78.9	Confident	84 Å²	84	74.9 Å²	74.9	39%	0.389	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-39.8	173.5	-87.9	-92.4	0	0	0	111.8	L462 K469 E470	L462-H466 WeakPolarHBondContact O-CB 3.43Å; L462-H466 PolarHBondContact O-CD2 3.44Å; L462-H466 VanDerWaalsContact O-CD2 3.28Å; L462-H466 PolarHBondContact O-N 3.2Å; H466-K469 PolarHBondContact O-N 3.35Å; H466-E470 IonicContact CE1-OE1 3.13Å; H466-E470 IonicContact CG-OE1 2.66Å; H466-E470 IonicContact ND1-OE1 2.66Å; H466-E470 PolarHBondContact ND1-OE1 3.17Å; H466-E470 WeakPolarHBondContact O-CB 3.43Å; H466-E470 WeakPolarHBondContact O-CG 3.22Å; H466-E470 PolarHBondContact O-N 2.89Å
467	F	82.9	Confident	78.2	Confident	42 Å²	42	76 Å²	76	18%	0.184	36%	0.36	C	S	.	.	H	α-helix	trans	-60.5	-47.2	176.4	-167.1	-76.3	0	0	0	112.5	K463 W464 Y465 K469 R471 I474 I478 A482	K463-F467 PolarHBondContact O-N 3.45Å; K463-F467 VanDerWaalsContact O-N 3.13Å; W464-F467 HydrophobicContact CE3-CB 4.29Å; W464-F467 HydrophobicContact CE3-CG 4.3Å; W464-F467 WeakPolarHBondContact O-CB 3.45Å; W464-F467 PolarHBondContact O-N 2.61Å; Y465-F467 VanDerWaalsContact C-N 3.32Å; Y465-F467 PolarHBondContact O-N 2.92Å; F467-K469 VanDerWaalsContact C-N 3.32Å; F467-K469 PolarHBondContact O-N 2.93Å; F467-R471 WeakPolarHBondContact O-CB 3.2Å; F467-R471 PolarHBondContact O-N 3.38Å; F467-I474 HydrophobicContact CE1-CD1 3.86Å; F467-I474 HydrophobicContact CE1-CG2 4.3Å; F467-I474 HydrophobicContact CE2-CD1 4.26Å; F467-I474 HydrophobicContact CZ-CD1 3.45Å; F467-I474 VanDerWaalsContact CZ-CD1 3.45Å; F467-I478 HydrophobicContact CE1-CG2 3.8Å; F467-I478 HydrophobicContact CZ-CG2 3.76Å; F467-A482 HydrophobicContact CB-CB 4.5Å; F467-A482 HydrophobicContact CD1-CB 3.55Å; F467-A482 HydrophobicContact CE1-CB 4.11Å; F467-A482 HydrophobicContact CG-CB 4.3Å
468	V	80.6	Confident	77.7	Confident	10 Å²	10	79.6 Å²	79.6	6%	0.061	38%	0.378	C	S	.	.	H	α-helix	trans	-62	-39.6	175.2	173.1	0	0	0	0	111.3	W464 Y465 A482 F483 T510 V511	W464-V468 WeakPolarHBondContact O-CG2 3.21Å; W464-V468 PolarHBondContact O-N 3.41Å; Y465-V468 PolarHBondContact O-N 3.44Å; V468-A482 HydrophobicContact CG2-CB 3.66Å; V468-F483 HydrophobicContact CG2-CB 4.33Å; V468-T510 HydrophobicContact CG1-CG2 4.27Å; V468-V511 HydrophobicContact CG1-CG2 4.31Å
469	K	81.1	Confident	77.1	Confident	102 Å²	102	76.1 Å²	76.1	44%	0.443	36%	0.362	S	S	.	.	H	α-helix	trans	-74.2	-46	-174.7	-172.5	173.6	-166.2	160.3	0	114.4	Y465 H466 F467 T510	Y465-K469 HydrophobicContact CE1-CD 3.82Å; Y465-K469 VanDerWaalsContact O-CB 3.24Å; Y465-K469 WeakPolarHBondContact O-CB 3.43Å; Y465-K469 PolarHBondContact O-N 3.12Å; Y465-K469 PolarHBondContact OH-NZ 3.15Å; H466-K469 PolarHBondContact O-N 3.35Å; F467-K469 VanDerWaalsContact C-N 3.32Å; F467-K469 PolarHBondContact O-N 2.93Å; K469-T510 HydrophobicContact CB-CG2 3.74Å; K469-T510 HydrophobicContact CG-CG2 3.94Å
470	E	77.4	Confident	76.3	Confident	131 Å²	131	71 Å²	71	61%	0.612	34%	0.337	S	S	*	.	H	α-helix	trans	-90.2	-31.7	-167.5	-66.4	173.6	179.3	0	0	112	H466 Q472	H466-E470 IonicContact CE1-OE1 3.13Å; H466-E470 IonicContact CG-OE1 2.66Å; H466-E470 IonicContact ND1-OE1 2.66Å; H466-E470 PolarHBondContact ND1-OE1 3.17Å; H466-E470 WeakPolarHBondContact O-CB 3.43Å; H466-E470 WeakPolarHBondContact O-CG 3.22Å; H466-E470 PolarHBondContact O-N 2.89Å; E470-Q472 PolarHBondContact O-N 3.3Å
471	R	69.5	Low	75.7	Confident	97 Å²	97	73.8 Å²	73.8	37%	0.366	35%	0.353	S	S	.	.			trans	-91.9	63.4	-169	-60	-164.6	165.2	-159.8	-9.1	113.5	F467 N473 I474 K479	F467-R471 WeakPolarHBondContact O-CB 3.2Å; F467-R471 PolarHBondContact O-N 3.38Å; R471-N473 PolarHBondContact O-N 3.17Å; R471-N473 VanDerWaalsContact O-N 3.12Å; R471-I474 HydrophobicContact CB-CB 4.32Å; R471-I474 HydrophobicContact CB-CD1 3.96Å; R471-I474 HydrophobicContact CB-CG1 4.05Å; R471-I474 VanDerWaalsContact CD-CD1 3.47Å; R471-I474 HydrophobicContact CG-CD1 4.34Å; R471-I474 PolarHBondContact O-N 2.82Å; R471-K479 VanDerWaalsContact O-CE 3.3Å; R471-K479 WeakPolarHBondContact O-CE 2.97Å
472	Q	62.2	Low	75.1	Confident	152 Å²	152	73.1 Å²	73.1	71%	0.71	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-34	177.9	-64.7	-171.6	-4.8	0	0	113.7	E470 I474 K479	E470-Q472 PolarHBondContact O-N 3.3Å; Q472-I474 PolarHBondContact O-N 3.1Å; Q472-K479 PolarHBondContact O-NZ 2.91Å
473	N	60.9	Low	74.8	Confident	169 Å²	169	69.5 Å²	69.5	90%	0.904	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	4.4	-175.2	-66.6	-10.6	0	0	0	115.3	R471	R471-N473 PolarHBondContact O-N 3.17Å; R471-N473 VanDerWaalsContact O-N 3.12Å
474	I	67.5	Low	74.2	Confident	39 Å²	39	64.7 Å²	64.7	20%	0.2	31%	0.312	C	S	.	.	S	Bend	trans	-82.7	150.7	177.8	-78.8	-168.2	0	0	0	112.1	F467 R471 Q472 I478 K479	F467-I474 HydrophobicContact CE1-CD1 3.86Å; F467-I474 HydrophobicContact CE1-CG2 4.3Å; F467-I474 HydrophobicContact CE2-CD1 4.26Å; F467-I474 HydrophobicContact CZ-CD1 3.45Å; F467-I474 VanDerWaalsContact CZ-CD1 3.45Å; R471-I474 HydrophobicContact CB-CB 4.32Å; R471-I474 HydrophobicContact CB-CD1 3.96Å; R471-I474 HydrophobicContact CB-CG1 4.05Å; R471-I474 VanDerWaalsContact CD-CD1 3.47Å; R471-I474 HydrophobicContact CG-CD1 4.34Å; R471-I474 PolarHBondContact O-N 2.82Å; Q472-I474 PolarHBondContact O-N 3.1Å; I474-I478 HydrophobicContact CG2-CB 3.6Å; I474-I478 HydrophobicContact CG2-CD1 4.48Å; I474-I478 HydrophobicContact CG2-CG2 3.84Å; I474-K479 HydrophobicContact CG2-CG 4.23Å; I474-K479 VanDerWaalsContact O-CE 3.22Å; I474-K479 WeakPolarHBondContact O-CE 3.48Å; I474-K479 PolarHBondContact O-NZ 2.86Å
475	S	69.7	Low	73.9	Confident	61 Å²	61	64.3 Å²	64.3	43%	0.427	31%	0.313	S	S	.	.			trans	-58.7	151.4	176.5	56.2	0	0	0	0	112.3	E477 I478 K479	S475-E477 PolarHBondContact O-N 3.16Å; S475-I478 PolarHBondContact O-N 3.07Å; S475-I478 WeakPolarHBondContact OG-CD1 3.2Å; S475-I478 WeakPolarHBondContact OG-CG1 3.46Å; S475-K479 PolarHBondContact O-N 3.04Å
476	Q	67.6	Low	73.7	Confident	95 Å²	95	63.2 Å²	63.2	44%	0.444	31%	0.308	S	S	.	.	H	α-helix	trans	-61.9	-43.4	-175	-156.7	179	-54.1	0	0	112	I478 K479 E480	Q476-I478 VanDerWaalsContact C-N 3.28Å; Q476-I478 PolarHBondContact O-N 3.11Å; Q476-K479 CarbonylContact O-C 3.56Å; Q476-K479 WeakPolarHBondContact O-CB 3.46Å; Q476-K479 PolarHBondContact O-N 3Å; Q476-E480 HydrophobicContact CG-CG 4.35Å; Q476-E480 WeakPolarHBondContact CG-OE1 3.09Å; Q476-E480 PolarHBondContact NE2-OE1 3.27Å; Q476-E480 WeakPolarHBondContact O-CG 3.4Å; Q476-E480 PolarHBondContact O-N 3.38Å
477	E	65.1	Low	73.4	Confident	78 Å²	78	59.7 Å²	59.7	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-44.6	-50.3	173.6	-61.5	173.9	-171.2	0	0	112.4	S475 E480 D481 K532 L533	S475-E477 PolarHBondContact O-N 3.16Å; E477-E480 PolarHBondContact O-N 2.92Å; E477-D481 PolarHBondContact O-N 3.38Å; E477-K532 HydrophobicContact CG-CD 4.33Å; E477-K532 VanDerWaalsContact OE1-CD 3.26Å; E477-K532 WeakPolarHBondContact OE1-CD 3.44Å; E477-K532 IonicContact OE1-NZ 2.74Å; E477-K532 PolarHBondContact OE1-NZ 3Å; E477-K532 VanDerWaalsContact OE2-CD 3.24Å; E477-K532 WeakPolarHBondContact OE2-CD 3.4Å; E477-K532 IonicContact OE2-NZ 3.84Å; E477-K532 PolarHBondContact OE2-NZ 3.02Å; E477-L533 HydrophobicContact CB-CD1 4.2Å; E477-L533 WeakPolarHBondContact O-CD1 3.4Å
478	I	68.1	Low	73.1	Confident	74 Å²	74	58.1 Å²	58.1	38%	0.379	29%	0.287	S	S	.	.	H	α-helix	trans	-78.8	-25.2	-174.3	-55	174.1	0	0	0	111.4	F467 I474 S475 Q476 A482	F467-I478 HydrophobicContact CE1-CG2 3.8Å; F467-I478 HydrophobicContact CZ-CG2 3.76Å; I474-I478 HydrophobicContact CG2-CB 3.6Å; I474-I478 HydrophobicContact CG2-CD1 4.48Å; I474-I478 HydrophobicContact CG2-CG2 3.84Å; S475-I478 PolarHBondContact O-N 3.07Å; S475-I478 WeakPolarHBondContact OG-CD1 3.2Å; S475-I478 WeakPolarHBondContact OG-CG1 3.46Å; Q476-I478 VanDerWaalsContact C-N 3.28Å; Q476-I478 PolarHBondContact O-N 3.11Å; I478-A482 VanDerWaalsContact O-CB 3.27Å; I478-A482 WeakPolarHBondContact O-CB 3.22Å; I478-A482 PolarHBondContact O-N 3.44Å
479	K	71.4	Confident	73.2	Confident	7 Å²	7	57.7 Å²	57.7	3%	0.03	28%	0.284	C	S	.	.	H	α-helix	trans	-72.4	-36.4	169.2	-69.9	169.8	172	144.2	0	111.6	R471 Q472 I474 S475 Q476 A482 F483 F517	R471-K479 VanDerWaalsContact O-CE 3.3Å; R471-K479 WeakPolarHBondContact O-CE 2.97Å; Q472-K479 PolarHBondContact O-NZ 2.91Å; I474-K479 HydrophobicContact CG2-CG 4.23Å; I474-K479 VanDerWaalsContact O-CE 3.22Å; I474-K479 WeakPolarHBondContact O-CE 3.48Å; I474-K479 PolarHBondContact O-NZ 2.86Å; S475-K479 PolarHBondContact O-N 3.04Å; Q476-K479 CarbonylContact O-C 3.56Å; Q476-K479 WeakPolarHBondContact O-CB 3.46Å; Q476-K479 PolarHBondContact O-N 3Å; K479-A482 PolarHBondContact O-N 2.92Å; K479-F483 WeakPolarHBondContact O-CB 3.46Å; K479-F483 PolarHBondContact O-N 3.32Å; K479-F517 HydrophobicContact CB-CE2 3.91Å
480	E	69.2	Low	73.3	Confident	26 Å²	26	53 Å²	53	12%	0.121	26%	0.264	C	S	.	.	H	α-helix	trans	-68.9	-45.4	175.8	-67.8	165.9	176.9	0	0	111	Q476 E477 A482 F483 V484 F517 L533	Q476-E480 HydrophobicContact CG-CG 4.35Å; Q476-E480 WeakPolarHBondContact CG-OE1 3.09Å; Q476-E480 PolarHBondContact NE2-OE1 3.27Å; Q476-E480 WeakPolarHBondContact O-CG 3.4Å; Q476-E480 PolarHBondContact O-N 3.38Å; E477-E480 PolarHBondContact O-N 2.92Å; E480-A482 VanDerWaalsContact C-N 3.33Å; E480-A482 PolarHBondContact O-N 3.31Å; E480-F483 PolarHBondContact O-N 3.28Å; E480-F483 VanDerWaalsContact O-N 3.16Å; E480-V484 WeakPolarHBondContact O-CG2 3.41Å; E480-V484 PolarHBondContact O-N 3.49Å; E480-F517 HydrophobicContact CB-CZ 4.28Å; E480-F517 HydrophobicContact CG-CE1 4.01Å; E480-F517 HydrophobicContact CG-CE2 4.16Å; E480-F517 HydrophobicContact CG-CZ 3.41Å; E480-F517 VanDerWaalsContact CG-CZ 3.41Å; E480-L533 HydrophobicContact CB-CD1 4.37Å; E480-L533 HydrophobicContact CB-CD2 3.82Å
481	D	72.1	Confident	73.1	Confident	78 Å²	78	49.1 Å²	49.1	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-54	-49	168.9	-88.3	-25.9	0	0	0	111.3	E477 F483 V484 Q485	E477-D481 PolarHBondContact O-N 3.38Å; D481-F483 VanDerWaalsContact C-N 3.31Å; D481-F483 PolarHBondContact O-N 3.39Å; D481-V484 PolarHBondContact O-N 3.34Å; D481-Q485 WeakPolarHBondContact O-CB 3.45Å; D481-Q485 VanDerWaalsContact O-CG 3.22Å; D481-Q485 WeakPolarHBondContact O-CG 3.48Å; D481-Q485 PolarHBondContact O-N 2.83Å
482	A	78.4	Confident	73.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-36.5	178.4	0	0	0	0	0	112.8	W464 F467 V468 I478 K479 E480 A486	W464-A482 HydrophobicContact CE3-CB 3.57Å; W464-A482 HydrophobicContact CZ3-CB 3.96Å; F467-A482 HydrophobicContact CB-CB 4.5Å; F467-A482 HydrophobicContact CD1-CB 3.55Å; F467-A482 HydrophobicContact CE1-CB 4.11Å; F467-A482 HydrophobicContact CG-CB 4.3Å; V468-A482 HydrophobicContact CG2-CB 3.66Å; I478-A482 VanDerWaalsContact O-CB 3.27Å; I478-A482 WeakPolarHBondContact O-CB 3.22Å; I478-A482 PolarHBondContact O-N 3.44Å; K479-A482 PolarHBondContact O-N 2.92Å; E480-A482 VanDerWaalsContact C-N 3.33Å; E480-A482 PolarHBondContact O-N 3.31Å; A482-A486 WeakPolarHBondContact O-CB 3.41Å; A482-A486 PolarHBondContact O-N 3.43Å
483	F	79.9	Confident	74	Confident	9 Å²	9	37.3 Å²	37.3	4%	0.039	20%	0.198	C	C	.	.	H	α-helix	trans	-67.4	-42.4	174.5	174.3	-100.9	0	0	0	111.9	V468 K479 E480 D481 A486 L487 L507 V511 L538	V468-F483 HydrophobicContact CG2-CB 4.33Å; K479-F483 WeakPolarHBondContact O-CB 3.46Å; K479-F483 PolarHBondContact O-N 3.32Å; E480-F483 PolarHBondContact O-N 3.28Å; E480-F483 VanDerWaalsContact O-N 3.16Å; D481-F483 VanDerWaalsContact C-N 3.31Å; D481-F483 PolarHBondContact O-N 3.39Å; F483-A486 PolarHBondContact O-N 3.34Å; F483-L487 HydrophobicContact CD1-CD1 4Å; F483-L487 HydrophobicContact CE1-CD1 3.43Å; F483-L487 VanDerWaalsContact CE1-CD1 3.43Å; F483-L487 HydrophobicContact CE1-CG 4.22Å; F483-L487 HydrophobicContact CE2-CD1 4.45Å; F483-L487 HydrophobicContact CE2-CG 4.48Å; F483-L487 HydrophobicContact CZ-CD1 3.7Å; F483-L487 HydrophobicContact CZ-CG 4.18Å; F483-L487 WeakPolarHBondContact O-CG 3.36Å; F483-L487 PolarHBondContact O-N 3.3Å; F483-L507 HydrophobicContact CD2-CD1 4.08Å; F483-L507 HydrophobicContact CD2-CD2 3.74Å; F483-L507 HydrophobicContact CD2-CG 3.75Å; F483-L507 HydrophobicContact CE2-CD2 3.63Å; F483-L507 HydrophobicContact CE2-CG 3.7Å; F483-V511 HydrophobicContact CD2-CG2 3.52Å; F483-V511 HydrophobicContact CE2-CG2 3.65Å; F483-V511 HydrophobicContact CG-CG2 4.45Å; F483-L538 HydrophobicContact CD1-CD2 3.86Å; F483-L538 HydrophobicContact CE1-CD2 3.66Å
484	V	76	Confident	74.6	Confident	28 Å²	28	30.6 Å²	30.6	17%	0.17	16%	0.164	C	C	.	.	H	α-helix	trans	-64.4	-41.3	174.9	172.4	0	0	0	0	111.5	E480 D481 A486 L487 S488 L538 I541	E480-V484 WeakPolarHBondContact O-CG2 3.41Å; E480-V484 PolarHBondContact O-N 3.49Å; D481-V484 PolarHBondContact O-N 3.34Å; V484-A486 VanDerWaalsContact C-N 3.31Å; V484-A486 PolarHBondContact O-N 3.41Å; V484-L487 PolarHBondContact O-N 3.06Å; V484-S488 PolarHBondContact O-N 3Å; V484-S488 PolarHBondContact O-OG 3.29Å; V484-L538 HydrophobicContact CG2-CD2 4.15Å; V484-L538 HydrophobicContact CG2-CG 4.26Å; V484-I541 HydrophobicContact CG1-CD1 4.43Å
485	Q	78.9	Confident	74.7	Confident	46 Å²	46	30.9 Å²	30.9	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-69.9	-25	176.3	-65.3	-70.7	-41.4	0	0	113.4	H460 W464 D481 S488	H460-Q485 PolarHBondContact CE1-OE1 3.36Å; H460-Q485 PolarHBondContact ND1-O 2.83Å; W464-Q485 HydrophobicContact CB-CB 4.42Å; W464-Q485 HydrophobicContact CD2-CB 3.69Å; W464-Q485 HydrophobicContact CD2-CG 4.37Å; W464-Q485 HydrophobicContact CE3-CB 4.4Å; W464-Q485 HydrophobicContact CG-CB 3.69Å; W464-Q485 HydrophobicContact CH2-CG 4.44Å; W464-Q485 HydrophobicContact CZ2-CB 4.13Å; W464-Q485 HydrophobicContact CZ2-CG 3.97Å; D481-Q485 WeakPolarHBondContact O-CB 3.45Å; D481-Q485 VanDerWaalsContact O-CG 3.22Å; D481-Q485 WeakPolarHBondContact O-CG 3.48Å; D481-Q485 PolarHBondContact O-N 2.83Å; Q485-S488 PolarHBondContact O-OG 3.05Å
486	A	83	Confident	74.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-74.8	-42.6	168.5	0	0	0	0	0	111.3	F461 W464 A482 F483 V484 A489 L490 L507	F461-A486 HydrophobicContact CD2-CB 4.09Å; F461-A486 HydrophobicContact CE2-CB 4.34Å; W464-A486 HydrophobicContact CB-CB 3.94Å; A482-A486 WeakPolarHBondContact O-CB 3.41Å; A482-A486 PolarHBondContact O-N 3.43Å; F483-A486 PolarHBondContact O-N 3.34Å; V484-A486 VanDerWaalsContact C-N 3.31Å; V484-A486 PolarHBondContact O-N 3.41Å; A486-A489 PolarHBondContact O-N 3.43Å; A486-L490 WeakPolarHBondContact O-CG 3.45Å; A486-L490 PolarHBondContact O-N 3.39Å; A486-L507 HydrophobicContact CB-CD1 3.92Å; A486-L507 HydrophobicContact CB-CD2 4.05Å
487	L	79.2	Confident	74.7	Confident	10 Å²	10	31.7 Å²	31.7	5%	0.052	17%	0.167	C	C	.	.	H	α-helix	trans	-62.8	-46.2	177.1	-77.3	179.3	0	0	0	112.7	F483 V484 A489 L490 T491 L507 I541 I545	F483-L487 HydrophobicContact CD1-CD1 4Å; F483-L487 HydrophobicContact CE1-CD1 3.43Å; F483-L487 VanDerWaalsContact CE1-CD1 3.43Å; F483-L487 HydrophobicContact CE1-CG 4.22Å; F483-L487 HydrophobicContact CE2-CD1 4.45Å; F483-L487 HydrophobicContact CE2-CG 4.48Å; F483-L487 HydrophobicContact CZ-CD1 3.7Å; F483-L487 HydrophobicContact CZ-CG 4.18Å; F483-L487 WeakPolarHBondContact O-CG 3.36Å; F483-L487 PolarHBondContact O-N 3.3Å; V484-L487 PolarHBondContact O-N 3.06Å; L487-A489 PolarHBondContact O-N 3.02Å; L487-L490 CarbonylContact O-C 3.49Å; L487-L490 WeakPolarHBondContact O-CA 3.47Å; L487-L490 WeakPolarHBondContact O-CB 3.1Å; L487-L490 PolarHBondContact O-N 3.16Å; L487-T491 PolarHBondContact O-N 2.87Å; L487-T491 PolarHBondContact O-OG1 3.48Å; L487-L507 HydrophobicContact CD2-CD2 3.72Å; L487-L507 HydrophobicContact CG-CD2 3.96Å; L487-I541 HydrophobicContact CD1-CG2 3.89Å; L487-I545 HydrophobicContact CD1-CD1 4.43Å; L487-I545 HydrophobicContact CD2-CD1 4.08Å
488	S	77.7	Confident	75.2	Confident	9 Å²	9	30.2 Å²	30.2	6%	0.063	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-35.2	-180	62.7	0	0	0	0	112.7	V484 Q485 T491 I492	V484-S488 PolarHBondContact O-N 3Å; V484-S488 PolarHBondContact O-OG 3.29Å; Q485-S488 PolarHBondContact O-OG 3.05Å; S488-T491 PolarHBondContact O-N 3.1Å; S488-I492 WeakPolarHBondContact O-CG1 3.5Å; S488-I492 PolarHBondContact O-N 3.01Å; S488-I492 VanDerWaalsContact O-N 3.09Å
489	A	81.3	Confident	75.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-35.1	172.3	0	0	0	0	0	112.8	H460 F461 A486 L487 L493	H460-A489 HydrophobicContact CB-CB 4.19Å; F461-A489 HydrophobicContact CB-CB 3.81Å; A486-A489 PolarHBondContact O-N 3.43Å; L487-A489 PolarHBondContact O-N 3.02Å; A489-L493 VanDerWaalsContact O-CG 3.3Å; A489-L493 WeakPolarHBondContact O-CG 3.46Å; A489-L493 PolarHBondContact O-N 3.13Å
490	L	83.6	Confident	76	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-71.5	-38.5	173.2	-63.9	179.8	0	0	0	112.2	F461 A486 L487 I492 L493 S494 V500 Q503 I504 L507	F461-L490 HydrophobicContact CB-CD2 4.39Å; F461-L490 HydrophobicContact CD1-CD2 4.08Å; F461-L490 HydrophobicContact CD2-CD1 3.99Å; F461-L490 HydrophobicContact CD2-CD2 3.55Å; F461-L490 HydrophobicContact CD2-CG 3.61Å; F461-L490 HydrophobicContact CE1-CD2 4.29Å; F461-L490 HydrophobicContact CE2-CD1 3.69Å; F461-L490 HydrophobicContact CE2-CD2 3.8Å; F461-L490 HydrophobicContact CE2-CG 3.85Å; F461-L490 HydrophobicContact CG-CD2 3.71Å; F461-L490 HydrophobicContact CG-CG 4.24Å; F461-L490 HydrophobicContact CZ-CD1 4.38Å; F461-L490 HydrophobicContact CZ-CD2 4.16Å; A486-L490 WeakPolarHBondContact O-CG 3.45Å; A486-L490 PolarHBondContact O-N 3.39Å; L487-L490 CarbonylContact O-C 3.49Å; L487-L490 WeakPolarHBondContact O-CA 3.47Å; L487-L490 WeakPolarHBondContact O-CB 3.1Å; L487-L490 PolarHBondContact O-N 3.16Å; L490-I492 VanDerWaalsContact C-N 3.29Å; L490-I492 PolarHBondContact O-N 3.23Å; L490-L493 HydrophobicContact CD2-CD1 4.31Å; L490-L493 PolarHBondContact O-N 3.48Å; L490-S494 WeakPolarHBondContact O-CB 3.43Å; L490-S494 PolarHBondContact O-N 2.91Å; L490-V500 HydrophobicContact CB-CG1 4.49Å; L490-V500 HydrophobicContact CD2-CB 4.37Å; L490-V500 HydrophobicContact CD2-CG1 4.22Å; L490-Q503 HydrophobicContact CD1-CB 4.31Å; L490-Q503 HydrophobicContact CD2-CB 3.61Å; L490-Q503 HydrophobicContact CD2-CG 4.44Å; L490-I504 HydrophobicContact CD1-CG1 3.75Å; L490-L507 HydrophobicContact CD1-CD2 4.34Å
491	T	73.7	Confident	76.3	Confident	50 Å²	50	35 Å²	35	31%	0.307	19%	0.189	S	C	.	.	H	α-helix	trans	-57.7	-44.3	173.1	-52.9	0	0	0	0	111	L487 S488 L493 S494 N495	L487-T491 PolarHBondContact O-N 2.87Å; L487-T491 PolarHBondContact O-OG1 3.48Å; S488-T491 PolarHBondContact O-N 3.1Å; T491-L493 PolarHBondContact O-N 3.38Å; T491-S494 PolarHBondContact O-N 3.08Å; T491-N495 PolarHBondContact O-N 2.97Å; T491-N495 PolarHBondContact O-ND2 3.32Å; T491-N495 PolarHBondContact O-OD1 3.33Å
492	I	72.8	Confident	76.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.4	-44.6	174.3	-80.2	160	0	0	0	112.8	I422 T425 Y436 I453 A457 S488 L490 N495 F496	I422-I492 HydrophobicContact CB-CD1 3.99Å; I422-I492 HydrophobicContact CD1-CD1 3.5Å; I422-I492 HydrophobicContact CG1-CD1 3.5Å; I422-I492 VanDerWaalsContact CG1-CD1 3.5Å; I422-I492 HydrophobicContact CG2-CD1 4.13Å; T425-I492 HydrophobicContact CG2-CD1 4.47Å; T425-I492 HydrophobicContact CG2-CG1 4.27Å; Y436-I492 HydrophobicContact CE2-CG1 3.83Å; Y436-I492 WeakPolarHBondContact OH-CG2 3.31Å; I453-I492 HydrophobicContact CG2-CG2 4.2Å; A457-I492 HydrophobicContact CB-CB 4.21Å; A457-I492 HydrophobicContact CB-CG2 3.35Å; S488-I492 WeakPolarHBondContact O-CG1 3.5Å; S488-I492 PolarHBondContact O-N 3.01Å; S488-I492 VanDerWaalsContact O-N 3.09Å; L490-I492 VanDerWaalsContact C-N 3.29Å; L490-I492 PolarHBondContact O-N 3.23Å; I492-N495 PolarHBondContact O-N 3.49Å; I492-F496 HydrophobicContact CG2-CD2 4.34Å; I492-F496 HydrophobicContact CG2-CE2 4.13Å; I492-F496 WeakPolarHBondContact O-CD2 3.48Å; I492-F496 PolarHBondContact O-N 3.05Å
493	L	78	Confident	76.8	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-40.4	-179.7	-69	165.6	0	0	0	111.6	A457 E458 A489 L490 T491 N495 F496 M498 V500	A457-L493 HydrophobicContact CB-CD1 4.42Å; A457-L493 HydrophobicContact CB-CD2 3.91Å; A457-L493 HydrophobicContact CB-CG 3.88Å; E458-L493 HydrophobicContact CG-CD1 4.19Å; E458-L493 HydrophobicContact CG-CD2 3.81Å; A489-L493 VanDerWaalsContact O-CG 3.3Å; A489-L493 WeakPolarHBondContact O-CG 3.46Å; A489-L493 PolarHBondContact O-N 3.13Å; L490-L493 HydrophobicContact CD2-CD1 4.31Å; L490-L493 PolarHBondContact O-N 3.48Å; T491-L493 PolarHBondContact O-N 3.38Å; L493-N495 VanDerWaalsContact C-N 3.31Å; L493-N495 PolarHBondContact O-N 2.78Å; L493-F496 PolarHBondContact O-N 3.03Å; L493-M498 HydrophobicContact CB-CB 4.4Å; L493-M498 HydrophobicContact CD2-CE 4.23Å; L493-M498 HydrophobicContact CD2-SD 3.57Å; L493-M498 VanDerWaalsContact CD2-SD 3.57Å; L493-M498 VanDerWaalsContact O-CB 3.32Å; L493-M498 WeakPolarHBondContact O-CB 3.43Å; L493-M498 PolarHBondContact O-N 3.33Å; L493-V500 HydrophobicContact CB-CG1 3.67Å
494	S	74.3	Confident	76.7	Confident	27 Å²	27	38.5 Å²	38.5	19%	0.189	21%	0.206	C	C	.	.	H	α-helix	trans	-56.4	-45.9	173.9	-163.9	0	0	0	0	111.4	L490 T491 F496 N497	L490-S494 WeakPolarHBondContact O-CB 3.43Å; L490-S494 PolarHBondContact O-N 2.91Å; T491-S494 PolarHBondContact O-N 3.08Å; S494-F496 PolarHBondContact O-N 3.33Å; S494-F496 VanDerWaalsContact O-N 3.08Å; S494-N497 WeakPolarHBondContact O-CA 3.46Å; S494-N497 PolarHBondContact O-N 2.81Å
495	N	68.8	Low	76.8	Confident	46 Å²	46	42.7 Å²	42.7	25%	0.246	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-2.6	178.5	-60.5	-11.5	0	0	0	114.3	Y436 T491 I492 L493	Y436-N495 WeakPolarHBondContact CB-ND2 3.26Å; Y436-N495 HydrophobicContact CD1-CB 3.26Å; Y436-N495 HydrophobicContact CD2-CB 4.37Å; Y436-N495 WeakPolarHBondContact CD2-ND2 3.29Å; Y436-N495 HydrophobicContact CE1-CB 3.41Å; Y436-N495 VanDerWaalsContact CE1-CB 3.41Å; Y436-N495 HydrophobicContact CE2-CB 4.5Å; Y436-N495 HydrophobicContact CG-CB 3.76Å; T491-N495 PolarHBondContact O-N 2.97Å; T491-N495 PolarHBondContact O-ND2 3.32Å; T491-N495 PolarHBondContact O-OD1 3.33Å; I492-N495 PolarHBondContact O-N 3.49Å; L493-N495 VanDerWaalsContact C-N 3.31Å; L493-N495 PolarHBondContact O-N 2.78Å
496	F	69.2	Low	76.9	Confident	27 Å²	27	44.5 Å²	44.5	12%	0.118	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	22.2	165.9	-71.4	-60.6	0	0	0	112.5	Y436 L440 K450 I453 Q454 I492 L493 S494 M498	Y436-F496 HydrophobicContact CE1-CE1 4.31Å; Y436-F496 HydrophobicContact CE1-CE2 4.29Å; Y436-F496 HydrophobicContact CE1-CZ 4.14Å; Y436-F496 WeakPolarHBondContact OH-CE2 3.33Å; Y436-F496 VanDerWaalsContact OH-CZ 3.29Å; Y436-F496 WeakPolarHBondContact OH-CZ 3.43Å; L440-F496 HydrophobicContact CD1-CE1 4.4Å; L440-F496 HydrophobicContact CD2-CE1 4.44Å; K450-F496 HydrophobicContact CB-CE1 4.16Å; K450-F496 HydrophobicContact CG-CE1 4.13Å; I453-F496 HydrophobicContact CB-CE2 3.86Å; I453-F496 HydrophobicContact CB-CZ 3.91Å; I453-F496 HydrophobicContact CD1-CZ 4.17Å; I453-F496 HydrophobicContact CG2-CE2 3.61Å; I453-F496 HydrophobicContact CG2-CZ 3.94Å; Q454-F496 HydrophobicContact CG-CB 3.93Å; Q454-F496 HydrophobicContact CG-CD1 4.48Å; Q454-F496 HydrophobicContact CG-CD2 3.56Å; Q454-F496 HydrophobicContact CG-CE2 4.11Å; Q454-F496 HydrophobicContact CG-CG 3.77Å; I492-F496 HydrophobicContact CG2-CD2 4.34Å; I492-F496 HydrophobicContact CG2-CE2 4.13Å; I492-F496 WeakPolarHBondContact O-CD2 3.48Å; I492-F496 PolarHBondContact O-N 3.05Å; L493-F496 PolarHBondContact O-N 3.03Å; S494-F496 PolarHBondContact O-N 3.33Å; S494-F496 VanDerWaalsContact O-N 3.08Å; F496-M498 HydrophobicContact CB-CG 4.34Å; F496-M498 PolarHBondContact O-N 3.49Å
497	N	68.8	Low	76.7	Confident	145 Å²	145	44.6 Å²	44.6	78%	0.775	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	30.4	-176.7	-63.7	-4.7	0	0	0	113.7	S494	S494-N497 WeakPolarHBondContact O-CA 3.46Å; S494-N497 PolarHBondContact O-N 2.81Å
498	M	74	Confident	76.5	Confident	48 Å²	48	48.4 Å²	48.4	24%	0.236	25%	0.246	C	C	.	.			trans	-89.1	133.7	173	-56.2	-174.3	62.1	0	0	109.7	Q454 E458 L493 F496 V500	Q454-M498 HydrophobicContact CB-SD 4.18Å; Q454-M498 HydrophobicContact CG-SD 3.85Å; Q454-M498 PolarHBondContact NE2-SD 2.91Å; Q454-M498 VanDerWaalsContact NE2-SD 3.44Å; E458-M498 WeakPolarHBondContact OE1-CE 3.22Å; L493-M498 HydrophobicContact CB-CB 4.4Å; L493-M498 HydrophobicContact CD2-CE 4.23Å; L493-M498 HydrophobicContact CD2-SD 3.57Å; L493-M498 VanDerWaalsContact CD2-SD 3.57Å; L493-M498 VanDerWaalsContact O-CB 3.32Å; L493-M498 WeakPolarHBondContact O-CB 3.43Å; L493-M498 PolarHBondContact O-N 3.33Å; F496-M498 HydrophobicContact CB-CG 4.34Å; F496-M498 PolarHBondContact O-N 3.49Å; M498-V500 PolarHBondContact O-N 2.83Å; M498-V500 VanDerWaalsContact O-N 3.14Å
499	N	76	Confident	76.4	Confident	101 Å²	101	52.1 Å²	52.1	54%	0.54	26%	0.262	S	S	.	.			trans	-65.9	116.6	173.1	-175.1	-65.6	0	0	0	109.6	D501 Q503	N499-D501 PolarHBondContact ND2-OD2 2.73Å; N499-D501 PolarHBondContact OD1-N 3.06Å; N499-D501 VanDerWaalsContact OD1-N 3.12Å; N499-D501 PolarHBondContact OD1-OD2 3.36Å; N499-Q503 PolarHBondContact O-NE2 3.04Å
500	V	81.7	Confident	76	Confident	5 Å²	5	52.7 Å²	52.7	3%	0.03	27%	0.266	C	S	.	.			trans	-107.8	-4.3	178.9	-68.9	0	0	0	0	113.1	L490 L493 M498 D502 Q503 I504	L490-V500 HydrophobicContact CB-CG1 4.49Å; L490-V500 HydrophobicContact CD2-CB 4.37Å; L490-V500 HydrophobicContact CD2-CG1 4.22Å; L493-V500 HydrophobicContact CB-CG1 3.67Å; M498-V500 PolarHBondContact O-N 2.83Å; M498-V500 VanDerWaalsContact O-N 3.14Å; V500-D502 VanDerWaalsContact C-N 3.26Å; V500-D502 PolarHBondContact O-N 2.82Å; V500-Q503 CarbonylContact O-C 3.44Å; V500-Q503 WeakPolarHBondContact O-CA 3.5Å; V500-Q503 WeakPolarHBondContact O-CB 3.33Å; V500-Q503 PolarHBondContact O-N 2.91Å; V500-I504 HydrophobicContact CB-CD1 4.34Å; V500-I504 HydrophobicContact CB-CG1 4.42Å; V500-I504 HydrophobicContact CG2-CD1 3.73Å; V500-I504 HydrophobicContact CG2-CG1 4.34Å; V500-I504 WeakPolarHBondContact O-CG1 3.32Å; V500-I504 PolarHBondContact O-N 3.02Å
501	D	75.2	Confident	75.2	Confident	100 Å²	100	52.7 Å²	52.7	54%	0.535	27%	0.266	S	S	.	.	H	α-helix	trans	-54.7	-45	-173.5	-48.3	-25.5	0	0	0	111.4	N499 Q503 I504 K505	N499-D501 PolarHBondContact ND2-OD2 2.73Å; N499-D501 PolarHBondContact OD1-N 3.06Å; N499-D501 VanDerWaalsContact OD1-N 3.12Å; N499-D501 PolarHBondContact OD1-OD2 3.36Å; D501-Q503 PolarHBondContact O-N 3.29Å; D501-I504 PolarHBondContact O-N 3.45Å; D501-K505 WeakPolarHBondContact O-CB 3.49Å; D501-K505 PolarHBondContact O-N 3.34Å
502	D	78.3	Confident	74.8	Confident	89 Å²	89	58.2 Å²	58.2	48%	0.476	29%	0.286	S	S	.	.	H	α-helix	trans	-65.2	-25.4	179.9	-146.1	42.7	0	0	0	112.3	V500 K506	V500-D502 VanDerWaalsContact C-N 3.26Å; V500-D502 PolarHBondContact O-N 2.82Å; D502-K506 WeakPolarHBondContact O-CD 3.39Å; D502-K506 VanDerWaalsContact O-CE 3.23Å; D502-K506 WeakPolarHBondContact O-CE 3.4Å; D502-K506 WeakPolarHBondContact O-CG 3.25Å; D502-K506 PolarHBondContact O-N 2.76Å; D502-K506 WeakPolarHBondContact OD2-CE 3.21Å; D502-K506 IonicContact OD2-NZ 2.65Å; D502-K506 PolarHBondContact OD2-NZ 2.87Å
503	Q	82.1	Confident	74.2	Confident	42 Å²	42	65 Å²	65	20%	0.196	32%	0.317	C	S	.	.	H	α-helix	trans	-91.9	-41.7	-177.6	-55.9	157	33.7	0	0	110.5	F461 L490 N499 V500 D501 K505 K506 L507	F461-Q503 HydrophobicContact CE1-CB 3.93Å; F461-Q503 HydrophobicContact CE1-CG 4.27Å; F461-Q503 HydrophobicContact CZ-CB 3.9Å; L490-Q503 HydrophobicContact CD1-CB 4.31Å; L490-Q503 HydrophobicContact CD2-CB 3.61Å; L490-Q503 HydrophobicContact CD2-CG 4.44Å; N499-Q503 PolarHBondContact O-NE2 3.04Å; V500-Q503 CarbonylContact O-C 3.44Å; V500-Q503 WeakPolarHBondContact O-CA 3.5Å; V500-Q503 WeakPolarHBondContact O-CB 3.33Å; V500-Q503 PolarHBondContact O-N 2.91Å; D501-Q503 PolarHBondContact O-N 3.29Å; Q503-K505 VanDerWaalsContact C-N 3.28Å; Q503-K505 PolarHBondContact O-N 3.07Å; Q503-K506 PolarHBondContact O-N 3.28Å; Q503-L507 WeakPolarHBondContact O-CB 3.25Å; Q503-L507 PolarHBondContact O-N 3.49Å
504	I	77.3	Confident	73.2	Confident	30 Å²	30	66.4 Å²	66.4	15%	0.154	33%	0.328	C	S	.	.	H	α-helix	trans	-56.1	-44.8	166.5	-67.1	175	0	0	0	109.7	L490 V500 D501 L507 K508	L490-I504 HydrophobicContact CD1-CG1 3.75Å; V500-I504 HydrophobicContact CB-CD1 4.34Å; V500-I504 HydrophobicContact CB-CG1 4.42Å; V500-I504 HydrophobicContact CG2-CD1 3.73Å; V500-I504 HydrophobicContact CG2-CG1 4.34Å; V500-I504 WeakPolarHBondContact O-CG1 3.32Å; V500-I504 PolarHBondContact O-N 3.02Å; D501-I504 PolarHBondContact O-N 3.45Å; I504-L507 PolarHBondContact O-N 2.92Å; I504-K508 HydrophobicContact CG2-CD 3.84Å; I504-K508 VanDerWaalsContact CG2-CE 3.45Å; I504-K508 HydrophobicContact CG2-CG 4.36Å; I504-K508 WeakPolarHBondContact O-CB 3.24Å; I504-K508 VanDerWaalsContact O-CG 3.32Å; I504-K508 WeakPolarHBondContact O-CG 3.38Å; I504-K508 PolarHBondContact O-N 3.2Å
505	K	78.4	Confident	71.7	Confident	116 Å²	116	72.9 Å²	72.9	50%	0.504	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-50.6	176.3	-177.9	175.1	176.9	-179.1	0	111.9	D501 Q503 L507 K508 E509	D501-K505 WeakPolarHBondContact O-CB 3.49Å; D501-K505 PolarHBondContact O-N 3.34Å; Q503-K505 VanDerWaalsContact C-N 3.28Å; Q503-K505 PolarHBondContact O-N 3.07Å; K505-L507 VanDerWaalsContact C-N 3.27Å; K505-L507 PolarHBondContact O-N 2.78Å; K505-K508 PolarHBondContact O-N 3.15Å; K505-E509 WeakPolarHBondContact CE-OE1 3.33Å; K505-E509 HydrophobicContact CG-CG 4.46Å; K505-E509 WeakPolarHBondContact CG-OE1 3.35Å; K505-E509 WeakPolarHBondContact O-CB 3.31Å; K505-E509 WeakPolarHBondContact O-CG 3.36Å; K505-E509 PolarHBondContact O-N 3.12Å
506	K	80.8	Confident	70.7	Confident	85 Å²	85	76.1 Å²	76.1	37%	0.37	37%	0.374	S	S	.	.	H	α-helix	trans	-57.1	-39.4	175.4	-74.1	158.7	-160	156.2	0	112.1	Y465 D502 Q503 T510	Y465-K506 HydrophobicContact CE2-CB 4.15Å; D502-K506 WeakPolarHBondContact O-CD 3.39Å; D502-K506 VanDerWaalsContact O-CE 3.23Å; D502-K506 WeakPolarHBondContact O-CE 3.4Å; D502-K506 WeakPolarHBondContact O-CG 3.25Å; D502-K506 PolarHBondContact O-N 2.76Å; D502-K506 WeakPolarHBondContact OD2-CE 3.21Å; D502-K506 IonicContact OD2-NZ 2.65Å; D502-K506 PolarHBondContact OD2-NZ 2.87Å; Q503-K506 PolarHBondContact O-N 3.28Å; K506-T510 VanDerWaalsContact O-CB 3.31Å; K506-T510 WeakPolarHBondContact O-CB 3.45Å; K506-T510 PolarHBondContact O-N 3.28Å; K506-T510 PolarHBondContact O-OG1 2.99Å
507	L	80.3	Confident	69.5	Low	1 Å²	1	75.9 Å²	75.9	1%	0.005	37%	0.372	C	S	.	.	H	α-helix	trans	-67.9	-50	176.9	-168	70	0	0	0	111.3	Y465 F483 A486 L487 L490 Q503 I504 K505 E509 T510 V511	Y465-L507 HydrophobicContact CD2-CD1 3.94Å; F483-L507 HydrophobicContact CD2-CD1 4.08Å; F483-L507 HydrophobicContact CD2-CD2 3.74Å; F483-L507 HydrophobicContact CD2-CG 3.75Å; F483-L507 HydrophobicContact CE2-CD2 3.63Å; F483-L507 HydrophobicContact CE2-CG 3.7Å; A486-L507 HydrophobicContact CB-CD1 3.92Å; A486-L507 HydrophobicContact CB-CD2 4.05Å; L487-L507 HydrophobicContact CD2-CD2 3.72Å; L487-L507 HydrophobicContact CG-CD2 3.96Å; L490-L507 HydrophobicContact CD1-CD2 4.34Å; Q503-L507 WeakPolarHBondContact O-CB 3.25Å; Q503-L507 PolarHBondContact O-N 3.49Å; I504-L507 PolarHBondContact O-N 2.92Å; K505-L507 VanDerWaalsContact C-N 3.27Å; K505-L507 PolarHBondContact O-N 2.78Å; L507-E509 VanDerWaalsContact C-N 3.33Å; L507-E509 PolarHBondContact O-N 3.19Å; L507-T510 PolarHBondContact O-N 2.92Å; L507-V511 WeakPolarHBondContact O-CG2 3.47Å; L507-V511 PolarHBondContact O-N 3.01Å
508	K	73.6	Confident	68.1	Low	91 Å²	91	72.5 Å²	72.5	40%	0.396	36%	0.355	S	S	.	.	H	α-helix	trans	-56.4	-42.2	175	-74.8	174.1	179.2	173.1	0	112.1	I504 K505 K512	I504-K508 HydrophobicContact CG2-CD 3.84Å; I504-K508 VanDerWaalsContact CG2-CE 3.45Å; I504-K508 HydrophobicContact CG2-CG 4.36Å; I504-K508 WeakPolarHBondContact O-CB 3.24Å; I504-K508 VanDerWaalsContact O-CG 3.32Å; I504-K508 WeakPolarHBondContact O-CG 3.38Å; I504-K508 PolarHBondContact O-N 3.2Å; K505-K508 PolarHBondContact O-N 3.15Å; K508-K512 WeakPolarHBondContact O-CG 3.45Å; K508-K512 PolarHBondContact O-N 3.4Å; K508-K512 VanDerWaalsContact O-N 3.08Å
509	E	75.9	Confident	66.6	Low	86 Å²	86	73.7 Å²	73.7	40%	0.402	36%	0.36	S	S	.	.	H	α-helix	trans	-68.3	-40.6	176.5	-74.5	174.3	-172.7	0	0	112.6	K505 L507 K512 Q513	K505-E509 WeakPolarHBondContact CE-OE1 3.33Å; K505-E509 HydrophobicContact CG-CG 4.46Å; K505-E509 WeakPolarHBondContact CG-OE1 3.35Å; K505-E509 WeakPolarHBondContact O-CB 3.31Å; K505-E509 WeakPolarHBondContact O-CG 3.36Å; K505-E509 PolarHBondContact O-N 3.12Å; L507-E509 VanDerWaalsContact C-N 3.33Å; L507-E509 PolarHBondContact O-N 3.19Å; E509-K512 PolarHBondContact O-N 3.47Å; E509-Q513 WeakPolarHBondContact O-CG 3.34Å; E509-Q513 PolarHBondContact O-N 3.41Å
510	T	73.2	Confident	64.7	Low	12 Å²	12	74.3 Å²	74.3	7%	0.074	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-40.7	178.9	-57.7	0	0	0	0	111.1	Y465 V468 K469 K506 L507 Q513 S514	Y465-T510 HydrophobicContact CE2-CG2 4.35Å; Y465-T510 VanDerWaalsContact CE2-OG1 3.24Å; Y465-T510 WeakPolarHBondContact CE2-OG1 3.29Å; Y465-T510 PolarHBondContact OH-OG1 2.98Å; V468-T510 HydrophobicContact CG1-CG2 4.27Å; K469-T510 HydrophobicContact CB-CG2 3.74Å; K469-T510 HydrophobicContact CG-CG2 3.94Å; K506-T510 VanDerWaalsContact O-CB 3.31Å; K506-T510 WeakPolarHBondContact O-CB 3.45Å; K506-T510 PolarHBondContact O-N 3.28Å; K506-T510 PolarHBondContact O-OG1 2.99Å; L507-T510 PolarHBondContact O-N 2.92Å; T510-Q513 PolarHBondContact O-N 2.87Å; T510-S514 PolarHBondContact O-N 3.19Å
511	V	66.4	Low	62.5	Low	4 Å²	4	78.6 Å²	78.6	2%	0.024	39%	0.387	C	S	.	.	H	α-helix	trans	-61.2	-48.2	172.6	169.6	0	0	0	0	111	V468 F483 L507 Q513 S514 F517 M519	V468-V511 HydrophobicContact CG1-CG2 4.31Å; F483-V511 HydrophobicContact CD2-CG2 3.52Å; F483-V511 HydrophobicContact CE2-CG2 3.65Å; F483-V511 HydrophobicContact CG-CG2 4.45Å; L507-V511 WeakPolarHBondContact O-CG2 3.47Å; L507-V511 PolarHBondContact O-N 3.01Å; V511-Q513 VanDerWaalsContact C-N 3.27Å; V511-Q513 PolarHBondContact O-N 3.16Å; V511-S514 PolarHBondContact O-N 2.84Å; V511-S514 PolarHBondContact O-OG 3.21Å; V511-F517 HydrophobicContact CG1-CB 3.58Å; V511-F517 HydrophobicContact CG1-CD1 3.56Å; V511-F517 HydrophobicContact CG1-CD2 4.34Å; V511-F517 HydrophobicContact CG1-CE1 4.26Å; V511-F517 HydrophobicContact CG1-CG 3.59Å; V511-M519 HydrophobicContact CG1-SD 4.27Å
512	K	66.4	Low	60.6	Low	166 Å²	166	75.1 Å²	75.1	72%	0.722	37%	0.368	S	S	*	.	H	α-helix	trans	-59.8	-31.9	175.7	-76.7	178.8	178	-175	0	114	K508 E509 S514	K508-K512 WeakPolarHBondContact O-CG 3.45Å; K508-K512 PolarHBondContact O-N 3.4Å; K508-K512 VanDerWaalsContact O-N 3.08Å; E509-K512 PolarHBondContact O-N 3.47Å; K512-S514 VanDerWaalsContact C-N 3.33Å
513	Q	58.6	Low	58.5	Low	143 Å²	143	76 Å²	76	67%	0.668	38%	0.376	S	S	*	.	H	α-helix	trans	-75.6	-22	175.8	-73.3	174.4	20.4	0	0	112.8	E509 T510 V511 N515	E509-Q513 WeakPolarHBondContact O-CG 3.34Å; E509-Q513 PolarHBondContact O-N 3.41Å; T510-Q513 PolarHBondContact O-N 2.87Å; V511-Q513 VanDerWaalsContact C-N 3.27Å; V511-Q513 PolarHBondContact O-N 3.16Å; Q513-N515 PolarHBondContact O-N 3.36Å
514	S	57	Low	56.1	Low	31 Å²	31	76.6 Å²	76.6	22%	0.217	39%	0.385	C	S	.	.	S	Bend	trans	-80.4	97.8	170	72.1	0	0	0	0	110.2	T510 V511 K512 Q516 F517	T510-S514 PolarHBondContact O-N 3.19Å; V511-S514 PolarHBondContact O-N 2.84Å; V511-S514 PolarHBondContact O-OG 3.21Å; K512-S514 VanDerWaalsContact C-N 3.33Å; S514-Q516 PolarHBondContact O-N 3.33Å; S514-F517 PolarHBondContact O-N 3.46Å
515	N	44.2	Very low	53.8	Low	163 Å²	163	84.3 Å²	84.3	87%	0.872	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	27	-177.2	-65.9	-30.2	0	0	0	115.6	Q513	Q513-N515 PolarHBondContact O-N 3.36Å
516	Q	46.8	Very low	51.5	Low	114 Å²	114	85.4 Å²	85.4	53%	0.533	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-20.6	171.6	-68.8	177.2	-37.8	0	0	111.9	S514 D518	S514-Q516 PolarHBondContact O-N 3.33Å; Q516-D518 VanDerWaalsContact C-N 3.28Å; Q516-D518 PolarHBondContact O-N 2.96Å
517	F	44.2	Very low	49.1	Very low	21 Å²	21	87.5 Å²	87.5	9%	0.092	45%	0.449	C	S	.	.			trans	-82	73.4	177.3	-109.3	-88.8	0	0	0	110.9	K479 E480 V511 S514 M519	K479-F517 HydrophobicContact CB-CE2 3.91Å; E480-F517 HydrophobicContact CB-CZ 4.28Å; E480-F517 HydrophobicContact CG-CE1 4.01Å; E480-F517 HydrophobicContact CG-CE2 4.16Å; E480-F517 HydrophobicContact CG-CZ 3.41Å; E480-F517 VanDerWaalsContact CG-CZ 3.41Å; V511-F517 HydrophobicContact CG1-CB 3.58Å; V511-F517 HydrophobicContact CG1-CD1 3.56Å; V511-F517 HydrophobicContact CG1-CD2 4.34Å; V511-F517 HydrophobicContact CG1-CE1 4.26Å; V511-F517 HydrophobicContact CG1-CG 3.59Å; S514-F517 PolarHBondContact O-N 3.46Å; F517-M519 HydrophobicContact CD1-SD 4.32Å; F517-M519 PolarHBondContact O-N 2.96Å
518	D	39.4	Very low	46.8	Very low	75 Å²	75	93.2 Å²	93.2	40%	0.401	48%	0.484	S	S	.	.			trans	-74.9	94	169.6	-172.1	-3.2	0	0	0	109.6	Q516 N520 N521	Q516-D518 VanDerWaalsContact C-N 3.28Å; Q516-D518 PolarHBondContact O-N 2.96Å; D518-N520 PolarHBondContact O-N 2.9Å; D518-N520 WeakPolarHBondContact OD1-CB 3.39Å; D518-N520 PolarHBondContact OD1-N 3.29Å; D518-N520 VanDerWaalsContact OD1-N 3.1Å; D518-N520 PolarHBondContact OD1-ND2 2.81Å; D518-N521 WeakPolarHBondContact CB-ND2 3.47Å; D518-N521 VanDerWaalsContact CG-ND2 3.3Å; D518-N521 PolarHBondContact O-N 2.82Å; D518-N521 PolarHBondContact OD2-ND2 3.04Å
519	M	42.1	Very low	44.7	Very low	73 Å²	73	100.2 Å²	100.2	36%	0.36	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-54.9	-20.8	178.7	-66.9	-66.8	-62.8	0	0	113.2	V511 F517 L522 L542	V511-M519 HydrophobicContact CG1-SD 4.27Å; F517-M519 HydrophobicContact CD1-SD 4.32Å; F517-M519 PolarHBondContact O-N 2.96Å; M519-L522 HydrophobicContact CE-CD1 4.03Å; M519-L522 PolarHBondContact O-N 2.91Å; M519-L522 HydrophobicContact SD-CD1 4Å; M519-L542 HydrophobicContact CE-CD1 4.01Å
520	N	35.9	Very low	42.3	Very low	113 Å²	113	105.1 Å²	105.1	60%	0.604	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-77.4	-22.1	178	-48.6	-77.3	0	0	0	112.3	D518 L522 T523 S524	D518-N520 PolarHBondContact O-N 2.9Å; D518-N520 WeakPolarHBondContact OD1-CB 3.39Å; D518-N520 PolarHBondContact OD1-N 3.29Å; D518-N520 VanDerWaalsContact OD1-N 3.1Å; D518-N520 PolarHBondContact OD1-ND2 2.81Å; N520-L522 PolarHBondContact O-N 3.47Å; N520-T523 PolarHBondContact O-N 3.22Å; N520-T523 VanDerWaalsContact O-N 3.16Å; N520-T523 PolarHBondContact O-OG1 2.73Å; N520-S524 PolarHBondContact O-N 3.45Å
521	N	37	Very low	40.1	Very low	96 Å²	96	111.5 Å²	111.5	51%	0.513	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-80.6	-2.3	175	-67.4	-43	0	0	0	113.5	D518 S524	D518-N521 WeakPolarHBondContact CB-ND2 3.47Å; D518-N521 VanDerWaalsContact CG-ND2 3.3Å; D518-N521 PolarHBondContact O-N 2.82Å; D518-N521 PolarHBondContact OD2-ND2 3.04Å; N521-S524 WeakPolarHBondContact CA-OG 3.46Å; N521-S524 PolarHBondContact OD1-OG 2.93Å
522	L	34.5	Very low	38.3	Very low	26 Å²	26	118.5 Å²	118.5	14%	0.136	60%	0.595	C	S	.	*	G	3₁₀ helix	trans	-77	-10.1	163.5	-68.5	157.6	0	0	0	112.2	M519 N520 T535 L538	M519-L522 HydrophobicContact CE-CD1 4.03Å; M519-L522 PolarHBondContact O-N 2.91Å; M519-L522 HydrophobicContact SD-CD1 4Å; N520-L522 PolarHBondContact O-N 3.47Å; L522-T535 HydrophobicContact CB-CG2 4.04Å; L522-T535 HydrophobicContact CD2-CG2 3.66Å; L522-T535 HydrophobicContact CG-CG2 4.4Å; L522-T535 WeakPolarHBondContact O-CG2 3.23Å; L522-L538 HydrophobicContact CD2-CB 4.21Å; L522-L538 HydrophobicContact CD2-CD1 4.03Å
523	T	33.6	Very low	36.7	Very low	107 Å²	107	112.8 Å²	112.8	66%	0.656	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123	-3.5	-178	63.9	0	0	0	0	114.6	N520	N520-T523 PolarHBondContact O-N 3.22Å; N520-T523 VanDerWaalsContact O-N 3.16Å; N520-T523 PolarHBondContact O-OG1 2.73Å
524	S	32	Very low	35.5	Very low	56 Å²	56	111 Å²	111	39%	0.392	57%	0.567	S	S	.	*	S	Bend	trans	-85.3	146.5	177.3	62.6	0	0	0	0	112.8	N520 N521 D526	N520-S524 PolarHBondContact O-N 3.45Å; N521-S524 WeakPolarHBondContact CA-OG 3.46Å; N521-S524 PolarHBondContact OD1-OG 2.93Å; S524-D526 PolarHBondContact O-N 2.74Å
525	K	30.1	Very low	34.1	Very low	192 Å²	192	112.8 Å²	112.8	84%	0.835	58%	0.577	S	S	*	*			trans	-92	39.7	-166.5	-65.6	-176.5	175.9	178.8	0	114.9	T527	K525-T527 PolarHBondContact O-N 2.73Å
526	D	30.3	Very low	33.7	Very low	139 Å²	139	108.2 Å²	108.2	74%	0.743	56%	0.558	S	S	*	*			trans	-83.5	79	179.1	-87.3	-46.6	0	0	0	112.6	S524 T528	S524-D526 PolarHBondContact O-N 2.74Å; D526-T528 PolarHBondContact O-N 3.15Å
527	T	29.7	Very low	33.2	Very low	128 Å²	128	107.4 Å²	107.4	79%	0.785	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	34.4	-167.5	50.3	0	0	0	0	116.2	K525	K525-T527 PolarHBondContact O-N 2.73Å
528	T	32.8	Very low	32.7	Very low	121 Å²	121	106.7 Å²	106.7	74%	0.742	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	3.1	-168.3	58.5	0	0	0	0	117	D526	D526-T528 PolarHBondContact O-N 3.15Å
529	R	27.9	Very low	32.4	Very low	239 Å²	239	104.6 Å²	104.6	90%	0.902	54%	0.538	S	S	*	.			trans	-136	110.5	166.4	-69.7	-172.7	175.9	178.9	-0.6	110
530	Q	26.3	Very low	32.1	Very low	188 Å²	188	106.6 Å²	106.6	88%	0.879	54%	0.544	S	S	*	.			trans	-106	16.7	-159.8	-155.5	172.9	-3	0	0	114.1
531	D	26.1	Very low	32.2	Very low	146 Å²	146	103.4 Å²	103.4	78%	0.781	53%	0.527	S	S	*	.			trans	-130.2	103.8	-173.2	-77	-61	0	0	0	111.9
532	K	29.7	Very low	32.1	Very low	151 Å²	151	100.4 Å²	100.4	66%	0.657	51%	0.511	S	S	*	.	S	Bend		161.7	-44.9	115.7	-88.8	167.3	-177.8	175.4	0	115.5	E477	E477-K532 HydrophobicContact CG-CD 4.33Å; E477-K532 VanDerWaalsContact OE1-CD 3.26Å; E477-K532 WeakPolarHBondContact OE1-CD 3.44Å; E477-K532 IonicContact OE1-NZ 2.74Å; E477-K532 PolarHBondContact OE1-NZ 3Å; E477-K532 VanDerWaalsContact OE2-CD 3.24Å; E477-K532 WeakPolarHBondContact OE2-CD 3.4Å; E477-K532 IonicContact OE2-NZ 3.84Å; E477-K532 PolarHBondContact OE2-NZ 3.02Å
533	L	32	Very low	32.3	Very low	46 Å²	46	103.2 Å²	103.2	24%	0.241	53%	0.526	C	S	.	.	S	Bend	trans	-110.4	127.4	170.5	-86.6	105.4	0	0	0	110.1	E477 E480 T535	E477-L533 HydrophobicContact CB-CD1 4.2Å; E477-L533 WeakPolarHBondContact O-CD1 3.4Å; E480-L533 HydrophobicContact CB-CD1 4.37Å; E480-L533 HydrophobicContact CB-CD2 3.82Å; L533-T535 PolarHBondContact O-N 3.05Å; L533-T535 VanDerWaalsContact O-N 3.07Å
534	N	32.8	Very low	32.2	Very low	105 Å²	105	100.8 Å²	100.8	56%	0.561	51%	0.508	S	S	*	.			trans	-69.8	106	177.8	-99.8	-32.5	0	0	0	109.1	S536 R537 L538	N534-S536 PolarHBondContact O-N 3.15Å; N534-S536 VanDerWaalsContact O-N 3.16Å; N534-R537 HydrophobicContact CB-CB 3.79Å; N534-R537 HydrophobicContact CB-CG 3.89Å; N534-R537 WeakPolarHBondContact O-CA 3.16Å; N534-R537 WeakPolarHBondContact O-CB 3.15Å; N534-R537 PolarHBondContact O-N 3.42Å; N534-L538 PolarHBondContact O-N 3.2Å; N534-L538 VanDerWaalsContact O-N 3.1Å
535	T	29.3	Very low	32.3	Very low	70 Å²	70	99.6 Å²	99.6	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-47.3	-39.8	164.1	-13.3	0	0	0	0	110.4	L522 L533 R537 L538 C539	L522-T535 HydrophobicContact CB-CG2 4.04Å; L522-T535 HydrophobicContact CD2-CG2 3.66Å; L522-T535 HydrophobicContact CG-CG2 4.4Å; L522-T535 WeakPolarHBondContact O-CG2 3.23Å; L533-T535 PolarHBondContact O-N 3.05Å; L533-T535 VanDerWaalsContact O-N 3.07Å; T535-R537 PolarHBondContact O-N 3.32Å; T535-L538 PolarHBondContact O-N 3.16Å; T535-C539 PolarHBondContact O-N 3.49Å; T535-C539 PolarHBondContact O-SG 2.89Å; T535-C539 VanDerWaalsContact O-SG 3.38Å
536	S	34.8	Very low	32.5	Very low	67 Å²	67	96.2 Å²	96.2	47%	0.469	48%	0.483	S	S	.	.	H	α-helix	trans	-63.1	-35.1	173.4	-177.9	0	0	0	0	114.3	N534 K540	N534-S536 PolarHBondContact O-N 3.15Å; N534-S536 VanDerWaalsContact O-N 3.16Å; S536-K540 VanDerWaalsContact O-CB 3.23Å; S536-K540 WeakPolarHBondContact O-CB 3.4Å; S536-K540 WeakPolarHBondContact O-CG 3.42Å; S536-K540 PolarHBondContact O-N 3.38Å
537	R	36.1	Very low	32.7	Very low	96 Å²	96	95 Å²	95	36%	0.362	47%	0.472	S	S	.	.	H	α-helix	trans	-67.6	-44.4	172.8	-88.1	-170.9	172.6	-159.7	-6.7	110.2	E429 N534 T535 K540 I541	E429-R537 IonicContact OE1-CZ 2.88Å; E429-R537 IonicContact OE1-NE 2.88Å; E429-R537 IonicContact OE1-NH2 2.64Å; E429-R537 PolarHBondContact OE1-NH2 2.89Å; N534-R537 HydrophobicContact CB-CB 3.79Å; N534-R537 HydrophobicContact CB-CG 3.89Å; N534-R537 WeakPolarHBondContact O-CA 3.16Å; N534-R537 WeakPolarHBondContact O-CB 3.15Å; N534-R537 PolarHBondContact O-N 3.42Å; T535-R537 PolarHBondContact O-N 3.32Å; R537-K540 PolarHBondContact O-N 3.49Å; R537-I541 WeakPolarHBondContact O-CB 3.37Å; R537-I541 WeakPolarHBondContact O-CD1 3.39Å; R537-I541 WeakPolarHBondContact O-CG1 3.45Å; R537-I541 PolarHBondContact O-N 3.3Å
538	L	34.3	Very low	32.7	Very low	6 Å²	6	92.3 Å²	92.3	3%	0.031	45%	0.453	C	S	.	.	H	α-helix	trans	-65.1	-43.3	179.9	-101.3	165.9	0	0	0	112.6	F483 V484 L522 N534 T535 I541 L542	F483-L538 HydrophobicContact CD1-CD2 3.86Å; F483-L538 HydrophobicContact CE1-CD2 3.66Å; V484-L538 HydrophobicContact CG2-CD2 4.15Å; V484-L538 HydrophobicContact CG2-CG 4.26Å; L522-L538 HydrophobicContact CD2-CB 4.21Å; L522-L538 HydrophobicContact CD2-CD1 4.03Å; N534-L538 PolarHBondContact O-N 3.2Å; N534-L538 VanDerWaalsContact O-N 3.1Å; T535-L538 PolarHBondContact O-N 3.16Å; L538-I541 PolarHBondContact O-N 2.85Å; L538-L542 WeakPolarHBondContact O-CG 3.44Å; L538-L542 PolarHBondContact O-N 3.15Å; L538-L542 VanDerWaalsContact O-N 3.1Å
539	C	32.8	Very low	32.6	Very low	32 Å²	32	90.7 Å²	90.7	22%	0.216	44%	0.44	C	S	.	.	H	α-helix	trans	-63.8	-47.8	173	-64	0	0	0	0	111.3	T535 I541 L542 D543	T535-C539 PolarHBondContact O-N 3.49Å; T535-C539 PolarHBondContact O-SG 2.89Å; T535-C539 VanDerWaalsContact O-SG 3.38Å; C539-I541 VanDerWaalsContact C-N 3.31Å; C539-I541 PolarHBondContact O-N 2.76Å; C539-L542 CarbonylContact O-C 3.53Å; C539-L542 WeakPolarHBondContact O-CA 3.17Å; C539-L542 WeakPolarHBondContact O-CB 3.2Å; C539-L542 PolarHBondContact O-N 2.8Å; C539-D543 PolarHBondContact O-N 3.13Å
540	K	36.9	Very low	32.7	Very low	114 Å²	114	85.7 Å²	85.7	50%	0.496	43%	0.427	S	S	.	.	H	α-helix	trans	-56.5	-40.9	175.3	-77.8	175.6	175.6	-166	0	113.1	S536 R537 L542 D543 I544	S536-K540 VanDerWaalsContact O-CB 3.23Å; S536-K540 WeakPolarHBondContact O-CB 3.4Å; S536-K540 WeakPolarHBondContact O-CG 3.42Å; S536-K540 PolarHBondContact O-N 3.38Å; R537-K540 PolarHBondContact O-N 3.49Å; K540-L542 VanDerWaalsContact C-N 3.31Å; K540-L542 PolarHBondContact O-N 2.92Å; K540-D543 PolarHBondContact O-N 2.96Å; K540-I544 WeakPolarHBondContact O-CB 3.34Å; K540-I544 WeakPolarHBondContact O-CD1 3.35Å; K540-I544 WeakPolarHBondContact O-CG1 3.13Å; K540-I544 PolarHBondContact O-N 3.44Å
541	I	36.9	Very low	32.9	Very low	47 Å²	47	81 Å²	81	24%	0.241	41%	0.41	C	S	.	.	H	α-helix	trans	-64.9	-36.8	176.7	-70.9	163.2	0	0	0	110.9	V484 L487 R537 L538 C539 I545	V484-I541 HydrophobicContact CG1-CD1 4.43Å; L487-I541 HydrophobicContact CD1-CG2 3.89Å; R537-I541 WeakPolarHBondContact O-CB 3.37Å; R537-I541 WeakPolarHBondContact O-CD1 3.39Å; R537-I541 WeakPolarHBondContact O-CG1 3.45Å; R537-I541 PolarHBondContact O-N 3.3Å; L538-I541 PolarHBondContact O-N 2.85Å; C539-I541 VanDerWaalsContact C-N 3.31Å; C539-I541 PolarHBondContact O-N 2.76Å; I541-I545 HydrophobicContact CG2-CD1 4.09Å; I541-I545 WeakPolarHBondContact O-CD1 3.39Å; I541-I545 VanDerWaalsContact O-CG1 3.22Å; I541-I545 WeakPolarHBondContact O-CG1 3.23Å; I541-I545 PolarHBondContact O-N 3.24Å
542	L	35.2	Very low	33	Very low	32 Å²	32	77.3 Å²	77.3	17%	0.168	39%	0.388	C	S	.	.	H	α-helix	trans	-70.6	-41.5	174.3	-68.8	167.2	0	0	0	112	M519 L538 C539 K540 I545 F546	M519-L542 HydrophobicContact CE-CD1 4.01Å; L538-L542 WeakPolarHBondContact O-CG 3.44Å; L538-L542 PolarHBondContact O-N 3.15Å; L538-L542 VanDerWaalsContact O-N 3.1Å; C539-L542 CarbonylContact O-C 3.53Å; C539-L542 WeakPolarHBondContact O-CA 3.17Å; C539-L542 WeakPolarHBondContact O-CB 3.2Å; C539-L542 PolarHBondContact O-N 2.8Å; K540-L542 VanDerWaalsContact C-N 3.31Å; K540-L542 PolarHBondContact O-N 2.92Å; L542-I545 WeakPolarHBondContact O-CB 3.21Å; L542-I545 PolarHBondContact O-N 3.36Å; L542-I545 VanDerWaalsContact O-N 3.13Å; L542-F546 WeakPolarHBondContact O-CD2 3.39Å; L542-F546 PolarHBondContact O-N 2.82Å
543	D	38.4	Very low	33.1	Very low	86 Å²	86	75.2 Å²	75.2	46%	0.46	38%	0.38	S	S	.	.	H	α-helix	trans	-62.2	-42.3	175.2	-60.7	-33	0	0	0	111	C539 K540 I545 F546 Q547	C539-D543 PolarHBondContact O-N 3.13Å; K540-D543 PolarHBondContact O-N 2.96Å; D543-I545 VanDerWaalsContact C-N 3.33Å; D543-I545 PolarHBondContact O-N 2.81Å; D543-F546 PolarHBondContact O-N 3.48Å; D543-Q547 WeakPolarHBondContact O-CG 3.46Å; D543-Q547 PolarHBondContact O-N 2.88Å
544	I	32.4	Very low	33.2	Very low	56 Å²	56	80 Å²	80	29%	0.287	40%	0.401	S	S	.	.	H	α-helix	trans	-60.7	-40.9	171.6	-70.5	161.4	0	0	0	110.8	P431 K540 F546 Q547 L548	P431-I544 HydrophobicContact CB-CD1 3.86Å; P431-I544 HydrophobicContact CB-CG1 3.83Å; K540-I544 WeakPolarHBondContact O-CB 3.34Å; K540-I544 WeakPolarHBondContact O-CD1 3.35Å; K540-I544 WeakPolarHBondContact O-CG1 3.13Å; K540-I544 PolarHBondContact O-N 3.44Å; I544-F546 VanDerWaalsContact C-N 3.35Å; I544-F546 PolarHBondContact O-N 3.47Å; I544-Q547 PolarHBondContact O-N 2.84Å; I544-L548 HydrophobicContact CG2-CD1 3.74Å; I544-L548 HydrophobicContact CG2-CG 4.19Å; I544-L548 VanDerWaalsContact O-CB 3.23Å; I544-L548 WeakPolarHBondContact O-CB 3.41Å; I544-L548 WeakPolarHBondContact O-CG 3.24Å; I544-L548 PolarHBondContact O-N 2.82Å
545	I	33.8	Very low	33.1	Very low	31 Å²	31	76.4 Å²	76.4	16%	0.159	39%	0.389	C	S	.	.	H	α-helix	trans	-64.4	-38.6	176.4	-73.5	162.6	0	0	0	111.3	L487 I541 L542 D543 D549	L487-I545 HydrophobicContact CD1-CD1 4.43Å; L487-I545 HydrophobicContact CD2-CD1 4.08Å; I541-I545 HydrophobicContact CG2-CD1 4.09Å; I541-I545 WeakPolarHBondContact O-CD1 3.39Å; I541-I545 VanDerWaalsContact O-CG1 3.22Å; I541-I545 WeakPolarHBondContact O-CG1 3.23Å; I541-I545 PolarHBondContact O-N 3.24Å; L542-I545 WeakPolarHBondContact O-CB 3.21Å; L542-I545 PolarHBondContact O-N 3.36Å; L542-I545 VanDerWaalsContact O-N 3.13Å; D543-I545 VanDerWaalsContact C-N 3.33Å; D543-I545 PolarHBondContact O-N 2.81Å; I545-D549 PolarHBondContact O-N 3.26Å
546	F	34.9	Very low	33.2	Very low	121 Å²	121	79.1 Å²	79.1	53%	0.531	39%	0.391	S	S	.	.	H	α-helix	trans	-70.7	-42.9	175.9	-71.5	-63	0	0	0	112.6	L542 D543 I544 L548 D549 E550	L542-F546 WeakPolarHBondContact O-CD2 3.39Å; L542-F546 PolarHBondContact O-N 2.82Å; D543-F546 PolarHBondContact O-N 3.48Å; I544-F546 VanDerWaalsContact C-N 3.35Å; I544-F546 PolarHBondContact O-N 3.47Å; F546-L548 VanDerWaalsContact C-N 3.33Å; F546-L548 PolarHBondContact O-N 3.34Å; F546-D549 WeakPolarHBondContact O-CB 3.32Å; F546-D549 PolarHBondContact O-N 3.12Å; F546-D549 VanDerWaalsContact O-N 3.14Å; F546-E550 PolarHBondContact O-N 2.9Å
547	Q	34.3	Very low	33	Very low	112 Å²	112	78.8 Å²	78.8	52%	0.523	39%	0.392	S	S	.	.	H	α-helix	trans	-64.3	-37.3	174.8	-72	176.3	2.8	0	0	112	D543 I544 D549 V551	D543-Q547 WeakPolarHBondContact O-CG 3.46Å; D543-Q547 PolarHBondContact O-N 2.88Å; I544-Q547 PolarHBondContact O-N 2.84Å; Q547-D549 VanDerWaalsContact C-N 3.33Å; Q547-V551 WeakPolarHBondContact O-CB 3.26Å; Q547-V551 VanDerWaalsContact O-CG2 3.24Å; Q547-V551 WeakPolarHBondContact O-CG2 3.28Å; Q547-V551 PolarHBondContact O-N 3.03Å
548	L	28.9	Very low	33	Very low	72 Å²	72	78.4 Å²	78.4	38%	0.377	40%	0.398	S	S	.	.	H	α-helix	trans	-67.4	-31.9	172.9	-75.7	173	0	0	0	112.2	I544 F546 F552	I544-L548 HydrophobicContact CG2-CD1 3.74Å; I544-L548 HydrophobicContact CG2-CG 4.19Å; I544-L548 VanDerWaalsContact O-CB 3.23Å; I544-L548 WeakPolarHBondContact O-CB 3.41Å; I544-L548 WeakPolarHBondContact O-CG 3.24Å; I544-L548 PolarHBondContact O-N 2.82Å; F546-L548 VanDerWaalsContact C-N 3.33Å; F546-L548 PolarHBondContact O-N 3.34Å; L548-F552 VanDerWaalsContact O-CB 3.26Å; L548-F552 WeakPolarHBondContact O-CB 3.4Å; L548-F552 WeakPolarHBondContact O-CD2 3.23Å; L548-F552 PolarHBondContact O-N 2.98Å
549	D	31.1	Very low	33	Very low	87 Å²	87	84.2 Å²	84.2	47%	0.465	43%	0.425	S	S	.	.	H	α-helix	trans	-67.5	-49.1	174.3	-153.6	-12.5	0	0	0	110.1	I545 F546 Q547 V551 F552 Q553	I545-D549 PolarHBondContact O-N 3.26Å; F546-D549 WeakPolarHBondContact O-CB 3.32Å; F546-D549 PolarHBondContact O-N 3.12Å; F546-D549 VanDerWaalsContact O-N 3.14Å; Q547-D549 VanDerWaalsContact C-N 3.33Å; D549-V551 PolarHBondContact O-N 3.02Å; D549-F552 PolarHBondContact O-N 3.24Å; D549-F552 VanDerWaalsContact O-N 3.12Å; D549-Q553 WeakPolarHBondContact O-CG 3.28Å; D549-Q553 PolarHBondContact O-N 2.84Å; D549-Q553 PolarHBondContact OD1-NE2 3.46Å
550	E	30.5	Very low	33.1	Very low	135 Å²	135	87.1 Å²	87.1	63%	0.631	44%	0.438	S	S	*	.	H	α-helix	trans	-56.2	-50	173.1	-74.6	-177.3	134.7	0	0	111.9	F546 F552 Q553 E554	F546-E550 PolarHBondContact O-N 2.9Å; E550-F552 VanDerWaalsContact C-N 3.28Å; E550-F552 PolarHBondContact O-N 3.09Å; E550-Q553 PolarHBondContact O-N 2.94Å; E550-E554 PolarHBondContact O-N 3Å
551	V	29.1	Very low	33.2	Very low	88 Å²	88	86 Å²	86	53%	0.533	44%	0.437	S	S	.	.	H	α-helix	trans	-66	-26.9	177.5	172.3	0	0	0	0	112.3	Q547 D549 G555	Q547-V551 WeakPolarHBondContact O-CB 3.26Å; Q547-V551 VanDerWaalsContact O-CG2 3.24Å; Q547-V551 WeakPolarHBondContact O-CG2 3.28Å; Q547-V551 PolarHBondContact O-N 3.03Å; D549-V551 PolarHBondContact O-N 3.02Å; V551-G555 VanDerWaalsContact O-CA 3.28Å; V551-G555 WeakPolarHBondContact O-CA 3.36Å; V551-G555 PolarHBondContact O-N 3.14Å
552	F	27.8	Very low	33.6	Very low	69 Å²	69	88.8 Å²	88.8	30%	0.303	45%	0.447	S	S	.	.	H	α-helix	trans	-73.3	-27.2	170.2	-108.6	-90.3	0	0	0	112.9	L548 D549 E550 R556	L548-F552 VanDerWaalsContact O-CB 3.26Å; L548-F552 WeakPolarHBondContact O-CB 3.4Å; L548-F552 WeakPolarHBondContact O-CD2 3.23Å; L548-F552 PolarHBondContact O-N 2.98Å; D549-F552 PolarHBondContact O-N 3.24Å; D549-F552 VanDerWaalsContact O-N 3.12Å; E550-F552 VanDerWaalsContact C-N 3.28Å; E550-F552 PolarHBondContact O-N 3.09Å; F552-R556 HydrophobicContact CD1-CG 4.39Å; F552-R556 VanDerWaalsContact O-CB 3.27Å; F552-R556 WeakPolarHBondContact O-CB 3.27Å; F552-R556 WeakPolarHBondContact O-CD 3.45Å; F552-R556 WeakPolarHBondContact O-CG 3.48Å; F552-R556 PolarHBondContact O-N 3.32Å; F552-R556 PolarHBondContact O-NE 3.15Å
553	Q	31.9	Very low	33.5	Very low	108 Å²	108	92.6 Å²	92.6	51%	0.505	47%	0.466	S	S	.	.	H	α-helix	trans	-77.9	-51	173	-53.1	-53.1	-13.4	0	0	110.9	D549 E550 R556 A557	D549-Q553 WeakPolarHBondContact O-CG 3.28Å; D549-Q553 PolarHBondContact O-N 2.84Å; D549-Q553 PolarHBondContact OD1-NE2 3.46Å; E550-Q553 PolarHBondContact O-N 2.94Å; Q553-R556 VanDerWaalsContact CD-NH2 3.35Å; Q553-A557 PolarHBondContact O-N 3.15Å
554	E	34	Very low	33.4	Very low	146 Å²	146	93 Å²	93	68%	0.682	47%	0.465	S	S	*	.	H	α-helix	trans	-65.9	-49.3	179.4	-66	-166.8	144.6	0	0	111.7	E550 R556 A557 D558	E550-E554 PolarHBondContact O-N 3Å; E554-R556 VanDerWaalsContact C-N 3.32Å; E554-R556 PolarHBondContact O-N 3.35Å; E554-A557 WeakPolarHBondContact O-CB 3.17Å; E554-A557 PolarHBondContact O-N 3.43Å; E554-A557 VanDerWaalsContact O-N 3.09Å; E554-D558 WeakPolarHBondContact O-CB 3.48Å; E554-D558 PolarHBondContact O-N 2.9Å
555	G	32.7	Very low	33.9	Very low	29 Å²	29	95 Å²	95	30%	0.299	47%	0.473	S	S	.	.	H	α-helix	trans	-62	-35	-178.7	0	0	0	0	0	113.5	V551 D558 E559	V551-G555 VanDerWaalsContact O-CA 3.28Å; V551-G555 WeakPolarHBondContact O-CA 3.36Å; V551-G555 PolarHBondContact O-N 3.14Å; G555-D558 PolarHBondContact O-N 3.49Å; G555-E559 WeakPolarHBondContact O-CB 3.29Å; G555-E559 WeakPolarHBondContact O-CG 3.43Å; G555-E559 PolarHBondContact O-N 3.15Å
556	R	30	Very low	34.1	Very low	128 Å²	128	97.9 Å²	97.9	48%	0.483	49%	0.488	S	S	.	.	H	α-helix	trans	-70.8	-34.9	173.6	-75.8	-174.3	-61.6	-158.4	-0.2	112.6	F552 Q553 E554 L560	F552-R556 HydrophobicContact CD1-CG 4.39Å; F552-R556 VanDerWaalsContact O-CB 3.27Å; F552-R556 WeakPolarHBondContact O-CB 3.27Å; F552-R556 WeakPolarHBondContact O-CD 3.45Å; F552-R556 WeakPolarHBondContact O-CG 3.48Å; F552-R556 PolarHBondContact O-N 3.32Å; F552-R556 PolarHBondContact O-NE 3.15Å; Q553-R556 VanDerWaalsContact CD-NH2 3.35Å; E554-R556 VanDerWaalsContact C-N 3.32Å; E554-R556 PolarHBondContact O-N 3.35Å; R556-L560 VanDerWaalsContact O-CB 3.23Å; R556-L560 WeakPolarHBondContact O-CB 3.41Å; R556-L560 PolarHBondContact O-N 3.5Å
557	A	31.9	Very low	34.3	Very low	59 Å²	59	97.3 Å²	97.3	49%	0.488	49%	0.487	S	S	.	.	H	α-helix	trans	-64.8	-47.2	172.2	0	0	0	0	0	110.5	Q553 E554 E559 L560 D561	Q553-A557 PolarHBondContact O-N 3.15Å; E554-A557 WeakPolarHBondContact O-CB 3.17Å; E554-A557 PolarHBondContact O-N 3.43Å; E554-A557 VanDerWaalsContact O-N 3.09Å; A557-E559 PolarHBondContact O-N 3.2Å; A557-L560 PolarHBondContact O-N 2.8Å; A557-L560 VanDerWaalsContact O-N 3.15Å; A557-D561 PolarHBondContact O-N 3.28Å
558	D	35.5	Very low	34.4	Very low	89 Å²	89	97.1 Å²	97.1	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-68.7	-31.4	-176.8	-140.5	42.7	0	0	0	112.7	E554 G555 K562	E554-D558 WeakPolarHBondContact O-CB 3.48Å; E554-D558 PolarHBondContact O-N 2.9Å; G555-D558 PolarHBondContact O-N 3.49Å; D558-K562 VanDerWaalsContact CG-NZ 3.33Å; D558-K562 WeakPolarHBondContact O-CB 3.37Å; D558-K562 WeakPolarHBondContact O-CD 3.49Å; D558-K562 WeakPolarHBondContact O-CE 3.18Å; D558-K562 WeakPolarHBondContact O-CG 3.5Å; D558-K562 PolarHBondContact O-N 3.4Å; D558-K562 WeakPolarHBondContact OD2-CE 3.3Å; D558-K562 IonicContact OD2-NZ 2.61Å; D558-K562 PolarHBondContact OD2-NZ 2.83Å
559	E	34.7	Very low	35.1	Very low	128 Å²	128	99.2 Å²	99.2	60%	0.598	49%	0.494	S	S	*	.	H	α-helix	trans	-75.7	-35.8	168.7	-76.5	-158.3	141.2	0	0	113	G555 A557 K562 M563	G555-E559 WeakPolarHBondContact O-CB 3.29Å; G555-E559 WeakPolarHBondContact O-CG 3.43Å; G555-E559 PolarHBondContact O-N 3.15Å; A557-E559 PolarHBondContact O-N 3.2Å; E559-K562 PolarHBondContact O-N 3.02Å; E559-M563 HydrophobicContact CB-CE 4.36Å; E559-M563 WeakPolarHBondContact O-CB 3.29Å; E559-M563 WeakPolarHBondContact O-CG 3.47Å; E559-M563 PolarHBondContact O-N 2.89Å
560	L	33.7	Very low	35.4	Very low	93 Å²	93	101 Å²	101	49%	0.487	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-44.5	176.5	-161.2	77.2	0	0	0	110.8	R556 A557 M563 Q564	R556-L560 VanDerWaalsContact O-CB 3.23Å; R556-L560 WeakPolarHBondContact O-CB 3.41Å; R556-L560 PolarHBondContact O-N 3.5Å; A557-L560 PolarHBondContact O-N 2.8Å; A557-L560 VanDerWaalsContact O-N 3.15Å; L560-M563 PolarHBondContact O-N 2.96Å; L560-Q564 WeakPolarHBondContact O-CB 3.41Å; L560-Q564 WeakPolarHBondContact O-CG 3.48Å; L560-Q564 PolarHBondContact O-N 3.3Å
561	D	39.6	Very low	35.7	Very low	90 Å²	90	100 Å²	100	48%	0.481	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-42.6	174.7	-100.4	28.5	0	0	0	111.8	A557 Q564 Q565	A557-D561 PolarHBondContact O-N 3.28Å; D561-Q564 PolarHBondContact O-N 2.93Å; D561-Q565 WeakPolarHBondContact O-CB 3.46Å; D561-Q565 WeakPolarHBondContact O-CG 3.38Å; D561-Q565 PolarHBondContact O-N 3.21Å
562	K	46	Very low	36.5	Very low	105 Å²	105	99.5 Å²	99.5	46%	0.457	50%	0.495	S	S	.	.	H	α-helix	trans	-66.5	-36.9	175.3	-73.2	164.4	-158.6	151.7	0	112.2	D558 E559 N566	D558-K562 VanDerWaalsContact CG-NZ 3.33Å; D558-K562 WeakPolarHBondContact O-CB 3.37Å; D558-K562 WeakPolarHBondContact O-CD 3.49Å; D558-K562 WeakPolarHBondContact O-CE 3.18Å; D558-K562 WeakPolarHBondContact O-CG 3.5Å; D558-K562 PolarHBondContact O-N 3.4Å; D558-K562 WeakPolarHBondContact OD2-CE 3.3Å; D558-K562 IonicContact OD2-NZ 2.61Å; D558-K562 PolarHBondContact OD2-NZ 2.83Å; E559-K562 PolarHBondContact O-N 3.02Å; K562-N566 VanDerWaalsContact O-CB 3.25Å; K562-N566 WeakPolarHBondContact O-CB 3.31Å; K562-N566 VanDerWaalsContact O-CG 3.23Å; K562-N566 PolarHBondContact O-N 3.26Å; K562-N566 PolarHBondContact O-ND2 3.38Å
563	M	32.7	Very low	37.6	Very low	113 Å²	113	101 Å²	101	56%	0.557	51%	0.506	S	S	*	.	H	α-helix	trans	-65.8	-47.9	173.1	-78.6	-171.6	-76.6	0	0	111.1	E559 L560 Q565 N566 E567	E559-M563 HydrophobicContact CB-CE 4.36Å; E559-M563 WeakPolarHBondContact O-CB 3.29Å; E559-M563 WeakPolarHBondContact O-CG 3.47Å; E559-M563 PolarHBondContact O-N 2.89Å; L560-M563 PolarHBondContact O-N 2.96Å; M563-Q565 PolarHBondContact O-N 2.91Å; M563-N566 PolarHBondContact O-N 2.98Å; M563-E567 WeakPolarHBondContact O-CB 3.43Å; M563-E567 PolarHBondContact O-N 3.43Å
564	Q	35.2	Very low	38.1	Very low	95 Å²	95	96.3 Å²	96.3	44%	0.444	49%	0.488	S	S	.	.	H	α-helix	trans	-62.2	-41	177	-71.5	-178.6	26.6	0	0	112.4	L560 D561 E567 M568	L560-Q564 WeakPolarHBondContact O-CB 3.41Å; L560-Q564 WeakPolarHBondContact O-CG 3.48Å; L560-Q564 PolarHBondContact O-N 3.3Å; D561-Q564 PolarHBondContact O-N 2.93Å; Q564-E567 PolarHBondContact O-N 2.86Å; Q564-M568 WeakPolarHBondContact O-CB 3.15Å; Q564-M568 WeakPolarHBondContact O-CG 3.31Å; Q564-M568 PolarHBondContact O-N 3.34Å
565	Q	42.9	Very low	38.7	Very low	98 Å²	98	94.8 Å²	94.8	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-66.8	-38.8	174.9	-74.8	-171.9	33	0	0	112.9	D561 M563 K569	D561-Q565 WeakPolarHBondContact O-CB 3.46Å; D561-Q565 WeakPolarHBondContact O-CG 3.38Å; D561-Q565 PolarHBondContact O-N 3.21Å; M563-Q565 PolarHBondContact O-N 2.91Å; Q565-K569 WeakPolarHBondContact O-CB 3.46Å; Q565-K569 VanDerWaalsContact O-CG 3.29Å; Q565-K569 WeakPolarHBondContact O-CG 3.49Å; Q565-K569 PolarHBondContact O-N 2.8Å
566	N	39.9	Very low	39.7	Very low	90 Å²	90	97.2 Å²	97.2	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-71.7	-37.2	176.6	-76.3	-34.9	0	0	0	111.7	K562 M563 K569 L570	K562-N566 VanDerWaalsContact O-CB 3.25Å; K562-N566 WeakPolarHBondContact O-CB 3.31Å; K562-N566 VanDerWaalsContact O-CG 3.23Å; K562-N566 PolarHBondContact O-N 3.26Å; K562-N566 PolarHBondContact O-ND2 3.38Å; M563-N566 PolarHBondContact O-N 2.98Å; N566-K569 PolarHBondContact O-N 3.46Å; N566-L570 WeakPolarHBondContact O-CB 3.41Å; N566-L570 WeakPolarHBondContact O-CG 3.47Å; N566-L570 PolarHBondContact O-N 2.86Å
567	E	37.5	Very low	40.9	Very low	109 Å²	109	95.1 Å²	95.1	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-65.4	-48.5	173.3	-170.1	177.4	174.4	0	0	110.8	M563 Q564 K569 L570 Q571	M563-E567 WeakPolarHBondContact O-CB 3.43Å; M563-E567 PolarHBondContact O-N 3.43Å; Q564-E567 PolarHBondContact O-N 2.86Å; E567-K569 VanDerWaalsContact C-N 3.28Å; E567-K569 PolarHBondContact O-N 2.93Å; E567-L570 PolarHBondContact O-N 3.2Å; E567-L570 VanDerWaalsContact O-N 3.08Å; E567-Q571 HydrophobicContact CG-CG 4.21Å; E567-Q571 WeakPolarHBondContact O-CB 3.32Å; E567-Q571 WeakPolarHBondContact O-CG 3.14Å; E567-Q571 PolarHBondContact O-N 3.03Å; E567-Q571 PolarHBondContact OE1-NE2 2.91Å
568	M	37.9	Very low	41.9	Very low	108 Å²	108	93.9 Å²	93.9	53%	0.532	47%	0.47	S	S	.	.	H	α-helix	trans	-56.7	-40.4	172.8	-80.5	-168.9	-79.6	0	0	112.2	Q564 T572	Q564-M568 WeakPolarHBondContact O-CB 3.15Å; Q564-M568 WeakPolarHBondContact O-CG 3.31Å; Q564-M568 PolarHBondContact O-N 3.34Å; M568-T572 WeakPolarHBondContact O-CB 3.36Å; M568-T572 PolarHBondContact O-N 3.38Å; M568-T572 PolarHBondContact O-OG1 2.96Å
569	K	43.1	Very low	43	Very low	117 Å²	117	93.3 Å²	93.3	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-66.1	-39.5	174.4	-79.4	169.3	-179.3	162.8	0	112.5	Q565 N566 E567 N573	Q565-K569 WeakPolarHBondContact O-CB 3.46Å; Q565-K569 VanDerWaalsContact O-CG 3.29Å; Q565-K569 WeakPolarHBondContact O-CG 3.49Å; Q565-K569 PolarHBondContact O-N 2.8Å; N566-K569 PolarHBondContact O-N 3.46Å; E567-K569 VanDerWaalsContact C-N 3.28Å; E567-K569 PolarHBondContact O-N 2.93Å; K569-N573 VanDerWaalsContact O-CB 3.28Å; K569-N573 WeakPolarHBondContact O-CB 3.15Å; K569-N573 PolarHBondContact O-N 2.85Å; K569-N573 PolarHBondContact O-ND2 3.38Å
570	L	36	Very low	44.3	Very low	125 Å²	125	93.7 Å²	93.7	65%	0.654	47%	0.466	S	S	*	.	H	α-helix	trans	-67.5	-47.5	176.2	-79.4	164.3	0	0	0	111.4	N566 E567 N573 G574	N566-L570 WeakPolarHBondContact O-CB 3.41Å; N566-L570 WeakPolarHBondContact O-CG 3.47Å; N566-L570 PolarHBondContact O-N 2.86Å; E567-L570 PolarHBondContact O-N 3.2Å; E567-L570 VanDerWaalsContact O-N 3.08Å; L570-N573 PolarHBondContact O-N 2.9Å; L570-G574 PolarHBondContact O-N 2.86Å
571	Q	38.6	Very low	45.7	Very low	113 Å²	113	92.5 Å²	92.5	53%	0.528	46%	0.455	S	S	.	.	H	α-helix	trans	-59.6	-45.9	174.8	-68.8	-176.8	12.5	0	0	111	E567 G574 L575	E567-Q571 HydrophobicContact CG-CG 4.21Å; E567-Q571 WeakPolarHBondContact O-CB 3.32Å; E567-Q571 WeakPolarHBondContact O-CG 3.14Å; E567-Q571 PolarHBondContact O-N 3.03Å; E567-Q571 PolarHBondContact OE1-NE2 2.91Å; Q571-G574 PolarHBondContact O-N 3.31Å; Q571-L575 WeakPolarHBondContact O-CB 3.4Å; Q571-L575 PolarHBondContact O-N 3.01Å
572	T	45.3	Very low	46.4	Very low	77 Å²	77	96.5 Å²	96.5	47%	0.472	46%	0.464	S	S	.	.	H	α-helix	trans	-64.1	-46.7	178.4	-58.3	0	0	0	0	111.9	M568 G574 L575 I576	M568-T572 WeakPolarHBondContact O-CB 3.36Å; M568-T572 PolarHBondContact O-N 3.38Å; M568-T572 PolarHBondContact O-OG1 2.96Å; T572-G574 VanDerWaalsContact C-N 3.31Å; T572-G574 PolarHBondContact O-N 2.93Å; T572-L575 WeakPolarHBondContact O-CB 3.35Å; T572-L575 PolarHBondContact O-N 2.84Å; T572-I576 HydrophobicContact CG2-CD1 3.96Å; T572-I576 VanDerWaalsContact O-CG1 3.3Å; T572-I576 WeakPolarHBondContact O-CG1 3.05Å; T572-I576 PolarHBondContact O-N 2.84Å
573	N	50	Low	47.1	Very low	100 Å²	100	99 Å²	99	54%	0.535	48%	0.477	S	S	.	.	H	α-helix	trans	-65.6	-35	176.3	-77	-47.1	0	0	0	112.1	K569 L570 I576 K577	K569-N573 VanDerWaalsContact O-CB 3.28Å; K569-N573 WeakPolarHBondContact O-CB 3.15Å; K569-N573 PolarHBondContact O-N 2.85Å; K569-N573 PolarHBondContact O-ND2 3.38Å; L570-N573 PolarHBondContact O-N 2.9Å; N573-I576 PolarHBondContact O-N 3.16Å; N573-K577 PolarHBondContact O-N 3.39Å
574	G	42.3	Very low	48.1	Very low	11 Å²	11	97.1 Å²	97.1	11%	0.113	47%	0.472	C	S	.	.	H	α-helix	trans	-60.2	-50.2	169.6	0	0	0	0	0	111.8	L570 Q571 T572 I576 K577 V578	L570-G574 PolarHBondContact O-N 2.86Å; Q571-G574 PolarHBondContact O-N 3.31Å; T572-G574 VanDerWaalsContact C-N 3.31Å; T572-G574 PolarHBondContact O-N 2.93Å; G574-I576 VanDerWaalsContact C-N 3.33Å; G574-I576 PolarHBondContact O-N 3.08Å; G574-K577 PolarHBondContact O-N 2.75Å; G574-V578 WeakPolarHBondContact O-CB 3.4Å; G574-V578 WeakPolarHBondContact O-CG2 3.44Å; G574-V578 PolarHBondContact O-N 3.34Å
575	L	46.9	Very low	48.7	Very low	113 Å²	113	99.8 Å²	99.8	59%	0.592	49%	0.489	S	S	*	.	H	α-helix	trans	-58.6	-42.8	176.5	-127.5	77.6	0	0	0	111.8	Q571 T572 V578 N579	Q571-L575 WeakPolarHBondContact O-CB 3.4Å; Q571-L575 PolarHBondContact O-N 3.01Å; T572-L575 WeakPolarHBondContact O-CB 3.35Å; T572-L575 PolarHBondContact O-N 2.84Å; L575-V578 PolarHBondContact O-N 2.79Å; L575-N579 VanDerWaalsContact O-CB 3.28Å; L575-N579 WeakPolarHBondContact O-CB 3.22Å; L575-N579 VanDerWaalsContact O-CG 3.29Å; L575-N579 PolarHBondContact O-N 3.08Å; L575-N579 PolarHBondContact O-ND2 3.21Å
576	I	53.8	Low	48.8	Very low	80 Å²	80	103.3 Å²	103.3	41%	0.41	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-42.8	176.7	-68.6	165.4	0	0	0	110.8	T572 N573 G574 K580	T572-I576 HydrophobicContact CG2-CD1 3.96Å; T572-I576 VanDerWaalsContact O-CG1 3.3Å; T572-I576 WeakPolarHBondContact O-CG1 3.05Å; T572-I576 PolarHBondContact O-N 2.84Å; N573-I576 PolarHBondContact O-N 3.16Å; G574-I576 VanDerWaalsContact C-N 3.33Å; G574-I576 PolarHBondContact O-N 3.08Å; I576-K580 HydrophobicContact CG2-CD 4.33Å; I576-K580 WeakPolarHBondContact O-CB 3.4Å; I576-K580 WeakPolarHBondContact O-CG 3.27Å; I576-K580 PolarHBondContact O-N 3.37Å
577	K	55.6	Low	49.4	Very low	85 Å²	85	106.9 Å²	106.9	37%	0.37	52%	0.518	S	S	.	.	H	α-helix	trans	-64.8	-42.8	174.1	-80.2	-165.4	175	-168.5	0	112.2	N573 G574 W581 E592 I593 I596	N573-K577 PolarHBondContact O-N 3.39Å; G574-K577 PolarHBondContact O-N 2.75Å; K577-W581 WeakPolarHBondContact O-CB 3.41Å; K577-W581 PolarHBondContact O-N 3.47Å; K577-E592 IonicContact NZ-OE2 3.94Å; K577-E592 PolarHBondContact NZ-OE2 2.87Å; K577-I593 HydrophobicContact CB-CD1 4.38Å; K577-I596 HydrophobicContact CD-CD1 3.75Å
578	V	52.3	Low	50.3	Low	33 Å²	33	108.7 Å²	108.7	20%	0.2	52%	0.524	C	S	.	.	H	α-helix	trans	-65.8	-43.6	178.4	169.5	0	0	0	0	111.5	G574 L575 W581 R582 I593 I597	G574-V578 WeakPolarHBondContact O-CB 3.4Å; G574-V578 WeakPolarHBondContact O-CG2 3.44Å; G574-V578 PolarHBondContact O-N 3.34Å; L575-V578 PolarHBondContact O-N 2.79Å; V578-W581 PolarHBondContact O-N 3.42Å; V578-R582 WeakPolarHBondContact O-CG 3.31Å; V578-R582 PolarHBondContact O-N 2.86Å; V578-I593 HydrophobicContact CG2-CG2 3.72Å; V578-I597 HydrophobicContact CG2-CD1 4.48Å
579	N	58.7	Low	51.3	Low	77 Å²	77	106.4 Å²	106.4	41%	0.412	51%	0.512	S	S	.	.	H	α-helix	trans	-67.8	-42.2	178.1	-74.2	-19.6	0	0	0	111.6	L575 W581 R582 Q583	L575-N579 VanDerWaalsContact O-CB 3.28Å; L575-N579 WeakPolarHBondContact O-CB 3.22Å; L575-N579 VanDerWaalsContact O-CG 3.29Å; L575-N579 PolarHBondContact O-N 3.08Å; L575-N579 PolarHBondContact O-ND2 3.21Å; N579-W581 VanDerWaalsContact C-N 3.31Å; N579-W581 PolarHBondContact O-N 3.5Å; N579-R582 PolarHBondContact O-N 2.96Å; N579-Q583 VanDerWaalsContact O-CG 3.3Å; N579-Q583 WeakPolarHBondContact O-CG 3.35Å; N579-Q583 PolarHBondContact O-N 2.94Å
580	K	62.3	Low	52	Low	136 Å²	136	103.5 Å²	103.5	59%	0.591	51%	0.505	S	S	*	.	H	α-helix	trans	-60.6	-39.8	171	-76.6	-176.5	176.4	-173.9	0	112	I576 Q583 T584	I576-K580 HydrophobicContact CG2-CD 4.33Å; I576-K580 WeakPolarHBondContact O-CB 3.4Å; I576-K580 WeakPolarHBondContact O-CG 3.27Å; I576-K580 PolarHBondContact O-N 3.37Å; K580-Q583 PolarHBondContact O-N 2.85Å; K580-T584 WeakPolarHBondContact O-CG2 3.3Å; K580-T584 PolarHBondContact O-N 2.8Å
581	W	63.1	Low	52.9	Low	67 Å²	67	103.1 Å²	103.1	25%	0.254	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-47.4	175.1	174.3	69.7	0	0	0	112.1	K577 V578 N579 Q583 T584 R586 K588 M589 I593	K577-W581 WeakPolarHBondContact O-CB 3.41Å; K577-W581 PolarHBondContact O-N 3.47Å; V578-W581 PolarHBondContact O-N 3.42Å; N579-W581 VanDerWaalsContact C-N 3.31Å; N579-W581 PolarHBondContact O-N 3.5Å; W581-Q583 PolarHBondContact O-N 2.98Å; W581-T584 PolarHBondContact O-N 3.4Å; W581-T584 PolarHBondContact O-OG1 3.4Å; W581-R586 VanDerWaalsContact CZ2-O 3.29Å; W581-R586 WeakPolarHBondContact CZ2-O 3.17Å; W581-R586 PolarHBondContact NE1-O 3.48Å; W581-K588 PolarHBondContact NE1-O 2.6Å; W581-M589 HydrophobicContact CH2-CB 4.28Å; W581-M589 HydrophobicContact CZ2-CB 3.9Å; W581-I593 HydrophobicContact CB-CD1 3.76Å; W581-I593 HydrophobicContact CG-CD1 4.16Å
582	R	55.2	Low	53.5	Low	175 Å²	175	103.4 Å²	103.4	66%	0.66	51%	0.505	S	S	*	.	H	α-helix	trans	-55.6	-36.9	174.4	-75.2	-176.9	176.3	-157.8	0.1	112.5	V578 N579 T584	V578-R582 WeakPolarHBondContact O-CG 3.31Å; V578-R582 PolarHBondContact O-N 2.86Å; N579-R582 PolarHBondContact O-N 2.96Å; R582-T584 VanDerWaalsContact C-N 3.27Å; R582-T584 PolarHBondContact O-N 2.85Å
583	Q	59.3	Low	53.6	Low	158 Å²	158	100.1 Å²	100.1	74%	0.738	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-13.8	175.7	-73.2	169.9	-18.3	0	0	114.4	N579 K580 W581	N579-Q583 VanDerWaalsContact O-CG 3.3Å; N579-Q583 WeakPolarHBondContact O-CG 3.35Å; N579-Q583 PolarHBondContact O-N 2.94Å; K580-Q583 PolarHBondContact O-N 2.85Å; W581-Q583 PolarHBondContact O-N 2.98Å
584	T	54.8	Low	53.7	Low	73 Å²	73	98.4 Å²	98.4	45%	0.448	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.7	-177.5	58.2	0	0	0	0	115.4	K580 W581 R582 R586	K580-T584 WeakPolarHBondContact O-CG2 3.3Å; K580-T584 PolarHBondContact O-N 2.8Å; W581-T584 PolarHBondContact O-N 3.4Å; W581-T584 PolarHBondContact O-OG1 3.4Å; R582-T584 VanDerWaalsContact C-N 3.27Å; R582-T584 PolarHBondContact O-N 2.85Å; T584-R586 PolarHBondContact O-N 2.76Å
585	N	46.7	Very low	54	Low	151 Å²	151	106 Å²	106	81%	0.807	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	32	-178.5	-76.3	-9.4	0	0	0	114.5
586	R	46.1	Very low	53.7	Low	171 Å²	171	104.6 Å²	104.6	65%	0.645	50%	0.498	S	S	*	.			trans	-88.2	114.7	-179.5	-72	-175.7	176.8	-159.8	-1.1	111	W581 T584 K588	W581-R586 VanDerWaalsContact CZ2-O 3.29Å; W581-R586 WeakPolarHBondContact CZ2-O 3.17Å; W581-R586 PolarHBondContact NE1-O 3.48Å; T584-R586 PolarHBondContact O-N 2.76Å; R586-K588 PolarHBondContact O-N 3.04Å
587	N	53	Low	53	Low	166 Å²	166	104.9 Å²	104.9	89%	0.888	50%	0.499	S	S	*	.	S	Bend	trans	-58	-10.4	178.3	-66	-5.8	0	0	0	115.3
588	K	55.1	Low	51.7	Low	146 Å²	146	104.2 Å²	104.2	64%	0.635	52%	0.516	S	S	*	.	S	Bend	trans	-123.6	136.9	172.5	-73.8	-164.2	168	-168	0	112.3	W581 R586 E604	W581-K588 PolarHBondContact NE1-O 2.6Å; R586-K588 PolarHBondContact O-N 3.04Å; K588-E604 WeakPolarHBondContact CE-OE1 3.25Å
589	M	58.3	Low	50.7	Low	61 Å²	61	104.1 Å²	104.1	30%	0.3	52%	0.517	S	S	.	.			trans	-79.9	128.9	174.3	-179.1	175.8	161.5	0	0	109.9	W581 I593 L594 I597	W581-M589 HydrophobicContact CH2-CB 4.28Å; W581-M589 HydrophobicContact CZ2-CB 3.9Å; M589-I593 HydrophobicContact CE-CB 3.85Å; M589-I593 HydrophobicContact CE-CG2 3.66Å; M589-I593 HydrophobicContact CG-CB 4.2Å; M589-L594 HydrophobicContact CE-CD2 3.76Å; M589-L594 HydrophobicContact CE-CG 3.93Å; M589-L594 HydrophobicContact CG-CG 4.38Å; M589-L594 HydrophobicContact SD-CD2 4.05Å; M589-L594 HydrophobicContact SD-CG 4.32Å; M589-I597 HydrophobicContact CE-CD1 3.76Å
590	P	58.8	Low	49.4	Very low	55 Å²	55	106.9 Å²	106.9	36%	0.357	54%	0.542	S	S	.	.			trans	-66.2	145.8	-179.7	-22.2	32.3	0	0	0	113.4	E592 I593 L594	P590-E592 PolarHBondContact O-N 3.4Å; P590-E592 VanDerWaalsContact O-N 3.1Å; P590-I593 HydrophobicContact CB-CG1 4.35Å; P590-I593 HydrophobicContact CG-CD1 4.29Å; P590-I593 HydrophobicContact CG-CG1 4.4Å; P590-I593 PolarHBondContact O-N 3.44Å; P590-L594 PolarHBondContact O-N 3.23Å
591	D	53.9	Low	47.9	Very low	117 Å²	117	104.7 Å²	104.7	63%	0.626	54%	0.544	S	S	*	.	H	α-helix	trans	-54.9	-29	175.9	-66.8	-19.3	0	0	0	113.7	I593 L594 K595	D591-I593 VanDerWaalsContact C-N 3.31Å; D591-I593 PolarHBondContact O-N 3.03Å; D591-L594 PolarHBondContact O-N 2.82Å; D591-K595 WeakPolarHBondContact O-CB 3.42Å; D591-K595 VanDerWaalsContact O-CG 3.28Å; D591-K595 WeakPolarHBondContact O-CG 3.34Å; D591-K595 PolarHBondContact O-N 2.91Å
592	E	52.9	Low	46.4	Very low	120 Å²	120	108 Å²	108	56%	0.561	56%	0.56	S	S	*	*	H	α-helix	trans	-61	-38.7	172.5	-69.9	-171.2	-164.8	0	0	112.8	K577 P590 I596	K577-E592 IonicContact NZ-OE2 3.94Å; K577-E592 PolarHBondContact NZ-OE2 2.87Å; P590-E592 PolarHBondContact O-N 3.4Å; P590-E592 VanDerWaalsContact O-N 3.1Å; E592-I596 WeakPolarHBondContact O-CD1 3.36Å; E592-I596 VanDerWaalsContact O-CG1 3.26Å; E592-I596 WeakPolarHBondContact O-CG1 3.41Å; E592-I596 PolarHBondContact O-N 3.41Å; E592-I596 VanDerWaalsContact O-N 3.15Å
593	I	47.1	Very low	45.4	Very low	8 Å²	8	106.9 Å²	106.9	4%	0.041	56%	0.56	C	S	.	*	H	α-helix	trans	-78.2	-36.1	179.8	-43.6	-170.7	0	0	0	109.5	K577 V578 W581 M589 P590 D591 K595 I596 I597	K577-I593 HydrophobicContact CB-CD1 4.38Å; V578-I593 HydrophobicContact CG2-CG2 3.72Å; W581-I593 HydrophobicContact CB-CD1 3.76Å; W581-I593 HydrophobicContact CG-CD1 4.16Å; M589-I593 HydrophobicContact CE-CB 3.85Å; M589-I593 HydrophobicContact CE-CG2 3.66Å; M589-I593 HydrophobicContact CG-CB 4.2Å; P590-I593 HydrophobicContact CB-CG1 4.35Å; P590-I593 HydrophobicContact CG-CD1 4.29Å; P590-I593 HydrophobicContact CG-CG1 4.4Å; P590-I593 PolarHBondContact O-N 3.44Å; D591-I593 VanDerWaalsContact C-N 3.31Å; D591-I593 PolarHBondContact O-N 3.03Å; I593-K595 VanDerWaalsContact C-N 3.3Å; I593-K595 PolarHBondContact O-N 3.1Å; I593-I596 PolarHBondContact O-N 3.47Å; I593-I596 VanDerWaalsContact O-N 3.15Å; I593-I597 HydrophobicContact CG2-CD1 4.11Å; I593-I597 WeakPolarHBondContact O-CG1 3.47Å; I593-I597 PolarHBondContact O-N 2.86Å
594	L	51.3	Low	44.1	Very low	63 Å²	63	106.4 Å²	106.4	33%	0.33	56%	0.558	S	S	.	*	H	α-helix	trans	-60.3	-40.2	171.8	-73.1	166.8	0	0	0	111.7	M589 P590 D591 I597 G598	M589-L594 HydrophobicContact CE-CD2 3.76Å; M589-L594 HydrophobicContact CE-CG 3.93Å; M589-L594 HydrophobicContact CG-CG 4.38Å; M589-L594 HydrophobicContact SD-CD2 4.05Å; M589-L594 HydrophobicContact SD-CG 4.32Å; P590-L594 PolarHBondContact O-N 3.23Å; D591-L594 PolarHBondContact O-N 2.82Å; L594-I597 PolarHBondContact O-N 3.47Å; L594-G598 PolarHBondContact O-N 3.08Å
595	K	48.4	Very low	43	Very low	171 Å²	171	112.1 Å²	112.1	74%	0.743	58%	0.577	S	S	*	*	H	α-helix	trans	-65.4	-34.9	173.3	-75.7	169.5	-178.9	172.5	0	113.1	D591 I593	D591-K595 WeakPolarHBondContact O-CB 3.42Å; D591-K595 VanDerWaalsContact O-CG 3.28Å; D591-K595 WeakPolarHBondContact O-CG 3.34Å; D591-K595 PolarHBondContact O-N 2.91Å; I593-K595 VanDerWaalsContact C-N 3.3Å; I593-K595 PolarHBondContact O-N 3.1Å
596	I	40.6	Very low	42.3	Very low	84 Å²	84	110 Å²	110	43%	0.431	57%	0.565	S	S	.	*	H	α-helix	trans	-71	-33.2	176.9	-72	163.6	0	0	0	111.9	K577 E592 I593 G598	K577-I596 HydrophobicContact CD-CD1 3.75Å; E592-I596 WeakPolarHBondContact O-CD1 3.36Å; E592-I596 VanDerWaalsContact O-CG1 3.26Å; E592-I596 WeakPolarHBondContact O-CG1 3.41Å; E592-I596 PolarHBondContact O-N 3.41Å; E592-I596 VanDerWaalsContact O-N 3.15Å; I593-I596 PolarHBondContact O-N 3.47Å; I593-I596 VanDerWaalsContact O-N 3.15Å; I596-G598 VanDerWaalsContact C-N 3.29Å; I596-G598 PolarHBondContact O-N 2.85Å
597	I	39	Very low	41.5	Very low	86 Å²	86	108.2 Å²	108.2	44%	0.441	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.6	0.4	-178.5	-60.3	-178.8	0	0	0	112.1	V578 M589 I593 L594 S599	V578-I597 HydrophobicContact CG2-CD1 4.48Å; M589-I597 HydrophobicContact CE-CD1 3.76Å; I593-I597 HydrophobicContact CG2-CD1 4.11Å; I593-I597 WeakPolarHBondContact O-CG1 3.47Å; I593-I597 PolarHBondContact O-N 2.86Å; L594-I597 PolarHBondContact O-N 3.47Å; I597-S599 PolarHBondContact O-N 2.78Å; I597-S599 PolarHBondContact O-OG 3.49Å
598	G	28.2	Very low	40.1	Very low	70 Å²	70	103.1 Å²	103.1	72%	0.722	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.3	5.8	161.4	0	0	0	0	0	116.7	L594 I596	L594-G598 PolarHBondContact O-N 3.08Å; I596-G598 VanDerWaalsContact C-N 3.29Å; I596-G598 PolarHBondContact O-N 2.85Å
599	S	30.6	Very low	38.6	Very low	31 Å²	31	103.6 Å²	103.6	22%	0.217	57%	0.568	C	S	.	*			trans	-121.2	96.3	-166.4	52.8	0	0	0	0	112.5	I597 S601 F602	I597-S599 PolarHBondContact O-N 2.78Å; I597-S599 PolarHBondContact O-OG 3.49Å; S599-S601 PolarHBondContact O-N 3.37Å; S599-F602 VanDerWaalsContact OG-CD2 3.31Å; S599-F602 WeakPolarHBondContact OG-CD2 3.37Å
600	S	31.7	Very low	37	Very low	135 Å²	135	108.5 Å²	108.5	94%	0.944	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	23.5	176.7	61.9	0	0	0	0	114.4
601	S	32	Very low	35.3	Very low	90 Å²	90	114.8 Å²	114.8	63%	0.629	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	-6.9	-169.6	53	0	0	0	0	114.7	S599 K603	S599-S601 PolarHBondContact O-N 3.37Å; S601-K603 PolarHBondContact O-N 3.24Å
602	F	30.8	Very low	33.9	Very low	137 Å²	137	118.9 Å²	118.9	60%	0.601	62%	0.62	S	S	*	*			trans	-64.6	119.6	176.2	-98.1	-87	0	0	0	111.2	S599	S599-F602 VanDerWaalsContact OG-CD2 3.31Å; S599-F602 WeakPolarHBondContact OG-CD2 3.37Å
603	K	34.7	Very low	32.5	Very low	151 Å²	151	118.1 Å²	118.1	66%	0.657	63%	0.628	S	S	*	*			trans	-96.7	142.2	166.4	-65.5	175.7	180	172.2	0	109.3	S601 K605 D606	S601-K603 PolarHBondContact O-N 3.24Å; K603-K605 PolarHBondContact O-N 3.45Å; K603-D606 WeakPolarHBondContact CB-OD2 3.17Å; K603-D606 PolarHBondContact N-OD2 2.96Å; K603-D606 PolarHBondContact O-N 3.4Å
604	E	31.4	Very low	31.4	Very low	149 Å²	149	125.3 Å²	125.3	70%	0.696	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-3.7	179.6	-150.4	167.2	-149.9	0	0	113.5	K588	K588-E604 WeakPolarHBondContact CE-OE1 3.25Å
605	K	33.4	Very low	30.1	Very low	193 Å²	193	131.3 Å²	131.3	84%	0.839	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-11.1	176.8	-63.7	-170.3	176.7	-173.3	0	114.7	K603 V607	K603-K605 PolarHBondContact O-N 3.45Å; K605-V607 PolarHBondContact O-N 2.84Å
606	D	31.5	Very low	29	Very low	107 Å²	107	127.9 Å²	127.9	57%	0.572	70%	0.695	S	S	*	*			trans	-83.3	3.8	-178.6	-54.7	-38.7	0	0	0	112.3	K603 G608	K603-D606 WeakPolarHBondContact CB-OD2 3.17Å; K603-D606 PolarHBondContact N-OD2 2.96Å; K603-D606 PolarHBondContact O-N 3.4Å; D606-G608 PolarHBondContact O-N 2.84Å
607	V	28.5	Very low	28.2	Very low	132 Å²	132	133.4 Å²	133.4	80%	0.8	72%	0.716	S	S	*	*			trans	-80.4	64.3	174.4	-169.1	0	0	0	0	109.8	K605	K605-V607 PolarHBondContact O-N 2.84Å
608	G	23.6	Very low	27.5	Very low	60 Å²	60	133.7 Å²	133.7	62%	0.619	73%	0.726	S	S	*	*			trans	-140.8	108.1	-172.5	0	0	0	0	0	114.9	D606	D606-G608 PolarHBondContact O-N 2.84Å
609	L	24.2	Very low	27.5	Very low	155 Å²	155	139.5 Å²	139.5	81%	0.812	73%	0.731	S	S	*	*			trans	53.2	89.3	153.5	-67.6	168.4	0	0	0	119.9
610	H	24.6	Very low	27.3	Very low	165 Å²	165	144.1 Å²	144.1	76%	0.764	76%	0.758	S	S	*	*			trans	-165.1	124.9	130.5	-89.9	-63.8	0	0	0	106.7	Y612	H610-Y612 AromaticContact CE1-CE2 3.99Å; H610-Y612 AromaticContact ND1-CD2 3.52Å; H610-Y612 AromaticContact ND1-CE2 3.85Å
611	K	23.7	Very low	27	Very low	187 Å²	187	146.2 Å²	146.2	81%	0.813	75%	0.75	S	S	*	*			cis	74.8	32.5	5	-139.3	-172.3	179	-176.9	0	118.6
612	Y	23.2	Very low	26.8	Very low	203 Å²	203	148.7 Å²	148.7	80%	0.796	76%	0.761	S	S	*	*			trans	-142.6	146.8	141.2	-72.9	-78.4	0	0	0	106.8	H610	H610-Y612 AromaticContact CE1-CE2 3.99Å; H610-Y612 AromaticContact ND1-CD2 3.52Å; H610-Y612 AromaticContact ND1-CE2 3.85Å
613	S	24.4	Very low	26.6	Very low	104 Å²	104	145.9 Å²	145.9	73%	0.727	77%	0.771	S	S	*	*			cis	-136.9	164.5	-6.4	50.4	0	0	0	0	110.1
614	I	22.8	Very low	26.2	Very low	159 Å²	159	144.5 Å²	144.5	82%	0.815	77%	0.771	S	S	*	*			trans	-113.9	103.9	177.9	-61.9	170.5	0	0	0	107.9
615	E	23.9	Very low	26.2	Very low	189 Å²	189	145.3 Å²	145.3	88%	0.883	77%	0.772	S	S	*	*			trans	-151.6	46.1	-179.5	-150.6	152	-136.6	0	0	114.5
616	A	25.5	Very low	25.9	Very low	99 Å²	99	141.8 Å²	141.8	82%	0.818	77%	0.767	S	S	*	*	S	Bend	trans	-139.6	3.6	171.4	0	0	0	0	0	114.8
617	F	24.4	Very low	25.9	Very low	200 Å²	200	145.4 Å²	145.4	88%	0.877	78%	0.78	S	S	*	*			trans	-109.9	95.4	178.1	-88.3	-83.9	0	0	0	111.5
618	S	25.3	Very low	25.9	Very low	92 Å²	92	146.9 Å²	146.9	64%	0.643	78%	0.776	S	S	*	*			trans	-174.2	152.3	144.5	62.9	0	0	0	0	111.8
619	K	26.7	Very low	26.1	Very low	192 Å²	192	151.7 Å²	151.7	84%	0.835	78%	0.78	S	S	*	*			trans	70.2	130.2	173.9	-47.8	162.9	-169.6	172.4	0	112.6
620	V	26.9	Very low	26.4	Very low	128 Å²	128	150 Å²	150	78%	0.776	77%	0.772	S	S	*	*			cis	-136	119.9	11	176.8	0	0	0	0	111.5
621	K	25.9	Very low	26.6	Very low	179 Å²	179	149.3 Å²	149.3	78%	0.778	77%	0.769	S	S	*	*			trans	20.2	139.4	136.4	-58	-176.4	171.5	-174.3	0	122.6
622	T	26.9	Very low	27	Very low	141 Å²	141	146.6 Å²	146.6	87%	0.865	76%	0.763	S	S	*	*			trans	53.9	132.3	139.3	56.7	0	0	0	0	119.8
623	G	26.2	Very low	27.3	Very low	78 Å²	78	144.1 Å²	144.1	80%	0.804	76%	0.763	S	S	*	*			cis	-155	-156.7	-3.7	0	0	0	0	0	108.2
624	D	28	Very low	27.7	Very low	123 Å²	123	147.5 Å²	147.5	66%	0.658	77%	0.767	S	S	*	*			cis	-165.9	154.6	4.6	-172.4	22.4	0	0	0	107.9
625	K	31	Very low	27.9	Very low	166 Å²	166	144.5 Å²	144.5	72%	0.722	76%	0.76	S	S	*	*			trans	61.5	153.7	167.3	-70.5	157	-177.5	127.2	0	119.6
626	T	27.4	Very low	28	Very low	119 Å²	119	144.5 Å²	144.5	73%	0.73	76%	0.757	S	S	*	*			cis	-168.2	176	-46.8	17.2	0	0	0	0	107.9
627	E	31.5	Very low	28.1	Very low	182 Å²	182	148.2 Å²	148.2	85%	0.85	76%	0.758	S	S	*	*			trans	77.6	148.4	166	-48.9	-173.5	151.9	0	0	118.1
628	K	28.5	Very low	28.3	Very low	164 Å²	164	143.2 Å²	143.2	71%	0.713	75%	0.747	S	S	*	*				-176.6	172.6	-51.5	-115.9	-161.7	170.5	-157.1	0	108.9
629	F	27	Very low	28.6	Very low	161 Å²	161	144.1 Å²	144.1	71%	0.706	75%	0.754	S	S	*	*			trans	74.3	118.3	171.9	-59.4	-77.8	0	0	0	115
630	D	29.7	Very low	28.6	Very low	118 Å²	118	145.2 Å²	145.2	63%	0.631	75%	0.753	S	S	*	*			cis	99	144.6	40.2	-65.3	-5.4	0	0	0	109.6
631	E	29.4	Very low	28.8	Very low	151 Å²	151	144.9 Å²	144.9	71%	0.706	75%	0.747	S	S	*	*			cis	-163	-177.4	-0.2	-124	178.5	170.9	0	0	111
632	N	32.6	Very low	28.9	Very low	130 Å²	130	145 Å²	145	70%	0.695	75%	0.747	S	S	*	*			trans	68.6	127.5	164.2	-53	-42.3	0	0	0	118.4
633	I	29.6	Very low	28.9	Very low	152 Å²	152	145.9 Å²	145.9	78%	0.779	75%	0.746	S	S	*	*			cis	81.1	112.8	15.6	-45.4	176.4	0	0	0	116.1
634	E	31.9	Very low	28.9	Very low	174 Å²	174	147.5 Å²	147.5	81%	0.813	74%	0.74	S	S	*	*			trans	162.8	126.7	141	-90.5	-174.9	158.3	0	0	108.9
635	S	28	Very low	28.7	Very low	96 Å²	96	147.2 Å²	147.2	67%	0.671	75%	0.746	S	S	*	*				81.1	147.8	65.3	94.5	0	0	0	0	112.9
636	F	24.8	Very low	28.6	Very low	190 Å²	190	148.3 Å²	148.3	83%	0.833	75%	0.751	S	S	*	*			cis	-160.4	178.8	-29	-137.1	-88.8	0	0	0	108.4
637	E	29.3	Very low	28.7	Very low	176 Å²	176	148.4 Å²	148.4	82%	0.822	75%	0.747	S	S	*	*			trans	67.4	163.6	159.7	-68	-164.3	169.4	0	0	120.8
638	S	27.4	Very low	28.5	Very low	95 Å²	95	146.3 Å²	146.3	66%	0.664	74%	0.741	S	S	*	*			cis	-170.5	163.7	-29.1	-178.1	0	0	0	0	111.8
639	S	31.1	Very low	28.6	Very low	112 Å²	112	144.7 Å²	144.7	78%	0.783	74%	0.74	S	S	*	*			trans	68.6	159.4	157.2	77.2	0	0	0	0	120.5
640	R	28.1	Very low	28.5	Very low	215 Å²	215	142.4 Å²	142.4	81%	0.811	74%	0.74	S	S	*	*			cis	-163.5	176	-43.8	-142	-179.2	-160.6	162.1	5.6	110.8
641	D	31.5	Very low	28.4	Very low	120 Å²	120	141.9 Å²	141.9	64%	0.642	75%	0.745	S	S	*	*			trans	68.2	162	158.8	-63.6	-35.4	0	0	0	119.2
642	K	27.4	Very low	28.2	Very low	182 Å²	182	143.6 Å²	143.6	79%	0.791	75%	0.753	S	S	*	*			cis	167.2	136.6	-39.7	-108.9	-176.4	178.9	176.9	0	107
643	L	26.7	Very low	27.9	Very low	159 Å²	159	142.4 Å²	142.4	83%	0.832	76%	0.755	S	S	*	*			trans	157.9	128.5	136.9	-87.3	158.9	0	0	0	115.9
644	T	26.8	Very low	27.8	Very low	112 Å²	112	142.2 Å²	142.2	69%	0.687	75%	0.754	S	S	*	*			trans	17.5	123.2	147.1	53.2	0	0	0	0	120.9
645	C	24	Very low	27.5	Very low	117 Å²	117	141.9 Å²	141.9	79%	0.791	75%	0.753	S	S	*	*				68.6	119.3	66.8	-67.2	0	0	0	0	116.5
646	K	28.2	Very low	27.4	Very low	189 Å²	189	144.2 Å²	144.2	82%	0.822	76%	0.756	S	S	*	*				176	152	122.6	-102.1	176.1	-178	179.7	0	116.5
647	N	30.3	Very low	27.4	Very low	122 Å²	122	144.1 Å²	144.1	65%	0.652	76%	0.758	S	S	*	*			trans	81.5	120.5	144.6	-70.4	9.8	0	0	0	123.8
648	L	27.3	Very low	27.2	Very low	137 Å²	137	139.6 Å²	139.6	72%	0.717	75%	0.746	S	S	*	*				66.4	138.8	120.3	-59.1	173.3	0	0	0	120.4
649	D	29.1	Very low	27.2	Very low	130 Å²	130	140.2 Å²	140.2	70%	0.695	74%	0.742	S	S	*	*			cis	-158.1	176.6	-13.9	-143.3	-8.6	0	0	0	113.9
650	T	25.9	Very low	27.2	Very low	114 Å²	114	140 Å²	140	70%	0.699	75%	0.747	S	S	*	*			trans	-16.9	138.2	169.5	57.6	0	0	0	0	120.1
651	S	27.7	Very low	27.4	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	73%	0.734	S	S	*	*				-174.8	120.5	105.6	56.2	0	0	0	0	114.9
652	Q	25.3	Very low	27.5	Very low	187 Å²	187	134 Å²	134	87%	0.874	73%	0.727	S	S	*	*			trans	36.2	116.2	141.6	-55	174	4.7	0	0	118.5
653	S	26.4	Very low	27.7	Very low	106 Å²	106	132 Å²	132	74%	0.741	73%	0.725	S	S	*	*				-174.2	138.1	75.9	44.6	0	0	0	0	115
654	I	26.4	Very low	28	Very low	147 Å²	147	130 Å²	130	75%	0.754	72%	0.715	S	S	*	*			trans	53.8	101.8	133	-57.4	173.8	0	0	0	119
655	H	25.6	Very low	28.3	Very low	168 Å²	168	130.2 Å²	130.2	78%	0.778	71%	0.706	S	S	*	*				55.2	156.7	128.9	-67.7	-41.1	0	0	0	121.6
656	I	26.1	Very low	28.7	Very low	144 Å²	144	128.5 Å²	128.5	74%	0.738	69%	0.688	S	S	*	*			cis	-151.3	167.5	2.2	-126.1	157.4	0	0	0	110.3
657	E	24.4	Very low	28.9	Very low	189 Å²	189	126.7 Å²	126.7	88%	0.883	68%	0.68	S	S	*	*			trans	-75.3	132.6	176.2	-58.2	165.9	105.5	0	0	114.4
658	S	25.2	Very low	29	Very low	81 Å²	81	123.8 Å²	123.8	57%	0.566	67%	0.674	S	S	*	*			trans	-164.2	157.8	159.1	-148	0	0	0	0	106.8
659	D	28.1	Very low	29.2	Very low	108 Å²	108	124.6 Å²	124.6	58%	0.578	67%	0.668	S	S	*	*	S	Bend	cis	-134.6	33.8	29.3	-70.6	-60.8	0	0	0	114.9	L661	D659-L661 PolarHBondContact O-N 3.29Å
660	A	30.8	Very low	29.5	Very low	108 Å²	108	120.7 Å²	120.7	89%	0.893	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	13.4	173.8	0	0	0	0	0	115
661	L	32.1	Very low	29.9	Very low	101 Å²	101	118.6 Å²	118.6	53%	0.529	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.6	-18.7	-167.7	-148.7	71.3	0	0	0	114.2	D659 N664 K665	D659-L661 PolarHBondContact O-N 3.29Å; L661-N664 PolarHBondContact O-N 2.92Å; L661-K665 PolarHBondContact O-N 3.31Å
662	E	32.8	Very low	30.1	Very low	108 Å²	108	114.8 Å²	114.8	51%	0.505	61%	0.612	S	S	.	*	H	α-helix	trans	-70.7	-43.4	-171.1	-64.5	-150.6	115.7	0	0	113.9	N664 K665 I666	E662-N664 PolarHBondContact O-N 3.4Å; E662-K665 WeakPolarHBondContact O-CA 3.15Å; E662-K665 WeakPolarHBondContact O-CB 3.46Å; E662-K665 PolarHBondContact O-N 2.81Å; E662-I666 PolarHBondContact O-N 3.18Å
663	N	33.1	Very low	30.7	Very low	140 Å²	140	109.5 Å²	109.5	75%	0.749	59%	0.587	S	S	*	*	H	α-helix	trans	-58.7	-21.6	178	-89.5	-53	0	0	0	114.1
664	N	32.8	Very low	31.1	Very low	115 Å²	115	109.5 Å²	109.5	62%	0.615	58%	0.575	S	S	*	*	H	α-helix	trans	-91.6	-29.6	171.9	-75.9	-44.5	0	0	0	112.8	L661 E662 A668	L661-N664 PolarHBondContact O-N 2.92Å; E662-N664 PolarHBondContact O-N 3.4Å; N664-A668 WeakPolarHBondContact O-CB 3.45Å; N664-A668 PolarHBondContact O-N 2.83Å; N664-A668 VanDerWaalsContact O-N 3.09Å
665	K	33	Very low	31.4	Very low	117 Å²	117	106.1 Å²	106.1	51%	0.509	56%	0.558	S	S	.	*	H	α-helix	trans	-65.3	-43.4	171	-75.4	174.9	177.3	168.4	0	111.8	L661 E662 K667 A668 Y669	L661-K665 PolarHBondContact O-N 3.31Å; E662-K665 WeakPolarHBondContact O-CA 3.15Å; E662-K665 WeakPolarHBondContact O-CB 3.46Å; E662-K665 PolarHBondContact O-N 2.81Å; K665-K667 PolarHBondContact O-N 2.78Å; K665-A668 CarbonylContact O-C 3.52Å; K665-A668 PolarHBondContact O-N 3.45Å; K665-Y669 WeakPolarHBondContact O-CB 3.4Å; K665-Y669 PolarHBondContact O-N 3.3Å
666	I	31.6	Very low	31.7	Very low	81 Å²	81	107.1 Å²	107.1	42%	0.415	56%	0.555	S	S	.	*	H	α-helix	trans	-61.8	-45.4	179.5	-65	168.9	0	0	0	110.6	E662 A668 Y669 L670	E662-I666 PolarHBondContact O-N 3.18Å; I666-A668 PolarHBondContact O-N 2.83Å; I666-Y669 PolarHBondContact O-N 2.84Å; I666-Y669 VanDerWaalsContact O-N 3.15Å; I666-L670 HydrophobicContact CG2-CD1 4.07Å; I666-L670 PolarHBondContact O-N 2.92Å
667	K	32.4	Very low	32.1	Very low	151 Å²	151	107.7 Å²	107.7	66%	0.657	56%	0.559	S	S	*	*	H	α-helix	trans	-60.6	-41.2	172.8	-84.6	178.8	174	171.2	0	113.2	K665 Y669 V671	K665-K667 PolarHBondContact O-N 2.78Å; K667-Y669 VanDerWaalsContact C-N 3.32Å; K667-V671 WeakPolarHBondContact O-CB 3.26Å; K667-V671 VanDerWaalsContact O-CG2 3.31Å; K667-V671 WeakPolarHBondContact O-CG2 3.35Å; K667-V671 PolarHBondContact O-N 3.37Å; K667-V671 VanDerWaalsContact O-N 3.1Å
668	A	32.2	Very low	32.2	Very low	62 Å²	62	102.5 Å²	102.5	51%	0.512	54%	0.543	S	S	.	.	H	α-helix	trans	-66.2	-34.6	174.9	0	0	0	0	0	112.5	N664 K665 I666 G672	N664-A668 WeakPolarHBondContact O-CB 3.45Å; N664-A668 PolarHBondContact O-N 2.83Å; N664-A668 VanDerWaalsContact O-N 3.09Å; K665-A668 CarbonylContact O-C 3.52Å; K665-A668 PolarHBondContact O-N 3.45Å; I666-A668 PolarHBondContact O-N 2.83Å; A668-G672 PolarHBondContact O-N 2.63Å
669	Y	31.6	Very low	32.4	Very low	154 Å²	154	103 Å²	103	60%	0.604	54%	0.543	S	S	*	.	H	α-helix	trans	-71.4	-45.1	178.8	-166.1	-104.7	0	0	0	112.1	K665 I666 K667 G672 Q673	K665-Y669 WeakPolarHBondContact O-CB 3.4Å; K665-Y669 PolarHBondContact O-N 3.3Å; I666-Y669 PolarHBondContact O-N 2.84Å; I666-Y669 VanDerWaalsContact O-N 3.15Å; K667-Y669 VanDerWaalsContact C-N 3.32Å; Y669-G672 CarbonylContact O-C 3.6Å; Y669-G672 WeakPolarHBondContact O-CA 3.41Å; Y669-G672 PolarHBondContact O-N 3.14Å; Y669-G672 VanDerWaalsContact O-N 3.11Å; Y669-Q673 HydrophobicContact CD1-CG 4.31Å; Y669-Q673 HydrophobicContact CE1-CG 4.19Å; Y669-Q673 WeakPolarHBondContact O-CG 3.33Å; Y669-Q673 PolarHBondContact O-N 2.88Å
670	L	35.6	Very low	32.4	Very low	47 Å²	47	103.5 Å²	103.5	25%	0.246	56%	0.555	C	S	.	*	H	α-helix	trans	-61.1	-44.4	173.8	-75	167	0	0	0	111.8	I666 G672 Q673 Q674	I666-L670 HydrophobicContact CG2-CD1 4.07Å; I666-L670 PolarHBondContact O-N 2.92Å; L670-G672 VanDerWaalsContact C-N 3.29Å; L670-G672 PolarHBondContact O-N 2.73Å; L670-Q673 PolarHBondContact O-N 2.85Å; L670-Q674 WeakPolarHBondContact O-CG 3.37Å; L670-Q674 PolarHBondContact O-N 2.67Å
671	V	35.5	Very low	32.6	Very low	70 Å²	70	107.7 Å²	107.7	42%	0.424	55%	0.553	S	S	.	*	H	α-helix	trans	-62.7	-36.8	172.8	171.1	0	0	0	0	111.5	K667 Q674 L675	K667-V671 WeakPolarHBondContact O-CB 3.26Å; K667-V671 VanDerWaalsContact O-CG2 3.31Å; K667-V671 WeakPolarHBondContact O-CG2 3.35Å; K667-V671 PolarHBondContact O-N 3.37Å; K667-V671 VanDerWaalsContact O-N 3.1Å; V671-Q674 PolarHBondContact O-N 3.24Å; V671-L675 HydrophobicContact CG1-CD1 4.09Å; V671-L675 WeakPolarHBondContact O-CB 3.48Å; V671-L675 WeakPolarHBondContact O-CG 3.35Å; V671-L675 PolarHBondContact O-N 3.29Å
672	G	32.1	Very low	32.7	Very low	27 Å²	27	108.6 Å²	108.6	28%	0.278	56%	0.557	S	S	.	*	H	α-helix	trans	-64.3	-39.3	173.4	0	0	0	0	0	113.8	A668 Y669 L670 L675 R676	A668-G672 PolarHBondContact O-N 2.63Å; Y669-G672 CarbonylContact O-C 3.6Å; Y669-G672 WeakPolarHBondContact O-CA 3.41Å; Y669-G672 PolarHBondContact O-N 3.14Å; Y669-G672 VanDerWaalsContact O-N 3.11Å; L670-G672 VanDerWaalsContact C-N 3.29Å; L670-G672 PolarHBondContact O-N 2.73Å; G672-L675 PolarHBondContact O-N 3.4Å; G672-R676 WeakPolarHBondContact O-CG 3.34Å; G672-R676 PolarHBondContact O-N 2.68Å
673	Q	37.8	Very low	32.8	Very low	76 Å²	76	107 Å²	107	36%	0.355	56%	0.556	S	S	.	*	H	α-helix	trans	-69.6	-43.2	175.1	-68.3	-77.3	74	0	0	111.2	Y669 L670 L675 R676 L677	Y669-Q673 HydrophobicContact CD1-CG 4.31Å; Y669-Q673 HydrophobicContact CE1-CG 4.19Å; Y669-Q673 WeakPolarHBondContact O-CG 3.33Å; Y669-Q673 PolarHBondContact O-N 2.88Å; L670-Q673 PolarHBondContact O-N 2.85Å; Q673-L675 VanDerWaalsContact C-N 3.31Å; Q673-L675 PolarHBondContact O-N 3.33Å; Q673-R676 PolarHBondContact O-N 2.89Å; Q673-L677 WeakPolarHBondContact O-CG 3.25Å; Q673-L677 PolarHBondContact O-N 3.37Å
674	Q	33.9	Very low	33.1	Very low	105 Å²	105	105.3 Å²	105.3	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-61.8	-36.5	174	-70.4	179.7	5	0	0	112	E414 L670 V671 L677 S678	E414-Q674 PolarHBondContact OE1-NE2 2.64Å; L670-Q674 WeakPolarHBondContact O-CG 3.37Å; L670-Q674 PolarHBondContact O-N 2.67Å; V671-Q674 PolarHBondContact O-N 3.24Å; Q674-L677 PolarHBondContact O-N 3.44Å; Q674-S678 WeakPolarHBondContact O-CB 3.33Å; Q674-S678 PolarHBondContact O-N 3.03Å; Q674-S678 PolarHBondContact O-OG 2.86Å
675	L	32.5	Very low	33.6	Very low	76 Å²	76	106.9 Å²	106.9	40%	0.398	56%	0.556	S	S	.	*	H	α-helix	trans	-67.8	-39	172.4	-78.1	166.8	0	0	0	113	V671 G672 Q673 L677 S678	V671-L675 HydrophobicContact CG1-CD1 4.09Å; V671-L675 WeakPolarHBondContact O-CB 3.48Å; V671-L675 WeakPolarHBondContact O-CG 3.35Å; V671-L675 PolarHBondContact O-N 3.29Å; G672-L675 PolarHBondContact O-N 3.4Å; Q673-L675 VanDerWaalsContact C-N 3.31Å; Q673-L675 PolarHBondContact O-N 3.33Å; L675-L677 VanDerWaalsContact C-N 3.32Å; L675-L677 PolarHBondContact O-N 3.42Å; L675-S678 WeakPolarHBondContact CA-OG 3.48Å; L675-S678 PolarHBondContact O-N 3.44Å; L675-S678 PolarHBondContact O-OG 3.36Å
676	R	32.4	Very low	33.8	Very low	190 Å²	190	102.7 Å²	102.7	72%	0.717	55%	0.546	S	S	*	.	H	α-helix	trans	-64.7	-34.4	174.7	-80.7	176.9	168.6	178.4	-4	113	G672 Q673 S678	G672-R676 WeakPolarHBondContact O-CG 3.34Å; G672-R676 PolarHBondContact O-N 2.68Å; Q673-R676 PolarHBondContact O-N 2.89Å; R676-S678 VanDerWaalsContact C-N 3.3Å; R676-S678 PolarHBondContact O-N 2.95Å
677	L	33.5	Very low	34.2	Very low	156 Å²	156	105.4 Å²	105.4	82%	0.817	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-5.6	179.3	-68.9	169.5	0	0	0	114.1	Q673 Q674 L675	Q673-L677 WeakPolarHBondContact O-CG 3.25Å; Q673-L677 PolarHBondContact O-N 3.37Å; Q674-L677 PolarHBondContact O-N 3.44Å; L675-L677 VanDerWaalsContact C-N 3.32Å; L675-L677 PolarHBondContact O-N 3.42Å
678	S	27.1	Very low	34.9	Very low	79 Å²	79	102.6 Å²	102.6	55%	0.552	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	15.5	-168.2	55.9	0	0	0	0	116.4	Q674 L675 R676	Q674-S678 WeakPolarHBondContact O-CB 3.33Å; Q674-S678 PolarHBondContact O-N 3.03Å; Q674-S678 PolarHBondContact O-OG 2.86Å; L675-S678 WeakPolarHBondContact CA-OG 3.48Å; L675-S678 PolarHBondContact O-N 3.44Å; L675-S678 PolarHBondContact O-OG 3.36Å; R676-S678 VanDerWaalsContact C-N 3.3Å; R676-S678 PolarHBondContact O-N 2.95Å
679	T	29.6	Very low	35.5	Very low	91 Å²	91	104.3 Å²	104.3	56%	0.558	55%	0.549	S	S	*	.			trans	-131	88.1	171.4	42.8	0	0	0	0	113.9
680	S	28.4	Very low	35.9	Very low	120 Å²	120	102.8 Å²	102.8	84%	0.839	55%	0.549	S	S	*	.	S	Bend	trans	-70.7	129.3	157.5	51	0	0	0	0	109.5
681	K	35.6	Very low	36.7	Very low	195 Å²	195	108.4 Å²	108.4	85%	0.848	57%	0.572	S	S	*	*	S	Bend	trans	67.4	89.5	-169.8	-53.9	-179.6	-179.5	-179.6	0	114.7	T683	K681-T683 PolarHBondContact O-N 3.31Å
682	I	33.4	Very low	37.4	Very low	120 Å²	120	110.1 Å²	110.1	62%	0.615	58%	0.575	S	S	*	*			trans	-69.9	119	164.3	-60.7	172.3	0	0	0	108.9	Q687	I682-Q687 HydrophobicContact CG2-CG 4.07Å
683	T	35.5	Very low	37.8	Very low	76 Å²	76	112.1 Å²	112.1	47%	0.466	58%	0.576	S	S	.	*			trans	-87.1	164.6	169.1	58.5	0	0	0	0	110.9	K681 Q685 G686 Q687	K681-T683 PolarHBondContact O-N 3.31Å; T683-Q685 PolarHBondContact O-N 2.81Å; T683-G686 WeakPolarHBondContact O-CA 3.34Å; T683-G686 PolarHBondContact O-N 3.14Å; T683-Q687 PolarHBondContact O-N 3.28Å
684	P	38.1	Very low	38.1	Very low	103 Å²	103	114.9 Å²	114.9	67%	0.669	59%	0.593	S	S	*	*	H	α-helix	trans	-55.5	-36.7	175.4	-27.8	36.4	0	0	0	113.5	G686 Q687 T688	P684-G686 VanDerWaalsContact C-N 3.25Å; P684-G686 PolarHBondContact O-N 2.85Å; P684-Q687 WeakPolarHBondContact O-CB 3.47Å; P684-Q687 PolarHBondContact O-N 2.95Å; P684-Q687 VanDerWaalsContact O-N 3.09Å; P684-T688 PolarHBondContact O-N 3.41Å; P684-T688 VanDerWaalsContact O-N 3.13Å; P684-T688 PolarHBondContact O-OG1 2.82Å
685	Q	43.7	Very low	39.2	Very low	149 Å²	149	114.2 Å²	114.2	70%	0.696	60%	0.6	S	S	*	*	H	α-helix	trans	-60.3	-33.2	173.1	-73.3	174.2	-42.5	0	0	112.8	T683 T688 Q689	T683-Q685 PolarHBondContact O-N 2.81Å; Q685-T688 PolarHBondContact O-N 2.79Å; Q685-Q689 PolarHBondContact O-N 3.4Å
686	G	37.1	Very low	40.4	Very low	29 Å²	29	114.1 Å²	114.1	30%	0.299	60%	0.6	S	S	.	*	H	α-helix	trans	-65.2	-36.7	173.5	0	0	0	0	0	112.9	T683 P684 M690	T683-G686 WeakPolarHBondContact O-CA 3.34Å; T683-G686 PolarHBondContact O-N 3.14Å; P684-G686 VanDerWaalsContact C-N 3.25Å; P684-G686 PolarHBondContact O-N 2.85Å; G686-M690 WeakPolarHBondContact O-CB 3.41Å; G686-M690 PolarHBondContact O-N 3.44Å
687	Q	40	Very low	40.9	Very low	137 Å²	137	107.8 Å²	107.8	64%	0.64	58%	0.583	S	S	*	*	H	α-helix	trans	-67.2	-39.5	172.8	-66.8	-172.2	-12.2	0	0	111.9	I682 T683 P684 M690 K691	I682-Q687 HydrophobicContact CG2-CG 4.07Å; T683-Q687 PolarHBondContact O-N 3.28Å; P684-Q687 WeakPolarHBondContact O-CB 3.47Å; P684-Q687 PolarHBondContact O-N 2.95Å; P684-Q687 VanDerWaalsContact O-N 3.09Å; Q687-M690 PolarHBondContact O-N 3.1Å; Q687-K691 PolarHBondContact O-N 2.79Å
688	T	47.1	Very low	41.6	Very low	93 Å²	93	109.1 Å²	109.1	57%	0.571	58%	0.582	S	S	*	*	H	α-helix	trans	-63.7	-50.2	175.7	-49.2	0	0	0	0	111.5	P684 Q685 M690 K691 E692	P684-T688 PolarHBondContact O-N 3.41Å; P684-T688 VanDerWaalsContact O-N 3.13Å; P684-T688 PolarHBondContact O-OG1 2.82Å; Q685-T688 PolarHBondContact O-N 2.79Å; T688-M690 VanDerWaalsContact C-N 3.26Å; T688-M690 PolarHBondContact O-N 3.29Å; T688-K691 PolarHBondContact O-N 3.45Å; T688-K691 VanDerWaalsContact O-N 3.16Å; T688-E692 PolarHBondContact O-N 3.46Å
689	Q	45.4	Very low	43.2	Very low	97 Å²	97	109.4 Å²	109.4	45%	0.453	58%	0.575	S	S	.	*	H	α-helix	trans	-62.2	-32.1	176.6	-72.8	-171.4	11.2	0	0	112.6	Q685 E692 F693	Q685-Q689 PolarHBondContact O-N 3.4Å; Q689-E692 PolarHBondContact O-N 3.12Å; Q689-F693 WeakPolarHBondContact O-CB 3.42Å; Q689-F693 PolarHBondContact O-N 2.93Å
690	M	38.6	Very low	44.4	Very low	122 Å²	122	106.2 Å²	106.2	60%	0.601	56%	0.556	S	S	*	*	H	α-helix	trans	-72.7	-34.6	176.4	-161.1	159.8	87.5	0	0	112.3	G686 Q687 T688 L694	G686-M690 WeakPolarHBondContact O-CB 3.41Å; G686-M690 PolarHBondContact O-N 3.44Å; Q687-M690 PolarHBondContact O-N 3.1Å; T688-M690 VanDerWaalsContact C-N 3.26Å; T688-M690 PolarHBondContact O-N 3.29Å; M690-L694 HydrophobicContact CG-CD1 4.32Å; M690-L694 WeakPolarHBondContact O-CB 3.42Å; M690-L694 WeakPolarHBondContact O-CD1 3.43Å; M690-L694 WeakPolarHBondContact O-CG 3.21Å; M690-L694 PolarHBondContact O-N 2.81Å
691	K	52.9	Low	45.1	Very low	166 Å²	166	105 Å²	105	72%	0.722	54%	0.539	S	S	*	.	H	α-helix	trans	-62.4	-45.3	167.8	-78.4	-173.2	174.8	-176.6	0	111.5	Q687 T688 L694 S695	Q687-K691 PolarHBondContact O-N 2.79Å; T688-K691 PolarHBondContact O-N 3.45Å; T688-K691 VanDerWaalsContact O-N 3.16Å; K691-L694 PolarHBondContact O-N 3.02Å; K691-S695 PolarHBondContact O-N 3.5Å; K691-S695 PolarHBondContact O-OG 3.18Å
692	E	50.9	Low	45.6	Very low	106 Å²	106	98.6 Å²	98.6	50%	0.495	52%	0.522	S	S	.	.	H	α-helix	trans	-62.7	-45.4	-178.8	-165.2	172.2	-152.2	0	0	112.1	T688 Q689 L694 S695 N696 V700	T688-E692 PolarHBondContact O-N 3.46Å; Q689-E692 PolarHBondContact O-N 3.12Å; E692-L694 PolarHBondContact O-N 3.32Å; E692-S695 WeakPolarHBondContact CA-OG 3.35Å; E692-S695 PolarHBondContact O-N 2.97Å; E692-S695 PolarHBondContact O-OG 3.23Å; E692-N696 PolarHBondContact O-N 3.44Å; E692-V700 HydrophobicContact CG-CG2 4.24Å
693	F	41.1	Very low	46.5	Very low	68 Å²	68	97.7 Å²	97.7	30%	0.298	51%	0.514	S	S	.	.	H	α-helix	trans	-64.9	-35.4	174.3	-172.5	-93.9	0	0	0	113.1	Q689 S695 P697 V700 L701	Q689-F693 WeakPolarHBondContact O-CB 3.42Å; Q689-F693 PolarHBondContact O-N 2.93Å; F693-S695 VanDerWaalsContact C-N 3.32Å; F693-P697 HydrophobicContact CE1-CB 4.44Å; F693-P697 HydrophobicContact CE2-CB 4.39Å; F693-P697 HydrophobicContact CZ-CB 4.28Å; F693-P697 WeakPolarHBondContact O-CA 3.29Å; F693-P697 WeakPolarHBondContact O-CB 3.49Å; F693-P697 VanDerWaalsContact O-CD 3.32Å; F693-P697 WeakPolarHBondContact O-CD 3.33Å; F693-V700 HydrophobicContact CD2-CB 4.01Å; F693-V700 HydrophobicContact CD2-CG1 3.84Å; F693-L701 HydrophobicContact CE2-CG 4.34Å
694	L	42.5	Very low	46.8	Very low	134 Å²	134	100 Å²	100	70%	0.702	51%	0.514	S	S	*	.	H	α-helix	trans	-71.1	-25.6	173.9	-74.2	168.8	0	0	0	112.8	M690 K691 E692	M690-L694 HydrophobicContact CG-CD1 4.32Å; M690-L694 WeakPolarHBondContact O-CB 3.42Å; M690-L694 WeakPolarHBondContact O-CD1 3.43Å; M690-L694 WeakPolarHBondContact O-CG 3.21Å; M690-L694 PolarHBondContact O-N 2.81Å; K691-L694 PolarHBondContact O-N 3.02Å; E692-L694 PolarHBondContact O-N 3.32Å
695	S	56.9	Low	46.7	Very low	92 Å²	92	100.4 Å²	100.4	64%	0.643	51%	0.514	S	S	*	.	H	α-helix	trans	-88.4	-35.6	178.4	49.6	0	0	0	0	115	K691 E692 F693	K691-S695 PolarHBondContact O-N 3.5Å; K691-S695 PolarHBondContact O-OG 3.18Å; E692-S695 WeakPolarHBondContact CA-OG 3.35Å; E692-S695 PolarHBondContact O-N 2.97Å; E692-S695 PolarHBondContact O-OG 3.23Å; F693-S695 VanDerWaalsContact C-N 3.32Å
696	N	58.2	Low	46.5	Very low	74 Å²	74	101.6 Å²	101.6	40%	0.396	52%	0.52	S	S	.	.			trans	-144.4	67.3	177.6	-150.3	1.2	0	0	0	114.2	E692 K698 E699 V700	E692-N696 PolarHBondContact O-N 3.44Å; N696-K698 VanDerWaalsContact C-N 3.31Å; N696-K698 PolarHBondContact O-N 3.45Å; N696-E699 HydrophobicContact CB-CB 4.2Å; N696-E699 PolarHBondContact ND2-OE2 2.96Å; N696-E699 PolarHBondContact O-N 2.8Å; N696-V700 PolarHBondContact O-N 2.76Å; N696-V700 VanDerWaalsContact O-N 3.12Å
697	P	43.6	Very low	46.4	Very low	57 Å²	57	107.2 Å²	107.2	37%	0.37	54%	0.538	S	S	.	.	H	α-helix	trans	-62.2	-31.7	-170.6	22.2	-32.5	0	0	0	114	F693 E699 L701	F693-P697 HydrophobicContact CE1-CB 4.44Å; F693-P697 HydrophobicContact CE2-CB 4.39Å; F693-P697 HydrophobicContact CZ-CB 4.28Å; F693-P697 WeakPolarHBondContact O-CA 3.29Å; F693-P697 WeakPolarHBondContact O-CB 3.49Å; F693-P697 VanDerWaalsContact O-CD 3.32Å; F693-P697 WeakPolarHBondContact O-CD 3.33Å; P697-E699 VanDerWaalsContact C-N 3.35Å; P697-L701 VanDerWaalsContact O-CB 3.31Å; P697-L701 WeakPolarHBondContact O-CB 3.42Å; P697-L701 WeakPolarHBondContact O-CD1 3.45Å; P697-L701 VanDerWaalsContact O-CG 3.28Å; P697-L701 WeakPolarHBondContact O-CG 3.45Å; P697-L701 PolarHBondContact O-N 3.39Å
698	K	48.7	Very low	45.8	Very low	183 Å²	183	107 Å²	107	80%	0.796	54%	0.541	S	S	*	.	H	α-helix	trans	-62.7	-41.5	174.6	-79.2	-174.7	176.7	178.4	0	111.9	N696 A702	N696-K698 VanDerWaalsContact C-N 3.31Å; N696-K698 PolarHBondContact O-N 3.45Å; K698-A702 WeakPolarHBondContact O-CB 3.43Å; K698-A702 PolarHBondContact O-N 2.8Å
699	E	60.4	Low	45	Very low	85 Å²	85	107.7 Å²	107.7	40%	0.397	55%	0.547	S	S	.	.	H	α-helix	trans	-75.7	-39.9	-176.5	-158.8	-167	158	0	0	111.6	N696 P697 L701 A702 K703	N696-E699 HydrophobicContact CB-CB 4.2Å; N696-E699 PolarHBondContact ND2-OE2 2.96Å; N696-E699 PolarHBondContact O-N 2.8Å; P697-E699 VanDerWaalsContact C-N 3.35Å; E699-L701 VanDerWaalsContact C-N 3.34Å; E699-L701 PolarHBondContact O-N 2.82Å; E699-A702 PolarHBondContact O-N 3.31Å; E699-K703 HydrophobicContact CG-CD 4.48Å; E699-K703 WeakPolarHBondContact O-CG 3.36Å; E699-K703 PolarHBondContact O-N 2.77Å; E699-K703 WeakPolarHBondContact OE1-CE 3.29Å; E699-K703 IonicContact OE1-NZ 2.58Å; E699-K703 PolarHBondContact OE1-NZ 3.32Å
700	V	54.1	Low	44.1	Very low	25 Å²	25	111.8 Å²	111.8	15%	0.152	56%	0.564	C	S	.	*	H	α-helix	trans	-66.9	-35.4	174.8	-177.4	0	0	0	0	111.4	E692 F693 N696 R704	E692-V700 HydrophobicContact CG-CG2 4.24Å; F693-V700 HydrophobicContact CD2-CB 4.01Å; F693-V700 HydrophobicContact CD2-CG1 3.84Å; N696-V700 PolarHBondContact O-N 2.76Å; N696-V700 VanDerWaalsContact O-N 3.12Å; V700-R704 WeakPolarHBondContact O-CB 3.29Å; V700-R704 PolarHBondContact O-N 3.44Å
701	L	42.7	Very low	43.6	Very low	95 Å²	95	109.7 Å²	109.7	50%	0.497	57%	0.565	S	S	.	*	H	α-helix	trans	-64.8	-45	170.1	-78.8	167.6	0	0	0	111.8	F693 P697 E699 K703 R704 V705	F693-L701 HydrophobicContact CE2-CG 4.34Å; P697-L701 VanDerWaalsContact O-CB 3.31Å; P697-L701 WeakPolarHBondContact O-CB 3.42Å; P697-L701 WeakPolarHBondContact O-CD1 3.45Å; P697-L701 VanDerWaalsContact O-CG 3.28Å; P697-L701 WeakPolarHBondContact O-CG 3.45Å; P697-L701 PolarHBondContact O-N 3.39Å; E699-L701 VanDerWaalsContact C-N 3.34Å; E699-L701 PolarHBondContact O-N 2.82Å; L701-K703 PolarHBondContact O-N 3.27Å; L701-R704 PolarHBondContact O-N 2.72Å; L701-V705 WeakPolarHBondContact O-CB 3.21Å; L701-V705 VanDerWaalsContact O-CG2 3.25Å; L701-V705 WeakPolarHBondContact O-CG2 3.41Å; L701-V705 PolarHBondContact O-N 3.31Å
702	A	47.2	Very low	42.4	Very low	59 Å²	59	106.6 Å²	106.6	49%	0.488	56%	0.562	S	S	.	*	H	α-helix	trans	-60.2	-45.5	177.8	0	0	0	0	0	112.2	K698 E699 V705 Q706	K698-A702 WeakPolarHBondContact O-CB 3.43Å; K698-A702 PolarHBondContact O-N 2.8Å; E699-A702 PolarHBondContact O-N 3.31Å; A702-V705 PolarHBondContact O-N 2.83Å; A702-Q706 PolarHBondContact O-N 3.04Å
703	K	52.3	Low	41.2	Very low	102 Å²	102	111 Å²	111	44%	0.443	58%	0.58	S	S	.	*	H	α-helix	trans	-62.3	-51.8	175.7	-74.2	167.3	171.4	166.9	0	111.7	E699 L701 V705 Q706 E707	E699-K703 HydrophobicContact CG-CD 4.48Å; E699-K703 WeakPolarHBondContact O-CG 3.36Å; E699-K703 PolarHBondContact O-N 2.77Å; E699-K703 WeakPolarHBondContact OE1-CE 3.29Å; E699-K703 IonicContact OE1-NZ 2.58Å; E699-K703 PolarHBondContact OE1-NZ 3.32Å; L701-K703 PolarHBondContact O-N 3.27Å; K703-V705 VanDerWaalsContact C-N 3.29Å; K703-V705 PolarHBondContact O-N 2.87Å; K703-Q706 PolarHBondContact O-N 3.23Å; K703-E707 PolarHBondContact O-N 3.2Å
704	R	41.8	Very low	40.5	Very low	123 Å²	123	113.1 Å²	113.1	46%	0.464	60%	0.601	S	S	.	*	H	α-helix	trans	-64	-27.8	179.4	-77.6	-169.7	173.7	-167.2	1	114.3	V700 L701 Q706 L708	V700-R704 WeakPolarHBondContact O-CB 3.29Å; V700-R704 PolarHBondContact O-N 3.44Å; L701-R704 PolarHBondContact O-N 2.72Å; R704-Q706 VanDerWaalsContact C-N 3.3Å; R704-L708 WeakPolarHBondContact O-CG 3.17Å; R704-L708 PolarHBondContact O-N 2.96Å
705	V	36.1	Very low	39.6	Very low	112 Å²	112	111.9 Å²	111.9	68%	0.679	60%	0.604	S	S	*	*	H	α-helix	trans	-70.5	-25.7	173.7	167.6	0	0	0	0	112.2	L701 A702 K703	L701-V705 WeakPolarHBondContact O-CB 3.21Å; L701-V705 VanDerWaalsContact O-CG2 3.25Å; L701-V705 WeakPolarHBondContact O-CG2 3.41Å; L701-V705 PolarHBondContact O-N 3.31Å; A702-V705 PolarHBondContact O-N 2.83Å; K703-V705 VanDerWaalsContact C-N 3.29Å; K703-V705 PolarHBondContact O-N 2.87Å
706	Q	38.9	Very low	38.1	Very low	174 Å²	174	115.7 Å²	115.7	81%	0.813	62%	0.616	S	S	*	*	H	α-helix	trans	-87.5	-28.8	173.6	-67.3	-173.7	-11.8	0	0	113.3	A702 K703 R704	A702-Q706 PolarHBondContact O-N 3.04Å; K703-Q706 PolarHBondContact O-N 3.23Å; R704-Q706 VanDerWaalsContact C-N 3.3Å
707	E	35.4	Very low	36.5	Very low	147 Å²	147	116.2 Å²	116.2	69%	0.687	63%	0.625	S	S	*	*	H	α-helix	trans	-92.3	-4.6	-174.1	-68.7	-176.6	151.1	0	0	115.8	K703 P709	K703-E707 PolarHBondContact O-N 3.2Å; E707-P709 WeakPolarHBondContact O-CD 3.14Å; E707-P709 VanDerWaalsContact O-N 3.15Å
708	L	27.6	Very low	35.7	Very low	134 Å²	134	121 Å²	121	70%	0.702	65%	0.646	S	S	*	*			trans	-58.3	114.3	-176	-98.8	167.2	0	0	0	113.1	R704	R704-L708 WeakPolarHBondContact O-CG 3.17Å; R704-L708 PolarHBondContact O-N 2.96Å
709	P	30.2	Very low	34.6	Very low	107 Å²	107	122 Å²	122	70%	0.695	65%	0.651	S	S	*	*			trans	-67.5	145.5	-179.1	-20.9	34.1	0	0	0	112.2	E707 A711	E707-P709 WeakPolarHBondContact O-CD 3.14Å; E707-P709 VanDerWaalsContact O-N 3.15Å; P709-A711 PolarHBondContact O-N 3.16Å
710	K	26.4	Very low	32.9	Very low	183 Å²	183	122.9 Å²	122.9	80%	0.796	67%	0.667	S	S	*	*			trans	-75.8	46.3	177.8	-66.9	172.1	-178.2	161.4	0	112.8	R926	K710-R926 PolarHBondContact O-NH2 3Å
711	A	27.9	Very low	31.6	Very low	77 Å²	77	127.7 Å²	127.7	64%	0.636	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-65.3	130.9	176	0	0	0	0	0	110.5	P709	P709-A711 PolarHBondContact O-N 3.16Å
712	P	27.7	Very low	30.7	Very low	102 Å²	102	131.9 Å²	131.9	66%	0.662	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-75.9	133.8	170.3	31.2	-31.4	0	0	0	110.1
713	F	25.3	Very low	29.7	Very low	198 Å²	198	135.5 Å²	135.5	87%	0.868	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-61.4	134.3	161.7	-83.1	-91.7	0	0	0	109	S715	F713-S715 PolarHBondContact O-N 2.89Å
714	P	27.7	Very low	28.5	Very low	112 Å²	112	135.3 Å²	135.3	73%	0.727	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-66.4	124.5	175.6	27.4	-33.1	0	0	0	109.5	L716	P714-L716 PolarHBondContact O-N 2.66Å; P714-L716 VanDerWaalsContact O-N 3.11Å
715	S	23.3	Very low	27.6	Very low	109 Å²	109	140.7 Å²	140.7	76%	0.762	75%	0.752	S	S	*	*			trans	-67.4	107.8	175	54.5	0	0	0	0	110	F713 S717	F713-S715 PolarHBondContact O-N 2.89Å; S715-S717 VanDerWaalsContact C-N 3.3Å; S715-S717 PolarHBondContact O-N 2.58Å
716	L	23.9	Very low	27.2	Very low	171 Å²	171	142.1 Å²	142.1	90%	0.895	76%	0.756	S	S	*	*			trans	-68.5	87.9	169.8	-75.5	171.6	0	0	0	109.7	P714 L718	P714-L716 PolarHBondContact O-N 2.66Å; P714-L716 VanDerWaalsContact O-N 3.11Å; L716-L718 PolarHBondContact O-N 2.94Å
717	S	25.2	Very low	26.6	Very low	85 Å²	85	141.6 Å²	141.6	59%	0.594	76%	0.758	S	S	*	*			trans	-72	124.2	172.5	56.2	0	0	0	0	109.6	S715 K719	S715-S717 VanDerWaalsContact C-N 3.3Å; S715-S717 PolarHBondContact O-N 2.58Å; S717-K719 PolarHBondContact O-N 2.97Å
718	L	26.2	Very low	26.2	Very low	157 Å²	157	139.9 Å²	139.9	82%	0.822	76%	0.763	S	S	*	*	S	Bend	trans	-69.5	22.7	-176.9	-83.1	163.6	0	0	0	114.9	L716	L716-L718 PolarHBondContact O-N 2.94Å
719	K	25.4	Very low	26.3	Very low	205 Å²	205	139.9 Å²	139.9	89%	0.891	77%	0.768	S	S	*	*	S	Bend	trans	-89.6	9.9	-178	-83.7	-165.8	170.1	-171.6	0	114.9	S717	S717-K719 PolarHBondContact O-N 2.97Å
720	S	26.3	Very low	26	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	77%	0.766	S	S	*	*	S	Bend	trans	-142.9	55.8	-177.4	61.6	0	0	0	0	112.2
721	L	25.8	Very low	26.1	Very low	126 Å²	126	140.2 Å²	140.2	66%	0.66	77%	0.767	S	S	*	*			trans	-145.2	33.3	169.1	-121.7	163.2	0	0	0	112.9	L723	L721-L723 HydrophobicContact CD2-CD1 3.96Å; L721-L723 HydrophobicContact CD2-CG 4.32Å; L721-L723 PolarHBondContact O-N 2.97Å; L721-L723 VanDerWaalsContact O-N 3.14Å
722	E	24.7	Very low	26.1	Very low	182 Å²	182	140.7 Å²	140.7	85%	0.85	77%	0.771	S	S	*	*			trans	-70	96.8	152.3	-70.3	-166.8	122.3	0	0	108.5
723	L	26.3	Very low	26.3	Very low	135 Å²	135	145.8 Å²	145.8	71%	0.707	78%	0.782	S	S	*	*			trans	-111.4	117.9	163	-77.1	173.1	0	0	0	108.7	L721	L721-L723 HydrophobicContact CD2-CD1 3.96Å; L721-L723 HydrophobicContact CD2-CG 4.32Å; L721-L723 PolarHBondContact O-N 2.97Å; L721-L723 VanDerWaalsContact O-N 3.14Å
724	S	26.2	Very low	26.6	Very low	99 Å²	99	144.3 Å²	144.3	69%	0.692	78%	0.784	S	S	*	*			trans	-65.6	138.1	167.9	41.6	0	0	0	0	109.9	D726	S724-D726 PolarHBondContact O-N 3.45Å
725	Y	23.2	Very low	26.6	Very low	235 Å²	235	143.1 Å²	143.1	92%	0.922	79%	0.791	S	S	*	*			trans	-86.6	92.9	158.1	-93.6	-95.2	0	0	0	107.4
726	D	27.9	Very low	26.8	Very low	142 Å²	142	141.5 Å²	141.5	76%	0.759	79%	0.792	S	S	*	*			trans	-118.3	149.6	160.3	-93.8	-53.3	0	0	0	108.7	S724	S724-D726 PolarHBondContact O-N 3.45Å
727	D	25.2	Very low	26.9	Very low	163 Å²	163	141.4 Å²	141.4	87%	0.872	79%	0.793	S	S	*	*			trans	-69	131.2	-170.4	-74.6	-57.6	0	0	0	113.7
728	S	27.4	Very low	27	Very low	111 Å²	111	145.1 Å²	145.1	78%	0.776	81%	0.805	S	S	*	*			trans	-166.8	108.5	141.1	22.3	0	0	0	0	115.1
729	V	30.9	Very low	27.1	Very low	134 Å²	134	144.3 Å²	144.3	81%	0.812	81%	0.806	S	S	*	*				25.5	120.9	120.6	-175	0	0	0	0	117.9	P731	V729-P731 WeakPolarHBondContact O-CD 3.48Å
730	R	22.8	Very low	27.2	Very low	171 Å²	171	141.9 Å²	141.9	65%	0.645	80%	0.8	S	S	*	*			trans	-50.8	141.1	165.5	-65.7	170.6	169.3	-175.2	-6.3	112	D1140	R730-D1140 IonicContact CZ-OD2 2.65Å; R730-D1140 VanDerWaalsContact CZ-OD2 3.29Å; R730-D1140 IonicContact NH1-OD2 3.18Å; R730-D1140 PolarHBondContact NH1-OD2 3.43Å; R730-D1140 IonicContact NH2-OD2 2.82Å; R730-D1140 PolarHBondContact NH2-OD2 3.07Å
731	P	28.4	Very low	27.4	Very low	126 Å²	126	144.6 Å²	144.6	82%	0.818	81%	0.805	S	S	*	*				-114.6	152.5	129.9	-8.3	27.7	0	0	0	112.5	V729	V729-P731 WeakPolarHBondContact O-CD 3.48Å
732	A	29.1	Very low	27.5	Very low	87 Å²	87	147.9 Å²	147.9	72%	0.719	81%	0.814	S	S	*	*			trans	-87.5	145.6	170	0	0	0	0	0	110.6	N734	A732-N734 PolarHBondContact O-N 3.49Å
733	K	30.1	Very low	27.5	Very low	209 Å²	209	150.2 Å²	150.2	91%	0.909	82%	0.815	S	S	*	*			trans	-81.8	112.4	166.2	-74.9	-174.9	176.5	-179.1	0	109.8
734	N	33.3	Very low	27.7	Very low	168 Å²	168	151 Å²	151	90%	0.898	82%	0.82	S	S	*	*			trans	-134.9	151.4	144.6	-98.5	-21	0	0	0	107.4	A732	A732-N734 PolarHBondContact O-N 3.49Å
735	G	27.3	Very low	27.8	Very low	86 Å²	86	152.3 Å²	152.3	89%	0.887	82%	0.824	S	S	*	*			trans	-75.6	159.9	-164.2	0	0	0	0	0	115.2
736	G	27.2	Very low	27.9	Very low	76 Å²	76	149.7 Å²	149.7	78%	0.784	82%	0.823	S	S	*	*			trans	173.6	112.8	172.6	0	0	0	0	0	110.4
737	N	26.8	Very low	28	Very low	169 Å²	169	147.3 Å²	147.3	90%	0.904	82%	0.823	S	S	*	*			trans	-72.9	127.2	171.9	-76.2	-25.4	0	0	0	109.4
738	L	27.1	Very low	28.3	Very low	163 Å²	163	145.7 Å²	145.7	85%	0.853	81%	0.814	S	S	*	*			trans	-150.1	107.4	149.2	-149.8	70	0	0	0	111.8
739	V	28.3	Very low	28.3	Very low	139 Å²	139	150 Å²	150	84%	0.842	82%	0.822	S	S	*	*			trans	-78	119	157.8	172.9	0	0	0	0	106.6
740	M	27.9	Very low	28.2	Very low	155 Å²	155	148.4 Å²	148.4	76%	0.764	81%	0.812	S	S	*	*			trans	170.5	107	151	-96.8	-79.9	-85.7	0	0	111.2
741	L	28.7	Very low	28.6	Very low	160 Å²	160	146.2 Å²	146.2	84%	0.838	82%	0.819	S	S	*	*			trans	175.2	92	131.7	-96.9	162.4	0	0	0	111.1
742	K	27.9	Very low	28.6	Very low	196 Å²	196	148.9 Å²	148.9	85%	0.852	82%	0.817	S	S	*	*			trans	-88.9	158.9	151.5	-92.8	-177.5	173.4	177.9	0	108.3
743	R	26.3	Very low	28.4	Very low	230 Å²	230	152.9 Å²	152.9	87%	0.868	82%	0.823	S	S	*	*			trans	79	98.1	175	-56.8	175.5	171.1	147.4	-4.3	115.7
744	N	29	Very low	28.4	Very low	151 Å²	151	149.8 Å²	149.8	81%	0.807	82%	0.816	S	S	*	*				174.8	137.1	124.7	-83.4	-12.5	0	0	0	107.2
745	T	29.4	Very low	28.4	Very low	128 Å²	128	148.2 Å²	148.2	79%	0.785	81%	0.806	S	S	*	*			cis	-147.8	165.3	-1.8	-3.7	0	0	0	0	110.3
746	M	26.2	Very low	28.4	Very low	179 Å²	179	148.9 Å²	148.9	88%	0.882	80%	0.797	S	S	*	*			trans	-75.8	173.8	-173.6	-60.7	169.7	-72.2	0	0	113.9
747	A	30	Very low	28.6	Very low	92 Å²	92	155.1 Å²	155.1	76%	0.76	80%	0.797	S	S	*	*			trans	77.9	139.1	173.2	0	0	0	0	0	116.1
748	N	30.6	Very low	28.9	Very low	130 Å²	130	155.9 Å²	155.9	70%	0.695	79%	0.792	S	S	*	*			cis	-142.8	106.6	3.3	-148.3	33.7	0	0	0	114	T750	N748-T750 PolarHBondContact ND2-OG1 2.94Å; N748-T750 PolarHBondContact O-N 2.68Å; N748-T750 PolarHBondContact OD1-OG1 2.85Å
749	E	27.5	Very low	29.1	Very low	202 Å²	202	154.2 Å²	154.2	94%	0.944	78%	0.784	S	S	*	*			trans	-86.8	90.5	156.4	-82.6	-158.7	131.8	0	0	109.3
750	T	28	Very low	29.1	Very low	99 Å²	99	152.7 Å²	152.7	61%	0.607	78%	0.78	S	S	*	*			trans	-172.4	138.4	164.8	9.8	0	0	0	0	105.7	N748	N748-T750 PolarHBondContact ND2-OG1 2.94Å; N748-T750 PolarHBondContact O-N 2.68Å; N748-T750 PolarHBondContact OD1-OG1 2.85Å
751	T	31.4	Very low	29.4	Very low	126 Å²	126	152.5 Å²	152.5	77%	0.773	78%	0.781	S	S	*	*			cis	-148.3	144.7	37.1	-70.4	0	0	0	0	111
752	K	27.9	Very low	29.6	Very low	182 Å²	182	151.7 Å²	151.7	79%	0.791	78%	0.777	S	S	*	*			trans	-74.6	162.9	169.1	-67.5	175.8	179.4	172.6	0	110.8
753	M	26.2	Very low	29.7	Very low	171 Å²	171	150.1 Å²	150.1	84%	0.842	77%	0.77	S	S	*	*			trans	85.7	164.3	161.8	-44.4	-175.3	-64.5	0	0	118.3
754	L	29.8	Very low	29.8	Very low	143 Å²	143	147 Å²	147	75%	0.749	77%	0.765	S	S	*	*			trans	87.5	92.8	161.6	-59.4	174.7	0	0	0	120
755	I	33.5	Very low	30	Very low	136 Å²	136	151.7 Å²	151.7	70%	0.697	77%	0.772	S	S	*	*			trans	82.9	108.2	133.9	-58.8	167.3	0	0	0	118.1	R757	I755-R757 HydrophobicContact CG2-CB 4.09Å
756	S	27.4	Very low	29.9	Very low	99 Å²	99	151.7 Å²	151.7	69%	0.692	77%	0.772	S	S	*	*			trans	-103.8	80.5	158.2	-57.3	0	0	0	0	111.6
757	R	31.6	Very low	30.1	Very low	208 Å²	208	148 Å²	148	79%	0.785	76%	0.764	S	S	*	*			trans	-144.8	149	167.9	-77.7	-179.6	175.1	173.6	-1.2	107.8	I755	I755-R757 HydrophobicContact CG2-CB 4.09Å
758	K	32.4	Very low	30.2	Very low	184 Å²	184	153 Å²	153	80%	0.8	77%	0.768	S	S	*	*			cis	-148.2	166.3	5.2	-136.9	173.9	-177	-179.7	0	108.7
759	N	30.5	Very low	30.1	Very low	129 Å²	129	155.6 Å²	155.6	69%	0.69	77%	0.773	S	S	*	*			trans	-77.2	157.7	170.1	-56.1	4.2	0	0	0	110.6	K332	K332-N759 PolarHBondContact NZ-OD1 3.04Å
760	S	29.9	Very low	30.3	Very low	107 Å²	107	153.5 Å²	153.5	75%	0.748	76%	0.764	S	S	*	*			trans	136.2	158.5	138.8	-158.3	0	0	0	0	115.4
761	L	33.7	Very low	30.4	Very low	150 Å²	150	157.5 Å²	157.5	79%	0.785	78%	0.775	S	S	*	*			trans	58.5	90.9	164.3	-69.4	151	0	0	0	117.2
762	N	31.6	Very low	30.4	Very low	143 Å²	143	157.7 Å²	157.7	77%	0.765	78%	0.776	S	S	*	*				69.7	138.9	73.9	-162.2	12.5	0	0	0	115
763	K	30.9	Very low	30.7	Very low	163 Å²	163	156.3 Å²	156.3	71%	0.709	78%	0.778	S	S	*	*			trans	91.2	114.9	173.7	-60.1	-174.9	177.5	-179.5	0	119.9
764	Q	29.3	Very low	30.9	Very low	164 Å²	164	154.2 Å²	154.2	77%	0.766	77%	0.774	S	S	*	*				41.4	108.4	123.3	-55.4	171	-53.7	0	0	119.2
765	R	31.5	Very low	30.9	Very low	250 Å²	250	154.9 Å²	154.9	94%	0.943	78%	0.777	S	S	*	*				-172.3	172.4	95.9	-103.2	171.1	176.1	168.3	-2.4	111.8
766	T	28.8	Very low	30.7	Very low	128 Å²	128	158.1 Å²	158.1	79%	0.785	79%	0.786	S	S	*	*			trans	-110.4	151.9	-167.6	37.8	0	0	0	0	113.8
767	S	30	Very low	30.7	Very low	102 Å²	102	158 Å²	158	71%	0.713	79%	0.791	S	S	*	*			trans	88.1	132.2	142.8	80	0	0	0	0	121.6
768	K	30.9	Very low	30.6	Very low	196 Å²	196	155.7 Å²	155.7	85%	0.852	79%	0.789	S	S	*	*			trans	90.6	127.2	141.3	-79	172.1	178.2	179.8	0	121.7
769	K	29.2	Very low	30.5	Very low	185 Å²	185	155.4 Å²	155.4	80%	0.804	79%	0.79	S	S	*	*			trans	97.2	158.5	143.3	-85.6	-166.4	164.3	-156.5	0	120.3
770	E	32.3	Very low	30.5	Very low	159 Å²	159	159 Å²	159	74%	0.743	80%	0.8	S	S	*	*			trans	53.3	98.3	-170.8	-72.3	114.5	-117.8	0	0	114.7
771	E	29	Very low	30.5	Very low	182 Å²	182	159.5 Å²	159.5	85%	0.85	80%	0.799	S	S	*	*				61	108.6	57.6	-58.4	-167	144	0	0	114.9
772	V	31.6	Very low	30.5	Very low	130 Å²	130	160.2 Å²	160.2	79%	0.788	80%	0.796	S	S	*	*			trans	178.3	156.2	136.7	142.7	0	0	0	0	109.2
773	N	34.5	Very low	30.4	Very low	154 Å²	154	164.2 Å²	164.2	82%	0.824	80%	0.802	S	S	*	*			trans	71.1	70.9	175.8	-65.1	-26.4	0	0	0	118
774	V	29.6	Very low	30.5	Very low	127 Å²	127	165.9 Å²	165.9	77%	0.77	81%	0.809	S	S	*	*			trans	-110.2	100.3	160.7	177.4	0	0	0	0	110.3
775	I	30.2	Very low	30.7	Very low	157 Å²	157	165 Å²	165	81%	0.805	80%	0.804	S	S	*	*			trans	-144.3	146.1	160.6	-49	-178.5	0	0	0	108.4
776	K	29.6	Very low	30.8	Very low	204 Å²	204	159.9 Å²	159.9	89%	0.887	80%	0.796	S	S	*	*	S	Bend	trans	77.1	39.4	177.8	-54.1	-169.4	178.5	177.7	0	118
777	A	28.4	Very low	31	Very low	96 Å²	96	161.5 Å²	161.5	79%	0.793	80%	0.799	S	S	*	*	S	Bend	trans	-145	37.6	164.4	0	0	0	0	0	114
778	Q	28.8	Very low	31.2	Very low	160 Å²	160	164.5 Å²	164.5	75%	0.748	80%	0.804	S	S	*	*			trans	-156.1	75.1	-174.2	-117.9	174.6	34.4	0	0	114.5
779	H	30.4	Very low	31.2	Very low	177 Å²	177	161.8 Å²	161.8	82%	0.819	80%	0.799	S	S	*	*	S	Bend	trans	-148.9	149.7	158.6	-99.3	-88.2	0	0	0	109.7
780	F	30.3	Very low	31.4	Very low	204 Å²	204	161.6 Å²	161.6	90%	0.895	81%	0.806	S	S	*	*	S	Bend	trans	72.1	8.7	-179	-70.9	-77.6	0	0	0	119.8
781	T	30.3	Very low	31.2	Very low	119 Å²	119	164.6 Å²	164.6	73%	0.73	81%	0.811	S	S	*	*			trans	-102.7	48.2	160.7	44.2	0	0	0	0	112.3
782	K	33.1	Very low	31.3	Very low	165 Å²	165	164.1 Å²	164.1	72%	0.717	81%	0.809	S	S	*	*			trans	-145.5	29.4	-175.1	-138.6	174.2	-171.9	178	0	116.5
783	Y	29.5	Very low	31.4	Very low	227 Å²	227	166.1 Å²	166.1	89%	0.89	81%	0.809	S	S	*	*	S	Bend	trans	-124.8	11.5	178.7	-140.2	-93	0	0	0	114.6
784	K	32.9	Very low	31	Very low	197 Å²	197	165.8 Å²	165.8	86%	0.857	81%	0.806	S	S	*	*	S	Bend	trans	-126.5	-0.4	-179.1	-144.5	173.5	-177	178.4	0	115.6
785	E	33.3	Very low	31	Very low	145 Å²	145	165.6 Å²	165.6	68%	0.678	81%	0.808	S	S	*	*	S	Bend	trans	-105	-20.7	175.7	-69.7	179.3	119.6	0	0	113.6	L787	E785-L787 PolarHBondContact O-N 2.73Å
786	N	34	Very low	30.8	Very low	144 Å²	144	166.4 Å²	166.4	77%	0.77	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	14.7	-176.9	-77.9	10.7	0	0	0	115
787	L	33.5	Very low	30.6	Very low	162 Å²	162	162.3 Å²	162.3	85%	0.848	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	9.6	-175.7	-127.5	155.5	0	0	0	113.4	E785	E785-L787 PolarHBondContact O-N 2.73Å
788	M	33.1	Very low	30.7	Very low	164 Å²	164	163.2 Å²	163.2	81%	0.808	80%	0.798	S	S	*	*	S	Bend	trans	-127.4	-4.8	-173.1	-83	-73.7	-170.9	0	0	115.6
789	N	31.9	Very low	30.4	Very low	140 Å²	140	159.8 Å²	159.8	75%	0.749	80%	0.797	S	S	*	*			trans	-124.7	18	-165.4	-88.4	-39.3	0	0	0	117.1	R791	N789-R791 VanDerWaalsContact C-N 3.31Å; N789-R791 PolarHBondContact O-N 3.33Å; N789-R791 VanDerWaalsContact O-N 3.12Å
790	N	32.8	Very low	30.4	Very low	180 Å²	180	158.4 Å²	158.4	96%	0.963	80%	0.795	S	S	*	*			trans	-84.6	73.6	165	-83.2	1.6	0	0	0	111.1
791	R	27.7	Very low	30.1	Very low	222 Å²	222	155.7 Å²	155.7	84%	0.838	79%	0.79	S	S	*	*			trans	-101.1	114.7	162.9	-88.9	-176.7	166.6	-172.4	-2.6	109.4	N789	N789-R791 VanDerWaalsContact C-N 3.31Å; N789-R791 PolarHBondContact O-N 3.33Å; N789-R791 VanDerWaalsContact O-N 3.12Å
792	Q	32.1	Very low	30	Very low	173 Å²	173	157.9 Å²	157.9	81%	0.808	80%	0.796	S	S	*	*			trans	178.8	167.8	137.5	-99.4	161.5	36.7	0	0	112
793	H	34.4	Very low	29.6	Very low	171 Å²	171	155.8 Å²	155.8	79%	0.792	80%	0.797	S	S	*	*			trans	78.6	106.2	176.3	-52.4	-70.9	0	0	0	118
794	L	26.1	Very low	29.4	Very low	147 Å²	147	152 Å²	152	77%	0.77	79%	0.792	S	S	*	*			trans	-86	163.2	160.4	-74.2	75.4	0	0	0	109.6	K796	L794-K796 HydrophobicContact CD2-CG 4.45Å
795	P	29.4	Very low	29.1	Very low	124 Å²	124	147.1 Å²	147.1	81%	0.805	78%	0.783	S	S	*	*				-120.7	151.6	91.4	35.8	-32.4	0	0	0	111.8
796	K	25.3	Very low	28.8	Very low	173 Å²	173	147.2 Å²	147.2	75%	0.752	79%	0.787	S	S	*	*			cis	76.9	128.4	40.6	-80.8	-165.5	171.8	-174.6	0	115.1	L794	L794-K796 HydrophobicContact CD2-CG 4.45Å
797	S	24.9	Very low	28.6	Very low	119 Å²	119	146.4 Å²	146.4	83%	0.832	78%	0.781	S	S	*	*			trans	61.7	144.5	-175.8	19.7	0	0	0	0	114.2
798	T	30.2	Very low	28.3	Very low	114 Å²	114	144.5 Å²	144.5	70%	0.699	77%	0.772	S	S	*	*			cis	-140.2	130.4	11.8	-46.9	0	0	0	0	105.9
799	A	23.5	Very low	28	Very low	88 Å²	88	145.4 Å²	145.4	73%	0.727	77%	0.771	S	S	*	*				61.7	156	65.8	0	0	0	0	0	114.4
800	I	29.2	Very low	27.9	Very low	149 Å²	149	143.6 Å²	143.6	76%	0.764	77%	0.767	S	S	*	*			trans	77.7	97	-169.5	-53	166.7	0	0	0	111.4
801	N	25.1	Very low	27.5	Very low	147 Å²	147	139.8 Å²	139.8	79%	0.786	75%	0.753	S	S	*	*				62.6	114.3	74.1	-71.6	-9.7	0	0	0	114.7
802	L	27.8	Very low	27.4	Very low	164 Å²	164	138.5 Å²	138.5	86%	0.859	75%	0.754	S	S	*	*				-165.6	99.1	120.2	-106.7	163.9	0	0	0	110.9
803	T	25.2	Very low	27	Very low	122 Å²	122	135.8 Å²	135.8	75%	0.748	75%	0.749	S	S	*	*			trans	-61.3	134.5	153.6	43.8	0	0	0	0	109.5
804	N	26	Very low	26.6	Very low	146 Å²	146	135.6 Å²	135.6	78%	0.781	75%	0.746	S	S	*	*			trans	-172.5	162.2	132.6	-99	-23.5	0	0	0	113.2
805	S	26.7	Very low	26.5	Very low	96 Å²	96	134.3 Å²	134.3	67%	0.671	74%	0.74	S	S	*	*			trans	73.1	111	167.7	-62.7	0	0	0	0	117.3
806	I	26.8	Very low	26.3	Very low	147 Å²	147	132.7 Å²	132.7	75%	0.754	73%	0.732	S	S	*	*				93.2	131.8	54.7	-78.3	164.7	0	0	0	110.6
807	I	28	Very low	26.3	Very low	127 Å²	127	131.2 Å²	131.2	65%	0.651	73%	0.731	S	S	*	*			cis	-169.5	160.8	-15.1	-157.8	166.4	0	0	0	108.1
808	N	27.2	Very low	26.2	Very low	121 Å²	121	131 Å²	131	65%	0.647	73%	0.725	S	S	*	*			trans	64.5	157.9	165.1	-69.4	-26.8	0	0	0	117.1
809	K	28.4	Very low	26	Very low	183 Å²	183	130 Å²	130	80%	0.796	72%	0.723	S	S	*	*			cis	-144.1	162.2	-7.4	-124.6	162.5	-176.1	-173.2	0	110
810	P	29	Very low	26.1	Very low	103 Å²	103	136.3 Å²	136.3	67%	0.669	73%	0.728	S	S	*	*			trans	-131.4	179.3	-155	46.1	-32.9	0	0	0	116
811	C	24.8	Very low	25.9	Very low	99 Å²	99	133 Å²	133	67%	0.669	72%	0.718	S	S	*	*			trans	57.6	165.6	145.8	-67.5	0	0	0	0	121.7
812	F	24.7	Very low	25.9	Very low	196 Å²	196	132.9 Å²	132.9	86%	0.86	71%	0.712	S	S	*	*			trans	66.1	154.1	165.6	-55.8	-70	0	0	0	115.4
813	V	25.4	Very low	25.7	Very low	115 Å²	115	132.5 Å²	132.5	70%	0.697	71%	0.706	S	S	*	*			cis	-123.7	127.6	-2.8	-179.7	0	0	0	0	104.3
814	K	24.5	Very low	25.7	Very low	168 Å²	168	131.5 Å²	131.5	73%	0.73	70%	0.704	S	S	*	*				57.6	152.3	81	-138.2	-168.9	169.2	-154.3	0	113.1
815	D	25.1	Very low	25.6	Very low	120 Å²	120	130.8 Å²	130.8	64%	0.642	70%	0.7	S	S	*	*			trans	67.9	142.8	163.5	-53.6	-33.7	0	0	0	115.7
816	S	23.7	Very low	25.4	Very low	90 Å²	90	134.5 Å²	134.5	63%	0.629	70%	0.704	S	S	*	*			cis	-168.1	173.7	-10.6	54.6	0	0	0	0	111.2
817	L	25.7	Very low	25.3	Very low	141 Å²	141	134.4 Å²	134.4	74%	0.738	70%	0.7	S	S	*	*			trans	61.8	113.5	148.6	-69.5	162.9	0	0	0	117.5
818	T	24.2	Very low	25.2	Very low	114 Å²	114	134.2 Å²	134.2	70%	0.699	71%	0.705	S	S	*	*				50.3	135.3	91.4	68.1	0	0	0	0	114.3
819	S	24.7	Very low	25.1	Very low	94 Å²	94	132.2 Å²	132.2	66%	0.657	71%	0.706	S	S	*	*			cis	-178	-169.4	4	48.5	0	0	0	0	108
820	R	25.5	Very low	25	Very low	220 Å²	220	130.4 Å²	130.4	83%	0.83	70%	0.704	S	S	*	*			trans	71.2	132.5	162.7	-75.9	177.6	165.9	160.2	-4.9	113.3
821	S	25.4	Very low	24.8	Very low	80 Å²	80	132.2 Å²	132.2	56%	0.559	71%	0.707	S	S	*	*				68.1	138.6	63.2	104.7	0	0	0	0	110.8
822	E	24.5	Very low	24.9	Very low	144 Å²	144	132.1 Å²	132.1	67%	0.673	70%	0.704	S	S	*	*			cis	-162.7	171.2	10.8	-137.2	152.4	-150.9	0	0	110.7
823	Q	24.7	Very low	25	Very low	157 Å²	157	131.6 Å²	131.6	73%	0.734	70%	0.701	S	S	*	*			trans	62.6	155	149.7	-72.6	146.2	28.9	0	0	120.5
824	S	25.6	Very low	25	Very low	100 Å²	100	131.7 Å²	131.7	70%	0.699	71%	0.707	S	S	*	*			trans	77.4	141.4	134.4	175.6	0	0	0	0	121
825	L	23.7	Very low	25.1	Very low	132 Å²	132	126.9 Å²	126.9	69%	0.691	71%	0.705	S	S	*	*			cis	-167.3	136.9	-24.8	-101	177.8	0	0	0	104.4
826	F	22.4	Very low	25.4	Very low	174 Å²	174	126.6 Å²	126.6	76%	0.763	71%	0.71	S	S	*	*			trans	60.2	-174.5	152.7	-75.7	-151	0	0	0	113.2
827	E	25.2	Very low	25.4	Very low	144 Å²	144	128.8 Å²	128.8	67%	0.673	71%	0.713	S	S	*	*			cis	-148.4	163.5	-17.1	-136.3	169.4	172.3	0	0	110.3
828	T	25.4	Very low	25.4	Very low	123 Å²	123	129 Å²	129	76%	0.755	72%	0.715	S	S	*	*			trans	59.2	168.2	160.5	61.8	0	0	0	0	117.1
829	A	25.5	Very low	25.4	Very low	79 Å²	79	134 Å²	134	65%	0.653	72%	0.721	S	S	*	*			cis	-140.3	127.8	-9.9	0	0	0	0	0	106.5
830	L	25.5	Very low	25.4	Very low	146 Å²	146	138 Å²	138	76%	0.764	73%	0.729	S	S	*	*				84.9	156.2	74.5	-87.9	168.7	0	0	0	114.7
831	L	25.4	Very low	25.4	Very low	141 Å²	141	134.9 Å²	134.9	74%	0.738	73%	0.728	S	S	*	*			trans	73.1	129.7	160.9	-64	142.3	0	0	0	117.9
832	T	26.2	Very low	25.4	Very low	97 Å²	97	140 Å²	140	60%	0.595	74%	0.741	S	S	*	*			cis	-169	166.4	-18.4	-0.7	0	0	0	0	112.1
833	K	26.8	Very low	25.5	Very low	185 Å²	185	138.8 Å²	138.8	80%	0.804	75%	0.746	S	S	*	*			trans	67.2	156.3	150.3	-69.9	156.9	-172.4	175.7	0	116.4
834	S	26.4	Very low	25.5	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	75%	0.748	S	S	*	*			cis	-176.3	151	-24.9	50.9	0	0	0	0	106.6
835	G	26.3	Very low	25.6	Very low	68 Å²	68	139.7 Å²	139.7	70%	0.701	75%	0.751	S	S	*	*			cis	-160.9	-129	5.4	0	0	0	0	0	111.9
836	P	30.5	Very low	25.6	Very low	114 Å²	114	138 Å²	138	74%	0.74	75%	0.751	S	S	*	*				-137.7	171.3	-115.1	42.7	-26.9	0	0	0	118.5
837	I	24.5	Very low	25.7	Very low	136 Å²	136	135.7 Å²	135.7	70%	0.697	75%	0.75	S	S	*	*			trans	69.4	100.6	150.4	-67.9	153.2	0	0	0	119
838	N	25.8	Very low	25.7	Very low	144 Å²	144	137.2 Å²	137.2	77%	0.77	76%	0.758	S	S	*	*				-174.4	125.9	107.8	-91.2	-31.2	0	0	0	106.7
839	R	23.7	Very low	25.7	Very low	220 Å²	220	137.7 Å²	137.7	83%	0.83	76%	0.761	S	S	*	*			cis	62.8	135.2	46.9	-75.8	-167.6	171	-177.4	-1.8	113.6
840	E	24.6	Very low	25.7	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	77%	0.766	S	S	*	*			trans	69.4	130	-177.8	-66.9	171.9	-144.6	0	0	114.8
841	L	25.2	Very low	25.8	Very low	156 Å²	156	139.5 Å²	139.5	82%	0.817	77%	0.766	S	S	*	*			cis	-137.3	145.4	-6.8	-79.3	116.7	0	0	0	111.9
842	F	25.9	Very low	25.9	Very low	186 Å²	186	141.2 Å²	141.2	82%	0.816	77%	0.767	S	S	*	*			trans	-118.6	143.3	155.1	-99.6	-84.3	0	0	0	107.6	L844	F842-L844 HydrophobicContact CB-CD1 4.43Å
843	P	26.5	Very low	26	Very low	120 Å²	120	144.7 Å²	144.7	78%	0.779	78%	0.78	S	S	*	*			trans	-102.8	96.5	152.7	31.6	-23.2	0	0	0	110.1
844	L	24.9	Very low	25.8	Very low	151 Å²	151	146 Å²	146	79%	0.791	78%	0.78	S	S	*	*			trans	-62.5	127.5	144.3	-91.7	69.6	0	0	0	109.3	F842	F842-L844 HydrophobicContact CB-CD1 4.43Å
845	T	27.4	Very low	25.8	Very low	124 Å²	124	146.4 Å²	146.4	76%	0.761	77%	0.769	S	S	*	*			trans	-150.2	117.1	141.7	31.2	0	0	0	0	106.1
846	S	23.4	Very low	25.9	Very low	98 Å²	98	151.2 Å²	151.2	69%	0.685	78%	0.778	S	S	*	*			cis	79.4	132.7	39.3	90.8	0	0	0	0	112.3
847	V	24.6	Very low	25.6	Very low	124 Å²	124	154.7 Å²	154.7	75%	0.752	78%	0.777	S	S	*	*			cis	-151.3	170.8	15.5	-165.6	0	0	0	0	109.6
848	Q	24.6	Very low	25.7	Very low	176 Å²	176	157.1 Å²	157.1	82%	0.822	78%	0.782	S	S	*	*			trans	82.4	135.7	164.2	-48.5	-178.4	17.6	0	0	115.5
849	T	25	Very low	25.8	Very low	134 Å²	134	158.1 Å²	158.1	82%	0.822	78%	0.782	S	S	*	*			cis	-139.9	144.2	5.7	-38.2	0	0	0	0	111.6
850	L	26.3	Very low	25.9	Very low	144 Å²	144	154.8 Å²	154.8	75%	0.754	78%	0.776	S	S	*	*			trans	-151.7	131.7	-179.4	-129	-179.7	0	0	0	112.2
851	P	28.7	Very low	25.9	Very low	118 Å²	118	153.5 Å²	153.5	77%	0.766	77%	0.774	S	S	*	*			trans	-110	104.9	152.3	21.6	-4	0	0	0	109.2
852	K	25.8	Very low	26	Very low	178 Å²	178	154.3 Å²	154.3	77%	0.774	78%	0.779	S	S	*	*				59.7	101.4	76.8	-68.7	-178.6	175.9	172.2	0	114.7
853	I	28.2	Very low	25.9	Very low	169 Å²	169	150.3 Å²	150.3	87%	0.867	77%	0.774	S	S	*	*				-158.2	104.9	120.7	-85.9	136.7	0	0	0	104.6
854	R	24.3	Very low	25.8	Very low	214 Å²	214	156.1 Å²	156.1	81%	0.808	78%	0.78	S	S	*	*				72.6	96.6	72.9	-95.2	-168.1	159.9	155.4	-1.3	116.3
855	E	26.2	Very low	25.8	Very low	123 Å²	123	154.6 Å²	154.6	58%	0.575	78%	0.778	S	S	*	*			trans	74.3	159.7	135.3	-62	-166.3	87	0	0	123	R857	E855-R857 IonicContact OE1-CZ 3.73Å; E855-R857 IonicContact OE1-NE 2.64Å; E855-R857 IonicContact OE1-NH2 2.65Å; E855-R857 PolarHBondContact OE1-NH2 2.88Å
856	L	28.4	Very low	25.7	Very low	169 Å²	169	154.1 Å²	154.1	89%	0.885	78%	0.777	S	S	*	*			trans	85.8	82.1	-173.9	-55.3	176.2	0	0	0	114.4
857	R	23.5	Very low	25.8	Very low	188 Å²	188	154 Å²	154	71%	0.709	78%	0.775	S	S	*	*			cis	74.9	104.3	31	-132.7	-152.7	-72	-149.3	10.4	115.2	E855	E855-R857 IonicContact OE1-CZ 3.73Å; E855-R857 IonicContact OE1-NE 2.64Å; E855-R857 IonicContact OE1-NH2 2.65Å; E855-R857 PolarHBondContact OE1-NH2 2.88Å
858	K	26.4	Very low	25.8	Very low	186 Å²	186	157.4 Å²	157.4	81%	0.809	78%	0.781	S	S	*	*			trans	89.7	153.2	161.4	-59.8	-174.3	172.7	-173.8	0	119.8
859	Q	27	Very low	25.7	Very low	166 Å²	166	153.8 Å²	153.8	78%	0.776	77%	0.77	S	S	*	*			trans	69.2	140.1	169.4	-69.2	-171.8	-68.7	0	0	118
860	E	26.8	Very low	25.7	Very low	150 Å²	150	154.8 Å²	154.8	70%	0.701	77%	0.771	S	S	*	*			cis	-157.1	179.1	-22.9	-153	137.3	-140.1	0	0	111.5
861	N	24	Very low	25.6	Very low	149 Å²	149	156 Å²	156	80%	0.797	78%	0.777	S	S	*	*			trans	-57.4	133.4	-173.5	-55.4	-68.8	0	0	0	114.8
862	L	27	Very low	25.3	Very low	173 Å²	173	156 Å²	156	91%	0.906	78%	0.775	S	S	*	*			trans	-157.4	140.8	144.1	-114.9	167.6	0	0	0	111.9
863	S	24	Very low	25.3	Very low	102 Å²	102	155 Å²	155	71%	0.713	78%	0.775	S	S	*	*			trans	-100.8	113.5	-168.3	45	0	0	0	0	113.1
864	R	25.2	Very low	25.2	Very low	243 Å²	243	153.6 Å²	153.6	92%	0.917	77%	0.769	S	S	*	*			trans	-170	129.7	157.2	-101.7	145.3	-172	-160.7	2.2	109.2	P866	R864-P866 WeakPolarHBondContact O-CD 3.22Å
865	T	25.5	Very low	25.2	Very low	119 Å²	119	151.5 Å²	151.5	73%	0.73	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-85	117.1	176.4	-7.4	0	0	0	0	109.6
866	P	25.1	Very low	25.1	Very low	114 Å²	114	153.6 Å²	153.6	74%	0.74	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-81.3	162.7	175.7	-9.1	28.4	0	0	0	112.1	R864	R864-P866 WeakPolarHBondContact O-CD 3.22Å
867	S	24.4	Very low	24.8	Very low	94 Å²	94	154.9 Å²	154.9	66%	0.657	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-76.8	141	176.2	50.1	0	0	0	0	112.7	T869	S867-T869 VanDerWaalsContact C-N 3.28Å; S867-T869 PolarHBondContact O-N 2.92Å
868	F	24.7	Very low	24.9	Very low	197 Å²	197	152.5 Å²	152.5	86%	0.864	78%	0.779	S	S	*	*	S	Bend	trans	-75	76.4	175.7	-107.8	-94.9	0	0	0	112.2
869	T	23.6	Very low	24.8	Very low	99 Å²	99	152.6 Å²	152.6	61%	0.607	78%	0.779	S	S	*	*			trans	-137.7	130.2	165.5	42.7	0	0	0	0	107.6	S867	S867-T869 VanDerWaalsContact C-N 3.28Å; S867-T869 PolarHBondContact O-N 2.92Å
870	N	23.7	Very low	24.6	Very low	155 Å²	155	150 Å²	150	83%	0.829	78%	0.779	S	S	*	*			trans	80.2	87.7	-168.9	-49.3	-35.1	0	0	0	115.2
871	L	25.1	Very low	24.5	Very low	170 Å²	170	152.3 Å²	152.3	89%	0.89	79%	0.787	S	S	*	*			trans	-119.5	85.7	143.8	-165.1	81.1	0	0	0	108.2
872	V	23.5	Very low	24.5	Very low	119 Å²	119	154.2 Å²	154.2	72%	0.721	79%	0.791	S	S	*	*			trans	-137.3	130.2	-179.3	166.1	0	0	0	0	108
873	M	25.6	Very low	24.3	Very low	156 Å²	156	153.9 Å²	153.9	77%	0.768	79%	0.788	S	S	*	*			trans	66.7	125.4	174.7	-63.1	-77	-81.4	0	0	117.1
874	N	24.5	Very low	24.3	Very low	140 Å²	140	157.8 Å²	157.8	75%	0.749	79%	0.792	S	S	*	*			trans	-151.2	107.1	153.1	-127	-8.2	0	0	0	110.4
875	F	24.1	Very low	24.3	Very low	169 Å²	169	156.6 Å²	156.6	74%	0.741	79%	0.788	S	S	*	*	S	Bend	trans	63	148.4	173.2	-58.3	-87	0	0	0	117.6
876	M	24.7	Very low	24.3	Very low	168 Å²	168	158.2 Å²	158.2	83%	0.828	79%	0.787	S	S	*	*			cis	-108.3	150.2	0.5	-90.2	-67.7	178.7	0	0	113
877	Y	22.4	Very low	24.3	Very low	196 Å²	196	160.7 Å²	160.7	77%	0.769	80%	0.795	S	S	*	*			trans	-121.9	110.1	-178.6	-149.3	-77.3	0	0	0	109.7
878	T	25.9	Very low	24.3	Very low	137 Å²	137	160.8 Å²	160.8	84%	0.84	80%	0.795	S	S	*	*			trans	-125.3	130.8	169.2	45.5	0	0	0	0	110.9
879	K	23.9	Very low	24.2	Very low	189 Å²	189	153.1 Å²	153.1	82%	0.822	77%	0.772	S	S	*	*			trans	-82.1	136.2	-171.3	-57	167.3	-177.5	172.4	0	110.4
880	S	23.4	Very low	24.2	Very low	110 Å²	110	155.1 Å²	155.1	77%	0.769	77%	0.772	S	S	*	*				-171.5	128.8	123.5	38.8	0	0	0	0	115.8
881	K	24.7	Very low	24.1	Very low	200 Å²	200	154.8 Å²	154.8	87%	0.87	77%	0.77	S	S	*	*			trans	47.7	117	141.5	-63	-174.6	176	-178.1	0	120.3
882	Q	23.5	Very low	23.9	Very low	188 Å²	188	155.3 Å²	155.3	88%	0.879	77%	0.766	S	S	*	*			trans	-35.7	134.9	155.8	-58.3	166.8	-10.5	0	0	114
883	I	24.1	Very low	23.8	Very low	166 Å²	166	154.8 Å²	154.8	85%	0.851	77%	0.767	S	S	*	*			trans	-130.5	125.3	152.5	-63.4	-177.2	0	0	0	108
884	K	23.4	Very low	23.7	Very low	184 Å²	184	152.6 Å²	152.6	80%	0.8	76%	0.762	S	S	*	*			trans	-87.9	148.1	171	-74.5	178.2	174	171.8	0	110.1
885	R	24.1	Very low	23.6	Very low	218 Å²	218	154.2 Å²	154.2	82%	0.823	77%	0.765	S	S	*	*			trans	91.2	142.8	157.7	-66.4	-175.6	168.9	-169.6	-3.2	120.6
886	Q	25.1	Very low	23.6	Very low	153 Å²	153	151.5 Å²	151.5	72%	0.715	76%	0.763	S	S	*	*			trans	87.9	99.6	139.8	-84.1	163.6	-27	0	0	120.6	S888	Q886-S888 PolarHBondContact O-N 3.25Å
887	N	25.2	Very low	23.5	Very low	167 Å²	167	150.8 Å²	150.8	89%	0.893	76%	0.762	S	S	*	*			trans	16.3	95	134.2	-56.5	18.4	0	0	0	116.9
888	S	25.2	Very low	23.6	Very low	96 Å²	96	151.6 Å²	151.6	67%	0.671	77%	0.765	S	S	*	*			trans	-152.7	147.5	149.4	50.2	0	0	0	0	109.3	Q886	Q886-S888 PolarHBondContact O-N 3.25Å
889	G	22.9	Very low	23.5	Very low	36 Å²	36	154 Å²	154	37%	0.371	77%	0.766	S	S	.	*			trans	-80	123.1	-177.3	0	0	0	0	0	111.9	N324	N324-G889 PolarHBondContact ND2-O 3.44Å
890	F	22.6	Very low	23.6	Very low	141 Å²	141	152.8 Å²	152.8	62%	0.618	77%	0.768	S	S	*	*			trans	-130.2	120.3	168.5	-93.2	-86.2	0	0	0	110.6	F892	F890-F892 HydrophobicContact CB-CE2 4.48Å
891	N	21.9	Very low	23.9	Very low	147 Å²	147	153.5 Å²	153.5	79%	0.786	77%	0.77	S	S	*	*			trans	-73.4	126.5	166.5	-65.5	-12	0	0	0	108.1
892	F	22.3	Very low	24	Very low	182 Å²	182	149 Å²	149	80%	0.798	76%	0.764	S	S	*	*			trans	-101.9	98.4	163.8	-88.2	-86.1	0	0	0	109.4	F890 V894	F890-F892 HydrophobicContact CB-CE2 4.48Å; F892-V894 HydrophobicContact CB-CG2 4.39Å; F892-V894 PolarHBondContact O-N 3.27Å
893	S	21.2	Very low	24.3	Very low	108 Å²	108	148.3 Å²	148.3	76%	0.755	77%	0.765	S	S	*	*			trans	-72.2	108.9	155.1	47.5	0	0	0	0	107.8
894	V	22.8	Very low	24.5	Very low	109 Å²	109	147.8 Å²	147.8	66%	0.661	76%	0.759	S	S	*	*			trans	-102	103.1	170.1	-178.1	0	0	0	0	107.5	F892 T896	F892-V894 HydrophobicContact CB-CG2 4.39Å; F892-V894 PolarHBondContact O-N 3.27Å; V894-T896 HydrophobicContact CG1-CG2 4.14Å; V894-T896 PolarHBondContact O-N 2.91Å
895	E	22.1	Very low	25	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.813	76%	0.762	S	S	*	*			trans	-78.6	97	168.7	-68.1	175.3	125.6	0	0	108.5	L897	E895-L897 PolarHBondContact O-N 3.34Å; E895-L897 VanDerWaalsContact O-N 3.14Å
896	T	24.6	Very low	25.2	Very low	112 Å²	112	144.3 Å²	144.3	69%	0.687	76%	0.76	S	S	*	*			trans	-79.2	88.9	165.1	48.9	0	0	0	0	108.9	V894 Y898	V894-T896 HydrophobicContact CG1-CG2 4.14Å; V894-T896 PolarHBondContact O-N 2.91Å; T896-Y898 PolarHBondContact O-N 3.36Å
897	L	21.7	Very low	25.5	Very low	153 Å²	153	142 Å²	142	80%	0.801	77%	0.767	S	S	*	*			trans	-59.3	118.3	165.6	-77	160.3	0	0	0	109.5	E895	E895-L897 PolarHBondContact O-N 3.34Å; E895-L897 VanDerWaalsContact O-N 3.14Å
898	Y	24.6	Very low	25.7	Very low	214 Å²	214	142.4 Å²	142.4	84%	0.839	76%	0.761	S	S	*	*			trans	-122.6	115.2	156.2	-89.1	-85.9	0	0	0	107.1	T896 L900	T896-Y898 PolarHBondContact O-N 3.36Å; Y898-L900 PolarHBondContact O-N 2.99Å
899	E	24.4	Very low	25.9	Very low	186 Å²	186	145.7 Å²	145.7	87%	0.869	77%	0.766	S	S	*	*			trans	-76.9	112.1	-176.4	-63.8	178.4	125.4	0	0	109.8	P901	E899-P901 WeakPolarHBondContact O-CD 3.28Å
900	L	25.3	Very low	26.3	Very low	165 Å²	165	150.4 Å²	150.4	86%	0.864	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-76.3	123.2	161.2	-87.5	165	0	0	0	108.4	Y898 S902	Y898-L900 PolarHBondContact O-N 2.99Å; L900-S902 PolarHBondContact O-N 2.81Å
901	P	30.9	Very low	26.5	Very low	124 Å²	124	150.7 Å²	150.7	81%	0.805	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-57.1	130	174.8	-25.5	35.5	0	0	0	111.1	E899	E899-P901 WeakPolarHBondContact O-CD 3.28Å
902	S	26.5	Very low	26.9	Very low	107 Å²	107	153.2 Å²	153.2	75%	0.748	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-79.2	144.5	-176.5	54.3	0	0	0	0	112.2	L900	L900-S902 PolarHBondContact O-N 2.81Å
903	L	29.6	Very low	27.1	Very low	172 Å²	172	154.3 Å²	154.3	90%	0.901	80%	0.795	S	S	*	*			trans	-142.3	142.3	147.9	-108	171.2	0	0	0	109.5
904	H	29.1	Very low	27.5	Very low	155 Å²	155	154.9 Å²	154.9	72%	0.718	79%	0.794	S	S	*	*			trans	-77.7	146.4	-165.8	-73.8	-47.4	0	0	0	113.7
905	N	33.7	Very low	27.6	Very low	162 Å²	162	158.9 Å²	158.9	87%	0.866	81%	0.805	S	S	*	*				-158.8	162.8	101.3	-102.4	-41.9	0	0	0	114.6
906	Q	28.4	Very low	28.1	Very low	167 Å²	167	156.7 Å²	156.7	78%	0.78	80%	0.803	S	S	*	*			trans	-95.8	135.3	-163.4	-58.1	175.3	1.7	0	0	113
907	A	31.6	Very low	28.4	Very low	105 Å²	105	158.4 Å²	158.4	87%	0.868	81%	0.808	S	S	*	*			trans	-144.2	142.3	155.8	0	0	0	0	0	108.9
908	K	29.2	Very low	28.6	Very low	176 Å²	176	161 Å²	161	77%	0.765	81%	0.813	S	S	*	*			trans	-107.6	149.6	-166.6	-79.6	-176.6	178.6	176.3	0	114.3
909	Q	29.2	Very low	28.7	Very low	165 Å²	165	159.2 Å²	159.2	77%	0.771	81%	0.814	S	S	*	*			trans	83.6	154.6	139.2	-81.8	167.2	-72.7	0	0	122.8
910	E	30.9	Very low	28.8	Very low	134 Å²	134	157.8 Å²	157.8	63%	0.626	81%	0.813	S	S	*	*			trans	65.7	69	166.6	-69	-162.1	-140.1	0	0	121.1	R912	E910-R912 PolarHBondContact O-N 3.37Å; E910-R912 IonicContact OE2-CZ 3.47Å; E910-R912 IonicContact OE2-NE 2.96Å; E910-R912 PolarHBondContact OE2-NE 2.89Å; E910-R912 IonicContact OE2-NH2 3.05Å; E910-R912 PolarHBondContact OE2-NH2 3.44Å
911	T	27.1	Very low	29.1	Very low	148 Å²	148	161.5 Å²	161.5	91%	0.908	82%	0.815	S	S	*	*			trans	-76.7	87.5	151.6	38.1	0	0	0	0	112.2	K913	T911-K913 PolarHBondContact O-N 3.38Å
912	R	30.6	Very low	28.9	Very low	200 Å²	200	161.4 Å²	161.4	76%	0.755	81%	0.813	S	S	*	*			trans	-75.3	111.3	166.7	-68.7	-170.9	-175	-153.5	-1.2	110.8	E910	E910-R912 PolarHBondContact O-N 3.37Å; E910-R912 IonicContact OE2-CZ 3.47Å; E910-R912 IonicContact OE2-NE 2.96Å; E910-R912 PolarHBondContact OE2-NE 2.89Å; E910-R912 IonicContact OE2-NH2 3.05Å; E910-R912 PolarHBondContact OE2-NH2 3.44Å
913	K	26.2	Very low	29.1	Very low	205 Å²	205	164 Å²	164	89%	0.891	82%	0.818	S	S	*	*			trans	-65.5	130.5	166.7	-72.1	179.2	178.2	176.1	0	109.5	T911	T911-K913 PolarHBondContact O-N 3.38Å
914	V	29.5	Very low	28.8	Very low	120 Å²	120	159.6 Å²	159.6	73%	0.727	81%	0.814	S	S	*	*			trans	-134.7	105.2	169.4	172.8	0	0	0	0	108.1	V916	V914-V916 HydrophobicContact CG1-CG2 3.87Å
915	E	24.5	Very low	28.9	Very low	193 Å²	193	160 Å²	160	90%	0.902	82%	0.821	S	S	*	*			trans	-75.1	129.8	162.9	-66.6	-178.1	111	0	0	108.7
916	V	31.7	Very low	28.6	Very low	127 Å²	127	160.3 Å²	160.3	77%	0.77	81%	0.81	S	S	*	*			trans	-125	127	163.6	172.6	0	0	0	0	109.1	V914	V914-V916 HydrophobicContact CG1-CG2 3.87Å
917	N	32.1	Very low	28.5	Very low	148 Å²	148	163.3 Å²	163.3	79%	0.791	82%	0.816	S	S	*	*			trans	-68.9	159.3	-177.3	-88.1	-71.5	0	0	0	113	M919	N917-M919 PolarHBondContact O-N 2.97Å
918	K	25.7	Very low	28.4	Very low	208 Å²	208	167.3 Å²	167.3	90%	0.904	81%	0.813	S	S	*	*			trans	-50.9	125.7	171.4	-60.7	167.6	-177.3	169.1	0	110.6
919	M	27.2	Very low	28.2	Very low	177 Å²	177	169.2 Å²	169.2	87%	0.872	82%	0.822	S	S	*	*			trans	-144.7	128.3	156.5	-153.7	169.3	-68.1	0	0	111.3	N917	N917-M919 PolarHBondContact O-N 2.97Å
920	N	26.7	Very low	28.3	Very low	156 Å²	156	169.6 Å²	169.6	83%	0.834	82%	0.823	S	S	*	*			trans	-73.2	130.3	173.1	-68.4	-45	0	0	0	109.6
921	R	30.2	Very low	28	Very low	242 Å²	242	169.9 Å²	169.9	91%	0.913	84%	0.835	S	S	*	*			trans	-160.3	139.2	142	-111.7	155.6	-170.1	179.2	2.5	112.5
922	T	26.5	Very low	28.1	Very low	123 Å²	123	170.3 Å²	170.3	76%	0.755	83%	0.831	S	S	*	*			trans	-74	137.3	169.2	46.1	0	0	0	0	110.4
923	N	30.5	Very low	28	Very low	160 Å²	160	169.4 Å²	169.4	86%	0.856	84%	0.835	S	S	*	*				-174.6	140.7	129.6	-90.8	-17.2	0	0	0	109.9
924	G	25	Very low	28	Very low	80 Å²	80	165.9 Å²	165.9	83%	0.825	83%	0.831	S	S	*	*			trans	-86.9	136.2	178.9	0	0	0	0	0	112
925	L	30	Very low	27.9	Very low	164 Å²	164	165.5 Å²	165.5	86%	0.859	83%	0.831	S	S	*	*			trans	-122.8	132.1	170.8	-88.3	166.8	0	0	0	110.8
926	R	26.9	Very low	27.9	Very low	169 Å²	169	165.9 Å²	165.9	64%	0.638	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-77.7	119.3	174.9	-67.6	171.7	170.2	167.1	-6	109	K710 K928	K710-R926 PolarHBondContact O-NH2 3Å; R926-K928 PolarHBondContact O-N 3.05Å
927	Y	27	Very low	27.7	Very low	229 Å²	229	166.6 Å²	166.6	90%	0.898	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-73.6	118.6	164.8	-85.3	-83.7	0	0	0	110.1
928	K	30.2	Very low	27.3	Very low	189 Å²	189	167.4 Å²	167.4	82%	0.822	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-66.7	145.2	166.9	-82.7	-180	174.3	177.2	0	108.8	R926 Q930	R926-K928 PolarHBondContact O-N 3.05Å; K928-Q930 PolarHBondContact O-N 3.09Å; K928-Q930 VanDerWaalsContact O-N 3.14Å
929	K	25.5	Very low	27.4	Very low	217 Å²	217	165 Å²	165	94%	0.943	82%	0.822	S	S	*	*			trans	-62.2	111.2	164.8	-167.9	179.9	-172.3	-177.2	0	108.1
930	Q	29.9	Very low	27.4	Very low	172 Å²	172	163.9 Å²	163.9	80%	0.804	81%	0.814	S	S	*	*			trans	-115.2	114	176.1	-143	168.2	-10.8	0	0	107.7	K928	K928-Q930 PolarHBondContact O-N 3.09Å; K928-Q930 VanDerWaalsContact O-N 3.14Å
931	T	24.6	Very low	27.3	Very low	140 Å²	140	162.8 Å²	162.8	86%	0.859	82%	0.816	S	S	*	*			trans	-63.8	131.6	164.1	5.6	0	0	0	0	108
932	L	29.6	Very low	27.1	Very low	158 Å²	158	156.3 Å²	156.3	83%	0.827	81%	0.808	S	S	*	*			trans	-133.8	144.9	163.1	-148.6	76.7	0	0	0	108.1
933	E	28.8	Very low	27.1	Very low	181 Å²	181	159.1 Å²	159.1	85%	0.846	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-82.7	151	-164.1	-66.4	156.4	121.3	0	0	112.3	P935	E933-P935 VanDerWaalsContact O-CD 3.29Å; E933-P935 WeakPolarHBondContact O-CD 3.36Å
934	T	24.9	Very low	26.8	Very low	130 Å²	130	157.1 Å²	157.1	80%	0.798	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.8	117.5	175.7	46.4	0	0	0	0	110.8	K936	T934-K936 PolarHBondContact O-N 3.33Å
935	P	28.5	Very low	26.7	Very low	112 Å²	112	160.7 Å²	160.7	73%	0.727	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-68.5	122.5	167.4	29	-32.3	0	0	0	109	E933 I937	E933-P935 VanDerWaalsContact O-CD 3.29Å; E933-P935 WeakPolarHBondContact O-CD 3.36Å; P935-I937 PolarHBondContact O-N 3.03Å
936	K	25	Very low	26.5	Very low	202 Å²	202	159.6 Å²	159.6	88%	0.878	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-69.2	121.9	168.7	-68.9	179.3	179.1	178.2	0	108.6	T934	T934-K936 PolarHBondContact O-N 3.33Å
937	I	27.6	Very low	26.6	Very low	141 Å²	141	156.7 Å²	156.7	72%	0.723	82%	0.815	S	S	*	*			trans	-124.9	111.7	163.3	-59.9	-178.2	0	0	0	107	P935 I939	P935-I937 PolarHBondContact O-N 3.03Å; I937-I939 HydrophobicContact CG2-CG1 4.18Å
938	Q	23.8	Very low	26.6	Very low	166 Å²	166	152.8 Å²	152.8	78%	0.776	81%	0.809	S	S	*	*			trans	-79.1	135.7	167.6	-68.6	164.2	-97.4	0	0	108.4
939	I	27.8	Very low	26.5	Very low	157 Å²	157	149.7 Å²	149.7	81%	0.805	81%	0.808	S	S	*	*			trans	-132.3	111.2	159.7	-58.5	-177.7	0	0	0	105.8	I937	I937-I939 HydrophobicContact CG2-CG1 4.18Å
940	E	26.3	Very low	26.5	Very low	154 Å²	154	148 Å²	148	72%	0.72	80%	0.801	S	S	*	*			trans	-83.4	152.7	177	-68.4	-172.6	145.5	0	0	110.9	S942	E940-S942 PolarHBondContact O-N 2.84Å
941	P	25.5	Very low	26.5	Very low	132 Å²	132	147.9 Å²	147.9	86%	0.857	80%	0.804	S	S	*	*			trans	-79.8	120.3	-179.2	31.3	-33.4	0	0	0	111.5
942	S	24.4	Very low	26.5	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	79%	0.794	S	S	*	*			trans	-143.1	107.9	174.3	65.8	0	0	0	0	113.2	E940	E940-S942 PolarHBondContact O-N 2.84Å
943	L	26.7	Very low	26.5	Very low	182 Å²	182	142.7 Å²	142.7	95%	0.953	80%	0.797	S	S	*	*			trans	-162.2	144.6	149.5	-111.7	167.1	0	0	0	109.9
944	T	24.4	Very low	26.2	Very low	118 Å²	118	140.9 Å²	140.9	72%	0.724	79%	0.791	S	S	*	*			trans	-131.4	121.5	-152.5	-55.3	0	0	0	0	113.9
945	I	24.4	Very low	26.3	Very low	154 Å²	154	142.9 Å²	142.9	79%	0.79	80%	0.796	S	S	*	*			trans	24.6	112.5	148.7	-47	172.4	0	0	0	118.8
946	T	25.7	Very low	26.1	Very low	141 Å²	141	142.9 Å²	142.9	87%	0.865	79%	0.794	S	S	*	*			trans	-155.4	145.5	131.8	30.7	0	0	0	0	107.8
947	S	27.4	Very low	26.2	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	79%	0.793	S	S	*	*			cis	-154.4	153.6	-14.2	50.5	0	0	0	0	109.7
948	L	27.8	Very low	26	Very low	148 Å²	148	141.9 Å²	141.9	78%	0.775	79%	0.794	S	S	*	*			trans	-81.2	160.8	179.3	-93.4	153.6	0	0	0	112.7
949	P	28.4	Very low	26.1	Very low	123 Å²	123	140.2 Å²	140.2	80%	0.799	80%	0.797	S	S	*	*				-120.3	153.6	113.8	34.9	-34	0	0	0	113.7
950	K	25.6	Very low	26	Very low	181 Å²	181	138.2 Å²	138.2	79%	0.787	79%	0.792	S	S	*	*			trans	-93.1	153.2	176.4	-61.8	172.9	179.1	175.4	0	111.1
951	I	28.5	Very low	26	Very low	170 Å²	170	135.8 Å²	135.8	87%	0.872	79%	0.792	S	S	*	*			trans	170.6	131.6	142.3	-87.4	149.4	0	0	0	103.7
952	G	25.5	Very low	26	Very low	64 Å²	64	134 Å²	134	66%	0.66	78%	0.783	S	S	*	*			cis	111.4	89.5	24.3	0	0	0	0	0	108
953	S	28.7	Very low	26	Very low	125 Å²	125	136.6 Å²	136.6	87%	0.874	79%	0.787	S	S	*	*				-168.4	172.7	104.5	48.1	0	0	0	0	112.6
954	I	24.3	Very low	26	Very low	143 Å²	143	135.3 Å²	135.3	73%	0.733	78%	0.779	S	S	*	*			trans	-106.5	138.8	-171.6	-63.5	161.1	0	0	0	110.1	T956	I954-T956 HydrophobicContact CG2-CG2 3.98Å
955	L	27.1	Very low	26	Very low	172 Å²	172	134.1 Å²	134.1	90%	0.901	78%	0.776	S	S	*	*			trans	-137.4	89.8	155.2	-102.9	174.6	0	0	0	110.9
956	T	24.1	Very low	26	Very low	112 Å²	112	138.2 Å²	138.2	69%	0.687	78%	0.781	S	S	*	*			trans	-82.2	132.2	168.2	43.7	0	0	0	0	110.9	I954	I954-T956 HydrophobicContact CG2-CG2 3.98Å
957	I	26.2	Very low	26.1	Very low	165 Å²	165	137.1 Å²	137.1	85%	0.846	78%	0.776	S	S	*	*			trans	-125.1	139.1	155.6	-62.8	-176.4	0	0	0	107.4
958	Q	24.3	Very low	25.9	Very low	158 Å²	158	136.2 Å²	136.2	74%	0.738	78%	0.776	S	S	*	*			trans	-92.4	159.1	-157.1	-64.6	171.8	-51.3	0	0	114.7
959	P	25.4	Very low	25.8	Very low	130 Å²	130	140.1 Å²	140.1	84%	0.844	78%	0.782	S	S	*	*			trans	-88	121	161.5	33.7	-30.1	0	0	0	112.2
960	T	25.8	Very low	25.6	Very low	116 Å²	116	143.5 Å²	143.5	71%	0.712	78%	0.784	S	S	*	*			trans	-152.2	159.4	175.8	46.3	0	0	0	0	108.4
961	S	26.1	Very low	25.5	Very low	103 Å²	103	140.5 Å²	140.5	72%	0.72	78%	0.78	S	S	*	*			cis	-171.1	168.5	-16.1	47.3	0	0	0	0	108.4
962	S	24.6	Very low	25.4	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	78%	0.776	S	S	*	*			cis	-166.3	168.3	-43.4	55.5	0	0	0	0	109.5
963	I	24.9	Very low	25.4	Very low	161 Å²	161	143.9 Å²	143.9	83%	0.826	78%	0.779	S	S	*	*			trans	63.4	-173.3	177.1	-25.4	170.8	0	0	0	110.7
964	I	26.7	Very low	25.4	Very low	156 Å²	156	146.6 Å²	146.6	80%	0.8	78%	0.777	S	S	*	*			cis	-128.7	170.9	5.8	-55.1	169	0	0	0	109.8
965	S	24	Very low	25.5	Very low	93 Å²	93	148 Å²	148	65%	0.65	78%	0.778	S	S	*	*			trans	-106.1	154.1	-165.7	60.4	0	0	0	0	117.7
966	R	24.6	Very low	25.5	Very low	239 Å²	239	145.7 Å²	145.7	90%	0.902	77%	0.773	S	S	*	*			trans	53.7	172.3	137.5	-71.7	-178.3	177.4	-174.6	0.6	119.5
967	P	28.2	Very low	25.8	Very low	118 Å²	118	148.8 Å²	148.8	77%	0.766	78%	0.78	S	S	*	*			cis	-118.7	-168.2	-13.7	31.9	-11.6	0	0	0	113.1
968	A	22.8	Very low	25.9	Very low	90 Å²	90	150.6 Å²	150.6	74%	0.744	78%	0.781	S	S	*	*			trans	-95.9	160.9	-177.5	0	0	0	0	0	114.5
969	Y	25.3	Very low	26.1	Very low	230 Å²	230	149.7 Å²	149.7	90%	0.902	78%	0.78	S	S	*	*			trans	-131.2	162.1	162.4	-90.8	-80.1	0	0	0	112.2
970	K	25.8	Very low	26.3	Very low	193 Å²	193	151.2 Å²	151.2	84%	0.839	78%	0.776	S	S	*	*			trans	-91.4	138.4	-160.1	-77.1	176.5	177.2	174.2	0	115.2
971	V	23.1	Very low	26.3	Very low	118 Å²	118	155.8 Å²	155.8	72%	0.715	79%	0.786	S	S	*	*				28.7	119.5	127.8	-172.2	0	0	0	0	118.7
972	I	26.8	Very low	26.5	Very low	152 Å²	152	159.5 Å²	159.5	78%	0.779	79%	0.789	S	S	*	*				-130	136.5	129.5	-61.9	-176	0	0	0	107.6
973	Q	25.2	Very low	26.5	Very low	153 Å²	153	160.1 Å²	160.1	72%	0.715	80%	0.8	S	S	*	*			trans	-96.2	133.9	169.1	-68.9	-175.4	-1.5	0	0	109.9
974	H	27.9	Very low	26.6	Very low	183 Å²	183	160.1 Å²	160.1	85%	0.847	80%	0.8	S	S	*	*			trans	-113.8	127.9	157.8	-94	-90.7	0	0	0	110.3
975	K	27.5	Very low	26.7	Very low	173 Å²	173	163.4 Å²	163.4	75%	0.752	80%	0.802	S	S	*	*			trans	-86.7	159.3	177.3	-89.5	179	177.9	175.3	0	111
976	P	26.7	Very low	26.6	Very low	123 Å²	123	165.4 Å²	165.4	80%	0.799	81%	0.813	S	S	*	*			trans	-79.5	140.6	-162.3	30.5	-36.5	0	0	0	114
977	H	29.9	Very low	26.7	Very low	177 Å²	177	158.9 Å²	158.9	82%	0.819	80%	0.804	S	S	*	*			trans	-81.7	115.8	168.7	-99.2	-79	0	0	0	111.7
978	K	28.1	Very low	26.7	Very low	203 Å²	203	161.6 Å²	161.6	88%	0.883	81%	0.806	S	S	*	*			trans	-72	122.3	160.3	-64.4	175.2	-180	175.5	0	108.6
979	I	29.1	Very low	26.8	Very low	139 Å²	139	163.8 Å²	163.8	71%	0.713	81%	0.806	S	S	*	*			trans	-127.3	102.2	165.5	-61.1	-174.7	0	0	0	110.6
980	Q	29.6	Very low	26.9	Very low	161 Å²	161	158.3 Å²	158.3	75%	0.752	80%	0.798	S	S	*	*			trans	44.4	117.5	143.8	-55.5	-178.4	10.6	0	0	120	K982	Q980-K982 PolarHBondContact O-N 2.89Å
981	K	25.9	Very low	26.9	Very low	213 Å²	213	152.9 Å²	152.9	93%	0.926	78%	0.784	S	S	*	*			trans	-60.4	126	151.7	-64	177.4	178.4	-179.9	0	109.2
982	K	30.1	Very low	27	Very low	181 Å²	181	155.1 Å²	155.1	79%	0.787	79%	0.792	S	S	*	*			trans	-119.1	126.4	152.2	-86.8	-173.9	174.4	179.5	0	108.4	Q980	Q980-K982 PolarHBondContact O-N 2.89Å
983	A	24.7	Very low	26.8	Very low	106 Å²	106	153.2 Å²	153.2	88%	0.876	79%	0.788	S	S	*	*			trans	-81.1	126.1	174.6	0	0	0	0	0	109.2
984	I	27.7	Very low	26.8	Very low	161 Å²	161	148.8 Å²	148.8	83%	0.826	77%	0.769	S	S	*	*			trans	-105.4	135.5	165.9	-62.5	178.4	0	0	0	106.5
985	R	27	Very low	26.7	Very low	226 Å²	226	146.5 Å²	146.5	85%	0.853	76%	0.762	S	S	*	*			trans	-74.9	152.4	-177	-73.4	178.8	174.3	171.5	-2.6	110.6
986	P	23.8	Very low	26.6	Very low	135 Å²	135	148 Å²	148	88%	0.877	76%	0.763	S	S	*	*			trans	-68.4	137	176.5	29.5	-35	0	0	0	110.9
987	S	26	Very low	26.5	Very low	101 Å²	101	148.4 Å²	148.4	71%	0.706	76%	0.758	S	S	*	*			trans	-149.9	132.6	171.9	57.1	0	0	0	0	111
988	E	28.7	Very low	26.3	Very low	175 Å²	175	148 Å²	148	82%	0.818	75%	0.754	S	S	*	*			trans	72.3	136.8	165.9	-57.5	-179.9	165.3	0	0	116
989	N	24.3	Very low	26.3	Very low	137 Å²	137	146.1 Å²	146.1	73%	0.733	75%	0.754	S	S	*	*			trans	-101.5	137.7	-161	-51.4	-48	0	0	0	111.9	S991	N989-S991 VanDerWaalsContact CB-OG 3.27Å; N989-S991 WeakPolarHBondContact CB-OG 3.18Å; N989-S991 PolarHBondContact O-N 3.42Å; N989-S991 VanDerWaalsContact O-N 3.11Å
990	P	27.3	Very low	26.4	Very low	114 Å²	114	142.5 Å²	142.5	74%	0.74	74%	0.736	S	S	*	*			trans	-82.1	54.4	154.3	35.7	-33.3	0	0	0	110	D992	P990-D992 PolarHBondContact O-N 3.43Å
991	S	24.7	Very low	26.5	Very low	79 Å²	79	140.1 Å²	140.1	55%	0.552	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	62.7	178.8	62.6	0	0	0	0	110.9	N989	N989-S991 VanDerWaalsContact CB-OG 3.27Å; N989-S991 WeakPolarHBondContact CB-OG 3.18Å; N989-S991 PolarHBondContact O-N 3.42Å; N989-S991 VanDerWaalsContact O-N 3.11Å
992	D	25.5	Very low	26.7	Very low	165 Å²	165	136.8 Å²	136.8	88%	0.882	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-168.5	33.6	164.9	-94.1	-27	0	0	0	112.4	P990 D994	P990-D992 PolarHBondContact O-N 3.43Å; D992-D994 PolarHBondContact O-N 2.98Å; D992-D994 VanDerWaalsContact O-N 3.09Å
993	T	24	Very low	27	Very low	113 Å²	113	131.6 Å²	131.6	69%	0.693	70%	0.695	S	S	*	*			trans	-76.5	96.6	168.1	-46.1	0	0	0	0	109.2
994	D	24.4	Very low	27.7	Very low	60 Å²	60	127.6 Å²	127.6	32%	0.321	66%	0.659	S	S	.	*			trans	-66.7	136.5	-176.8	-158.3	-44.3	0	0	0	111.3	D992 R996 D997	D992-D994 PolarHBondContact O-N 2.98Å; D992-D994 VanDerWaalsContact O-N 3.09Å; D994-R996 HydrophobicContact CB-CB 4.44Å; D994-R996 VanDerWaalsContact CG-NE 3.29Å; D994-R996 PolarHBondContact O-N 3.49Å; D994-R996 VanDerWaalsContact O-N 3.13Å; D994-R996 VanDerWaalsContact OD1-CB 3.32Å; D994-R996 WeakPolarHBondContact OD1-CB 3.28Å; D994-R996 VanDerWaalsContact OD1-CG 3.25Å; D994-R996 WeakPolarHBondContact OD1-CG 3.48Å; D994-R996 PolarHBondContact OD1-N 2.8Å; D994-R996 IonicContact OD1-NE 3.6Å; D994-R996 PolarHBondContact OD1-NE 2.76Å; D994-R996 IonicContact OD2-CZ 3.71Å; D994-R996 IonicContact OD2-NE 2.93Å; D994-R996 PolarHBondContact OD2-NE 3.28Å; D994-R996 IonicContact OD2-NH2 3.87Å; D994-R996 PolarHBondContact OD2-NH2 2.87Å; D994-D997 PolarHBondContact O-N 2.84Å
995	I	25.1	Very low	28.6	Very low	135 Å²	135	124 Å²	124	69%	0.692	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-65.7	-16.1	177	-62.3	175	0	0	0	110.7	D997 F998	I995-D997 VanDerWaalsContact C-N 3.25Å; I995-D997 PolarHBondContact O-N 3.18Å; I995-F998 PolarHBondContact O-N 3.36Å
996	R	25.6	Very low	29.6	Very low	204 Å²	204	117.2 Å²	117.2	77%	0.77	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-63.8	-21.9	170.9	-68.9	-178.4	-78.6	-178.5	1.8	114.4	D994 F998	D994-R996 HydrophobicContact CB-CB 4.44Å; D994-R996 VanDerWaalsContact CG-NE 3.29Å; D994-R996 PolarHBondContact O-N 3.49Å; D994-R996 VanDerWaalsContact O-N 3.13Å; D994-R996 VanDerWaalsContact OD1-CB 3.32Å; D994-R996 WeakPolarHBondContact OD1-CB 3.28Å; D994-R996 VanDerWaalsContact OD1-CG 3.25Å; D994-R996 WeakPolarHBondContact OD1-CG 3.48Å; D994-R996 PolarHBondContact OD1-N 2.8Å; D994-R996 IonicContact OD1-NE 3.6Å; D994-R996 PolarHBondContact OD1-NE 2.76Å; D994-R996 IonicContact OD2-CZ 3.71Å; D994-R996 IonicContact OD2-NE 2.93Å; D994-R996 PolarHBondContact OD2-NE 3.28Å; D994-R996 IonicContact OD2-NH2 3.87Å; D994-R996 PolarHBondContact OD2-NH2 2.87Å; R996-F998 VanDerWaalsContact C-N 3.35Å
997	D	26.1	Very low	30.6	Very low	132 Å²	132	112.1 Å²	112.1	71%	0.706	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-88.2	1.8	-179	-68.7	-16.9	0	0	0	114	D994 I995 D999	D994-D997 PolarHBondContact O-N 2.84Å; I995-D997 VanDerWaalsContact C-N 3.25Å; I995-D997 PolarHBondContact O-N 3.18Å; D997-D999 PolarHBondContact O-N 2.03Å
998	F	25.7	Very low	31.6	Very low	168 Å²	168	109.8 Å²	109.8	74%	0.737	56%	0.56	S	S	*	*	S	Bend	trans	-70.2	100.9	160.4	-98.8	-85.8	0	0	0	109.1	I995 R996 L1000	I995-F998 PolarHBondContact O-N 3.36Å; R996-F998 VanDerWaalsContact C-N 3.35Å; F998-L1000 PolarHBondContact O-N 3.25Å
999	D	27.3	Very low	32.8	Very low	163 Å²	163	106.5 Å²	106.5	87%	0.872	55%	0.545	S	S	*	.			trans	-65.6	77.2	175.6	-165.8	16.2	0	0	0	110.5	D997 N1001	D997-D999 PolarHBondContact O-N 2.03Å; D999-N1001 PolarHBondContact O-N 3.49Å
1000	L	30.2	Very low	34.1	Very low	63 Å²	63	108.7 Å²	108.7	33%	0.33	54%	0.543	S	S	.	.			trans	-63.9	95.6	-178.2	-83.8	166.8	0	0	0	108.7	F998 F1002 T1004 Q1005	F998-L1000 PolarHBondContact O-N 3.25Å; L1000-F1002 PolarHBondContact O-N 3.44Å; L1000-T1004 HydrophobicContact CD2-CG2 3.84Å; L1000-Q1005 HydrophobicContact CB-CG 3.94Å
1001	N	32.5	Very low	35.1	Very low	111 Å²	111	103.3 Å²	103.3	59%	0.594	51%	0.508	S	S	*	.			trans	-38.8	134.4	179.6	-146.8	-7.8	0	0	0	110.9	D999 D1003 T1004	D999-N1001 PolarHBondContact O-N 3.49Å; N1001-D1003 PolarHBondContact O-N 3.48Å; N1001-T1004 WeakPolarHBondContact O-CA 3.25Å; N1001-T1004 WeakPolarHBondContact O-CB 3.29Å; N1001-T1004 PolarHBondContact O-N 3.38Å; N1001-T1004 PolarHBondContact O-OG1 2.8Å
1002	F	29.9	Very low	36.3	Very low	144 Å²	144	101.6 Å²	101.6	63%	0.632	49%	0.493	S	S	*	.	H	α-helix	trans	-55.7	-28.7	-157.1	-166.7	-124.3	0	0	0	114.2	L1000 K1006	L1000-F1002 PolarHBondContact O-N 3.44Å; F1002-K1006 WeakPolarHBondContact O-CG 3.39Å; F1002-K1006 PolarHBondContact O-N 2.94Å; F1002-K1006 VanDerWaalsContact O-N 3.14Å
1003	D	37	Very low	37.9	Very low	71 Å²	71	99.7 Å²	99.7	38%	0.38	48%	0.476	S	S	.	.	H	α-helix	trans	-73.7	-33.2	175.1	-62.6	-53	0	0	0	113.9	N1001 Q1005 K1006 I1007	N1001-D1003 PolarHBondContact O-N 3.48Å; D1003-Q1005 VanDerWaalsContact C-N 3.32Å; D1003-Q1005 PolarHBondContact O-N 3.14Å; D1003-K1006 CarbonylContact O-C 3.57Å; D1003-K1006 WeakPolarHBondContact O-CB 3.33Å; D1003-K1006 PolarHBondContact O-N 3.31Å; D1003-K1006 VanDerWaalsContact O-N 3.14Å; D1003-K1006 WeakPolarHBondContact OD1-CD 3.46Å; D1003-K1006 WeakPolarHBondContact OD1-CE 3.19Å; D1003-K1006 IonicContact OD1-NZ 2.92Å; D1003-K1006 PolarHBondContact OD1-NZ 3.45Å; D1003-I1007 WeakPolarHBondContact O-CD1 3.35Å; D1003-I1007 WeakPolarHBondContact O-CG1 3.27Å; D1003-I1007 PolarHBondContact O-N 3.39Å
1004	T	39.9	Very low	39.1	Very low	22 Å²	22	94.9 Å²	94.9	14%	0.135	45%	0.448	C	S	.	.	H	α-helix	trans	-61.8	-40.8	172	-47.7	0	0	0	0	111	L1000 N1001 I1007 L1008	L1000-T1004 HydrophobicContact CD2-CG2 3.84Å; N1001-T1004 WeakPolarHBondContact O-CA 3.25Å; N1001-T1004 WeakPolarHBondContact O-CB 3.29Å; N1001-T1004 PolarHBondContact O-N 3.38Å; N1001-T1004 PolarHBondContact O-OG1 2.8Å; T1004-I1007 PolarHBondContact O-N 2.77Å; T1004-L1008 HydrophobicContact CG2-CD1 4.45Å; T1004-L1008 WeakPolarHBondContact O-CG 3.26Å; T1004-L1008 PolarHBondContact O-N 2.87Å
1005	Q	45.1	Very low	40.2	Very low	86 Å²	86	92.1 Å²	92.1	40%	0.402	43%	0.433	S	S	.	.	H	α-helix	trans	-65.3	-40.8	172.1	-68.1	-164.4	17.9	0	0	112.2	L1000 D1003 I1007 L1008 Q1009	L1000-Q1005 HydrophobicContact CB-CG 3.94Å; D1003-Q1005 VanDerWaalsContact C-N 3.32Å; D1003-Q1005 PolarHBondContact O-N 3.14Å; Q1005-I1007 PolarHBondContact O-N 3.14Å; Q1005-L1008 PolarHBondContact O-N 3.49Å; Q1005-Q1009 WeakPolarHBondContact O-CB 3.29Å; Q1005-Q1009 WeakPolarHBondContact O-CG 3.43Å; Q1005-Q1009 PolarHBondContact O-N 2.89Å
1006	K	48.5	Very low	41.6	Very low	83 Å²	83	91.8 Å²	91.8	36%	0.361	43%	0.429	S	S	.	.	H	α-helix	trans	-61.9	-40.7	173.8	-69.4	172.6	-158.5	158.1	0	112.2	F1002 D1003 Q1009 R1010	F1002-K1006 WeakPolarHBondContact O-CG 3.39Å; F1002-K1006 PolarHBondContact O-N 2.94Å; F1002-K1006 VanDerWaalsContact O-N 3.14Å; D1003-K1006 CarbonylContact O-C 3.57Å; D1003-K1006 WeakPolarHBondContact O-CB 3.33Å; D1003-K1006 PolarHBondContact O-N 3.31Å; D1003-K1006 VanDerWaalsContact O-N 3.14Å; D1003-K1006 WeakPolarHBondContact OD1-CD 3.46Å; D1003-K1006 WeakPolarHBondContact OD1-CE 3.19Å; D1003-K1006 IonicContact OD1-NZ 2.92Å; D1003-K1006 PolarHBondContact OD1-NZ 3.45Å; K1006-Q1009 PolarHBondContact O-N 2.66Å; K1006-R1010 WeakPolarHBondContact O-CB 3.3Å; K1006-R1010 VanDerWaalsContact O-CG 3.28Å; K1006-R1010 WeakPolarHBondContact O-CG 3.39Å; K1006-R1010 PolarHBondContact O-N 3.25Å
1007	I	44.7	Very low	42.9	Very low	29 Å²	29	85.1 Å²	85.1	15%	0.149	42%	0.417	C	S	.	.	H	α-helix	trans	-63.2	-49.5	177.8	-69	159.5	0	0	0	109.6	D1003 T1004 Q1005 Q1009 R1010 F1011 N1056	D1003-I1007 WeakPolarHBondContact O-CD1 3.35Å; D1003-I1007 WeakPolarHBondContact O-CG1 3.27Å; D1003-I1007 PolarHBondContact O-N 3.39Å; T1004-I1007 PolarHBondContact O-N 2.77Å; Q1005-I1007 PolarHBondContact O-N 3.14Å; I1007-Q1009 PolarHBondContact O-N 3.38Å; I1007-R1010 PolarHBondContact O-N 2.71Å; I1007-R1010 VanDerWaalsContact O-N 3.14Å; I1007-F1011 VanDerWaalsContact O-CB 3.29Å; I1007-F1011 WeakPolarHBondContact O-CB 3.29Å; I1007-F1011 PolarHBondContact O-N 3.05Å; I1007-N1056 HydrophobicContact CD1-CB 4.25Å; I1007-N1056 WeakPolarHBondContact CD1-OD1 3.3Å
1008	L	47	Very low	43.8	Very low	52 Å²	52	81.9 Å²	81.9	27%	0.272	40%	0.4	S	S	.	.	H	α-helix	trans	-59.1	-45.1	176	-70.9	167.8	0	0	0	111.3	T1004 Q1005 R1010 F1011 D1012 K1072	T1004-L1008 HydrophobicContact CG2-CD1 4.45Å; T1004-L1008 WeakPolarHBondContact O-CG 3.26Å; T1004-L1008 PolarHBondContact O-N 2.87Å; Q1005-L1008 PolarHBondContact O-N 3.49Å; L1008-R1010 VanDerWaalsContact C-N 3.34Å; L1008-R1010 PolarHBondContact O-N 2.99Å; L1008-F1011 PolarHBondContact O-N 3.2Å; L1008-D1012 WeakPolarHBondContact O-CB 3.29Å; L1008-D1012 PolarHBondContact O-N 2.84Å; L1008-D1012 VanDerWaalsContact O-OD1 3.06Å; L1008-K1072 HydrophobicContact CD2-CD 4.04Å
1009	Q	54.9	Low	44.6	Very low	105 Å²	105	74.8 Å²	74.8	49%	0.491	37%	0.37	S	S	.	.	H	α-helix	trans	-66.5	-29.6	175.5	-72.8	-174.5	22.4	0	0	114.2	Q1005 K1006 I1007 K1013	Q1005-Q1009 WeakPolarHBondContact O-CB 3.29Å; Q1005-Q1009 WeakPolarHBondContact O-CG 3.43Å; Q1005-Q1009 PolarHBondContact O-N 2.89Å; K1006-Q1009 PolarHBondContact O-N 2.66Å; I1007-Q1009 PolarHBondContact O-N 3.38Å; Q1009-K1013 WeakPolarHBondContact O-CB 3.38Å; Q1009-K1013 VanDerWaalsContact O-CD 3.29Å; Q1009-K1013 WeakPolarHBondContact O-CD 3.42Å; Q1009-K1013 WeakPolarHBondContact O-CG 3.18Å; Q1009-K1013 PolarHBondContact O-N 3.01Å
1010	R	51.3	Low	45.2	Very low	184 Å²	184	68.4 Å²	68.4	69%	0.694	34%	0.335	S	S	*	.	H	α-helix	trans	-73.7	-41.2	173.8	-79.4	176.5	176	-165.8	-0.4	111	K1006 I1007 L1008 A1014	K1006-R1010 WeakPolarHBondContact O-CB 3.3Å; K1006-R1010 VanDerWaalsContact O-CG 3.28Å; K1006-R1010 WeakPolarHBondContact O-CG 3.39Å; K1006-R1010 PolarHBondContact O-N 3.25Å; I1007-R1010 PolarHBondContact O-N 2.71Å; I1007-R1010 VanDerWaalsContact O-N 3.14Å; L1008-R1010 VanDerWaalsContact C-N 3.34Å; L1008-R1010 PolarHBondContact O-N 2.99Å; R1010-A1014 VanDerWaalsContact O-CB 3.32Å; R1010-A1014 WeakPolarHBondContact O-CB 3.36Å; R1010-A1014 PolarHBondContact O-N 2.92Å
1011	F	48.6	Very low	45.7	Very low	1 Å²	1	67.7 Å²	67.7	0%	0.004	34%	0.335	C	S	.	.	H	α-helix	trans	-63.4	-50	176.4	176.7	-106.6	0	0	0	111.2	I1007 L1008 K1013 A1014 L1015 L1045 I1048 F1069 K1072 L1073	I1007-F1011 VanDerWaalsContact O-CB 3.29Å; I1007-F1011 WeakPolarHBondContact O-CB 3.29Å; I1007-F1011 PolarHBondContact O-N 3.05Å; L1008-F1011 PolarHBondContact O-N 3.2Å; F1011-K1013 PolarHBondContact O-N 3.1Å; F1011-A1014 WeakPolarHBondContact O-CA 3.42Å; F1011-A1014 WeakPolarHBondContact O-CB 3.43Å; F1011-A1014 PolarHBondContact O-N 3.02Å; F1011-L1015 HydrophobicContact CD1-CD1 3.97Å; F1011-L1015 HydrophobicContact CE1-CD1 3.51Å; F1011-L1015 HydrophobicContact CE1-CG 4.47Å; F1011-L1015 HydrophobicContact CE2-CD1 4.19Å; F1011-L1015 HydrophobicContact CE2-CG 4.45Å; F1011-L1015 HydrophobicContact CZ-CD1 3.65Å; F1011-L1015 HydrophobicContact CZ-CG 4.38Å; F1011-L1015 WeakPolarHBondContact O-CG 3.34Å; F1011-L1015 PolarHBondContact O-N 2.95Å; F1011-L1045 HydrophobicContact CD2-CD2 4.04Å; F1011-L1045 HydrophobicContact CE2-CD2 3.66Å; F1011-I1048 HydrophobicContact CD2-CG2 4.43Å; F1011-F1069 AromaticContact CD2-CE2 3.48Å; F1011-F1069 HydrophobicContact CD2-CE2 3.48Å; F1011-F1069 VanDerWaalsContact CD2-CE2 3.48Å; F1011-F1069 AromaticContact CD2-CZ 3.63Å; F1011-F1069 HydrophobicContact CD2-CZ 3.63Å; F1011-F1069 HydrophobicContact CE2-CD2 4.31Å; F1011-F1069 AromaticContact CE2-CE1 3.89Å; F1011-F1069 HydrophobicContact CE2-CE1 3.89Å; F1011-F1069 AromaticContact CE2-CE2 3.38Å; F1011-F1069 HydrophobicContact CE2-CE2 3.38Å; F1011-F1069 AromaticContact CE2-CZ 3.14Å; F1011-F1069 HydrophobicContact CE2-CZ 3.14Å; F1011-F1069 HydrophobicContact CG-CE2 4.1Å; F1011-F1069 HydrophobicContact CZ-CD2 4.44Å; F1011-F1069 HydrophobicContact CZ-CE1 4.22Å; F1011-F1069 AromaticContact CZ-CE2 3.92Å; F1011-F1069 HydrophobicContact CZ-CE2 3.92Å; F1011-F1069 AromaticContact CZ-CZ 3.81Å; F1011-F1069 HydrophobicContact CZ-CZ 3.81Å; F1011-K1072 HydrophobicContact CD1-CD 4.44Å; F1011-K1072 HydrophobicContact CE1-CB 4.42Å; F1011-K1072 HydrophobicContact CE1-CD 4.3Å; F1011-K1072 HydrophobicContact CE1-CG 4.32Å; F1011-L1073 HydrophobicContact CE2-CD1 4.25Å; F1011-L1073 HydrophobicContact CZ-CB 4.22Å; F1011-L1073 HydrophobicContact CZ-CD1 3.9Å
1012	D	49.6	Very low	45.9	Very low	43 Å²	43	65.4 Å²	65.4	23%	0.23	33%	0.327	C	S	.	.	H	α-helix	trans	-58.8	-46.5	177.9	-62.5	-1.3	0	0	0	110.8	L1008 A1014 L1015 E1016 K1072	L1008-D1012 WeakPolarHBondContact O-CB 3.29Å; L1008-D1012 PolarHBondContact O-N 2.84Å; L1008-D1012 VanDerWaalsContact O-OD1 3.06Å; D1012-A1014 VanDerWaalsContact C-N 3.31Å; D1012-A1014 PolarHBondContact O-N 3.35Å; D1012-L1015 PolarHBondContact O-N 2.81Å; D1012-E1016 WeakPolarHBondContact O-CB 3.35Å; D1012-E1016 WeakPolarHBondContact O-CG 3.28Å; D1012-E1016 PolarHBondContact O-N 3.38Å; D1012-K1072 WeakPolarHBondContact OD1-CE 3.17Å; D1012-K1072 IonicContact OD1-NZ 2.65Å; D1012-K1072 PolarHBondContact OD1-NZ 3.49Å; D1012-K1072 IonicContact OD2-NZ 2.64Å; D1012-K1072 PolarHBondContact OD2-NZ 3.49Å
1013	K	58	Low	46.2	Very low	124 Å²	124	61.9 Å²	61.9	54%	0.539	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-35.1	173.7	-74.4	169.4	-172.3	157.1	0	113.1	Q1009 F1011 A1017	Q1009-K1013 WeakPolarHBondContact O-CB 3.38Å; Q1009-K1013 VanDerWaalsContact O-CD 3.29Å; Q1009-K1013 WeakPolarHBondContact O-CD 3.42Å; Q1009-K1013 WeakPolarHBondContact O-CG 3.18Å; Q1009-K1013 PolarHBondContact O-N 3.01Å; F1011-K1013 PolarHBondContact O-N 3.1Å; K1013-A1017 WeakPolarHBondContact O-CB 3.28Å; K1013-A1017 PolarHBondContact O-N 3.46Å
1014	A	49.5	Very low	46.4	Very low	12 Å²	12	66.1 Å²	66.1	10%	0.099	33%	0.325	C	S	.	.	H	α-helix	trans	-69.9	-35.7	176.9	0	0	0	0	0	111.9	R1010 F1011 D1012 N1018 L1044 I1048	R1010-A1014 VanDerWaalsContact O-CB 3.32Å; R1010-A1014 WeakPolarHBondContact O-CB 3.36Å; R1010-A1014 PolarHBondContact O-N 2.92Å; F1011-A1014 WeakPolarHBondContact O-CA 3.42Å; F1011-A1014 WeakPolarHBondContact O-CB 3.43Å; F1011-A1014 PolarHBondContact O-N 3.02Å; D1012-A1014 VanDerWaalsContact C-N 3.31Å; D1012-A1014 PolarHBondContact O-N 3.35Å; A1014-N1018 VanDerWaalsContact O-CB 3.31Å; A1014-N1018 WeakPolarHBondContact O-CB 3.45Å; A1014-N1018 PolarHBondContact O-N 2.97Å; A1014-N1018 PolarHBondContact O-ND2 3.19Å; A1014-L1044 HydrophobicContact CB-CD2 4.21Å; A1014-I1048 HydrophobicContact CB-CD1 3.49Å; A1014-I1048 VanDerWaalsContact CB-CD1 3.49Å
1015	L	47.6	Very low	46.4	Very low	3 Å²	3	73 Å²	73	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-70.2	-48.2	173.3	-66.2	178.7	0	0	0	111.8	F1011 D1012 A1017 I1019 I1020 L1045 E1076	F1011-L1015 HydrophobicContact CD1-CD1 3.97Å; F1011-L1015 HydrophobicContact CE1-CD1 3.51Å; F1011-L1015 HydrophobicContact CE1-CG 4.47Å; F1011-L1015 HydrophobicContact CE2-CD1 4.19Å; F1011-L1015 HydrophobicContact CE2-CG 4.45Å; F1011-L1015 HydrophobicContact CZ-CD1 3.65Å; F1011-L1015 HydrophobicContact CZ-CG 4.38Å; F1011-L1015 WeakPolarHBondContact O-CG 3.34Å; F1011-L1015 PolarHBondContact O-N 2.95Å; D1012-L1015 PolarHBondContact O-N 2.81Å; L1015-A1017 VanDerWaalsContact C-N 3.29Å; L1015-A1017 PolarHBondContact O-N 2.89Å; L1015-I1019 HydrophobicContact CD2-CB 4.23Å; L1015-I1019 HydrophobicContact CD2-CD1 3.72Å; L1015-I1019 HydrophobicContact CD2-CG1 4.15Å; L1015-I1019 PolarHBondContact O-N 3.08Å; L1015-I1020 PolarHBondContact O-N 3.27Å; L1015-L1045 HydrophobicContact CD2-CD1 4.47Å; L1015-L1045 HydrophobicContact CD2-CD2 3.94Å; L1015-E1076 HydrophobicContact CD1-CB 3.74Å; L1015-E1076 HydrophobicContact CD1-CG 3.44Å; L1015-E1076 VanDerWaalsContact CD1-CG 3.44Å
1016	E	53.8	Low	45.8	Very low	127 Å²	127	75.6 Å²	75.6	59%	0.593	37%	0.368	S	S	*	.	H	α-helix	trans	-56.8	-39	174.7	-76.1	-169.8	141.1	0	0	112.8	D1012 I1020 P1021	D1012-E1016 WeakPolarHBondContact O-CB 3.35Å; D1012-E1016 WeakPolarHBondContact O-CG 3.28Å; D1012-E1016 PolarHBondContact O-N 3.38Å; E1016-I1020 HydrophobicContact CG-CD1 4.14Å; E1016-P1021 VanDerWaalsContact O-CD 3.25Å; E1016-P1021 WeakPolarHBondContact O-CD 3.3Å; E1016-P1021 WeakPolarHBondContact O-CG 3.5Å
1017	A	53	Low	45	Very low	64 Å²	64	75 Å²	75	53%	0.529	39%	0.385	S	S	.	.	H	α-helix	trans	-84	-37.2	-177.3	0	0	0	0	0	114.3	K1013 L1015	K1013-A1017 WeakPolarHBondContact O-CB 3.28Å; K1013-A1017 PolarHBondContact O-N 3.46Å; L1015-A1017 VanDerWaalsContact C-N 3.29Å; L1015-A1017 PolarHBondContact O-N 2.89Å
1018	N	46.3	Very low	44.3	Very low	65 Å²	65	81.4 Å²	81.4	35%	0.348	42%	0.419	S	S	.	.	H	α-helix	trans	-115.4	-18.6	-166.6	-54.2	-81.4	0	0	0	114.7	A1014 S1022 A1041 L1044	A1014-N1018 VanDerWaalsContact O-CB 3.31Å; A1014-N1018 WeakPolarHBondContact O-CB 3.45Å; A1014-N1018 PolarHBondContact O-N 2.97Å; A1014-N1018 PolarHBondContact O-ND2 3.19Å; N1018-S1022 PolarHBondContact O-OG 2.81Å; N1018-A1041 HydrophobicContact CB-CB 4.41Å; N1018-L1044 WeakPolarHBondContact ND2-CD2 3.38Å
1019	I	41.6	Very low	43.5	Very low	18 Å²	18	86.6 Å²	86.6	9%	0.092	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-49.3	-171.3	-58	-157.7	0	0	0	111.7	L1015 S1022 Y1023 A1041 L1045	L1015-I1019 HydrophobicContact CD2-CB 4.23Å; L1015-I1019 HydrophobicContact CD2-CD1 3.72Å; L1015-I1019 HydrophobicContact CD2-CG1 4.15Å; L1015-I1019 PolarHBondContact O-N 3.08Å; I1019-S1022 WeakPolarHBondContact O-CB 3.3Å; I1019-S1022 PolarHBondContact O-N 3.42Å; I1019-Y1023 HydrophobicContact CG2-CD2 3.78Å; I1019-Y1023 HydrophobicContact CG2-CE2 3.6Å; I1019-Y1023 WeakPolarHBondContact O-CD2 3.46Å; I1019-Y1023 PolarHBondContact O-N 2.72Å; I1019-Y1023 VanDerWaalsContact O-N 3.12Å; I1019-A1041 HydrophobicContact CD1-CB 4.47Å; I1019-A1041 HydrophobicContact CG1-CB 4.21Å; I1019-L1045 HydrophobicContact CD1-CD1 3.46Å; I1019-L1045 VanDerWaalsContact CD1-CD1 3.46Å; I1019-L1045 HydrophobicContact CD1-CG 4.04Å
1020	I	41.1	Very low	42.4	Very low	30 Å²	30	85.9 Å²	85.9	15%	0.154	45%	0.448	C	S	.	.	H	α-helix	trans	-57.7	-41.4	177.3	-70.9	168.7	0	0	0	112.7	L1015 E1016 Y1023 K1024 E1076	L1015-I1020 PolarHBondContact O-N 3.27Å; E1016-I1020 HydrophobicContact CG-CD1 4.14Å; I1020-Y1023 PolarHBondContact O-N 2.88Å; I1020-K1024 HydrophobicContact CG2-CD 3.73Å; I1020-K1024 VanDerWaalsContact CG2-CE 3.42Å; I1020-K1024 HydrophobicContact CG2-CG 4.39Å; I1020-K1024 VanDerWaalsContact CG2-NZ 3.27Å; I1020-K1024 WeakPolarHBondContact O-CB 3.37Å; I1020-K1024 WeakPolarHBondContact O-CG 3.37Å; I1020-K1024 PolarHBondContact O-N 3.15Å; I1020-K1024 VanDerWaalsContact O-N 3.07Å; I1020-E1076 WeakPolarHBondContact CD1-OE2 3.26Å
1021	P	39.3	Very low	41.3	Very low	48 Å²	48	80.4 Å²	80.4	31%	0.312	44%	0.435	S	S	.	.	H	α-helix	trans	-66.6	-40.1	177	-21.9	36	0	0	0	112.1	E1016 Y1023 K1024 Q1025	E1016-P1021 VanDerWaalsContact O-CD 3.25Å; E1016-P1021 WeakPolarHBondContact O-CD 3.3Å; E1016-P1021 WeakPolarHBondContact O-CG 3.5Å; P1021-Y1023 PolarHBondContact O-N 2.87Å; P1021-K1024 PolarHBondContact O-N 2.61Å; P1021-Q1025 PolarHBondContact O-N 3Å; P1021-Q1025 VanDerWaalsContact O-N 3.12Å
1022	S	37.7	Very low	40.2	Very low	62 Å²	62	85.7 Å²	85.7	43%	0.434	47%	0.469	S	S	.	.	H	α-helix	trans	-64.5	-24.5	179.8	-51.5	0	0	0	0	113.5	N1018 I1019	N1018-S1022 PolarHBondContact O-OG 2.81Å; I1019-S1022 WeakPolarHBondContact O-CB 3.3Å; I1019-S1022 PolarHBondContact O-N 3.42Å
1023	Y	36.3	Very low	39.3	Very low	71 Å²	71	91.5 Å²	91.5	28%	0.278	49%	0.492	S	S	.	.	H	α-helix	trans	-88	-32.8	168.2	-78.1	-69.4	0	0	0	113.2	I1019 I1020 P1021 L1077 L1081 I1083	I1019-Y1023 HydrophobicContact CG2-CD2 3.78Å; I1019-Y1023 HydrophobicContact CG2-CE2 3.6Å; I1019-Y1023 WeakPolarHBondContact O-CD2 3.46Å; I1019-Y1023 PolarHBondContact O-N 2.72Å; I1019-Y1023 VanDerWaalsContact O-N 3.12Å; I1020-Y1023 PolarHBondContact O-N 2.88Å; P1021-Y1023 PolarHBondContact O-N 2.87Å; Y1023-L1077 HydrophobicContact CE2-CD2 4.06Å; Y1023-L1081 HydrophobicContact CD1-CD2 4.16Å; Y1023-L1081 HydrophobicContact CE1-CD2 3.74Å; Y1023-I1083 WeakPolarHBondContact O-CD1 3.3Å
1024	K	41.4	Very low	38	Very low	159 Å²	159	87 Å²	87	69%	0.691	47%	0.474	S	S	*	.	H	α-helix	trans	-76.2	-25.8	-175	-79.5	176.4	179.4	168.5	0	115.3	I1020 P1021	I1020-K1024 HydrophobicContact CG2-CD 3.73Å; I1020-K1024 VanDerWaalsContact CG2-CE 3.42Å; I1020-K1024 HydrophobicContact CG2-CG 4.39Å; I1020-K1024 VanDerWaalsContact CG2-NZ 3.27Å; I1020-K1024 WeakPolarHBondContact O-CB 3.37Å; I1020-K1024 WeakPolarHBondContact O-CG 3.37Å; I1020-K1024 PolarHBondContact O-N 3.15Å; I1020-K1024 VanDerWaalsContact O-N 3.07Å; P1021-K1024 PolarHBondContact O-N 2.61Å
1025	Q	38.8	Very low	37.1	Very low	168 Å²	168	91.4 Å²	91.4	79%	0.785	49%	0.493	S	S	*	.	S	Bend	trans	-81.9	-42.1	-169.4	-79.8	-170.7	-35.4	0	0	115.8	P1021	P1021-Q1025 PolarHBondContact O-N 3Å; P1021-Q1025 VanDerWaalsContact O-N 3.12Å
1026	E	33	Very low	36.6	Very low	140 Å²	140	98.7 Å²	98.7	65%	0.654	52%	0.524	S	S	*	.			trans	-128.2	109.7	-170.9	-67.4	-169.5	147.8	0	0	113.5
1027	G	30.7	Very low	35.7	Very low	69 Å²	69	97.2 Å²	97.2	71%	0.711	52%	0.521	S	S	*	.			trans	-82.7	141.9	150.8	0	0	0	0	0	109.6
1028	L	30.3	Very low	34.8	Very low	165 Å²	165	99.3 Å²	99.3	86%	0.864	52%	0.515	S	S	*	.	S	Bend	trans	100.9	113.4	-175.6	-58.7	161.6	0	0	0	114.3
1029	M	29.8	Very low	34.2	Very low	160 Å²	160	101.7 Å²	101.7	79%	0.788	53%	0.526	S	S	*	.			trans	45.9	127.4	162.1	-70.2	-62.9	171.8	0	0	121	T1031	M1029-T1031 PolarHBondContact O-N 3.39Å
1030	P	32.7	Very low	34.2	Very low	90 Å²	90	104.6 Å²	104.6	58%	0.584	55%	0.548	S	S	*	.			trans	-71.8	102.3	175.7	31.1	-33.9	0	0	0	111.5
1031	T	27.2	Very low	33.9	Very low	70 Å²	70	104 Å²	104	43%	0.429	55%	0.547	S	S	.	.			trans	-73.4	154.9	168.4	65.3	0	0	0	0	111	M1029 K1033 L1034	M1029-T1031 PolarHBondContact O-N 3.39Å; T1031-K1033 PolarHBondContact O-N 3.47Å; T1031-L1034 WeakPolarHBondContact O-CB 3.21Å; T1031-L1034 PolarHBondContact O-N 2.89Å; T1031-L1034 VanDerWaalsContact O-N 3.08Å
1032	P	27.1	Very low	34	Very low	111 Å²	111	106 Å²	106	72%	0.721	56%	0.555	S	S	*	*	H	α-helix	trans	-60.7	-17.7	179.9	-27.2	36.3	0	0	0	115.5
1033	K	31	Very low	34.2	Very low	165 Å²	165	109.3 Å²	109.3	72%	0.717	56%	0.562	S	S	*	*	H	α-helix	trans	-64.4	-49.9	171.3	-77.6	-174.5	172	-176.5	0	111.2	T1031 Q1035 K1036 D1037	T1031-K1033 PolarHBondContact O-N 3.47Å; K1033-Q1035 PolarHBondContact O-N 2.86Å; K1033-K1036 WeakPolarHBondContact O-CB 3.46Å; K1033-K1036 PolarHBondContact O-N 2.88Å; K1033-D1037 PolarHBondContact O-N 3.44Å
1034	L	30.2	Very low	34.6	Very low	31 Å²	31	109 Å²	109	16%	0.162	57%	0.565	C	S	.	*	H	α-helix	trans	-55.8	-28.5	178.7	-89.4	160.3	0	0	0	113.3	T1031 R1038	T1031-L1034 WeakPolarHBondContact O-CB 3.21Å; T1031-L1034 PolarHBondContact O-N 2.89Å; T1031-L1034 VanDerWaalsContact O-N 3.08Å; L1034-R1038 VanDerWaalsContact O-CB 3.26Å; L1034-R1038 WeakPolarHBondContact O-CB 3.44Å; L1034-R1038 VanDerWaalsContact O-CD 3.29Å; L1034-R1038 WeakPolarHBondContact O-CD 3.38Å; L1034-R1038 WeakPolarHBondContact O-CG 3.29Å; L1034-R1038 PolarHBondContact O-N 3.4Å
1035	Q	30.3	Very low	34.6	Very low	103 Å²	103	102.4 Å²	102.4	48%	0.481	54%	0.537	S	S	.	.	H	α-helix	trans	-66.7	-39.7	172.8	-87.7	-175.1	-24.6	0	0	112.8	K1033 I1039	K1033-Q1035 PolarHBondContact O-N 2.86Å; Q1035-I1039 WeakPolarHBondContact O-CD1 3.35Å; Q1035-I1039 VanDerWaalsContact O-CG1 3.22Å; Q1035-I1039 WeakPolarHBondContact O-CG1 3.4Å; Q1035-I1039 PolarHBondContact O-N 3.22Å; Q1035-I1039 VanDerWaalsContact O-N 3.1Å
1036	K	36.6	Very low	34.6	Very low	157 Å²	157	101.6 Å²	101.6	68%	0.683	53%	0.528	S	S	*	.	H	α-helix	trans	-65.7	-46.1	175.3	-79.7	-169.6	172.6	-174.6	0	111.4	K1033 R1038 I1039 S1040	K1033-K1036 WeakPolarHBondContact O-CB 3.46Å; K1033-K1036 PolarHBondContact O-N 2.88Å; K1036-R1038 VanDerWaalsContact C-N 3.34Å; K1036-R1038 PolarHBondContact O-N 3.41Å; K1036-I1039 PolarHBondContact O-N 2.88Å; K1036-I1039 VanDerWaalsContact O-N 3.14Å; K1036-S1040 PolarHBondContact O-N 3.02Å; K1036-S1040 PolarHBondContact O-OG 2.95Å
1037	D	36	Very low	35.1	Very low	96 Å²	96	99 Å²	99	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-67.3	-37.3	-176.2	-54.4	-38.8	0	0	0	111.4	K1033 S1040 A1041	K1033-D1037 PolarHBondContact O-N 3.44Å; D1037-S1040 PolarHBondContact O-N 3.01Å; D1037-A1041 PolarHBondContact O-N 2.65Å
1038	R	34	Very low	35.7	Very low	108 Å²	108	97.4 Å²	97.4	41%	0.408	49%	0.49	S	S	.	.	H	α-helix	trans	-62.4	-40.6	170.4	-73.7	168.6	-174.8	-163.3	0	112.9	L1034 K1036 S1040 A1041 L1042	L1034-R1038 VanDerWaalsContact O-CB 3.26Å; L1034-R1038 WeakPolarHBondContact O-CB 3.44Å; L1034-R1038 VanDerWaalsContact O-CD 3.29Å; L1034-R1038 WeakPolarHBondContact O-CD 3.38Å; L1034-R1038 WeakPolarHBondContact O-CG 3.29Å; L1034-R1038 PolarHBondContact O-N 3.4Å; K1036-R1038 VanDerWaalsContact C-N 3.34Å; K1036-R1038 PolarHBondContact O-N 3.41Å; R1038-S1040 VanDerWaalsContact C-N 3.35Å; R1038-A1041 PolarHBondContact O-N 3.29Å; R1038-L1042 WeakPolarHBondContact O-CB 3.45Å; R1038-L1042 WeakPolarHBondContact O-CG 3.41Å; R1038-L1042 PolarHBondContact O-N 2.94Å
1039	I	34	Very low	36.1	Very low	115 Å²	115	91.9 Å²	91.9	59%	0.59	46%	0.458	S	S	*	.	H	α-helix	trans	-64.7	-40.6	176	-71.3	164.2	0	0	0	110.6	Q1035 K1036 L1042 K1043	Q1035-I1039 WeakPolarHBondContact O-CD1 3.35Å; Q1035-I1039 VanDerWaalsContact O-CG1 3.22Å; Q1035-I1039 WeakPolarHBondContact O-CG1 3.4Å; Q1035-I1039 PolarHBondContact O-N 3.22Å; Q1035-I1039 VanDerWaalsContact O-N 3.1Å; K1036-I1039 PolarHBondContact O-N 2.88Å; K1036-I1039 VanDerWaalsContact O-N 3.14Å; I1039-L1042 PolarHBondContact O-N 3.31Å; I1039-K1043 WeakPolarHBondContact O-CB 3.4Å; I1039-K1043 PolarHBondContact O-N 3.33Å
1040	S	39.7	Very low	36.7	Very low	78 Å²	78	90.6 Å²	90.6	55%	0.545	45%	0.445	S	S	.	.	H	α-helix	trans	-63.8	-45	175.4	-60.1	0	0	0	0	112.6	K1036 D1037 R1038 K1043 L1044	K1036-S1040 PolarHBondContact O-N 3.02Å; K1036-S1040 PolarHBondContact O-OG 2.95Å; D1037-S1040 PolarHBondContact O-N 3.01Å; R1038-S1040 VanDerWaalsContact C-N 3.35Å; S1040-K1043 WeakPolarHBondContact O-CB 3.49Å; S1040-K1043 PolarHBondContact O-N 2.78Å; S1040-L1044 PolarHBondContact O-N 3.07Å; S1040-L1044 VanDerWaalsContact O-N 3.14Å
1041	A	36.3	Very low	36.9	Very low	17 Å²	17	89.3 Å²	89.3	14%	0.14	45%	0.448	C	S	.	.	H	α-helix	trans	-65.3	-39	176.6	0	0	0	0	0	112.4	N1018 I1019 D1037 R1038 L1044 L1045	N1018-A1041 HydrophobicContact CB-CB 4.41Å; I1019-A1041 HydrophobicContact CD1-CB 4.47Å; I1019-A1041 HydrophobicContact CG1-CB 4.21Å; D1037-A1041 PolarHBondContact O-N 2.65Å; R1038-A1041 PolarHBondContact O-N 3.29Å; A1041-L1044 PolarHBondContact O-N 2.82Å; A1041-L1045 PolarHBondContact O-N 3.18Å; A1041-L1045 VanDerWaalsContact O-N 3.16Å
1042	L	40	Very low	37.2	Very low	92 Å²	92	87.2 Å²	87.2	48%	0.482	44%	0.436	S	S	.	.	H	α-helix	trans	-65.9	-36.5	172.1	-77.1	165.9	0	0	0	112.1	R1038 I1039 L1044 L1045 Y1046	R1038-L1042 WeakPolarHBondContact O-CB 3.45Å; R1038-L1042 WeakPolarHBondContact O-CG 3.41Å; R1038-L1042 PolarHBondContact O-N 2.94Å; I1039-L1042 PolarHBondContact O-N 3.31Å; L1042-L1044 VanDerWaalsContact C-N 3.32Å; L1042-L1044 PolarHBondContact O-N 3.02Å; L1042-L1045 HydrophobicContact CD2-CD1 4.31Å; L1042-L1045 WeakPolarHBondContact O-CB 3.44Å; L1042-L1045 PolarHBondContact O-N 2.86Å; L1042-Y1046 WeakPolarHBondContact O-CD2 3.38Å; L1042-Y1046 PolarHBondContact O-N 2.89Å
1043	K	43	Very low	37.6	Very low	131 Å²	131	84.8 Å²	84.8	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-59.7	-43.8	174.8	-170.4	176.9	-173.4	-82.6	0	111	I1039 S1040 L1045 Y1046 E1047	I1039-K1043 WeakPolarHBondContact O-CB 3.4Å; I1039-K1043 PolarHBondContact O-N 3.33Å; S1040-K1043 WeakPolarHBondContact O-CB 3.49Å; S1040-K1043 PolarHBondContact O-N 2.78Å; K1043-L1045 PolarHBondContact O-N 3.46Å; K1043-Y1046 PolarHBondContact O-N 2.97Å; K1043-E1047 IonicContact NZ-OE1 2.72Å; K1043-E1047 PolarHBondContact NZ-OE1 2.8Å; K1043-E1047 WeakPolarHBondContact O-CG 3.41Å; K1043-E1047 PolarHBondContact O-N 3.11Å
1044	L	43.7	Very low	37.7	Very low	65 Å²	65	82.3 Å²	82.3	34%	0.34	42%	0.416	S	S	.	.	H	α-helix	trans	-63.8	-38.3	176	-156.4	86.3	0	0	0	112.4	A1014 N1018 S1040 A1041 L1042 E1047 I1048	A1014-L1044 HydrophobicContact CB-CD2 4.21Å; N1018-L1044 WeakPolarHBondContact ND2-CD2 3.38Å; S1040-L1044 PolarHBondContact O-N 3.07Å; S1040-L1044 VanDerWaalsContact O-N 3.14Å; A1041-L1044 PolarHBondContact O-N 2.82Å; L1042-L1044 VanDerWaalsContact C-N 3.32Å; L1042-L1044 PolarHBondContact O-N 3.02Å; L1044-E1047 PolarHBondContact O-N 2.86Å; L1044-I1048 VanDerWaalsContact O-CG1 3.31Å; L1044-I1048 WeakPolarHBondContact O-CG1 3.26Å; L1044-I1048 PolarHBondContact O-N 3.16Å
1045	L	41.3	Very low	37.9	Very low	20 Å²	20	83.9 Å²	83.9	11%	0.105	43%	0.427	C	S	.	.	H	α-helix	trans	-63.6	-42.6	172.4	-78.3	-179.8	0	0	0	112.5	F1011 L1015 I1019 A1041 L1042 K1043 E1047 I1048 Y1049 L1073	F1011-L1045 HydrophobicContact CD2-CD2 4.04Å; F1011-L1045 HydrophobicContact CE2-CD2 3.66Å; L1015-L1045 HydrophobicContact CD2-CD1 4.47Å; L1015-L1045 HydrophobicContact CD2-CD2 3.94Å; I1019-L1045 HydrophobicContact CD1-CD1 3.46Å; I1019-L1045 VanDerWaalsContact CD1-CD1 3.46Å; I1019-L1045 HydrophobicContact CD1-CG 4.04Å; A1041-L1045 PolarHBondContact O-N 3.18Å; A1041-L1045 VanDerWaalsContact O-N 3.16Å; L1042-L1045 HydrophobicContact CD2-CD1 4.31Å; L1042-L1045 WeakPolarHBondContact O-CB 3.44Å; L1042-L1045 PolarHBondContact O-N 2.86Å; K1043-L1045 PolarHBondContact O-N 3.46Å; L1045-E1047 VanDerWaalsContact C-N 3.34Å; L1045-I1048 PolarHBondContact O-N 3.07Å; L1045-Y1049 WeakPolarHBondContact O-CB 3.49Å; L1045-Y1049 PolarHBondContact O-N 3.13Å; L1045-L1073 HydrophobicContact CD1-CD1 4.16Å
1046	Y	39.5	Very low	38.2	Very low	151 Å²	151	79.9 Å²	79.9	59%	0.592	41%	0.409	S	S	*	.	H	α-helix	trans	-64.1	-38.4	174.4	-94	-102.7	0	0	0	111.6	L1042 K1043 Y1049 W1050	L1042-Y1046 WeakPolarHBondContact O-CD2 3.38Å; L1042-Y1046 PolarHBondContact O-N 2.89Å; K1043-Y1046 PolarHBondContact O-N 2.97Å; Y1046-Y1049 PolarHBondContact O-N 3.05Å; Y1046-W1050 AromaticContact CD1-CD1 3.39Å; Y1046-W1050 AromaticContact CD1-NE1 3.5Å; Y1046-W1050 AromaticContact CE1-NE1 3.6Å; Y1046-W1050 WeakPolarHBondContact O-CB 3.37Å; Y1046-W1050 PolarHBondContact O-N 3.05Å
1047	E	44.5	Very low	38.3	Very low	85 Å²	85	75.2 Å²	75.2	40%	0.397	39%	0.389	S	S	.	.	H	α-helix	trans	-66.9	-34.7	175	-75	165.2	-179.5	0	0	112.4	K1043 L1044 L1045 G1051 S1052	K1043-E1047 IonicContact NZ-OE1 2.72Å; K1043-E1047 PolarHBondContact NZ-OE1 2.8Å; K1043-E1047 WeakPolarHBondContact O-CG 3.41Å; K1043-E1047 PolarHBondContact O-N 3.11Å; L1044-E1047 PolarHBondContact O-N 2.86Å; L1045-E1047 VanDerWaalsContact C-N 3.34Å; E1047-G1051 CarbonylContact O-C 3.57Å; E1047-G1051 VanDerWaalsContact O-C 3.22Å; E1047-G1051 WeakPolarHBondContact O-CA 3.48Å; E1047-G1051 PolarHBondContact O-N 2.96Å; E1047-S1052 PolarHBondContact O-N 3.3Å
1048	I	42.6	Very low	38.2	Very low	35 Å²	35	72.6 Å²	72.6	18%	0.179	39%	0.385	C	S	.	.	H	α-helix	trans	-69.5	-43.4	172.9	-69.4	164.3	0	0	0	111.2	F1011 A1014 L1044 L1045 S1052	F1011-I1048 HydrophobicContact CD2-CG2 4.43Å; A1014-I1048 HydrophobicContact CB-CD1 3.49Å; A1014-I1048 VanDerWaalsContact CB-CD1 3.49Å; L1044-I1048 VanDerWaalsContact O-CG1 3.31Å; L1044-I1048 WeakPolarHBondContact O-CG1 3.26Å; L1044-I1048 PolarHBondContact O-N 3.16Å; L1045-I1048 PolarHBondContact O-N 3.07Å; I1048-S1052 PolarHBondContact O-OG 2.85Å
1049	Y	38.2	Very low	38.2	Very low	49 Å²	49	69.1 Å²	69.1	19%	0.192	38%	0.375	C	S	.	.	H	α-helix	trans	-82	-29.6	-173.7	-168.1	-100.8	0	0	0	114.5	L1045 Y1046 L1060 F1069	L1045-Y1049 WeakPolarHBondContact O-CB 3.49Å; L1045-Y1049 PolarHBondContact O-N 3.13Å; Y1046-Y1049 PolarHBondContact O-N 3.05Å; Y1049-L1060 HydrophobicContact CD2-CD1 4.41Å; Y1049-L1060 HydrophobicContact CD2-CD2 4.37Å; Y1049-L1060 HydrophobicContact CE2-CD2 4.16Å; Y1049-L1060 WeakPolarHBondContact O-CD1 3.09Å; Y1049-F1069 AromaticContact CD2-CD1 3.45Å; Y1049-F1069 HydrophobicContact CD2-CD1 3.45Å; Y1049-F1069 VanDerWaalsContact CD2-CD1 3.45Å; Y1049-F1069 AromaticContact CD2-CD2 3.85Å; Y1049-F1069 HydrophobicContact CD2-CD2 3.85Å; Y1049-F1069 AromaticContact CD2-CE1 3.3Å; Y1049-F1069 HydrophobicContact CD2-CE1 3.3Å; Y1049-F1069 AromaticContact CD2-CE2 3.71Å; Y1049-F1069 HydrophobicContact CD2-CE2 3.71Å; Y1049-F1069 AromaticContact CD2-CG 3.72Å; Y1049-F1069 HydrophobicContact CD2-CG 3.72Å; Y1049-F1069 AromaticContact CD2-CZ 3.42Å; Y1049-F1069 HydrophobicContact CD2-CZ 3.42Å; Y1049-F1069 VanDerWaalsContact CD2-CZ 3.42Å; Y1049-F1069 HydrophobicContact CE2-CB 4.01Å; Y1049-F1069 AromaticContact CE2-CD1 3.34Å; Y1049-F1069 HydrophobicContact CE2-CD1 3.34Å; Y1049-F1069 HydrophobicContact CE2-CD2 4.11Å; Y1049-F1069 AromaticContact CE2-CE1 3.71Å; Y1049-F1069 HydrophobicContact CE2-CE1 3.71Å; Y1049-F1069 HydrophobicContact CE2-CE2 4.41Å; Y1049-F1069 AromaticContact CE2-CG 3.56Å; Y1049-F1069 HydrophobicContact CE2-CG 3.56Å; Y1049-F1069 HydrophobicContact CE2-CZ 4.21Å; Y1049-F1069 HydrophobicContact CG-CE1 4.08Å; Y1049-F1069 HydrophobicContact CG-CZ 4.13Å
1050	W	43.7	Very low	38.5	Very low	134 Å²	134	65 Å²	65	51%	0.508	35%	0.353	S	S	.	.	H	α-helix	trans	-116.3	-27.8	-178.9	-61.5	101.3	0	0	0	114.1	Y1046 Q1057	Y1046-W1050 AromaticContact CD1-CD1 3.39Å; Y1046-W1050 AromaticContact CD1-NE1 3.5Å; Y1046-W1050 AromaticContact CE1-NE1 3.6Å; Y1046-W1050 WeakPolarHBondContact O-CB 3.37Å; Y1046-W1050 PolarHBondContact O-N 3.05Å; W1050-Q1057 PolarHBondContact O-NE2 2.71Å; W1050-Q1057 VanDerWaalsContact O-NE2 3.16Å
1051	G	35.7	Very low	38.5	Very low	63 Å²	63	68.5 Å²	68.5	65%	0.649	36%	0.359	S	S	*	.	S	Bend	trans	-96.5	6.9	-175.8	0	0	0	0	0	114.9	E1047	E1047-G1051 CarbonylContact O-C 3.57Å; E1047-G1051 VanDerWaalsContact O-C 3.22Å; E1047-G1051 WeakPolarHBondContact O-CA 3.48Å; E1047-G1051 PolarHBondContact O-N 2.96Å
1052	S	33.3	Very low	38.6	Very low	26 Å²	26	71.6 Å²	71.6	18%	0.182	37%	0.371	C	S	.	.	S	Bend	trans	-83.8	140.9	164.8	53.4	0	0	0	0	110	E1047 I1048 N1056	E1047-S1052 PolarHBondContact O-N 3.3Å; I1048-S1052 PolarHBondContact O-OG 2.85Å; S1052-N1056 WeakPolarHBondContact OG-CB 3.33Å
1053	S	36.1	Very low	38.5	Very low	59 Å²	59	72.3 Å²	72.3	41%	0.413	38%	0.38	S	S	.	.			trans	-55.6	165.5	-164	56.7	0	0	0	0	115.6	V1055 N1056 Q1057	S1053-V1055 PolarHBondContact O-N 3.11Å; S1053-N1056 PolarHBondContact N-ND2 3.11Å; S1053-N1056 VanDerWaalsContact N-ND2 3.18Å; S1053-N1056 WeakPolarHBondContact O-CA 3.42Å; S1053-N1056 VanDerWaalsContact O-CB 3.27Å; S1053-N1056 WeakPolarHBondContact O-CB 3.16Å; S1053-N1056 PolarHBondContact O-N 3.43Å; S1053-N1056 PolarHBondContact O-ND2 3.03Å; S1053-N1056 PolarHBondContact OG-ND2 3.47Å; S1053-Q1057 PolarHBondContact O-N 3.17Å
1054	D	33	Very low	38.4	Very low	114 Å²	114	72.1 Å²	72.1	61%	0.61	38%	0.381	S	S	*	.	H	α-helix	trans	-46.7	-35.8	-171.4	-64.7	-37.9	0	0	0	115.9	N1056 Q1057 G1058	D1054-N1056 VanDerWaalsContact C-N 3.31Å; D1054-N1056 PolarHBondContact O-N 3.13Å; D1054-Q1057 PolarHBondContact O-N 3.05Å; D1054-G1058 PolarHBondContact O-N 3.43Å
1055	V	35.1	Very low	38.2	Very low	63 Å²	63	69.8 Å²	69.8	38%	0.382	37%	0.37	S	S	.	.	H	α-helix	trans	-60.6	-40.8	174	175.7	0	0	0	0	111.8	P31 S1053 G1058 I1059	P31-V1055 HydrophobicContact CB-CB 4.39Å; P31-V1055 HydrophobicContact CB-CG2 3.58Å; P31-V1055 HydrophobicContact CG-CG2 4.12Å; S1053-V1055 PolarHBondContact O-N 3.11Å; V1055-G1058 PolarHBondContact O-N 3.06Å; V1055-I1059 HydrophobicContact CG1-CD1 4.2Å; V1055-I1059 WeakPolarHBondContact O-CG1 3.46Å; V1055-I1059 PolarHBondContact O-N 2.76Å
1056	N	36.2	Very low	38.3	Very low	19 Å²	19	69.3 Å²	69.3	10%	0.102	37%	0.37	C	S	.	.	H	α-helix	trans	-72.4	-34.9	176.2	-48.7	-66	0	0	0	111.4	I1007 S1052 S1053 D1054 G1058 I1059 L1060	I1007-N1056 HydrophobicContact CD1-CB 4.25Å; I1007-N1056 WeakPolarHBondContact CD1-OD1 3.3Å; S1052-N1056 WeakPolarHBondContact OG-CB 3.33Å; S1053-N1056 PolarHBondContact N-ND2 3.11Å; S1053-N1056 VanDerWaalsContact N-ND2 3.18Å; S1053-N1056 WeakPolarHBondContact O-CA 3.42Å; S1053-N1056 VanDerWaalsContact O-CB 3.27Å; S1053-N1056 WeakPolarHBondContact O-CB 3.16Å; S1053-N1056 PolarHBondContact O-N 3.43Å; S1053-N1056 PolarHBondContact O-ND2 3.03Å; S1053-N1056 PolarHBondContact OG-ND2 3.47Å; D1054-N1056 VanDerWaalsContact C-N 3.31Å; D1054-N1056 PolarHBondContact O-N 3.13Å; N1056-G1058 VanDerWaalsContact C-N 3.31Å; N1056-G1058 PolarHBondContact O-N 3.36Å; N1056-I1059 PolarHBondContact O-N 3.26Å; N1056-L1060 VanDerWaalsContact O-CB 3.29Å; N1056-L1060 WeakPolarHBondContact O-CB 3.45Å; N1056-L1060 VanDerWaalsContact O-CG 3.29Å; N1056-L1060 WeakPolarHBondContact O-CG 3.13Å; N1056-L1060 PolarHBondContact O-N 2.69Å
1057	Q	38.9	Very low	38.6	Very low	59 Å²	59	65.1 Å²	65.1	28%	0.276	36%	0.357	S	S	.	.	H	α-helix	trans	-63.3	-37.6	168.8	-70.2	-156.8	10.9	0	0	111.8	W1050 S1053 D1054 K1061	W1050-Q1057 PolarHBondContact O-NE2 2.71Å; W1050-Q1057 VanDerWaalsContact O-NE2 3.16Å; S1053-Q1057 PolarHBondContact O-N 3.17Å; D1054-Q1057 PolarHBondContact O-N 3.05Å; Q1057-K1061 VanDerWaalsContact O-CB 3.25Å; Q1057-K1061 WeakPolarHBondContact O-CB 3.39Å; Q1057-K1061 WeakPolarHBondContact O-CD 3.33Å; Q1057-K1061 WeakPolarHBondContact O-CG 3.31Å; Q1057-K1061 PolarHBondContact O-N 3.26Å
1058	G	33.3	Very low	38.7	Very low	42 Å²	42	65.7 Å²	65.7	43%	0.433	36%	0.361	S	S	.	.	H	α-helix	trans	-60.1	-45.7	172.6	0	0	0	0	0	112.5	D1054 V1055 N1056	D1054-G1058 PolarHBondContact O-N 3.43Å; V1055-G1058 PolarHBondContact O-N 3.06Å; N1056-G1058 VanDerWaalsContact C-N 3.31Å; N1056-G1058 PolarHBondContact O-N 3.36Å
1059	I	33.9	Very low	39	Very low	35 Å²	35	65.2 Å²	65.2	18%	0.179	36%	0.358	C	S	.	.	H	α-helix	trans	-66.8	-45.9	177.2	-65.9	164.3	0	0	0	111.2	V1055 N1056 K1061 Q1062 C1065	V1055-I1059 HydrophobicContact CG1-CD1 4.2Å; V1055-I1059 WeakPolarHBondContact O-CG1 3.46Å; V1055-I1059 PolarHBondContact O-N 2.76Å; N1056-I1059 PolarHBondContact O-N 3.26Å; I1059-K1061 VanDerWaalsContact C-N 3.34Å; I1059-K1061 PolarHBondContact O-N 2.92Å; I1059-Q1062 WeakPolarHBondContact O-CB 3.34Å; I1059-Q1062 PolarHBondContact O-N 3.47Å; I1059-Q1062 VanDerWaalsContact O-N 3.12Å; I1059-C1065 HydrophobicContact CG2-CB 4.45Å; I1059-C1065 WeakPolarHBondContact O-CB 3.28Å; I1059-C1065 PolarHBondContact O-SG 3.11Å
1060	L	39.7	Very low	39.6	Very low	28 Å²	28	67.8 Å²	67.8	15%	0.147	37%	0.37	C	S	.	.	H	α-helix	trans	-71.8	-23.6	-178.5	-70.5	168.7	0	0	0	113.6	Y1049 N1056 Q1062	Y1049-L1060 HydrophobicContact CD2-CD1 4.41Å; Y1049-L1060 HydrophobicContact CD2-CD2 4.37Å; Y1049-L1060 HydrophobicContact CE2-CD2 4.16Å; Y1049-L1060 WeakPolarHBondContact O-CD1 3.09Å; N1056-L1060 VanDerWaalsContact O-CB 3.29Å; N1056-L1060 WeakPolarHBondContact O-CB 3.45Å; N1056-L1060 VanDerWaalsContact O-CG 3.29Å; N1056-L1060 WeakPolarHBondContact O-CG 3.13Å; N1056-L1060 PolarHBondContact O-N 2.69Å; L1060-Q1062 PolarHBondContact O-N 2.87Å
1061	K	40.8	Very low	39.9	Very low	152 Å²	152	65.7 Å²	65.7	66%	0.661	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-16.5	169.5	-78.3	167.7	-173.7	169.1	0	113.1	Q1057 I1059	Q1057-K1061 VanDerWaalsContact O-CB 3.25Å; Q1057-K1061 WeakPolarHBondContact O-CB 3.39Å; Q1057-K1061 WeakPolarHBondContact O-CD 3.33Å; Q1057-K1061 WeakPolarHBondContact O-CG 3.31Å; Q1057-K1061 PolarHBondContact O-N 3.26Å; I1059-K1061 VanDerWaalsContact C-N 3.34Å; I1059-K1061 PolarHBondContact O-N 2.92Å
1062	Q	38.5	Very low	40.6	Very low	82 Å²	82	65.1 Å²	65.1	38%	0.383	35%	0.346	S	S	.	.	S	Bend	trans	-69.5	126	172.3	-60.9	-169.2	-30.1	0	0	109.8	I1059 L1060 H1064 C1065 G1066	I1059-Q1062 WeakPolarHBondContact O-CB 3.34Å; I1059-Q1062 PolarHBondContact O-N 3.47Å; I1059-Q1062 VanDerWaalsContact O-N 3.12Å; L1060-Q1062 PolarHBondContact O-N 2.87Å; Q1062-H1064 VanDerWaalsContact C-N 3.26Å; Q1062-H1064 WeakPolarHBondContact CB-NE2 3.37Å; Q1062-H1064 PolarHBondContact O-N 3.46Å; Q1062-H1064 VanDerWaalsContact O-N 3.1Å; Q1062-H1064 PolarHBondContact OE1-CE1 3.29Å; Q1062-H1064 PolarHBondContact OE1-NE2 3.49Å; Q1062-C1065 HydrophobicContact CB-CB 4.49Å; Q1062-C1065 PolarHBondContact O-N 3.34Å; Q1062-G1066 PolarHBondContact O-N 3.4Å
1063	P	36.6	Very low	41.4	Very low	106 Å²	106	66.1 Å²	66.1	69%	0.688	35%	0.349	S	S	*	.	H	α-helix	trans	-54.8	-37.6	-170	-30.4	35.9	0	0	0	114.5	L1067	P1063-L1067 WeakPolarHBondContact O-CB 3.33Å; P1063-L1067 PolarHBondContact O-N 3.09Å
1064	H	41.3	Very low	41.9	Very low	128 Å²	128	67.5 Å²	67.5	59%	0.593	35%	0.351	S	S	*	.	H	α-helix	trans	-65.6	-36.4	177.1	45.7	-91.8	0	0	0	113.5	Q1062 L1067 M1068	Q1062-H1064 VanDerWaalsContact C-N 3.26Å; Q1062-H1064 WeakPolarHBondContact CB-NE2 3.37Å; Q1062-H1064 PolarHBondContact O-N 3.46Å; Q1062-H1064 VanDerWaalsContact O-N 3.1Å; Q1062-H1064 PolarHBondContact OE1-CE1 3.29Å; Q1062-H1064 PolarHBondContact OE1-NE2 3.49Å; H1064-L1067 PolarHBondContact O-N 3.34Å; H1064-M1068 WeakPolarHBondContact O-CG 3.33Å; H1064-M1068 PolarHBondContact O-N 3.4Å
1065	C	40.3	Very low	42.7	Very low	15 Å²	15	67.2 Å²	67.2	10%	0.101	35%	0.348	C	S	.	.	H	α-helix	trans	-69.6	-43.7	177.6	-70.1	0	0	0	0	111.7	I1059 Q1062 L1067 M1068 F1069	I1059-C1065 HydrophobicContact CG2-CB 4.45Å; I1059-C1065 WeakPolarHBondContact O-CB 3.28Å; I1059-C1065 PolarHBondContact O-SG 3.11Å; Q1062-C1065 HydrophobicContact CB-CB 4.49Å; Q1062-C1065 PolarHBondContact O-N 3.34Å; C1065-L1067 VanDerWaalsContact C-N 3.31Å; C1065-L1067 PolarHBondContact O-N 2.82Å; C1065-M1068 PolarHBondContact O-N 2.94Å; C1065-F1069 WeakPolarHBondContact O-CB 3.34Å; C1065-F1069 PolarHBondContact O-N 2.88Å
1066	G	43.7	Very low	43.3	Very low	10 Å²	10	66.2 Å²	66.2	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-38	172.7	0	0	0	0	0	112.8	Q1062 K1070	Q1062-G1066 PolarHBondContact O-N 3.4Å; G1066-K1070 WeakPolarHBondContact O-CB 3.5Å; G1066-K1070 VanDerWaalsContact O-CG 3.31Å; G1066-K1070 WeakPolarHBondContact O-CG 3.25Å; G1066-K1070 PolarHBondContact O-N 3.48Å
1067	L	46.2	Very low	43.7	Very low	63 Å²	63	67.6 Å²	67.6	33%	0.33	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-46.6	174.7	-118.8	162.8	0	0	0	112.3	P1063 H1064 C1065 F1069 K1070 Q1071 I1110	P1063-L1067 WeakPolarHBondContact O-CB 3.33Å; P1063-L1067 PolarHBondContact O-N 3.09Å; H1064-L1067 PolarHBondContact O-N 3.34Å; C1065-L1067 VanDerWaalsContact C-N 3.31Å; C1065-L1067 PolarHBondContact O-N 2.82Å; L1067-F1069 VanDerWaalsContact C-N 3.33Å; L1067-F1069 PolarHBondContact O-N 2.8Å; L1067-K1070 PolarHBondContact O-N 2.89Å; L1067-Q1071 HydrophobicContact CD2-CG 4.3Å; L1067-Q1071 WeakPolarHBondContact O-CB 3.32Å; L1067-Q1071 WeakPolarHBondContact O-CG 3.32Å; L1067-Q1071 PolarHBondContact O-N 2.92Å; L1067-I1110 HydrophobicContact CD1-CD1 4.48Å
1068	M	46	Very low	43.8	Very low	97 Å²	97	66.5 Å²	66.5	48%	0.478	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-40.4	175.8	-77.2	-156.4	-64.6	0	0	112.2	H1064 C1065 Q1071 K1072	H1064-M1068 WeakPolarHBondContact O-CG 3.33Å; H1064-M1068 PolarHBondContact O-N 3.4Å; C1065-M1068 PolarHBondContact O-N 2.94Å; M1068-Q1071 PolarHBondContact O-N 3.33Å; M1068-K1072 WeakPolarHBondContact O-CB 3.46Å; M1068-K1072 PolarHBondContact O-N 3.38Å
1069	F	48.6	Very low	44.2	Very low	25 Å²	25	70 Å²	70	11%	0.11	35%	0.354	C	S	.	.	H	α-helix	trans	-64.3	-47.1	176.3	-170.7	-83.1	0	0	0	111.4	F1011 Y1049 C1065 L1067 Q1071 K1072 L1073	F1011-F1069 AromaticContact CD2-CE2 3.48Å; F1011-F1069 HydrophobicContact CD2-CE2 3.48Å; F1011-F1069 VanDerWaalsContact CD2-CE2 3.48Å; F1011-F1069 AromaticContact CD2-CZ 3.63Å; F1011-F1069 HydrophobicContact CD2-CZ 3.63Å; F1011-F1069 HydrophobicContact CE2-CD2 4.31Å; F1011-F1069 AromaticContact CE2-CE1 3.89Å; F1011-F1069 HydrophobicContact CE2-CE1 3.89Å; F1011-F1069 AromaticContact CE2-CE2 3.38Å; F1011-F1069 HydrophobicContact CE2-CE2 3.38Å; F1011-F1069 AromaticContact CE2-CZ 3.14Å; F1011-F1069 HydrophobicContact CE2-CZ 3.14Å; F1011-F1069 HydrophobicContact CG-CE2 4.1Å; F1011-F1069 HydrophobicContact CZ-CD2 4.44Å; F1011-F1069 HydrophobicContact CZ-CE1 4.22Å; F1011-F1069 AromaticContact CZ-CE2 3.92Å; F1011-F1069 HydrophobicContact CZ-CE2 3.92Å; F1011-F1069 AromaticContact CZ-CZ 3.81Å; F1011-F1069 HydrophobicContact CZ-CZ 3.81Å; Y1049-F1069 AromaticContact CD2-CD1 3.45Å; Y1049-F1069 HydrophobicContact CD2-CD1 3.45Å; Y1049-F1069 VanDerWaalsContact CD2-CD1 3.45Å; Y1049-F1069 AromaticContact CD2-CD2 3.85Å; Y1049-F1069 HydrophobicContact CD2-CD2 3.85Å; Y1049-F1069 AromaticContact CD2-CE1 3.3Å; Y1049-F1069 HydrophobicContact CD2-CE1 3.3Å; Y1049-F1069 AromaticContact CD2-CE2 3.71Å; Y1049-F1069 HydrophobicContact CD2-CE2 3.71Å; Y1049-F1069 AromaticContact CD2-CG 3.72Å; Y1049-F1069 HydrophobicContact CD2-CG 3.72Å; Y1049-F1069 AromaticContact CD2-CZ 3.42Å; Y1049-F1069 HydrophobicContact CD2-CZ 3.42Å; Y1049-F1069 VanDerWaalsContact CD2-CZ 3.42Å; Y1049-F1069 HydrophobicContact CE2-CB 4.01Å; Y1049-F1069 AromaticContact CE2-CD1 3.34Å; Y1049-F1069 HydrophobicContact CE2-CD1 3.34Å; Y1049-F1069 HydrophobicContact CE2-CD2 4.11Å; Y1049-F1069 AromaticContact CE2-CE1 3.71Å; Y1049-F1069 HydrophobicContact CE2-CE1 3.71Å; Y1049-F1069 HydrophobicContact CE2-CE2 4.41Å; Y1049-F1069 AromaticContact CE2-CG 3.56Å; Y1049-F1069 HydrophobicContact CE2-CG 3.56Å; Y1049-F1069 HydrophobicContact CE2-CZ 4.21Å; Y1049-F1069 HydrophobicContact CG-CE1 4.08Å; Y1049-F1069 HydrophobicContact CG-CZ 4.13Å; C1065-F1069 WeakPolarHBondContact O-CB 3.34Å; C1065-F1069 PolarHBondContact O-N 2.88Å; L1067-F1069 VanDerWaalsContact C-N 3.33Å; L1067-F1069 PolarHBondContact O-N 2.8Å; F1069-Q1071 VanDerWaalsContact C-N 3.33Å; F1069-Q1071 PolarHBondContact O-N 3.08Å; F1069-K1072 PolarHBondContact O-N 3.1Å; F1069-L1073 VanDerWaalsContact O-CB 3.3Å; F1069-L1073 WeakPolarHBondContact O-CB 3.19Å; F1069-L1073 PolarHBondContact O-N 3.07Å
1070	K	50.5	Low	44.5	Very low	104 Å²	104	69.1 Å²	69.1	45%	0.452	35%	0.35	S	S	.	.	H	α-helix	trans	-57.9	-44	174.4	-74.8	174.3	-179.8	179.2	0	111.5	G1066 L1067 L1074	G1066-K1070 WeakPolarHBondContact O-CB 3.5Å; G1066-K1070 VanDerWaalsContact O-CG 3.31Å; G1066-K1070 WeakPolarHBondContact O-CG 3.25Å; G1066-K1070 PolarHBondContact O-N 3.48Å; L1067-K1070 PolarHBondContact O-N 2.89Å; K1070-L1074 WeakPolarHBondContact O-CB 3.31Å; K1070-L1074 PolarHBondContact O-N 3.41Å
1071	Q	49.5	Very low	44.3	Very low	90 Å²	90	73 Å²	73	42%	0.421	37%	0.371	S	S	.	.	H	α-helix	trans	-64.6	-44.6	176.9	-75.7	176.1	-8.7	0	0	112.9	L1067 M1068 F1069 L1074 M1075	L1067-Q1071 HydrophobicContact CD2-CG 4.3Å; L1067-Q1071 WeakPolarHBondContact O-CB 3.32Å; L1067-Q1071 WeakPolarHBondContact O-CG 3.32Å; L1067-Q1071 PolarHBondContact O-N 2.92Å; M1068-Q1071 PolarHBondContact O-N 3.33Å; F1069-Q1071 VanDerWaalsContact C-N 3.33Å; F1069-Q1071 PolarHBondContact O-N 3.08Å; Q1071-L1074 WeakPolarHBondContact O-CB 3.43Å; Q1071-L1074 PolarHBondContact O-N 3.33Å; Q1071-M1075 PolarHBondContact O-N 3.24Å
1072	K	51.2	Low	43.9	Very low	51 Å²	51	69.8 Å²	69.8	22%	0.222	37%	0.367	C	S	.	.	H	α-helix	trans	-68.4	-40.3	179.9	-161.2	176.6	-171.9	-172	0	111.7	L1008 F1011 D1012 M1068 F1069 L1074 M1075 E1076	L1008-K1072 HydrophobicContact CD2-CD 4.04Å; F1011-K1072 HydrophobicContact CD1-CD 4.44Å; F1011-K1072 HydrophobicContact CE1-CB 4.42Å; F1011-K1072 HydrophobicContact CE1-CD 4.3Å; F1011-K1072 HydrophobicContact CE1-CG 4.32Å; D1012-K1072 WeakPolarHBondContact OD1-CE 3.17Å; D1012-K1072 IonicContact OD1-NZ 2.65Å; D1012-K1072 PolarHBondContact OD1-NZ 3.49Å; D1012-K1072 IonicContact OD2-NZ 2.64Å; D1012-K1072 PolarHBondContact OD2-NZ 3.49Å; M1068-K1072 WeakPolarHBondContact O-CB 3.46Å; M1068-K1072 PolarHBondContact O-N 3.38Å; F1069-K1072 PolarHBondContact O-N 3.1Å; K1072-L1074 VanDerWaalsContact C-N 3.32Å; K1072-L1074 PolarHBondContact O-N 2.88Å; K1072-M1075 PolarHBondContact O-N 3.02Å; K1072-E1076 WeakPolarHBondContact O-CB 3.34Å; K1072-E1076 PolarHBondContact O-N 2.95Å
1073	L	50.4	Low	43.5	Very low	46 Å²	46	70.3 Å²	70.3	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-58.7	-42.6	170.9	-171.8	74.4	0	0	0	111.5	F1011 L1045 F1069 L1077	F1011-L1073 HydrophobicContact CE2-CD1 4.25Å; F1011-L1073 HydrophobicContact CZ-CB 4.22Å; F1011-L1073 HydrophobicContact CZ-CD1 3.9Å; L1045-L1073 HydrophobicContact CD1-CD1 4.16Å; F1069-L1073 VanDerWaalsContact O-CB 3.3Å; F1069-L1073 WeakPolarHBondContact O-CB 3.19Å; F1069-L1073 PolarHBondContact O-N 3.07Å; L1073-L1077 HydrophobicContact CD1-CD1 4.5Å; L1073-L1077 HydrophobicContact CG-CD1 4.01Å; L1073-L1077 WeakPolarHBondContact O-CB 3.45Å; L1073-L1077 VanDerWaalsContact O-CG 3.25Å; L1073-L1077 WeakPolarHBondContact O-CG 3.33Å; L1073-L1077 PolarHBondContact O-N 2.92Å
1074	L	47.4	Very low	43.1	Very low	88 Å²	88	74.8 Å²	74.8	46%	0.461	38%	0.38	S	S	.	.	H	α-helix	trans	-63.7	-43.2	175.3	-101.6	151.6	0	0	0	112.8	K1070 Q1071 K1072 S1078	K1070-L1074 WeakPolarHBondContact O-CB 3.31Å; K1070-L1074 PolarHBondContact O-N 3.41Å; Q1071-L1074 WeakPolarHBondContact O-CB 3.43Å; Q1071-L1074 PolarHBondContact O-N 3.33Å; K1072-L1074 VanDerWaalsContact C-N 3.32Å; K1072-L1074 PolarHBondContact O-N 2.88Å; L1074-S1078 WeakPolarHBondContact O-CB 3.48Å; L1074-S1078 PolarHBondContact O-N 3.48Å
1075	M	48.4	Very low	42.4	Very low	109 Å²	109	79.9 Å²	79.9	54%	0.537	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-47.9	174.8	-75.9	-165.8	-67.1	0	0	111.9	Q1071 K1072 L1077 S1078 N1079	Q1071-M1075 PolarHBondContact O-N 3.24Å; K1072-M1075 PolarHBondContact O-N 3.02Å; M1075-L1077 PolarHBondContact O-N 2.87Å; M1075-S1078 PolarHBondContact O-N 3.34Å; M1075-N1079 VanDerWaalsContact O-CB 3.29Å; M1075-N1079 WeakPolarHBondContact O-CB 3.49Å; M1075-N1079 PolarHBondContact O-N 3.22Å; M1075-N1079 PolarHBondContact O-ND2 3.42Å
1076	E	48.2	Very low	41.9	Very low	41 Å²	41	88.8 Å²	88.8	19%	0.192	43%	0.431	C	S	.	.	H	α-helix	trans	-59.9	-45	178.2	-86.4	-82.8	154.9	0	0	112.5	L1015 I1020 K1072 S1080	L1015-E1076 HydrophobicContact CD1-CB 3.74Å; L1015-E1076 HydrophobicContact CD1-CG 3.44Å; L1015-E1076 VanDerWaalsContact CD1-CG 3.44Å; I1020-E1076 WeakPolarHBondContact CD1-OE2 3.26Å; K1072-E1076 WeakPolarHBondContact O-CB 3.34Å; K1072-E1076 PolarHBondContact O-N 2.95Å; E1076-S1080 VanDerWaalsContact O-CB 3.24Å; E1076-S1080 WeakPolarHBondContact O-CB 3.35Å; E1076-S1080 PolarHBondContact O-N 2.72Å; E1076-S1080 PolarHBondContact O-OG 3.24Å
1077	L	44.8	Very low	41.1	Very low	48 Å²	48	96.7 Å²	96.7	25%	0.251	47%	0.465	S	S	.	.	H	α-helix	trans	-66.4	-42.8	174.5	-71.5	171.5	0	0	0	111.8	Y1023 L1073 M1075 S1080 L1081	Y1023-L1077 HydrophobicContact CE2-CD2 4.06Å; L1073-L1077 HydrophobicContact CD1-CD1 4.5Å; L1073-L1077 HydrophobicContact CG-CD1 4.01Å; L1073-L1077 WeakPolarHBondContact O-CB 3.45Å; L1073-L1077 VanDerWaalsContact O-CG 3.25Å; L1073-L1077 WeakPolarHBondContact O-CG 3.33Å; L1073-L1077 PolarHBondContact O-N 2.92Å; M1075-L1077 PolarHBondContact O-N 2.87Å; L1077-S1080 PolarHBondContact O-N 2.9Å; L1077-L1081 VanDerWaalsContact O-CB 3.26Å; L1077-L1081 WeakPolarHBondContact O-CB 3.49Å; L1077-L1081 WeakPolarHBondContact O-CD1 3.29Å; L1077-L1081 WeakPolarHBondContact O-CG 3.27Å; L1077-L1081 PolarHBondContact O-N 3.26Å
1078	S	41.8	Very low	40.5	Very low	36 Å²	36	98.3 Å²	98.3	25%	0.252	48%	0.48	S	S	.	.	H	α-helix	trans	-63.1	-43.1	177.5	-174.1	0	0	0	0	112.1	L1074 M1075 L1081 S1082	L1074-S1078 WeakPolarHBondContact O-CB 3.48Å; L1074-S1078 PolarHBondContact O-N 3.48Å; M1075-S1078 PolarHBondContact O-N 3.34Å; S1078-L1081 PolarHBondContact O-N 3.14Å; S1078-S1082 WeakPolarHBondContact O-CB 3.37Å; S1078-S1082 PolarHBondContact O-N 2.71Å; S1078-S1082 PolarHBondContact O-OG 3.23Å
1079	N	41.6	Very low	39.8	Very low	117 Å²	117	103.5 Å²	103.5	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-66	-39	175.7	-69.6	-20.2	0	0	0	111.4	M1075	M1075-N1079 VanDerWaalsContact O-CB 3.29Å; M1075-N1079 WeakPolarHBondContact O-CB 3.49Å; M1075-N1079 PolarHBondContact O-N 3.22Å; M1075-N1079 PolarHBondContact O-ND2 3.42Å
1080	S	40.4	Very low	39.2	Very low	16 Å²	16	109.7 Å²	109.7	11%	0.112	53%	0.534	C	S	.	.	H	α-helix	trans	-69.4	-32.6	175.2	-62.4	0	0	0	0	113.4	E1076 L1077 I1083	E1076-S1080 VanDerWaalsContact O-CB 3.24Å; E1076-S1080 WeakPolarHBondContact O-CB 3.35Å; E1076-S1080 PolarHBondContact O-N 2.72Å; E1076-S1080 PolarHBondContact O-OG 3.24Å; L1077-S1080 PolarHBondContact O-N 2.9Å; S1080-I1083 WeakPolarHBondContact O-CG1 3.4Å
1081	L	34	Very low	38.4	Very low	110 Å²	110	112.7 Å²	112.7	58%	0.576	55%	0.55	S	S	*	.	H	α-helix	trans	-83.5	-14	179.1	-73.1	167.9	0	0	0	113.5	Y1023 L1077 S1078 I1083	Y1023-L1081 HydrophobicContact CD1-CD2 4.16Å; Y1023-L1081 HydrophobicContact CE1-CD2 3.74Å; L1077-L1081 VanDerWaalsContact O-CB 3.26Å; L1077-L1081 WeakPolarHBondContact O-CB 3.49Å; L1077-L1081 WeakPolarHBondContact O-CD1 3.29Å; L1077-L1081 WeakPolarHBondContact O-CG 3.27Å; L1077-L1081 PolarHBondContact O-N 3.26Å; S1078-L1081 PolarHBondContact O-N 3.14Å; L1081-I1083 PolarHBondContact O-N 3.47Å
1082	S	32.8	Very low	37.5	Very low	84 Å²	84	117.9 Å²	117.9	59%	0.587	57%	0.571	S	S	*	*			trans	-72.3	31.6	179.3	-66.7	0	0	0	0	114.2	S1078 K1084	S1078-S1082 WeakPolarHBondContact O-CB 3.37Å; S1078-S1082 PolarHBondContact O-N 2.71Å; S1078-S1082 PolarHBondContact O-OG 3.23Å; S1082-K1084 PolarHBondContact O-N 2.94Å
1083	I	30.7	Very low	36.3	Very low	92 Å²	92	121 Å²	121	47%	0.472	60%	0.596	S	S	.	*			trans	-70.7	118.7	177	-65.1	169.5	0	0	0	109	Y1023 S1080 L1081 R1085	Y1023-I1083 WeakPolarHBondContact O-CD1 3.3Å; S1080-I1083 WeakPolarHBondContact O-CG1 3.4Å; L1081-I1083 PolarHBondContact O-N 3.47Å; I1083-R1085 PolarHBondContact O-N 3.27Å
1084	K	27.9	Very low	35.2	Very low	201 Å²	201	123.8 Å²	123.8	87%	0.874	62%	0.62	S	S	*	*			trans	-59	87.9	177.9	-65.3	179.8	179.4	179.1	0	111.8	S1082 K1086	S1082-K1084 PolarHBondContact O-N 2.94Å; K1084-K1086 PolarHBondContact O-N 3.01Å
1085	R	26.6	Very low	34.1	Very low	234 Å²	234	126.5 Å²	126.5	88%	0.883	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-64.2	118.2	166.9	-74.5	-172.3	175	-173.5	-0.1	109.1	I1083 Q1087	I1083-R1085 PolarHBondContact O-N 3.27Å; R1085-Q1087 PolarHBondContact O-N 3.3Å
1086	K	29.8	Very low	33	Very low	202 Å²	202	128.4 Å²	128.4	88%	0.878	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-59.9	125.2	165.8	-65.4	-179.8	-179.9	179	0	107.8	K1084	K1084-K1086 PolarHBondContact O-N 3.01Å
1087	Q	27.6	Very low	31.9	Very low	176 Å²	176	131.3 Å²	131.3	82%	0.822	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-65.9	134.6	176.3	-75.8	-177.6	-23.5	0	0	110.6	R1085	R1085-Q1087 PolarHBondContact O-N 3.3Å
1088	P	31.7	Very low	30.8	Very low	98 Å²	98	136.2 Å²	136.2	64%	0.636	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-67.9	138.6	163.2	30.6	-32.8	0	0	0	109.1	N1090	P1088-N1090 VanDerWaalsContact C-N 3.32Å; P1088-N1090 PolarHBondContact O-N 3.2Å; P1088-N1090 VanDerWaalsContact O-N 3.16Å
1089	K	32	Very low	30	Very low	205 Å²	205	139 Å²	139	89%	0.891	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-11	-161.5	-87.6	-171.8	170	-173.4	0	117.4
1090	N	36.7	Very low	29.2	Very low	156 Å²	156	138.1 Å²	138.1	83%	0.834	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.6	7	-157.8	-77	8.6	0	0	0	117	P1088	P1088-N1090 VanDerWaalsContact C-N 3.32Å; P1088-N1090 PolarHBondContact O-N 3.2Å; P1088-N1090 VanDerWaalsContact O-N 3.16Å
1091	E	32.5	Very low	28.4	Very low	167 Å²	167	142.5 Å²	142.5	78%	0.78	73%	0.729	S	S	*	*			trans	-114.5	135.8	-178.8	-67.3	-174.4	142.8	0	0	112.5
1092	K	30.5	Very low	27.9	Very low	199 Å²	199	142.1 Å²	142.1	87%	0.865	73%	0.727	S	S	*	*			trans	-66.3	139.6	177.8	-74.1	-177.6	176.8	178.8	0	110.1	S1094	K1092-S1094 PolarHBondContact O-N 3.46Å
1093	P	27.4	Very low	27.5	Very low	116 Å²	116	144.4 Å²	144.4	75%	0.753	74%	0.738	S	S	*	*			trans	-69.7	106.5	-176.7	28.1	-34.5	0	0	0	111.3	T1095	P1093-T1095 PolarHBondContact O-N 3.39Å
1094	S	26.8	Very low	27.3	Very low	104 Å²	104	148.2 Å²	148.2	73%	0.727	75%	0.751	S	S	*	*			trans	-72.6	116.4	163.7	49.7	0	0	0	0	109.1	K1092 L1096	K1092-S1094 PolarHBondContact O-N 3.46Å; S1094-L1096 VanDerWaalsContact C-N 3.3Å; S1094-L1096 PolarHBondContact O-N 2.89Å
1095	T	25.2	Very low	27	Very low	146 Å²	146	146.7 Å²	146.7	90%	0.896	75%	0.753	S	S	*	*			trans	-73.3	78.1	-177	23.8	0	0	0	0	112.2	P1093	P1093-T1095 PolarHBondContact O-N 3.39Å
1096	L	25.1	Very low	26.9	Very low	148 Å²	148	140.2 Å²	140.2	78%	0.775	74%	0.738	S	S	*	*			trans	-69.3	142.5	153.9	-78.9	165	0	0	0	109.2	S1094 M1098	S1094-L1096 VanDerWaalsContact C-N 3.3Å; S1094-L1096 PolarHBondContact O-N 2.89Å; L1096-M1098 PolarHBondContact O-N 3.32Å
1097	P	24.4	Very low	26.6	Very low	103 Å²	103	135.4 Å²	135.4	67%	0.669	73%	0.731	S	S	*	*			trans	-65.1	124.1	-173.9	25.5	-33.7	0	0	0	111.2	V1099	P1097-V1099 PolarHBondContact O-N 3.26Å; P1097-V1099 VanDerWaalsContact O-N 3.08Å
1098	M	22.6	Very low	26.4	Very low	150 Å²	150	133.7 Å²	133.7	74%	0.739	72%	0.717	S	S	*	*			trans	-61.4	111	161.7	-82.1	170.1	50.9	0	0	108.3	L1096 N1100	L1096-M1098 PolarHBondContact O-N 3.32Å; M1098-N1100 HydrophobicContact CB-CB 4.41Å; M1098-N1100 WeakPolarHBondContact CE-OD1 3.48Å; M1098-N1100 PolarHBondContact O-N 3.16Å
1099	V	24.1	Very low	26	Very low	95 Å²	95	137 Å²	137	58%	0.576	72%	0.724	S	S	*	*			trans	-68.2	83.7	162.4	174.3	0	0	0	0	106.8	P1097 I1101	P1097-V1099 PolarHBondContact O-N 3.26Å; P1097-V1099 VanDerWaalsContact O-N 3.08Å; V1099-I1101 HydrophobicContact CG1-CD1 3.85Å; V1099-I1101 HydrophobicContact CG1-CG1 3.91Å; V1099-I1101 PolarHBondContact O-N 2.78Å
1100	N	23.8	Very low	25.7	Very low	99 Å²	99	132.7 Å²	132.7	53%	0.529	71%	0.71	S	S	.	*			trans	-83.5	68.6	-165.9	-148.8	10.9	0	0	0	109.5	M1098 L1102	M1098-N1100 HydrophobicContact CB-CB 4.41Å; M1098-N1100 WeakPolarHBondContact CE-OD1 3.48Å; M1098-N1100 PolarHBondContact O-N 3.16Å; N1100-L1102 WeakPolarHBondContact ND2-CD1 3.28Å; N1100-L1102 PolarHBondContact O-N 3.21Å; N1100-L1102 WeakPolarHBondContact OD1-CG 3.31Å
1101	I	24.1	Very low	25.1	Very low	108 Å²	108	129 Å²	129	55%	0.554	70%	0.697	S	S	*	*			trans	-73.9	60.1	170.4	-56.2	169.4	0	0	0	108.1	V1099 T1103	V1099-I1101 HydrophobicContact CG1-CD1 3.85Å; V1099-I1101 HydrophobicContact CG1-CG1 3.91Å; V1099-I1101 PolarHBondContact O-N 2.78Å; I1101-T1103 PolarHBondContact O-N 3.48Å; I1101-T1103 VanDerWaalsContact O-N 3.14Å
1102	L	23.8	Very low	24.8	Very low	102 Å²	102	128.1 Å²	128.1	53%	0.534	70%	0.703	S	S	.	*			trans	-66.8	103.6	164.9	-87.7	165.5	0	0	0	107.4	N1100 K1104	N1100-L1102 WeakPolarHBondContact ND2-CD1 3.28Å; N1100-L1102 PolarHBondContact O-N 3.21Å; N1100-L1102 WeakPolarHBondContact OD1-CG 3.31Å; L1102-K1104 PolarHBondContact O-N 3.19Å
1103	T	25.3	Very low	24.6	Very low	131 Å²	131	122.4 Å²	122.4	80%	0.804	69%	0.688	S	S	*	*				26.7	35.6	124.5	54.9	0	0	0	0	119.1	I1101	I1101-T1103 PolarHBondContact O-N 3.48Å; I1101-T1103 VanDerWaalsContact O-N 3.14Å
1104	K	24.7	Very low	24.7	Very low	173 Å²	173	127.5 Å²	127.5	75%	0.752	70%	0.698	S	S	*	*			trans	-110	122.8	169.7	-74.9	-169.9	172.7	-173.5	0	108.1	L1102 V1106	L1102-K1104 PolarHBondContact O-N 3.19Å; K1104-V1106 PolarHBondContact O-N 2.99Å
1105	N	22.8	Very low	24.9	Very low	169 Å²	169	127.2 Å²	127.2	90%	0.904	70%	0.696	S	S	*	*			trans	-62	108.1	171.3	-60.4	-16.6	0	0	0	108.1
1106	V	24.3	Very low	25.2	Very low	97 Å²	97	125.9 Å²	125.9	59%	0.588	68%	0.681	S	S	*	*			trans	-109.3	96.4	171.5	-172.4	0	0	0	0	108	K1104 Y1108	K1104-V1106 PolarHBondContact O-N 2.99Å; V1106-Y1108 HydrophobicContact CB-CD2 4.28Å; V1106-Y1108 HydrophobicContact CB-CE2 4.21Å; V1106-Y1108 HydrophobicContact CG1-CD2 3.65Å; V1106-Y1108 HydrophobicContact CG1-CE2 3.4Å; V1106-Y1108 VanDerWaalsContact CG1-CE2 3.4Å; V1106-Y1108 PolarHBondContact O-N 3.15Å
1107	S	22.6	Very low	26.1	Very low	102 Å²	102	122.6 Å²	122.6	71%	0.713	67%	0.668	S	S	*	*			trans	-67.5	92.2	174.3	35.7	0	0	0	0	110.5	Q1109	S1107-Q1109 PolarHBondContact O-N 3.45Å; S1107-Q1109 VanDerWaalsContact O-N 3.09Å
1108	Y	25.1	Very low	26.9	Very low	139 Å²	139	125.3 Å²	125.3	55%	0.545	67%	0.669	S	S	.	*			trans	-80.1	87.6	175.2	-93.2	-74.5	0	0	0	111.6	V1106 I1110	V1106-Y1108 HydrophobicContact CB-CD2 4.28Å; V1106-Y1108 HydrophobicContact CB-CE2 4.21Å; V1106-Y1108 HydrophobicContact CG1-CD2 3.65Å; V1106-Y1108 HydrophobicContact CG1-CE2 3.4Å; V1106-Y1108 VanDerWaalsContact CG1-CE2 3.4Å; V1106-Y1108 PolarHBondContact O-N 3.15Å; Y1108-I1110 HydrophobicContact CD1-CG1 4.5Å; Y1108-I1110 PolarHBondContact O-N 3.1Å
1109	Q	22.8	Very low	27.9	Very low	167 Å²	167	126.8 Å²	126.8	78%	0.78	67%	0.671	S	S	*	*			trans	-63.2	98.4	154.8	-77.7	-176.1	-21.5	0	0	108.8	S1107 S1111	S1107-Q1109 PolarHBondContact O-N 3.45Å; S1107-Q1109 VanDerWaalsContact O-N 3.09Å; Q1109-S1111 PolarHBondContact O-N 2.85Å
1110	I	26.3	Very low	28.6	Very low	115 Å²	115	125.4 Å²	125.4	59%	0.59	66%	0.658	S	S	*	*			trans	-92	79.5	169.4	-54	-176.4	0	0	0	108.1	L1067 Y1108	L1067-I1110 HydrophobicContact CD1-CD1 4.48Å; Y1108-I1110 HydrophobicContact CD1-CG1 4.5Å; Y1108-I1110 PolarHBondContact O-N 3.1Å
1111	S	23.6	Very low	29.1	Very low	80 Å²	80	125.3 Å²	125.3	56%	0.559	66%	0.655	S	S	*	*			trans	-57.8	136.6	164.7	-58.7	0	0	0	0	109.4	Q1109 S1113	Q1109-S1111 PolarHBondContact O-N 2.85Å; S1111-S1113 PolarHBondContact O-N 3.3Å
1112	T	25.2	Very low	30	Very low	148 Å²	148	124.6 Å²	124.6	91%	0.908	65%	0.652	S	S	*	*			trans	-72	22.6	-178.3	45.1	0	0	0	0	114	K1114	T1112-K1114 PolarHBondContact O-N 3.25Å
1113	S	26.1	Very low	30.7	Very low	79 Å²	79	126.4 Å²	126.4	55%	0.552	66%	0.656	S	S	*	*			trans	-90.7	80.9	-172.3	54.8	0	0	0	0	112.7	S1111 S1115	S1111-S1113 PolarHBondContact O-N 3.3Å; S1113-S1115 PolarHBondContact O-N 3.06Å
1114	K	30.9	Very low	31.1	Very low	222 Å²	222	124.2 Å²	124.2	97%	0.965	64%	0.639	S	S	*	*	S	Bend	trans	40.2	6.5	150.2	-77.3	-170.8	172.8	-176.5	0	122.6	T1112	T1112-K1114 PolarHBondContact O-N 3.25Å
1115	S	30	Very low	31.7	Very low	98 Å²	98	122.8 Å²	122.8	69%	0.685	63%	0.633	S	S	*	*			trans	-155.4	104	177.2	57.9	0	0	0	0	111.7	S1113	S1113-S1115 PolarHBondContact O-N 3.06Å
1116	M	32.5	Very low	32.7	Very low	118 Å²	118	119.2 Å²	119.2	58%	0.581	61%	0.614	S	S	*	*			trans	-68	145.7	151	-83.8	-160.7	-74.7	0	0	108.4	E1121 L1124	M1116-E1121 HydrophobicContact CB-CG 4.11Å; M1116-E1121 HydrophobicContact CE-CG 4.45Å; M1116-L1124 HydrophobicContact SD-CD1 4.18Å
1117	T	42.4	Very low	33.4	Very low	80 Å²	80	117.7 Å²	117.7	49%	0.491	60%	0.602	S	S	.	*			trans	-78.5	146.2	173.4	65.7	0	0	0	0	109.8	K1119 Q1120 E1121	T1117-K1119 PolarHBondContact O-N 3.48Å; T1117-Q1120 WeakPolarHBondContact O-CA 3.27Å; T1117-Q1120 WeakPolarHBondContact O-CB 3.24Å; T1117-Q1120 PolarHBondContact O-N 3.26Å; T1117-Q1120 VanDerWaalsContact OG1-CD 3.25Å; T1117-Q1120 WeakPolarHBondContact OG1-CG 3.45Å; T1117-Q1120 PolarHBondContact OG1-OE1 3.39Å; T1117-E1121 PolarHBondContact O-N 3.45Å
1118	K	42	Very low	34.1	Very low	159 Å²	159	117.4 Å²	117.4	69%	0.691	59%	0.591	S	S	*	*	H	α-helix	trans	-56.6	-22.1	-177.6	-147	168.3	-170	172	0	114.2	N1122	K1118-N1122 WeakPolarHBondContact O-CB 3.49Å; K1118-N1122 PolarHBondContact O-N 3.31Å; K1118-N1122 VanDerWaalsContact O-N 3.15Å; K1118-N1122 PolarHBondContact O-OD1 3.08Å
1119	K	43.4	Very low	34.8	Very low	182 Å²	182	114 Å²	114	79%	0.791	58%	0.582	S	S	*	*	H	α-helix	trans	-71.2	-37.6	170.9	-84.1	-173.3	172.1	-178.5	0	113.2	T1117 F1123	T1117-K1119 PolarHBondContact O-N 3.48Å; K1119-F1123 VanDerWaalsContact O-CB 3.29Å; K1119-F1123 WeakPolarHBondContact O-CB 3.46Å; K1119-F1123 PolarHBondContact O-N 3.1Å
1120	Q	38.8	Very low	35.7	Very low	65 Å²	65	109.3 Å²	109.3	30%	0.304	56%	0.562	S	S	.	*	H	α-helix	trans	-72.5	-39.9	178.3	-69.3	159.5	-43.9	0	0	111	T1117 F1123 L1124	T1117-Q1120 WeakPolarHBondContact O-CA 3.27Å; T1117-Q1120 WeakPolarHBondContact O-CB 3.24Å; T1117-Q1120 PolarHBondContact O-N 3.26Å; T1117-Q1120 VanDerWaalsContact OG1-CD 3.25Å; T1117-Q1120 WeakPolarHBondContact OG1-CG 3.45Å; T1117-Q1120 PolarHBondContact OG1-OE1 3.39Å; Q1120-F1123 PolarHBondContact O-N 2.86Å; Q1120-L1124 PolarHBondContact O-N 3.26Å
1121	E	34.1	Very low	36	Very low	98 Å²	98	107 Å²	107	46%	0.458	55%	0.551	S	S	.	*	H	α-helix	trans	-59.5	-54.5	171.9	-66	-178.2	127	0	0	111.4	M1116 T1117 F1123 L1124 F1125	M1116-E1121 HydrophobicContact CB-CG 4.11Å; M1116-E1121 HydrophobicContact CE-CG 4.45Å; T1117-E1121 PolarHBondContact O-N 3.45Å; E1121-F1123 VanDerWaalsContact C-N 3.32Å; E1121-F1123 PolarHBondContact O-N 2.98Å; E1121-L1124 PolarHBondContact O-N 3.34Å; E1121-F1125 WeakPolarHBondContact O-CB 3.28Å; E1121-F1125 PolarHBondContact O-N 3.3Å
1122	N	43.1	Very low	36.5	Very low	92 Å²	92	106 Å²	106	49%	0.492	54%	0.543	S	S	.	.	H	α-helix	trans	-55.9	-45.9	177.5	-74.3	14.5	0	0	0	111.7	K1118 L1124 F1125 D1126	K1118-N1122 WeakPolarHBondContact O-CB 3.49Å; K1118-N1122 PolarHBondContact O-N 3.31Å; K1118-N1122 VanDerWaalsContact O-N 3.15Å; K1118-N1122 PolarHBondContact O-OD1 3.08Å; N1122-L1124 VanDerWaalsContact C-N 3.35Å; N1122-L1124 PolarHBondContact O-N 3.43Å; N1122-F1125 PolarHBondContact O-N 3.13Å; N1122-F1125 VanDerWaalsContact O-N 3.12Å; N1122-D1126 WeakPolarHBondContact O-CB 3.42Å; N1122-D1126 VanDerWaalsContact O-CG 3.3Å; N1122-D1126 PolarHBondContact O-N 3.14Å
1123	F	38.7	Very low	37.2	Very low	141 Å²	141	104.4 Å²	104.4	62%	0.618	52%	0.523	S	S	*	.	H	α-helix	trans	-64.8	-36.3	-179.5	-167.8	-100.9	0	0	0	112.7	K1119 Q1120 E1121 N1127	K1119-F1123 VanDerWaalsContact O-CB 3.29Å; K1119-F1123 WeakPolarHBondContact O-CB 3.46Å; K1119-F1123 PolarHBondContact O-N 3.1Å; Q1120-F1123 PolarHBondContact O-N 2.86Å; E1121-F1123 VanDerWaalsContact C-N 3.32Å; E1121-F1123 PolarHBondContact O-N 2.98Å; F1123-N1127 WeakPolarHBondContact CD1-ND2 3.33Å; F1123-N1127 VanDerWaalsContact CE1-ND2 3.32Å; F1123-N1127 WeakPolarHBondContact CE1-ND2 3.46Å; F1123-N1127 WeakPolarHBondContact O-CB 3.41Å; F1123-N1127 PolarHBondContact O-N 3.48Å; F1123-N1127 PolarHBondContact O-ND2 3.22Å
1124	L	34	Very low	37.6	Very low	84 Å²	84	106.1 Å²	106.1	44%	0.44	53%	0.525	S	S	.	.	H	α-helix	trans	-65.8	-43.9	170.4	-88.4	162.1	0	0	0	111.5	M1116 Q1120 E1121 N1122 M1128	M1116-L1124 HydrophobicContact SD-CD1 4.18Å; Q1120-L1124 PolarHBondContact O-N 3.26Å; E1121-L1124 PolarHBondContact O-N 3.34Å; N1122-L1124 VanDerWaalsContact C-N 3.35Å; N1122-L1124 PolarHBondContact O-N 3.43Å; L1124-M1128 WeakPolarHBondContact O-CB 3.41Å; L1124-M1128 WeakPolarHBondContact O-CG 3.38Å; L1124-M1128 PolarHBondContact O-N 3.37Å
1125	F	37.7	Very low	37.5	Very low	144 Å²	144	100.1 Å²	100.1	63%	0.632	50%	0.503	S	S	*	.	H	α-helix	trans	-65.7	-41.5	-177.8	-155.5	-93.7	0	0	0	112.4	E1121 N1122 M1128 N1129	E1121-F1125 WeakPolarHBondContact O-CB 3.28Å; E1121-F1125 PolarHBondContact O-N 3.3Å; N1122-F1125 PolarHBondContact O-N 3.13Å; N1122-F1125 VanDerWaalsContact O-N 3.12Å; F1125-M1128 PolarHBondContact O-N 3.04Å; F1125-N1129 WeakPolarHBondContact CD1-ND2 3.45Å; F1125-N1129 VanDerWaalsContact CE1-ND2 3.33Å; F1125-N1129 WeakPolarHBondContact CE1-ND2 3.41Å; F1125-N1129 WeakPolarHBondContact O-CB 3.47Å; F1125-N1129 PolarHBondContact O-N 2.77Å
1126	D	44	Very low	37.7	Very low	94 Å²	94	101.8 Å²	101.8	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-47.5	177.4	-70.2	-30.4	0	0	0	111.5	N1122 M1128 N1129 D1130	N1122-D1126 WeakPolarHBondContact O-CB 3.42Å; N1122-D1126 VanDerWaalsContact O-CG 3.3Å; N1122-D1126 PolarHBondContact O-N 3.14Å; D1126-M1128 VanDerWaalsContact C-N 3.34Å; D1126-M1128 PolarHBondContact O-N 3.08Å; D1126-N1129 WeakPolarHBondContact O-CB 3.5Å; D1126-N1129 PolarHBondContact O-N 3.33Å; D1126-D1130 PolarHBondContact O-N 3.08Å
1127	N	39.2	Very low	37.8	Very low	65 Å²	65	104.3 Å²	104.3	35%	0.348	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-38.7	176.6	-79.6	-73.7	0	0	0	112.2	F1123 L1131	F1123-N1127 WeakPolarHBondContact CD1-ND2 3.33Å; F1123-N1127 VanDerWaalsContact CE1-ND2 3.32Å; F1123-N1127 WeakPolarHBondContact CE1-ND2 3.46Å; F1123-N1127 WeakPolarHBondContact O-CB 3.41Å; F1123-N1127 PolarHBondContact O-N 3.48Å; F1123-N1127 PolarHBondContact O-ND2 3.22Å; N1127-L1131 WeakPolarHBondContact O-CB 3.39Å; N1127-L1131 PolarHBondContact O-N 3.36Å
1128	M	36.1	Very low	37.4	Very low	96 Å²	96	103.8 Å²	103.8	47%	0.473	51%	0.509	S	S	.	.	H	α-helix	trans	-68.6	-39	174.8	-71.5	-71.5	-70.9	0	0	111.8	L1124 F1125 D1126 L1131 C1132	L1124-M1128 WeakPolarHBondContact O-CB 3.41Å; L1124-M1128 WeakPolarHBondContact O-CG 3.38Å; L1124-M1128 PolarHBondContact O-N 3.37Å; F1125-M1128 PolarHBondContact O-N 3.04Å; D1126-M1128 VanDerWaalsContact C-N 3.34Å; D1126-M1128 PolarHBondContact O-N 3.08Å; M1128-L1131 PolarHBondContact O-N 2.94Å; M1128-C1132 WeakPolarHBondContact O-CB 3.46Å; M1128-C1132 PolarHBondContact O-N 2.88Å; M1128-C1132 PolarHBondContact O-SG 2.65Å; M1128-C1132 VanDerWaalsContact O-SG 3.41Å
1129	N	39.7	Very low	36.9	Very low	67 Å²	67	103.3 Å²	103.3	36%	0.358	51%	0.509	S	S	.	.	H	α-helix	trans	-61.4	-45.7	174.2	-105	-44.2	0	0	0	112	F1125 D1126 L1131 C1132 K1133	F1125-N1129 WeakPolarHBondContact CD1-ND2 3.45Å; F1125-N1129 VanDerWaalsContact CE1-ND2 3.33Å; F1125-N1129 WeakPolarHBondContact CE1-ND2 3.41Å; F1125-N1129 WeakPolarHBondContact O-CB 3.47Å; F1125-N1129 PolarHBondContact O-N 2.77Å; D1126-N1129 WeakPolarHBondContact O-CB 3.5Å; D1126-N1129 PolarHBondContact O-N 3.33Å; N1129-L1131 VanDerWaalsContact C-N 3.35Å; N1129-C1132 WeakPolarHBondContact O-CB 3.49Å; N1129-C1132 PolarHBondContact O-N 3.04Å; N1129-K1133 WeakPolarHBondContact O-CG 3.32Å; N1129-K1133 PolarHBondContact O-N 2.86Å
1130	D	41.6	Very low	36.1	Very low	68 Å²	68	99.8 Å²	99.8	36%	0.364	50%	0.499	S	S	.	.	H	α-helix	trans	-68.6	-34.9	178.2	-78.4	-6.6	0	0	0	111.8	D1126 K1133 I1134	D1126-D1130 PolarHBondContact O-N 3.08Å; D1130-K1133 PolarHBondContact O-N 3.23Å; D1130-K1133 WeakPolarHBondContact OD1-CD 3.46Å; D1130-K1133 WeakPolarHBondContact OD1-CE 3.27Å; D1130-K1133 IonicContact OD1-NZ 3.29Å; D1130-K1133 PolarHBondContact OD1-NZ 3.09Å; D1130-I1134 WeakPolarHBondContact O-CD1 3.47Å; D1130-I1134 VanDerWaalsContact O-CG1 3.25Å; D1130-I1134 WeakPolarHBondContact O-CG1 3.49Å; D1130-I1134 PolarHBondContact O-N 3.14Å
1131	L	34	Very low	35.6	Very low	67 Å²	67	103 Å²	103	35%	0.351	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-43.1	169.8	-165.4	71.6	0	0	0	111.7	N1127 M1128 N1129 I1134 I1135	N1127-L1131 WeakPolarHBondContact O-CB 3.39Å; N1127-L1131 PolarHBondContact O-N 3.36Å; M1128-L1131 PolarHBondContact O-N 2.94Å; N1129-L1131 VanDerWaalsContact C-N 3.35Å; L1131-I1134 PolarHBondContact O-N 2.9Å; L1131-I1135 HydrophobicContact CG-CD1 4.15Å; L1131-I1135 VanDerWaalsContact O-CG1 3.28Å; L1131-I1135 WeakPolarHBondContact O-CG1 3.36Å; L1131-I1135 PolarHBondContact O-N 2.79Å
1132	C	33.2	Very low	35.3	Very low	59 Å²	59	106.2 Å²	106.2	40%	0.399	53%	0.531	S	S	.	.	H	α-helix	trans	-62.5	-40.6	173.6	-76.5	0	0	0	0	112.3	M1128 N1129 I1135 H1136	M1128-C1132 WeakPolarHBondContact O-CB 3.46Å; M1128-C1132 PolarHBondContact O-N 2.88Å; M1128-C1132 PolarHBondContact O-SG 2.65Å; M1128-C1132 VanDerWaalsContact O-SG 3.41Å; N1129-C1132 WeakPolarHBondContact O-CB 3.49Å; N1129-C1132 PolarHBondContact O-N 3.04Å; C1132-I1135 PolarHBondContact O-N 3.1Å; C1132-H1136 WeakPolarHBondContact O-CB 3.25Å; C1132-H1136 PolarHBondContact O-CD2 3.46Å; C1132-H1136 VanDerWaalsContact O-CD2 3.24Å; C1132-H1136 PolarHBondContact O-N 2.71Å
1133	K	39	Very low	34.6	Very low	114 Å²	114	105.1 Å²	105.1	50%	0.496	53%	0.531	S	S	.	.	H	α-helix	trans	-61.5	-42.8	173.2	-68.3	167.3	-155.8	162.3	0	111.5	N1129 D1130 H1136 H1137	N1129-K1133 WeakPolarHBondContact O-CG 3.32Å; N1129-K1133 PolarHBondContact O-N 2.86Å; D1130-K1133 PolarHBondContact O-N 3.23Å; D1130-K1133 WeakPolarHBondContact OD1-CD 3.46Å; D1130-K1133 WeakPolarHBondContact OD1-CE 3.27Å; D1130-K1133 IonicContact OD1-NZ 3.29Å; D1130-K1133 PolarHBondContact OD1-NZ 3.09Å; K1133-H1136 PolarHBondContact O-N 3.22Å; K1133-H1137 WeakPolarHBondContact O-CB 3.31Å; K1133-H1137 PolarHBondContact O-N 2.86Å
1134	I	34.5	Very low	34.1	Very low	116 Å²	116	104.3 Å²	104.3	60%	0.595	54%	0.54	S	S	*	.	H	α-helix	trans	-63.3	-42.9	176.6	-70.3	163	0	0	0	111	D1130 L1131 S1138	D1130-I1134 WeakPolarHBondContact O-CD1 3.47Å; D1130-I1134 VanDerWaalsContact O-CG1 3.25Å; D1130-I1134 WeakPolarHBondContact O-CG1 3.49Å; D1130-I1134 PolarHBondContact O-N 3.14Å; L1131-I1134 PolarHBondContact O-N 2.9Å; I1134-S1138 PolarHBondContact O-N 3.35Å
1135	I	30.8	Very low	34.2	Very low	95 Å²	95	109.1 Å²	109.1	49%	0.487	56%	0.557	S	S	.	*	H	α-helix	trans	-64.4	-48.2	176.5	-69.3	164.8	0	0	0	110.5	L1131 C1132 H1137 S1138	L1131-I1135 HydrophobicContact CG-CD1 4.15Å; L1131-I1135 VanDerWaalsContact O-CG1 3.28Å; L1131-I1135 WeakPolarHBondContact O-CG1 3.36Å; L1131-I1135 PolarHBondContact O-N 2.79Å; C1132-I1135 PolarHBondContact O-N 3.1Å; I1135-H1137 PolarHBondContact O-N 3.28Å; I1135-S1138 WeakPolarHBondContact O-CB 3.47Å; I1135-S1138 PolarHBondContact O-N 3.4Å; I1135-S1138 PolarHBondContact O-OG 3.15Å
1136	H	33	Very low	34.1	Very low	134 Å²	134	109.3 Å²	109.3	62%	0.62	56%	0.56	S	S	*	*	H	α-helix	trans	-66.6	-34.5	178.5	-80.5	-68.6	0	0	0	113.3	C1132 K1133 S1138 Q1139	C1132-H1136 WeakPolarHBondContact O-CB 3.25Å; C1132-H1136 PolarHBondContact O-CD2 3.46Å; C1132-H1136 VanDerWaalsContact O-CD2 3.24Å; C1132-H1136 PolarHBondContact O-N 2.71Å; K1133-H1136 PolarHBondContact O-N 3.22Å; H1136-S1138 PolarHBondContact O-N 3Å; H1136-S1138 VanDerWaalsContact O-N 3.15Å; H1136-Q1139 PolarHBondContact O-N 2.79Å
1137	H	34.2	Very low	33.5	Very low	171 Å²	171	109.8 Å²	109.8	79%	0.792	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-11.7	171.8	-86.3	-37.4	0	0	0	114.1	K1133 I1135 Q1139	K1133-H1137 WeakPolarHBondContact O-CB 3.31Å; K1133-H1137 PolarHBondContact O-N 2.86Å; I1135-H1137 PolarHBondContact O-N 3.28Å; H1137-Q1139 VanDerWaalsContact C-N 3.3Å
1138	S	34.6	Very low	33.1	Very low	68 Å²	68	112.8 Å²	112.8	48%	0.476	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.2	-1.9	171.4	79.6	0	0	0	0	114.2	I1134 I1135 H1136	I1134-S1138 PolarHBondContact O-N 3.35Å; I1135-S1138 WeakPolarHBondContact O-CB 3.47Å; I1135-S1138 PolarHBondContact O-N 3.4Å; I1135-S1138 PolarHBondContact O-OG 3.15Å; H1136-S1138 PolarHBondContact O-N 3Å; H1136-S1138 VanDerWaalsContact O-N 3.15Å
1139	Q	30.6	Very low	32.8	Very low	149 Å²	149	111.5 Å²	111.5	70%	0.696	60%	0.603	S	S	*	*	S	Bend	trans	-106.6	121.9	172	-65.6	-169.3	-3.8	0	0	111.4	H1136 H1137	H1136-Q1139 PolarHBondContact O-N 2.79Å; H1137-Q1139 VanDerWaalsContact C-N 3.3Å
1140	D	27.6	Very low	32.1	Very low	108 Å²	108	115.6 Å²	115.6	58%	0.578	62%	0.624	S	S	*	*			trans	-73.6	126.6	-168	-166.8	34.9	0	0	0	112.2	R730	R730-D1140 IonicContact CZ-OD2 2.65Å; R730-D1140 VanDerWaalsContact CZ-OD2 3.29Å; R730-D1140 IonicContact NH1-OD2 3.18Å; R730-D1140 PolarHBondContact NH1-OD2 3.43Å; R730-D1140 IonicContact NH2-OD2 2.82Å; R730-D1140 PolarHBondContact NH2-OD2 3.07Å
1141	K	27.7	Very low	31.4	Very low	133 Å²	133	122.4 Å²	122.4	58%	0.578	65%	0.65	S	S	*	*			trans	77.9	85.1	167.4	-50.4	175.3	-177.8	-174.3	0	119.6
1142	L	27.8	Very low	31.2	Very low	165 Å²	165	125.7 Å²	125.7	86%	0.864	67%	0.666	S	S	*	*			trans	-123.7	155.8	142.7	-80.5	170.9	0	0	0	109.8
1143	S	28.1	Very low	30.9	Very low	70 Å²	70	130 Å²	130	49%	0.49	69%	0.686	S	S	.	*			trans	-93.2	148.9	-166	85.3	0	0	0	0	113.8	K1145	S1143-K1145 PolarHBondContact O-N 2.92Å
1144	P	29.4	Very low	30.4	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	17.3	-174.2	-21.4	34.7	0	0	0	117.4
1145	K	35.4	Very low	30.3	Very low	185 Å²	185	136.3 Å²	136.3	80%	0.804	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-5.6	-177.7	-81.7	-167.9	171.9	-174.1	0	115.3	S1143	S1143-K1145 PolarHBondContact O-N 2.92Å
1146	E	35.4	Very low	30.3	Very low	147 Å²	147	141.8 Å²	141.8	69%	0.687	73%	0.734	S	S	*	*	S	Bend	trans	-108.2	-2.6	-172.6	-65.4	173.2	138.4	0	0	113.5	T1148	E1146-T1148 PolarHBondContact O-N 3.41Å
1147	S	31	Very low	29.9	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	5.3	-172.7	51.4	0	0	0	0	116
1148	T	31	Very low	29.7	Very low	128 Å²	128	136.6 Å²	136.6	79%	0.785	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	8	-170.3	50.9	0	0	0	0	115.1	E1146	E1146-T1148 PolarHBondContact O-N 3.41Å
1149	G	29.5	Very low	29.3	Very low	70 Å²	70	140.7 Å²	140.7	72%	0.722	76%	0.755	S	S	*	*			trans	-93.3	-13.1	-170	0	0	0	0	0	117.9
1150	I	25.9	Very low	29.1	Very low	153 Å²	153	139.4 Å²	139.4	79%	0.785	76%	0.757	S	S	*	*			trans	-101.2	102.2	-164.5	-58.3	178.5	0	0	0	111.9	I1152	I1150-I1152 HydrophobicContact CG2-CD1 4.12Å; I1150-I1152 HydrophobicContact CG2-CG1 3.75Å
1151	K	27.8	Very low	29	Very low	210 Å²	210	140 Å²	140	91%	0.913	76%	0.764	S	S	*	*			trans	-93	137.1	154.5	-71.6	-176.4	176.1	-177.6	0	108.6
1152	I	28.1	Very low	28.9	Very low	136 Å²	136	141 Å²	141	70%	0.697	78%	0.777	S	S	*	*			trans	-116.5	135.7	172.3	-60.4	-179.3	0	0	0	108.2	I1150	I1150-I1152 HydrophobicContact CG2-CD1 4.12Å; I1150-I1152 HydrophobicContact CG2-CG1 3.75Å
1153	D	27.4	Very low	28.8	Very low	150 Å²	150	143.4 Å²	143.4	80%	0.802	79%	0.789	S	S	*	*			trans	-85.4	129.9	-174.6	-133.7	-32.2	0	0	0	111.5	Q1155	D1153-Q1155 PolarHBondContact O-N 3.04Å
1154	H	28.9	Very low	28.8	Very low	183 Å²	183	147.1 Å²	147.1	85%	0.847	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	7.8	-163.6	-78.4	-63.4	0	0	0	115.7
1155	Q	33.3	Very low	28.8	Very low	180 Å²	180	148.3 Å²	148.3	84%	0.841	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-0.9	-164.6	-79.2	-166.2	-12.2	0	0	117.9	D1153	D1153-Q1155 PolarHBondContact O-N 3.04Å
1156	K	29	Very low	28.4	Very low	209 Å²	209	146.2 Å²	146.2	91%	0.909	80%	0.804	S	S	*	*			trans	-135.5	84.4	176	-69.4	-170.2	179.1	-177.2	0	112.8
1157	A	25.6	Very low	28	Very low	99 Å²	99	146.2 Å²	146.2	82%	0.818	81%	0.811	S	S	*	*			trans	-129.2	97.9	168.8	0	0	0	0	0	109.1
1158	S	29.7	Very low	27.8	Very low	98 Å²	98	148.8 Å²	148.8	69%	0.685	82%	0.816	S	S	*	*			trans	-157.1	128	172.7	-175.7	0	0	0	0	108.8	T1160	S1158-T1160 PolarHBondContact O-N 2.71Å
1159	N	27.2	Very low	27.6	Very low	154 Å²	154	150.2 Å²	150.2	82%	0.824	82%	0.818	S	S	*	*	S	Bend	trans	54	52.7	160.9	-55.9	-4.6	0	0	0	118.4
1160	T	25	Very low	27.5	Very low	121 Å²	121	155.9 Å²	155.9	74%	0.742	83%	0.825	S	S	*	*			trans	-172.4	111	139.4	11.8	0	0	0	0	110.4	S1158	S1158-T1160 PolarHBondContact O-N 2.71Å
1161	V	25.2	Very low	27.6	Very low	120 Å²	120	156.2 Å²	156.2	73%	0.727	83%	0.828	S	S	*	*			trans	-123.6	101.7	155.5	177.9	0	0	0	0	105.2	L1163	V1161-L1163 HydrophobicContact CG1-CD2 4.34Å; V1161-L1163 HydrophobicContact CG1-CG 4.23Å
1162	D	26.1	Very low	27.6	Very low	156 Å²	156	151.7 Å²	151.7	83%	0.834	82%	0.821	S	S	*	*			trans	-65.7	130.5	161.2	-62.3	-51.1	0	0	0	107.5
1163	L	26	Very low	27.6	Very low	214 Å²	214	153.1 Å²	153.1	100%	1.12	83%	0.832	S	S	*	*			trans	-109.8	0	-159.5	-97.7	172.7	0	0	0	115.2	V1161	V1161-L1163 HydrophobicContact CG1-CD2 4.34Å; V1161-L1163 HydrophobicContact CG1-CG 4.23Å

Retrieved 1,163 of 1,163 residues in 442.5 ms (Link to these results)

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