A0A5K4F196_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F196, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 936 aa.

						>A0A5K4F196_SCHMA|A0A5K4F196
MFEPCYGTPGRIPSPQYTQQVPPILFRKRTEKIDWKRLASIDVNRITKDVDIESLQEILSSVTFCDITNEIDTRYVDNNLIKLFQLAQLLVEYLLYSQDYLTTTIDSLKEENNELRKNCDKLKHQLQEKTNRLTATRRECHRRRLLLMAQQQLMDSGPQSLHKCIYCPKAFVNASFLATHIHRRHPETEATDRNTPVYPTHPCLITNNTPYPQIQQSQQIYQQSDNQYTANNNMNTSLEHDVRELLNQLKLNPPNLPIKHQSPTRSIGFDVEQNKNNTDWHTQLMEEHRRDMELMRKGFEKELHNLQVQYHQTQEELSKLKCRPATSNLGELENDMSGPVFRSNRAKSANTSLRQSTKNFNVDQGETSSRHSLPTDDDKQSTAHVSIISGPTTRFLRPPYSLKPQFSDTMNHDDKDESEAQQVSRAMGRVLTASGGTSPTPSLNASTNMLRYSRLLDQLRGDPETLRKLRHEVEQLLLEQLNEHGIKSDQRRLSTNQLNQKLTILHKERENLARKYQNFMEIRDALSQNVDRLAHAALRGSTISIPETRLRAENIHKMNSSHKLGLPPPASHSPGSLRRAGTLPLASQRVDITSNLGVSLPILSVNNEIGRSQSTMTGMINSPSRKGTGFSETKPRLQRSSPQLQYVSEESNFGSKLTPTMPKQNPTNESQLQMTSQKYPTCLHNNNNNGNNNSSTVQQKQTISNSPEIHFSHDQRVVTFGTKPNTTNTTSNLSVVPSSEDDEWDSETEDLNIVAAEINKSQQLTSGSSNKPTNPLKPITSYYKSNNSINNSSIQQKNNSPQGVKFTSYKNQNLKTDDEDIFSVSSINGGLAEDNSLSLAQELSPRHSVRVSRSLDPSVAAAHAEMAALGPRPTTRVGGVSRQPMTAKHTSIGSPELSNTMVTSLWGTNSKAASPITNVISMARSDGAYDEFDSDD
					

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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	37.5	Very low	39.4	Very low	240 Å²	240	140.9 Å²	140.9	100%	1.182	77%	0.77	S	S	*	*				0	111.6	0	-73.6	171.3	170	0	0	108.5
2	F	35.8	Very low	39.5	Very low	157 Å²	157	141.7 Å²	141.7	69%	0.689	77%	0.77	S	S	*	*			trans	-145	120.4	165.6	-93.8	-85.2	0	0	0	106.3	P4 H311	F2-P4 WeakPolarHBondContact O-CD 3.39Å; F2-H311 AromaticContact CE1-CE1 3.77Å; F2-H311 AromaticContact CZ-CE1 3.95Å
3	E	38.8	Very low	39.3	Very low	181 Å²	181	137.8 Å²	137.8	85%	0.846	76%	0.756	S	S	*	*			trans	-71.4	123.1	167	-81	-173.4	115.9	0	0	108.5	C5	E3-C5 PolarHBondContact O-N 3.4Å
4	P	45.3	Very low	38.7	Very low	85 Å²	85	135.1 Å²	135.1	55%	0.552	75%	0.752	S	S	*	*			trans	-72.2	114.7	168.2	-5.9	22.8	0	0	0	107.4	F2 Y6	F2-P4 WeakPolarHBondContact O-CD 3.39Å; P4-Y6 HydrophobicContact CB-CD2 3.97Å; P4-Y6 HydrophobicContact CB-CE2 3.56Å; P4-Y6 HydrophobicContact CG-CE2 3.87Å; P4-Y6 WeakPolarHBondContact O-CD2 3.24Å; P4-Y6 PolarHBondContact O-N 3.16Å
5	C	36.8	Very low	39	Very low	113 Å²	113	133.2 Å²	133.2	76%	0.764	75%	0.748	S	S	*	*			trans	-69.2	77.7	177.9	-61.5	0	0	0	0	111.2	E3 G7	E3-C5 PolarHBondContact O-N 3.4Å; C5-G7 PolarHBondContact O-N 2.76Å
6	Y	37.2	Very low	38.8	Very low	202 Å²	202	134.1 Å²	134.1	79%	0.792	75%	0.745	S	S	*	*			trans	-72.2	66.1	172.5	-69.4	-63	0	0	0	111.2	P4 T8	P4-Y6 HydrophobicContact CB-CD2 3.97Å; P4-Y6 HydrophobicContact CB-CE2 3.56Å; P4-Y6 HydrophobicContact CG-CE2 3.87Å; P4-Y6 WeakPolarHBondContact O-CD2 3.24Å; P4-Y6 PolarHBondContact O-N 3.16Å; Y6-T8 PolarHBondContact O-N 3.24Å
7	G	38.9	Very low	39	Very low	69 Å²	69	133.8 Å²	133.8	71%	0.711	73%	0.731	S	S	*	*			trans	-63.6	114.1	163.7	0	0	0	0	0	109.4	C5	C5-G7 PolarHBondContact O-N 2.76Å
8	T	44.7	Very low	39.1	Very low	127 Å²	127	131.7 Å²	131.7	78%	0.779	72%	0.723	S	S	*	*			trans	-48.5	138.1	176	-45.5	0	0	0	0	110.6	Y6 G10	Y6-T8 PolarHBondContact O-N 3.24Å; T8-G10 VanDerWaalsContact C-N 3.34Å; T8-G10 PolarHBondContact O-N 2.89Å
9	P	43	Very low	39.9	Very low	125 Å²	125	128.6 Å²	128.6	81%	0.812	70%	0.703	S	S	*	*			trans	-66.6	92.3	177.2	27.1	-34.6	0	0	0	110.5	R11	P9-R11 PolarHBondContact O-N 3.21Å
10	G	34.5	Very low	40.8	Very low	61 Å²	61	131.1 Å²	131.1	63%	0.629	71%	0.709	S	S	*	*			trans	-55.6	123.4	177	0	0	0	0	0	110.6	T8 I12	T8-G10 VanDerWaalsContact C-N 3.34Å; T8-G10 PolarHBondContact O-N 2.89Å; G10-I12 PolarHBondContact O-N 3.12Å
11	R	40.9	Very low	42.1	Very low	190 Å²	190	129.1 Å²	129.1	72%	0.717	70%	0.701	S	S	*	*			trans	-71.5	89	-174.1	-170.3	-171.3	-155	-130.6	11.5	110.1	P9 P13 N334	P9-R11 PolarHBondContact O-N 3.21Å; R11-P13 VanDerWaalsContact O-CD 3.25Å; R11-P13 WeakPolarHBondContact O-CD 3.27Å; R11-P13 VanDerWaalsContact O-N 3.11Å; R11-N334 PolarHBondContact NH1-OD1 3.05Å; R11-N334 VanDerWaalsContact NH1-OD1 3.15Å
12	I	40.6	Very low	43.9	Very low	150 Å²	150	120.7 Å²	120.7	77%	0.769	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-49.4	116.9	177.8	-56.6	174.9	0	0	0	109.1	G10 S14	G10-I12 PolarHBondContact O-N 3.12Å; I12-S14 PolarHBondContact O-N 3.22Å
13	P	36.8	Very low	46	Very low	91 Å²	91	118.5 Å²	118.5	59%	0.591	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-68.1	130.8	173.8	-17.9	32.1	0	0	0	109.5	R11	R11-P13 VanDerWaalsContact O-CD 3.25Å; R11-P13 WeakPolarHBondContact O-CD 3.27Å; R11-P13 VanDerWaalsContact O-N 3.11Å
14	S	31.5	Very low	48.2	Very low	100 Å²	100	112.8 Å²	112.8	70%	0.699	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-56.8	142.5	166.7	-55.4	0	0	0	0	109.6	I12 Q16	I12-S14 PolarHBondContact O-N 3.22Å; S14-Q16 PolarHBondContact O-N 3.09Å
15	P	42.6	Very low	50.2	Low	107 Å²	107	115.9 Å²	115.9	70%	0.695	65%	0.652	S	S	*	*			trans	-62.3	102.3	173.3	26.2	-33.4	0	0	0	108.9	Y17	P15-Y17 HydrophobicContact CB-CE2 4.33Å; P15-Y17 PolarHBondContact O-N 3.46Å
16	Q	35.6	Very low	52.7	Low	147 Å²	147	115.8 Å²	115.8	69%	0.687	64%	0.639	S	S	*	*			trans	-71.1	99.5	171.2	-67.9	-168.5	12.5	0	0	107.4	S14 T18	S14-Q16 PolarHBondContact O-N 3.09Å; Q16-T18 HydrophobicContact CB-CG2 4.26Å; Q16-T18 PolarHBondContact O-N 3.5Å; Q16-T18 PolarHBondContact O-OG1 3.44Å
17	Y	42.8	Very low	55.1	Low	130 Å²	130	111.5 Å²	111.5	51%	0.51	62%	0.621	S	S	.	*			trans	-69.9	50.6	160.8	-77.4	-79.4	0	0	0	110.5	P15 Q19 L108 E111	P15-Y17 HydrophobicContact CB-CE2 4.33Å; P15-Y17 PolarHBondContact O-N 3.46Å; Y17-Q19 PolarHBondContact O-N 3.41Å; Y17-L108 HydrophobicContact CD1-CD2 4.32Å; Y17-L108 HydrophobicContact CE1-CD2 3.55Å; Y17-E111 PolarHBondContact OH-OE1 3.07Å; Y17-E111 PolarHBondContact OH-OE2 3.35Å; Y17-E111 VanDerWaalsContact OH-OE2 3.12Å
18	T	40.3	Very low	57.5	Low	96 Å²	96	116.8 Å²	116.8	59%	0.589	62%	0.624	S	S	*	*			trans	-76.3	58.8	162.7	40.3	0	0	0	0	108.6	Q16 Q20	Q16-T18 HydrophobicContact CB-CG2 4.26Å; Q16-T18 PolarHBondContact O-N 3.5Å; Q16-T18 PolarHBondContact O-OG1 3.44Å; T18-Q20 VanDerWaalsContact C-N 3.33Å; T18-Q20 PolarHBondContact O-N 3.38Å
19	Q	54.8	Low	59.7	Low	73 Å²	73	113.3 Å²	113.3	34%	0.341	60%	0.597	S	S	.	*			trans	-55.9	103.7	161.3	-73.6	173.8	-16.1	0	0	106.3	Y17 V21 T104	Y17-Q19 PolarHBondContact O-N 3.41Å; Q19-V21 PolarHBondContact O-N 3.32Å; Q19-T104 VanDerWaalsContact OE1-CG2 3.31Å
20	Q	57.8	Low	61.8	Low	178 Å²	178	112 Å²	112	83%	0.832	59%	0.587	S	S	*	*			trans	-67.9	99.5	179.6	-65.4	-175.9	7.4	0	0	106.8	T18 P22	T18-Q20 VanDerWaalsContact C-N 3.33Å; T18-Q20 PolarHBondContact O-N 3.38Å; Q20-P22 WeakPolarHBondContact O-CD 3.3Å
21	V	68.2	Low	64.4	Low	90 Å²	90	111.4 Å²	111.4	55%	0.545	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-52.4	117.1	177.6	-177.5	0	0	0	0	107.5	Q19 Y96 Y100	Q19-V21 PolarHBondContact O-N 3.32Å; V21-Y96 HydrophobicContact CG1-CE1 4.49Å; V21-Y100 HydrophobicContact CG1-CE2 4.42Å
22	P	75.6	Confident	66.6	Low	63 Å²	63	110.6 Å²	110.6	41%	0.409	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-53.7	144.6	-179	-29.2	34.9	0	0	0	111.9	Q20 I24 Y96 Y100	Q20-P22 WeakPolarHBondContact O-CD 3.3Å; P22-I24 PolarHBondContact O-N 2.89Å; P22-Y96 HydrophobicContact CB-CE2 4.46Å; P22-Y96 VanDerWaalsContact CD-OH 3.26Å; P22-Y96 WeakPolarHBondContact CD-OH 3.29Å; P22-Y96 PolarHBondContact O-OH 3.42Å; P22-Y100 HydrophobicContact CG-CD2 4.38Å
23	P	78.8	Confident	68.9	Low	110 Å²	110	104.3 Å²	104.3	71%	0.714	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-64.3	121	177.7	26.2	-33.3	0	0	0	109.9	L25	P23-L25 PolarHBondContact O-N 3.24Å
24	I	85.6	Confident	71.3	Confident	62 Å²	62	104 Å²	104	32%	0.318	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-69.8	117.7	179.1	-54.2	-178	0	0	0	108.9	P22 F26 Y93 Y96	P22-I24 PolarHBondContact O-N 2.89Å; I24-F26 HydrophobicContact CG2-CE1 4.45Å; I24-F26 HydrophobicContact CG2-CZ 4.46Å; I24-Y93 HydrophobicContact CD1-CD2 3.72Å; I24-Y93 HydrophobicContact CD1-CE2 3.6Å; I24-Y96 HydrophobicContact CD1-CD1 3.5Å; I24-Y96 VanDerWaalsContact CD1-CD1 3.5Å; I24-Y96 HydrophobicContact CD1-CE1 3.55Å; I24-Y96 HydrophobicContact CD1-CG 4.26Å; I24-Y96 HydrophobicContact CG1-CD1 3.68Å; I24-Y96 HydrophobicContact CG1-CD2 4.33Å; I24-Y96 HydrophobicContact CG1-CE1 3.49Å; I24-Y96 VanDerWaalsContact CG1-CE1 3.49Å; I24-Y96 HydrophobicContact CG1-CE2 4.16Å; I24-Y96 HydrophobicContact CG1-CG 4.12Å; I24-Y96 HydrophobicContact CG2-CG 4.37Å
25	L	86.8	Confident	74.1	Confident	150 Å²	150	105 Å²	105	79%	0.785	52%	0.519	S	S	*	.			trans	-117.1	102.4	176.6	-65	178.1	0	0	0	109.3	P23 R27	P23-L25 PolarHBondContact O-N 3.24Å; L25-R27 PolarHBondContact O-N 2.87Å
26	F	90.1	Very high	76.3	Confident	111 Å²	111	108.6 Å²	108.6	49%	0.487	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-59.8	128.1	176.5	-62.5	-72.7	0	0	0	111	I24 L89 E92	I24-F26 HydrophobicContact CG2-CE1 4.45Å; I24-F26 HydrophobicContact CG2-CZ 4.46Å; F26-L89 HydrophobicContact CB-CD2 4.21Å; F26-L89 HydrophobicContact CD1-CD2 3.53Å; F26-L89 HydrophobicContact CD2-CD2 4.21Å; F26-L89 HydrophobicContact CE1-CB 4.41Å; F26-L89 HydrophobicContact CE1-CD2 3.84Å; F26-L89 HydrophobicContact CE2-CD2 4.47Å; F26-L89 HydrophobicContact CG-CD2 3.73Å; F26-L89 HydrophobicContact CZ-CD2 4.3Å; F26-E92 WeakPolarHBondContact CA-OE1 3.46Å; F26-E92 HydrophobicContact CD1-CB 4.48Å; F26-E92 HydrophobicContact CD1-CG 4.07Å; F26-E92 WeakPolarHBondContact CD1-OE2 3.36Å
27	R	87.8	Confident	78.9	Confident	111 Å²	111	106.4 Å²	106.4	42%	0.419	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-72.7	139	-175.2	-175.8	174.8	170.4	-136	-7.9	110.8	L25 R29 E31 F64 E92	L25-R27 PolarHBondContact O-N 2.87Å; R27-R29 PolarHBondContact O-N 3.03Å; R27-R29 PolarHBondContact O-NH1 3.44Å; R27-E31 IonicContact CZ-OE1 2.71Å; R27-E31 IonicContact NH1-OE1 2.68Å; R27-E31 PolarHBondContact NH1-OE1 3.08Å; R27-E31 IonicContact NH2-OE1 3.34Å; R27-E31 PolarHBondContact NH2-OE1 2.9Å; R27-F64 HydrophobicContact CB-CD1 4.12Å; R27-F64 HydrophobicContact CB-CE1 4.08Å; R27-F64 HydrophobicContact CG-CD1 4.37Å; R27-E92 VanDerWaalsContact CB-OE1 3.3Å; R27-E92 WeakPolarHBondContact CB-OE1 3.29Å; R27-E92 PolarHBondContact N-OE1 2.92Å
28	K	88.2	Confident	81.1	Confident	181 Å²	181	103.3 Å²	103.3	79%	0.787	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-56	126.6	174.9	-68.9	-173	177.8	-177	0	110.4	T30	K28-T30 HydrophobicContact CB-CG2 4.18Å; K28-T30 PolarHBondContact O-N 2.86Å; K28-T30 PolarHBondContact O-OG1 3.34Å; K28-T30 VanDerWaalsContact O-OG1 3.07Å
29	R	90.6	Very high	83.5	Confident	53 Å²	53	102.9 Å²	102.9	20%	0.2	51%	0.507	C	S	.	.			trans	-64.2	114.3	174.5	-60.4	-57	-178.1	-109.1	15.6	109.1	R27 T63 F64 C65 D66 E92	R27-R29 PolarHBondContact O-N 3.03Å; R27-R29 PolarHBondContact O-NH1 3.44Å; R29-T63 PolarHBondContact NE-O 2.77Å; R29-F64 CarbonylContact C-O 3.59Å; R29-F64 VanDerWaalsContact CA-O 3.26Å; R29-F64 WeakPolarHBondContact CA-O 3.3Å; R29-C65 WeakPolarHBondContact CD-O 3.49Å; R29-D66 HydrophobicContact CB-CB 3.96Å; R29-E92 IonicContact CZ-OE2 3.84Å; R29-E92 IonicContact NH1-OE1 3.35Å; R29-E92 IonicContact NH1-OE2 3.13Å; R29-E92 PolarHBondContact NH1-OE2 3.37Å; R29-E92 IonicContact NH2-OE2 2.66Å; R29-E92 PolarHBondContact NH2-OE2 3.1Å
30	T	88	Confident	85.2	Confident	97 Å²	97	103.5 Å²	103.5	60%	0.595	52%	0.519	S	S	*	.			trans	-150.3	-9.6	-169.5	47.8	0	0	0	0	114	K28 F64	K28-T30 HydrophobicContact CB-CG2 4.18Å; K28-T30 PolarHBondContact O-N 2.86Å; K28-T30 PolarHBondContact O-OG1 3.34Å; K28-T30 VanDerWaalsContact O-OG1 3.07Å; T30-F64 PolarHBondContact N-O 3.18Å
31	E	88.9	Confident	86.7	Confident	49 Å²	49	96.4 Å²	96.4	23%	0.229	49%	0.487	C	S	.	.	B	Isolated β-bridge	trans	-83	159.3	177.8	-61.7	-171.6	-166.2	0	0	110.6	R27 S60 F64 C65	R27-E31 IonicContact CZ-OE1 2.71Å; R27-E31 IonicContact NH1-OE1 2.68Å; R27-E31 PolarHBondContact NH1-OE1 3.08Å; R27-E31 IonicContact NH2-OE1 3.34Å; R27-E31 PolarHBondContact NH2-OE1 2.9Å; E31-S60 VanDerWaalsContact CD-OG 3.29Å; E31-S60 PolarHBondContact OE1-OG 3.31Å; E31-S60 WeakPolarHBondContact OE2-CB 3.35Å; E31-S60 PolarHBondContact OE2-OG 3.4Å; E31-F64 HydrophobicContact CB-CB 4.21Å; E31-F64 HydrophobicContact CG-CB 3.93Å; E31-F64 PolarHBondContact N-O 2.87Å; E31-C65 WeakPolarHBondContact O-CA 3.4Å; E31-C65 VanDerWaalsContact O-CB 3.26Å; E31-C65 WeakPolarHBondContact O-CB 3.45Å
32	K	87.9	Confident	87.8	Confident	174 Å²	174	95.5 Å²	95.5	76%	0.757	48%	0.479	S	S	*	.			trans	-110.9	148.6	179.5	-69.3	-161.7	172.5	-163.1	0	110.8	D34 E70	K32-D34 PolarHBondContact O-N 3.39Å; K32-E70 WeakPolarHBondContact CA-OE1 3.42Å; K32-E70 WeakPolarHBondContact CB-OE1 3.26Å
33	I	88.8	Confident	88.6	Confident	17 Å²	17	97.2 Å²	97.2	9%	0.087	49%	0.488	C	S	.	.			trans	-81.2	119.9	178.1	-58.3	176	0	0	0	108.7	W35 L38 C65 I67 E70	I33-W35 VanDerWaalsContact C-N 3.29Å; I33-W35 HydrophobicContact CB-CD2 4.31Å; I33-W35 HydrophobicContact CB-CZ2 4.29Å; I33-W35 HydrophobicContact CD1-CH2 4.11Å; I33-W35 HydrophobicContact CD1-CZ2 3.82Å; I33-W35 HydrophobicContact CG2-CD2 3.74Å; I33-W35 HydrophobicContact CG2-CE3 4.05Å; I33-W35 HydrophobicContact CG2-CG 4.1Å; I33-W35 HydrophobicContact CG2-CZ2 4.25Å; I33-W35 HydrophobicContact CG2-CZ3 4.43Å; I33-W35 PolarHBondContact O-N 3.44Å; I33-L38 HydrophobicContact CG2-CD2 4.01Å; I33-C65 HydrophobicContact CD1-CB 4.46Å; I33-C65 HydrophobicContact CG1-CB 3.86Å; I33-I67 HydrophobicContact CD1-CD1 4.41Å; I33-E70 HydrophobicContact CD1-CB 4.07Å; I33-E70 HydrophobicContact CD1-CG 4.13Å; I33-E70 HydrophobicContact CG1-CG 4.18Å; I33-E70 PolarHBondContact N-OE1 3.48Å
34	D	87.5	Confident	89.2	Confident	84 Å²	84	96.8 Å²	96.8	45%	0.449	48%	0.48	S	S	.	.			trans	-77.2	87.7	164	-174.3	-14	0	0	0	109	K32 K36 R37 L38	K32-D34 PolarHBondContact O-N 3.39Å; D34-K36 PolarHBondContact O-N 2.97Å; D34-K36 VanDerWaalsContact O-N 3.16Å; D34-K36 WeakPolarHBondContact OD1-CA 3.38Å; D34-K36 WeakPolarHBondContact OD1-CB 3.25Å; D34-K36 PolarHBondContact OD1-N 3.36Å; D34-R37 HydrophobicContact CB-CB 3.9Å; D34-R37 PolarHBondContact O-N 3.1Å; D34-R37 VanDerWaalsContact O-N 3.1Å; D34-R37 PolarHBondContact OD1-N 3.18Å; D34-L38 WeakPolarHBondContact O-CB 3.49Å; D34-L38 PolarHBondContact O-N 2.65Å
35	W	88.7	Confident	89.5	Confident	122 Å²	122	98.1 Å²	98.1	46%	0.462	48%	0.481	S	S	.	.	H	α-helix	trans	-56.8	-25.9	178.1	-66.2	101.8	0	0	0	113.6	I33 L38 A39 E70 I71	I33-W35 VanDerWaalsContact C-N 3.29Å; I33-W35 HydrophobicContact CB-CD2 4.31Å; I33-W35 HydrophobicContact CB-CZ2 4.29Å; I33-W35 HydrophobicContact CD1-CH2 4.11Å; I33-W35 HydrophobicContact CD1-CZ2 3.82Å; I33-W35 HydrophobicContact CG2-CD2 3.74Å; I33-W35 HydrophobicContact CG2-CE3 4.05Å; I33-W35 HydrophobicContact CG2-CG 4.1Å; I33-W35 HydrophobicContact CG2-CZ2 4.25Å; I33-W35 HydrophobicContact CG2-CZ3 4.43Å; I33-W35 PolarHBondContact O-N 3.44Å; W35-L38 HydrophobicContact CE3-CD2 4.22Å; W35-L38 HydrophobicContact CZ3-CD2 4.24Å; W35-A39 VanDerWaalsContact O-CB 3.26Å; W35-A39 WeakPolarHBondContact O-CB 3.49Å; W35-A39 PolarHBondContact O-N 3.46Å; W35-A39 VanDerWaalsContact O-N 3.12Å; W35-E70 HydrophobicContact CZ2-CB 4.15Å; W35-E70 PolarHBondContact NE1-OE2 3.28Å; W35-I71 HydrophobicContact CH2-CD1 4.42Å; W35-I71 HydrophobicContact CH2-CG1 4.27Å; W35-I71 HydrophobicContact CZ2-CG1 4.44Å
36	K	90.5	Very high	89.7	Confident	183 Å²	183	92 Å²	92	80%	0.796	45%	0.448	S	S	*	.	H	α-helix	trans	-76.3	-43.9	175.3	-64.7	179.4	179	177.2	0	110.9	D34 A39 S40	D34-K36 PolarHBondContact O-N 2.97Å; D34-K36 VanDerWaalsContact O-N 3.16Å; D34-K36 WeakPolarHBondContact OD1-CA 3.38Å; D34-K36 WeakPolarHBondContact OD1-CB 3.25Å; D34-K36 PolarHBondContact OD1-N 3.36Å; K36-A39 PolarHBondContact O-N 3.48Å; K36-S40 PolarHBondContact O-N 2.92Å
37	R	88.7	Confident	89.8	Confident	101 Å²	101	91.9 Å²	91.9	38%	0.381	46%	0.457	S	S	.	.	H	α-helix	trans	-64.1	-44.3	175.7	-164.2	178.4	-159.3	149	8.6	111	D34 A39 S40 I41 E57 I58	D34-R37 HydrophobicContact CB-CB 3.9Å; D34-R37 PolarHBondContact O-N 3.1Å; D34-R37 VanDerWaalsContact O-N 3.1Å; D34-R37 PolarHBondContact OD1-N 3.18Å; R37-A39 VanDerWaalsContact C-N 3.33Å; R37-A39 PolarHBondContact O-N 3.15Å; R37-S40 PolarHBondContact O-N 2.76Å; R37-S40 PolarHBondContact O-OG 3.02Å; R37-I41 WeakPolarHBondContact O-CG1 3.46Å; R37-E57 IonicContact CZ-OE2 2.83Å; R37-E57 IonicContact NE-OE2 3.56Å; R37-E57 PolarHBondContact NE-OE2 2.8Å; R37-E57 IonicContact NH2-OE1 2.72Å; R37-E57 PolarHBondContact NH2-OE1 3.12Å; R37-E57 IonicContact NH2-OE2 3.92Å; R37-E57 PolarHBondContact NH2-OE2 2.83Å; R37-I58 HydrophobicContact CG-CG2 4.23Å
38	L	89.5	Confident	90.1	Very high	65 Å²	65	94.2 Å²	94.2	34%	0.34	47%	0.471	S	S	.	.	H	α-helix	trans	-60.3	-41.1	176.4	-171	63.4	0	0	0	111.9	I33 D34 W35 S40 I41 I58	I33-L38 HydrophobicContact CG2-CD2 4.01Å; D34-L38 WeakPolarHBondContact O-CB 3.49Å; D34-L38 PolarHBondContact O-N 2.65Å; W35-L38 HydrophobicContact CE3-CD2 4.22Å; W35-L38 HydrophobicContact CZ3-CD2 4.24Å; L38-S40 VanDerWaalsContact C-N 3.3Å; L38-S40 PolarHBondContact O-N 2.74Å; L38-I41 PolarHBondContact O-N 3.04Å; L38-I58 HydrophobicContact CD1-CD1 4.14Å
39	A	90.6	Very high	90.3	Very high	87 Å²	87	91 Å²	91	72%	0.719	46%	0.462	S	S	*	.	H	α-helix	trans	-71.9	-18.1	175	0	0	0	0	0	114.5	W35 K36 R37 I41	W35-A39 VanDerWaalsContact O-CB 3.26Å; W35-A39 WeakPolarHBondContact O-CB 3.49Å; W35-A39 PolarHBondContact O-N 3.46Å; W35-A39 VanDerWaalsContact O-N 3.12Å; K36-A39 PolarHBondContact O-N 3.48Å; R37-A39 VanDerWaalsContact C-N 3.33Å; R37-A39 PolarHBondContact O-N 3.15Å; A39-I41 VanDerWaalsContact C-N 3.32Å
40	S	90.6	Very high	90.2	Very high	85 Å²	85	93.3 Å²	93.3	59%	0.594	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-8.5	176.6	75.2	0	0	0	0	114.1	K36 R37 L38	K36-S40 PolarHBondContact O-N 2.92Å; R37-S40 PolarHBondContact O-N 2.76Å; R37-S40 PolarHBondContact O-OG 3.02Å; L38-S40 VanDerWaalsContact C-N 3.3Å; L38-S40 PolarHBondContact O-N 2.74Å
41	I	90.4	Very high	90.2	Very high	29 Å²	29	90.1 Å²	90.1	15%	0.149	46%	0.461	C	S	.	.			trans	-91.7	115.6	-174.1	-73.7	168.5	0	0	0	110.7	R37 L38 A39 V43 I46 I58	R37-I41 WeakPolarHBondContact O-CG1 3.46Å; L38-I41 PolarHBondContact O-N 3.04Å; A39-I41 VanDerWaalsContact C-N 3.32Å; I41-V43 PolarHBondContact O-N 3.4Å; I41-I46 HydrophobicContact CG2-CD1 3.32Å; I41-I46 HydrophobicContact CG2-CG1 4.46Å; I41-I58 HydrophobicContact CD1-CB 4.37Å; I41-I58 HydrophobicContact CD1-CD1 3.8Å; I41-I58 HydrophobicContact CD1-CG1 4.09Å; I41-I58 HydrophobicContact CD1-CG2 3.43Å; I41-I58 VanDerWaalsContact CD1-CG2 3.43Å
42	D	90.1	Very high	90.3	Very high	71 Å²	71	90.7 Å²	90.7	38%	0.38	47%	0.465	S	S	.	.			trans	-81.8	102.8	169.8	-178.4	12.3	0	0	0	110.5	N44 R45 I46	D42-N44 PolarHBondContact O-N 2.89Å; D42-N44 WeakPolarHBondContact OD1-CA 3.5Å; D42-N44 VanDerWaalsContact OD1-CB 3.23Å; D42-N44 WeakPolarHBondContact OD1-CB 3.45Å; D42-N44 PolarHBondContact OD1-N 2.8Å; D42-N44 PolarHBondContact OD1-ND2 3.17Å; D42-R45 HydrophobicContact CB-CB 3.92Å; D42-R45 WeakPolarHBondContact O-CB 3.29Å; D42-R45 PolarHBondContact O-N 3.09Å; D42-R45 PolarHBondContact OD2-N 3.2Å; D42-I46 PolarHBondContact O-N 3.28Å; D42-I46 VanDerWaalsContact O-N 3.1Å
43	V	92.3	Very high	90.4	Very high	99 Å²	99	88 Å²	88	60%	0.6	46%	0.455	S	S	*	.	H	α-helix	trans	-56.9	-30.3	174.5	-176.8	0	0	0	0	111.8	I41 T47	I41-V43 PolarHBondContact O-N 3.4Å; V43-T47 WeakPolarHBondContact O-CB 3.4Å; V43-T47 PolarHBondContact O-N 3.35Å; V43-T47 PolarHBondContact O-OG1 3.49Å
44	N	92.6	Very high	90.5	Very high	101 Å²	101	88.1 Å²	88.1	54%	0.54	46%	0.457	S	S	.	.	H	α-helix	trans	-72.1	-34.8	177.3	-51.9	-88.9	0	0	0	111.7	D42 K48	D42-N44 PolarHBondContact O-N 2.89Å; D42-N44 WeakPolarHBondContact OD1-CA 3.5Å; D42-N44 VanDerWaalsContact OD1-CB 3.23Å; D42-N44 WeakPolarHBondContact OD1-CB 3.45Å; D42-N44 PolarHBondContact OD1-N 2.8Å; D42-N44 PolarHBondContact OD1-ND2 3.17Å; N44-K48 WeakPolarHBondContact O-CB 3.4Å; N44-K48 WeakPolarHBondContact O-CD 3.29Å; N44-K48 VanDerWaalsContact O-CG 3.22Å; N44-K48 WeakPolarHBondContact O-CG 3.5Å; N44-K48 PolarHBondContact O-N 2.7Å; N44-K48 VanDerWaalsContact O-N 3.16Å
45	R	90.4	Very high	90.6	Very high	90 Å²	90	88 Å²	88	34%	0.34	46%	0.456	S	S	.	.	H	α-helix	trans	-65.7	-51.2	172.7	-167.1	-175.8	75.2	-128.6	6.1	110.2	D42 T47 K48 D49 D51 S54	D42-R45 HydrophobicContact CB-CB 3.92Å; D42-R45 WeakPolarHBondContact O-CB 3.29Å; D42-R45 PolarHBondContact O-N 3.09Å; D42-R45 PolarHBondContact OD2-N 3.2Å; R45-T47 VanDerWaalsContact C-N 3.26Å; R45-T47 PolarHBondContact O-N 2.87Å; R45-K48 PolarHBondContact O-N 3.44Å; R45-K48 VanDerWaalsContact O-N 3.07Å; R45-D49 WeakPolarHBondContact CG-OD2 3.12Å; R45-D49 WeakPolarHBondContact O-CB 3.25Å; R45-D49 PolarHBondContact O-N 3.4Å; R45-D51 IonicContact CZ-OD2 3.59Å; R45-D51 IonicContact NE-OD2 3.7Å; R45-D51 PolarHBondContact NE-OD2 3.17Å; R45-D51 IonicContact NH2-OD2 3.7Å; R45-D51 PolarHBondContact NH2-OD2 3.14Å; R45-S54 PolarHBondContact NH2-OG 3.25Å; R45-S54 VanDerWaalsContact NH2-OG 3.1Å
46	I	91.5	Very high	90.7	Very high	21 Å²	21	85.1 Å²	85.1	11%	0.108	45%	0.448	C	S	.	.	H	α-helix	trans	-53.7	-45	176.1	-69.3	172.6	0	0	0	111.3	I41 D42 K48 V50 D51 L55	I41-I46 HydrophobicContact CG2-CD1 3.32Å; I41-I46 HydrophobicContact CG2-CG1 4.46Å; D42-I46 PolarHBondContact O-N 3.28Å; D42-I46 VanDerWaalsContact O-N 3.1Å; I46-K48 VanDerWaalsContact C-N 3.34Å; I46-K48 PolarHBondContact O-N 2.91Å; I46-V50 VanDerWaalsContact O-CA 3.31Å; I46-V50 WeakPolarHBondContact O-CA 3.43Å; I46-V50 PolarHBondContact O-N 2.97Å; I46-D51 HydrophobicContact CG1-CB 4.07Å; I46-L55 HydrophobicContact CD1-CD2 3.92Å; I46-L55 HydrophobicContact CD1-CG 4.06Å; I46-L55 HydrophobicContact CG2-CD1 3.7Å; I46-L55 HydrophobicContact CG2-CD2 4.09Å; I46-L55 HydrophobicContact CG2-CG 3.82Å
47	T	92.9	Very high	90.6	Very high	109 Å²	109	81.9 Å²	81.9	67%	0.669	44%	0.435	S	S	*	.	H	α-helix	trans	-67.5	-29.1	-179.2	-54	0	0	0	0	113.4	V43 R45	V43-T47 WeakPolarHBondContact O-CB 3.4Å; V43-T47 PolarHBondContact O-N 3.35Å; V43-T47 PolarHBondContact O-OG1 3.49Å; R45-T47 VanDerWaalsContact C-N 3.26Å; R45-T47 PolarHBondContact O-N 2.87Å
48	K	93.6	Very high	90.7	Very high	161 Å²	161	78 Å²	78	70%	0.7	42%	0.422	S	S	*	.	H	α-helix	trans	-89.5	-46.5	-179.3	-71.9	167.7	-174.1	171.3	0	112.9	N44 R45 I46	N44-K48 WeakPolarHBondContact O-CB 3.4Å; N44-K48 WeakPolarHBondContact O-CD 3.29Å; N44-K48 VanDerWaalsContact O-CG 3.22Å; N44-K48 WeakPolarHBondContact O-CG 3.5Å; N44-K48 PolarHBondContact O-N 2.7Å; N44-K48 VanDerWaalsContact O-N 3.16Å; R45-K48 PolarHBondContact O-N 3.44Å; R45-K48 VanDerWaalsContact O-N 3.07Å; I46-K48 VanDerWaalsContact C-N 3.34Å; I46-K48 PolarHBondContact O-N 2.91Å
49	D	91.8	Very high	90.8	Very high	114 Å²	114	77 Å²	77	61%	0.61	42%	0.417	S	S	*	.	H	α-helix	trans	-97.2	-10	-167.1	-57.1	-18.7	0	0	0	112	R45	R45-D49 WeakPolarHBondContact CG-OD2 3.12Å; R45-D49 WeakPolarHBondContact O-CB 3.25Å; R45-D49 PolarHBondContact O-N 3.4Å
50	V	89	Confident	90.8	Very high	101 Å²	101	75.3 Å²	75.3	61%	0.612	40%	0.4	S	S	*	.			trans	55.6	52	-174.6	-162.8	0	0	0	0	110.8	I46 I52	I46-V50 VanDerWaalsContact O-CA 3.31Å; I46-V50 WeakPolarHBondContact O-CA 3.43Å; I46-V50 PolarHBondContact O-N 2.97Å; V50-I52 VanDerWaalsContact C-N 3.29Å; V50-I52 HydrophobicContact CG1-CD1 4.22Å; V50-I52 HydrophobicContact CG1-CG1 4.06Å; V50-I52 PolarHBondContact O-N 3.21Å
51	D	89.1	Confident	90.8	Very high	30 Å²	30	72.4 Å²	72.4	16%	0.16	38%	0.38	C	S	.	.			trans	-74.2	78.1	179.3	-174.4	-21.8	0	0	0	110.2	R45 I46 E53 S54	R45-D51 IonicContact CZ-OD2 3.59Å; R45-D51 IonicContact NE-OD2 3.7Å; R45-D51 PolarHBondContact NE-OD2 3.17Å; R45-D51 IonicContact NH2-OD2 3.7Å; R45-D51 PolarHBondContact NH2-OD2 3.14Å; I46-D51 HydrophobicContact CG1-CB 4.07Å; D51-E53 VanDerWaalsContact C-N 3.34Å; D51-S54 WeakPolarHBondContact OD1-CB 3.49Å; D51-S54 PolarHBondContact OD1-N 3.2Å; D51-S54 PolarHBondContact OD1-OG 2.79Å; D51-S54 PolarHBondContact OD2-OG 3.27Å; D51-S54 VanDerWaalsContact OD2-OG 3.06Å
52	I	90	Very high	90.9	Very high	61 Å²	61	73.2 Å²	73.2	31%	0.313	39%	0.385	S	S	.	.	H	α-helix	trans	-69.7	-34.7	-177.8	-60.5	162.9	0	0	0	110.5	V50 S54 L55 Q56 F395	V50-I52 VanDerWaalsContact C-N 3.29Å; V50-I52 HydrophobicContact CG1-CD1 4.22Å; V50-I52 HydrophobicContact CG1-CG1 4.06Å; V50-I52 PolarHBondContact O-N 3.21Å; I52-S54 VanDerWaalsContact C-N 3.35Å; I52-S54 PolarHBondContact O-N 3.16Å; I52-L55 WeakPolarHBondContact O-CB 3.31Å; I52-L55 PolarHBondContact O-N 2.89Å; I52-L55 VanDerWaalsContact O-N 3.11Å; I52-Q56 WeakPolarHBondContact O-CB 3.41Å; I52-Q56 PolarHBondContact O-N 3.33Å; I52-F395 HydrophobicContact CD1-CE1 4.49Å; I52-F395 HydrophobicContact CG2-CD2 4.47Å; I52-F395 HydrophobicContact CG2-CE1 4.39Å; I52-F395 HydrophobicContact CG2-CE2 3.56Å; I52-F395 HydrophobicContact CG2-CZ 3.52Å
53	E	90.2	Very high	91	Very high	118 Å²	118	70 Å²	70	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-53.4	-49.3	174.8	-75.6	83.5	166.2	0	0	111.5	D51 L55 Q56 E57	D51-E53 VanDerWaalsContact C-N 3.34Å; E53-L55 VanDerWaalsContact C-N 3.3Å; E53-L55 PolarHBondContact O-N 2.97Å; E53-Q56 PolarHBondContact O-N 3.16Å; E53-E57 WeakPolarHBondContact O-CG 3.38Å; E53-E57 PolarHBondContact O-N 3.41Å
54	S	90	Very high	91.1	Very high	18 Å²	18	66.5 Å²	66.5	13%	0.126	35%	0.345	C	S	.	.	H	α-helix	trans	-63.5	-32.2	177.4	-60.7	0	0	0	0	113.5	R45 D51 I52	R45-S54 PolarHBondContact NH2-OG 3.25Å; R45-S54 VanDerWaalsContact NH2-OG 3.1Å; D51-S54 WeakPolarHBondContact OD1-CB 3.49Å; D51-S54 PolarHBondContact OD1-N 3.2Å; D51-S54 PolarHBondContact OD1-OG 2.79Å; D51-S54 PolarHBondContact OD2-OG 3.27Å; D51-S54 VanDerWaalsContact OD2-OG 3.06Å; I52-S54 VanDerWaalsContact C-N 3.35Å; I52-S54 PolarHBondContact O-N 3.16Å
55	L	90.3	Very high	91.1	Very high	81 Å²	81	61.7 Å²	61.7	42%	0.424	32%	0.319	S	S	.	.	H	α-helix	trans	-71.2	-46.4	174.6	-73.7	173.6	0	0	0	111.9	I46 I52 E53 E57 I58 L59	I46-L55 HydrophobicContact CD1-CD2 3.92Å; I46-L55 HydrophobicContact CD1-CG 4.06Å; I46-L55 HydrophobicContact CG2-CD1 3.7Å; I46-L55 HydrophobicContact CG2-CD2 4.09Å; I46-L55 HydrophobicContact CG2-CG 3.82Å; I52-L55 WeakPolarHBondContact O-CB 3.31Å; I52-L55 PolarHBondContact O-N 2.89Å; I52-L55 VanDerWaalsContact O-N 3.11Å; E53-L55 VanDerWaalsContact C-N 3.3Å; E53-L55 PolarHBondContact O-N 2.97Å; L55-E57 PolarHBondContact O-N 2.94Å; L55-I58 WeakPolarHBondContact O-CG1 3.45Å; L55-I58 PolarHBondContact O-N 2.98Å; L55-L59 WeakPolarHBondContact O-CB 3.35Å; L55-L59 PolarHBondContact O-N 3.42Å
56	Q	90	Very high	91.2	Very high	63 Å²	63	59.6 Å²	59.6	29%	0.294	32%	0.315	S	S	.	.	H	α-helix	trans	-60.5	-33.6	-177.9	-170.2	67.9	20.7	0	0	111.8	I52 E53	I52-Q56 WeakPolarHBondContact O-CB 3.41Å; I52-Q56 PolarHBondContact O-N 3.33Å; E53-Q56 PolarHBondContact O-N 3.16Å
57	E	89.1	Confident	91.1	Very high	114 Å²	114	59 Å²	59	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-68.1	-33.4	178.7	-74.5	-169.8	151.2	0	0	114.6	R37 E53 L55	R37-E57 IonicContact CZ-OE2 2.83Å; R37-E57 IonicContact NE-OE2 3.56Å; R37-E57 PolarHBondContact NE-OE2 2.8Å; R37-E57 IonicContact NH2-OE1 2.72Å; R37-E57 PolarHBondContact NH2-OE1 3.12Å; R37-E57 IonicContact NH2-OE2 3.92Å; R37-E57 PolarHBondContact NH2-OE2 2.83Å; E53-E57 WeakPolarHBondContact O-CG 3.38Å; E53-E57 PolarHBondContact O-N 3.41Å; L55-E57 PolarHBondContact O-N 2.94Å
58	I	91.1	Very high	90.9	Very high	21 Å²	21	56.5 Å²	56.5	11%	0.108	30%	0.297	C	S	.	.	H	α-helix	trans	-92.7	-20	176.7	55.6	163.7	0	0	0	113.5	R37 L38 I41 L55 S60 S61 V62	R37-I58 HydrophobicContact CG-CG2 4.23Å; L38-I58 HydrophobicContact CD1-CD1 4.14Å; I41-I58 HydrophobicContact CD1-CB 4.37Å; I41-I58 HydrophobicContact CD1-CD1 3.8Å; I41-I58 HydrophobicContact CD1-CG1 4.09Å; I41-I58 HydrophobicContact CD1-CG2 3.43Å; I41-I58 VanDerWaalsContact CD1-CG2 3.43Å; L55-I58 WeakPolarHBondContact O-CG1 3.45Å; L55-I58 PolarHBondContact O-N 2.98Å; I58-S60 PolarHBondContact O-N 3.27Å; I58-S61 PolarHBondContact O-N 2.7Å; I58-S61 PolarHBondContact O-OG 3.08Å; I58-V62 HydrophobicContact CB-CG2 4.3Å; I58-V62 HydrophobicContact CD1-CG2 4.4Å; I58-V62 PolarHBondContact O-N 2.9Å; I58-V62 VanDerWaalsContact O-N 3.12Å
59	L	91.8	Very high	90.6	Very high	44 Å²	44	55 Å²	55	23%	0.23	30%	0.297	C	S	.	.	H	α-helix	trans	-43.8	-57.6	-169.5	-175.9	56.7	0	0	0	113.3	L55 S61 V62 T63 V91 L95	L55-L59 WeakPolarHBondContact O-CB 3.35Å; L55-L59 PolarHBondContact O-N 3.42Å; L59-S61 PolarHBondContact O-N 3.43Å; L59-V62 PolarHBondContact O-N 2.83Å; L59-T63 HydrophobicContact CD1-CG2 4.02Å; L59-T63 WeakPolarHBondContact O-CG2 3.25Å; L59-T63 PolarHBondContact O-N 2.83Å; L59-T63 PolarHBondContact O-OG1 3.2Å; L59-T63 VanDerWaalsContact O-OG1 3.08Å; L59-V91 HydrophobicContact CD1-CG1 3.92Å; L59-L95 HydrophobicContact CD2-CD2 4.1Å
60	S	91.2	Very high	90.4	Very high	50 Å²	50	52 Å²	52	35%	0.35	28%	0.279	S	S	.	.	H	α-helix	trans	-56.6	-46.5	179.2	-165.3	0	0	0	0	112.9	E31 I58 V62 T63 F64	E31-S60 VanDerWaalsContact CD-OG 3.29Å; E31-S60 PolarHBondContact OE1-OG 3.31Å; E31-S60 WeakPolarHBondContact OE2-CB 3.35Å; E31-S60 PolarHBondContact OE2-OG 3.4Å; I58-S60 PolarHBondContact O-N 3.27Å; S60-V62 PolarHBondContact O-N 3.42Å; S60-T63 PolarHBondContact O-N 2.83Å; S60-T63 PolarHBondContact O-OG1 3.39Å; S60-F64 WeakPolarHBondContact O-CB 3.49Å; S60-F64 WeakPolarHBondContact O-CD2 3.3Å; S60-F64 PolarHBondContact O-N 3.23Å; S60-F64 WeakPolarHBondContact OG-CD2 3.39Å
61	S	90.4	Very high	90.3	Very high	25 Å²	25	49.8 Å²	49.8	18%	0.175	26%	0.263	C	S	.	.	H	α-helix	trans	-67.3	-21.8	-177.9	70.8	0	0	0	0	113.7	I58 L59 C65	I58-S61 PolarHBondContact O-N 2.7Å; I58-S61 PolarHBondContact O-OG 3.08Å; L59-S61 PolarHBondContact O-N 3.43Å; S61-C65 WeakPolarHBondContact O-CB 3.32Å; S61-C65 PolarHBondContact O-SG 2.7Å
62	V	92.2	Very high	90.1	Very high	45 Å²	45	51.6 Å²	51.6	27%	0.273	27%	0.272	S	S	.	.	H	α-helix	trans	-92.8	-37.1	177.2	178.6	0	0	0	0	111.2	I58 L59 S60 C65 F84 Q88	I58-V62 HydrophobicContact CB-CG2 4.3Å; I58-V62 HydrophobicContact CD1-CG2 4.4Å; I58-V62 PolarHBondContact O-N 2.9Å; I58-V62 VanDerWaalsContact O-N 3.12Å; L59-V62 PolarHBondContact O-N 2.83Å; S60-V62 PolarHBondContact O-N 3.42Å; V62-C65 PolarHBondContact O-SG 3.26Å; V62-F84 HydrophobicContact CG1-CE2 4.49Å; V62-F84 HydrophobicContact CG1-CZ 4.04Å; V62-Q88 PolarHBondContact O-NE2 3.03Å
63	T	92.6	Very high	89.9	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.025	28%	0.275	C	S	.	.	H	α-helix	trans	-76	-35.2	-179.6	54.7	0	0	0	0	113.4	R29 L59 S60 Q88 V91 L95	R29-T63 PolarHBondContact NE-O 2.77Å; L59-T63 HydrophobicContact CD1-CG2 4.02Å; L59-T63 WeakPolarHBondContact O-CG2 3.25Å; L59-T63 PolarHBondContact O-N 2.83Å; L59-T63 PolarHBondContact O-OG1 3.2Å; L59-T63 VanDerWaalsContact O-OG1 3.08Å; S60-T63 PolarHBondContact O-N 2.83Å; S60-T63 PolarHBondContact O-OG1 3.39Å; T63-Q88 PolarHBondContact O-NE2 3.37Å; T63-V91 HydrophobicContact CG2-CB 3.84Å; T63-V91 HydrophobicContact CG2-CG1 3.39Å; T63-L95 HydrophobicContact CG2-CD1 4.3Å
64	F	93.2	Very high	89.7	Confident	25 Å²	25	54.9 Å²	54.9	11%	0.11	28%	0.282	C	S	.	.	S	Bend	trans	-110	9.9	-171	-55.2	-63	0	0	0	115	R27 R29 T30 E31 S60 E92	R27-F64 HydrophobicContact CB-CD1 4.12Å; R27-F64 HydrophobicContact CB-CE1 4.08Å; R27-F64 HydrophobicContact CG-CD1 4.37Å; R29-F64 CarbonylContact C-O 3.59Å; R29-F64 VanDerWaalsContact CA-O 3.26Å; R29-F64 WeakPolarHBondContact CA-O 3.3Å; T30-F64 PolarHBondContact N-O 3.18Å; E31-F64 HydrophobicContact CB-CB 4.21Å; E31-F64 HydrophobicContact CG-CB 3.93Å; E31-F64 PolarHBondContact N-O 2.87Å; S60-F64 WeakPolarHBondContact O-CB 3.49Å; S60-F64 WeakPolarHBondContact O-CD2 3.3Å; S60-F64 PolarHBondContact O-N 3.23Å; S60-F64 WeakPolarHBondContact OG-CD2 3.39Å; F64-E92 HydrophobicContact CE1-CG 4.01Å
65	C	92.4	Very high	89.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-82.5	155.2	173.7	63.6	0	0	0	0	113.4	R29 E31 I33 S61 V62 I67 Q88	R29-C65 WeakPolarHBondContact CD-O 3.49Å; E31-C65 WeakPolarHBondContact O-CA 3.4Å; E31-C65 VanDerWaalsContact O-CB 3.26Å; E31-C65 WeakPolarHBondContact O-CB 3.45Å; I33-C65 HydrophobicContact CD1-CB 4.46Å; I33-C65 HydrophobicContact CG1-CB 3.86Å; S61-C65 WeakPolarHBondContact O-CB 3.32Å; S61-C65 PolarHBondContact O-SG 2.7Å; V62-C65 PolarHBondContact O-SG 3.26Å; C65-I67 PolarHBondContact O-N 2.93Å; C65-Q88 PolarHBondContact O-NE2 3.31Å; C65-Q88 PolarHBondContact SG-NE2 2.87Å
66	D	92.3	Very high	89.6	Confident	46 Å²	46	61.2 Å²	61.2	25%	0.246	31%	0.305	C	S	.	.			trans	-94.1	95	170.1	-169.4	-11.6	0	0	0	110.1	R29 T68 N69 E70	R29-D66 HydrophobicContact CB-CB 3.96Å; D66-T68 PolarHBondContact O-N 3.45Å; D66-T68 WeakPolarHBondContact OD1-CB 3.36Å; D66-T68 PolarHBondContact OD1-N 3.45Å; D66-T68 PolarHBondContact OD1-OG1 3.01Å; D66-N69 PolarHBondContact O-N 2.9Å; D66-N69 PolarHBondContact OD2-ND2 2.73Å; D66-E70 PolarHBondContact O-N 2.93Å
67	I	90.2	Very high	89.7	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.041	31%	0.312	C	S	.	.	H	α-helix	trans	-54.6	-24.8	178.1	-165.2	64	0	0	0	113.1	I33 C65 N69 I71 I81 F84 Q85	I33-I67 HydrophobicContact CD1-CD1 4.41Å; C65-I67 PolarHBondContact O-N 2.93Å; I67-N69 VanDerWaalsContact C-N 3.32Å; I67-I71 HydrophobicContact CD1-CD1 3.46Å; I67-I71 VanDerWaalsContact CD1-CD1 3.46Å; I67-I71 HydrophobicContact CD1-CG1 3.98Å; I67-I71 HydrophobicContact CG1-CD1 4.12Å; I67-I71 PolarHBondContact O-N 2.91Å; I67-I81 HydrophobicContact CG2-CG2 4.15Å; I67-F84 HydrophobicContact CB-CD1 3.62Å; I67-F84 HydrophobicContact CB-CE1 3.83Å; I67-F84 HydrophobicContact CD1-CD1 3.84Å; I67-F84 HydrophobicContact CD1-CE1 3.68Å; I67-F84 HydrophobicContact CD1-CE2 4.48Å; I67-F84 HydrophobicContact CD1-CG 4.29Å; I67-F84 HydrophobicContact CD1-CZ 4.03Å; I67-F84 HydrophobicContact CG1-CB 4.48Å; I67-F84 HydrophobicContact CG1-CD1 3.53Å; I67-F84 HydrophobicContact CG1-CE1 3.86Å; I67-F84 HydrophobicContact CG1-CG 4.04Å; I67-F84 HydrophobicContact CG2-CD1 3.91Å; I67-Q85 HydrophobicContact CG2-CG 3.76Å
68	T	88.8	Confident	89.8	Confident	57 Å²	57	61.4 Å²	61.4	35%	0.35	31%	0.311	S	S	.	.	H	α-helix	trans	-73.9	-22.8	-179.8	-22.3	0	0	0	0	112.8	D66 T73 Q85	D66-T68 PolarHBondContact O-N 3.45Å; D66-T68 WeakPolarHBondContact OD1-CB 3.36Å; D66-T68 PolarHBondContact OD1-N 3.45Å; D66-T68 PolarHBondContact OD1-OG1 3.01Å; T68-T73 HydrophobicContact CG2-CG2 4.12Å; T68-Q85 PolarHBondContact OG1-NE2 3.24Å
69	N	87.8	Confident	90	Very high	131 Å²	131	65 Å²	65	70%	0.701	33%	0.331	S	S	*	.	H	α-helix	trans	-100.8	-22.3	177.4	-60.6	-41.2	0	0	0	112.5	D66 I67	D66-N69 PolarHBondContact O-N 2.9Å; D66-N69 PolarHBondContact OD2-ND2 2.73Å; I67-N69 VanDerWaalsContact C-N 3.32Å
70	E	87.2	Confident	90	Very high	51 Å²	51	67.8 Å²	67.8	24%	0.238	35%	0.346	C	S	.	.	H	α-helix	trans	-87.3	-16.1	179.9	-70.7	-79.2	172.5	0	0	113.1	K32 I33 W35 D66	K32-E70 WeakPolarHBondContact CA-OE1 3.42Å; K32-E70 WeakPolarHBondContact CB-OE1 3.26Å; I33-E70 HydrophobicContact CD1-CB 4.07Å; I33-E70 HydrophobicContact CD1-CG 4.13Å; I33-E70 HydrophobicContact CG1-CG 4.18Å; I33-E70 PolarHBondContact N-OE1 3.48Å; W35-E70 HydrophobicContact CZ2-CB 4.15Å; W35-E70 PolarHBondContact NE1-OE2 3.28Å; D66-E70 PolarHBondContact O-N 2.93Å
71	I	87	Confident	90.1	Very high	54 Å²	54	66 Å²	66	28%	0.277	33%	0.332	S	S	.	.	S	Bend	trans	-128.6	136.6	-179.9	-63.7	-174.3	0	0	0	111.2	W35 I67 T73 V76	W35-I71 HydrophobicContact CH2-CD1 4.42Å; W35-I71 HydrophobicContact CH2-CG1 4.27Å; W35-I71 HydrophobicContact CZ2-CG1 4.44Å; I67-I71 HydrophobicContact CD1-CD1 3.46Å; I67-I71 VanDerWaalsContact CD1-CD1 3.46Å; I67-I71 HydrophobicContact CD1-CG1 3.98Å; I67-I71 HydrophobicContact CG1-CD1 4.12Å; I67-I71 PolarHBondContact O-N 2.91Å; I71-T73 PolarHBondContact O-N 3.45Å; I71-T73 VanDerWaalsContact O-N 3.09Å; I71-V76 HydrophobicContact CG2-CB 4.36Å; I71-V76 HydrophobicContact CG2-CG2 3.68Å
72	D	84.6	Confident	90.3	Very high	67 Å²	67	70.4 Å²	70.4	36%	0.358	35%	0.348	S	S	.	.			trans	-71.4	102.6	171.8	-170.9	-21.1	0	0	0	110.9	R74 Y75	D72-R74 PolarHBondContact O-N 2.79Å; D72-R74 VanDerWaalsContact OD1-CB 3.27Å; D72-R74 WeakPolarHBondContact OD1-CB 3.2Å; D72-R74 VanDerWaalsContact OD1-CG 3.3Å; D72-R74 WeakPolarHBondContact OD1-CG 3.21Å; D72-R74 IonicContact OD1-CZ 2.65Å; D72-R74 PolarHBondContact OD1-N 2.63Å; D72-R74 VanDerWaalsContact OD1-N 3.1Å; D72-R74 IonicContact OD1-NE 3.86Å; D72-R74 PolarHBondContact OD1-NE 3.17Å; D72-R74 IonicContact OD1-NH2 2.75Å; D72-R74 IonicContact OD2-CZ 3.2Å; D72-R74 IonicContact OD2-NE 2.95Å; D72-R74 PolarHBondContact OD2-NE 2.82Å; D72-R74 IonicContact OD2-NH2 3.88Å; D72-R74 PolarHBondContact OD2-NH2 2.9Å; D72-Y75 HydrophobicContact CB-CD2 4.03Å; D72-Y75 PolarHBondContact O-N 3.29Å; D72-Y75 VanDerWaalsContact O-N 3.13Å; D72-Y75 WeakPolarHBondContact OD2-CE2 3.36Å
73	T	85.3	Confident	90.4	Very high	59 Å²	59	73.6 Å²	73.6	36%	0.362	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-8.7	-175.7	63	0	0	0	0	114.4	T68 I71 Y75 I81	T68-T73 HydrophobicContact CG2-CG2 4.12Å; I71-T73 PolarHBondContact O-N 3.45Å; I71-T73 VanDerWaalsContact O-N 3.09Å; T73-Y75 VanDerWaalsContact C-N 3.3Å; T73-I81 HydrophobicContact CG2-CD1 3.76Å
74	R	86.3	Confident	90.5	Very high	189 Å²	189	76.5 Å²	76.5	71%	0.713	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-17.4	175	-58.5	176.7	-65.8	169.6	1.6	113.4	D72	D72-R74 PolarHBondContact O-N 2.79Å; D72-R74 VanDerWaalsContact OD1-CB 3.27Å; D72-R74 WeakPolarHBondContact OD1-CB 3.2Å; D72-R74 VanDerWaalsContact OD1-CG 3.3Å; D72-R74 WeakPolarHBondContact OD1-CG 3.21Å; D72-R74 IonicContact OD1-CZ 2.65Å; D72-R74 PolarHBondContact OD1-N 2.63Å; D72-R74 VanDerWaalsContact OD1-N 3.1Å; D72-R74 IonicContact OD1-NE 3.86Å; D72-R74 PolarHBondContact OD1-NE 3.17Å; D72-R74 IonicContact OD1-NH2 2.75Å; D72-R74 IonicContact OD2-CZ 3.2Å; D72-R74 IonicContact OD2-NE 2.95Å; D72-R74 PolarHBondContact OD2-NE 2.82Å; D72-R74 IonicContact OD2-NH2 3.88Å; D72-R74 PolarHBondContact OD2-NH2 2.9Å
75	Y	89.1	Confident	90.5	Very high	183 Å²	183	78.6 Å²	78.6	72%	0.718	39%	0.385	S	S	*	.	S	Bend	trans	-114.3	2.2	-175	-61.4	-78.5	0	0	0	114.1	D72 T73	D72-Y75 HydrophobicContact CB-CD2 4.03Å; D72-Y75 PolarHBondContact O-N 3.29Å; D72-Y75 VanDerWaalsContact O-N 3.13Å; D72-Y75 WeakPolarHBondContact OD2-CE2 3.36Å; T73-Y75 VanDerWaalsContact C-N 3.3Å
76	V	89.2	Confident	90.7	Very high	50 Å²	50	83.5 Å²	83.5	30%	0.303	41%	0.411	S	S	.	.	S	Bend	trans	-131.6	139	-176	-179.6	0	0	0	0	109.8	I71 N78 L80 I81	I71-V76 HydrophobicContact CG2-CB 4.36Å; I71-V76 HydrophobicContact CG2-CG2 3.68Å; V76-N78 PolarHBondContact O-N 2.79Å; V76-L80 HydrophobicContact CG1-CB 4.11Å; V76-L80 HydrophobicContact CG1-CD1 4.22Å; V76-I81 HydrophobicContact CG1-CG1 4.15Å
77	D	92.6	Very high	90.9	Very high	82 Å²	82	83.3 Å²	83.3	44%	0.439	42%	0.416	S	S	.	.			trans	-61.8	128.9	175.7	-177.6	3	0	0	0	110.8	N79 L80 I81	D77-N79 VanDerWaalsContact CG-ND2 3.33Å; D77-N79 PolarHBondContact O-N 3.27Å; D77-N79 PolarHBondContact OD1-N 3.09Å; D77-N79 PolarHBondContact OD1-ND2 2.82Å; D77-N79 WeakPolarHBondContact OD2-CB 3.45Å; D77-N79 PolarHBondContact OD2-ND2 3.34Å; D77-L80 HydrophobicContact CB-CD1 4.3Å; D77-L80 HydrophobicContact CB-CG 4.26Å; D77-L80 WeakPolarHBondContact O-CB 3.48Å; D77-L80 PolarHBondContact O-N 2.73Å; D77-I81 PolarHBondContact O-N 3.29Å
78	N	91.6	Very high	91.1	Very high	98 Å²	98	83.4 Å²	83.4	52%	0.524	42%	0.416	S	S	.	.	H	α-helix	trans	-50.9	-27.8	171	-71.3	-63	0	0	0	113.2	V76 K82	V76-N78 PolarHBondContact O-N 2.79Å; N78-K82 WeakPolarHBondContact O-CB 3.49Å; N78-K82 VanDerWaalsContact O-CG 3.25Å; N78-K82 WeakPolarHBondContact O-CG 3.42Å; N78-K82 PolarHBondContact O-N 3.2Å
79	N	93.8	Very high	91.3	Very high	98 Å²	98	83.7 Å²	83.7	52%	0.524	42%	0.416	S	S	.	.	H	α-helix	trans	-69.4	-34.8	174.6	-56.5	-50.8	0	0	0	112.6	D77 L83	D77-N79 VanDerWaalsContact CG-ND2 3.33Å; D77-N79 PolarHBondContact O-N 3.27Å; D77-N79 PolarHBondContact OD1-N 3.09Å; D77-N79 PolarHBondContact OD1-ND2 2.82Å; D77-N79 WeakPolarHBondContact OD2-CB 3.45Å; D77-N79 PolarHBondContact OD2-ND2 3.34Å; N79-L83 VanDerWaalsContact O-CB 3.29Å; N79-L83 WeakPolarHBondContact O-CB 3.47Å; N79-L83 PolarHBondContact O-N 3.06Å
80	L	93.5	Very high	91.7	Very high	102 Å²	102	82.9 Å²	82.9	53%	0.534	41%	0.411	S	S	.	.	H	α-helix	trans	-70.3	-39	174	-64.2	173.2	0	0	0	111.2	V76 D77 L83 F84	V76-L80 HydrophobicContact CG1-CB 4.11Å; V76-L80 HydrophobicContact CG1-CD1 4.22Å; D77-L80 HydrophobicContact CB-CD1 4.3Å; D77-L80 HydrophobicContact CB-CG 4.26Å; D77-L80 WeakPolarHBondContact O-CB 3.48Å; D77-L80 PolarHBondContact O-N 2.73Å; L80-L83 PolarHBondContact O-N 3.17Å; L80-F84 WeakPolarHBondContact O-CB 3.34Å; L80-F84 PolarHBondContact O-N 3.34Å
81	I	92.6	Very high	92.1	Very high	13 Å²	13	83 Å²	83	7%	0.067	41%	0.414	C	S	.	.	H	α-helix	trans	-61.1	-47.4	174.3	-61.1	171.1	0	0	0	110.2	I67 T73 V76 D77 F84 Q85	I67-I81 HydrophobicContact CG2-CG2 4.15Å; T73-I81 HydrophobicContact CG2-CD1 3.76Å; V76-I81 HydrophobicContact CG1-CG1 4.15Å; D77-I81 PolarHBondContact O-N 3.29Å; I81-F84 PolarHBondContact O-N 3.48Å; I81-Q85 WeakPolarHBondContact O-CG 3.45Å; I81-Q85 PolarHBondContact O-N 3.31Å
82	K	93.7	Very high	92.4	Very high	117 Å²	117	81.1 Å²	81.1	51%	0.509	41%	0.405	S	S	.	.	H	α-helix	trans	-62.1	-42.1	174.7	-72.7	168.3	-175.2	173.3	0	112.6	N78 F84 Q85 L86	N78-K82 WeakPolarHBondContact O-CB 3.49Å; N78-K82 VanDerWaalsContact O-CG 3.25Å; N78-K82 WeakPolarHBondContact O-CG 3.42Å; N78-K82 PolarHBondContact O-N 3.2Å; K82-F84 VanDerWaalsContact C-N 3.31Å; K82-F84 PolarHBondContact O-N 3.44Å; K82-Q85 PolarHBondContact O-N 2.9Å; K82-L86 WeakPolarHBondContact O-CB 3.23Å; K82-L86 VanDerWaalsContact O-CG 3.3Å; K82-L86 WeakPolarHBondContact O-CG 3.22Å; K82-L86 PolarHBondContact O-N 3.48Å
83	L	95.6	Very high	92.9	Very high	111 Å²	111	83.5 Å²	83.5	58%	0.581	41%	0.409	S	S	*	.	H	α-helix	trans	-60.4	-42.1	176.8	179.7	62.9	0	0	0	111.1	N79 L80 L86 A87	N79-L83 VanDerWaalsContact O-CB 3.29Å; N79-L83 WeakPolarHBondContact O-CB 3.47Å; N79-L83 PolarHBondContact O-N 3.06Å; L80-L83 PolarHBondContact O-N 3.17Å; L83-L86 PolarHBondContact O-N 3.47Å; L83-A87 WeakPolarHBondContact O-CB 3.3Å; L83-A87 PolarHBondContact O-N 3.21Å
84	F	94.1	Very high	93.3	Very high	66 Å²	66	85.9 Å²	85.9	29%	0.289	42%	0.419	S	S	.	.	H	α-helix	trans	-66.3	-45.4	175.4	-167.8	-88.9	0	0	0	112.1	V62 I67 L80 I81 K82 L86 A87 Q88	V62-F84 HydrophobicContact CG1-CE2 4.49Å; V62-F84 HydrophobicContact CG1-CZ 4.04Å; I67-F84 HydrophobicContact CB-CD1 3.62Å; I67-F84 HydrophobicContact CB-CE1 3.83Å; I67-F84 HydrophobicContact CD1-CD1 3.84Å; I67-F84 HydrophobicContact CD1-CE1 3.68Å; I67-F84 HydrophobicContact CD1-CE2 4.48Å; I67-F84 HydrophobicContact CD1-CG 4.29Å; I67-F84 HydrophobicContact CD1-CZ 4.03Å; I67-F84 HydrophobicContact CG1-CB 4.48Å; I67-F84 HydrophobicContact CG1-CD1 3.53Å; I67-F84 HydrophobicContact CG1-CE1 3.86Å; I67-F84 HydrophobicContact CG1-CG 4.04Å; I67-F84 HydrophobicContact CG2-CD1 3.91Å; L80-F84 WeakPolarHBondContact O-CB 3.34Å; L80-F84 PolarHBondContact O-N 3.34Å; I81-F84 PolarHBondContact O-N 3.48Å; K82-F84 VanDerWaalsContact C-N 3.31Å; K82-F84 PolarHBondContact O-N 3.44Å; F84-L86 VanDerWaalsContact C-N 3.32Å; F84-L86 PolarHBondContact O-N 3.3Å; F84-A87 WeakPolarHBondContact O-CB 3.38Å; F84-A87 PolarHBondContact O-N 2.91Å; F84-A87 VanDerWaalsContact O-N 3.14Å; F84-Q88 HydrophobicContact CD1-CG 3.94Å; F84-Q88 HydrophobicContact CE1-CG 3.76Å; F84-Q88 WeakPolarHBondContact O-CG 3.41Å; F84-Q88 PolarHBondContact O-N 2.91Å
85	Q	94	Very high	93.6	Very high	68 Å²	68	78.5 Å²	78.5	32%	0.318	39%	0.394	S	S	.	.	H	α-helix	trans	-60	-40.3	175.6	-72.1	171.7	-14.6	0	0	112.2	I67 T68 I81 K82 Q88 L89	I67-Q85 HydrophobicContact CG2-CG 3.76Å; T68-Q85 PolarHBondContact OG1-NE2 3.24Å; I81-Q85 WeakPolarHBondContact O-CG 3.45Å; I81-Q85 PolarHBondContact O-N 3.31Å; K82-Q85 PolarHBondContact O-N 2.9Å; Q85-Q88 PolarHBondContact O-N 3.44Å; Q85-L89 WeakPolarHBondContact O-CG 3.17Å; Q85-L89 PolarHBondContact O-N 2.83Å; Q85-L89 VanDerWaalsContact O-N 3.11Å
86	L	95.6	Very high	93.8	Very high	103 Å²	103	72.3 Å²	72.3	54%	0.539	37%	0.369	S	S	.	.	H	α-helix	trans	-65.3	-42.3	173	-72.5	169.8	0	0	0	111.7	K82 L83 F84 Q88 L89 L90	K82-L86 WeakPolarHBondContact O-CB 3.23Å; K82-L86 VanDerWaalsContact O-CG 3.3Å; K82-L86 WeakPolarHBondContact O-CG 3.22Å; K82-L86 PolarHBondContact O-N 3.48Å; L83-L86 PolarHBondContact O-N 3.47Å; F84-L86 VanDerWaalsContact C-N 3.32Å; F84-L86 PolarHBondContact O-N 3.3Å; L86-Q88 PolarHBondContact O-N 2.79Å; L86-L89 PolarHBondContact O-N 3.19Å; L86-L90 WeakPolarHBondContact O-CB 3.42Å; L86-L90 VanDerWaalsContact O-CG 3.31Å; L86-L90 WeakPolarHBondContact O-CG 3.34Å; L86-L90 PolarHBondContact O-N 2.99Å
87	A	95.8	Very high	93.9	Very high	43 Å²	43	71.2 Å²	71.2	36%	0.355	36%	0.364	S	S	.	.	H	α-helix	trans	-61.6	-41.9	175.2	0	0	0	0	0	112.1	L83 F84 L89 L90 V91	L83-A87 WeakPolarHBondContact O-CB 3.3Å; L83-A87 PolarHBondContact O-N 3.21Å; F84-A87 WeakPolarHBondContact O-CB 3.38Å; F84-A87 PolarHBondContact O-N 2.91Å; F84-A87 VanDerWaalsContact O-N 3.14Å; A87-L89 PolarHBondContact O-N 2.96Å; A87-L90 PolarHBondContact O-N 2.95Å; A87-V91 WeakPolarHBondContact O-CG2 3.33Å; A87-V91 PolarHBondContact O-N 2.89Å
88	Q	94.7	Very high	93.9	Very high	9 Å²	9	71.3 Å²	71.3	4%	0.042	36%	0.362	C	S	.	.	H	α-helix	trans	-59.3	-45.8	173.8	-71.8	-174.7	-42.5	0	0	112.3	V62 T63 C65 F84 Q85 L86 L90 V91 E92	V62-Q88 PolarHBondContact O-NE2 3.03Å; T63-Q88 PolarHBondContact O-NE2 3.37Å; C65-Q88 PolarHBondContact O-NE2 3.31Å; C65-Q88 PolarHBondContact SG-NE2 2.87Å; F84-Q88 HydrophobicContact CD1-CG 3.94Å; F84-Q88 HydrophobicContact CE1-CG 3.76Å; F84-Q88 WeakPolarHBondContact O-CG 3.41Å; F84-Q88 PolarHBondContact O-N 2.91Å; Q85-Q88 PolarHBondContact O-N 3.44Å; L86-Q88 PolarHBondContact O-N 2.79Å; Q88-L90 VanDerWaalsContact C-N 3.35Å; Q88-V91 PolarHBondContact O-N 2.93Å; Q88-E92 VanDerWaalsContact O-CB 3.31Å; Q88-E92 WeakPolarHBondContact O-CB 3.38Å; Q88-E92 PolarHBondContact O-N 3.49Å
89	L	94.4	Very high	93.9	Very high	64 Å²	64	70.3 Å²	70.3	34%	0.335	36%	0.357	S	S	.	.	H	α-helix	trans	-65.5	-36.8	178	-70.6	166.7	0	0	0	112.1	F26 Q85 L86 A87 Y93	F26-L89 HydrophobicContact CB-CD2 4.21Å; F26-L89 HydrophobicContact CD1-CD2 3.53Å; F26-L89 HydrophobicContact CD2-CD2 4.21Å; F26-L89 HydrophobicContact CE1-CB 4.41Å; F26-L89 HydrophobicContact CE1-CD2 3.84Å; F26-L89 HydrophobicContact CE2-CD2 4.47Å; F26-L89 HydrophobicContact CG-CD2 3.73Å; F26-L89 HydrophobicContact CZ-CD2 4.3Å; Q85-L89 WeakPolarHBondContact O-CG 3.17Å; Q85-L89 PolarHBondContact O-N 2.83Å; Q85-L89 VanDerWaalsContact O-N 3.11Å; L86-L89 PolarHBondContact O-N 3.19Å; A87-L89 PolarHBondContact O-N 2.96Å; L89-Y93 WeakPolarHBondContact O-CB 3.24Å; L89-Y93 PolarHBondContact O-N 3.45Å
90	L	95.3	Very high	93.8	Very high	114 Å²	114	67.9 Å²	67.9	60%	0.597	34%	0.341	S	S	*	.	H	α-helix	trans	-65.6	-46.3	174.9	-74.4	167.6	0	0	0	112	L86 A87 Q88 Y93 L94	L86-L90 WeakPolarHBondContact O-CB 3.42Å; L86-L90 VanDerWaalsContact O-CG 3.31Å; L86-L90 WeakPolarHBondContact O-CG 3.34Å; L86-L90 PolarHBondContact O-N 2.99Å; A87-L90 PolarHBondContact O-N 2.95Å; Q88-L90 VanDerWaalsContact C-N 3.35Å; L90-Y93 PolarHBondContact O-N 3.11Å; L90-L94 WeakPolarHBondContact O-CG 3.35Å; L90-L94 PolarHBondContact O-N 3.13Å
91	V	95.1	Very high	93.8	Very high	52 Å²	52	66.7 Å²	66.7	32%	0.315	33%	0.334	S	S	.	.	H	α-helix	trans	-68.1	-36.2	177.9	-179.2	0	0	0	0	111.2	L59 T63 A87 Q88 L94 L95	L59-V91 HydrophobicContact CD1-CG1 3.92Å; T63-V91 HydrophobicContact CG2-CB 3.84Å; T63-V91 HydrophobicContact CG2-CG1 3.39Å; A87-V91 WeakPolarHBondContact O-CG2 3.33Å; A87-V91 PolarHBondContact O-N 2.89Å; Q88-V91 PolarHBondContact O-N 2.93Å; V91-L94 PolarHBondContact O-N 3.15Å; V91-L95 HydrophobicContact CG1-CD1 4.32Å; V91-L95 WeakPolarHBondContact O-CG 3.43Å; V91-L95 PolarHBondContact O-N 3.37Å
92	E	94.1	Very high	93.8	Very high	16 Å²	16	68.6 Å²	68.6	8%	0.075	35%	0.346	C	S	.	.	H	α-helix	trans	-63.5	-39.8	172.7	-176.4	171.6	-160.4	0	0	112.5	F26 R27 R29 F64 Q88 L95 Y96	F26-E92 WeakPolarHBondContact CA-OE1 3.46Å; F26-E92 HydrophobicContact CD1-CB 4.48Å; F26-E92 HydrophobicContact CD1-CG 4.07Å; F26-E92 WeakPolarHBondContact CD1-OE2 3.36Å; R27-E92 VanDerWaalsContact CB-OE1 3.3Å; R27-E92 WeakPolarHBondContact CB-OE1 3.29Å; R27-E92 PolarHBondContact N-OE1 2.92Å; R29-E92 IonicContact CZ-OE2 3.84Å; R29-E92 IonicContact NH1-OE1 3.35Å; R29-E92 IonicContact NH1-OE2 3.13Å; R29-E92 PolarHBondContact NH1-OE2 3.37Å; R29-E92 IonicContact NH2-OE2 2.66Å; R29-E92 PolarHBondContact NH2-OE2 3.1Å; F64-E92 HydrophobicContact CE1-CG 4.01Å; Q88-E92 VanDerWaalsContact O-CB 3.31Å; Q88-E92 WeakPolarHBondContact O-CB 3.38Å; Q88-E92 PolarHBondContact O-N 3.49Å; E92-L95 PolarHBondContact O-N 3.09Å; E92-Y96 WeakPolarHBondContact O-CB 3.47Å; E92-Y96 PolarHBondContact O-N 2.94Å
93	Y	94.5	Very high	93.8	Very high	117 Å²	117	67.4 Å²	67.4	46%	0.459	35%	0.349	S	S	.	.	H	α-helix	trans	-64.2	-37.6	172.1	175.1	-93.5	0	0	0	112.5	I24 L89 L90 S97	I24-Y93 HydrophobicContact CD1-CD2 3.72Å; I24-Y93 HydrophobicContact CD1-CE2 3.6Å; L89-Y93 WeakPolarHBondContact O-CB 3.24Å; L89-Y93 PolarHBondContact O-N 3.45Å; L90-Y93 PolarHBondContact O-N 3.11Å; Y93-S97 WeakPolarHBondContact O-CB 3.4Å; Y93-S97 PolarHBondContact O-N 3.44Å; Y93-S97 PolarHBondContact O-OG 3.31Å
94	L	94.2	Very high	93.6	Very high	109 Å²	109	63.1 Å²	63.1	57%	0.571	33%	0.327	S	S	*	.	H	α-helix	trans	-66.4	-41.1	174.6	-70.3	170.7	0	0	0	111.9	L90 V91 S97 Q98	L90-L94 WeakPolarHBondContact O-CG 3.35Å; L90-L94 PolarHBondContact O-N 3.13Å; V91-L94 PolarHBondContact O-N 3.15Å; L94-S97 WeakPolarHBondContact O-CB 3.39Å; L94-S97 PolarHBondContact O-N 3.31Å; L94-Q98 WeakPolarHBondContact O-CB 3.35Å; L94-Q98 PolarHBondContact O-N 3.03Å
95	L	92.3	Very high	93.6	Very high	34 Å²	34	64 Å²	64	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-63.2	-47.5	174.4	-73.6	167.9	0	0	0	111.7	L59 T63 V91 E92 S97 Q98 D99	L59-L95 HydrophobicContact CD2-CD2 4.1Å; T63-L95 HydrophobicContact CG2-CD1 4.3Å; V91-L95 HydrophobicContact CG1-CD1 4.32Å; V91-L95 WeakPolarHBondContact O-CG 3.43Å; V91-L95 PolarHBondContact O-N 3.37Å; E92-L95 PolarHBondContact O-N 3.09Å; L95-S97 VanDerWaalsContact C-N 3.28Å; L95-S97 PolarHBondContact O-N 3.44Å; L95-Q98 WeakPolarHBondContact O-CB 3.33Å; L95-Q98 PolarHBondContact O-N 3.43Å; L95-D99 PolarHBondContact O-N 3.02Å
96	Y	92.6	Very high	93.6	Very high	52 Å²	52	64.4 Å²	64.4	20%	0.204	34%	0.339	C	S	.	.	H	α-helix	trans	-55.3	-45	172.2	171	-91.2	0	0	0	111.7	V21 P22 I24 E92 Q98 D99 Y100	V21-Y96 HydrophobicContact CG1-CE1 4.49Å; P22-Y96 HydrophobicContact CB-CE2 4.46Å; P22-Y96 VanDerWaalsContact CD-OH 3.26Å; P22-Y96 WeakPolarHBondContact CD-OH 3.29Å; P22-Y96 PolarHBondContact O-OH 3.42Å; I24-Y96 HydrophobicContact CD1-CD1 3.5Å; I24-Y96 VanDerWaalsContact CD1-CD1 3.5Å; I24-Y96 HydrophobicContact CD1-CE1 3.55Å; I24-Y96 HydrophobicContact CD1-CG 4.26Å; I24-Y96 HydrophobicContact CG1-CD1 3.68Å; I24-Y96 HydrophobicContact CG1-CD2 4.33Å; I24-Y96 HydrophobicContact CG1-CE1 3.49Å; I24-Y96 VanDerWaalsContact CG1-CE1 3.49Å; I24-Y96 HydrophobicContact CG1-CE2 4.16Å; I24-Y96 HydrophobicContact CG1-CG 4.12Å; I24-Y96 HydrophobicContact CG2-CG 4.37Å; E92-Y96 WeakPolarHBondContact O-CB 3.47Å; E92-Y96 PolarHBondContact O-N 2.94Å; Y96-Q98 VanDerWaalsContact C-N 3.34Å; Y96-Q98 PolarHBondContact O-N 3.4Å; Y96-D99 PolarHBondContact O-N 3.48Å; Y96-Y100 VanDerWaalsContact O-CB 3.28Å; Y96-Y100 WeakPolarHBondContact O-CB 3.29Å; Y96-Y100 PolarHBondContact O-N 3.13Å
97	S	92.3	Very high	93.5	Very high	27 Å²	27	62.8 Å²	62.8	19%	0.189	34%	0.336	C	S	.	.	H	α-helix	trans	-64.5	-38.8	179.5	-59.7	0	0	0	0	111.8	Y93 L94 L95 L101	Y93-S97 WeakPolarHBondContact O-CB 3.4Å; Y93-S97 PolarHBondContact O-N 3.44Å; Y93-S97 PolarHBondContact O-OG 3.31Å; L94-S97 WeakPolarHBondContact O-CB 3.39Å; L94-S97 PolarHBondContact O-N 3.31Å; L95-S97 VanDerWaalsContact C-N 3.28Å; L95-S97 PolarHBondContact O-N 3.44Å; S97-L101 VanDerWaalsContact O-CB 3.28Å; S97-L101 WeakPolarHBondContact O-CB 3.48Å; S97-L101 WeakPolarHBondContact O-CD1 3.46Å; S97-L101 WeakPolarHBondContact O-CG 3.31Å; S97-L101 PolarHBondContact O-N 2.73Å
98	Q	92.3	Very high	93.4	Very high	84 Å²	84	63.1 Å²	63.1	39%	0.393	33%	0.331	S	S	.	.	H	α-helix	trans	-63.6	-48.3	175.4	179.4	-179.3	-7.4	0	0	111.5	L94 L95 Y96 L101 T102	L94-Q98 WeakPolarHBondContact O-CB 3.35Å; L94-Q98 PolarHBondContact O-N 3.03Å; L95-Q98 WeakPolarHBondContact O-CB 3.33Å; L95-Q98 PolarHBondContact O-N 3.43Å; Y96-Q98 VanDerWaalsContact C-N 3.34Å; Y96-Q98 PolarHBondContact O-N 3.4Å; Q98-L101 PolarHBondContact O-N 2.92Å; Q98-T102 VanDerWaalsContact O-CB 3.29Å; Q98-T102 WeakPolarHBondContact O-CB 3.33Å; Q98-T102 PolarHBondContact O-N 2.86Å; Q98-T102 PolarHBondContact O-OG1 2.92Å
99	D	91.9	Very high	93.4	Very high	78 Å²	78	67.8 Å²	67.8	42%	0.417	35%	0.352	S	S	.	.	H	α-helix	trans	-68.5	-41.2	-179.4	-73.6	-14.3	0	0	0	111.6	L95 Y96 T102 T103	L95-D99 PolarHBondContact O-N 3.02Å; Y96-D99 PolarHBondContact O-N 3.48Å; D99-T102 PolarHBondContact O-N 2.92Å; D99-T103 WeakPolarHBondContact O-CB 3.31Å; D99-T103 WeakPolarHBondContact O-CG2 3.49Å; D99-T103 PolarHBondContact O-N 3.4Å; D99-T103 PolarHBondContact O-OG1 2.82Å
100	Y	90.9	Very high	93.4	Very high	47 Å²	47	71.8 Å²	71.8	18%	0.184	37%	0.369	C	S	.	.	H	α-helix	trans	-59.6	-47.3	173.6	174.1	-100.2	0	0	0	111.9	V21 P22 Y96 T103 T104	V21-Y100 HydrophobicContact CG1-CE2 4.42Å; P22-Y100 HydrophobicContact CG-CD2 4.38Å; Y96-Y100 VanDerWaalsContact O-CB 3.28Å; Y96-Y100 WeakPolarHBondContact O-CB 3.29Å; Y96-Y100 PolarHBondContact O-N 3.13Å; Y100-T103 PolarHBondContact O-OG1 3.29Å; Y100-T104 WeakPolarHBondContact O-CB 3.26Å; Y100-T104 PolarHBondContact O-N 3.41Å; Y100-T104 PolarHBondContact O-OG1 3.01Å
101	L	93.1	Very high	93.3	Very high	77 Å²	77	70.1 Å²	70.1	40%	0.403	36%	0.358	S	S	.	.	H	α-helix	trans	-68	-39.1	178.6	-72.2	171.2	0	0	0	111.7	S97 Q98 I105	S97-L101 VanDerWaalsContact O-CB 3.28Å; S97-L101 WeakPolarHBondContact O-CB 3.48Å; S97-L101 WeakPolarHBondContact O-CD1 3.46Å; S97-L101 WeakPolarHBondContact O-CG 3.31Å; S97-L101 PolarHBondContact O-N 2.73Å; Q98-L101 PolarHBondContact O-N 2.92Å; L101-I105 VanDerWaalsContact O-CB 3.22Å; L101-I105 WeakPolarHBondContact O-CB 3.14Å; L101-I105 WeakPolarHBondContact O-CD1 3.5Å; L101-I105 WeakPolarHBondContact O-CG1 3.49Å; L101-I105 PolarHBondContact O-N 3.44Å
102	T	94	Very high	93.1	Very high	52 Å²	52	71.2 Å²	71.2	32%	0.319	36%	0.362	S	S	.	.	H	α-helix	trans	-64.9	-51.3	179.1	-56.7	0	0	0	0	111	Q98 D99 T104 I105 D106	Q98-T102 VanDerWaalsContact O-CB 3.29Å; Q98-T102 WeakPolarHBondContact O-CB 3.33Å; Q98-T102 PolarHBondContact O-N 2.86Å; Q98-T102 PolarHBondContact O-OG1 2.92Å; D99-T102 PolarHBondContact O-N 2.92Å; T102-T104 VanDerWaalsContact C-N 3.35Å; T102-T104 PolarHBondContact O-N 3Å; T102-I105 PolarHBondContact O-N 2.85Å; T102-D106 PolarHBondContact O-N 3.09Å
103	T	93	Very high	93.1	Very high	93 Å²	93	74.9 Å²	74.9	57%	0.571	38%	0.382	S	S	*	.	H	α-helix	trans	-62.8	-39.5	177.9	51.3	0	0	0	0	112.5	D99 Y100 D106 S107	D99-T103 WeakPolarHBondContact O-CB 3.31Å; D99-T103 WeakPolarHBondContact O-CG2 3.49Å; D99-T103 PolarHBondContact O-N 3.4Å; D99-T103 PolarHBondContact O-OG1 2.82Å; Y100-T103 PolarHBondContact O-OG1 3.29Å; T103-D106 PolarHBondContact O-N 3.38Å; T103-S107 WeakPolarHBondContact O-CB 3.42Å; T103-S107 PolarHBondContact O-N 2.96Å
104	T	92	Very high	93.1	Very high	20 Å²	20	73.3 Å²	73.3	12%	0.123	38%	0.379	C	S	.	.	H	α-helix	trans	-59.7	-48.4	171.4	-70.8	0	0	0	0	111.9	Q19 Y100 T102 D106 S107 L108	Q19-T104 VanDerWaalsContact OE1-CG2 3.31Å; Y100-T104 WeakPolarHBondContact O-CB 3.26Å; Y100-T104 PolarHBondContact O-N 3.41Å; Y100-T104 PolarHBondContact O-OG1 3.01Å; T102-T104 VanDerWaalsContact C-N 3.35Å; T102-T104 PolarHBondContact O-N 3Å; T104-D106 PolarHBondContact O-N 3.47Å; T104-S107 PolarHBondContact O-N 3.35Å; T104-L108 HydrophobicContact CG2-CD1 3.82Å; T104-L108 WeakPolarHBondContact O-CB 3.25Å; T104-L108 VanDerWaalsContact O-CG 3.23Å; T104-L108 WeakPolarHBondContact O-CG 3.41Å; T104-L108 PolarHBondContact O-N 2.92Å
105	I	94.1	Very high	92.9	Very high	84 Å²	84	72.6 Å²	72.6	43%	0.431	38%	0.375	S	S	.	.	H	α-helix	trans	-63.6	-40.6	-179.4	-77.8	166.7	0	0	0	111.3	L101 T102 L108 K109	L101-I105 VanDerWaalsContact O-CB 3.22Å; L101-I105 WeakPolarHBondContact O-CB 3.14Å; L101-I105 WeakPolarHBondContact O-CD1 3.5Å; L101-I105 WeakPolarHBondContact O-CG1 3.49Å; L101-I105 PolarHBondContact O-N 3.44Å; T102-I105 PolarHBondContact O-N 2.85Å; I105-L108 PolarHBondContact O-N 3.18Å; I105-K109 HydrophobicContact CG2-CD 4.36Å; I105-K109 VanDerWaalsContact CG2-CE 3.41Å; I105-K109 VanDerWaalsContact O-CG 3.3Å; I105-K109 WeakPolarHBondContact O-CG 3.22Å; I105-K109 PolarHBondContact O-N 3.46Å
106	D	94.2	Very high	92.9	Very high	77 Å²	77	78.5 Å²	78.5	41%	0.412	40%	0.395	S	S	.	.	H	α-helix	trans	-73.1	-37.8	-179.2	-71.3	-22.3	0	0	0	112.4	T102 T103 T104 K109 E110	T102-D106 PolarHBondContact O-N 3.09Å; T103-D106 PolarHBondContact O-N 3.38Å; T104-D106 PolarHBondContact O-N 3.47Å; D106-K109 WeakPolarHBondContact O-CB 3.39Å; D106-K109 PolarHBondContact O-N 2.93Å; D106-K109 WeakPolarHBondContact OD1-CD 3.33Å; D106-K109 WeakPolarHBondContact OD1-CE 3.36Å; D106-K109 IonicContact OD1-NZ 2.7Å; D106-K109 PolarHBondContact OD1-NZ 3.34Å; D106-E110 PolarHBondContact O-N 3.1Å
107	S	93.4	Very high	93	Very high	69 Å²	69	82 Å²	82	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-58.3	-47.1	168.6	179.5	0	0	0	0	111.9	T103 T104 K109 E110 E111	T103-S107 WeakPolarHBondContact O-CB 3.42Å; T103-S107 PolarHBondContact O-N 2.96Å; T104-S107 PolarHBondContact O-N 3.35Å; S107-K109 VanDerWaalsContact C-N 3.32Å; S107-K109 PolarHBondContact O-N 2.93Å; S107-E110 PolarHBondContact O-N 3.2Å; S107-E111 PolarHBondContact O-N 3.17Å
108	L	92.6	Very high	93.1	Very high	50 Å²	50	83.7 Å²	83.7	26%	0.262	42%	0.418	S	S	.	.	H	α-helix	trans	-63.6	-33.5	176.6	-72	169.1	0	0	0	113	Y17 T104 I105 N112	Y17-L108 HydrophobicContact CD1-CD2 4.32Å; Y17-L108 HydrophobicContact CE1-CD2 3.55Å; T104-L108 HydrophobicContact CG2-CD1 3.82Å; T104-L108 WeakPolarHBondContact O-CB 3.25Å; T104-L108 VanDerWaalsContact O-CG 3.23Å; T104-L108 WeakPolarHBondContact O-CG 3.41Å; T104-L108 PolarHBondContact O-N 2.92Å; I105-L108 PolarHBondContact O-N 3.18Å; L108-N112 WeakPolarHBondContact O-CB 3.2Å; L108-N112 PolarHBondContact O-N 3.49Å; L108-N112 PolarHBondContact O-ND2 3.08Å
109	K	94.7	Very high	93	Very high	108 Å²	108	83 Å²	83	47%	0.47	42%	0.421	S	S	.	.	H	α-helix	trans	-66.2	-42.9	172.7	-73.7	168.8	-165.5	157.5	0	111.4	I105 D106 S107 N112 N113	I105-K109 HydrophobicContact CG2-CD 4.36Å; I105-K109 VanDerWaalsContact CG2-CE 3.41Å; I105-K109 VanDerWaalsContact O-CG 3.3Å; I105-K109 WeakPolarHBondContact O-CG 3.22Å; I105-K109 PolarHBondContact O-N 3.46Å; D106-K109 WeakPolarHBondContact O-CB 3.39Å; D106-K109 PolarHBondContact O-N 2.93Å; D106-K109 WeakPolarHBondContact OD1-CD 3.33Å; D106-K109 WeakPolarHBondContact OD1-CE 3.36Å; D106-K109 IonicContact OD1-NZ 2.7Å; D106-K109 PolarHBondContact OD1-NZ 3.34Å; S107-K109 VanDerWaalsContact C-N 3.32Å; S107-K109 PolarHBondContact O-N 2.93Å; K109-N112 PolarHBondContact O-N 2.86Å; K109-N113 WeakPolarHBondContact O-CB 3.25Å; K109-N113 VanDerWaalsContact O-CG 3.23Å; K109-N113 PolarHBondContact O-N 3.49Å; K109-N113 PolarHBondContact O-ND2 3.29Å
110	E	93.9	Very high	93	Very high	148 Å²	148	83.3 Å²	83.3	69%	0.692	42%	0.423	S	S	*	.	H	α-helix	trans	-65.4	-46.2	178.9	-174.7	160.4	-141.6	0	0	111.5	D106 S107 N112 N113 E114	D106-E110 PolarHBondContact O-N 3.1Å; S107-E110 PolarHBondContact O-N 3.2Å; E110-N112 PolarHBondContact O-N 3.32Å; E110-N113 PolarHBondContact O-N 3.29Å; E110-N113 VanDerWaalsContact O-N 3.15Å; E110-E114 PolarHBondContact O-N 3.26Å
111	E	93.3	Very high	93.1	Very high	78 Å²	78	87 Å²	87	36%	0.364	44%	0.441	S	S	.	.	H	α-helix	trans	-56.1	-47.9	172.5	-170.2	-168.5	171.3	0	0	111.3	Y17 S107 N113 E114 L115	Y17-E111 PolarHBondContact OH-OE1 3.07Å; Y17-E111 PolarHBondContact OH-OE2 3.35Å; Y17-E111 VanDerWaalsContact OH-OE2 3.12Å; S107-E111 PolarHBondContact O-N 3.17Å; E111-N113 VanDerWaalsContact C-N 3.32Å; E111-N113 PolarHBondContact O-N 3.05Å; E111-E114 PolarHBondContact O-N 3.44Å; E111-L115 HydrophobicContact CG-CD1 4.07Å; E111-L115 HydrophobicContact CG-CG 4.48Å; E111-L115 WeakPolarHBondContact O-CB 3.38Å; E111-L115 VanDerWaalsContact O-CG 3.31Å; E111-L115 WeakPolarHBondContact O-CG 3.42Å; E111-L115 PolarHBondContact O-N 3.46Å
112	N	91	Very high	93	Very high	76 Å²	76	88.5 Å²	88.5	41%	0.406	45%	0.448	S	S	.	.	H	α-helix	trans	-61.4	-37.7	177	-92	-94.9	0	0	0	113	L108 K109 E110 R116	L108-N112 WeakPolarHBondContact O-CB 3.2Å; L108-N112 PolarHBondContact O-N 3.49Å; L108-N112 PolarHBondContact O-ND2 3.08Å; K109-N112 PolarHBondContact O-N 2.86Å; E110-N112 PolarHBondContact O-N 3.32Å; N112-R116 WeakPolarHBondContact O-CB 3.48Å; N112-R116 WeakPolarHBondContact O-CD 3.24Å; N112-R116 WeakPolarHBondContact O-CG 3.48Å; N112-R116 PolarHBondContact O-N 2.81Å
113	N	94.7	Very high	92.9	Very high	92 Å²	92	92.1 Å²	92.1	49%	0.492	46%	0.459	S	S	.	.	H	α-helix	trans	-68.8	-39	177.3	-75.2	-28.4	0	0	0	111.7	K109 E110 E111 R116 K117	K109-N113 WeakPolarHBondContact O-CB 3.25Å; K109-N113 VanDerWaalsContact O-CG 3.23Å; K109-N113 PolarHBondContact O-N 3.49Å; K109-N113 PolarHBondContact O-ND2 3.29Å; E110-N113 PolarHBondContact O-N 3.29Å; E110-N113 VanDerWaalsContact O-N 3.15Å; E111-N113 VanDerWaalsContact C-N 3.32Å; E111-N113 PolarHBondContact O-N 3.05Å; N113-R116 PolarHBondContact O-N 3.25Å; N113-K117 WeakPolarHBondContact O-CG 3.3Å; N113-K117 PolarHBondContact O-N 3Å; N113-K117 VanDerWaalsContact O-N 3.13Å
114	E	93.8	Very high	92.8	Very high	85 Å²	85	94 Å²	94	40%	0.397	46%	0.462	S	S	.	.	H	α-helix	trans	-72.3	-39.7	176.5	-169.2	53.8	-141.2	0	0	112	E110 E111 R116 K117 N118	E110-E114 PolarHBondContact O-N 3.26Å; E111-E114 PolarHBondContact O-N 3.44Å; E114-R116 VanDerWaalsContact C-N 3.29Å; E114-R116 PolarHBondContact O-N 2.66Å; E114-K117 PolarHBondContact O-N 2.83Å; E114-K117 WeakPolarHBondContact OE2-CD 3.44Å; E114-K117 WeakPolarHBondContact OE2-CE 3.38Å; E114-K117 IonicContact OE2-NZ 2.87Å; E114-K117 PolarHBondContact OE2-NZ 3.17Å; E114-N118 PolarHBondContact O-N 2.94Å; E114-N118 PolarHBondContact O-ND2 2.72Å; E114-N118 PolarHBondContact OE1-ND2 3.3Å
115	L	90.7	Very high	92.7	Very high	93 Å²	93	97.7 Å²	97.7	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-59.5	-39.3	171.3	-72.7	172.1	0	0	0	111.7	E111 N118 C119	E111-L115 HydrophobicContact CG-CD1 4.07Å; E111-L115 HydrophobicContact CG-CG 4.48Å; E111-L115 WeakPolarHBondContact O-CB 3.38Å; E111-L115 VanDerWaalsContact O-CG 3.31Å; E111-L115 WeakPolarHBondContact O-CG 3.42Å; E111-L115 PolarHBondContact O-N 3.46Å; L115-N118 PolarHBondContact O-N 2.84Å; L115-C119 WeakPolarHBondContact O-CB 3.5Å; L115-C119 PolarHBondContact O-N 2.81Å; L115-C119 PolarHBondContact O-SG 3.39Å; L115-C119 VanDerWaalsContact O-SG 3.35Å
116	R	92.9	Very high	92.5	Very high	159 Å²	159	99.4 Å²	99.4	60%	0.6	49%	0.487	S	S	*	.	H	α-helix	trans	-61.4	-51.4	174.1	-76.8	165.2	-177.8	-84.6	-2.5	112.1	N112 N113 E114 N118 C119 D120	N112-R116 WeakPolarHBondContact O-CB 3.48Å; N112-R116 WeakPolarHBondContact O-CD 3.24Å; N112-R116 WeakPolarHBondContact O-CG 3.48Å; N112-R116 PolarHBondContact O-N 2.81Å; N113-R116 PolarHBondContact O-N 3.25Å; E114-R116 VanDerWaalsContact C-N 3.29Å; E114-R116 PolarHBondContact O-N 2.66Å; R116-N118 VanDerWaalsContact C-N 3.27Å; R116-N118 PolarHBondContact O-N 3.18Å; R116-C119 WeakPolarHBondContact O-CB 3.45Å; R116-C119 PolarHBondContact O-N 2.75Å; R116-D120 PolarHBondContact O-N 2.75Å
117	K	95	Very high	92.4	Very high	126 Å²	126	101.1 Å²	101.1	55%	0.548	49%	0.492	S	S	.	.	H	α-helix	trans	-53.7	-44.5	175.8	-67.8	175.5	-137.5	159.4	0	111.8	N113 E114 D120 K121	N113-K117 WeakPolarHBondContact O-CG 3.3Å; N113-K117 PolarHBondContact O-N 3Å; N113-K117 VanDerWaalsContact O-N 3.13Å; E114-K117 PolarHBondContact O-N 2.83Å; E114-K117 WeakPolarHBondContact OE2-CD 3.44Å; E114-K117 WeakPolarHBondContact OE2-CE 3.38Å; E114-K117 IonicContact OE2-NZ 2.87Å; E114-K117 PolarHBondContact OE2-NZ 3.17Å; K117-D120 PolarHBondContact O-N 2.9Å; K117-K121 VanDerWaalsContact O-CB 3.32Å; K117-K121 WeakPolarHBondContact O-CB 3.27Å; K117-K121 PolarHBondContact O-N 3.36Å
118	N	93.2	Very high	92.3	Very high	62 Å²	62	101.5 Å²	101.5	33%	0.332	49%	0.486	S	S	.	.	H	α-helix	trans	-71.5	-38.4	-179.2	-73.8	-69.7	0	0	0	112.5	E114 L115 R116 D120 K121 L122	E114-N118 PolarHBondContact O-N 2.94Å; E114-N118 PolarHBondContact O-ND2 2.72Å; E114-N118 PolarHBondContact OE1-ND2 3.3Å; L115-N118 PolarHBondContact O-N 2.84Å; R116-N118 VanDerWaalsContact C-N 3.27Å; R116-N118 PolarHBondContact O-N 3.18Å; N118-D120 PolarHBondContact O-N 3.5Å; N118-K121 PolarHBondContact O-N 3.49Å; N118-L122 WeakPolarHBondContact O-CB 3.35Å; N118-L122 VanDerWaalsContact O-CG 3.26Å; N118-L122 WeakPolarHBondContact O-CG 3.35Å; N118-L122 PolarHBondContact O-N 3.35Å
119	C	90.2	Very high	92.1	Very high	68 Å²	68	103.5 Å²	103.5	46%	0.459	49%	0.493	S	S	.	.	H	α-helix	trans	-58.4	-45	169.8	-79.9	0	0	0	0	112.1	L115 R116 L122 K123	L115-C119 WeakPolarHBondContact O-CB 3.5Å; L115-C119 PolarHBondContact O-N 2.81Å; L115-C119 PolarHBondContact O-SG 3.39Å; L115-C119 VanDerWaalsContact O-SG 3.35Å; R116-C119 WeakPolarHBondContact O-CB 3.45Å; R116-C119 PolarHBondContact O-N 2.75Å; C119-L122 PolarHBondContact O-N 3.03Å; C119-K123 WeakPolarHBondContact O-CG 3.32Å; C119-K123 PolarHBondContact O-N 3.42Å
120	D	92.5	Very high	91.8	Very high	85 Å²	85	101.1 Å²	101.1	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-72.1	-35.7	-178.4	-65.4	-32.2	0	0	0	112.3	R116 K117 N118 K123 H124	R116-D120 PolarHBondContact O-N 2.75Å; K117-D120 PolarHBondContact O-N 2.9Å; N118-D120 PolarHBondContact O-N 3.5Å; D120-K123 PolarHBondContact O-N 3.46Å; D120-K123 WeakPolarHBondContact OD1-CE 3.36Å; D120-K123 IonicContact OD1-NZ 2.69Å; D120-K123 PolarHBondContact OD1-NZ 2.95Å; D120-H124 PolarHBondContact O-N 2.92Å
121	K	93.5	Very high	91.7	Very high	126 Å²	126	98 Å²	98	55%	0.548	48%	0.476	S	S	.	.	H	α-helix	trans	-59.9	-43.2	168.4	-176	-179.9	-179.6	-178.4	0	112.2	K117 N118 H124 Q125	K117-K121 VanDerWaalsContact O-CB 3.32Å; K117-K121 WeakPolarHBondContact O-CB 3.27Å; K117-K121 PolarHBondContact O-N 3.36Å; N118-K121 PolarHBondContact O-N 3.49Å; K121-H124 PolarHBondContact O-N 3.16Å; K121-Q125 WeakPolarHBondContact O-CG 3.3Å; K121-Q125 PolarHBondContact O-N 3.39Å; K121-Q125 VanDerWaalsContact O-N 3.09Å
122	L	90.5	Very high	91.5	Very high	107 Å²	107	101.5 Å²	101.5	56%	0.56	49%	0.486	S	S	*	.	H	α-helix	trans	-68.2	-39	176.4	-73.9	168.3	0	0	0	112.1	N118 C119 H124 Q125 L126	N118-L122 WeakPolarHBondContact O-CB 3.35Å; N118-L122 VanDerWaalsContact O-CG 3.26Å; N118-L122 WeakPolarHBondContact O-CG 3.35Å; N118-L122 PolarHBondContact O-N 3.35Å; C119-L122 PolarHBondContact O-N 3.03Å; L122-H124 VanDerWaalsContact C-N 3.34Å; L122-H124 PolarHBondContact O-N 2.95Å; L122-Q125 PolarHBondContact O-N 2.84Å; L122-L126 WeakPolarHBondContact O-CB 3.42Å; L122-L126 PolarHBondContact O-N 2.93Å
123	K	91.3	Very high	91.4	Very high	128 Å²	128	102.5 Å²	102.5	56%	0.557	49%	0.49	S	S	*	.	H	α-helix	trans	-58.4	-44.8	171.4	-71.1	170.4	-162.6	165.3	0	111.4	C119 D120 L126 Q127	C119-K123 WeakPolarHBondContact O-CG 3.32Å; C119-K123 PolarHBondContact O-N 3.42Å; D120-K123 PolarHBondContact O-N 3.46Å; D120-K123 WeakPolarHBondContact OD1-CE 3.36Å; D120-K123 IonicContact OD1-NZ 2.69Å; D120-K123 PolarHBondContact OD1-NZ 2.95Å; K123-L126 PolarHBondContact O-N 2.91Å; K123-Q127 WeakPolarHBondContact O-CB 3.03Å; K123-Q127 PolarHBondContact O-N 3.27Å
124	H	92.3	Very high	91	Very high	134 Å²	134	99.9 Å²	99.9	62%	0.62	48%	0.478	S	S	*	.	H	α-helix	trans	-61.9	-44.6	177.9	-170.1	-71.8	0	0	0	111.7	D120 K121 L122 L126 Q127 E128	D120-H124 PolarHBondContact O-N 2.92Å; K121-H124 PolarHBondContact O-N 3.16Å; L122-H124 VanDerWaalsContact C-N 3.34Å; L122-H124 PolarHBondContact O-N 2.95Å; H124-L126 PolarHBondContact O-N 3.41Å; H124-Q127 PolarHBondContact O-N 3.45Å; H124-E128 WeakPolarHBondContact O-CB 3.41Å; H124-E128 PolarHBondContact O-N 2.9Å
125	Q	89.9	Confident	90.8	Very high	97 Å²	97	98.4 Å²	98.4	45%	0.453	48%	0.48	S	S	.	.	H	α-helix	trans	-64.1	-39	176	-71.1	-179.4	-11.1	0	0	112.6	K121 L122 E128 K129	K121-Q125 WeakPolarHBondContact O-CG 3.3Å; K121-Q125 PolarHBondContact O-N 3.39Å; K121-Q125 VanDerWaalsContact O-N 3.09Å; L122-Q125 PolarHBondContact O-N 2.84Å; Q125-E128 PolarHBondContact O-N 3.19Å; Q125-K129 WeakPolarHBondContact O-CB 3.4Å; Q125-K129 VanDerWaalsContact O-CG 3.32Å; Q125-K129 WeakPolarHBondContact O-CG 3.4Å; Q125-K129 PolarHBondContact O-N 3.33Å
126	L	88.5	Confident	90.6	Very high	120 Å²	120	98.6 Å²	98.6	63%	0.628	49%	0.485	S	S	*	.	H	α-helix	trans	-64.1	-44.1	174.9	-176.4	66.8	0	0	0	111.5	L122 K123 H124 K129 T130	L122-L126 WeakPolarHBondContact O-CB 3.42Å; L122-L126 PolarHBondContact O-N 2.93Å; K123-L126 PolarHBondContact O-N 2.91Å; H124-L126 PolarHBondContact O-N 3.41Å; L126-K129 PolarHBondContact O-N 3.4Å; L126-T130 VanDerWaalsContact O-CB 3.29Å; L126-T130 WeakPolarHBondContact O-CB 3.44Å; L126-T130 PolarHBondContact O-N 3.4Å; L126-T130 PolarHBondContact O-OG1 3.31Å
127	Q	91.5	Very high	90.4	Very high	113 Å²	113	100.5 Å²	100.5	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-63.9	-42.8	177	-174.8	66.6	-2.5	0	0	111.3	K123 H124 T130 N131	K123-Q127 WeakPolarHBondContact O-CB 3.03Å; K123-Q127 PolarHBondContact O-N 3.27Å; H124-Q127 PolarHBondContact O-N 3.45Å; Q127-T130 PolarHBondContact O-N 2.9Å; Q127-N131 WeakPolarHBondContact O-CB 3.46Å; Q127-N131 VanDerWaalsContact O-CG 3.23Å; Q127-N131 PolarHBondContact O-N 2.96Å
128	E	92.3	Very high	90.1	Very high	76 Å²	76	101.7 Å²	101.7	36%	0.355	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-48.3	176.3	-165.7	-158.8	150.9	0	0	112	H124 Q125 T130 N131 R132	H124-E128 WeakPolarHBondContact O-CB 3.41Å; H124-E128 PolarHBondContact O-N 2.9Å; Q125-E128 PolarHBondContact O-N 3.19Å; E128-T130 VanDerWaalsContact C-N 3.31Å; E128-T130 PolarHBondContact O-N 3.43Å; E128-N131 PolarHBondContact O-N 3.49Å; E128-R132 WeakPolarHBondContact O-CG 3.42Å; E128-R132 PolarHBondContact O-N 3.03Å; E128-R132 IonicContact OE1-CZ 3.24Å; E128-R132 IonicContact OE1-NE 3.24Å; E128-R132 PolarHBondContact OE1-NE 3.03Å; E128-R132 IonicContact OE1-NH2 2.73Å; E128-R132 PolarHBondContact OE1-NH2 3.43Å
129	K	88	Confident	89.8	Confident	92 Å²	92	101.4 Å²	101.4	40%	0.4	49%	0.49	S	S	.	.	H	α-helix	trans	-62.7	-37.3	176.2	-72.6	-80	-173.8	167.7	0	111.7	Q125 L126 L133	Q125-K129 WeakPolarHBondContact O-CB 3.4Å; Q125-K129 VanDerWaalsContact O-CG 3.32Å; Q125-K129 WeakPolarHBondContact O-CG 3.4Å; Q125-K129 PolarHBondContact O-N 3.33Å; L126-K129 PolarHBondContact O-N 3.4Å; K129-L133 WeakPolarHBondContact O-CB 3.34Å; K129-L133 PolarHBondContact O-N 3.11Å
130	T	89.2	Confident	89.7	Confident	59 Å²	59	100.8 Å²	100.8	36%	0.362	49%	0.486	S	S	.	.	H	α-helix	trans	-66.7	-44.9	175.5	-58.6	0	0	0	0	111.5	L126 Q127 E128 R132 L133 T134	L126-T130 VanDerWaalsContact O-CB 3.29Å; L126-T130 WeakPolarHBondContact O-CB 3.44Å; L126-T130 PolarHBondContact O-N 3.4Å; L126-T130 PolarHBondContact O-OG1 3.31Å; Q127-T130 PolarHBondContact O-N 2.9Å; E128-T130 VanDerWaalsContact C-N 3.31Å; E128-T130 PolarHBondContact O-N 3.43Å; T130-R132 PolarHBondContact O-N 3.35Å; T130-L133 PolarHBondContact O-N 3.36Å; T130-T134 WeakPolarHBondContact O-CG2 3.41Å; T130-T134 PolarHBondContact O-N 2.93Å
131	N	90.5	Very high	89.4	Confident	82 Å²	82	102.3 Å²	102.3	44%	0.439	49%	0.49	S	S	.	.	H	α-helix	trans	-59.2	-48.6	175.3	-74.3	-14.2	0	0	0	111.1	Q127 E128 L133 T134 A135	Q127-N131 WeakPolarHBondContact O-CB 3.46Å; Q127-N131 VanDerWaalsContact O-CG 3.23Å; Q127-N131 PolarHBondContact O-N 2.96Å; E128-N131 PolarHBondContact O-N 3.49Å; N131-L133 VanDerWaalsContact C-N 3.34Å; N131-L133 PolarHBondContact O-N 3.25Å; N131-T134 PolarHBondContact O-N 3.02Å; N131-T134 PolarHBondContact O-OG1 3.19Å; N131-A135 PolarHBondContact O-N 3.06Å
132	R	90.5	Very high	89.1	Confident	152 Å²	152	100.8 Å²	100.8	57%	0.574	48%	0.481	S	S	*	.	H	α-helix	trans	-55.2	-46.4	173.9	-69.9	171.7	-178.5	-120.6	9.1	111.5	E128 T130 T134 A135 T136	E128-R132 WeakPolarHBondContact O-CG 3.42Å; E128-R132 PolarHBondContact O-N 3.03Å; E128-R132 IonicContact OE1-CZ 3.24Å; E128-R132 IonicContact OE1-NE 3.24Å; E128-R132 PolarHBondContact OE1-NE 3.03Å; E128-R132 IonicContact OE1-NH2 2.73Å; E128-R132 PolarHBondContact OE1-NH2 3.43Å; T130-R132 PolarHBondContact O-N 3.35Å; R132-T134 PolarHBondContact O-N 3.45Å; R132-A135 PolarHBondContact O-N 2.94Å; R132-T136 PolarHBondContact O-N 3.49Å; R132-T136 PolarHBondContact O-OG1 2.86Å
133	L	87.6	Confident	89	Confident	96 Å²	96	102 Å²	102	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-62	-43.2	178.5	-175	67.9	0	0	0	112.6	K129 T130 N131 T136 R137	K129-L133 WeakPolarHBondContact O-CB 3.34Å; K129-L133 PolarHBondContact O-N 3.11Å; T130-L133 PolarHBondContact O-N 3.36Å; N131-L133 VanDerWaalsContact C-N 3.34Å; N131-L133 PolarHBondContact O-N 3.25Å; L133-T136 PolarHBondContact O-N 3.39Å; L133-R137 WeakPolarHBondContact O-CB 3.33Å; L133-R137 PolarHBondContact O-N 3.27Å
134	T	87.9	Confident	88.9	Confident	38 Å²	38	103.6 Å²	103.6	23%	0.233	48%	0.481	C	S	.	.	H	α-helix	trans	-67.5	-35.5	177.8	63.2	0	0	0	0	112.6	T130 N131 R132 R137 R138	T130-T134 WeakPolarHBondContact O-CG2 3.41Å; T130-T134 PolarHBondContact O-N 2.93Å; N131-T134 PolarHBondContact O-N 3.02Å; N131-T134 PolarHBondContact O-OG1 3.19Å; R132-T134 PolarHBondContact O-N 3.45Å; T134-R137 PolarHBondContact O-N 3.42Å; T134-R138 WeakPolarHBondContact O-CG 3.39Å; T134-R138 PolarHBondContact O-N 3.21Å
135	A	88.4	Confident	88.6	Confident	54 Å²	54	100 Å²	100	45%	0.446	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-50.8	174	0	0	0	0	0	111.5	N131 R132 R137 R138 E139	N131-A135 PolarHBondContact O-N 3.06Å; R132-A135 PolarHBondContact O-N 2.94Å; A135-R137 VanDerWaalsContact C-N 3.29Å; A135-R137 PolarHBondContact O-N 2.89Å; A135-R138 PolarHBondContact O-N 3.19Å; A135-E139 PolarHBondContact O-N 2.86Å
136	T	87.8	Confident	88.4	Confident	96 Å²	96	100.1 Å²	100.1	59%	0.589	47%	0.469	S	S	*	.	H	α-helix	trans	-60.3	-38	176.3	-56.3	0	0	0	0	112	R132 L133 E139 C140	R132-T136 PolarHBondContact O-N 3.49Å; R132-T136 PolarHBondContact O-OG1 2.86Å; L133-T136 PolarHBondContact O-N 3.39Å; T136-E139 PolarHBondContact O-N 3.4Å; T136-C140 VanDerWaalsContact O-CB 3.27Å; T136-C140 WeakPolarHBondContact O-CB 3.24Å; T136-C140 PolarHBondContact O-N 3.47Å
137	R	88.7	Confident	88.1	Confident	200 Å²	200	97.8 Å²	97.8	76%	0.755	46%	0.457	S	S	*	.	H	α-helix	trans	-64.8	-39.5	176.7	-171.1	173.7	-179	170.8	0.8	112.5	L133 T134 A135 H141	L133-R137 WeakPolarHBondContact O-CB 3.33Å; L133-R137 PolarHBondContact O-N 3.27Å; T134-R137 PolarHBondContact O-N 3.42Å; A135-R137 VanDerWaalsContact C-N 3.29Å; A135-R137 PolarHBondContact O-N 2.89Å; R137-H141 WeakPolarHBondContact O-CB 3.34Å; R137-H141 PolarHBondContact O-N 2.96Å
138	R	87.4	Confident	87.4	Confident	150 Å²	150	97.7 Å²	97.7	57%	0.566	46%	0.458	S	S	*	.	H	α-helix	trans	-65.6	-46	174.7	-71.7	171.5	-172.6	159.8	5.5	111.6	T134 A135 H141 R142	T134-R138 WeakPolarHBondContact O-CG 3.39Å; T134-R138 PolarHBondContact O-N 3.21Å; A135-R138 PolarHBondContact O-N 3.19Å; R138-H141 PolarHBondContact O-N 2.79Å; R138-R142 WeakPolarHBondContact O-CB 3.46Å; R138-R142 PolarHBondContact O-N 3.43Å
139	E	87.8	Confident	86.6	Confident	57 Å²	57	95.2 Å²	95.2	27%	0.266	45%	0.45	S	S	.	.	H	α-helix	trans	-64.8	-40.5	178.3	174.7	60.2	-176.7	0	0	112.2	A135 T136 H141 R142 R143	A135-E139 PolarHBondContact O-N 2.86Å; T136-E139 PolarHBondContact O-N 3.4Å; E139-H141 PolarHBondContact O-N 3.38Å; E139-R142 VanDerWaalsContact CD-NH2 3.28Å; E139-R142 PolarHBondContact O-N 2.91Å; E139-R142 IonicContact OE1-CZ 2.68Å; E139-R142 IonicContact OE1-NH2 3.6Å; E139-R142 PolarHBondContact OE1-NH2 3.32Å; E139-R142 IonicContact OE2-CZ 3.8Å; E139-R142 VanDerWaalsContact OE2-CZ 3.26Å; E139-R142 IonicContact OE2-NE 3.45Å; E139-R142 PolarHBondContact OE2-NE 2.95Å; E139-R142 IonicContact OE2-NH2 3.16Å; E139-R142 PolarHBondContact OE2-NH2 3.47Å; E139-R143 WeakPolarHBondContact O-CG 3.41Å; E139-R143 PolarHBondContact O-N 2.94Å; E139-R143 IonicContact OE1-CZ 3.41Å; E139-R143 VanDerWaalsContact OE1-CZ 3.23Å; E139-R143 IonicContact OE1-NE 3.17Å; E139-R143 PolarHBondContact OE1-NE 2.65Å; E139-R143 IonicContact OE1-NH2 3.7Å; E139-R143 PolarHBondContact OE1-NH2 2.97Å
140	C	87.2	Confident	86.3	Confident	55 Å²	55	95.1 Å²	95.1	37%	0.372	45%	0.451	S	S	.	.	H	α-helix	trans	-62.4	-41.3	173.6	-176.3	0	0	0	0	112	T136 R143 R144	T136-C140 VanDerWaalsContact O-CB 3.27Å; T136-C140 WeakPolarHBondContact O-CB 3.24Å; T136-C140 PolarHBondContact O-N 3.47Å; C140-R143 PolarHBondContact O-N 2.91Å; C140-R144 WeakPolarHBondContact O-CB 3.28Å; C140-R144 PolarHBondContact O-N 3.49Å
141	H	87.3	Confident	85.7	Confident	117 Å²	117	97.2 Å²	97.2	54%	0.542	46%	0.457	S	S	.	.	H	α-helix	trans	-63.6	-45.7	174.5	-175.8	62.5	0	0	0	112.1	R137 R138 E139 R143 R144 L145	R137-H141 WeakPolarHBondContact O-CB 3.34Å; R137-H141 PolarHBondContact O-N 2.96Å; R138-H141 PolarHBondContact O-N 2.79Å; E139-H141 PolarHBondContact O-N 3.38Å; H141-R143 VanDerWaalsContact C-N 3.35Å; H141-R143 PolarHBondContact O-N 3.34Å; H141-R144 PolarHBondContact O-N 2.93Å; H141-R144 VanDerWaalsContact O-N 3.16Å; H141-L145 PolarHBondContact O-N 3.44Å
142	R	85.6	Confident	84.7	Confident	93 Å²	93	97.7 Å²	97.7	35%	0.351	46%	0.456	S	S	.	.	H	α-helix	trans	-58.2	-43.9	176	-168.3	-172.7	68.6	84.4	3.2	112.1	R138 E139 L145 L146 N235	R138-R142 WeakPolarHBondContact O-CB 3.46Å; R138-R142 PolarHBondContact O-N 3.43Å; E139-R142 VanDerWaalsContact CD-NH2 3.28Å; E139-R142 PolarHBondContact O-N 2.91Å; E139-R142 IonicContact OE1-CZ 2.68Å; E139-R142 IonicContact OE1-NH2 3.6Å; E139-R142 PolarHBondContact OE1-NH2 3.32Å; E139-R142 IonicContact OE2-CZ 3.8Å; E139-R142 VanDerWaalsContact OE2-CZ 3.26Å; E139-R142 IonicContact OE2-NE 3.45Å; E139-R142 PolarHBondContact OE2-NE 2.95Å; E139-R142 IonicContact OE2-NH2 3.16Å; E139-R142 PolarHBondContact OE2-NH2 3.47Å; R142-L145 PolarHBondContact O-N 2.96Å; R142-L146 PolarHBondContact O-N 3.36Å; R142-L146 VanDerWaalsContact O-N 3.09Å; R142-N235 WeakPolarHBondContact CD-OD1 3.32Å
143	R	89.3	Confident	83.6	Confident	132 Å²	132	95.6 Å²	95.6	50%	0.498	46%	0.456	S	S	.	.	H	α-helix	trans	-63.7	-43.1	174.3	-71	179.8	-167.7	-160.9	3	112.2	E139 C140 H141 L145 L146 L147	E139-R143 WeakPolarHBondContact O-CG 3.41Å; E139-R143 PolarHBondContact O-N 2.94Å; E139-R143 IonicContact OE1-CZ 3.41Å; E139-R143 VanDerWaalsContact OE1-CZ 3.23Å; E139-R143 IonicContact OE1-NE 3.17Å; E139-R143 PolarHBondContact OE1-NE 2.65Å; E139-R143 IonicContact OE1-NH2 3.7Å; E139-R143 PolarHBondContact OE1-NH2 2.97Å; C140-R143 PolarHBondContact O-N 2.91Å; H141-R143 VanDerWaalsContact C-N 3.35Å; H141-R143 PolarHBondContact O-N 3.34Å; R143-L145 PolarHBondContact O-N 2.84Å; R143-L146 PolarHBondContact O-N 3.21Å; R143-L147 WeakPolarHBondContact O-CB 3.4Å; R143-L147 WeakPolarHBondContact O-CG 3.42Å; R143-L147 PolarHBondContact O-N 2.95Å
144	R	88.4	Confident	82.6	Confident	162 Å²	162	95.7 Å²	95.7	61%	0.611	46%	0.455	S	S	*	.	H	α-helix	trans	-62.3	-41.8	177.1	-173.3	178.9	-67	-158.6	-3.6	112	C140 H141 L147 M148	C140-R144 WeakPolarHBondContact O-CB 3.28Å; C140-R144 PolarHBondContact O-N 3.49Å; H141-R144 PolarHBondContact O-N 2.93Å; H141-R144 VanDerWaalsContact O-N 3.16Å; R144-L147 PolarHBondContact O-N 3.02Å; R144-M148 WeakPolarHBondContact O-CG 3.16Å; R144-M148 PolarHBondContact O-N 3.16Å
145	L	86.9	Confident	81.3	Confident	59 Å²	59	99.1 Å²	99.1	31%	0.309	47%	0.472	S	S	.	.	H	α-helix	trans	-63.7	-43.5	176.8	-175.1	63.8	0	0	0	111.7	H141 R142 R143 M148 A149 E239	H141-L145 PolarHBondContact O-N 3.44Å; R142-L145 PolarHBondContact O-N 2.96Å; R143-L145 PolarHBondContact O-N 2.84Å; L145-M148 PolarHBondContact O-N 3.35Å; L145-A149 PolarHBondContact O-N 3.49Å; L145-E239 HydrophobicContact CD2-CG 4.06Å
146	L	85.5	Confident	79.8	Confident	99 Å²	99	99.2 Å²	99.2	52%	0.518	47%	0.47	S	S	.	.	H	α-helix	trans	-62.4	-43.6	175.4	-178.5	67.3	0	0	0	112.1	R142 R143 A149 Q150	R142-L146 PolarHBondContact O-N 3.36Å; R142-L146 VanDerWaalsContact O-N 3.09Å; R143-L146 PolarHBondContact O-N 3.21Å; L146-A149 PolarHBondContact O-N 3.24Å; L146-Q150 WeakPolarHBondContact O-CB 3.26Å; L146-Q150 PolarHBondContact O-N 2.97Å
147	L	82.4	Confident	78.1	Confident	72 Å²	72	96.2 Å²	96.2	38%	0.377	46%	0.457	S	S	.	.	H	α-helix	trans	-63.4	-40.7	176.1	-73.9	169.3	0	0	0	111.9	R143 R144 Q150 Q151 F299	R143-L147 WeakPolarHBondContact O-CB 3.4Å; R143-L147 WeakPolarHBondContact O-CG 3.42Å; R143-L147 PolarHBondContact O-N 2.95Å; R144-L147 PolarHBondContact O-N 3.02Å; L147-Q150 PolarHBondContact O-N 3.29Å; L147-Q151 VanDerWaalsContact O-CB 3.29Å; L147-Q151 WeakPolarHBondContact O-CB 3.29Å; L147-Q151 PolarHBondContact O-N 3.31Å; L147-F299 HydrophobicContact CD2-CD1 4.43Å; L147-F299 HydrophobicContact CD2-CE1 4.14Å
148	M	77.1	Confident	76.3	Confident	111 Å²	111	91.9 Å²	91.9	55%	0.547	46%	0.455	S	S	.	.	H	α-helix	trans	-67.3	-37.4	175.6	-74.4	-171.7	127.5	0	0	112.6	R144 L145 Q151 Q152	R144-M148 WeakPolarHBondContact O-CG 3.16Å; R144-M148 PolarHBondContact O-N 3.16Å; L145-M148 PolarHBondContact O-N 3.35Å; M148-Q151 PolarHBondContact O-N 3.38Å; M148-Q152 WeakPolarHBondContact O-CB 3.23Å; M148-Q152 VanDerWaalsContact O-CG 3.31Å; M148-Q152 WeakPolarHBondContact O-CG 3.38Å; M148-Q152 PolarHBondContact O-N 3.26Å
149	A	76.4	Confident	74.6	Confident	24 Å²	24	94.1 Å²	94.1	20%	0.198	47%	0.472	C	S	.	.	H	α-helix	trans	-64.7	-43	173.1	0	0	0	0	0	111.8	L145 L146 L153	L145-A149 PolarHBondContact O-N 3.49Å; L146-A149 PolarHBondContact O-N 3.24Å; A149-L153 WeakPolarHBondContact O-CG 3.22Å; A149-L153 PolarHBondContact O-N 2.89Å
150	Q	79.9	Confident	73.1	Confident	89 Å²	89	93.2 Å²	93.2	42%	0.416	47%	0.472	S	S	.	.	H	α-helix	trans	-63.8	-41.4	174.4	-178.3	176	-12.3	0	0	111.9	L146 L147 L153 M154	L146-Q150 WeakPolarHBondContact O-CB 3.26Å; L146-Q150 PolarHBondContact O-N 2.97Å; L147-Q150 PolarHBondContact O-N 3.29Å; Q150-L153 WeakPolarHBondContact O-CB 3.33Å; Q150-L153 PolarHBondContact O-N 3.46Å; Q150-M154 HydrophobicContact CG-SD 4.33Å; Q150-M154 PolarHBondContact O-N 3.33Å
151	Q	77.2	Confident	72.1	Confident	103 Å²	103	93.3 Å²	93.3	48%	0.481	47%	0.468	S	S	.	.	H	α-helix	trans	-68.3	-39.7	179.1	179.6	163.5	3.8	0	0	112	L147 M148 L153 M154 D155	L147-Q151 VanDerWaalsContact O-CB 3.29Å; L147-Q151 WeakPolarHBondContact O-CB 3.29Å; L147-Q151 PolarHBondContact O-N 3.31Å; M148-Q151 PolarHBondContact O-N 3.38Å; Q151-L153 PolarHBondContact O-N 2.81Å; Q151-M154 CarbonylContact O-C 3.25Å; Q151-M154 WeakPolarHBondContact O-CA 3.4Å; Q151-M154 WeakPolarHBondContact O-CB 3.32Å; Q151-M154 PolarHBondContact O-N 3.09Å; Q151-D155 WeakPolarHBondContact CG-OD2 3.26Å; Q151-D155 PolarHBondContact NE2-OD2 3.39Å; Q151-D155 WeakPolarHBondContact O-CB 3.31Å; Q151-D155 PolarHBondContact O-N 3.47Å
152	Q	70.5	Confident	71.4	Confident	92 Å²	92	91 Å²	91	43%	0.43	46%	0.457	S	S	.	.	H	α-helix	trans	-61.2	-32.4	173.6	-73.9	173.3	9	0	0	112.7	M148 M154 S156	M148-Q152 WeakPolarHBondContact O-CB 3.23Å; M148-Q152 VanDerWaalsContact O-CG 3.31Å; M148-Q152 WeakPolarHBondContact O-CG 3.38Å; M148-Q152 PolarHBondContact O-N 3.26Å; Q152-M154 VanDerWaalsContact C-N 3.27Å; Q152-M154 PolarHBondContact O-N 3.35Å; Q152-S156 WeakPolarHBondContact O-CB 3.32Å; Q152-S156 PolarHBondContact O-N 2.84Å; Q152-S156 PolarHBondContact O-OG 2.61Å
153	L	67.1	Low	71.2	Confident	109 Å²	109	93.4 Å²	93.4	57%	0.571	47%	0.471	S	S	*	.	H	α-helix	trans	-71.9	-16.3	172.2	-67.5	168.1	0	0	0	113.6	A149 Q150 Q151	A149-L153 WeakPolarHBondContact O-CG 3.22Å; A149-L153 PolarHBondContact O-N 2.89Å; Q150-L153 WeakPolarHBondContact O-CB 3.33Å; Q150-L153 PolarHBondContact O-N 3.46Å; Q151-L153 PolarHBondContact O-N 2.81Å
154	M	66.5	Low	71	Confident	97 Å²	97	87.7 Å²	87.7	48%	0.478	45%	0.451	S	S	.	.	H	α-helix	trans	-98.6	-45.2	177.1	-71.6	172.7	44.7	0	0	112.7	Q150 Q151 Q152 S156 M292	Q150-M154 HydrophobicContact CG-SD 4.33Å; Q150-M154 PolarHBondContact O-N 3.33Å; Q151-M154 CarbonylContact O-C 3.25Å; Q151-M154 WeakPolarHBondContact O-CA 3.4Å; Q151-M154 WeakPolarHBondContact O-CB 3.32Å; Q151-M154 PolarHBondContact O-N 3.09Å; Q152-M154 VanDerWaalsContact C-N 3.27Å; Q152-M154 PolarHBondContact O-N 3.35Å; M154-S156 CarbonylContact O-C 3.59Å; M154-S156 PolarHBondContact O-N 3.5Å; M154-M292 HydrophobicContact CE-CE 3.56Å; M154-M292 HydrophobicContact SD-CE 4.17Å
155	D	60.2	Low	70.8	Confident	111 Å²	111	86.5 Å²	86.5	59%	0.594	46%	0.455	S	S	*	.	H	α-helix	trans	-67.8	-12.5	177.3	-66.2	-10.5	0	0	0	111.8	Q151 G157	Q151-D155 WeakPolarHBondContact CG-OD2 3.26Å; Q151-D155 PolarHBondContact NE2-OD2 3.39Å; Q151-D155 WeakPolarHBondContact O-CB 3.31Å; Q151-D155 PolarHBondContact O-N 3.47Å; D155-G157 PolarHBondContact O-N 2.88Å
156	S	56.3	Low	70.7	Confident	56 Å²	56	87.6 Å²	87.6	39%	0.392	46%	0.456	S	S	.	.	S	Bend	trans	-60.4	64.3	152.7	-66.3	0	0	0	0	111.4	Q152 M154 S160	Q152-S156 WeakPolarHBondContact O-CB 3.32Å; Q152-S156 PolarHBondContact O-N 2.84Å; Q152-S156 PolarHBondContact O-OG 2.61Å; M154-S156 CarbonylContact O-C 3.59Å; M154-S156 PolarHBondContact O-N 3.5Å; S156-S160 WeakPolarHBondContact O-CB 3.41Å; S156-S160 PolarHBondContact O-OG 2.99Å
157	G	51.9	Low	70.8	Confident	32 Å²	32	84.3 Å²	84.3	33%	0.33	44%	0.441	S	S	.	.			trans	-64.1	-175.1	-177.4	0	0	0	0	0	114.3	D155 Q159 S160	D155-G157 PolarHBondContact O-N 2.88Å; G157-Q159 PolarHBondContact O-N 2.88Å; G157-S160 WeakPolarHBondContact O-CB 3.38Å; G157-S160 PolarHBondContact O-N 3.3Å; G157-S160 PolarHBondContact O-OG 2.71Å
158	P	52	Low	70.9	Confident	110 Å²	110	87.6 Å²	87.6	71%	0.714	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	8.8	-162.4	24.6	-35.5	0	0	0	118
159	Q	51.3	Low	71.3	Confident	197 Å²	197	87.9 Å²	87.9	92%	0.921	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-18.1	167.2	-58.2	-171.9	53	0	0	113.2	G157 L161	G157-Q159 PolarHBondContact O-N 2.88Å; Q159-L161 PolarHBondContact O-N 2.88Å
160	S	57.2	Low	71.6	Confident	37 Å²	37	88.7 Å²	88.7	26%	0.259	47%	0.471	S	S	.	.	S	Bend	trans	-66	-23.5	166.5	73.5	0	0	0	0	112.4	S156 G157 H162	S156-S160 WeakPolarHBondContact O-CB 3.41Å; S156-S160 PolarHBondContact O-OG 2.99Å; G157-S160 WeakPolarHBondContact O-CB 3.38Å; G157-S160 PolarHBondContact O-N 3.3Å; G157-S160 PolarHBondContact O-OG 2.71Å; S160-H162 PolarHBondContact O-CD2 2.98Å; S160-H162 VanDerWaalsContact O-CD2 3.27Å; S160-H162 PolarHBondContact O-N 3.13Å
161	L	64.8	Low	71.6	Confident	57 Å²	57	86.5 Å²	86.5	30%	0.298	46%	0.46	S	S	.	.			trans	-57.1	107.6	-170.8	-132.3	66.7	0	0	0	109.6	Q159 K163 A170 F171 V172	Q159-L161 PolarHBondContact O-N 2.88Å; L161-K163 WeakPolarHBondContact O-CG 3.44Å; L161-K163 PolarHBondContact O-N 3.11Å; L161-A170 HydrophobicContact CB-CB 4.13Å; L161-A170 HydrophobicContact CD2-CB 3.61Å; L161-A170 HydrophobicContact CG-CB 3.73Å; L161-F171 CarbonylContact C-O 3.51Å; L161-V172 HydrophobicContact CD1-CG2 4.27Å
162	H	72.5	Confident	71.4	Confident	68 Å²	68	86.5 Å²	86.5	32%	0.315	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	93.2	-175.9	-66.9	-88.2	0	0	0	109.1	S160 A170 F171 A174 L177	S160-H162 PolarHBondContact O-CD2 2.98Å; S160-H162 VanDerWaalsContact O-CD2 3.27Å; S160-H162 PolarHBondContact O-N 3.13Å; H162-A170 WeakPolarHBondContact O-CA 3.37Å; H162-F171 HydrophobicContact CB-CB 4.44Å; H162-F171 PolarHBondContact N-O 3.45Å; H162-F171 WeakPolarHBondContact O-CD2 3.43Å; H162-F171 PolarHBondContact O-N 3.44Å; H162-A174 PolarHBondContact CD2-N 2.84Å; H162-A174 PolarHBondContact NE2-N 3.37Å; H162-L177 HydrophobicContact CB-CB 3.86Å; H162-L177 HydrophobicContact CB-CD2 3.8Å; H162-L177 HydrophobicContact CB-CG 4.41Å
163	K	82.3	Confident	71.5	Confident	144 Å²	144	85.3 Å²	85.3	63%	0.626	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.4	-178.6	-61.2	179.1	-172.9	173.3	0	110.1	L161 A170	L161-K163 WeakPolarHBondContact O-CG 3.44Å; L161-K163 PolarHBondContact O-N 3.11Å; K163-A170 HydrophobicContact CG-CB 3.91Å
164	C	85.6	Confident	72.1	Confident	12 Å²	12	82.3 Å²	82.3	8%	0.081	46%	0.455	C	S	.	.			trans	-72.4	136.4	169.2	-171.1	0	0	0	0	110.1	Y166 C167 K169 L177 H180	C164-Y166 PolarHBondContact O-N 3.36Å; C164-Y166 PolarHBondContact SG-N 2.96Å; C164-Y166 VanDerWaalsContact SG-N 3.39Å; C164-C167 WeakPolarHBondContact CB-O 3.45Å; C164-C167 VanDerWaalsContact O-O 3.07Å; C164-K169 PolarHBondContact N-O 3.24Å; C164-L177 HydrophobicContact CB-CD1 3.85Å; C164-H180 PolarHBondContact SG-NE2 2.89Å; C164-H180 VanDerWaalsContact SG-NE2 3.4Å
165	I	83.9	Confident	72.7	Confident	137 Å²	137	80.4 Å²	80.4	70%	0.703	45%	0.451	S	S	*	.	S	Bend	trans	-75.5	-14.7	175.2	58	175.2	0	0	0	112.9
166	Y	84.7	Confident	73.8	Confident	82 Å²	82	81.1 Å²	81.1	32%	0.322	45%	0.449	S	S	.	.	S	Bend	trans	-110.1	-11.3	-174.2	-50.5	-63.2	0	0	0	114.3	C164 I181 H185 T188	C164-Y166 PolarHBondContact O-N 3.36Å; C164-Y166 PolarHBondContact SG-N 2.96Å; C164-Y166 VanDerWaalsContact SG-N 3.39Å; Y166-I181 HydrophobicContact CD2-CG1 4.47Å; Y166-I181 HydrophobicContact CD2-CG2 4.37Å; Y166-I181 HydrophobicContact CE2-CG2 3.93Å; Y166-H185 VanDerWaalsContact CB-CG 3.47Å; Y166-H185 VanDerWaalsContact CB-ND1 3.29Å; Y166-H185 WeakPolarHBondContact CB-ND1 3.43Å; Y166-H185 HydrophobicContact CD2-CB 3.47Å; Y166-H185 VanDerWaalsContact CD2-CB 3.47Å; Y166-H185 AromaticContact CD2-CG 3.59Å; Y166-H185 HydrophobicContact CE2-CB 4.04Å; Y166-H185 HydrophobicContact CG-CB 4.04Å; Y166-H185 AromaticContact CG-CG 3.85Å; Y166-T188 HydrophobicContact CD1-CG2 3.74Å; Y166-T188 HydrophobicContact CE1-CG2 3.27Å; Y166-T188 PolarHBondContact OH-O 3.02Å; Y166-T188 VanDerWaalsContact OH-O 3.1Å
167	C	87.4	Confident	75.1	Confident	31 Å²	31	79.9 Å²	79.9	21%	0.209	44%	0.438	C	S	.	.	S	Bend	trans	-157.1	162.6	176.1	86.7	0	0	0	0	111.5	C164 K169 H180	C164-C167 WeakPolarHBondContact CB-O 3.45Å; C164-C167 VanDerWaalsContact O-O 3.07Å; C167-K169 PolarHBondContact O-N 3.04Å; C167-H180 VanDerWaalsContact SG-CE1 3.56Å; C167-H180 PolarHBondContact SG-NE2 3.43Å
168	P	84.6	Confident	76.6	Confident	141 Å²	141	81 Å²	81	92%	0.916	45%	0.445	S	S	*	.	S	Bend	trans	-73.6	18.4	-172.4	31.6	-37.4	0	0	0	115.2
169	K	85	Confident	78.3	Confident	117 Å²	117	79.2 Å²	79.2	51%	0.509	43%	0.431	S	S	.	.			trans	-88.2	142.6	-179.3	-65.4	-178.7	-179.7	-178.1	0	111.2	C164 C167 F171	C164-K169 PolarHBondContact N-O 3.24Å; C167-K169 PolarHBondContact O-N 3.04Å; K169-F171 HydrophobicContact CB-CE2 3.68Å; K169-F171 HydrophobicContact CB-CZ 3.67Å; K169-F171 HydrophobicContact CD-CZ 4.4Å
170	A	82	Confident	80.1	Confident	41 Å²	41	70.7 Å²	70.7	34%	0.339	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	146.7	177.6	0	0	0	0	0	110.3	L161 H162 K163	L161-A170 HydrophobicContact CB-CB 4.13Å; L161-A170 HydrophobicContact CD2-CB 3.61Å; L161-A170 HydrophobicContact CG-CB 3.73Å; H162-A170 WeakPolarHBondContact O-CA 3.37Å; K163-A170 HydrophobicContact CG-CB 3.91Å
171	F	80.3	Confident	81.5	Confident	42 Å²	42	69.9 Å²	69.9	18%	0.184	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.7	-168.7	-60.7	-85.5	0	0	0	111.6	L161 H162 K169 N173 F176 L177 H180	L161-F171 CarbonylContact C-O 3.51Å; H162-F171 HydrophobicContact CB-CB 4.44Å; H162-F171 PolarHBondContact N-O 3.45Å; H162-F171 WeakPolarHBondContact O-CD2 3.43Å; H162-F171 PolarHBondContact O-N 3.44Å; K169-F171 HydrophobicContact CB-CE2 3.68Å; K169-F171 HydrophobicContact CB-CZ 3.67Å; K169-F171 HydrophobicContact CD-CZ 4.4Å; F171-N173 PolarHBondContact O-N 3.47Å; F171-F176 HydrophobicContact CB-CB 3.91Å; F171-F176 HydrophobicContact CD1-CB 3.84Å; F171-F176 HydrophobicContact CG-CB 4.16Å; F171-L177 HydrophobicContact CB-CB 4.27Å; F171-L177 HydrophobicContact CD2-CB 4.03Å; F171-L177 HydrophobicContact CD2-CD1 3.89Å; F171-L177 HydrophobicContact CE2-CD1 4.19Å; F171-L177 HydrophobicContact CG-CB 4.35Å; F171-H180 HydrophobicContact CE1-CB 3.85Å; F171-H180 HydrophobicContact CE2-CB 3.84Å; F171-H180 AromaticContact CE2-CD2 3.12Å; F171-H180 WeakPolarHBondContact CE2-CD2 3.41Å; F171-H180 AromaticContact CE2-CG 3.56Å; F171-H180 AromaticContact CE2-NE2 3.9Å; F171-H180 HydrophobicContact CZ-CB 3.44Å; F171-H180 VanDerWaalsContact CZ-CB 3.44Å; F171-H180 AromaticContact CZ-CD2 3.29Å; F171-H180 WeakPolarHBondContact CZ-CD2 3.35Å; F171-H180 AromaticContact CZ-CG 3.23Å; F171-H180 AromaticContact CZ-ND1 3.95Å; F171-H180 AromaticContact CZ-NE2 3.99Å
172	V	74	Confident	82.4	Confident	104 Å²	104	73.4 Å²	73.4	63%	0.63	40%	0.399	S	S	*	.	S	Bend	trans	-69	-16.9	-177.2	-174.7	0	0	0	0	112.7	L161	L161-V172 HydrophobicContact CD1-CG2 4.27Å
173	N	72.6	Confident	83.1	Confident	67 Å²	67	79.1 Å²	79.1	36%	0.358	42%	0.418	S	S	.	.	S	Bend	trans	-146.6	144.4	179.8	-171.6	-34.1	0	0	0	110.1	F171 S175 F176 L177	F171-N173 PolarHBondContact O-N 3.47Å; N173-S175 VanDerWaalsContact CG-OG 3.29Å; N173-S175 PolarHBondContact O-N 3.08Å; N173-S175 PolarHBondContact OD1-N 2.6Å; N173-S175 VanDerWaalsContact OD1-N 3.14Å; N173-S175 PolarHBondContact OD1-OG 3.45Å; N173-F176 HydrophobicContact CB-CD2 3.82Å; N173-F176 HydrophobicContact CB-CE2 4.25Å; N173-F176 PolarHBondContact O-N 2.88Å; N173-L177 PolarHBondContact O-N 3.44Å
174	A	78.5	Confident	83.1	Confident	45 Å²	45	80.9 Å²	80.9	37%	0.372	42%	0.42	S	S	.	.	H	α-helix	trans	-51.9	-35.7	176.3	0	0	0	0	0	113.1	H162 F176 L177 A178	H162-A174 PolarHBondContact CD2-N 2.84Å; H162-A174 PolarHBondContact NE2-N 3.37Å; A174-F176 VanDerWaalsContact C-N 3.32Å; A174-F176 PolarHBondContact O-N 3Å; A174-L177 PolarHBondContact O-N 2.91Å; A174-L177 VanDerWaalsContact O-N 3.17Å; A174-A178 PolarHBondContact O-N 3.43Å
175	S	79.1	Confident	83	Confident	58 Å²	58	81.7 Å²	81.7	41%	0.406	42%	0.423	S	S	.	.	H	α-helix	trans	-60.4	-38.4	177.2	59.1	0	0	0	0	113	N173 T179	N173-S175 VanDerWaalsContact CG-OG 3.29Å; N173-S175 PolarHBondContact O-N 3.08Å; N173-S175 PolarHBondContact OD1-N 2.6Å; N173-S175 VanDerWaalsContact OD1-N 3.14Å; N173-S175 PolarHBondContact OD1-OG 3.45Å; S175-T179 WeakPolarHBondContact O-CB 3.37Å; S175-T179 PolarHBondContact O-N 2.93Å; S175-T179 PolarHBondContact O-OG1 3.47Å
176	F	83.9	Confident	82.3	Confident	126 Å²	126	78.7 Å²	78.7	55%	0.553	41%	0.412	S	S	*	.	H	α-helix	trans	-73.1	-35.9	174.9	-65.5	-54.7	0	0	0	111.9	F171 N173 A174 H180	F171-F176 HydrophobicContact CB-CB 3.91Å; F171-F176 HydrophobicContact CD1-CB 3.84Å; F171-F176 HydrophobicContact CG-CB 4.16Å; N173-F176 HydrophobicContact CB-CD2 3.82Å; N173-F176 HydrophobicContact CB-CE2 4.25Å; N173-F176 PolarHBondContact O-N 2.88Å; A174-F176 VanDerWaalsContact C-N 3.32Å; A174-F176 PolarHBondContact O-N 3Å; F176-H180 VanDerWaalsContact O-CB 3.26Å; F176-H180 WeakPolarHBondContact O-CB 3.42Å; F176-H180 PolarHBondContact O-N 3.41Å
177	L	84.6	Confident	81	Confident	29 Å²	29	83.1 Å²	83.1	15%	0.152	44%	0.436	C	S	.	.	H	α-helix	trans	-62.4	-49.8	172.5	173.1	61.4	0	0	0	111.2	H162 C164 F171 N173 A174 T179 H180 I181	H162-L177 HydrophobicContact CB-CB 3.86Å; H162-L177 HydrophobicContact CB-CD2 3.8Å; H162-L177 HydrophobicContact CB-CG 4.41Å; C164-L177 HydrophobicContact CB-CD1 3.85Å; F171-L177 HydrophobicContact CB-CB 4.27Å; F171-L177 HydrophobicContact CD2-CB 4.03Å; F171-L177 HydrophobicContact CD2-CD1 3.89Å; F171-L177 HydrophobicContact CE2-CD1 4.19Å; F171-L177 HydrophobicContact CG-CB 4.35Å; N173-L177 PolarHBondContact O-N 3.44Å; A174-L177 PolarHBondContact O-N 2.91Å; A174-L177 VanDerWaalsContact O-N 3.17Å; L177-T179 PolarHBondContact O-N 2.95Å; L177-H180 WeakPolarHBondContact O-CA 3.39Å; L177-H180 WeakPolarHBondContact O-CB 3.36Å; L177-H180 PolarHBondContact O-N 2.92Å; L177-H180 VanDerWaalsContact O-N 3.08Å; L177-I181 HydrophobicContact CD1-CD1 3.79Å; L177-I181 HydrophobicContact CD1-CG1 3.92Å; L177-I181 HydrophobicContact CD2-CD1 4.44Å; L177-I181 HydrophobicContact CG-CD1 3.87Å; L177-I181 HydrophobicContact CG-CG1 4.4Å; L177-I181 WeakPolarHBondContact O-CG1 3.28Å; L177-I181 PolarHBondContact O-N 3.31Å
178	A	83.2	Confident	79.5	Confident	57 Å²	57	84.3 Å²	84.3	47%	0.471	44%	0.442	S	S	.	.	H	α-helix	trans	-59.2	-46	178	0	0	0	0	0	111.5	A174 H180 I181 H182	A174-A178 PolarHBondContact O-N 3.43Å; A178-H180 VanDerWaalsContact C-N 3.25Å; A178-H180 PolarHBondContact O-N 3.49Å; A178-I181 PolarHBondContact O-N 2.93Å; A178-H182 WeakPolarHBondContact O-CB 3.39Å; A178-H182 PolarHBondContact O-N 2.66Å
179	T	86.5	Confident	77.8	Confident	71 Å²	71	82.8 Å²	82.8	44%	0.436	42%	0.423	S	S	.	.	H	α-helix	trans	-60.8	-34.4	174.9	-56.8	0	0	0	0	112.2	S175 L177 R183	S175-T179 WeakPolarHBondContact O-CB 3.37Å; S175-T179 PolarHBondContact O-N 2.93Å; S175-T179 PolarHBondContact O-OG1 3.47Å; L177-T179 PolarHBondContact O-N 2.95Å; T179-R183 VanDerWaalsContact O-CB 3.27Å; T179-R183 WeakPolarHBondContact O-CB 3.43Å; T179-R183 VanDerWaalsContact O-CG 3.24Å; T179-R183 WeakPolarHBondContact O-CG 3.18Å; T179-R183 PolarHBondContact O-N 3.49Å
180	H	89.2	Confident	75.9	Confident	18 Å²	18	81 Å²	81	8%	0.083	43%	0.43	C	S	.	.	H	α-helix	trans	-72.3	-47.2	176.4	162.2	52.3	0	0	0	112.6	C164 C167 F171 F176 L177 A178 R183 R184 H185	C164-H180 PolarHBondContact SG-NE2 2.89Å; C164-H180 VanDerWaalsContact SG-NE2 3.4Å; C167-H180 VanDerWaalsContact SG-CE1 3.56Å; C167-H180 PolarHBondContact SG-NE2 3.43Å; F171-H180 HydrophobicContact CE1-CB 3.85Å; F171-H180 HydrophobicContact CE2-CB 3.84Å; F171-H180 AromaticContact CE2-CD2 3.12Å; F171-H180 WeakPolarHBondContact CE2-CD2 3.41Å; F171-H180 AromaticContact CE2-CG 3.56Å; F171-H180 AromaticContact CE2-NE2 3.9Å; F171-H180 HydrophobicContact CZ-CB 3.44Å; F171-H180 VanDerWaalsContact CZ-CB 3.44Å; F171-H180 AromaticContact CZ-CD2 3.29Å; F171-H180 WeakPolarHBondContact CZ-CD2 3.35Å; F171-H180 AromaticContact CZ-CG 3.23Å; F171-H180 AromaticContact CZ-ND1 3.95Å; F171-H180 AromaticContact CZ-NE2 3.99Å; F176-H180 VanDerWaalsContact O-CB 3.26Å; F176-H180 WeakPolarHBondContact O-CB 3.42Å; F176-H180 PolarHBondContact O-N 3.41Å; L177-H180 WeakPolarHBondContact O-CA 3.39Å; L177-H180 WeakPolarHBondContact O-CB 3.36Å; L177-H180 PolarHBondContact O-N 2.92Å; L177-H180 VanDerWaalsContact O-N 3.08Å; A178-H180 VanDerWaalsContact C-N 3.25Å; A178-H180 PolarHBondContact O-N 3.49Å; H180-R183 PolarHBondContact O-N 3.27Å; H180-R184 WeakPolarHBondContact O-CB 3.47Å; H180-R184 PolarHBondContact O-N 3.01Å; H180-H185 AromaticContact CE1-CD2 3.7Å; H180-H185 AromaticContact CE1-NE2 3.42Å; H180-H185 PolarHBondContact CE1-NE2 3.36Å; H180-H185 AromaticContact NE2-CD2 3.68Å; H180-H185 AromaticContact NE2-NE2 3.5Å
181	I	86.3	Confident	74.1	Confident	21 Å²	21	84.2 Å²	84.2	11%	0.108	45%	0.446	C	S	.	.	H	α-helix	trans	-57.2	-53.1	176.6	-67	169.1	0	0	0	108.8	Y166 L177 A178 R183 R184 H185 E189	Y166-I181 HydrophobicContact CD2-CG1 4.47Å; Y166-I181 HydrophobicContact CD2-CG2 4.37Å; Y166-I181 HydrophobicContact CE2-CG2 3.93Å; L177-I181 HydrophobicContact CD1-CD1 3.79Å; L177-I181 HydrophobicContact CD1-CG1 3.92Å; L177-I181 HydrophobicContact CD2-CD1 4.44Å; L177-I181 HydrophobicContact CG-CD1 3.87Å; L177-I181 HydrophobicContact CG-CG1 4.4Å; L177-I181 WeakPolarHBondContact O-CG1 3.28Å; L177-I181 PolarHBondContact O-N 3.31Å; A178-I181 PolarHBondContact O-N 2.93Å; I181-R183 PolarHBondContact O-N 3.47Å; I181-R183 VanDerWaalsContact O-N 3.12Å; I181-R184 PolarHBondContact O-N 2.76Å; I181-H185 HydrophobicContact CG2-CB 4.25Å; I181-H185 CarbonylContact O-C 3.24Å; I181-H185 VanDerWaalsContact O-C 3.24Å; I181-H185 VanDerWaalsContact O-CA 3.3Å; I181-H185 WeakPolarHBondContact O-CA 3.43Å; I181-H185 PolarHBondContact O-N 3.31Å; I181-E189 HydrophobicContact CG2-CG 3.62Å; I181-E189 VanDerWaalsContact CG2-OE1 3.25Å; I181-E189 WeakPolarHBondContact CG2-OE1 3.3Å
182	H	84.3	Confident	72.2	Confident	131 Å²	131	89.5 Å²	89.5	61%	0.606	48%	0.476	S	S	*	.	H	α-helix	trans	-60.2	-28	-179.8	-167.9	56.9	0	0	0	113.9	A178	A178-H182 WeakPolarHBondContact O-CB 3.39Å; A178-H182 PolarHBondContact O-N 2.66Å
183	R	86.4	Confident	70.5	Confident	188 Å²	188	95.8 Å²	95.8	71%	0.709	49%	0.488	S	S	*	.	H	α-helix	trans	-95	-16.4	179.6	-73.6	-178.6	172.2	-156.7	-3	115.9	T179 H180 I181	T179-R183 VanDerWaalsContact O-CB 3.27Å; T179-R183 WeakPolarHBondContact O-CB 3.43Å; T179-R183 VanDerWaalsContact O-CG 3.24Å; T179-R183 WeakPolarHBondContact O-CG 3.18Å; T179-R183 PolarHBondContact O-N 3.49Å; H180-R183 PolarHBondContact O-N 3.27Å; I181-R183 PolarHBondContact O-N 3.47Å; I181-R183 VanDerWaalsContact O-N 3.12Å
184	R	82.7	Confident	68.6	Low	181 Å²	181	99.4 Å²	99.4	68%	0.683	51%	0.508	S	S	*	.	H	α-helix	trans	-133.6	-16.2	-171.9	-62.5	-62.3	-179.6	-160.6	5	114.6	H180 I181	H180-R184 WeakPolarHBondContact O-CB 3.47Å; H180-R184 PolarHBondContact O-N 3.01Å; I181-R184 PolarHBondContact O-N 2.76Å
185	H	83	Confident	66.7	Low	29 Å²	29	104 Å²	104	13%	0.134	53%	0.531	C	S	.	.			trans	-130.3	38.1	174.6	-54.3	-68	0	0	0	112.6	Y166 H180 I181 E187 T188	Y166-H185 VanDerWaalsContact CB-CG 3.47Å; Y166-H185 VanDerWaalsContact CB-ND1 3.29Å; Y166-H185 WeakPolarHBondContact CB-ND1 3.43Å; Y166-H185 HydrophobicContact CD2-CB 3.47Å; Y166-H185 VanDerWaalsContact CD2-CB 3.47Å; Y166-H185 AromaticContact CD2-CG 3.59Å; Y166-H185 HydrophobicContact CE2-CB 4.04Å; Y166-H185 HydrophobicContact CG-CB 4.04Å; Y166-H185 AromaticContact CG-CG 3.85Å; H180-H185 AromaticContact CE1-CD2 3.7Å; H180-H185 AromaticContact CE1-NE2 3.42Å; H180-H185 PolarHBondContact CE1-NE2 3.36Å; H180-H185 AromaticContact NE2-CD2 3.68Å; H180-H185 AromaticContact NE2-NE2 3.5Å; I181-H185 HydrophobicContact CG2-CB 4.25Å; I181-H185 CarbonylContact O-C 3.24Å; I181-H185 VanDerWaalsContact O-C 3.24Å; I181-H185 VanDerWaalsContact O-CA 3.3Å; I181-H185 WeakPolarHBondContact O-CA 3.43Å; I181-H185 PolarHBondContact O-N 3.31Å; H185-E187 PolarHBondContact O-N 3.15Å; H185-E187 VanDerWaalsContact O-N 3.16Å; H185-T188 PolarHBondContact O-N 3.07Å; H185-T188 VanDerWaalsContact O-N 3.09Å
186	P	69.6	Low	64.6	Low	74 Å²	74	106.9 Å²	106.9	48%	0.481	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.4	179.6	30	-36.3	0	0	0	112.5	T188	P186-T188 PolarHBondContact O-N 2.73Å
187	E	57.4	Low	62.4	Low	175 Å²	175	107.2 Å²	107.2	82%	0.818	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-6.1	178.6	-59.1	-178.6	171.6	0	0	113.3	H185	H185-E187 PolarHBondContact O-N 3.15Å; H185-E187 VanDerWaalsContact O-N 3.16Å
188	T	56.1	Low	60.1	Low	56 Å²	56	115.8 Å²	115.8	34%	0.344	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121	-10.1	-169.5	-23.2	0	0	0	0	114.9	Y166 H185 P186 A190	Y166-T188 HydrophobicContact CD1-CG2 3.74Å; Y166-T188 HydrophobicContact CE1-CG2 3.27Å; Y166-T188 PolarHBondContact OH-O 3.02Å; Y166-T188 VanDerWaalsContact OH-O 3.1Å; H185-T188 PolarHBondContact O-N 3.07Å; H185-T188 VanDerWaalsContact O-N 3.09Å; P186-T188 PolarHBondContact O-N 2.73Å; T188-A190 PolarHBondContact O-N 3.04Å
189	E	49.3	Very low	57.8	Low	108 Å²	108	118.8 Å²	118.8	51%	0.505	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-77.1	-8.9	166.6	-65	-169.2	136.2	0	0	112.7	I181 T191	I181-E189 HydrophobicContact CG2-CG 3.62Å; I181-E189 VanDerWaalsContact CG2-OE1 3.25Å; I181-E189 WeakPolarHBondContact CG2-OE1 3.3Å; E189-T191 PolarHBondContact O-N 2.97Å
190	A	44.3	Very low	55.3	Low	80 Å²	80	121.9 Å²	121.9	66%	0.661	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-78.2	-12.6	-173.4	0	0	0	0	0	115.2	T188	T188-A190 PolarHBondContact O-N 3.04Å
191	T	45.3	Very low	53	Low	108 Å²	108	129.3 Å²	129.3	66%	0.663	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-94.9	-10.6	-161.4	-39.7	0	0	0	0	114.9	E189	E189-T191 PolarHBondContact O-N 2.97Å
192	D	40.7	Very low	50.4	Low	153 Å²	153	134.4 Å²	134.4	82%	0.818	70%	0.695	S	S	*	*	S	Bend	trans	-120.3	28.7	-172.7	-135.6	-12.1	0	0	0	114.3
193	R	38	Very low	47.9	Very low	236 Å²	236	134.2 Å²	134.2	89%	0.891	71%	0.707	S	S	*	*			trans	-133.7	80.5	165.6	-78.6	-169.6	172.2	-177.2	-0.9	110.8
194	N	32.8	Very low	45.2	Very low	144 Å²	144	132.8 Å²	132.8	77%	0.77	71%	0.713	S	S	*	*			trans	-66.1	155	173.5	-83.5	-61.1	0	0	0	112.6
195	T	38.8	Very low	42.9	Very low	140 Å²	140	131.7 Å²	131.7	86%	0.859	72%	0.719	S	S	*	*	S	Bend	trans	68.6	143.8	178.5	22.9	0	0	0	0	117.1
196	P	33.3	Very low	40.6	Very low	120 Å²	120	136.4 Å²	136.4	78%	0.779	75%	0.75	S	S	*	*			trans	-100.7	161.6	-161.2	39.2	-36.5	0	0	0	114.8
197	V	37.7	Very low	38.8	Very low	132 Å²	132	139.3 Å²	139.3	80%	0.8	76%	0.761	S	S	*	*			trans	-164.5	139	142.1	134.1	0	0	0	0	111.5
198	Y	37.4	Very low	37.9	Very low	209 Å²	209	138.9 Å²	138.9	82%	0.82	77%	0.765	S	S	*	*			trans	-8.4	142.7	173.1	-65.4	-92.3	0	0	0	123
199	P	35.4	Very low	37.1	Very low	121 Å²	121	142.4 Å²	142.4	79%	0.786	79%	0.786	S	S	*	*			trans	-90	142.4	166.8	36.3	-32	0	0	0	113.1
200	T	33.9	Very low	36.5	Very low	136 Å²	136	143.7 Å²	143.7	83%	0.834	80%	0.804	S	S	*	*			trans	-139.1	130.1	165.3	-56.8	0	0	0	0	111.4
201	H	41.1	Very low	35.8	Very low	173 Å²	173	150.3 Å²	150.3	80%	0.801	81%	0.813	S	S	*	*			trans	-55.3	146.4	-172.9	-60.4	-101.7	0	0	0	116.4
202	P	31	Very low	35.7	Very low	129 Å²	129	149 Å²	149	84%	0.838	81%	0.806	S	S	*	*			trans	-74.5	146.5	153.2	34	-32.3	0	0	0	110.1
203	C	31.7	Very low	35.4	Very low	127 Å²	127	148.8 Å²	148.8	86%	0.858	80%	0.801	S	S	*	*			trans	-137.1	152.8	175.2	-142.4	0	0	0	0	111.8
204	L	30	Very low	35.4	Very low	158 Å²	158	145.2 Å²	145.2	83%	0.827	80%	0.798	S	S	*	*			trans	-108.3	-168.8	-176.9	-69.2	163.2	0	0	0	110.3
205	I	34.8	Very low	35.7	Very low	157 Å²	157	144 Å²	144	81%	0.805	79%	0.787	S	S	*	*			trans	63.7	151	166.1	37.1	-177.8	0	0	0	116.7
206	T	34.1	Very low	35.5	Very low	128 Å²	128	144.5 Å²	144.5	79%	0.785	78%	0.78	S	S	*	*			cis	-136.9	161.4	12	2.3	0	0	0	0	113.2
207	N	31.2	Very low	35.5	Very low	135 Å²	135	144.2 Å²	144.2	72%	0.722	78%	0.781	S	S	*	*			trans	-63.4	165.2	169.8	-45.2	-48	0	0	0	113.7
208	N	39.3	Very low	35.9	Very low	167 Å²	167	144.4 Å²	144.4	89%	0.893	77%	0.773	S	S	*	*				-166.5	134.8	120.1	-93.5	-25.4	0	0	0	112.8
209	T	38.6	Very low	36	Very low	130 Å²	130	141.4 Å²	141.4	80%	0.798	77%	0.766	S	S	*	*			trans	-100.3	168.2	175.4	48.1	0	0	0	0	110.7
210	P	37.3	Very low	36.4	Very low	134 Å²	134	142.8 Å²	142.8	87%	0.87	77%	0.766	S	S	*	*				-142.4	-172.8	88.5	28	-5.2	0	0	0	115.8
211	Y	30.3	Very low	36.6	Very low	219 Å²	219	146.1 Å²	146.1	86%	0.859	76%	0.764	S	S	*	*			trans	-155	172.2	-156.9	-171.9	-119.7	0	0	0	107.1
212	P	42.3	Very low	36.7	Very low	80 Å²	80	143 Å²	143	52%	0.519	75%	0.75	S	S	.	*			cis	-135.4	-149.8	-24.4	38.8	-17.7	0	0	0	114.6
213	Q	33.6	Very low	37.3	Very low	150 Å²	150	144 Å²	144	70%	0.701	74%	0.743	S	S	*	*			trans	86	130.7	155.1	-119.3	159.5	-20.6	0	0	114.6
214	I	38.3	Very low	37.6	Very low	161 Å²	161	141 Å²	141	83%	0.826	72%	0.724	S	S	*	*			cis	-145.3	170.1	32.8	-67.4	156	0	0	0	108.6
215	Q	40.4	Very low	37.9	Very low	117 Å²	117	138.3 Å²	138.3	55%	0.547	71%	0.711	S	S	.	*				-176.9	133	-54.6	177.3	169.3	-28.2	0	0	107.7
216	Q	34.6	Very low	38.3	Very low	151 Å²	151	135.7 Å²	135.7	71%	0.706	70%	0.698	S	S	*	*			trans	52.5	107.3	162.6	-71.3	164.9	-31.5	0	0	120.7
217	S	33.6	Very low	38.6	Very low	114 Å²	114	135.9 Å²	135.9	80%	0.797	69%	0.69	S	S	*	*	S	Bend	trans	-162.9	-28.9	143.6	56.8	0	0	0	0	115.1
218	Q	44.5	Very low	38.9	Very low	136 Å²	136	137.2 Å²	137.2	64%	0.636	69%	0.686	S	S	*	*	S	Bend	trans	-101	1.1	-167	-62.8	-174.7	3.2	0	0	117.2	I220	Q218-I220 VanDerWaalsContact C-N 3.27Å; Q218-I220 PolarHBondContact O-N 3.22Å; Q218-I220 VanDerWaalsContact O-N 3.09Å
219	Q	40.1	Very low	39.2	Very low	147 Å²	147	133 Å²	133	69%	0.687	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-2.4	-165.5	-79.3	-177.7	-34.7	0	0	117
220	I	44.2	Very low	39.4	Very low	150 Å²	150	129.4 Å²	129.4	77%	0.769	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-22.7	-176.9	-65.3	177.1	0	0	0	112.8	Q218	Q218-I220 VanDerWaalsContact C-N 3.27Å; Q218-I220 PolarHBondContact O-N 3.22Å; Q218-I220 VanDerWaalsContact O-N 3.09Å
221	Y	37.3	Very low	39.8	Very low	206 Å²	206	127.2 Å²	127.2	81%	0.808	63%	0.631	S	S	*	*	S	Bend	trans	-107.9	15.7	-173	-76.1	-80.8	0	0	0	115.1
222	Q	44.3	Very low	40.8	Very low	106 Å²	106	121.4 Å²	121.4	50%	0.495	62%	0.615	S	S	.	*	S	Bend	trans	-124.2	6.2	-176.7	-63.4	-178.8	7	0	0	114.2	N226	Q222-N226 PolarHBondContact O-ND2 3.02Å
223	Q	43	Very low	41.4	Very low	150 Å²	150	123.2 Å²	123.2	70%	0.701	62%	0.62	S	S	*	*	H	α-helix	trans	-92	-26.3	-177	-65.3	-171	1.2	0	0	114.1
224	S	38.8	Very low	42.1	Very low	64 Å²	64	122.6 Å²	122.6	45%	0.448	62%	0.619	S	S	.	*	H	α-helix	trans	-65	-53.8	175.4	49.8	0	0	0	0	111.8	N226 Q227 Y228	S224-N226 PolarHBondContact O-N 2.81Å; S224-Q227 WeakPolarHBondContact O-CB 3.45Å; S224-Q227 PolarHBondContact O-N 2.78Å; S224-Q227 VanDerWaalsContact O-N 3.17Å; S224-Y228 VanDerWaalsContact O-CD2 3.26Å; S224-Y228 WeakPolarHBondContact O-CD2 3.44Å
225	D	36.1	Very low	42.9	Very low	103 Å²	103	117.4 Å²	117.4	55%	0.551	59%	0.593	S	S	*	*	H	α-helix	trans	-76.9	-33.1	-162.1	-60	2.2	0	0	0	111.5	Q227 Y228 T229	D225-Q227 PolarHBondContact O-N 2.82Å; D225-Y228 PolarHBondContact O-N 3.02Å; D225-T229 PolarHBondContact O-N 3.5Å; D225-T229 VanDerWaalsContact O-N 3.1Å; D225-T229 PolarHBondContact O-OG1 3.43Å
226	N	41.8	Very low	43.9	Very low	101 Å²	101	115.5 Å²	115.5	54%	0.54	59%	0.589	S	S	.	*	H	α-helix	trans	-64.7	-25.7	173.4	-78.9	-54.3	0	0	0	113.2	Q222 S224 T229 A230	Q222-N226 PolarHBondContact O-ND2 3.02Å; S224-N226 PolarHBondContact O-N 2.81Å; N226-T229 WeakPolarHBondContact CA-OG1 3.14Å; N226-T229 PolarHBondContact O-OG1 3.16Å; N226-A230 VanDerWaalsContact O-CB 3.23Å; N226-A230 WeakPolarHBondContact O-CB 3.49Å; N226-A230 PolarHBondContact O-N 2.67Å
227	Q	41.7	Very low	45.5	Very low	132 Å²	132	111 Å²	111	62%	0.617	58%	0.575	S	S	*	*	H	α-helix	trans	-75.6	-29.9	175.8	-163.9	167.9	82.5	0	0	111.8	S224 D225 N231	S224-Q227 WeakPolarHBondContact O-CB 3.45Å; S224-Q227 PolarHBondContact O-N 2.78Å; S224-Q227 VanDerWaalsContact O-N 3.17Å; D225-Q227 PolarHBondContact O-N 2.82Å; Q227-N231 WeakPolarHBondContact O-CB 3.24Å; Q227-N231 VanDerWaalsContact O-CG 3.31Å; Q227-N231 PolarHBondContact O-N 3.2Å; Q227-N231 PolarHBondContact O-ND2 3.29Å
228	Y	37.3	Very low	47.1	Very low	163 Å²	163	109.4 Å²	109.4	64%	0.639	56%	0.557	S	S	*	*	H	α-helix	trans	-76.4	-38	173.2	-63.6	-66	0	0	0	112.7	S224 D225 N232	S224-Y228 VanDerWaalsContact O-CD2 3.26Å; S224-Y228 WeakPolarHBondContact O-CD2 3.44Å; D225-Y228 PolarHBondContact O-N 3.02Å; Y228-N232 PolarHBondContact O-N 3Å; Y228-N232 PolarHBondContact O-ND2 3.31Å; Y228-N232 VanDerWaalsContact O-ND2 3.17Å
229	T	44.4	Very low	48.2	Very low	79 Å²	79	106.6 Å²	106.6	49%	0.485	54%	0.544	S	S	.	.	H	α-helix	trans	-70.5	-41.9	177	57.3	0	0	0	0	112.3	D225 N226 N231 N232 N233	D225-T229 PolarHBondContact O-N 3.5Å; D225-T229 VanDerWaalsContact O-N 3.1Å; D225-T229 PolarHBondContact O-OG1 3.43Å; N226-T229 WeakPolarHBondContact CA-OG1 3.14Å; N226-T229 PolarHBondContact O-OG1 3.16Å; T229-N231 PolarHBondContact O-N 3.41Å; T229-N232 PolarHBondContact O-N 3.35Å; T229-N233 PolarHBondContact O-N 3.39Å; T229-N233 VanDerWaalsContact O-N 3.08Å
230	A	44.1	Very low	49.9	Very low	55 Å²	55	104.4 Å²	104.4	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-60.5	-44.7	176	0	0	0	0	0	112.3	N226 N232 N233 M234	N226-A230 VanDerWaalsContact O-CB 3.23Å; N226-A230 WeakPolarHBondContact O-CB 3.49Å; N226-A230 PolarHBondContact O-N 2.67Å; A230-N232 VanDerWaalsContact C-N 3.34Å; A230-N232 PolarHBondContact O-N 3.13Å; A230-N233 PolarHBondContact O-N 3.45Å; A230-M234 PolarHBondContact O-N 2.88Å
231	N	45.4	Very low	51.3	Low	88 Å²	88	100.8 Å²	100.8	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-65.5	-34.2	178	-78.4	-30.7	0	0	0	112.9	Q227 T229 N235	Q227-N231 WeakPolarHBondContact O-CB 3.24Å; Q227-N231 VanDerWaalsContact O-CG 3.31Å; Q227-N231 PolarHBondContact O-N 3.2Å; Q227-N231 PolarHBondContact O-ND2 3.29Å; T229-N231 PolarHBondContact O-N 3.41Å; N231-N235 PolarHBondContact O-N 2.86Å; N231-N235 PolarHBondContact O-ND2 3.15Å
232	N	50.3	Low	53	Low	97 Å²	97	92.4 Å²	92.4	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-68	-42.1	174.2	-73.4	-30.1	0	0	0	111.9	Y228 T229 A230 N235 T236	Y228-N232 PolarHBondContact O-N 3Å; Y228-N232 PolarHBondContact O-ND2 3.31Å; Y228-N232 VanDerWaalsContact O-ND2 3.17Å; T229-N232 PolarHBondContact O-N 3.35Å; A230-N232 VanDerWaalsContact C-N 3.34Å; A230-N232 PolarHBondContact O-N 3.13Å; N232-N235 PolarHBondContact O-N 3.5Å; N232-T236 PolarHBondContact O-N 2.94Å; N232-T236 PolarHBondContact O-OG1 3.34Å
233	N	54.9	Low	54.4	Low	117 Å²	117	93.9 Å²	93.9	63%	0.626	49%	0.487	S	S	*	.	H	α-helix	trans	-67.3	-34.6	174.5	-87.8	-5.8	0	0	0	113.1	T229 A230 T236 S237	T229-N233 PolarHBondContact O-N 3.39Å; T229-N233 VanDerWaalsContact O-N 3.08Å; A230-N233 PolarHBondContact O-N 3.45Å; N233-T236 WeakPolarHBondContact CA-OG1 3.31Å; N233-T236 PolarHBondContact O-OG1 3.34Å; N233-S237 WeakPolarHBondContact O-CB 3.42Å; N233-S237 PolarHBondContact O-N 2.73Å
234	M	48.4	Very low	55.9	Low	137 Å²	137	90.5 Å²	90.5	68%	0.675	47%	0.471	S	S	*	.	H	α-helix	trans	-62.3	-44.1	172	-99.5	-74.9	178.9	0	0	111.7	A230 L238	A230-M234 PolarHBondContact O-N 2.88Å; M234-L238 WeakPolarHBondContact O-CB 3.35Å; M234-L238 PolarHBondContact O-N 2.96Å
235	N	55.3	Low	57.3	Low	52 Å²	52	92.5 Å²	92.5	28%	0.278	48%	0.476	S	S	.	.	H	α-helix	trans	-66.7	-43.4	177.3	-72.6	-43.4	0	0	0	112	R142 N231 N232 S237 L238 E239	R142-N235 WeakPolarHBondContact CD-OD1 3.32Å; N231-N235 PolarHBondContact O-N 2.86Å; N231-N235 PolarHBondContact O-ND2 3.15Å; N232-N235 PolarHBondContact O-N 3.5Å; N235-S237 PolarHBondContact O-N 3.17Å; N235-L238 PolarHBondContact O-N 3.19Å; N235-E239 WeakPolarHBondContact O-CB 3.38Å; N235-E239 WeakPolarHBondContact O-CG 3.47Å; N235-E239 PolarHBondContact O-N 2.96Å
236	T	62.1	Low	58.8	Low	77 Å²	77	91.1 Å²	91.1	47%	0.472	47%	0.468	S	S	.	.	H	α-helix	trans	-69	-32.3	178.4	55.1	0	0	0	0	113	N232 N233 H240	N232-T236 PolarHBondContact O-N 2.94Å; N232-T236 PolarHBondContact O-OG1 3.34Å; N233-T236 WeakPolarHBondContact CA-OG1 3.31Å; N233-T236 PolarHBondContact O-OG1 3.34Å; T236-H240 VanDerWaalsContact O-CB 3.24Å; T236-H240 WeakPolarHBondContact O-CB 3.32Å; T236-H240 PolarHBondContact O-N 2.86Å
237	S	69	Low	60.1	Low	57 Å²	57	90.3 Å²	90.3	40%	0.399	46%	0.463	S	S	.	.	H	α-helix	trans	-64.6	-52.1	168.6	-164.2	0	0	0	0	110.6	N233 N235 E239 H240 D241	N233-S237 WeakPolarHBondContact O-CB 3.42Å; N233-S237 PolarHBondContact O-N 2.73Å; N235-S237 PolarHBondContact O-N 3.17Å; S237-E239 VanDerWaalsContact C-N 3.33Å; S237-E239 PolarHBondContact O-N 3.45Å; S237-H240 CarbonylContact O-C 3.57Å; S237-H240 WeakPolarHBondContact O-CA 3.35Å; S237-H240 VanDerWaalsContact O-CB 3.29Å; S237-H240 WeakPolarHBondContact O-CB 3.4Å; S237-H240 PolarHBondContact O-N 3.19Å; S237-D241 PolarHBondContact O-N 3.04Å; S237-D241 PolarHBondContact OG-OD2 2.96Å; S237-D241 VanDerWaalsContact OG-OD2 3.08Å
238	L	67	Low	61.1	Low	80 Å²	80	88.9 Å²	88.9	42%	0.419	46%	0.457	S	S	.	.	H	α-helix	trans	-61.4	-40.2	-178.3	-169.3	70.1	0	0	0	112.3	M234 N235 H240 D241 V242	M234-L238 WeakPolarHBondContact O-CB 3.35Å; M234-L238 PolarHBondContact O-N 2.96Å; N235-L238 PolarHBondContact O-N 3.19Å; L238-H240 VanDerWaalsContact C-N 3.31Å; L238-H240 PolarHBondContact O-N 3.43Å; L238-D241 PolarHBondContact O-N 3.35Å; L238-V242 VanDerWaalsContact O-CB 3.3Å; L238-V242 WeakPolarHBondContact O-CB 3.37Å; L238-V242 WeakPolarHBondContact O-CG2 3.43Å; L238-V242 PolarHBondContact O-N 3.48Å
239	E	66.2	Low	62	Low	78 Å²	78	87 Å²	87	36%	0.364	46%	0.457	S	S	.	.	H	α-helix	trans	-64.3	-33.8	172	-74.4	175.7	-158.1	0	0	112.8	L145 N235 S237 R243	L145-E239 HydrophobicContact CD2-CG 4.06Å; N235-E239 WeakPolarHBondContact O-CB 3.38Å; N235-E239 WeakPolarHBondContact O-CG 3.47Å; N235-E239 PolarHBondContact O-N 2.96Å; S237-E239 VanDerWaalsContact C-N 3.33Å; S237-E239 PolarHBondContact O-N 3.45Å; E239-R243 VanDerWaalsContact C-NH2 3.33Å; E239-R243 WeakPolarHBondContact O-CB 3.23Å; E239-R243 PolarHBondContact O-N 2.76Å; E239-R243 VanDerWaalsContact O-N 3.1Å; E239-R243 PolarHBondContact O-NE 3.17Å; E239-R243 PolarHBondContact O-NH2 3.02Å
240	H	75.4	Confident	62.7	Low	101 Å²	101	91.8 Å²	91.8	47%	0.468	47%	0.471	S	S	.	.	H	α-helix	trans	-68.5	-48.4	174.3	178.6	-78.9	0	0	0	111.2	T236 S237 L238 R243 E244	T236-H240 VanDerWaalsContact O-CB 3.24Å; T236-H240 WeakPolarHBondContact O-CB 3.32Å; T236-H240 PolarHBondContact O-N 2.86Å; S237-H240 CarbonylContact O-C 3.57Å; S237-H240 WeakPolarHBondContact O-CA 3.35Å; S237-H240 VanDerWaalsContact O-CB 3.29Å; S237-H240 WeakPolarHBondContact O-CB 3.4Å; S237-H240 PolarHBondContact O-N 3.19Å; L238-H240 VanDerWaalsContact C-N 3.31Å; L238-H240 PolarHBondContact O-N 3.43Å; H240-R243 PolarHBondContact O-N 3.27Å; H240-E244 WeakPolarHBondContact O-CB 3.36Å; H240-E244 PolarHBondContact O-N 3.42Å
241	D	75.1	Confident	62.9	Low	73 Å²	73	94.9 Å²	94.9	39%	0.39	48%	0.48	S	S	.	.	H	α-helix	trans	-69.1	-36.2	-176.5	-56.8	-31.7	0	0	0	111.3	S237 L238 E244 L245	S237-D241 PolarHBondContact O-N 3.04Å; S237-D241 PolarHBondContact OG-OD2 2.96Å; S237-D241 VanDerWaalsContact OG-OD2 3.08Å; L238-D241 PolarHBondContact O-N 3.35Å; D241-E244 PolarHBondContact O-N 2.86Å; D241-L245 WeakPolarHBondContact O-CB 3.48Å; D241-L245 VanDerWaalsContact O-CG 3.3Å; D241-L245 WeakPolarHBondContact O-CG 3.42Å; D241-L245 PolarHBondContact O-N 3.43Å
242	V	73.2	Confident	62.8	Low	30 Å²	30	97 Å²	97	18%	0.182	49%	0.491	C	S	.	.	H	α-helix	trans	-65.8	-43.3	169.9	169.5	0	0	0	0	111.4	L238 L245 L246	L238-V242 VanDerWaalsContact O-CB 3.3Å; L238-V242 WeakPolarHBondContact O-CB 3.37Å; L238-V242 WeakPolarHBondContact O-CG2 3.43Å; L238-V242 PolarHBondContact O-N 3.48Å; V242-L245 PolarHBondContact O-N 3.45Å; V242-L246 HydrophobicContact CG1-CD1 3.89Å; V242-L246 WeakPolarHBondContact O-CD1 3.4Å; V242-L246 PolarHBondContact O-N 2.82Å
243	R	73	Confident	62.5	Low	138 Å²	138	96.9 Å²	96.9	52%	0.521	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-42.4	174.5	-94.4	179.8	-80.7	99.5	0.5	112.2	E239 H240 L246 N247	E239-R243 VanDerWaalsContact C-NH2 3.33Å; E239-R243 WeakPolarHBondContact O-CB 3.23Å; E239-R243 PolarHBondContact O-N 2.76Å; E239-R243 VanDerWaalsContact O-N 3.1Å; E239-R243 PolarHBondContact O-NE 3.17Å; E239-R243 PolarHBondContact O-NH2 3.02Å; H240-R243 PolarHBondContact O-N 3.27Å; R243-L246 PolarHBondContact O-N 2.86Å; R243-N247 WeakPolarHBondContact O-CB 3.47Å; R243-N247 PolarHBondContact O-N 2.83Å
244	E	74.5	Confident	62	Low	79 Å²	79	97 Å²	97	37%	0.369	50%	0.503	S	S	.	.	H	α-helix	trans	-65.1	-43.5	179.4	-179.4	54.4	-155.1	0	0	111.2	H240 D241 N247 Q248	H240-E244 WeakPolarHBondContact O-CB 3.36Å; H240-E244 PolarHBondContact O-N 3.42Å; D241-E244 PolarHBondContact O-N 2.86Å; E244-N247 PolarHBondContact O-N 3.25Å; E244-N247 VanDerWaalsContact O-N 3.15Å; E244-Q248 WeakPolarHBondContact O-CG 3.36Å; E244-Q248 PolarHBondContact O-N 2.96Å; E244-Q248 PolarHBondContact OE1-NE2 2.91Å
245	L	68.7	Low	61.3	Low	105 Å²	105	97.6 Å²	97.6	55%	0.55	51%	0.509	S	S	.	.	H	α-helix	trans	-60.3	-45.5	172.5	-76	167.8	0	0	0	112.5	D241 V242 N247 Q248 L249	D241-L245 WeakPolarHBondContact O-CB 3.48Å; D241-L245 VanDerWaalsContact O-CG 3.3Å; D241-L245 WeakPolarHBondContact O-CG 3.42Å; D241-L245 PolarHBondContact O-N 3.43Å; V242-L245 PolarHBondContact O-N 3.45Å; L245-N247 VanDerWaalsContact C-N 3.26Å; L245-N247 PolarHBondContact O-N 3.41Å; L245-Q248 PolarHBondContact O-N 3.15Å; L245-L249 WeakPolarHBondContact O-CG 3.47Å; L245-L249 PolarHBondContact O-N 3.26Å; L245-L249 VanDerWaalsContact O-N 3.11Å
246	L	68	Low	60.5	Low	75 Å²	75	102.6 Å²	102.6	39%	0.393	53%	0.534	S	S	.	.	H	α-helix	trans	-59.7	-38.4	173.8	-96.1	83.1	0	0	0	111.8	V242 R243 K250	V242-L246 HydrophobicContact CG1-CD1 3.89Å; V242-L246 WeakPolarHBondContact O-CD1 3.4Å; V242-L246 PolarHBondContact O-N 2.82Å; R243-L246 PolarHBondContact O-N 2.86Å; L246-K250 WeakPolarHBondContact O-CB 3.39Å; L246-K250 PolarHBondContact O-N 3.01Å; L246-K250 VanDerWaalsContact O-N 3.09Å
247	N	68.7	Low	59.3	Low	83 Å²	83	104.8 Å²	104.8	44%	0.444	55%	0.55	S	S	.	.	H	α-helix	trans	-72	-41	-177.7	-153.2	33	0	0	0	111.7	R243 E244 L245 L249 K250 L251	R243-N247 WeakPolarHBondContact O-CB 3.47Å; R243-N247 PolarHBondContact O-N 2.83Å; E244-N247 PolarHBondContact O-N 3.25Å; E244-N247 VanDerWaalsContact O-N 3.15Å; L245-N247 VanDerWaalsContact C-N 3.26Å; L245-N247 PolarHBondContact O-N 3.41Å; N247-L249 VanDerWaalsContact C-N 3.33Å; N247-L249 PolarHBondContact O-N 3.41Å; N247-K250 PolarHBondContact O-N 3.37Å; N247-K250 VanDerWaalsContact O-N 3.13Å; N247-L251 WeakPolarHBondContact O-CG 3.49Å; N247-L251 PolarHBondContact O-N 2.96Å
248	Q	63	Low	57.5	Low	103 Å²	103	109.4 Å²	109.4	48%	0.481	57%	0.569	S	S	.	*	H	α-helix	trans	-62.4	-37.8	174.1	-71	179.6	21.3	0	0	112.4	E244 L245 K250 N252	E244-Q248 WeakPolarHBondContact O-CG 3.36Å; E244-Q248 PolarHBondContact O-N 2.96Å; E244-Q248 PolarHBondContact OE1-NE2 2.91Å; L245-Q248 PolarHBondContact O-N 3.15Å; Q248-K250 VanDerWaalsContact C-N 3.34Å; Q248-N252 PolarHBondContact O-ND2 3.32Å
249	L	56.6	Low	55.9	Low	123 Å²	123	113.8 Å²	113.8	64%	0.644	58%	0.584	S	S	*	*	H	α-helix	trans	-66.1	-34.7	172.8	-71.1	170	0	0	0	112.4	L245 N247 L251	L245-L249 WeakPolarHBondContact O-CG 3.47Å; L245-L249 PolarHBondContact O-N 3.26Å; L245-L249 VanDerWaalsContact O-N 3.11Å; N247-L249 VanDerWaalsContact C-N 3.33Å; N247-L249 PolarHBondContact O-N 3.41Å; L249-L251 VanDerWaalsContact C-N 3.33Å; L249-L251 PolarHBondContact O-N 2.97Å
250	K	57.7	Low	54.3	Low	180 Å²	180	117.2 Å²	117.2	78%	0.783	60%	0.6	S	S	*	*	H	α-helix	trans	-77.4	-13.5	-176.9	-148.6	170	-171.1	177	0	114.4	L246 N247 Q248	L246-K250 WeakPolarHBondContact O-CB 3.39Å; L246-K250 PolarHBondContact O-N 3.01Å; L246-K250 VanDerWaalsContact O-N 3.09Å; N247-K250 PolarHBondContact O-N 3.37Å; N247-K250 VanDerWaalsContact O-N 3.13Å; Q248-K250 VanDerWaalsContact C-N 3.34Å
251	L	48.7	Very low	52.4	Low	120 Å²	120	121.2 Å²	121.2	63%	0.628	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	1	-172.8	-73.3	170.1	0	0	0	115.5	N247 L249 P253	N247-L251 WeakPolarHBondContact O-CG 3.49Å; N247-L251 PolarHBondContact O-N 2.96Å; L249-L251 VanDerWaalsContact C-N 3.33Å; L249-L251 PolarHBondContact O-N 2.97Å; L251-P253 VanDerWaalsContact C-CD 3.47Å; L251-P253 WeakPolarHBondContact O-CD 3.2Å
252	N	42.2	Very low	50.4	Low	133 Å²	133	122.8 Å²	122.8	71%	0.711	64%	0.636	S	S	*	*			trans	-123.8	68	-175.1	-74	-76.2	0	0	0	115.3	Q248 P254	Q248-N252 PolarHBondContact O-ND2 3.32Å; N252-P254 WeakPolarHBondContact O-CD 3.09Å
253	P	45	Very low	48.8	Very low	94 Å²	94	127.1 Å²	127.1	61%	0.61	66%	0.664	S	S	*	*			trans	-80.9	116.7	167.6	31.8	-31.5	0	0	0	111.6	L251 N255	L251-P253 VanDerWaalsContact C-CD 3.47Å; L251-P253 WeakPolarHBondContact O-CD 3.2Å; P253-N255 PolarHBondContact O-N 3.43Å; P253-N255 PolarHBondContact O-ND2 2.93Å
254	P	44.8	Very low	46.9	Very low	120 Å²	120	126.7 Å²	126.7	78%	0.779	68%	0.677	S	S	*	*			trans	-72.4	112.7	179.5	28.5	-33.5	0	0	0	111.5	N252	N252-P254 WeakPolarHBondContact O-CD 3.09Å
255	N	33.8	Very low	45.1	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	70%	0.703	S	S	*	*			trans	-76.2	135.2	172.4	-80.7	-103.8	0	0	0	110.5	P253	P253-N255 PolarHBondContact O-N 3.43Å; P253-N255 PolarHBondContact O-ND2 2.93Å
256	L	38.5	Very low	43.5	Very low	156 Å²	156	134.3 Å²	134.3	82%	0.817	71%	0.711	S	S	*	*			trans	-132.6	114.4	178.6	-94.4	166.9	0	0	0	112
257	P	36.3	Very low	42	Very low	123 Å²	123	138.7 Å²	138.7	80%	0.799	73%	0.733	S	S	*	*			trans	-68.4	163.8	167.9	-20.6	34.5	0	0	0	113.3
258	I	32.4	Very low	40.4	Very low	155 Å²	155	137.8 Å²	137.8	80%	0.795	74%	0.743	S	S	*	*			trans	-107.7	129.7	-162.6	-39	169.4	0	0	0	111.7
259	K	33.5	Very low	39.2	Very low	172 Å²	172	142.1 Å²	142.1	75%	0.748	76%	0.761	S	S	*	*				161.2	149.8	121.4	-87.8	-172.8	168.3	-177.7	0	115
260	H	31.4	Very low	38.5	Very low	149 Å²	149	142.5 Å²	142.5	69%	0.69	76%	0.763	S	S	*	*			trans	-5.8	155	160.7	-36.2	-68.2	0	0	0	119.3
261	Q	35.6	Very low	37.9	Very low	185 Å²	185	138.7 Å²	138.7	86%	0.864	76%	0.755	S	S	*	*			cis	-167.3	149.9	37.7	-152.4	161.7	49.1	0	0	112.6
262	S	32.8	Very low	37.8	Very low	106 Å²	106	139.2 Å²	139.2	74%	0.741	75%	0.754	S	S	*	*			trans	-84	165.3	169.5	-22.5	0	0	0	0	111
263	P	39.3	Very low	37.9	Very low	121 Å²	121	141 Å²	141	79%	0.786	76%	0.758	S	S	*	*				-154.5	153.2	56.2	40.4	-18.2	0	0	0	121
264	T	33.7	Very low	37.9	Very low	129 Å²	129	140.9 Å²	140.9	79%	0.791	75%	0.753	S	S	*	*			trans	6.6	126	141.8	-38.6	0	0	0	0	123
265	R	36.5	Very low	38.1	Very low	243 Å²	243	140.3 Å²	140.3	92%	0.917	74%	0.738	S	S	*	*				-177.7	140.9	127.4	-97	165.8	-173.4	-161.7	1.8	106.8
266	S	35.4	Very low	38.8	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	73%	0.732	S	S	*	*			cis	132.8	158	14.9	-175.9	0	0	0	0	106.2
267	I	36.8	Very low	39.5	Very low	167 Å²	167	136.1 Å²	136.1	86%	0.856	72%	0.716	S	S	*	*			trans	75.1	120.9	-167.5	-48.5	160.6	0	0	0	112.3
268	G	34.6	Very low	40.4	Very low	64 Å²	64	133.7 Å²	133.7	66%	0.66	70%	0.7	S	S	*	*			cis	119.5	102.8	-15.6	0	0	0	0	0	115.5
269	F	37.9	Very low	42.2	Very low	194 Å²	194	131.5 Å²	131.5	85%	0.851	69%	0.689	S	S	*	*			trans	-163.2	179.8	153.6	-115.7	-81.6	0	0	0	109.2
270	D	41.7	Very low	44.1	Very low	130 Å²	130	130 Å²	130	70%	0.695	68%	0.679	S	S	*	*			trans	62.5	57	171.9	-58.4	-16.5	0	0	0	118.4
271	V	45.7	Very low	45.8	Very low	100 Å²	100	127 Å²	127	61%	0.606	67%	0.665	S	S	*	*	H	α-helix	trans	-77.6	-23.9	173.8	173.5	0	0	0	0	113.5
272	E	47	Very low	47.7	Very low	132 Å²	132	122.5 Å²	122.5	62%	0.617	65%	0.65	S	S	*	*	H	α-helix	trans	-72.5	-50.6	-171.6	-124.2	64.1	-104.7	0	0	114	N274 K275	E272-N274 PolarHBondContact O-N 3.42Å; E272-K275 PolarHBondContact O-N 3.01Å; E272-K275 IonicContact OE1-NZ 3.87Å; E272-K275 PolarHBondContact OE1-NZ 3.01Å
273	Q	43.4	Very low	49.9	Very low	170 Å²	170	123.4 Å²	123.4	79%	0.794	64%	0.643	S	S	*	*	H	α-helix	trans	-64.6	-30.6	179	-81	-169.6	-9.3	0	0	112.5	K275 N277	Q273-K275 VanDerWaalsContact C-N 3.32Å; Q273-K275 PolarHBondContact O-N 3.24Å; Q273-N277 PolarHBondContact O-N 3.22Å
274	N	45.4	Very low	51.6	Low	91 Å²	91	121.8 Å²	121.8	49%	0.487	63%	0.627	S	S	.	*	H	α-helix	trans	-70.8	-28.6	-176.3	-151.2	15.6	0	0	0	112.2	E272 N276 N277 T278	E272-N274 PolarHBondContact O-N 3.42Å; N274-N276 PolarHBondContact O-N 2.95Å; N274-N277 CarbonylContact O-C 3.26Å; N274-N277 PolarHBondContact O-N 2.96Å; N274-T278 WeakPolarHBondContact O-CG2 3.5Å; N274-T278 PolarHBondContact O-N 2.81Å; N274-T278 PolarHBondContact O-OG1 2.93Å; N274-T278 VanDerWaalsContact O-OG1 3.12Å
275	K	48.9	Very low	53.4	Low	108 Å²	108	121.5 Å²	121.5	47%	0.47	62%	0.618	S	S	.	*	H	α-helix	trans	-56.1	-52.7	176.2	-72.7	168.7	-179.6	169.7	0	112	E272 Q273 N277 T278 D279	E272-K275 PolarHBondContact O-N 3.01Å; E272-K275 IonicContact OE1-NZ 3.87Å; E272-K275 PolarHBondContact OE1-NZ 3.01Å; Q273-K275 VanDerWaalsContact C-N 3.32Å; Q273-K275 PolarHBondContact O-N 3.24Å; K275-N277 VanDerWaalsContact C-N 3.26Å; K275-N277 PolarHBondContact O-N 3.02Å; K275-T278 WeakPolarHBondContact CA-OG1 3.36Å; K275-T278 PolarHBondContact O-N 3.36Å; K275-T278 VanDerWaalsContact O-N 3.15Å; K275-T278 PolarHBondContact O-OG1 2.86Å; K275-D279 WeakPolarHBondContact O-CB 3.38Å; K275-D279 PolarHBondContact O-N 3.19Å
276	N	49.2	Very low	55.5	Low	128 Å²	128	113.6 Å²	113.6	68%	0.684	59%	0.592	S	S	*	*	H	α-helix	trans	-65.5	-33.2	179.5	-63.4	8.6	0	0	0	111.4	N274 D279 W280	N274-N276 PolarHBondContact O-N 2.95Å; N276-D279 PolarHBondContact O-N 3.23Å; N276-W280 PolarHBondContact O-N 2.92Å
277	N	51.9	Low	57.5	Low	89 Å²	89	113 Å²	113	48%	0.476	58%	0.578	S	S	.	*	H	α-helix	trans	-75	-24.3	176.4	-160.6	19	0	0	0	113.1	Q273 N274 K275 W280 H281	Q273-N277 PolarHBondContact O-N 3.22Å; N274-N277 CarbonylContact O-C 3.26Å; N274-N277 PolarHBondContact O-N 2.96Å; K275-N277 VanDerWaalsContact C-N 3.26Å; K275-N277 PolarHBondContact O-N 3.02Å; N277-W280 PolarHBondContact O-NE1 3.48Å; N277-W280 PolarHBondContact OD1-NE1 2.86Å; N277-H281 WeakPolarHBondContact O-CB 3.38Å
278	T	56.1	Low	59.4	Low	73 Å²	73	110.7 Å²	110.7	45%	0.448	56%	0.563	S	S	.	*	H	α-helix	trans	-81.6	-30.1	168.9	50.1	0	0	0	0	112.8	N274 K275 H281 T282	N274-T278 WeakPolarHBondContact O-CG2 3.5Å; N274-T278 PolarHBondContact O-N 2.81Å; N274-T278 PolarHBondContact O-OG1 2.93Å; N274-T278 VanDerWaalsContact O-OG1 3.12Å; K275-T278 WeakPolarHBondContact CA-OG1 3.36Å; K275-T278 PolarHBondContact O-N 3.36Å; K275-T278 VanDerWaalsContact O-N 3.15Å; K275-T278 PolarHBondContact O-OG1 2.86Å; T278-H281 PolarHBondContact O-N 2.72Å; T278-T282 VanDerWaalsContact O-CB 3.31Å; T278-T282 WeakPolarHBondContact O-CB 3.43Å; T278-T282 PolarHBondContact O-N 3.14Å; T278-T282 PolarHBondContact O-OG1 2.73Å
279	D	69.8	Low	61.6	Low	108 Å²	108	113.8 Å²	113.8	58%	0.578	56%	0.555	S	S	*	*	H	α-helix	trans	-69.1	-54.5	-175.1	-167	39.7	0	0	0	111.9	K275 N276 H281 T282 Q283	K275-D279 WeakPolarHBondContact O-CB 3.38Å; K275-D279 PolarHBondContact O-N 3.19Å; N276-D279 PolarHBondContact O-N 3.23Å; D279-H281 PolarHBondContact O-N 3.02Å; D279-T282 WeakPolarHBondContact O-CB 3.49Å; D279-T282 PolarHBondContact O-N 2.86Å; D279-T282 VanDerWaalsContact O-N 3.09Å; D279-Q283 WeakPolarHBondContact O-CB 3.41Å; D279-Q283 PolarHBondContact O-N 3.3Å
280	W	73	Confident	63.9	Low	140 Å²	140	109.5 Å²	109.5	53%	0.53	53%	0.533	S	S	.	.	H	α-helix	trans	-59.4	-34.8	175.8	83.4	-68.9	0	0	0	112.3	N276 N277 Q283 L284	N276-W280 PolarHBondContact O-N 2.92Å; N277-W280 PolarHBondContact O-NE1 3.48Å; N277-W280 PolarHBondContact OD1-NE1 2.86Å; W280-Q283 PolarHBondContact O-N 3.2Å; W280-L284 HydrophobicContact CZ3-CD2 4.46Å; W280-L284 VanDerWaalsContact O-CB 3.29Å; W280-L284 WeakPolarHBondContact O-CB 3.49Å; W280-L284 PolarHBondContact O-N 2.96Å
281	H	67.8	Low	65.7	Low	88 Å²	88	107 Å²	107	41%	0.407	52%	0.52	S	S	.	.	H	α-helix	trans	-74.3	-28.7	-178.8	-149.1	-40.3	0	0	0	112.1	N277 T278 D279 M285	N277-H281 WeakPolarHBondContact O-CB 3.38Å; T278-H281 PolarHBondContact O-N 2.72Å; D279-H281 PolarHBondContact O-N 3.02Å; H281-M285 VanDerWaalsContact O-CG 3.25Å; H281-M285 WeakPolarHBondContact O-CG 3.3Å; H281-M285 PolarHBondContact O-N 3.17Å
282	T	75.4	Confident	67.2	Low	90 Å²	90	105.8 Å²	105.8	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-75.3	-43.9	170	-57.5	0	0	0	0	110.5	T278 D279 L284 M285 E286	T278-T282 VanDerWaalsContact O-CB 3.31Å; T278-T282 WeakPolarHBondContact O-CB 3.43Å; T278-T282 PolarHBondContact O-N 3.14Å; T278-T282 PolarHBondContact O-OG1 2.73Å; D279-T282 WeakPolarHBondContact O-CB 3.49Å; D279-T282 PolarHBondContact O-N 2.86Å; D279-T282 VanDerWaalsContact O-N 3.09Å; T282-L284 VanDerWaalsContact C-N 3.34Å; T282-L284 PolarHBondContact O-N 3.27Å; T282-M285 PolarHBondContact O-N 3.45Å; T282-E286 VanDerWaalsContact O-CB 3.3Å; T282-E286 WeakPolarHBondContact O-CB 3.39Å; T282-E286 PolarHBondContact O-N 2.92Å
283	Q	78	Confident	68.9	Low	125 Å²	125	101.8 Å²	101.8	58%	0.584	49%	0.49	S	S	*	.	H	α-helix	trans	-62.5	-38.5	178	-169.7	173.4	50.5	0	0	112.3	D279 W280 E286 E287	D279-Q283 WeakPolarHBondContact O-CB 3.41Å; D279-Q283 PolarHBondContact O-N 3.3Å; W280-Q283 PolarHBondContact O-N 3.2Å; Q283-E286 PolarHBondContact O-N 3.45Å; Q283-E287 WeakPolarHBondContact O-CB 3.11Å; Q283-E287 PolarHBondContact O-N 3.22Å
284	L	76.1	Confident	70.9	Confident	87 Å²	87	99.5 Å²	99.5	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-68.1	-39.5	174.4	-176.8	65.7	0	0	0	112.4	W280 T282 E287 H288	W280-L284 HydrophobicContact CZ3-CD2 4.46Å; W280-L284 VanDerWaalsContact O-CB 3.29Å; W280-L284 WeakPolarHBondContact O-CB 3.49Å; W280-L284 PolarHBondContact O-N 2.96Å; T282-L284 VanDerWaalsContact C-N 3.34Å; T282-L284 PolarHBondContact O-N 3.27Å; L284-E287 PolarHBondContact O-N 2.9Å; L284-H288 WeakPolarHBondContact O-CB 3.41Å; L284-H288 PolarHBondContact O-N 3.14Å
285	M	71.6	Confident	72.5	Confident	123 Å²	123	100.1 Å²	100.1	61%	0.606	48%	0.484	S	S	*	.	H	α-helix	trans	-66.5	-40	173.1	-72.9	-70.5	-175.9	0	0	111.5	H281 T282 E287 H288 R289	H281-M285 VanDerWaalsContact O-CG 3.25Å; H281-M285 WeakPolarHBondContact O-CG 3.3Å; H281-M285 PolarHBondContact O-N 3.17Å; T282-M285 PolarHBondContact O-N 3.45Å; M285-E287 VanDerWaalsContact C-N 3.33Å; M285-H288 PolarHBondContact O-N 3.34Å; M285-R289 VanDerWaalsContact O-CB 3.25Å; M285-R289 WeakPolarHBondContact O-CB 3.27Å; M285-R289 PolarHBondContact O-N 3.4Å
286	E	79.4	Confident	74.2	Confident	77 Å²	77	101 Å²	101	36%	0.36	48%	0.484	S	S	.	.	H	α-helix	trans	-67.8	-31.8	175.6	176.4	57.7	-162	0	0	112.3	T282 Q283 R289 R290	T282-E286 VanDerWaalsContact O-CB 3.3Å; T282-E286 WeakPolarHBondContact O-CB 3.39Å; T282-E286 PolarHBondContact O-N 2.92Å; Q283-E286 PolarHBondContact O-N 3.45Å; E286-R289 VanDerWaalsContact CD-NH2 3.35Å; E286-R289 IonicContact OE1-CZ 3.87Å; E286-R289 IonicContact OE1-NE 2.72Å; E286-R289 IonicContact OE1-NH2 2.67Å; E286-R289 PolarHBondContact OE1-NH2 2.79Å; E286-R289 IonicContact OE2-CZ 2.65Å; E286-R289 IonicContact OE2-NE 3.33Å; E286-R289 PolarHBondContact OE2-NE 3.44Å; E286-R289 IonicContact OE2-NH2 3.74Å; E286-R289 PolarHBondContact OE2-NH2 3.38Å; E286-R290 WeakPolarHBondContact O-CG 3.38Å; E286-R290 PolarHBondContact O-N 3.49Å; E286-R290 PolarHBondContact O-NE 3.12Å
287	E	77.8	Confident	75.9	Confident	88 Å²	88	99.4 Å²	99.4	41%	0.411	47%	0.471	S	S	.	.	H	α-helix	trans	-67.3	-51.4	169.5	-175.5	140.3	-96.4	0	0	112.2	Q283 L284 M285 R289 R290 D291	Q283-E287 WeakPolarHBondContact O-CB 3.11Å; Q283-E287 PolarHBondContact O-N 3.22Å; L284-E287 PolarHBondContact O-N 2.9Å; M285-E287 VanDerWaalsContact C-N 3.33Å; E287-R289 PolarHBondContact O-N 3.06Å; E287-R290 VanDerWaalsContact CA-CZ 3.47Å; E287-R290 VanDerWaalsContact CA-NH2 3.29Å; E287-R290 WeakPolarHBondContact O-CA 3.42Å; E287-R290 WeakPolarHBondContact O-CB 3.49Å; E287-R290 PolarHBondContact O-N 2.91Å; E287-R290 IonicContact OE1-CZ 2.6Å; E287-R290 IonicContact OE1-NH1 2.76Å; E287-R290 PolarHBondContact OE1-NH1 3.28Å; E287-R290 VanDerWaalsContact OE1-NH1 3.16Å; E287-R290 IonicContact OE1-NH2 2.66Å; E287-R290 PolarHBondContact OE1-NH2 3.44Å; E287-D291 PolarHBondContact O-N 3.34Å
288	H	77.7	Confident	77.5	Confident	119 Å²	119	96.7 Å²	96.7	55%	0.551	46%	0.464	S	S	*	.	H	α-helix	trans	-63.5	-32.2	178.1	-149.6	43.1	0	0	0	111.7	L284 M285 D291 M292	L284-H288 WeakPolarHBondContact O-CB 3.41Å; L284-H288 PolarHBondContact O-N 3.14Å; M285-H288 PolarHBondContact O-N 3.34Å; H288-D291 PolarHBondContact O-N 3.33Å; H288-M292 WeakPolarHBondContact O-CB 3.35Å; H288-M292 WeakPolarHBondContact O-CG 3.26Å; H288-M292 PolarHBondContact O-N 3.04Å
289	R	80.5	Confident	78.7	Confident	129 Å²	129	97.8 Å²	97.8	49%	0.487	46%	0.463	S	S	.	.	H	α-helix	trans	-64.3	-42	170.1	-167	-167.6	69.3	74.1	-0.9	112	M285 E286 E287 E293	M285-R289 VanDerWaalsContact O-CB 3.25Å; M285-R289 WeakPolarHBondContact O-CB 3.27Å; M285-R289 PolarHBondContact O-N 3.4Å; E286-R289 VanDerWaalsContact CD-NH2 3.35Å; E286-R289 IonicContact OE1-CZ 3.87Å; E286-R289 IonicContact OE1-NE 2.72Å; E286-R289 IonicContact OE1-NH2 2.67Å; E286-R289 PolarHBondContact OE1-NH2 2.79Å; E286-R289 IonicContact OE2-CZ 2.65Å; E286-R289 IonicContact OE2-NE 3.33Å; E286-R289 PolarHBondContact OE2-NE 3.44Å; E286-R289 IonicContact OE2-NH2 3.74Å; E286-R289 PolarHBondContact OE2-NH2 3.38Å; E287-R289 PolarHBondContact O-N 3.06Å; R289-E293 WeakPolarHBondContact O-CB 3.25Å; R289-E293 PolarHBondContact O-N 2.98Å
290	R	84.9	Confident	79.3	Confident	104 Å²	104	96.8 Å²	96.8	39%	0.392	46%	0.455	S	S	.	.	H	α-helix	trans	-63.7	-41.2	174.4	-79.6	179.3	-77.4	113.5	-11.6	111.9	E286 E287 E293 L294	E286-R290 WeakPolarHBondContact O-CG 3.38Å; E286-R290 PolarHBondContact O-N 3.49Å; E286-R290 PolarHBondContact O-NE 3.12Å; E287-R290 VanDerWaalsContact CA-CZ 3.47Å; E287-R290 VanDerWaalsContact CA-NH2 3.29Å; E287-R290 WeakPolarHBondContact O-CA 3.42Å; E287-R290 WeakPolarHBondContact O-CB 3.49Å; E287-R290 PolarHBondContact O-N 2.91Å; E287-R290 IonicContact OE1-CZ 2.6Å; E287-R290 IonicContact OE1-NH1 2.76Å; E287-R290 PolarHBondContact OE1-NH1 3.28Å; E287-R290 VanDerWaalsContact OE1-NH1 3.16Å; E287-R290 IonicContact OE1-NH2 2.66Å; E287-R290 PolarHBondContact OE1-NH2 3.44Å; R290-E293 PolarHBondContact O-N 3.02Å; R290-L294 WeakPolarHBondContact O-CB 3.31Å; R290-L294 PolarHBondContact O-N 3.25Å
291	D	80.9	Confident	80	Confident	79 Å²	79	97.6 Å²	97.6	42%	0.422	46%	0.462	S	S	.	.	H	α-helix	trans	-68.6	-42.2	178	-70.6	-13.7	0	0	0	112.1	E287 H288 L294 M295	E287-D291 PolarHBondContact O-N 3.34Å; H288-D291 PolarHBondContact O-N 3.33Å; D291-L294 PolarHBondContact O-N 2.9Å; D291-M295 PolarHBondContact O-N 3.15Å
292	M	76.5	Confident	80.8	Confident	74 Å²	74	100 Å²	100	37%	0.365	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-40.7	173.9	-73.1	-68.1	-70.1	0	0	112	M154 H288 L294 M295 R296	M154-M292 HydrophobicContact CE-CE 3.56Å; M154-M292 HydrophobicContact SD-CE 4.17Å; H288-M292 WeakPolarHBondContact O-CB 3.35Å; H288-M292 WeakPolarHBondContact O-CG 3.26Å; H288-M292 PolarHBondContact O-N 3.04Å; M292-L294 VanDerWaalsContact C-N 3.34Å; M292-M295 PolarHBondContact O-N 3.31Å; M292-M295 HydrophobicContact SD-CE 3.56Å; M292-M295 VanDerWaalsContact SD-CE 3.56Å; M292-R296 WeakPolarHBondContact O-CB 3.28Å; M292-R296 PolarHBondContact O-N 2.88Å
293	E	83	Confident	81.3	Confident	47 Å²	47	100.6 Å²	100.6	22%	0.22	47%	0.473	C	S	.	.	H	α-helix	trans	-64.1	-37.7	173.6	178.6	66.5	-153.4	0	0	111.8	R289 R290 R296 K297	R289-E293 WeakPolarHBondContact O-CB 3.25Å; R289-E293 PolarHBondContact O-N 2.98Å; R290-E293 PolarHBondContact O-N 3.02Å; E293-R296 VanDerWaalsContact CD-NH2 3.3Å; E293-R296 PolarHBondContact O-N 3Å; E293-R296 IonicContact OE1-CZ 2.73Å; E293-R296 IonicContact OE1-NH1 3.59Å; E293-R296 IonicContact OE1-NH2 3.37Å; E293-R296 PolarHBondContact OE1-NH2 2.95Å; E293-R296 IonicContact OE2-CZ 3.24Å; E293-R296 VanDerWaalsContact OE2-CZ 3.24Å; E293-R296 IonicContact OE2-NH1 3.14Å; E293-R296 PolarHBondContact OE2-NH1 3.48Å; E293-R296 IonicContact OE2-NH2 3.17Å; E293-R296 PolarHBondContact OE2-NH2 2.92Å; E293-R296 VanDerWaalsContact OE2-NH2 3.13Å; E293-K297 HydrophobicContact CG-CD 4.48Å; E293-K297 WeakPolarHBondContact O-CB 3.39Å; E293-K297 PolarHBondContact O-N 2.63Å; E293-K297 VanDerWaalsContact OE1-CE 3.22Å; E293-K297 WeakPolarHBondContact OE1-CE 3.44Å; E293-K297 IonicContact OE1-NZ 2.7Å; E293-K297 PolarHBondContact OE1-NZ 3.34Å
294	L	85.4	Confident	81.8	Confident	123 Å²	123	100.7 Å²	100.7	64%	0.644	47%	0.473	S	S	*	.	H	α-helix	trans	-68.7	-42.6	175.7	-172.6	66.5	0	0	0	111.6	R290 D291 M292 K297 G298	R290-L294 WeakPolarHBondContact O-CB 3.31Å; R290-L294 PolarHBondContact O-N 3.25Å; D291-L294 PolarHBondContact O-N 2.9Å; M292-L294 VanDerWaalsContact C-N 3.34Å; L294-K297 PolarHBondContact O-N 2.84Å; L294-G298 PolarHBondContact O-N 3.4Å
295	M	79	Confident	82.3	Confident	104 Å²	104	101 Å²	101	51%	0.512	48%	0.475	S	S	.	.	H	α-helix	trans	-64	-41.6	172.6	-74.9	-163.9	-66.6	0	0	111.9	D291 M292 K297 G298 F299	D291-M295 PolarHBondContact O-N 3.15Å; M292-M295 PolarHBondContact O-N 3.31Å; M292-M295 HydrophobicContact SD-CE 3.56Å; M292-M295 VanDerWaalsContact SD-CE 3.56Å; M295-K297 VanDerWaalsContact C-N 3.34Å; M295-K297 PolarHBondContact O-N 3.01Å; M295-G298 WeakPolarHBondContact O-CA 3.34Å; M295-G298 PolarHBondContact O-N 2.94Å; M295-F299 VanDerWaalsContact O-CD2 3.31Å; M295-F299 WeakPolarHBondContact O-CD2 3.03Å; M295-F299 PolarHBondContact O-N 2.75Å
296	R	84.2	Confident	83	Confident	125 Å²	125	99 Å²	99	47%	0.472	47%	0.466	S	S	.	.	H	α-helix	trans	-58.2	-46.9	175.1	-159	-174.4	77.1	-124.8	-17.2	110.7	M292 E293 G298 F299 E300	M292-R296 WeakPolarHBondContact O-CB 3.28Å; M292-R296 PolarHBondContact O-N 2.88Å; E293-R296 VanDerWaalsContact CD-NH2 3.3Å; E293-R296 PolarHBondContact O-N 3Å; E293-R296 IonicContact OE1-CZ 2.73Å; E293-R296 IonicContact OE1-NH1 3.59Å; E293-R296 IonicContact OE1-NH2 3.37Å; E293-R296 PolarHBondContact OE1-NH2 2.95Å; E293-R296 IonicContact OE2-CZ 3.24Å; E293-R296 VanDerWaalsContact OE2-CZ 3.24Å; E293-R296 IonicContact OE2-NH1 3.14Å; E293-R296 PolarHBondContact OE2-NH1 3.48Å; E293-R296 IonicContact OE2-NH2 3.17Å; E293-R296 PolarHBondContact OE2-NH2 2.92Å; E293-R296 VanDerWaalsContact OE2-NH2 3.13Å; R296-G298 VanDerWaalsContact C-N 3.25Å; R296-G298 PolarHBondContact O-N 2.82Å; R296-F299 PolarHBondContact O-N 2.79Å; R296-E300 WeakPolarHBondContact CG-OE1 3.39Å; R296-E300 IonicContact CZ-OE1 2.63Å; R296-E300 IonicContact NE-OE1 3.59Å; R296-E300 PolarHBondContact NE-OE1 3.27Å; R296-E300 IonicContact NH2-OE1 3.78Å; R296-E300 WeakPolarHBondContact O-CB 3.29Å; R296-E300 VanDerWaalsContact O-CG 3.25Å; R296-E300 WeakPolarHBondContact O-CG 3.4Å; R296-E300 PolarHBondContact O-N 3.34Å
297	K	85.7	Confident	83.3	Confident	96 Å²	96	101.6 Å²	101.6	42%	0.417	48%	0.478	S	S	.	.	H	α-helix	trans	-65.5	-22.4	174.1	-81.4	166.5	167.7	147	0	114.5	E293 L294 M295 E300 K301	E293-K297 HydrophobicContact CG-CD 4.48Å; E293-K297 WeakPolarHBondContact O-CB 3.39Å; E293-K297 PolarHBondContact O-N 2.63Å; E293-K297 VanDerWaalsContact OE1-CE 3.22Å; E293-K297 WeakPolarHBondContact OE1-CE 3.44Å; E293-K297 IonicContact OE1-NZ 2.7Å; E293-K297 PolarHBondContact OE1-NZ 3.34Å; L294-K297 PolarHBondContact O-N 2.84Å; M295-K297 VanDerWaalsContact C-N 3.34Å; M295-K297 PolarHBondContact O-N 3.01Å; K297-E300 WeakPolarHBondContact CG-OE2 3.43Å; K297-K301 WeakPolarHBondContact O-CD 3.22Å; K297-K301 VanDerWaalsContact O-CG 3.25Å; K297-K301 WeakPolarHBondContact O-CG 3.14Å; K297-K301 PolarHBondContact O-N 3.13Å
298	G	84.8	Confident	83.9	Confident	32 Å²	32	99.8 Å²	99.8	33%	0.33	47%	0.473	S	S	.	.	H	α-helix	trans	-68.9	-55.6	166.8	0	0	0	0	0	111.4	L294 M295 R296 E300 K301 E302	L294-G298 PolarHBondContact O-N 3.4Å; M295-G298 WeakPolarHBondContact O-CA 3.34Å; M295-G298 PolarHBondContact O-N 2.94Å; R296-G298 VanDerWaalsContact C-N 3.25Å; R296-G298 PolarHBondContact O-N 2.82Å; G298-E300 PolarHBondContact O-N 2.97Å; G298-K301 PolarHBondContact O-N 3.11Å; G298-K301 VanDerWaalsContact O-N 3.17Å; G298-E302 PolarHBondContact O-N 3.41Å
299	F	81.6	Confident	84.3	Confident	95 Å²	95	99.1 Å²	99.1	42%	0.417	47%	0.47	S	S	.	.	H	α-helix	trans	-61.4	-41.3	178.6	-78	-66.7	0	0	0	113.3	L147 M295 R296 K301 E302 L303	L147-F299 HydrophobicContact CD2-CD1 4.43Å; L147-F299 HydrophobicContact CD2-CE1 4.14Å; M295-F299 VanDerWaalsContact O-CD2 3.31Å; M295-F299 WeakPolarHBondContact O-CD2 3.03Å; M295-F299 PolarHBondContact O-N 2.75Å; R296-F299 PolarHBondContact O-N 2.79Å; F299-K301 VanDerWaalsContact C-N 3.3Å; F299-K301 PolarHBondContact O-N 2.87Å; F299-E302 PolarHBondContact O-N 3.01Å; F299-L303 WeakPolarHBondContact O-CB 3.4Å; F299-L303 PolarHBondContact O-N 3.1Å
300	E	81.7	Confident	84.5	Confident	88 Å²	88	99.9 Å²	99.9	41%	0.411	47%	0.474	S	S	.	.	H	α-helix	trans	-55.5	-44.8	173.5	-74.5	163.2	-171.1	0	0	111.2	R296 K297 G298 H304	R296-E300 WeakPolarHBondContact CG-OE1 3.39Å; R296-E300 IonicContact CZ-OE1 2.63Å; R296-E300 IonicContact NE-OE1 3.59Å; R296-E300 PolarHBondContact NE-OE1 3.27Å; R296-E300 IonicContact NH2-OE1 3.78Å; R296-E300 WeakPolarHBondContact O-CB 3.29Å; R296-E300 VanDerWaalsContact O-CG 3.25Å; R296-E300 WeakPolarHBondContact O-CG 3.4Å; R296-E300 PolarHBondContact O-N 3.34Å; K297-E300 WeakPolarHBondContact CG-OE2 3.43Å; G298-E300 PolarHBondContact O-N 2.97Å; E300-H304 VanDerWaalsContact O-CB 3.3Å; E300-H304 WeakPolarHBondContact O-CB 3.32Å; E300-H304 PolarHBondContact O-N 3.41Å
301	K	88.6	Confident	84.6	Confident	157 Å²	157	99.1 Å²	99.1	68%	0.683	48%	0.475	S	S	*	.	H	α-helix	trans	-68.8	-43.3	177.4	-75.9	174.9	-179.3	179	0	112.7	K297 G298 F299 N305	K297-K301 WeakPolarHBondContact O-CD 3.22Å; K297-K301 VanDerWaalsContact O-CG 3.25Å; K297-K301 WeakPolarHBondContact O-CG 3.14Å; K297-K301 PolarHBondContact O-N 3.13Å; G298-K301 PolarHBondContact O-N 3.11Å; G298-K301 VanDerWaalsContact O-N 3.17Å; F299-K301 VanDerWaalsContact C-N 3.3Å; F299-K301 PolarHBondContact O-N 2.87Å; K301-N305 VanDerWaalsContact O-CB 3.24Å; K301-N305 WeakPolarHBondContact O-CB 3.36Å; K301-N305 PolarHBondContact O-N 2.96Å
302	E	84.9	Confident	84.8	Confident	137 Å²	137	100.5 Å²	100.5	64%	0.64	48%	0.479	S	S	*	.	H	α-helix	trans	-64.2	-41.7	176.6	-74.3	-167.1	-179.3	0	0	112	G298 F299 N305 L306	G298-E302 PolarHBondContact O-N 3.41Å; F299-E302 PolarHBondContact O-N 3.01Å; E302-N305 PolarHBondContact O-N 3.34Å; E302-L306 VanDerWaalsContact O-CB 3.32Å; E302-L306 WeakPolarHBondContact O-CB 3.23Å; E302-L306 PolarHBondContact O-N 3.22Å
303	L	86	Confident	85.2	Confident	104 Å²	104	100.4 Å²	100.4	55%	0.545	48%	0.482	S	S	.	.	H	α-helix	trans	-67.4	-43.4	179.4	-165.1	155.2	0	0	0	110.9	F299 L306 Q307	F299-L303 WeakPolarHBondContact O-CB 3.4Å; F299-L303 PolarHBondContact O-N 3.1Å; L303-L306 PolarHBondContact O-N 2.92Å; L303-Q307 WeakPolarHBondContact O-CB 3.13Å; L303-Q307 PolarHBondContact O-N 3.02Å
304	H	87.2	Confident	85.1	Confident	126 Å²	126	103.2 Å²	103.2	58%	0.583	50%	0.496	S	S	*	.	H	α-helix	trans	-59	-46.4	170.6	177.9	-83.1	0	0	0	111.8	E300 L306 Q307 V308	E300-H304 VanDerWaalsContact O-CB 3.3Å; E300-H304 WeakPolarHBondContact O-CB 3.32Å; E300-H304 PolarHBondContact O-N 3.41Å; H304-L306 VanDerWaalsContact C-N 3.35Å; H304-L306 PolarHBondContact O-N 3.45Å; H304-Q307 PolarHBondContact O-N 3.15Å; H304-V308 WeakPolarHBondContact O-CG2 3.24Å; H304-V308 PolarHBondContact O-N 3.29Å
305	N	87.9	Confident	85	Confident	94 Å²	94	100.1 Å²	100.1	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-65.1	-38.1	-179.7	-160.3	21.2	0	0	0	111.9	K301 E302 V308 Q309	K301-N305 VanDerWaalsContact O-CB 3.24Å; K301-N305 WeakPolarHBondContact O-CB 3.36Å; K301-N305 PolarHBondContact O-N 2.96Å; E302-N305 PolarHBondContact O-N 3.34Å; N305-V308 PolarHBondContact O-N 3.28Å; N305-Q309 WeakPolarHBondContact O-CG 3.25Å; N305-Q309 PolarHBondContact O-N 3.44Å
306	L	85.8	Confident	85.2	Confident	82 Å²	82	100.2 Å²	100.2	43%	0.429	48%	0.477	S	S	.	.	H	α-helix	trans	-68.5	-35.3	174	-171.8	65.5	0	0	0	112.1	E302 L303 H304 Q309 Y310	E302-L306 VanDerWaalsContact O-CB 3.32Å; E302-L306 WeakPolarHBondContact O-CB 3.23Å; E302-L306 PolarHBondContact O-N 3.22Å; L303-L306 PolarHBondContact O-N 2.92Å; H304-L306 VanDerWaalsContact C-N 3.35Å; H304-L306 PolarHBondContact O-N 3.45Å; L306-Q309 PolarHBondContact O-N 3.48Å; L306-Y310 WeakPolarHBondContact O-CB 3.22Å; L306-Y310 PolarHBondContact O-N 2.85Å
307	Q	86.4	Confident	84.9	Confident	130 Å²	130	97.7 Å²	97.7	61%	0.607	47%	0.473	S	S	*	.	H	α-helix	trans	-69.1	-37.1	174	-175	166.5	-19.6	0	0	111.8	L303 H304 Y310 H311	L303-Q307 WeakPolarHBondContact O-CB 3.13Å; L303-Q307 PolarHBondContact O-N 3.02Å; H304-Q307 PolarHBondContact O-N 3.15Å; Q307-Y310 PolarHBondContact O-N 3.46Å; Q307-H311 PolarHBondContact O-N 2.93Å
308	V	88.6	Confident	84.3	Confident	51 Å²	51	95.9 Å²	95.9	31%	0.309	47%	0.472	S	S	.	.	H	α-helix	trans	-63	-46.1	169.7	170.1	0	0	0	0	111	H304 N305 Y310 H311 Q312	H304-V308 WeakPolarHBondContact O-CG2 3.24Å; H304-V308 PolarHBondContact O-N 3.29Å; N305-V308 PolarHBondContact O-N 3.28Å; V308-Y310 VanDerWaalsContact C-N 3.32Å; V308-Y310 PolarHBondContact O-N 3.47Å; V308-H311 PolarHBondContact O-N 3.3Å; V308-Q312 HydrophobicContact CG1-CG 4.39Å; V308-Q312 WeakPolarHBondContact O-CB 3.07Å; V308-Q312 VanDerWaalsContact O-CG 3.3Å; V308-Q312 WeakPolarHBondContact O-CG 3.49Å; V308-Q312 PolarHBondContact O-N 3.1Å
309	Q	86	Confident	84	Confident	104 Å²	104	100.1 Å²	100.1	49%	0.486	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-36.7	174.9	-75.7	-172.8	-7.9	0	0	113	N305 L306 Q312 T313	N305-Q309 WeakPolarHBondContact O-CG 3.25Å; N305-Q309 PolarHBondContact O-N 3.44Å; L306-Q309 PolarHBondContact O-N 3.48Å; Q309-Q312 PolarHBondContact O-N 3.48Å; Q309-T313 PolarHBondContact O-N 3.26Å; Q309-T313 PolarHBondContact O-OG1 2.74Å
310	Y	86.6	Confident	83.4	Confident	145 Å²	145	99.9 Å²	99.9	57%	0.569	48%	0.484	S	S	*	.	H	α-helix	trans	-64.9	-45.4	174.3	-179.4	-92.7	0	0	0	111.4	L306 Q307 V308 T313 Q314	L306-Y310 WeakPolarHBondContact O-CB 3.22Å; L306-Y310 PolarHBondContact O-N 2.85Å; Q307-Y310 PolarHBondContact O-N 3.46Å; V308-Y310 VanDerWaalsContact C-N 3.32Å; V308-Y310 PolarHBondContact O-N 3.47Å; Y310-T313 PolarHBondContact O-N 2.7Å; Y310-T313 PolarHBondContact O-OG1 3.49Å; Y310-Q314 WeakPolarHBondContact O-CB 3.46Å; Y310-Q314 PolarHBondContact O-N 2.99Å
311	H	85.5	Confident	82.8	Confident	88 Å²	88	104.7 Å²	104.7	41%	0.407	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-45	174.9	-168.9	-78.7	0	0	0	111.6	F2 Q307 V308 T313 Q314 E315	F2-H311 AromaticContact CE1-CE1 3.77Å; F2-H311 AromaticContact CZ-CE1 3.95Å; Q307-H311 PolarHBondContact O-N 2.93Å; V308-H311 PolarHBondContact O-N 3.3Å; H311-T313 PolarHBondContact O-N 3.31Å; H311-Q314 PolarHBondContact O-N 3.44Å; H311-E315 IonicContact ND1-OE2 3.13Å; H311-E315 WeakPolarHBondContact O-CB 3.31Å; H311-E315 PolarHBondContact O-N 2.88Å
312	Q	86.4	Confident	81	Confident	108 Å²	108	102.2 Å²	102.2	51%	0.505	51%	0.505	S	S	.	.	H	α-helix	trans	-59.5	-44.7	176.3	-74.9	172.4	-11.4	0	0	112.1	V308 Q309 E315 E316	V308-Q312 HydrophobicContact CG1-CG 4.39Å; V308-Q312 WeakPolarHBondContact O-CB 3.07Å; V308-Q312 VanDerWaalsContact O-CG 3.3Å; V308-Q312 WeakPolarHBondContact O-CG 3.49Å; V308-Q312 PolarHBondContact O-N 3.1Å; Q309-Q312 PolarHBondContact O-N 3.48Å; Q312-E315 CarbonylContact O-C 3.45Å; Q312-E315 PolarHBondContact O-N 3.33Å; Q312-E316 PolarHBondContact O-N 2.93Å
313	T	84.6	Confident	79.2	Confident	72 Å²	72	104 Å²	104	44%	0.442	51%	0.506	S	S	.	.	H	α-helix	trans	-71.7	-29.8	177.1	44.7	0	0	0	0	113	Q309 Y310 H311 E315 L317	Q309-T313 PolarHBondContact O-N 3.26Å; Q309-T313 PolarHBondContact O-OG1 2.74Å; Y310-T313 PolarHBondContact O-N 2.7Å; Y310-T313 PolarHBondContact O-OG1 3.49Å; H311-T313 PolarHBondContact O-N 3.31Å; T313-E315 VanDerWaalsContact C-N 3.35Å; T313-L317 WeakPolarHBondContact O-CB 3.42Å; T313-L317 VanDerWaalsContact O-CG 3.24Å; T313-L317 WeakPolarHBondContact O-CG 3.28Å; T313-L317 PolarHBondContact O-N 3.15Å
314	Q	81.4	Confident	77.1	Confident	107 Å²	107	103.4 Å²	103.4	50%	0.5	51%	0.508	S	S	.	.	H	α-helix	trans	-68.2	-35.1	170	-169.1	172.8	2.4	0	0	111.8	Y310 H311 L317 S318	Y310-Q314 WeakPolarHBondContact O-CB 3.46Å; Y310-Q314 PolarHBondContact O-N 2.99Å; H311-Q314 PolarHBondContact O-N 3.44Å; Q314-L317 PolarHBondContact O-N 3.1Å; Q314-S318 PolarHBondContact O-N 3.07Å
315	E	83.3	Confident	75	Confident	57 Å²	57	102.3 Å²	102.3	27%	0.266	52%	0.521	S	S	.	.	H	α-helix	trans	-74.6	-35.4	174.9	-161.9	-170.5	143.3	0	0	112.4	H311 Q312 T313 L317 S318 K319	H311-E315 IonicContact ND1-OE2 3.13Å; H311-E315 WeakPolarHBondContact O-CB 3.31Å; H311-E315 PolarHBondContact O-N 2.88Å; Q312-E315 CarbonylContact O-C 3.45Å; Q312-E315 PolarHBondContact O-N 3.33Å; T313-E315 VanDerWaalsContact C-N 3.35Å; E315-L317 VanDerWaalsContact C-N 3.35Å; E315-S318 PolarHBondContact O-N 3.37Å; E315-S318 PolarHBondContact O-OG 3.25Å; E315-K319 HydrophobicContact CG-CD 4.46Å; E315-K319 VanDerWaalsContact O-CB 3.31Å; E315-K319 WeakPolarHBondContact O-CB 3.48Å; E315-K319 WeakPolarHBondContact O-CG 3.46Å; E315-K319 PolarHBondContact O-N 2.75Å; E315-K319 WeakPolarHBondContact OE1-CE 3.4Å; E315-K319 IonicContact OE1-NZ 2.73Å; E315-K319 PolarHBondContact OE1-NZ 2.93Å
316	E	81.3	Confident	72.6	Confident	107 Å²	107	102.7 Å²	102.7	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-41.6	167.4	-77.1	-170.4	-177.5	0	0	111.5	Q312 K319 L320	Q312-E316 PolarHBondContact O-N 2.93Å; E316-K319 PolarHBondContact O-N 3.01Å; E316-L320 WeakPolarHBondContact O-CB 3.28Å; E316-L320 VanDerWaalsContact O-CG 3.26Å; E316-L320 WeakPolarHBondContact O-CG 3.5Å; E316-L320 PolarHBondContact O-N 2.69Å
317	L	77.7	Confident	70.5	Confident	72 Å²	72	103 Å²	103	38%	0.377	54%	0.535	S	S	.	.	H	α-helix	trans	-66	-38.3	176.4	-76.6	168	0	0	0	112	T313 Q314 E315 K321	T313-L317 WeakPolarHBondContact O-CB 3.42Å; T313-L317 VanDerWaalsContact O-CG 3.24Å; T313-L317 WeakPolarHBondContact O-CG 3.28Å; T313-L317 PolarHBondContact O-N 3.15Å; Q314-L317 PolarHBondContact O-N 3.1Å; E315-L317 VanDerWaalsContact C-N 3.35Å; L317-K321 VanDerWaalsContact O-CB 3.23Å; L317-K321 WeakPolarHBondContact O-CB 3.28Å; L317-K321 PolarHBondContact O-N 2.91Å
318	S	74.1	Confident	68.4	Low	58 Å²	58	105 Å²	105	41%	0.406	55%	0.551	S	S	.	*	H	α-helix	trans	-68.9	-44.5	173.9	72.9	0	0	0	0	111.3	Q314 E315 L320 K321 C322	Q314-S318 PolarHBondContact O-N 3.07Å; E315-S318 PolarHBondContact O-N 3.37Å; E315-S318 PolarHBondContact O-OG 3.25Å; S318-L320 VanDerWaalsContact C-N 3.32Å; S318-L320 PolarHBondContact O-N 3.19Å; S318-K321 PolarHBondContact O-N 3.21Å; S318-K321 VanDerWaalsContact O-N 3.16Å; S318-C322 VanDerWaalsContact O-CB 3.28Å; S318-C322 WeakPolarHBondContact O-CB 3.18Å; S318-C322 PolarHBondContact O-N 3.01Å; S318-C322 PolarHBondContact O-SG 3.49Å
319	K	77.8	Confident	66.1	Low	120 Å²	120	109.9 Å²	109.9	52%	0.522	57%	0.574	S	S	.	*	H	α-helix	trans	-58.4	-40	173.5	-74.8	168.3	-175.9	169.2	0	112.5	E315 E316 R323	E315-K319 HydrophobicContact CG-CD 4.46Å; E315-K319 VanDerWaalsContact O-CB 3.31Å; E315-K319 WeakPolarHBondContact O-CB 3.48Å; E315-K319 WeakPolarHBondContact O-CG 3.46Å; E315-K319 PolarHBondContact O-N 2.75Å; E315-K319 WeakPolarHBondContact OE1-CE 3.4Å; E315-K319 IonicContact OE1-NZ 2.73Å; E315-K319 PolarHBondContact OE1-NZ 2.93Å; E316-K319 PolarHBondContact O-N 3.01Å; K319-R323 WeakPolarHBondContact O-CB 3.18Å; K319-R323 PolarHBondContact O-N 3.38Å
320	L	69.6	Low	63.8	Low	90 Å²	90	108.7 Å²	108.7	47%	0.471	59%	0.589	S	S	.	*	H	α-helix	trans	-69.5	-39.9	174.8	-75.9	166.9	0	0	0	112.4	E316 S318 R323	E316-L320 WeakPolarHBondContact O-CB 3.28Å; E316-L320 VanDerWaalsContact O-CG 3.26Å; E316-L320 WeakPolarHBondContact O-CG 3.5Å; E316-L320 PolarHBondContact O-N 2.69Å; S318-L320 VanDerWaalsContact C-N 3.32Å; S318-L320 PolarHBondContact O-N 3.19Å; L320-R323 PolarHBondContact O-N 2.87Å
321	K	68.4	Low	61.4	Low	190 Å²	190	111 Å²	111	83%	0.826	61%	0.605	S	S	*	*	H	α-helix	trans	-72.1	-28.3	178.5	-170.3	176.6	-177.8	-177.3	0	113.1	L317 S318	L317-K321 VanDerWaalsContact O-CB 3.23Å; L317-K321 WeakPolarHBondContact O-CB 3.28Å; L317-K321 PolarHBondContact O-N 2.91Å; S318-K321 PolarHBondContact O-N 3.21Å; S318-K321 VanDerWaalsContact O-N 3.16Å
322	C	52	Low	59.1	Low	104 Å²	104	114.5 Å²	114.5	70%	0.703	63%	0.626	S	S	*	*	S	Bend	trans	-96.2	-2.5	177.5	-66.2	0	0	0	0	113.5	S318 P324	S318-C322 VanDerWaalsContact O-CB 3.28Å; S318-C322 WeakPolarHBondContact O-CB 3.18Å; S318-C322 PolarHBondContact O-N 3.01Å; S318-C322 PolarHBondContact O-SG 3.49Å; C322-P324 VanDerWaalsContact O-CD 3.24Å; C322-P324 WeakPolarHBondContact O-CD 3.31Å
323	R	47	Very low	56.9	Low	175 Å²	175	117.8 Å²	117.8	66%	0.66	64%	0.641	S	S	*	*			trans	-69.9	116.6	177.2	-168.9	168.9	-174.8	156.4	2.8	109.2	K319 L320	K319-R323 WeakPolarHBondContact O-CB 3.18Å; K319-R323 PolarHBondContact O-N 3.38Å; L320-R323 PolarHBondContact O-N 2.87Å
324	P	42.1	Very low	54.7	Low	92 Å²	92	119.1 Å²	119.1	60%	0.597	65%	0.646	S	S	*	*			trans	-62.1	155.1	172.5	-18.4	32.7	0	0	0	109.9	C322 T326	C322-P324 VanDerWaalsContact O-CD 3.24Å; C322-P324 WeakPolarHBondContact O-CD 3.31Å; P324-T326 PolarHBondContact O-N 2.85Å
325	A	42.2	Very low	52.5	Low	103 Å²	103	121.1 Å²	121.1	85%	0.851	66%	0.66	S	S	*	*			trans	-70.1	84.1	169.5	0	0	0	0	0	109.5	S327	A325-S327 VanDerWaalsContact C-N 3.25Å; A325-S327 PolarHBondContact O-N 2.92Å
326	T	38.8	Very low	50.4	Low	102 Å²	102	126.9 Å²	126.9	63%	0.626	69%	0.689	S	S	*	*			trans	-70.9	80.6	176.3	56.3	0	0	0	0	109.9	P324	P324-T326 PolarHBondContact O-N 2.85Å
327	S	40.2	Very low	48.4	Very low	87 Å²	87	127.8 Å²	127.8	61%	0.608	71%	0.707	S	S	*	*			trans	-70.8	159.3	157.8	64.2	0	0	0	0	109.5	A325 L329	A325-S327 VanDerWaalsContact C-N 3.25Å; A325-S327 PolarHBondContact O-N 2.92Å; S327-L329 PolarHBondContact O-N 2.71Å
328	N	42.5	Very low	46.5	Very low	174 Å²	174	127.7 Å²	127.7	93%	0.93	72%	0.724	S	S	*	*	S	Bend	trans	-82.5	48.7	-171.7	-61.9	-34.9	0	0	0	112.8
329	L	41.4	Very low	44.5	Very low	153 Å²	153	131 Å²	131	80%	0.801	74%	0.744	S	S	*	*			trans	-123.9	123.5	177.5	-88.5	154.9	0	0	0	109.4	S327	S327-L329 PolarHBondContact O-N 2.71Å
330	G	37.3	Very low	42.6	Very low	78 Å²	78	131.6 Å²	131.6	80%	0.804	76%	0.757	S	S	*	*			trans	-76.2	163.3	-166.3	0	0	0	0	0	115.4
331	E	34.8	Very low	40.8	Very low	194 Å²	194	136.2 Å²	136.2	91%	0.907	77%	0.774	S	S	*	*			trans	-65.8	142.9	174.7	-61	163.2	116.5	0	0	111.6
332	L	37.7	Very low	39.2	Very low	161 Å²	161	138.2 Å²	138.2	84%	0.843	78%	0.776	S	S	*	*			trans	-152.1	143.1	158.8	-114.3	163	0	0	0	110.9
333	E	40.3	Very low	38.4	Very low	177 Å²	177	138.7 Å²	138.7	83%	0.827	78%	0.781	S	S	*	*			trans	-92.4	159.5	-159	-163.8	162.1	-166.5	0	0	113.3	D335	E333-D335 PolarHBondContact O-N 3.44Å
334	N	39.2	Very low	37.5	Very low	100 Å²	100	138 Å²	138	54%	0.535	79%	0.79	S	S	.	*			trans	-97.3	63.2	-171.4	-80.9	-116.3	0	0	0	113	R11 M336	R11-N334 PolarHBondContact NH1-OD1 3.05Å; R11-N334 VanDerWaalsContact NH1-OD1 3.15Å; N334-M336 PolarHBondContact O-N 2.85Å; N334-M336 VanDerWaalsContact O-N 3.09Å
335	D	35.9	Very low	37.1	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	81%	0.807	S	S	*	*			trans	-77.8	90.4	172	-98	-16.8	0	0	0	111.8	E333	E333-D335 PolarHBondContact O-N 3.44Å
336	M	37.5	Very low	36.6	Very low	177 Å²	177	144.9 Å²	144.9	87%	0.872	80%	0.801	S	S	*	*			trans	-135	84.7	164.1	-91.8	-67.6	167.5	0	0	110.6	N334	N334-M336 PolarHBondContact O-N 2.85Å; N334-M336 VanDerWaalsContact O-N 3.09Å
337	S	40.9	Very low	36.6	Very low	126 Å²	126	149.8 Å²	149.8	88%	0.881	81%	0.814	S	S	*	*	S	Bend	trans	-151.1	79.6	171.7	-77.6	0	0	0	0	112.5
338	G	36.4	Very low	36.3	Very low	70 Å²	70	151.2 Å²	151.2	72%	0.722	82%	0.824	S	S	*	*			trans	99.9	125.3	161.1	0	0	0	0	0	116.4
339	P	32.8	Very low	36.1	Very low	129 Å²	129	147 Å²	147	84%	0.838	81%	0.813	S	S	*	*			trans	-98.6	97.8	175.6	34.8	-29.9	0	0	0	112.5
340	V	37	Very low	35.8	Very low	132 Å²	132	146.4 Å²	146.4	80%	0.8	81%	0.811	S	S	*	*			trans	-137.6	104.3	171.7	-171	0	0	0	0	113.6
341	F	31.7	Very low	35.8	Very low	186 Å²	186	148.5 Å²	148.5	82%	0.816	81%	0.808	S	S	*	*			trans	2	112.2	144.3	-77.2	-87.2	0	0	0	119.3
342	R	34.6	Very low	35.9	Very low	232 Å²	232	144.8 Å²	144.8	88%	0.875	80%	0.803	S	S	*	*				170.9	132	100.7	-98.5	161.9	-172	-122.6	0.4	116.9
343	S	35.1	Very low	35.9	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	80%	0.802	S	S	*	*			trans	60.7	117.3	133.2	-157.1	0	0	0	0	121.4
344	N	29.2	Very low	35.6	Very low	160 Å²	160	146.9 Å²	146.9	86%	0.856	80%	0.803	S	S	*	*			trans	-56.8	136.8	165.2	-60.7	-32.4	0	0	0	113.6
345	R	33.9	Very low	35.6	Very low	251 Å²	251	150.3 Å²	150.3	95%	0.947	82%	0.816	S	S	*	*			trans	-156.8	130.3	137.5	-138.3	177.3	-164	-164.5	4.1	111.9
346	A	32.1	Very low	35.6	Very low	89 Å²	89	148 Å²	148	74%	0.736	81%	0.812	S	S	*	*			trans	-85.7	151.4	175.6	0	0	0	0	0	112.2
347	K	37.4	Very low	35.6	Very low	205 Å²	205	145.6 Å²	145.6	89%	0.891	81%	0.807	S	S	*	*				167.8	137.3	120.5	-92.8	173.3	-178.3	-172.1	0	114.6
348	S	35.6	Very low	35.5	Very low	117 Å²	117	147.3 Å²	147.3	82%	0.818	80%	0.799	S	S	*	*			trans	89.4	135.6	140.5	-150	0	0	0	0	121.8
349	A	37.1	Very low	35.6	Very low	85 Å²	85	150.9 Å²	150.9	70%	0.702	80%	0.801	S	S	*	*			trans	71	156.4	149.7	0	0	0	0	0	121.2
350	N	34.4	Very low	35.7	Very low	140 Å²	140	151.9 Å²	151.9	75%	0.749	79%	0.793	S	S	*	*				-177	144.7	-50.6	-118.2	-11.3	0	0	0	111
351	T	37.2	Very low	35.7	Very low	123 Å²	123	152.6 Å²	152.6	76%	0.755	79%	0.792	S	S	*	*			trans	66.9	153.1	147.5	55.9	0	0	0	0	122.9
352	S	38.8	Very low	35.8	Very low	115 Å²	115	148.3 Å²	148.3	80%	0.804	78%	0.781	S	S	*	*			trans	72	146.5	175.1	-82.4	0	0	0	0	117.5
353	L	36	Very low	36.1	Very low	156 Å²	156	145 Å²	145	82%	0.817	78%	0.78	S	S	*	*			cis	-132.6	164.4	11.8	-169.5	58.4	0	0	0	112.9
354	R	34.9	Very low	36	Very low	226 Å²	226	147.2 Å²	147.2	85%	0.853	78%	0.778	S	S	*	*			trans	-145.7	135.1	-172.6	-178.8	-172.3	-175.2	-132.6	7.9	113.3
355	Q	39.1	Very low	36.3	Very low	173 Å²	173	143.3 Å²	143.3	81%	0.808	78%	0.776	S	S	*	*			trans	-165.6	126.6	159.7	-98.7	141.3	88.3	0	0	106.1
356	S	36.8	Very low	36.3	Very low	100 Å²	100	140 Å²	140	70%	0.699	77%	0.771	S	S	*	*			cis	71.4	128.1	49.4	-162.2	0	0	0	0	111.3
357	T	37.5	Very low	36.4	Very low	128 Å²	128	142.9 Å²	142.9	79%	0.785	78%	0.78	S	S	*	*			cis	-133.1	164.5	34.5	45.9	0	0	0	0	113.2
358	K	37.7	Very low	36.1	Very low	162 Å²	162	138.2 Å²	138.2	70%	0.704	77%	0.773	S	S	*	*			cis	94.2	117.2	21.9	-146.8	-167.5	-166.7	-164.8	0	115.5
359	N	38.2	Very low	36.1	Very low	144 Å²	144	138.3 Å²	138.3	77%	0.77	77%	0.774	S	S	*	*			trans	143.1	152.7	148.3	-73.6	-8	0	0	0	113.5
360	F	36.2	Very low	35.8	Very low	151 Å²	151	144.8 Å²	144.8	66%	0.662	78%	0.78	S	S	*	*			cis	-163.9	-175.9	-41.5	-142.3	-105.5	0	0	0	109.8	V362	F360-V362 HydrophobicContact CD1-CG2 4Å; F360-V362 HydrophobicContact CE1-CG2 3.62Å; F360-V362 HydrophobicContact CZ-CG2 4.26Å
361	N	35.8	Very low	35.7	Very low	147 Å²	147	146.9 Å²	146.9	79%	0.786	79%	0.785	S	S	*	*			trans	83.3	111.1	-173.6	-54	-5.3	0	0	0	112.8
362	V	34.7	Very low	35.5	Very low	95 Å²	95	146 Å²	146	58%	0.576	78%	0.784	S	S	*	*			cis	70.3	109.1	21	-168.7	0	0	0	0	114.9	F360 Q364	F360-V362 HydrophobicContact CD1-CG2 4Å; F360-V362 HydrophobicContact CE1-CG2 3.62Å; F360-V362 HydrophobicContact CZ-CG2 4.26Å; V362-Q364 HydrophobicContact CG1-CG 4.28Å
363	D	39.8	Very low	35.3	Very low	162 Å²	162	148 Å²	148	87%	0.866	78%	0.784	S	S	*	*			trans	-133.2	164.6	131.2	-155.5	-9.7	0	0	0	108.2
364	Q	33.6	Very low	35.2	Very low	163 Å²	163	145.5 Å²	145.5	76%	0.762	78%	0.778	S	S	*	*			trans	-113.8	154	-169.8	-61.6	-176.5	11.1	0	0	113.2	V362	V362-Q364 HydrophobicContact CG1-CG 4.28Å
365	G	35.1	Very low	35	Very low	78 Å²	78	139.7 Å²	139.7	80%	0.804	77%	0.767	S	S	*	*			trans	-166.7	88	178.6	0	0	0	0	0	111.9
366	E	33.2	Very low	34.8	Very low	180 Å²	180	137.4 Å²	137.4	84%	0.841	76%	0.761	S	S	*	*			trans	-78.3	144.6	179.5	-55.9	179.9	119.5	0	0	112.2
367	T	35.8	Very low	34.9	Very low	151 Å²	151	139.4 Å²	139.4	93%	0.926	76%	0.764	S	S	*	*			trans	-169.9	153.6	133.8	12.1	0	0	0	0	111.1
368	S	30.7	Very low	34.8	Very low	107 Å²	107	139.5 Å²	139.5	75%	0.748	76%	0.759	S	S	*	*			trans	-112.3	133.8	-169.6	-73.1	0	0	0	0	114.3
369	S	34.8	Very low	34.9	Very low	118 Å²	118	141.8 Å²	141.8	83%	0.825	77%	0.769	S	S	*	*			trans	-166	117.5	146.6	-76.7	0	0	0	0	106.7
370	R	31.3	Very low	34.8	Very low	221 Å²	221	143.2 Å²	143.2	83%	0.834	77%	0.772	S	S	*	*			cis	57.8	83.3	41.3	-65.9	-167.6	176.2	-170.8	0.5	114
371	H	33.2	Very low	34.8	Very low	184 Å²	184	141.6 Å²	141.6	85%	0.852	78%	0.779	S	S	*	*				-173.1	107.1	123.2	-93.5	-70.1	0	0	0	106.2
372	S	32.7	Very low	34.6	Very low	106 Å²	106	141.4 Å²	141.4	74%	0.741	78%	0.783	S	S	*	*				88.8	112.2	66.8	-71.1	0	0	0	0	112.9
373	L	33.4	Very low	34.5	Very low	155 Å²	155	141 Å²	141	81%	0.812	79%	0.79	S	S	*	*			trans	-59.6	159	156.1	-61.7	156.6	0	0	0	109.5
374	P	34.6	Very low	34.2	Very low	105 Å²	105	141.2 Å²	141.2	68%	0.682	79%	0.786	S	S	*	*				-127.2	166.5	74.2	41.9	-31.7	0	0	0	112.1
375	T	31	Very low	34	Very low	103 Å²	103	140.1 Å²	140.1	63%	0.632	79%	0.789	S	S	*	*			cis	71.5	159.2	30.9	-24.3	0	0	0	0	113.6
376	D	34.2	Very low	33.9	Very low	125 Å²	125	140.5 Å²	140.5	67%	0.668	78%	0.78	S	S	*	*			trans	72.7	138.9	170.1	-38.8	-18.2	0	0	0	115.1
377	D	38.8	Very low	34	Very low	142 Å²	142	138.9 Å²	138.9	76%	0.759	78%	0.776	S	S	*	*			cis	-157.6	167.7	-12.4	-122.5	-18.5	0	0	0	113.5
378	D	36.7	Very low	33.9	Very low	130 Å²	130	139.5 Å²	139.5	70%	0.695	77%	0.771	S	S	*	*			trans	0	134.4	165.5	-85.4	-23.8	0	0	0	121.6
379	K	39.2	Very low	34	Very low	210 Å²	210	139.5 Å²	139.5	91%	0.913	77%	0.771	S	S	*	*			trans	-145.9	127	134.6	-121.6	167.1	-168.4	169.8	0	113.5
380	Q	36.3	Very low	34	Very low	175 Å²	175	136.6 Å²	136.6	82%	0.818	76%	0.761	S	S	*	*			trans	-74.5	141.3	-172.4	-64	158.4	-5.3	0	0	112.4
381	S	35.6	Very low	34.7	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	76%	0.759	S	S	*	*			trans	-149.1	89.2	163.4	-179.7	0	0	0	0	111	A383	S381-A383 PolarHBondContact O-N 3.11Å
382	T	31.4	Very low	34.9	Very low	143 Å²	143	128.6 Å²	128.6	88%	0.877	75%	0.752	S	S	*	*			trans	-75.5	110	174.6	45.2	0	0	0	0	111.9
383	A	33.7	Very low	35.3	Very low	87 Å²	87	125.5 Å²	125.5	72%	0.719	73%	0.728	S	S	*	*			trans	-159.2	145.9	161.2	0	0	0	0	0	113.1	S381	S381-A383 PolarHBondContact O-N 3.11Å
384	H	32	Very low	35.6	Very low	166 Å²	166	129 Å²	129	77%	0.769	73%	0.731	S	S	*	*			trans	55.8	97.2	158.7	-103.9	-95.9	0	0	0	120.1	S386	H384-S386 PolarHBondContact ND1-OG 2.81Å; H384-S386 PolarHBondContact O-N 2.97Å; H384-S386 VanDerWaalsContact O-N 3.15Å
385	V	30.3	Very low	35.8	Very low	139 Å²	139	130 Å²	130	84%	0.842	72%	0.724	S	S	*	*			trans	-69.3	98.5	145.6	175.5	0	0	0	0	107.7
386	S	32.3	Very low	36	Very low	87 Å²	87	133.4 Å²	133.4	61%	0.608	74%	0.738	S	S	*	*			trans	-87.1	110.1	173.8	-70.6	0	0	0	0	110.3	H384 I388	H384-S386 PolarHBondContact ND1-OG 2.81Å; H384-S386 PolarHBondContact O-N 2.97Å; H384-S386 VanDerWaalsContact O-N 3.15Å; S386-I388 PolarHBondContact O-N 2.99Å
387	I	35.4	Very low	36.3	Very low	146 Å²	146	135.3 Å²	135.3	75%	0.749	74%	0.736	S	S	*	*			trans	-58.5	125.6	168.9	-61.8	169.7	0	0	0	107.9	S389	I387-S389 VanDerWaalsContact C-N 3.33Å; I387-S389 PolarHBondContact O-N 3.1Å
388	I	33.7	Very low	36.5	Very low	163 Å²	163	133 Å²	133	84%	0.836	73%	0.728	S	S	*	*			trans	-74.4	91.9	172.2	-59.4	178.2	0	0	0	107.6	S386 G390	S386-I388 PolarHBondContact O-N 2.99Å; I388-G390 PolarHBondContact O-N 3.27Å
389	S	34.4	Very low	36.7	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-61.4	117.9	162.5	-65	0	0	0	0	108.6	I387	I387-S389 VanDerWaalsContact C-N 3.33Å; I387-S389 PolarHBondContact O-N 3.1Å
390	G	34.6	Very low	36.4	Very low	58 Å²	58	130.3 Å²	130.3	60%	0.598	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-59.6	145.9	174.3	0	0	0	0	0	111.3	I388 T392	I388-G390 PolarHBondContact O-N 3.27Å; G390-T392 PolarHBondContact O-N 3.12Å
391	P	45.3	Very low	36.2	Very low	122 Å²	122	127.5 Å²	127.5	79%	0.792	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-66.8	124.5	175.5	28.4	-33.1	0	0	0	109.4	T393	P391-T393 PolarHBondContact O-N 2.81Å
392	T	38.2	Very low	36.2	Very low	115 Å²	115	129.5 Å²	129.5	71%	0.706	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-50.6	129.1	172.4	-51.9	0	0	0	0	109.8	G390 R394	G390-T392 PolarHBondContact O-N 3.12Å; T392-R394 VanDerWaalsContact C-N 3.28Å; T392-R394 PolarHBondContact O-N 2.79Å
393	T	40.6	Very low	36.4	Very low	41 Å²	41	131.9 Å²	131.9	25%	0.252	72%	0.719	S	S	.	*			trans	-64.6	81.2	-175.1	32.5	0	0	0	0	112.1	P391 F395	P391-T393 PolarHBondContact O-N 2.81Å; T393-F395 PolarHBondContact O-N 2.9Å
394	R	38.7	Very low	36.6	Very low	228 Å²	228	133.8 Å²	133.8	86%	0.86	72%	0.724	S	S	*	*			trans	-66.2	120.9	172.9	-163.9	-179.1	-152.5	168.3	8.3	108.6	T392 L396	T392-R394 VanDerWaalsContact C-N 3.28Å; T392-R394 PolarHBondContact O-N 2.79Å; R394-L396 PolarHBondContact O-N 3.05Å
395	F	39	Very low	36.5	Very low	125 Å²	125	134.7 Å²	134.7	55%	0.548	73%	0.728	S	S	.	*			trans	-49.5	113	178	-79.4	-93.7	0	0	0	111.1	I52 T393 R397	I52-F395 HydrophobicContact CD1-CE1 4.49Å; I52-F395 HydrophobicContact CG2-CD2 4.47Å; I52-F395 HydrophobicContact CG2-CE1 4.39Å; I52-F395 HydrophobicContact CG2-CE2 3.56Å; I52-F395 HydrophobicContact CG2-CZ 3.52Å; T393-F395 PolarHBondContact O-N 2.9Å; F395-R397 PolarHBondContact O-N 3.29Å
396	L	35.8	Very low	36.6	Very low	175 Å²	175	137.8 Å²	137.8	92%	0.916	73%	0.731	S	S	*	*			trans	-75.2	74.3	177.8	-78.7	174.2	0	0	0	110.2	R394	R394-L396 PolarHBondContact O-N 3.05Å
397	R	41.5	Very low	36.6	Very low	165 Å²	165	138.5 Å²	138.5	62%	0.623	74%	0.735	S	S	*	*			trans	-61.8	126.1	174	-162.5	168	-173.4	167.9	2.1	109.2	F395 Y400	F395-R397 PolarHBondContact O-N 3.29Å; R397-Y400 HydrophobicContact CG-CE2 3.88Å; R397-Y400 WeakPolarHBondContact CG-OH 3.25Å; R397-Y400 PolarHBondContact NE-OH 3.04Å
398	P	41.8	Very low	36.4	Very low	94 Å²	94	138.2 Å²	138.2	61%	0.61	74%	0.736	S	S	*	*			trans	-56.2	139.4	179.4	-27.3	35.3	0	0	0	112	Y400	P398-Y400 PolarHBondContact O-N 3.34Å
399	P	40.7	Very low	36.2	Very low	124 Å²	124	136 Å²	136	81%	0.805	73%	0.73	S	S	*	*			trans	-70.5	115	-172.7	26.9	-34.2	0	0	0	111.9	S401	P399-S401 PolarHBondContact O-N 2.93Å
400	Y	33.2	Very low	36.2	Very low	160 Å²	160	138.8 Å²	138.8	63%	0.627	73%	0.733	S	S	*	*			trans	-72.1	88	171	-49	-65.5	0	0	0	109.9	R397 P398 L402	R397-Y400 HydrophobicContact CG-CE2 3.88Å; R397-Y400 WeakPolarHBondContact CG-OH 3.25Å; R397-Y400 PolarHBondContact NE-OH 3.04Å; P398-Y400 PolarHBondContact O-N 3.34Å; Y400-L402 PolarHBondContact O-N 3.15Å
401	S	33.1	Very low	36	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	74%	0.738	S	S	*	*			trans	-69.1	105.3	178	-162.3	0	0	0	0	110.5	P399	P399-S401 PolarHBondContact O-N 2.93Å
402	L	35	Very low	35.7	Very low	160 Å²	160	144.6 Å²	144.6	84%	0.838	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-63.4	133	177.1	-71.9	159.8	0	0	0	110.2	Y400	Y400-L402 PolarHBondContact O-N 3.15Å
403	K	35.3	Very low	35.7	Very low	193 Å²	193	145 Å²	145	84%	0.839	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-77	128.7	172.8	-67	179.1	179.2	177.9	0	110
404	P	37.9	Very low	35.7	Very low	127 Å²	127	148.6 Å²	148.6	83%	0.825	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-66	138.2	164.9	-17.6	31.7	0	0	0	110.8
405	Q	29	Very low	36	Very low	184 Å²	184	144.6 Å²	144.6	86%	0.86	74%	0.742	S	S	*	*			trans	-110.2	117.5	164.3	-75.8	-172.9	-8.3	0	0	109.4
406	F	33.8	Very low	36.1	Very low	205 Å²	205	145.5 Å²	145.5	90%	0.899	75%	0.753	S	S	*	*			trans	-165.2	142.7	161.1	-87.2	-82.6	0	0	0	106
407	S	31.1	Very low	36.2	Very low	101 Å²	101	147 Å²	147	71%	0.706	76%	0.755	S	S	*	*			cis	-163.1	175.2	-19.4	43.9	0	0	0	0	109.2
408	D	31.7	Very low	36.4	Very low	141 Å²	141	143.7 Å²	143.7	75%	0.754	76%	0.757	S	S	*	*			trans	-67.1	155.2	-163	-54.5	-90.2	0	0	0	118.2
409	T	29.3	Very low	36.3	Very low	116 Å²	116	147.3 Å²	147.3	71%	0.712	77%	0.766	S	S	*	*			trans	42.6	127.4	146.2	57.2	0	0	0	0	121.5
410	M	35	Very low	36.2	Very low	166 Å²	166	145.7 Å²	145.7	82%	0.818	76%	0.763	S	S	*	*				-167.5	168.2	98.3	-99.9	-60.3	167.4	0	0	112.4
411	N	30.2	Very low	36.7	Very low	131 Å²	131	146.2 Å²	146.2	70%	0.701	77%	0.771	S	S	*	*			trans	-101.9	145.9	-169.6	-45.5	-74.6	0	0	0	113.7
412	H	38.4	Very low	37.1	Very low	170 Å²	170	149 Å²	149	79%	0.787	77%	0.771	S	S	*	*				-179.8	140	127.2	-91.4	-43.3	0	0	0	106.8
413	D	39	Very low	37.2	Very low	125 Å²	125	147 Å²	147	67%	0.668	77%	0.766	S	S	*	*				61.2	133	60	-50.2	-46.2	0	0	0	111.6
414	D	41.1	Very low	37.4	Very low	116 Å²	116	143.4 Å²	143.4	62%	0.62	77%	0.765	S	S	*	*			cis	-155.4	165.3	0	-147.8	-10.9	0	0	0	111.2
415	K	43.5	Very low	37.5	Very low	144 Å²	144	148 Å²	148	63%	0.626	77%	0.766	S	S	*	*			trans	39.8	130.8	151.6	-78.6	164.4	-164.7	70.6	0	123.6
416	D	40.9	Very low	37.8	Very low	143 Å²	143	143 Å²	143	77%	0.765	76%	0.756	S	S	*	*				60.3	106	127.8	-49.5	-19.5	0	0	0	121.2
417	E	37.9	Very low	37.7	Very low	206 Å²	206	142.2 Å²	142.2	96%	0.963	76%	0.758	S	S	*	*				-141.3	151.1	125.3	-143.8	176.1	-175.8	0	0	110.5
418	S	46.2	Very low	37.8	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	76%	0.758	S	S	*	*			trans	-130.1	-171.7	-158.7	-170.6	0	0	0	0	113.5	A420	S418-A420 VanDerWaalsContact C-N 3.28Å; S418-A420 PolarHBondContact O-N 2.74Å
419	E	39.6	Very low	38	Very low	171 Å²	171	145 Å²	145	80%	0.799	76%	0.764	S	S	*	*	S	Bend	trans	70	-29.3	161.3	-45.9	-156.1	138.6	0	0	118.7	Q421	E419-Q421 VanDerWaalsContact C-N 3.34Å; E419-Q421 PolarHBondContact O-N 2.87Å
420	A	40	Very low	38.1	Very low	90 Å²	90	145.4 Å²	145.4	74%	0.744	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-17.9	-170.8	0	0	0	0	0	116.9	S418	S418-A420 VanDerWaalsContact C-N 3.28Å; S418-A420 PolarHBondContact O-N 2.74Å
421	Q	43.1	Very low	38	Very low	170 Å²	170	146.3 Å²	146.3	79%	0.794	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.8	11.4	-166.5	-67.1	-177.5	0.4	0	0	115.6	E419	E419-Q421 VanDerWaalsContact C-N 3.34Å; E419-Q421 PolarHBondContact O-N 2.87Å
422	Q	40.9	Very low	38.1	Very low	173 Å²	173	145.9 Å²	145.9	81%	0.808	78%	0.775	S	S	*	*	S	Bend	trans	-82.6	-18.7	-177.6	-153.5	168.4	94.7	0	0	113.6
423	V	37.6	Very low	37.8	Very low	120 Å²	120	141.6 Å²	141.6	73%	0.727	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-77.9	-28.3	-167.1	-138.1	0	0	0	0	114.7
424	S	40	Very low	37.4	Very low	117 Å²	117	140.7 Å²	140.7	82%	0.818	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-88.4	-1.4	-171	-50.8	0	0	0	0	115.5
425	R	39.4	Very low	36.8	Very low	222 Å²	222	138.8 Å²	138.8	84%	0.838	78%	0.781	S	S	*	*	G	3₁₀ helix	trans	-102.4	-2.4	-179.8	-74.5	-179.9	172.3	140.6	-0.7	114.5
426	A	36.1	Very low	36.2	Very low	80 Å²	80	135.1 Å²	135.1	66%	0.661	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-14	-173.3	0	0	0	0	0	115.6
427	M	31.2	Very low	35.8	Very low	189 Å²	189	135.1 Å²	135.1	93%	0.931	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	11.3	-173.9	-74.2	-83.5	-83.7	0	0	114.5
428	G	33.7	Very low	35.5	Very low	69 Å²	69	130 Å²	130	71%	0.711	78%	0.775	S	S	*	*	S	Bend	trans	-110.9	1.7	-171.9	0	0	0	0	0	116.7
429	R	35.1	Very low	34.9	Very low	232 Å²	232	131.1 Å²	131.1	88%	0.875	78%	0.78	S	S	*	*	S	Bend	trans	-143.8	154.7	-178.3	-68.5	-175.2	175.9	165.8	-1	111.2
430	V	31.7	Very low	34.6	Very low	123 Å²	123	127.2 Å²	127.2	75%	0.745	77%	0.769	S	S	*	*			trans	73.1	62.8	179.2	-159.3	0	0	0	0	115.4
431	L	32.6	Very low	34.5	Very low	185 Å²	185	128 Å²	128	97%	0.969	77%	0.766	S	S	*	*				-127.9	104.6	129.9	-83.2	-175.8	0	0	0	109.1
432	T	32.4	Very low	34.3	Very low	122 Å²	122	123.7 Å²	123.7	75%	0.748	76%	0.755	S	S	*	*			trans	-100.3	145.1	-173.5	46.4	0	0	0	0	112.9
433	A	31.2	Very low	34	Very low	80 Å²	80	121.7 Å²	121.7	66%	0.661	75%	0.749	S	S	*	*			trans	72.8	68	144.9	0	0	0	0	0	121.2	K911	A433-K911 PolarHBondContact O-NZ 2.89Å
434	S	32.2	Very low	34	Very low	106 Å²	106	120.7 Å²	120.7	74%	0.741	74%	0.739	S	S	*	*				-175.5	138.7	124.1	48.2	0	0	0	0	114.3
435	G	28.6	Very low	33.9	Very low	77 Å²	77	117.8 Å²	117.8	79%	0.794	72%	0.722	S	S	*	*			trans	161	87.9	168.3	0	0	0	0	0	113.1	T437	G435-T437 PolarHBondContact O-N 2.94Å
436	G	29.1	Very low	34	Very low	66 Å²	66	110.4 Å²	110.4	68%	0.68	71%	0.705	S	S	*	*			trans	-32.6	118.7	-171.8	0	0	0	0	0	118.2	S438	G436-S438 PolarHBondContact O-N 3.38Å
437	T	34.2	Very low	34.6	Very low	143 Å²	143	110.1 Å²	110.1	88%	0.877	70%	0.695	S	S	*	*			trans	-65.9	115.8	154.8	48.3	0	0	0	0	108.8	G435	G435-T437 PolarHBondContact O-N 2.94Å
438	S	30.7	Very low	35.4	Very low	98 Å²	98	104.3 Å²	104.3	69%	0.685	67%	0.668	S	S	*	*			trans	-62.9	148.6	168.9	43.7	0	0	0	0	110.6	G436 T440	G436-S438 PolarHBondContact O-N 3.38Å; S438-T440 PolarHBondContact O-N 2.81Å; S438-T440 VanDerWaalsContact O-N 3.08Å
439	P	33.3	Very low	36	Very low	120 Å²	120	105.6 Å²	105.6	78%	0.779	66%	0.657	S	S	*	*			trans	-69.8	108.3	-178.6	27.8	-33.6	0	0	0	110.3
440	T	33.8	Very low	36.6	Very low	90 Å²	90	100.8 Å²	100.8	55%	0.552	65%	0.647	S	S	*	*			trans	-65.2	137.2	171.8	43.6	0	0	0	0	109.9	S438 S442	S438-T440 PolarHBondContact O-N 2.81Å; S438-T440 VanDerWaalsContact O-N 3.08Å; T440-S442 PolarHBondContact O-N 2.81Å
441	P	37.3	Very low	37.8	Very low	105 Å²	105	103 Å²	103	68%	0.682	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-11.1	-170	-26.4	35.7	0	0	0	116.6	L443 N444	P441-L443 PolarHBondContact O-N 2.82Å; P441-N444 PolarHBondContact O-N 3.47Å
442	S	38.6	Very low	39	Very low	80 Å²	80	100.5 Å²	100.5	56%	0.559	62%	0.621	S	S	*	*	H	α-helix	trans	-64.8	-35.6	-171	51.6	0	0	0	0	114.4	T440 N444 A445	T440-S442 PolarHBondContact O-N 2.81Å; S442-N444 VanDerWaalsContact C-N 3.3Å; S442-N444 PolarHBondContact O-N 2.98Å; S442-A445 WeakPolarHBondContact O-CB 3.46Å; S442-A445 PolarHBondContact O-N 3.4Å
443	L	35.9	Very low	40.4	Very low	131 Å²	131	95.9 Å²	95.9	69%	0.686	59%	0.594	S	S	*	*	H	α-helix	trans	-67.1	-32.6	178.2	-75.2	166.4	0	0	0	112.4	P441 A445 T447	P441-L443 PolarHBondContact O-N 2.82Å; L443-A445 VanDerWaalsContact C-N 3.31Å; L443-A445 PolarHBondContact O-N 2.89Å; L443-T447 PolarHBondContact O-N 3.45Å; L443-T447 PolarHBondContact O-OG1 2.96Å
444	N	37	Very low	42.3	Very low	99 Å²	99	101.5 Å²	101.5	53%	0.529	60%	0.598	S	S	.	*	H	α-helix	trans	-70	-29.7	179.8	-62.6	-12.4	0	0	0	111.9	P441 S442 T447 N448	P441-N444 PolarHBondContact O-N 3.47Å; S442-N444 VanDerWaalsContact C-N 3.3Å; S442-N444 PolarHBondContact O-N 2.98Å; N444-T447 PolarHBondContact O-N 2.99Å; N444-N448 WeakPolarHBondContact O-CB 3.43Å; N444-N448 PolarHBondContact O-N 2.68Å
445	A	38.2	Very low	44.1	Very low	56 Å²	56	101 Å²	101	46%	0.463	59%	0.586	S	S	.	*	H	α-helix	trans	-62.4	-46.4	177.8	0	0	0	0	0	111.7	S442 L443 T447 N448 M449	S442-A445 WeakPolarHBondContact O-CB 3.46Å; S442-A445 PolarHBondContact O-N 3.4Å; L443-A445 VanDerWaalsContact C-N 3.31Å; L443-A445 PolarHBondContact O-N 2.89Å; A445-T447 PolarHBondContact O-N 3.48Å; A445-N448 PolarHBondContact O-N 3.18Å; A445-M449 WeakPolarHBondContact O-CG 3.29Å; A445-M449 PolarHBondContact O-N 2.86Å
446	S	41.1	Very low	46	Very low	68 Å²	68	101.7 Å²	101.7	48%	0.476	57%	0.571	S	S	.	*	H	α-helix	trans	-63.2	-41.3	177.8	-58.2	0	0	0	0	112.6	M449 L450	S446-M449 PolarHBondContact O-N 2.92Å; S446-L450 WeakPolarHBondContact O-CG 3.41Å; S446-L450 PolarHBondContact O-N 3.05Å
447	T	48.8	Very low	48.1	Very low	74 Å²	74	102.1 Å²	102.1	45%	0.454	56%	0.558	S	S	.	*	H	α-helix	trans	-66.6	-38.3	176.3	-54.8	0	0	0	0	112.1	L443 N444 A445 R451	L443-T447 PolarHBondContact O-N 3.45Å; L443-T447 PolarHBondContact O-OG1 2.96Å; N444-T447 PolarHBondContact O-N 2.99Å; A445-T447 PolarHBondContact O-N 3.48Å; T447-R451 WeakPolarHBondContact O-CG 3.35Å; T447-R451 PolarHBondContact O-N 3.37Å
448	N	48.4	Very low	49.9	Very low	67 Å²	67	101.9 Å²	101.9	36%	0.358	55%	0.547	S	S	.	.	H	α-helix	trans	-69.7	-41.1	175.1	-78.6	-15.6	0	0	0	112	N444 A445 L450 R451 Y452	N444-N448 WeakPolarHBondContact O-CB 3.43Å; N444-N448 PolarHBondContact O-N 2.68Å; A445-N448 PolarHBondContact O-N 3.18Å; N448-L450 VanDerWaalsContact C-N 3.31Å; N448-L450 PolarHBondContact O-N 3.18Å; N448-R451 WeakPolarHBondContact O-CA 3.41Å; N448-R451 WeakPolarHBondContact O-CB 3.4Å; N448-R451 PolarHBondContact O-N 3.44Å; N448-Y452 HydrophobicContact CB-CD2 4.28Å; N448-Y452 HydrophobicContact CB-CE2 4.02Å; N448-Y452 WeakPolarHBondContact O-CD2 3.48Å; N448-Y452 PolarHBondContact O-N 2.93Å
449	M	46.3	Very low	51.6	Low	96 Å²	96	99.2 Å²	99.2	47%	0.473	53%	0.525	S	S	.	.	H	α-helix	trans	-56.7	-42.9	175.6	-79.4	-54.9	-49	0	0	112.7	A445 S446 R451 Y452 S453 L550	A445-M449 WeakPolarHBondContact O-CG 3.29Å; A445-M449 PolarHBondContact O-N 2.86Å; S446-M449 PolarHBondContact O-N 2.92Å; M449-R451 VanDerWaalsContact C-N 3.28Å; M449-R451 PolarHBondContact O-N 3.48Å; M449-Y452 PolarHBondContact O-N 3.48Å; M449-S453 PolarHBondContact O-N 3.17Å; M449-L550 HydrophobicContact CE-CD1 4.3Å
450	L	47.5	Very low	53.5	Low	130 Å²	130	99.3 Å²	99.3	68%	0.681	51%	0.51	S	S	*	.	H	α-helix	trans	-71.6	-18.6	176.8	-67.7	171.7	0	0	0	113.9	S446 N448	S446-L450 WeakPolarHBondContact O-CG 3.41Å; S446-L450 PolarHBondContact O-N 3.05Å; N448-L450 VanDerWaalsContact C-N 3.31Å; N448-L450 PolarHBondContact O-N 3.18Å
451	R	57.5	Low	55.4	Low	171 Å²	171	97.7 Å²	97.7	65%	0.645	51%	0.511	S	S	*	.	H	α-helix	trans	-80.6	-41.1	168.7	-71.8	170	173	179.9	-4.3	111	T447 N448 M449 L455	T447-R451 WeakPolarHBondContact O-CG 3.35Å; T447-R451 PolarHBondContact O-N 3.37Å; N448-R451 WeakPolarHBondContact O-CA 3.41Å; N448-R451 WeakPolarHBondContact O-CB 3.4Å; N448-R451 PolarHBondContact O-N 3.44Å; M449-R451 VanDerWaalsContact C-N 3.28Å; M449-R451 PolarHBondContact O-N 3.48Å; R451-L455 WeakPolarHBondContact O-CB 3.42Å; R451-L455 PolarHBondContact O-N 3.24Å
452	Y	56.9	Low	57.3	Low	131 Å²	131	96.9 Å²	96.9	51%	0.514	50%	0.501	S	S	.	.	H	α-helix	trans	-67.2	-40.5	179.8	-74	-59.1	0	0	0	113	N448 M449 L455 L456	N448-Y452 HydrophobicContact CB-CD2 4.28Å; N448-Y452 HydrophobicContact CB-CE2 4.02Å; N448-Y452 WeakPolarHBondContact O-CD2 3.48Å; N448-Y452 PolarHBondContact O-N 2.93Å; M449-Y452 PolarHBondContact O-N 3.48Å; Y452-L455 PolarHBondContact O-N 3.4Å; Y452-L456 WeakPolarHBondContact O-CB 3.28Å; Y452-L456 WeakPolarHBondContact O-CG 3.46Å; Y452-L456 PolarHBondContact O-N 3.44Å
453	S	62.8	Low	59.2	Low	25 Å²	25	97.2 Å²	97.2	18%	0.175	50%	0.501	C	S	.	.	H	α-helix	trans	-60.9	-49.6	175.8	58.4	0	0	0	0	111.7	M449 L455 L456 D457 E547	M449-S453 PolarHBondContact O-N 3.17Å; S453-L455 VanDerWaalsContact C-N 3.29Å; S453-L455 PolarHBondContact O-N 2.92Å; S453-L456 PolarHBondContact O-N 2.9Å; S453-D457 PolarHBondContact O-N 2.82Å; S453-E547 VanDerWaalsContact CB-OE1 3.31Å; S453-E547 WeakPolarHBondContact CB-OE1 3.42Å
454	R	71.1	Confident	61.2	Low	199 Å²	199	95.7 Å²	95.7	75%	0.751	49%	0.491	S	S	*	.	H	α-helix	trans	-60.5	-35.9	178	-162.2	176.4	-168.8	175.1	4.4	113	Q458	R454-Q458 WeakPolarHBondContact O-CB 3.43Å; R454-Q458 PolarHBondContact O-N 3.2Å
455	L	70.5	Confident	63.2	Low	94 Å²	94	93.1 Å²	93.1	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-66.8	-44.2	172.9	-169.1	82.7	0	0	0	111.6	R451 Y452 S453 Q458 L459	R451-L455 WeakPolarHBondContact O-CB 3.42Å; R451-L455 PolarHBondContact O-N 3.24Å; Y452-L455 PolarHBondContact O-N 3.4Å; S453-L455 VanDerWaalsContact C-N 3.29Å; S453-L455 PolarHBondContact O-N 2.92Å; L455-Q458 PolarHBondContact O-N 2.99Å; L455-L459 HydrophobicContact CD2-CD1 4.35Å; L455-L459 HydrophobicContact CG-CD1 4.13Å; L455-L459 WeakPolarHBondContact O-CB 3.31Å; L455-L459 VanDerWaalsContact O-CG 3.3Å; L455-L459 WeakPolarHBondContact O-CG 3.48Å; L455-L459 PolarHBondContact O-N 3.48Å
456	L	68.1	Low	65	Low	93 Å²	93	94.1 Å²	94.1	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-65.5	-39.2	-179.4	-74.4	166.9	0	0	0	112.4	Y452 S453 L459 R460	Y452-L456 WeakPolarHBondContact O-CB 3.28Å; Y452-L456 WeakPolarHBondContact O-CG 3.46Å; Y452-L456 PolarHBondContact O-N 3.44Å; S453-L456 PolarHBondContact O-N 2.9Å; L456-L459 PolarHBondContact O-N 3.47Å; L456-R460 VanDerWaalsContact O-CG 3.3Å; L456-R460 WeakPolarHBondContact O-CG 3.37Å; L456-R460 PolarHBondContact O-N 2.86Å
457	D	73.2	Confident	66.9	Low	75 Å²	75	97.6 Å²	97.6	40%	0.401	48%	0.478	S	S	.	.	H	α-helix	trans	-71.3	-35	175.6	-67.9	-30.8	0	0	0	112.2	S453 R460 G461	S453-D457 PolarHBondContact O-N 2.82Å; D457-R460 WeakPolarHBondContact O-CB 3.28Å; D457-R460 PolarHBondContact O-N 3.18Å; D457-R460 IonicContact OD1-CZ 3.52Å; D457-R460 IonicContact OD1-NH1 2.81Å; D457-R460 PolarHBondContact OD1-NH1 3.27Å; D457-G461 PolarHBondContact O-N 3.3Å; D457-G461 VanDerWaalsContact O-N 3.14Å
458	Q	71	Confident	68.5	Low	137 Å²	137	100.1 Å²	100.1	64%	0.64	48%	0.483	S	S	*	.	H	α-helix	trans	-67.4	-38.7	173.3	-167.5	159.1	6.6	0	0	111.8	R454 L455 R460 G461	R454-Q458 WeakPolarHBondContact O-CB 3.43Å; R454-Q458 PolarHBondContact O-N 3.2Å; L455-Q458 PolarHBondContact O-N 2.99Å; Q458-R460 VanDerWaalsContact C-N 3.35Å; Q458-G461 PolarHBondContact O-N 2.84Å
459	L	66.9	Low	70.2	Confident	43 Å²	43	100.4 Å²	100.4	23%	0.225	48%	0.484	C	S	.	.	H	α-helix	trans	-65.8	-33.7	171.7	-72.4	167.9	0	0	0	112.6	L455 L456 G461 D462 L466 L469	L455-L459 HydrophobicContact CD2-CD1 4.35Å; L455-L459 HydrophobicContact CG-CD1 4.13Å; L455-L459 WeakPolarHBondContact O-CB 3.31Å; L455-L459 VanDerWaalsContact O-CG 3.3Å; L455-L459 WeakPolarHBondContact O-CG 3.48Å; L455-L459 PolarHBondContact O-N 3.48Å; L456-L459 PolarHBondContact O-N 3.47Å; L459-G461 VanDerWaalsContact C-N 3.27Å; L459-G461 PolarHBondContact O-N 3.34Å; L459-D462 PolarHBondContact O-N 3.11Å; L459-L466 HydrophobicContact CB-CD2 4.29Å; L459-L466 VanDerWaalsContact O-CD1 3.26Å; L459-L466 WeakPolarHBondContact O-CD1 3.41Å; L459-L466 WeakPolarHBondContact O-CG 3.1Å; L459-L469 HydrophobicContact CD2-CD1 3.83Å
460	R	72.4	Confident	71.9	Confident	121 Å²	121	104.2 Å²	104.2	46%	0.457	49%	0.493	S	S	.	.	H	α-helix	trans	-65.8	-27.3	172	-76.6	168.8	177.9	157.4	-0.1	113.4	L456 D457 Q458 D462	L456-R460 VanDerWaalsContact O-CG 3.3Å; L456-R460 WeakPolarHBondContact O-CG 3.37Å; L456-R460 PolarHBondContact O-N 2.86Å; D457-R460 WeakPolarHBondContact O-CB 3.28Å; D457-R460 PolarHBondContact O-N 3.18Å; D457-R460 IonicContact OD1-CZ 3.52Å; D457-R460 IonicContact OD1-NH1 2.81Å; D457-R460 PolarHBondContact OD1-NH1 3.27Å; Q458-R460 VanDerWaalsContact C-N 3.35Å; R460-D462 VanDerWaalsContact C-N 3.32Å
461	G	74.5	Confident	73.7	Confident	56 Å²	56	103 Å²	103	58%	0.577	48%	0.483	S	S	*	.	H	α-helix	trans	-67.2	-31.1	173.2	0	0	0	0	0	113.5	D457 Q458 L459 P463	D457-G461 PolarHBondContact O-N 3.3Å; D457-G461 VanDerWaalsContact O-N 3.14Å; Q458-G461 PolarHBondContact O-N 2.84Å; L459-G461 VanDerWaalsContact C-N 3.27Å; L459-G461 PolarHBondContact O-N 3.34Å; G461-P463 WeakPolarHBondContact O-CD 3.15Å
462	D	77.7	Confident	75	Confident	89 Å²	89	99.9 Å²	99.9	48%	0.476	48%	0.476	S	S	.	.			trans	-109	82.3	-175.8	-76	-28.1	0	0	0	112.3	L459 R460 E464 T465 L466	L459-D462 PolarHBondContact O-N 3.11Å; R460-D462 VanDerWaalsContact C-N 3.32Å; D462-E464 PolarHBondContact O-N 3.41Å; D462-T465 HydrophobicContact CB-CG2 3.81Å; D462-T465 WeakPolarHBondContact CB-OG1 3.44Å; D462-T465 PolarHBondContact O-N 2.98Å; D462-T465 PolarHBondContact O-OG1 3.38Å; D462-L466 PolarHBondContact O-N 2.86Å
463	P	78.8	Confident	76.3	Confident	87 Å²	87	98.2 Å²	98.2	57%	0.565	48%	0.48	S	S	*	.	H	α-helix	trans	-60.6	-22	179.6	25	-35.2	0	0	0	113.7	G461 R467	G461-P463 WeakPolarHBondContact O-CD 3.15Å; P463-R467 PolarHBondContact O-N 3.06Å
464	E	77.6	Confident	77.4	Confident	99 Å²	99	101.4 Å²	101.4	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-40.3	170.9	-70.8	-60.2	133.9	0	0	112.8	D462 R467 K468	D462-E464 PolarHBondContact O-N 3.41Å; E464-R467 VanDerWaalsContact CD-NH1 3.25Å; E464-R467 PolarHBondContact O-N 2.65Å; E464-R467 IonicContact OE1-CZ 3.23Å; E464-R467 IonicContact OE1-NH1 2.75Å; E464-R467 PolarHBondContact OE1-NH1 3.1Å; E464-R467 VanDerWaalsContact OE1-NH1 3.13Å; E464-R467 IonicContact OE1-NH2 3.26Å; E464-R467 PolarHBondContact OE1-NH2 2.98Å; E464-R467 IonicContact OE2-CZ 3.79Å; E464-R467 IonicContact OE2-NH1 2.89Å; E464-R467 PolarHBondContact OE2-NH1 2.94Å; E464-R467 IonicContact OE2-NH2 3.23Å; E464-K468 WeakPolarHBondContact O-CG 3.31Å; E464-K468 PolarHBondContact O-N 2.69Å; E464-K468 VanDerWaalsContact O-N 3.16Å
465	T	79.2	Confident	78.1	Confident	44 Å²	44	96.7 Å²	96.7	27%	0.27	48%	0.478	S	S	.	.	H	α-helix	trans	-73.9	-40	179.6	65.7	0	0	0	0	110.6	D462 R467 K468 L469	D462-T465 HydrophobicContact CB-CG2 3.81Å; D462-T465 WeakPolarHBondContact CB-OG1 3.44Å; D462-T465 PolarHBondContact O-N 2.98Å; D462-T465 PolarHBondContact O-OG1 3.38Å; T465-R467 VanDerWaalsContact C-N 3.29Å; T465-R467 PolarHBondContact O-N 3.48Å; T465-K468 PolarHBondContact O-N 2.87Å; T465-L469 WeakPolarHBondContact O-CB 3.4Å; T465-L469 WeakPolarHBondContact O-CG 3.3Å; T465-L469 PolarHBondContact O-N 2.93Å
466	L	75.6	Confident	78.8	Confident	78 Å²	78	96.8 Å²	96.8	41%	0.408	48%	0.479	S	S	.	.	H	α-helix	trans	-60.8	-34.9	171.8	-75.6	173.8	0	0	0	112.8	L459 D462 R470	L459-L466 HydrophobicContact CB-CD2 4.29Å; L459-L466 VanDerWaalsContact O-CD1 3.26Å; L459-L466 WeakPolarHBondContact O-CD1 3.41Å; L459-L466 WeakPolarHBondContact O-CG 3.1Å; D462-L466 PolarHBondContact O-N 2.86Å; L466-R470 VanDerWaalsContact O-CB 3.26Å; L466-R470 WeakPolarHBondContact O-CB 3.46Å; L466-R470 PolarHBondContact O-N 3.39Å
467	R	80.7	Confident	79.5	Confident	140 Å²	140	97.3 Å²	97.3	53%	0.528	48%	0.482	S	S	.	.	H	α-helix	trans	-68.1	-40.9	174.3	-160.2	-166.4	-51.3	113.8	9.2	112.1	P463 E464 T465 R470 H471	P463-R467 PolarHBondContact O-N 3.06Å; E464-R467 VanDerWaalsContact CD-NH1 3.25Å; E464-R467 PolarHBondContact O-N 2.65Å; E464-R467 IonicContact OE1-CZ 3.23Å; E464-R467 IonicContact OE1-NH1 2.75Å; E464-R467 PolarHBondContact OE1-NH1 3.1Å; E464-R467 VanDerWaalsContact OE1-NH1 3.13Å; E464-R467 IonicContact OE1-NH2 3.26Å; E464-R467 PolarHBondContact OE1-NH2 2.98Å; E464-R467 IonicContact OE2-CZ 3.79Å; E464-R467 IonicContact OE2-NH1 2.89Å; E464-R467 PolarHBondContact OE2-NH1 2.94Å; E464-R467 IonicContact OE2-NH2 3.23Å; T465-R467 VanDerWaalsContact C-N 3.29Å; T465-R467 PolarHBondContact O-N 3.48Å; R467-R470 PolarHBondContact O-N 2.97Å; R467-H471 PolarHBondContact O-N 3.42Å
468	K	82.6	Confident	80	Confident	128 Å²	128	97.1 Å²	97.1	56%	0.557	48%	0.48	S	S	*	.	H	α-helix	trans	-63.8	-51.1	175.7	-70.2	171.4	-176.8	178.3	0	111.3	E464 T465 R470 H471 E472	E464-K468 WeakPolarHBondContact O-CG 3.31Å; E464-K468 PolarHBondContact O-N 2.69Å; E464-K468 VanDerWaalsContact O-N 3.16Å; T465-K468 PolarHBondContact O-N 2.87Å; K468-R470 VanDerWaalsContact C-N 3.31Å; K468-R470 PolarHBondContact O-N 3.05Å; K468-H471 CarbonylContact O-C 3.46Å; K468-H471 WeakPolarHBondContact O-CA 3.4Å; K468-H471 WeakPolarHBondContact O-CB 3.48Å; K468-H471 PolarHBondContact O-N 3.26Å; K468-E472 WeakPolarHBondContact O-CG 3.45Å; K468-E472 PolarHBondContact O-N 3.07Å
469	L	83	Confident	80.7	Confident	72 Å²	72	95.9 Å²	95.9	38%	0.377	48%	0.475	S	S	.	.	H	α-helix	trans	-57.9	-39.8	175.1	-73.2	165.5	0	0	0	112.5	L459 T465 E472 V473	L459-L469 HydrophobicContact CD2-CD1 3.83Å; T465-L469 WeakPolarHBondContact O-CB 3.4Å; T465-L469 WeakPolarHBondContact O-CG 3.3Å; T465-L469 PolarHBondContact O-N 2.93Å; L469-E472 PolarHBondContact O-N 2.84Å; L469-V473 WeakPolarHBondContact O-CB 3.39Å; L469-V473 VanDerWaalsContact O-CG2 3.31Å; L469-V473 WeakPolarHBondContact O-CG2 3.26Å; L469-V473 PolarHBondContact O-N 2.84Å
470	R	83.3	Confident	81.4	Confident	177 Å²	177	98.1 Å²	98.1	67%	0.668	48%	0.484	S	S	*	.	H	α-helix	trans	-61	-44.9	172.6	174.7	-179.7	164.9	175.7	-2.3	111.4	L466 R467 K468 V473 E474	L466-R470 VanDerWaalsContact O-CB 3.26Å; L466-R470 WeakPolarHBondContact O-CB 3.46Å; L466-R470 PolarHBondContact O-N 3.39Å; R467-R470 PolarHBondContact O-N 2.97Å; K468-R470 VanDerWaalsContact C-N 3.31Å; K468-R470 PolarHBondContact O-N 3.05Å; R470-V473 PolarHBondContact O-N 3.45Å; R470-E474 WeakPolarHBondContact O-CB 3.18Å; R470-E474 PolarHBondContact O-N 3.34Å
471	H	84.9	Confident	81.8	Confident	103 Å²	103	95.4 Å²	95.4	48%	0.477	48%	0.478	S	S	.	.	H	α-helix	trans	-67.1	-39.4	178.7	-173.3	49.3	0	0	0	111.7	R467 K468 V473 E474 Q475	R467-H471 PolarHBondContact O-N 3.42Å; K468-H471 CarbonylContact O-C 3.46Å; K468-H471 WeakPolarHBondContact O-CA 3.4Å; K468-H471 WeakPolarHBondContact O-CB 3.48Å; K468-H471 PolarHBondContact O-N 3.26Å; H471-V473 PolarHBondContact O-N 3.17Å; H471-E474 PolarHBondContact O-N 2.94Å; H471-Q475 WeakPolarHBondContact O-CB 2.99Å; H471-Q475 VanDerWaalsContact O-CG 3.24Å; H471-Q475 WeakPolarHBondContact O-CG 3.37Å; H471-Q475 PolarHBondContact O-N 3.46Å
472	E	84.8	Confident	82.3	Confident	106 Å²	106	97.7 Å²	97.7	50%	0.495	48%	0.477	S	S	.	.	H	α-helix	trans	-59.6	-44.3	172.5	-71.2	161.1	-150.4	0	0	111.6	K468 L469 Q475 L476	K468-E472 WeakPolarHBondContact O-CG 3.45Å; K468-E472 PolarHBondContact O-N 3.07Å; L469-E472 PolarHBondContact O-N 2.84Å; E472-Q475 PolarHBondContact O-N 3.37Å; E472-L476 WeakPolarHBondContact O-CB 3.44Å; E472-L476 VanDerWaalsContact O-CG 3.28Å; E472-L476 WeakPolarHBondContact O-CG 3.35Å; E472-L476 PolarHBondContact O-N 2.89Å
473	V	84.7	Confident	82.5	Confident	97 Å²	97	99.9 Å²	99.9	59%	0.588	48%	0.484	S	S	*	.	H	α-helix	trans	-65.9	-35.6	174.5	169.9	0	0	0	0	112.3	L469 R470 H471 L477	L469-V473 WeakPolarHBondContact O-CB 3.39Å; L469-V473 VanDerWaalsContact O-CG2 3.31Å; L469-V473 WeakPolarHBondContact O-CG2 3.26Å; L469-V473 PolarHBondContact O-N 2.84Å; R470-V473 PolarHBondContact O-N 3.45Å; H471-V473 PolarHBondContact O-N 3.17Å; V473-L477 VanDerWaalsContact O-CB 3.29Å; V473-L477 WeakPolarHBondContact O-CB 3.5Å; V473-L477 PolarHBondContact O-N 3.34Å
474	E	84.8	Confident	82.3	Confident	92 Å²	92	96.9 Å²	96.9	43%	0.43	46%	0.463	S	S	.	.	H	α-helix	trans	-68.6	-40.8	175.4	-173.7	165.1	-151.5	0	0	111.6	R470 H471 L477 L478	R470-E474 WeakPolarHBondContact O-CB 3.18Å; R470-E474 PolarHBondContact O-N 3.34Å; H471-E474 PolarHBondContact O-N 2.94Å; E474-L477 PolarHBondContact O-N 3.09Å; E474-L478 VanDerWaalsContact O-CG 3.3Å; E474-L478 WeakPolarHBondContact O-CG 3.41Å; E474-L478 PolarHBondContact O-N 2.91Å
475	Q	86.1	Confident	82.4	Confident	100 Å²	100	94.4 Å²	94.4	47%	0.467	46%	0.463	S	S	.	.	H	α-helix	trans	-67.4	-44.2	174.1	-68.3	-67.1	105.3	0	0	111.8	H471 E472 L477 L478 E479	H471-Q475 WeakPolarHBondContact O-CB 2.99Å; H471-Q475 VanDerWaalsContact O-CG 3.24Å; H471-Q475 WeakPolarHBondContact O-CG 3.37Å; H471-Q475 PolarHBondContact O-N 3.46Å; E472-Q475 PolarHBondContact O-N 3.37Å; Q475-L477 VanDerWaalsContact C-N 3.31Å; Q475-L477 PolarHBondContact O-N 3.19Å; Q475-L478 PolarHBondContact O-N 3.08Å; Q475-E479 WeakPolarHBondContact O-CB 3.47Å; Q475-E479 PolarHBondContact O-N 3.21Å
476	L	84.7	Confident	82.4	Confident	95 Å²	95	93.7 Å²	93.7	50%	0.497	46%	0.458	S	S	.	.	H	α-helix	trans	-61.7	-37.5	173.6	-75.4	167.3	0	0	0	111.9	E472 E479 Q480	E472-L476 WeakPolarHBondContact O-CB 3.44Å; E472-L476 VanDerWaalsContact O-CG 3.28Å; E472-L476 WeakPolarHBondContact O-CG 3.35Å; E472-L476 PolarHBondContact O-N 2.89Å; L476-E479 PolarHBondContact O-N 2.73Å; L476-Q480 VanDerWaalsContact O-CB 3.32Å; L476-Q480 WeakPolarHBondContact O-CB 3.33Å; L476-Q480 VanDerWaalsContact O-CG 3.24Å; L476-Q480 WeakPolarHBondContact O-CG 3.5Å; L476-Q480 PolarHBondContact O-N 2.71Å
477	L	83.5	Confident	82.4	Confident	105 Å²	105	95.8 Å²	95.8	55%	0.55	46%	0.464	S	S	.	.	H	α-helix	trans	-65.6	-42.1	174.2	178.3	61.8	0	0	0	111.5	V473 E474 Q475 L481	V473-L477 VanDerWaalsContact O-CB 3.29Å; V473-L477 WeakPolarHBondContact O-CB 3.5Å; V473-L477 PolarHBondContact O-N 3.34Å; E474-L477 PolarHBondContact O-N 3.09Å; Q475-L477 VanDerWaalsContact C-N 3.31Å; Q475-L477 PolarHBondContact O-N 3.19Å; L477-L481 HydrophobicContact CD1-CD1 4.2Å; L477-L481 HydrophobicContact CD1-CG 4.26Å; L477-L481 HydrophobicContact CG-CD1 4.05Å; L477-L481 VanDerWaalsContact O-CB 3.31Å; L477-L481 WeakPolarHBondContact O-CB 3.39Å; L477-L481 WeakPolarHBondContact O-CG 3.26Å; L477-L481 PolarHBondContact O-N 2.98Å
478	L	83.4	Confident	82	Confident	71 Å²	71	94.5 Å²	94.5	37%	0.372	48%	0.476	S	S	.	.	H	α-helix	trans	-65.8	-38.7	175.8	-71.8	167.8	0	0	0	112.2	E474 Q475 N482	E474-L478 VanDerWaalsContact O-CG 3.3Å; E474-L478 WeakPolarHBondContact O-CG 3.41Å; E474-L478 PolarHBondContact O-N 2.91Å; Q475-L478 PolarHBondContact O-N 3.08Å; L478-N482 VanDerWaalsContact O-CB 3.25Å; L478-N482 WeakPolarHBondContact O-CB 3.49Å; L478-N482 PolarHBondContact O-N 3.14Å
479	E	85.3	Confident	81.7	Confident	111 Å²	111	94 Å²	94	52%	0.519	48%	0.479	S	S	.	.	H	α-helix	trans	-63.1	-52.8	174	-176.7	167.7	-132.8	0	0	111.1	Q475 L476 L481 N482 E483	Q475-E479 WeakPolarHBondContact O-CB 3.47Å; Q475-E479 PolarHBondContact O-N 3.21Å; L476-E479 PolarHBondContact O-N 2.73Å; E479-L481 VanDerWaalsContact C-N 3.34Å; E479-L481 PolarHBondContact O-N 3.01Å; E479-N482 PolarHBondContact O-N 2.96Å; E479-E483 PolarHBondContact O-N 3.39Å
480	Q	81.4	Confident	81.2	Confident	90 Å²	90	94.3 Å²	94.3	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-59.9	-39.3	177	-74.4	-65.4	-67.6	0	0	113.1	L476 E483 H484	L476-Q480 VanDerWaalsContact O-CB 3.32Å; L476-Q480 WeakPolarHBondContact O-CB 3.33Å; L476-Q480 VanDerWaalsContact O-CG 3.24Å; L476-Q480 WeakPolarHBondContact O-CG 3.5Å; L476-Q480 PolarHBondContact O-N 2.71Å; Q480-E483 PolarHBondContact NE2-OE2 2.63Å; Q480-H484 WeakPolarHBondContact O-CB 3.48Å; Q480-H484 PolarHBondContact O-N 3.23Å; Q480-H484 PolarHBondContact O-ND1 3.25Å
481	L	82	Confident	80.9	Confident	63 Å²	63	97.7 Å²	97.7	33%	0.33	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-41.7	173.2	-76.1	169.8	0	0	0	111.4	L477 E479 H484 G485 I486	L477-L481 HydrophobicContact CD1-CD1 4.2Å; L477-L481 HydrophobicContact CD1-CG 4.26Å; L477-L481 HydrophobicContact CG-CD1 4.05Å; L477-L481 VanDerWaalsContact O-CB 3.31Å; L477-L481 WeakPolarHBondContact O-CB 3.39Å; L477-L481 WeakPolarHBondContact O-CG 3.26Å; L477-L481 PolarHBondContact O-N 2.98Å; E479-L481 VanDerWaalsContact C-N 3.34Å; E479-L481 PolarHBondContact O-N 3.01Å; L481-H484 CarbonylContact O-C 3.57Å; L481-H484 VanDerWaalsContact O-C 3.26Å; L481-H484 WeakPolarHBondContact O-CA 3.38Å; L481-H484 WeakPolarHBondContact O-CB 3.49Å; L481-H484 PolarHBondContact O-N 3.08Å; L481-G485 PolarHBondContact O-N 2.92Å; L481-G485 VanDerWaalsContact O-N 3.1Å; L481-I486 CarbonylContact C-O 3.53Å; L481-I486 VanDerWaalsContact C-O 3.25Å; L481-I486 HydrophobicContact CB-CB 4.28Å; L481-I486 HydrophobicContact CD2-CB 4.2Å; L481-I486 HydrophobicContact CD2-CD1 3.86Å; L481-I486 HydrophobicContact CD2-CG2 4.25Å; L481-I486 WeakPolarHBondContact O-CA 3.31Å; L481-I486 WeakPolarHBondContact O-CB 3.36Å; L481-I486 PolarHBondContact O-N 2.89Å; L481-I486 VanDerWaalsContact O-O 3.13Å
482	N	84	Confident	80.5	Confident	105 Å²	105	103.5 Å²	103.5	56%	0.561	51%	0.509	S	S	*	.	H	α-helix	trans	-71.4	-37.8	-179.1	-169.2	56.1	0	0	0	112.6	L478 E479 H484 G485 I486	L478-N482 VanDerWaalsContact O-CB 3.25Å; L478-N482 WeakPolarHBondContact O-CB 3.49Å; L478-N482 PolarHBondContact O-N 3.14Å; E479-N482 PolarHBondContact O-N 2.96Å; N482-H484 VanDerWaalsContact C-N 3.3Å; N482-H484 PolarHBondContact O-N 2.98Å; N482-G485 WeakPolarHBondContact O-CA 3.49Å; N482-G485 PolarHBondContact O-N 3.35Å; N482-I486 PolarHBondContact N-O 2.72Å
483	E	82.3	Confident	80.4	Confident	135 Å²	135	101.6 Å²	101.6	63%	0.631	50%	0.502	S	S	*	.	H	α-helix	trans	-57.8	-44	166.3	-72.3	-172.7	151.4	0	0	111	E479 Q480 G485	E479-E483 PolarHBondContact O-N 3.39Å; Q480-E483 PolarHBondContact NE2-OE2 2.63Å; E483-G485 PolarHBondContact O-N 3.38Å; E483-G485 VanDerWaalsContact O-N 3.07Å
484	H	75.4	Confident	80.3	Confident	24 Å²	24	99.7 Å²	99.7	11%	0.111	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	5.1	171.8	-78.2	73.5	0	0	0	113.6	Q480 L481 N482 I486 K501 L505 E508	Q480-H484 WeakPolarHBondContact O-CB 3.48Å; Q480-H484 PolarHBondContact O-N 3.23Å; Q480-H484 PolarHBondContact O-ND1 3.25Å; L481-H484 CarbonylContact O-C 3.57Å; L481-H484 VanDerWaalsContact O-C 3.26Å; L481-H484 WeakPolarHBondContact O-CA 3.38Å; L481-H484 WeakPolarHBondContact O-CB 3.49Å; L481-H484 PolarHBondContact O-N 3.08Å; N482-H484 VanDerWaalsContact C-N 3.3Å; N482-H484 PolarHBondContact O-N 2.98Å; H484-I486 VanDerWaalsContact C-N 3.27Å; H484-I486 PolarHBondContact O-N 3.36Å; H484-K501 VanDerWaalsContact O-CD 3.28Å; H484-K501 WeakPolarHBondContact O-CD 3.24Å; H484-K501 WeakPolarHBondContact O-CE 3.45Å; H484-K501 PolarHBondContact O-NZ 3.38Å; H484-L505 WeakPolarHBondContact NE2-CD2 3.39Å; H484-E508 IonicContact CE1-OE1 3.19Å; H484-E508 IonicContact CE1-OE2 2.74Å; H484-E508 IonicContact NE2-OE1 3.68Å; H484-E508 IonicContact NE2-OE2 2.66Å
485	G	78	Confident	80.3	Confident	46 Å²	46	100 Å²	100	47%	0.474	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	20.3	176.5	0	0	0	0	0	114.6	L481 N482 E483	L481-G485 PolarHBondContact O-N 2.92Å; L481-G485 VanDerWaalsContact O-N 3.1Å; N482-G485 WeakPolarHBondContact O-CA 3.49Å; N482-G485 PolarHBondContact O-N 3.35Å; E483-G485 PolarHBondContact O-N 3.38Å; E483-G485 VanDerWaalsContact O-N 3.07Å
486	I	79.8	Confident	80.2	Confident	29 Å²	29	101.5 Å²	101.5	15%	0.149	51%	0.513	C	S	.	.			trans	-100.6	109.2	172	-58.2	168.9	0	0	0	107.3	L481 N482 H484 L493 K501	L481-I486 CarbonylContact C-O 3.53Å; L481-I486 VanDerWaalsContact C-O 3.25Å; L481-I486 HydrophobicContact CB-CB 4.28Å; L481-I486 HydrophobicContact CD2-CB 4.2Å; L481-I486 HydrophobicContact CD2-CD1 3.86Å; L481-I486 HydrophobicContact CD2-CG2 4.25Å; L481-I486 WeakPolarHBondContact O-CA 3.31Å; L481-I486 WeakPolarHBondContact O-CB 3.36Å; L481-I486 PolarHBondContact O-N 2.89Å; L481-I486 VanDerWaalsContact O-O 3.13Å; N482-I486 PolarHBondContact N-O 2.72Å; H484-I486 VanDerWaalsContact C-N 3.27Å; H484-I486 PolarHBondContact O-N 3.36Å; I486-L493 HydrophobicContact CD1-CD1 3.99Å; I486-L493 HydrophobicContact CG1-CD1 4.35Å; I486-L493 HydrophobicContact CG1-CD2 4.18Å; I486-L493 HydrophobicContact CG2-CD2 4.34Å; I486-K501 HydrophobicContact CD1-CG 4.49Å
487	K	76.4	Confident	80.2	Confident	123 Å²	123	101 Å²	101	54%	0.535	51%	0.508	S	S	.	.			trans	-78.7	151.9	-178.3	-62.1	-179.1	174.3	-174.8	0	111.5	D489 Q490	K487-D489 WeakPolarHBondContact CB-OD1 3.45Å; K487-D489 PolarHBondContact O-N 2.91Å; K487-D489 VanDerWaalsContact O-N 3.14Å; K487-Q490 HydrophobicContact CB-CG 4.11Å; K487-Q490 WeakPolarHBondContact O-CB 3.3Å; K487-Q490 PolarHBondContact O-N 3.27Å
488	S	71	Confident	80.3	Confident	113 Å²	113	99.9 Å²	99.9	79%	0.79	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.9	-180	55.4	0	0	0	0	115
489	D	76.4	Confident	80.5	Confident	116 Å²	116	100.5 Å²	100.5	62%	0.62	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-13.5	173.9	67.7	-37	0	0	0	113.8	K487 R491	K487-D489 WeakPolarHBondContact CB-OD1 3.45Å; K487-D489 PolarHBondContact O-N 2.91Å; K487-D489 VanDerWaalsContact O-N 3.14Å; D489-R491 PolarHBondContact O-N 2.95Å
490	Q	73.3	Confident	80.6	Confident	79 Å²	79	100.8 Å²	100.8	37%	0.369	51%	0.507	S	S	.	.			trans	-76.5	85.2	-174.8	-74.7	177.5	-29.2	0	0	112.9	K487 R492	K487-Q490 HydrophobicContact CB-CG 4.11Å; K487-Q490 WeakPolarHBondContact O-CB 3.3Å; K487-Q490 PolarHBondContact O-N 3.27Å; Q490-R492 PolarHBondContact O-N 3.02Å; Q490-R492 VanDerWaalsContact O-N 3.08Å
491	R	77.4	Confident	80.8	Confident	248 Å²	248	98.9 Å²	98.9	94%	0.936	50%	0.497	S	S	*	.	S	Bend	trans	-63.1	-8.9	172.3	-63.5	-174.5	177.5	-163.3	-1.6	115.1	D489	D489-R491 PolarHBondContact O-N 2.95Å
492	R	76.8	Confident	81.1	Confident	226 Å²	226	100 Å²	100	85%	0.853	50%	0.503	S	S	*	.			trans	-149.4	143.7	-179.7	-74.5	-170.3	165	-155.9	-6.6	111.3	Q490	Q490-R492 PolarHBondContact O-N 3.02Å; Q490-R492 VanDerWaalsContact O-N 3.08Å
493	L	81.2	Confident	81.3	Confident	65 Å²	65	99.5 Å²	99.5	34%	0.34	50%	0.504	S	S	.	.			trans	-115.1	149.6	166.3	-63.7	169.6	0	0	0	108.6	I486	I486-L493 HydrophobicContact CD1-CD1 3.99Å; I486-L493 HydrophobicContact CG1-CD1 4.35Å; I486-L493 HydrophobicContact CG1-CD2 4.18Å; I486-L493 HydrophobicContact CG2-CD2 4.34Å
494	S	83.6	Confident	81.6	Confident	57 Å²	57	96.2 Å²	96.2	40%	0.399	49%	0.49	S	S	.	.			trans	-74.2	154.4	167.3	67.2	0	0	0	0	110.9	N496 Q497 L498	S494-N496 PolarHBondContact O-N 2.69Å; S494-Q497 PolarHBondContact O-N 3.21Å; S494-Q497 VanDerWaalsContact O-N 3.1Å; S494-Q497 WeakPolarHBondContact OG-CB 3.5Å; S494-Q497 VanDerWaalsContact OG-CG 3.28Å; S494-Q497 WeakPolarHBondContact OG-CG 3.33Å; S494-Q497 PolarHBondContact OG-N 3.23Å; S494-Q497 PolarHBondContact OG-OE1 2.95Å; S494-L498 PolarHBondContact O-N 2.88Å
495	T	84.5	Confident	82.1	Confident	100 Å²	100	97.5 Å²	97.5	61%	0.613	50%	0.497	S	S	*	.	H	α-helix	trans	-56.5	-37.2	178.9	-44.2	0	0	0	0	112.2	L498 N499	T495-L498 PolarHBondContact O-N 3.1Å; T495-N499 WeakPolarHBondContact O-CB 3.35Å; T495-N499 PolarHBondContact O-N 3.16Å; T495-N499 PolarHBondContact O-ND2 3.32Å
496	N	84.3	Confident	82.5	Confident	130 Å²	130	100.9 Å²	100.9	70%	0.695	50%	0.501	S	S	*	.	H	α-helix	trans	-68.4	-42	177.4	-68.4	-2.7	0	0	0	112.1	S494 N499 Q500	S494-N496 PolarHBondContact O-N 2.69Å; N496-N499 PolarHBondContact O-N 3.12Å; N496-Q500 WeakPolarHBondContact O-CB 3.47Å; N496-Q500 PolarHBondContact O-N 2.93Å
497	Q	85	Confident	82.9	Confident	86 Å²	86	106 Å²	106	40%	0.402	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-43.9	173.9	-74.2	161.7	-35.8	0	0	111.4	S494 N499 Q500 K501	S494-Q497 PolarHBondContact O-N 3.21Å; S494-Q497 VanDerWaalsContact O-N 3.1Å; S494-Q497 WeakPolarHBondContact OG-CB 3.5Å; S494-Q497 VanDerWaalsContact OG-CG 3.28Å; S494-Q497 WeakPolarHBondContact OG-CG 3.33Å; S494-Q497 PolarHBondContact OG-N 3.23Å; S494-Q497 PolarHBondContact OG-OE1 2.95Å; Q497-N499 PolarHBondContact O-N 3.03Å; Q497-Q500 PolarHBondContact O-N 3.45Å; Q497-K501 VanDerWaalsContact O-CG 3.31Å; Q497-K501 WeakPolarHBondContact O-CG 3.47Å; Q497-K501 PolarHBondContact O-N 3.38Å
498	L	85.5	Confident	83.3	Confident	80 Å²	80	103.8 Å²	103.8	42%	0.419	51%	0.514	S	S	.	.	H	α-helix	trans	-58.2	-49.2	176.3	177.7	61	0	0	0	111	S494 T495 Q500 K501 L502	S494-L498 PolarHBondContact O-N 2.88Å; T495-L498 PolarHBondContact O-N 3.1Å; L498-Q500 PolarHBondContact O-N 2.91Å; L498-K501 PolarHBondContact O-N 3.18Å; L498-L502 HydrophobicContact CD1-CD1 4.02Å; L498-L502 HydrophobicContact CD1-CG 4.16Å; L498-L502 HydrophobicContact CG-CD1 3.93Å; L498-L502 HydrophobicContact CG-CG 4.47Å; L498-L502 WeakPolarHBondContact O-CB 3.37Å; L498-L502 VanDerWaalsContact O-CG 3.26Å; L498-L502 WeakPolarHBondContact O-CG 3.26Å; L498-L502 PolarHBondContact O-N 3.05Å
499	N	86.5	Confident	84.1	Confident	84 Å²	84	103.7 Å²	103.7	45%	0.449	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-45.1	176.9	-70.5	-11.9	0	0	0	111.6	T495 N496 Q497 K501 L502 T503	T495-N499 WeakPolarHBondContact O-CB 3.35Å; T495-N499 PolarHBondContact O-N 3.16Å; T495-N499 PolarHBondContact O-ND2 3.32Å; N496-N499 PolarHBondContact O-N 3.12Å; Q497-N499 PolarHBondContact O-N 3.03Å; N499-K501 PolarHBondContact O-N 3.27Å; N499-L502 PolarHBondContact O-N 3.46Å; N499-T503 PolarHBondContact O-N 3.4Å; N499-T503 PolarHBondContact O-OG1 2.95Å; N499-T503 VanDerWaalsContact O-OG1 3.06Å
500	Q	87.8	Confident	84.5	Confident	117 Å²	117	103.2 Å²	103.2	55%	0.547	49%	0.49	S	S	.	.	H	α-helix	trans	-59.2	-44.7	177.2	-171.3	-174.7	27.8	0	0	112.4	N496 Q497 L498 T503 I504	N496-Q500 WeakPolarHBondContact O-CB 3.47Å; N496-Q500 PolarHBondContact O-N 2.93Å; Q497-Q500 PolarHBondContact O-N 3.45Å; L498-Q500 PolarHBondContact O-N 2.91Å; Q500-T503 PolarHBondContact O-N 2.67Å; Q500-I504 WeakPolarHBondContact O-CG1 3.43Å; Q500-I504 PolarHBondContact O-N 2.9Å; Q500-I504 VanDerWaalsContact O-N 3.14Å
501	K	86.1	Confident	85.2	Confident	51 Å²	51	102.8 Å²	102.8	22%	0.222	49%	0.49	C	S	.	.	H	α-helix	trans	-70.8	-35.4	178.2	-60.7	-62.2	171.3	175.9	0	112.2	H484 I486 Q497 L498 N499 T503 I504 L505	H484-K501 VanDerWaalsContact O-CD 3.28Å; H484-K501 WeakPolarHBondContact O-CD 3.24Å; H484-K501 WeakPolarHBondContact O-CE 3.45Å; H484-K501 PolarHBondContact O-NZ 3.38Å; I486-K501 HydrophobicContact CD1-CG 4.49Å; Q497-K501 VanDerWaalsContact O-CG 3.31Å; Q497-K501 WeakPolarHBondContact O-CG 3.47Å; Q497-K501 PolarHBondContact O-N 3.38Å; L498-K501 PolarHBondContact O-N 3.18Å; N499-K501 PolarHBondContact O-N 3.27Å; K501-T503 VanDerWaalsContact C-N 3.34Å; K501-I504 HydrophobicContact CD-CD1 4.27Å; K501-I504 PolarHBondContact O-N 3.21Å; K501-L505 WeakPolarHBondContact O-CG 3.26Å; K501-L505 PolarHBondContact O-N 3.42Å
502	L	88	Confident	85.6	Confident	85 Å²	85	94.4 Å²	94.4	45%	0.445	46%	0.463	S	S	.	.	H	α-helix	trans	-63.9	-36.4	171.4	-73	171.9	0	0	0	112.3	L498 N499 H506	L498-L502 HydrophobicContact CD1-CD1 4.02Å; L498-L502 HydrophobicContact CD1-CG 4.16Å; L498-L502 HydrophobicContact CG-CD1 3.93Å; L498-L502 HydrophobicContact CG-CG 4.47Å; L498-L502 WeakPolarHBondContact O-CB 3.37Å; L498-L502 VanDerWaalsContact O-CG 3.26Å; L498-L502 WeakPolarHBondContact O-CG 3.26Å; L498-L502 PolarHBondContact O-N 3.05Å; N499-L502 PolarHBondContact O-N 3.46Å; L502-H506 WeakPolarHBondContact O-CB 3.3Å; L502-H506 PolarHBondContact O-N 2.82Å
503	T	87.7	Confident	86	Confident	96 Å²	96	85.3 Å²	85.3	59%	0.589	44%	0.437	S	S	*	.	H	α-helix	trans	-65.6	-41.3	173.9	-59.1	0	0	0	0	112.2	N499 Q500 K501 H506 K507	N499-T503 PolarHBondContact O-N 3.4Å; N499-T503 PolarHBondContact O-OG1 2.95Å; N499-T503 VanDerWaalsContact O-OG1 3.06Å; Q500-T503 PolarHBondContact O-N 2.67Å; K501-T503 VanDerWaalsContact C-N 3.34Å; T503-H506 WeakPolarHBondContact O-CB 3.35Å; T503-H506 PolarHBondContact O-N 3.05Å; T503-K507 PolarHBondContact O-N 2.91Å
504	I	88	Confident	86.2	Confident	66 Å²	66	91.5 Å²	91.5	34%	0.338	46%	0.456	S	S	.	.	H	α-helix	trans	-61.5	-53.1	174.8	-68.4	163.6	0	0	0	110.2	Q500 K501 H506 K507 E508	Q500-I504 WeakPolarHBondContact O-CG1 3.43Å; Q500-I504 PolarHBondContact O-N 2.9Å; Q500-I504 VanDerWaalsContact O-N 3.14Å; K501-I504 HydrophobicContact CD-CD1 4.27Å; K501-I504 PolarHBondContact O-N 3.21Å; I504-H506 PolarHBondContact O-N 3.31Å; I504-H506 VanDerWaalsContact O-N 3.15Å; I504-K507 PolarHBondContact O-N 3Å; I504-E508 PolarHBondContact O-N 3.16Å
505	L	86.9	Confident	86.4	Confident	50 Å²	50	95.9 Å²	95.9	26%	0.262	47%	0.468	S	S	.	.	H	α-helix	trans	-58.3	-28.8	175.8	-71.5	168	0	0	0	112.7	H484 K501 R509	H484-L505 WeakPolarHBondContact NE2-CD2 3.39Å; K501-L505 WeakPolarHBondContact O-CG 3.26Å; K501-L505 PolarHBondContact O-N 3.42Å; L505-R509 WeakPolarHBondContact O-CB 3.48Å; L505-R509 WeakPolarHBondContact O-CD 3.37Å; L505-R509 WeakPolarHBondContact O-CG 3.23Å; L505-R509 PolarHBondContact O-N 2.82Å
506	H	86.3	Confident	86.4	Confident	117 Å²	117	97.1 Å²	97.1	54%	0.542	46%	0.462	S	S	.	.	H	α-helix	trans	-71	-45.7	173.2	-165.9	-71.7	0	0	0	111.9	L502 T503 I504 E508 R509 E510	L502-H506 WeakPolarHBondContact O-CB 3.3Å; L502-H506 PolarHBondContact O-N 2.82Å; T503-H506 WeakPolarHBondContact O-CB 3.35Å; T503-H506 PolarHBondContact O-N 3.05Å; I504-H506 PolarHBondContact O-N 3.31Å; I504-H506 VanDerWaalsContact O-N 3.15Å; H506-E508 VanDerWaalsContact C-N 3.29Å; H506-E508 PolarHBondContact O-N 3.44Å; H506-R509 PolarHBondContact O-N 3.44Å; H506-E510 WeakPolarHBondContact O-CB 3.22Å; H506-E510 PolarHBondContact O-N 3.15Å
507	K	87.9	Confident	86.2	Confident	138 Å²	138	99.9 Å²	99.9	60%	0.6	47%	0.47	S	S	*	.	H	α-helix	trans	-60.4	-39.4	176.1	-167.5	175.5	-176.7	178.8	0	111.1	T503 I504 E510 N511	T503-K507 PolarHBondContact O-N 2.91Å; I504-K507 PolarHBondContact O-N 3Å; K507-E510 PolarHBondContact O-N 3.01Å; K507-N511 PolarHBondContact O-N 3.33Å; K507-N511 PolarHBondContact O-ND2 3.46Å; K507-N511 PolarHBondContact O-OD1 2.87Å
508	E	85.1	Confident	86.1	Confident	76 Å²	76	99.8 Å²	99.8	36%	0.355	47%	0.473	S	S	.	.	H	α-helix	trans	-66	-45.7	174.1	-70.3	173.5	-178.6	0	0	113	H484 I504 H506 E510 N511 L512	H484-E508 IonicContact CE1-OE1 3.19Å; H484-E508 IonicContact CE1-OE2 2.74Å; H484-E508 IonicContact NE2-OE1 3.68Å; H484-E508 IonicContact NE2-OE2 2.66Å; I504-E508 PolarHBondContact O-N 3.16Å; H506-E508 VanDerWaalsContact C-N 3.29Å; H506-E508 PolarHBondContact O-N 3.44Å; E508-E510 VanDerWaalsContact C-N 3.25Å; E508-E510 PolarHBondContact O-N 3.38Å; E508-N511 WeakPolarHBondContact O-CB 3.48Å; E508-N511 PolarHBondContact O-N 3.22Å; E508-N511 VanDerWaalsContact O-N 3.17Å; E508-L512 WeakPolarHBondContact O-CG 3.41Å; E508-L512 PolarHBondContact O-N 2.82Å
509	R	87.4	Confident	86.2	Confident	110 Å²	110	97.9 Å²	97.9	42%	0.415	46%	0.461	S	S	.	.	H	α-helix	trans	-61.3	-35.3	175	-74	163.6	-172.6	176.9	1.7	112	L505 H506 L512 A513 F519	L505-R509 WeakPolarHBondContact O-CB 3.48Å; L505-R509 WeakPolarHBondContact O-CD 3.37Å; L505-R509 WeakPolarHBondContact O-CG 3.23Å; L505-R509 PolarHBondContact O-N 2.82Å; H506-R509 PolarHBondContact O-N 3.44Å; R509-L512 PolarHBondContact O-N 3.1Å; R509-A513 VanDerWaalsContact O-CB 3.3Å; R509-A513 WeakPolarHBondContact O-CB 3.35Å; R509-A513 PolarHBondContact O-N 3.19Å; R509-F519 HydrophobicContact CB-CE1 4.06Å; R509-F519 HydrophobicContact CB-CZ 4.27Å; R509-F519 HydrophobicContact CG-CE1 4.35Å; R509-F519 HydrophobicContact CG-CZ 4.15Å; R509-F519 WeakPolarHBondContact O-CE1 3.39Å
510	E	85.8	Confident	86.1	Confident	107 Å²	107	98.7 Å²	98.7	50%	0.5	46%	0.463	S	S	.	.	H	α-helix	trans	-70.1	-39.7	174.1	-174.6	166.6	-166.7	0	0	112	H506 K507 E508 A513 R514	H506-E510 WeakPolarHBondContact O-CB 3.22Å; H506-E510 PolarHBondContact O-N 3.15Å; K507-E510 PolarHBondContact O-N 3.01Å; E508-E510 VanDerWaalsContact C-N 3.25Å; E508-E510 PolarHBondContact O-N 3.38Å; E510-A513 PolarHBondContact O-N 3.05Å; E510-R514 WeakPolarHBondContact O-CG 3.26Å; E510-R514 PolarHBondContact O-N 2.87Å
511	N	86.7	Confident	86	Confident	70 Å²	70	99.3 Å²	99.3	37%	0.374	47%	0.467	S	S	.	.	H	α-helix	trans	-61.2	-43.1	171.2	-66.9	-14.4	0	0	0	111.8	K507 E508 R514 K515	K507-N511 PolarHBondContact O-N 3.33Å; K507-N511 PolarHBondContact O-ND2 3.46Å; K507-N511 PolarHBondContact O-OD1 2.87Å; E508-N511 WeakPolarHBondContact O-CB 3.48Å; E508-N511 PolarHBondContact O-N 3.22Å; E508-N511 VanDerWaalsContact O-N 3.17Å; N511-R514 PolarHBondContact O-N 2.98Å; N511-R514 PolarHBondContact OD1-NH2 3.26Å; N511-K515 PolarHBondContact O-N 3.06Å
512	L	85.8	Confident	85.9	Confident	71 Å²	71	101.7 Å²	101.7	37%	0.372	48%	0.48	S	S	.	.	H	α-helix	trans	-67.8	-37.6	176.1	-70.1	170.9	0	0	0	112.3	E508 R509 R514 K515 Y516 F519	E508-L512 WeakPolarHBondContact O-CG 3.41Å; E508-L512 PolarHBondContact O-N 2.82Å; R509-L512 PolarHBondContact O-N 3.1Å; L512-R514 VanDerWaalsContact C-N 3.33Å; L512-K515 PolarHBondContact O-N 2.7Å; L512-Y516 HydrophobicContact CD2-CD2 4.33Å; L512-Y516 HydrophobicContact CD2-CE2 4.08Å; L512-Y516 PolarHBondContact O-N 2.91Å; L512-F519 HydrophobicContact CB-CD2 3.96Å; L512-F519 HydrophobicContact CB-CE1 4.27Å; L512-F519 HydrophobicContact CB-CE2 3.7Å; L512-F519 HydrophobicContact CB-CG 4.35Å; L512-F519 HydrophobicContact CB-CZ 3.86Å; L512-F519 HydrophobicContact CD1-CE2 3.92Å; L512-F519 HydrophobicContact CD1-CZ 4.1Å; L512-F519 HydrophobicContact CG-CE2 4.43Å
513	A	86.6	Confident	85.9	Confident	36 Å²	36	102.4 Å²	102.4	30%	0.298	48%	0.477	S	S	.	.	H	α-helix	trans	-65.2	-34.3	173.3	0	0	0	0	0	112.7	R509 E510 F519 M520	R509-A513 VanDerWaalsContact O-CB 3.3Å; R509-A513 WeakPolarHBondContact O-CB 3.35Å; R509-A513 PolarHBondContact O-N 3.19Å; E510-A513 PolarHBondContact O-N 3.05Å; A513-F519 HydrophobicContact CB-CD1 3.87Å; A513-M520 HydrophobicContact CB-CG 4.43Å
514	R	85.2	Confident	85.8	Confident	194 Å²	194	101.5 Å²	101.5	73%	0.732	47%	0.469	S	S	*	.	H	α-helix	trans	-69.3	-32.8	171.2	-71.8	-170.3	-70.7	164.9	-4.4	112.6	E510 N511 L512	E510-R514 WeakPolarHBondContact O-CG 3.26Å; E510-R514 PolarHBondContact O-N 2.87Å; N511-R514 PolarHBondContact O-N 2.98Å; N511-R514 PolarHBondContact OD1-NH2 3.26Å; L512-R514 VanDerWaalsContact C-N 3.33Å
515	K	87.5	Confident	85.7	Confident	150 Å²	150	101.3 Å²	101.3	65%	0.652	48%	0.477	S	S	*	.	H	α-helix	trans	-81.6	-31	179.6	-170.6	174.6	179.1	-175.5	0	113.9	N511 L512	N511-K515 PolarHBondContact O-N 3.06Å; L512-K515 PolarHBondContact O-N 2.7Å
516	Y	85.1	Confident	85.7	Confident	126 Å²	126	103.8 Å²	103.8	49%	0.494	49%	0.49	S	S	.	.			trans	-132.9	106.5	-174.5	-57.9	-75.5	0	0	0	111.2	L512 N518 F519	L512-Y516 HydrophobicContact CD2-CD2 4.33Å; L512-Y516 HydrophobicContact CD2-CE2 4.08Å; L512-Y516 PolarHBondContact O-N 2.91Å; Y516-N518 VanDerWaalsContact C-N 3.28Å; Y516-N518 PolarHBondContact O-N 2.92Å; Y516-N518 VanDerWaalsContact O-N 3.15Å; Y516-F519 WeakPolarHBondContact O-CB 3.41Å; Y516-F519 PolarHBondContact O-N 3.37Å
517	Q	80.3	Confident	85.6	Confident	187 Å²	187	100.7 Å²	100.7	87%	0.874	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-38	-173	-171.1	170.4	3.3	0	0	114.2
518	N	81.6	Confident	85.6	Confident	85 Å²	85	98 Å²	98	46%	0.455	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	5.7	-179.4	-60.9	64.1	0	0	0	114	Y516 M520 E521 I522	Y516-N518 VanDerWaalsContact C-N 3.28Å; Y516-N518 PolarHBondContact O-N 2.92Å; Y516-N518 VanDerWaalsContact O-N 3.15Å; N518-M520 VanDerWaalsContact C-N 3.3Å; N518-M520 PolarHBondContact O-N 3.14Å; N518-E521 PolarHBondContact ND2-OE2 3.26Å; N518-E521 PolarHBondContact O-N 3.19Å; N518-I522 HydrophobicContact CB-CD1 4.04Å; N518-I522 HydrophobicContact CB-CG1 4.43Å; N518-I522 WeakPolarHBondContact O-CG1 3.47Å; N518-I522 PolarHBondContact O-N 3.44Å
519	F	88.7	Confident	85.6	Confident	40 Å²	40	98.5 Å²	98.5	18%	0.175	48%	0.476	C	S	.	.	H	α-helix	trans	-53.2	-44.5	-174.9	175.1	-102.5	0	0	0	113.1	R509 L512 A513 Y516 R523	R509-F519 HydrophobicContact CB-CE1 4.06Å; R509-F519 HydrophobicContact CB-CZ 4.27Å; R509-F519 HydrophobicContact CG-CE1 4.35Å; R509-F519 HydrophobicContact CG-CZ 4.15Å; R509-F519 WeakPolarHBondContact O-CE1 3.39Å; L512-F519 HydrophobicContact CB-CD2 3.96Å; L512-F519 HydrophobicContact CB-CE1 4.27Å; L512-F519 HydrophobicContact CB-CE2 3.7Å; L512-F519 HydrophobicContact CB-CG 4.35Å; L512-F519 HydrophobicContact CB-CZ 3.86Å; L512-F519 HydrophobicContact CD1-CE2 3.92Å; L512-F519 HydrophobicContact CD1-CZ 4.1Å; L512-F519 HydrophobicContact CG-CE2 4.43Å; A513-F519 HydrophobicContact CB-CD1 3.87Å; Y516-F519 WeakPolarHBondContact O-CB 3.41Å; Y516-F519 PolarHBondContact O-N 3.37Å; F519-R523 VanDerWaalsContact O-CB 3.23Å; F519-R523 WeakPolarHBondContact O-CB 3.3Å; F519-R523 PolarHBondContact O-N 3.16Å
520	M	84.3	Confident	85.5	Confident	100 Å²	100	97.6 Å²	97.6	49%	0.493	48%	0.483	S	S	.	.	H	α-helix	trans	-70.8	-36.8	-177.5	-70.3	-65.4	-78.4	0	0	112.6	A513 N518 D524	A513-M520 HydrophobicContact CB-CG 4.43Å; N518-M520 VanDerWaalsContact C-N 3.3Å; N518-M520 PolarHBondContact O-N 3.14Å; M520-D524 WeakPolarHBondContact O-CB 3.4Å; M520-D524 PolarHBondContact O-N 3.44Å
521	E	84.1	Confident	85.5	Confident	131 Å²	131	96.3 Å²	96.3	61%	0.612	48%	0.479	S	S	*	.	H	α-helix	trans	-65	-46.6	175.5	-60.2	174.8	167	0	0	111	N518 D524 A525	N518-E521 PolarHBondContact ND2-OE2 3.26Å; N518-E521 PolarHBondContact O-N 3.19Å; E521-D524 PolarHBondContact O-N 3.26Å; E521-A525 WeakPolarHBondContact O-CB 3.5Å; E521-A525 PolarHBondContact O-N 3.28Å
522	I	83.9	Confident	85.3	Confident	100 Å²	100	100.5 Å²	100.5	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-63.6	-44	178	-65.2	165.9	0	0	0	110.2	N518 L526	N518-I522 HydrophobicContact CB-CD1 4.04Å; N518-I522 HydrophobicContact CB-CG1 4.43Å; N518-I522 WeakPolarHBondContact O-CG1 3.47Å; N518-I522 PolarHBondContact O-N 3.44Å; I522-L526 HydrophobicContact CG2-CD1 3.97Å; I522-L526 WeakPolarHBondContact O-CB 3.19Å; I522-L526 VanDerWaalsContact O-CG 3.27Å; I522-L526 WeakPolarHBondContact O-CG 3.31Å; I522-L526 PolarHBondContact O-N 3.19Å
523	R	88.2	Confident	85.1	Confident	100 Å²	100	101.9 Å²	101.9	38%	0.377	50%	0.497	S	S	.	.	H	α-helix	trans	-63.9	-40.6	178.4	-168.8	-174.4	72.8	81.2	7.1	112.2	F519 S527	F519-R523 VanDerWaalsContact O-CB 3.23Å; F519-R523 WeakPolarHBondContact O-CB 3.3Å; F519-R523 PolarHBondContact O-N 3.16Å; R523-S527 PolarHBondContact O-N 3.35Å
524	D	86.5	Confident	84.7	Confident	78 Å²	78	102.3 Å²	102.3	42%	0.417	50%	0.501	S	S	.	.	H	α-helix	trans	-69.5	-45.4	178.5	-164.9	78.8	0	0	0	111.6	M520 E521 L526 S527 Q528	M520-D524 WeakPolarHBondContact O-CB 3.4Å; M520-D524 PolarHBondContact O-N 3.44Å; E521-D524 PolarHBondContact O-N 3.26Å; D524-L526 VanDerWaalsContact C-N 3.29Å; D524-L526 PolarHBondContact O-N 2.92Å; D524-S527 WeakPolarHBondContact O-CB 3.22Å; D524-S527 PolarHBondContact O-N 3.02Å; D524-S527 VanDerWaalsContact O-N 3.13Å; D524-Q528 WeakPolarHBondContact O-CG 3.11Å; D524-Q528 PolarHBondContact O-N 2.86Å; D524-Q528 PolarHBondContact OD2-NE2 3.31Å
525	A	86.7	Confident	84.4	Confident	61 Å²	61	98.7 Å²	98.7	50%	0.504	49%	0.492	S	S	.	.	H	α-helix	trans	-59	-39.1	174.5	0	0	0	0	0	112.6	E521 N529	E521-A525 WeakPolarHBondContact O-CB 3.5Å; E521-A525 PolarHBondContact O-N 3.28Å; A525-N529 WeakPolarHBondContact O-CB 3.26Å; A525-N529 PolarHBondContact O-N 3.07Å; A525-N529 VanDerWaalsContact O-N 3.11Å
526	L	85.4	Confident	83.9	Confident	103 Å²	103	93.6 Å²	93.6	54%	0.539	48%	0.478	S	S	.	.	H	α-helix	trans	-68.1	-42	173.5	-73.4	172	0	0	0	112.4	I522 D524 N529 V530	I522-L526 HydrophobicContact CG2-CD1 3.97Å; I522-L526 WeakPolarHBondContact O-CB 3.19Å; I522-L526 VanDerWaalsContact O-CG 3.27Å; I522-L526 WeakPolarHBondContact O-CG 3.31Å; I522-L526 PolarHBondContact O-N 3.19Å; D524-L526 VanDerWaalsContact C-N 3.29Å; D524-L526 PolarHBondContact O-N 2.92Å; L526-N529 PolarHBondContact O-N 3.5Å; L526-V530 WeakPolarHBondContact O-CG2 3.37Å; L526-V530 PolarHBondContact O-N 3.25Å
527	S	85.7	Confident	83.5	Confident	51 Å²	51	90.9 Å²	90.9	36%	0.357	48%	0.481	S	S	.	.	H	α-helix	trans	-58.4	-55.4	174.7	-164.1	0	0	0	0	110.4	R523 D524 N529 V530 D531	R523-S527 PolarHBondContact O-N 3.35Å; D524-S527 WeakPolarHBondContact O-CB 3.22Å; D524-S527 PolarHBondContact O-N 3.02Å; D524-S527 VanDerWaalsContact O-N 3.13Å; S527-N529 PolarHBondContact O-N 3.24Å; S527-N529 VanDerWaalsContact O-N 3.1Å; S527-V530 CarbonylContact O-C 3.58Å; S527-V530 WeakPolarHBondContact O-CA 3.43Å; S527-V530 PolarHBondContact O-N 2.83Å; S527-D531 VanDerWaalsContact C-OD2 3.24Å; S527-D531 VanDerWaalsContact O-CG 3.24Å; S527-D531 PolarHBondContact O-N 2.7Å; S527-D531 PolarHBondContact OG-OD2 2.94Å; S527-D531 VanDerWaalsContact OG-OD2 3.11Å
528	Q	86.6	Confident	83.3	Confident	82 Å²	82	88.9 Å²	88.9	38%	0.383	48%	0.476	S	S	.	.	H	α-helix	trans	-55.1	-34.5	178.6	-68.8	-172	41.2	0	0	112.8	D524 R532	D524-Q528 WeakPolarHBondContact O-CG 3.11Å; D524-Q528 PolarHBondContact O-N 2.86Å; D524-Q528 PolarHBondContact OD2-NE2 3.31Å; Q528-R532 WeakPolarHBondContact O-CB 3.39Å; Q528-R532 VanDerWaalsContact O-CD 3.25Å; Q528-R532 WeakPolarHBondContact O-CD 3.26Å; Q528-R532 WeakPolarHBondContact O-CG 3.35Å; Q528-R532 PolarHBondContact O-N 2.74Å; Q528-R532 PolarHBondContact O-NE 2.73Å
529	N	84.6	Confident	82.9	Confident	86 Å²	86	95 Å²	95	46%	0.46	49%	0.492	S	S	.	.	H	α-helix	trans	-70.1	-44.3	175.9	-168.6	37.4	0	0	0	112.1	A525 L526 S527 R532 L533	A525-N529 WeakPolarHBondContact O-CB 3.26Å; A525-N529 PolarHBondContact O-N 3.07Å; A525-N529 VanDerWaalsContact O-N 3.11Å; L526-N529 PolarHBondContact O-N 3.5Å; S527-N529 PolarHBondContact O-N 3.24Å; S527-N529 VanDerWaalsContact O-N 3.1Å; N529-R532 PolarHBondContact O-N 3.46Å; N529-L533 WeakPolarHBondContact O-CB 3.47Å; N529-L533 VanDerWaalsContact O-CG 3.28Å; N529-L533 WeakPolarHBondContact O-CG 3.4Å; N529-L533 PolarHBondContact O-N 3.3Å
530	V	85.6	Confident	81.3	Confident	92 Å²	92	96.1 Å²	96.1	56%	0.558	52%	0.516	S	S	*	.	H	α-helix	trans	-62.8	-43.8	174.7	172.3	0	0	0	0	111.1	L526 S527 R532 L533 A534	L526-V530 WeakPolarHBondContact O-CG2 3.37Å; L526-V530 PolarHBondContact O-N 3.25Å; S527-V530 CarbonylContact O-C 3.58Å; S527-V530 WeakPolarHBondContact O-CA 3.43Å; S527-V530 PolarHBondContact O-N 2.83Å; V530-R532 PolarHBondContact O-N 2.96Å; V530-L533 PolarHBondContact O-N 3.32Å; V530-A534 WeakPolarHBondContact O-CB 3.44Å; V530-A534 PolarHBondContact O-N 3.44Å
531	D	85.6	Confident	79.6	Confident	79 Å²	79	95.2 Å²	95.2	42%	0.422	52%	0.519	S	S	.	.	H	α-helix	trans	-62.8	-42.1	178.7	-64.3	-44.9	0	0	0	111.3	S527 A534 H535	S527-D531 VanDerWaalsContact C-OD2 3.24Å; S527-D531 VanDerWaalsContact O-CG 3.24Å; S527-D531 PolarHBondContact O-N 2.7Å; S527-D531 PolarHBondContact OG-OD2 2.94Å; S527-D531 VanDerWaalsContact OG-OD2 3.11Å; D531-A534 PolarHBondContact O-N 3.46Å; D531-H535 WeakPolarHBondContact O-CB 3.31Å; D531-H535 PolarHBondContact O-CD2 2.94Å; D531-H535 PolarHBondContact O-N 3.24Å
532	R	84	Confident	77.8	Confident	158 Å²	158	95.1 Å²	95.1	60%	0.596	53%	0.528	S	S	*	.	H	α-helix	trans	-63.1	-44.1	173.2	-71.8	165.3	-158.7	-168.2	8.1	112.1	Q528 N529 V530 H535 A536	Q528-R532 WeakPolarHBondContact O-CB 3.39Å; Q528-R532 VanDerWaalsContact O-CD 3.25Å; Q528-R532 WeakPolarHBondContact O-CD 3.26Å; Q528-R532 WeakPolarHBondContact O-CG 3.35Å; Q528-R532 PolarHBondContact O-N 2.74Å; Q528-R532 PolarHBondContact O-NE 2.73Å; N529-R532 PolarHBondContact O-N 3.46Å; V530-R532 PolarHBondContact O-N 2.96Å; R532-H535 PolarHBondContact O-N 3.01Å; R532-A536 WeakPolarHBondContact O-CB 3.42Å; R532-A536 PolarHBondContact O-N 2.97Å
533	L	81.9	Confident	75.8	Confident	100 Å²	100	97 Å²	97	52%	0.524	54%	0.537	S	S	.	.	H	α-helix	trans	-65.7	-41.4	177.8	-73.3	167.4	0	0	0	111.9	N529 V530 A536 A537	N529-L533 WeakPolarHBondContact O-CB 3.47Å; N529-L533 VanDerWaalsContact O-CG 3.28Å; N529-L533 WeakPolarHBondContact O-CG 3.4Å; N529-L533 PolarHBondContact O-N 3.3Å; V530-L533 PolarHBondContact O-N 3.32Å; L533-A536 PolarHBondContact O-N 3.06Å; L533-A537 WeakPolarHBondContact O-CB 3.48Å; L533-A537 PolarHBondContact O-N 3.22Å
534	A	78.1	Confident	73.7	Confident	46 Å²	46	97 Å²	97	38%	0.38	55%	0.553	S	S	.	*	H	α-helix	trans	-63.4	-45	175.1	0	0	0	0	0	111.5	V530 D531 A536 A537 L538	V530-A534 WeakPolarHBondContact O-CB 3.44Å; V530-A534 PolarHBondContact O-N 3.44Å; D531-A534 PolarHBondContact O-N 3.46Å; A534-A536 VanDerWaalsContact C-N 3.34Å; A534-A536 PolarHBondContact O-N 3.19Å; A534-A537 PolarHBondContact O-N 3.13Å; A534-L538 WeakPolarHBondContact O-CB 3.17Å; A534-L538 VanDerWaalsContact O-CG 3.26Å; A534-L538 WeakPolarHBondContact O-CG 3.35Å; A534-L538 PolarHBondContact O-N 3.26Å
535	H	77.5	Confident	71.6	Confident	117 Å²	117	98 Å²	98	54%	0.542	56%	0.557	S	S	.	*	H	α-helix	trans	-64.6	-34.2	174.6	-76.6	-46.5	0	0	0	113.5	D531 R532 R539	D531-H535 WeakPolarHBondContact O-CB 3.31Å; D531-H535 PolarHBondContact O-CD2 2.94Å; D531-H535 PolarHBondContact O-N 3.24Å; R532-H535 PolarHBondContact O-N 3.01Å; H535-R539 VanDerWaalsContact O-CG 3.31Å; H535-R539 WeakPolarHBondContact O-CG 3.5Å; H535-R539 PolarHBondContact O-N 3.23Å
536	A	77.1	Confident	69.5	Low	43 Å²	43	99.6 Å²	99.6	36%	0.355	56%	0.563	S	S	.	*	H	α-helix	trans	-66.9	-46.9	174.2	0	0	0	0	0	111.6	R532 L533 A534 R539	R532-A536 WeakPolarHBondContact O-CB 3.42Å; R532-A536 PolarHBondContact O-N 2.97Å; L533-A536 PolarHBondContact O-N 3.06Å; A534-A536 VanDerWaalsContact C-N 3.34Å; A534-A536 PolarHBondContact O-N 3.19Å; A536-R539 PolarHBondContact O-N 3.28Å
537	A	76.9	Confident	67.1	Low	69 Å²	69	100.4 Å²	100.4	57%	0.57	56%	0.564	S	S	*	*	H	α-helix	trans	-62.2	-43.7	177.2	0	0	0	0	0	112.4	L533 A534 R539 G540	L533-A537 WeakPolarHBondContact O-CB 3.48Å; L533-A537 PolarHBondContact O-N 3.22Å; A534-A537 PolarHBondContact O-N 3.13Å; A537-R539 PolarHBondContact O-N 3.12Å; A537-G540 PolarHBondContact O-N 3.06Å
538	L	76.4	Confident	64.9	Low	145 Å²	145	103.8 Å²	103.8	76%	0.759	58%	0.582	S	S	*	*	H	α-helix	trans	-64.3	-23.4	176.9	-74.9	169.6	0	0	0	113.7	A534 G540	A534-L538 WeakPolarHBondContact O-CB 3.17Å; A534-L538 VanDerWaalsContact O-CG 3.26Å; A534-L538 WeakPolarHBondContact O-CG 3.35Å; A534-L538 PolarHBondContact O-N 3.26Å; L538-G540 VanDerWaalsContact C-N 3.32Å
539	R	72.9	Confident	62.5	Low	213 Å²	213	109.7 Å²	109.7	80%	0.804	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	0.8	174.6	-71.7	178.7	-172.4	-137.8	3.9	113.5	H535 A536 A537 S541	H535-R539 VanDerWaalsContact O-CG 3.31Å; H535-R539 WeakPolarHBondContact O-CG 3.5Å; H535-R539 PolarHBondContact O-N 3.23Å; A536-R539 PolarHBondContact O-N 3.28Å; A537-R539 PolarHBondContact O-N 3.12Å; R539-S541 PolarHBondContact O-N 3.47Å
540	G	55.6	Low	60	Low	65 Å²	65	112.6 Å²	112.6	67%	0.67	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.4	13.6	179.6	0	0	0	0	0	114.7	A537 L538 T542	A537-G540 PolarHBondContact O-N 3.06Å; L538-G540 VanDerWaalsContact C-N 3.32Å; G540-T542 PolarHBondContact O-N 3.43Å
541	S	48.9	Very low	57.5	Low	80 Å²	80	116.3 Å²	116.3	56%	0.559	62%	0.62	S	S	*	*			trans	-73.9	126.2	179.8	-168	0	0	0	0	109.9	R539	R539-S541 PolarHBondContact O-N 3.47Å
542	T	46.5	Very low	54.8	Low	130 Å²	130	117.2 Å²	117.2	80%	0.798	64%	0.638	S	S	*	*			trans	-62.8	139.2	177	40.4	0	0	0	0	111.1	G540 S544	G540-T542 PolarHBondContact O-N 3.43Å; T542-S544 PolarHBondContact O-N 2.71Å; T542-S544 VanDerWaalsContact O-N 3.15Å
543	I	40.9	Very low	52.3	Low	138 Å²	138	115.2 Å²	115.2	71%	0.708	64%	0.636	S	S	*	*			trans	-82.9	95.2	-172.6	-55.5	170.7	0	0	0	109.4	I545	I543-I545 HydrophobicContact CG2-CD1 4.21Å; I543-I545 HydrophobicContact CG2-CG1 4.13Å
544	S	44.1	Very low	50	Low	102 Å²	102	118.8 Å²	118.8	71%	0.713	66%	0.655	S	S	*	*			trans	-83.3	142.1	142.6	63.8	0	0	0	0	107.9	T542 P546	T542-S544 PolarHBondContact O-N 2.71Å; T542-S544 VanDerWaalsContact O-N 3.15Å; S544-P546 WeakPolarHBondContact O-CD 3.3Å
545	I	43.4	Very low	47.9	Very low	98 Å²	98	123.5 Å²	123.5	50%	0.503	67%	0.673	S	S	.	*			trans	-93.5	113.9	172.3	-58.5	94.4	0	0	0	108.1	I543 E547	I543-I545 HydrophobicContact CG2-CD1 4.21Å; I543-I545 HydrophobicContact CG2-CG1 4.13Å; I545-E547 PolarHBondContact O-N 2.93Å
546	P	41.1	Very low	45.8	Very low	95 Å²	95	126.2 Å²	126.2	62%	0.617	69%	0.685	S	S	*	*			trans	-77.8	111.9	161.8	4.2	14.8	0	0	0	106.9	S544 T548	S544-P546 WeakPolarHBondContact O-CD 3.3Å; P546-T548 HydrophobicContact CB-CG2 4.43Å; P546-T548 PolarHBondContact O-N 2.85Å
547	E	36.8	Very low	43.8	Very low	120 Å²	120	134 Å²	134	56%	0.561	71%	0.711	S	S	*	*			trans	-69.4	83.4	171.5	-165.8	-160.2	179.9	0	0	108.9	S453 I545 R549	S453-E547 VanDerWaalsContact CB-OE1 3.31Å; S453-E547 WeakPolarHBondContact CB-OE1 3.42Å; I545-E547 PolarHBondContact O-N 2.93Å; E547-R549 VanDerWaalsContact C-N 3.26Å; E547-R549 PolarHBondContact O-N 2.9Å
548	T	38.1	Very low	41.6	Very low	121 Å²	121	139.1 Å²	139.1	74%	0.742	73%	0.725	S	S	*	*			trans	-71.9	83.3	-179.1	42	0	0	0	0	110.6	P546 L550	P546-T548 HydrophobicContact CB-CG2 4.43Å; P546-T548 PolarHBondContact O-N 2.85Å; T548-L550 PolarHBondContact O-N 3.5Å; T548-L550 VanDerWaalsContact O-N 3.1Å
549	R	36.1	Very low	39.5	Very low	206 Å²	206	140 Å²	140	78%	0.777	73%	0.731	S	S	*	*			trans	-30.6	114	160	-101.5	174.9	162.8	163.6	-5.2	110.3	E547 R551	E547-R549 VanDerWaalsContact C-N 3.26Å; E547-R549 PolarHBondContact O-N 2.9Å; R549-R551 PolarHBondContact O-N 3.21Å
550	L	33.3	Very low	37.7	Very low	148 Å²	148	135.7 Å²	135.7	78%	0.775	73%	0.733	S	S	*	*			trans	-68.6	78.3	162	-71.7	174.2	0	0	0	108.1	M449 T548 A552	M449-L550 HydrophobicContact CE-CD1 4.3Å; T548-L550 PolarHBondContact O-N 3.5Å; T548-L550 VanDerWaalsContact O-N 3.1Å; L550-A552 PolarHBondContact O-N 3Å
551	R	32	Very low	36.7	Very low	169 Å²	169	137.2 Å²	137.2	64%	0.638	73%	0.734	S	S	*	*			trans	-78	92	-172.1	-164	173.5	-174.7	-168.7	-12.3	109.4	R549 E553	R549-R551 PolarHBondContact O-N 3.21Å; R551-E553 HydrophobicContact CG-CB 4.23Å; R551-E553 HydrophobicContact CG-CG 4.11Å; R551-E553 WeakPolarHBondContact CG-OE1 3.25Å; R551-E553 IonicContact CZ-OE1 2.71Å; R551-E553 IonicContact CZ-OE2 2.84Å; R551-E553 VanDerWaalsContact CZ-OE2 3.24Å; R551-E553 IonicContact NE-OE1 2.73Å; R551-E553 PolarHBondContact NE-OE1 2.88Å; R551-E553 IonicContact NE-OE2 3.15Å; R551-E553 PolarHBondContact NE-OE2 3.11Å; R551-E553 VanDerWaalsContact NH2-CD 3.33Å; R551-E553 IonicContact NH2-OE1 2.85Å; R551-E553 PolarHBondContact NH2-OE1 3.05Å; R551-E553 VanDerWaalsContact NH2-OE1 3.14Å; R551-E553 IonicContact NH2-OE2 3.88Å; R551-E553 PolarHBondContact NH2-OE2 3.48Å; R551-E553 PolarHBondContact O-N 2.83Å
552	A	30	Very low	36.1	Very low	98 Å²	98	142.1 Å²	142.1	81%	0.81	75%	0.747	S	S	*	*			trans	-70.7	65.9	176.9	0	0	0	0	0	111.9	L550	L550-A552 PolarHBondContact O-N 3Å
553	E	31.4	Very low	35.6	Very low	117 Å²	117	144.8 Å²	144.8	55%	0.547	75%	0.748	S	S	.	*			trans	-134.2	83.6	-179	-73.5	176.7	-134.1	0	0	110.6	R551	R551-E553 HydrophobicContact CG-CB 4.23Å; R551-E553 HydrophobicContact CG-CG 4.11Å; R551-E553 WeakPolarHBondContact CG-OE1 3.25Å; R551-E553 IonicContact CZ-OE1 2.71Å; R551-E553 IonicContact CZ-OE2 2.84Å; R551-E553 VanDerWaalsContact CZ-OE2 3.24Å; R551-E553 IonicContact NE-OE1 2.73Å; R551-E553 PolarHBondContact NE-OE1 2.88Å; R551-E553 IonicContact NE-OE2 3.15Å; R551-E553 PolarHBondContact NE-OE2 3.11Å; R551-E553 VanDerWaalsContact NH2-CD 3.33Å; R551-E553 IonicContact NH2-OE1 2.85Å; R551-E553 PolarHBondContact NH2-OE1 3.05Å; R551-E553 VanDerWaalsContact NH2-OE1 3.14Å; R551-E553 IonicContact NH2-OE2 3.88Å; R551-E553 PolarHBondContact NH2-OE2 3.48Å; R551-E553 PolarHBondContact O-N 2.83Å
554	N	34.1	Very low	35.4	Very low	175 Å²	175	145.8 Å²	145.8	94%	0.936	75%	0.754	S	S	*	*			trans	-177.2	41.3	145.3	-96.9	-21.2	0	0	0	113.1
555	I	33.7	Very low	34.7	Very low	145 Å²	145	144.3 Å²	144.3	74%	0.744	75%	0.754	S	S	*	*	S	Bend	trans	-112.7	140.8	160.5	-58.1	178.4	0	0	0	106.4
556	H	32.6	Very low	34.6	Very low	174 Å²	174	147.8 Å²	147.8	81%	0.806	77%	0.773	S	S	*	*	S	Bend	trans	74.1	76.8	-172.7	-42.3	-66	0	0	0	116.9
557	K	35.2	Very low	34.6	Very low	206 Å²	206	148.4 Å²	148.4	90%	0.896	78%	0.777	S	S	*	*				-177.5	86.1	126.9	-100	162.8	-176	177	0	113
558	M	31.1	Very low	35.2	Very low	177 Å²	177	148.5 Å²	148.5	87%	0.872	79%	0.788	S	S	*	*			trans	-122.6	162.2	147.2	-74.9	-66.8	-179.2	0	0	107.4
559	N	32	Very low	35.2	Very low	164 Å²	164	148.9 Å²	148.9	88%	0.877	79%	0.793	S	S	*	*			trans	62	85.2	177.1	-60.8	-19.9	0	0	0	117.3
560	S	35.7	Very low	35.1	Very low	122 Å²	122	143.7 Å²	143.7	85%	0.853	79%	0.794	S	S	*	*				-160.5	127.3	118.8	-165.6	0	0	0	0	110.9
561	S	32.7	Very low	35.3	Very low	97 Å²	97	141.2 Å²	141.2	68%	0.678	79%	0.789	S	S	*	*			trans	-84.5	156.6	169	-63.4	0	0	0	0	110.2
562	H	38	Very low	35.5	Very low	182 Å²	182	141.4 Å²	141.4	84%	0.843	80%	0.797	S	S	*	*				171.5	112.3	126.1	-85.1	-50.5	0	0	0	113
563	K	35.8	Very low	35.8	Very low	186 Å²	186	141.9 Å²	141.9	81%	0.809	79%	0.794	S	S	*	*			trans	53.2	139.7	132.4	-131.8	-180	-175.2	-179.4	0	121.4
564	L	36.1	Very low	36.5	Very low	160 Å²	160	142.4 Å²	142.4	84%	0.838	81%	0.808	S	S	*	*			trans	72.6	125.8	168.1	-46.6	175.5	0	0	0	115.1
565	G	30.4	Very low	36.5	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	80%	0.799	S	S	*	*			cis	112.9	83.5	-9.7	0	0	0	0	0	114.8
566	L	39.9	Very low	36.6	Very low	171 Å²	171	135.6 Å²	135.6	90%	0.895	80%	0.798	S	S	*	*			trans	-168.7	135.5	163.4	-104.3	155.2	0	0	0	108.7
567	P	41.8	Very low	36.7	Very low	109 Å²	109	133.7 Å²	133.7	71%	0.708	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-94.2	153.1	176.8	35.9	-33.2	0	0	0	112.8
568	P	49.7	Very low	36.9	Very low	122 Å²	122	133.6 Å²	133.6	79%	0.792	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-75.4	141.7	166.1	31.9	-32.9	0	0	0	111
569	P	38.6	Very low	37.1	Very low	129 Å²	129	135.9 Å²	135.9	84%	0.838	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-80.7	161.5	-178.7	33.3	-36	0	0	0	113.2
570	A	33	Very low	37.2	Very low	96 Å²	96	133 Å²	133	79%	0.793	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-87	152.8	177.8	0	0	0	0	0	113.2
571	S	37.2	Very low	37.1	Very low	96 Å²	96	130.5 Å²	130.5	67%	0.671	78%	0.778	S	S	*	*			trans	-150	104.3	164.1	63.3	0	0	0	0	112.8
572	H	37.3	Very low	37.4	Very low	173 Å²	173	133 Å²	133	80%	0.801	79%	0.79	S	S	*	*			trans	38	145.2	137.1	-25.3	-58	0	0	0	121
573	S	35.6	Very low	37.2	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	79%	0.789	S	S	*	*			cis	-168.7	164	-13.1	-103.3	0	0	0	0	109.6
574	P	45.4	Very low	37.3	Very low	128 Å²	128	128.3 Å²	128.3	83%	0.831	79%	0.785	S	S	*	*			trans	-109.7	174.4	-165.4	41.3	-35.7	0	0	0	115.7
575	G	33.8	Very low	37.1	Very low	73 Å²	73	128.6 Å²	128.6	75%	0.753	79%	0.786	S	S	*	*			trans	119.3	165	150.3	0	0	0	0	0	116.9
576	S	36.6	Very low	37.3	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	79%	0.793	S	S	*	*			cis	-169.4	157.1	-10.4	-152.8	0	0	0	0	111.8
577	L	35.6	Very low	37.1	Very low	134 Å²	134	127.6 Å²	127.6	70%	0.702	79%	0.789	S	S	*	*			trans	69.4	156.4	166.6	-51.9	170.8	0	0	0	115.2
578	R	38.8	Very low	36.9	Very low	203 Å²	203	131.3 Å²	131.3	77%	0.766	80%	0.797	S	S	*	*			cis	-157.6	144.5	9.1	-145.5	177.8	-100.6	-129.4	-1.5	113.1
579	R	36.1	Very low	36.2	Very low	226 Å²	226	135.8 Å²	135.8	85%	0.853	80%	0.798	S	S	*	*			trans	77.6	119.7	141.7	-129.8	-180	-163.4	179.8	3.1	122
580	A	32.5	Very low	36.2	Very low	103 Å²	103	135.7 Å²	135.7	85%	0.851	80%	0.795	S	S	*	*			trans	65.1	131.1	143.8	0	0	0	0	0	120.6
581	G	34.4	Very low	36.2	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	79%	0.79	S	S	*	*			trans	150.7	79.9	166	0	0	0	0	0	115.6
582	T	38.7	Very low	36.3	Very low	149 Å²	149	139.9 Å²	139.9	91%	0.914	80%	0.795	S	S	*	*			trans	64.2	152.6	149.2	-33.2	0	0	0	0	119.8
583	L	33.7	Very low	36	Very low	158 Å²	158	137.6 Å²	137.6	83%	0.827	79%	0.793	S	S	*	*			trans	-85.1	176.4	169.1	-68.3	169.9	0	0	0	109.7
584	P	38.5	Very low	36	Very low	112 Å²	112	136.8 Å²	136.8	73%	0.727	79%	0.788	S	S	*	*			cis	-141	177.4	12.5	45.2	-27.3	0	0	0	117.7
585	L	32.6	Very low	35.3	Very low	166 Å²	166	138.2 Å²	138.2	87%	0.869	79%	0.788	S	S	*	*			trans	45.4	106.8	137.6	-171.2	72.1	0	0	0	121
586	A	34.3	Very low	35.3	Very low	104 Å²	104	142.9 Å²	142.9	86%	0.86	80%	0.795	S	S	*	*			trans	-159.9	151.9	130.8	0	0	0	0	0	109.4
587	S	35.7	Very low	35	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	80%	0.797	S	S	*	*			trans	-117.1	119.5	-175.9	-172.1	0	0	0	0	112	R589	S587-R589 PolarHBondContact O-N 3.29Å
588	Q	37.4	Very low	35.2	Very low	188 Å²	188	142.1 Å²	142.1	88%	0.879	81%	0.806	S	S	*	*			trans	-81.2	114.8	177.4	-167.7	167.8	47.9	0	0	110.5
589	R	35	Very low	35.1	Very low	215 Å²	215	137.9 Å²	137.9	81%	0.811	81%	0.807	S	S	*	*			trans	-72.7	147.4	171.2	-73.6	-177	175.8	168.9	0.1	110.6	S587	S587-R589 PolarHBondContact O-N 3.29Å
590	V	38.8	Very low	35.2	Very low	127 Å²	127	133.9 Å²	133.9	77%	0.77	80%	0.802	S	S	*	*			trans	-118.5	110.9	162.7	176.9	0	0	0	0	106.7	I592	V590-I592 PolarHBondContact O-N 3.45Å
591	D	32.6	Very low	35.6	Very low	131 Å²	131	134.2 Å²	134.2	70%	0.701	80%	0.796	S	S	*	*			trans	-76.5	121.7	-177.1	-66	-54.8	0	0	0	111.5
592	I	38.3	Very low	35.6	Very low	149 Å²	149	138.2 Å²	138.2	76%	0.764	80%	0.799	S	S	*	*			trans	-115.5	90.6	167.5	-58.1	-179.9	0	0	0	107.2	V590 S594	V590-I592 PolarHBondContact O-N 3.45Å; I592-S594 PolarHBondContact O-N 2.97Å; I592-S594 VanDerWaalsContact O-N 3.12Å
593	T	31.4	Very low	35.2	Very low	126 Å²	126	138.3 Å²	138.3	77%	0.773	79%	0.794	S	S	*	*			trans	-81.2	87.8	-176.9	41.9	0	0	0	0	111.9
594	S	35.4	Very low	35	Very low	92 Å²	92	135 Å²	135	64%	0.643	78%	0.783	S	S	*	*			trans	-103.8	103.8	167.8	58.8	0	0	0	0	110.9	I592 L596	I592-S594 PolarHBondContact O-N 2.97Å; I592-S594 VanDerWaalsContact O-N 3.12Å; S594-L596 PolarHBondContact O-N 3.4Å
595	N	31.6	Very low	34.8	Very low	157 Å²	157	135.8 Å²	135.8	84%	0.84	79%	0.786	S	S	*	*			trans	-71.5	92.2	-174.7	-69.8	-16.6	0	0	0	112.7
596	L	32.5	Very low	34.8	Very low	172 Å²	172	134.2 Å²	134.2	90%	0.901	78%	0.778	S	S	*	*			trans	-127.6	84.6	167.9	-72.4	175.6	0	0	0	109.6	S594	S594-L596 PolarHBondContact O-N 3.4Å
597	G	30.7	Very low	34.7	Very low	74 Å²	74	136 Å²	136	76%	0.763	77%	0.774	S	S	*	*			trans	-167.7	86.8	-178.6	0	0	0	0	0	112.5
598	V	39.8	Very low	34.6	Very low	147 Å²	147	138.3 Å²	138.3	89%	0.891	77%	0.771	S	S	*	*			trans	-124.7	102.7	166.3	-179	0	0	0	0	108.5
599	S	36.9	Very low	34.4	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	77%	0.771	S	S	*	*			trans	-7	123.3	169.4	-47.8	0	0	0	0	118.4
600	L	39.1	Very low	34.3	Very low	143 Å²	143	130 Å²	130	75%	0.749	76%	0.761	S	S	*	*			trans	-60.6	138.7	154.4	-71.7	167.6	0	0	0	109.8	I602	L600-I602 PolarHBondContact O-N 2.86Å
601	P	39.6	Very low	33.9	Very low	110 Å²	110	135.8 Å²	135.8	71%	0.714	77%	0.769	S	S	*	*			trans	-74.2	110.9	171.3	29.8	-32	0	0	0	109.9	L603	P601-L603 PolarHBondContact O-N 3.14Å; P601-L603 VanDerWaalsContact O-N 3.13Å
602	I	34.5	Very low	34.1	Very low	153 Å²	153	135.6 Å²	135.6	79%	0.785	78%	0.778	S	S	*	*			trans	-66.6	111.5	166.3	-62.2	174.7	0	0	0	107.4	L600 S604	L600-I602 PolarHBondContact O-N 2.86Å; I602-S604 VanDerWaalsContact C-N 3.32Å; I602-S604 PolarHBondContact O-N 3.49Å
603	L	30.4	Very low	33.9	Very low	151 Å²	151	136.1 Å²	136.1	79%	0.791	78%	0.778	S	S	*	*			trans	-73.7	87.3	172.7	-70.1	176.6	0	0	0	109.5	P601 V605	P601-L603 PolarHBondContact O-N 3.14Å; P601-L603 VanDerWaalsContact O-N 3.13Å; L603-V605 PolarHBondContact O-N 2.91Å
604	S	30.8	Very low	34.1	Very low	87 Å²	87	136.3 Å²	136.3	61%	0.608	78%	0.784	S	S	*	*			trans	-65.4	92.4	170.7	-64.9	0	0	0	0	110.6	I602 N606	I602-S604 VanDerWaalsContact C-N 3.32Å; I602-S604 PolarHBondContact O-N 3.49Å; S604-N606 PolarHBondContact O-N 3.3Å
605	V	33.6	Very low	34.1	Very low	130 Å²	130	138.1 Å²	138.1	79%	0.788	79%	0.791	S	S	*	*			trans	-75.3	61.6	173.5	-168	0	0	0	0	109.9	L603 N607	L603-V605 PolarHBondContact O-N 2.91Å; V605-N607 PolarHBondContact O-N 2.68Å
606	N	32.9	Very low	34.3	Very low	133 Å²	133	138.9 Å²	138.9	71%	0.711	79%	0.792	S	S	*	*			trans	-78.1	70.6	-177.3	-73.6	17.1	0	0	0	111.1	S604 E608	S604-N606 PolarHBondContact O-N 3.3Å; N606-E608 PolarHBondContact O-N 2.92Å
607	N	31.4	Very low	34.5	Very low	142 Å²	142	137.2 Å²	137.2	76%	0.759	79%	0.789	S	S	*	*			trans	-88.3	51.1	176.3	-163.3	27.1	0	0	0	111.8	V605 I609	V605-N607 PolarHBondContact O-N 2.68Å; N607-I609 PolarHBondContact O-N 3.13Å
608	E	34.3	Very low	34.6	Very low	163 Å²	163	136.9 Å²	136.9	76%	0.762	79%	0.785	S	S	*	*			trans	-91.5	75.9	-169.9	-78.7	-67.3	156.7	0	0	112.7	N606	N606-E608 PolarHBondContact O-N 2.92Å
609	I	32.1	Very low	34.8	Very low	170 Å²	170	138 Å²	138	87%	0.872	78%	0.783	S	S	*	*			trans	-110.9	69.9	164.3	-53.6	-178.3	0	0	0	108.7	N607	N607-I609 PolarHBondContact O-N 3.13Å
610	G	33.7	Very low	34.9	Very low	59 Å²	59	138.8 Å²	138.8	61%	0.608	78%	0.777	S	S	*	*			trans	-147.8	98.1	-173.4	0	0	0	0	0	114.4	S612	G610-S612 PolarHBondContact O-N 2.81Å
611	R	31.4	Very low	34.8	Very low	249 Å²	249	138.6 Å²	138.6	94%	0.94	78%	0.777	S	S	*	*			trans	-65.2	131.2	170.2	-73.2	174	167	177.2	-5.1	111.3
612	S	35.4	Very low	34.8	Very low	127 Å²	127	138.5 Å²	138.5	89%	0.888	78%	0.779	S	S	*	*			trans	-160.6	149.1	136.1	-86.7	0	0	0	0	112.5	G610	G610-S612 PolarHBondContact O-N 2.81Å
613	Q	34.6	Very low	34.9	Very low	160 Å²	160	137 Å²	137	75%	0.748	78%	0.779	S	S	*	*			trans	-111.6	142.6	174.5	-67.1	170.1	-35.8	0	0	109
614	S	36.1	Very low	35.3	Very low	130 Å²	130	135.2 Å²	135.2	91%	0.909	78%	0.779	S	S	*	*			trans	-108	149.5	161.9	-69.8	0	0	0	0	110.1
615	T	35.1	Very low	35.8	Very low	129 Å²	129	141.8 Å²	141.8	79%	0.791	79%	0.791	S	S	*	*			trans	-122.1	144	-170.7	-59.8	0	0	0	0	110.2
616	M	34.9	Very low	36	Very low	173 Å²	173	145.7 Å²	145.7	85%	0.852	80%	0.797	S	S	*	*			trans	-110.3	155.2	160	-73.8	-127.5	-70.9	0	0	111.2
617	T	37.2	Very low	36.3	Very low	137 Å²	137	142.9 Å²	142.9	84%	0.84	80%	0.8	S	S	*	*			trans	-38	152	169.3	48.1	0	0	0	0	115.6
618	G	33.9	Very low	36.6	Very low	67 Å²	67	143.3 Å²	143.3	69%	0.691	81%	0.807	S	S	*	*			cis	159.9	-176	0.5	0	0	0	0	0	112.2
619	M	43.2	Very low	36.6	Very low	171 Å²	171	139.1 Å²	139.1	84%	0.842	81%	0.808	S	S	*	*			trans	90.8	98.7	166.2	-53.1	-141.7	87.3	0	0	121.7
620	I	38.2	Very low	36.8	Very low	131 Å²	131	141.6 Å²	141.6	67%	0.672	81%	0.813	S	S	*	*			trans	53.8	137.3	134.4	40.5	167.4	0	0	0	126.8
621	N	38.3	Very low	36.7	Very low	139 Å²	139	144.4 Å²	144.4	74%	0.743	82%	0.824	S	S	*	*			trans	72.1	144.9	149	-59.6	-13.7	0	0	0	119.4
622	S	38.2	Very low	36.7	Very low	107 Å²	107	141 Å²	141	75%	0.748	82%	0.818	S	S	*	*			cis	-159.2	168	-8.7	-98.3	0	0	0	0	111.5
623	P	38	Very low	36.7	Very low	123 Å²	123	140.1 Å²	140.1	80%	0.799	81%	0.808	S	S	*	*			trans	-119.9	158.9	-159.1	40.9	-31.8	0	0	0	118.6
624	S	37.9	Very low	37	Very low	113 Å²	113	142.2 Å²	142.2	79%	0.79	81%	0.814	S	S	*	*			trans	-166.7	141.2	151.8	-155	0	0	0	0	117.7
625	R	40.6	Very low	37.1	Very low	225 Å²	225	141.9 Å²	141.9	85%	0.849	81%	0.809	S	S	*	*			trans	50.1	95.7	152.1	-73.1	-178.9	177.4	-132.7	0.5	124.8
626	K	38.8	Very low	36.9	Very low	211 Å²	211	144.5 Å²	144.5	92%	0.917	81%	0.805	S	S	*	*				49.3	121	114.5	-66.8	-172.4	175.3	-172.7	0	123.5
627	G	38.6	Very low	36.7	Very low	75 Å²	75	143 Å²	143	77%	0.773	80%	0.799	S	S	*	*			trans	99.6	141.8	139.9	0	0	0	0	0	116.8
628	T	38.1	Very low	36.4	Very low	150 Å²	150	145.4 Å²	145.4	92%	0.92	80%	0.801	S	S	*	*			cis	-154.7	140.2	-6.6	45.4	0	0	0	0	110
629	G	34.3	Very low	36.4	Very low	76 Å²	76	153.9 Å²	153.9	78%	0.784	81%	0.812	S	S	*	*			trans	161.5	121.8	173.3	0	0	0	0	0	112.5
630	F	35.6	Very low	36.1	Very low	222 Å²	222	150.3 Å²	150.3	97%	0.974	80%	0.804	S	S	*	*			trans	-57.7	157.8	-162.8	-81	-97.7	0	0	0	117.7
631	S	31.8	Very low	35.6	Very low	118 Å²	118	149.3 Å²	149.3	83%	0.825	81%	0.808	S	S	*	*			trans	-91.6	145.6	-158.7	57.1	0	0	0	0	116.9
632	E	32.2	Very low	35.6	Very low	177 Å²	177	147.5 Å²	147.5	83%	0.827	80%	0.804	S	S	*	*			trans	-121.7	148.5	160.1	-155.4	176.9	-175.1	0	0	111.7
633	T	36	Very low	35.3	Very low	109 Å²	109	150.4 Å²	150.4	67%	0.669	81%	0.806	S	S	*	*			trans	37.1	102.6	163.3	46	0	0	0	0	122.8
634	K	40.9	Very low	35.1	Very low	203 Å²	203	151 Å²	151	88%	0.883	80%	0.802	S	S	*	*				54	170.9	119.7	-70.5	175	-179.9	170.6	0	120.4
635	P	37.6	Very low	34.7	Very low	123 Å²	123	153 Å²	153	80%	0.799	80%	0.799	S	S	*	*			cis	-113.6	-159.7	-3.8	33.2	-10.9	0	0	0	112.1
636	R	30.6	Very low	33.9	Very low	185 Å²	185	153.1 Å²	153.1	70%	0.698	80%	0.801	S	S	*	*			cis	-172.8	147.9	42.4	177.9	177.7	177	161.2	-0.6	112.7
637	L	30.9	Very low	33.6	Very low	140 Å²	140	148 Å²	148	73%	0.733	79%	0.787	S	S	*	*			trans	35.7	136.8	159.3	-60.8	174.4	0	0	0	121.1
638	Q	31.9	Very low	33.1	Very low	189 Å²	189	149.3 Å²	149.3	88%	0.883	78%	0.784	S	S	*	*				-162.8	160.2	73.7	-87.3	-178.2	-17.8	0	0	112.9
639	R	32.7	Very low	32.7	Very low	244 Å²	244	151.3 Å²	151.3	92%	0.921	78%	0.783	S	S	*	*			trans	-157.3	161.1	161.4	-148	177.6	-167.5	-92.3	1.8	111.6
640	S	36.3	Very low	32.4	Very low	97 Å²	97	156.4 Å²	156.4	68%	0.678	79%	0.786	S	S	*	*			trans	-123.9	147.7	-166.1	53.4	0	0	0	0	115.4
641	S	29.4	Very low	32.3	Very low	109 Å²	109	151.6 Å²	151.6	76%	0.762	78%	0.78	S	S	*	*				5.6	166.1	123	-82.3	0	0	0	0	121.4
642	P	37.8	Very low	32.2	Very low	101 Å²	101	151.9 Å²	151.9	66%	0.656	77%	0.773	S	S	*	*			cis	-147.8	-176.2	-14.2	35.5	-12.7	0	0	0	117.9
643	Q	32.3	Very low	32.1	Very low	169 Å²	169	152.6 Å²	152.6	79%	0.79	77%	0.774	S	S	*	*			trans	82.6	162.4	130.7	-106.5	-179.9	-27.5	0	0	126.2
644	L	32.4	Very low	31.8	Very low	136 Å²	136	150.4 Å²	150.4	71%	0.712	77%	0.773	S	S	*	*			trans	83.6	142.7	163.8	-51.9	-166.5	0	0	0	118.4
645	Q	29.9	Very low	31.7	Very low	154 Å²	154	146.1 Å²	146.1	72%	0.72	77%	0.768	S	S	*	*			cis	-161.9	150.8	-26.4	-176.2	167.7	-18.4	0	0	108.5	V647	Q645-V647 HydrophobicContact CG-CG2 4.29Å
646	Y	24.9	Very low	31.6	Very low	227 Å²	227	148.9 Å²	148.9	89%	0.89	77%	0.768	S	S	*	*			trans	-109.2	113.9	177.7	-139.8	-84.5	0	0	0	109.9
647	V	31.9	Very low	32	Very low	104 Å²	104	147 Å²	147	63%	0.63	77%	0.771	S	S	*	*			trans	-145.4	135.7	170.4	-179.2	0	0	0	0	108	Q645	Q645-V647 HydrophobicContact CG-CG2 4.29Å
648	S	27.3	Very low	32.4	Very low	102 Å²	102	146 Å²	146	71%	0.713	77%	0.77	S	S	*	*			trans	-103.4	135.1	167.7	-55.2	0	0	0	0	108.5
649	E	31.4	Very low	32.9	Very low	192 Å²	192	141.7 Å²	141.7	90%	0.897	76%	0.759	S	S	*	*			trans	-160.4	157.4	157.9	-117.5	156.1	-139	0	0	110.4
650	E	26.8	Very low	33	Very low	183 Å²	183	135.9 Å²	135.9	86%	0.855	75%	0.751	S	S	*	*			trans	-93.7	-172	-170.8	-55.6	-176.1	129.3	0	0	112.2
651	S	33.2	Very low	33.2	Very low	121 Å²	121	139.2 Å²	139.2	85%	0.846	76%	0.757	S	S	*	*			trans	76.6	160.6	167.6	86.1	0	0	0	0	117.6
652	N	29.6	Very low	33.8	Very low	125 Å²	125	138.2 Å²	138.2	67%	0.668	75%	0.749	S	S	*	*			cis	-162.7	144.9	-46.4	-160.4	-5.1	0	0	0	108.6
653	F	30.6	Very low	33.8	Very low	192 Å²	192	142 Å²	142	84%	0.842	76%	0.755	S	S	*	*			trans	58.8	154.1	-177.8	-58.2	-87.6	0	0	0	115.5
654	G	30.3	Very low	34.1	Very low	63 Å²	63	142.4 Å²	142.4	65%	0.649	76%	0.757	S	S	*	*			cis	131.4	136.9	1.3	0	0	0	0	0	111.6
655	S	37.4	Very low	34.2	Very low	113 Å²	113	143 Å²	143	79%	0.79	76%	0.761	S	S	*	*			trans	128.7	147.5	177.1	62.1	0	0	0	0	112.7
656	K	36.4	Very low	34.7	Very low	180 Å²	180	140.2 Å²	140.2	78%	0.783	76%	0.756	S	S	*	*			cis	-160.5	136.1	-5.3	-116.1	167.5	-179	176.1	0	111.2
657	L	38	Very low	35.1	Very low	146 Å²	146	134.9 Å²	134.9	76%	0.764	75%	0.747	S	S	*	*			trans	64.5	160.7	139.4	-64.5	171.3	0	0	0	119.6
658	T	40.5	Very low	35.1	Very low	118 Å²	118	136.2 Å²	136.2	72%	0.724	75%	0.75	S	S	*	*			cis	-158.9	175	9.3	-4.6	0	0	0	0	108.3
659	P	41.3	Very low	35.3	Very low	99 Å²	99	139.3 Å²	139.3	64%	0.643	75%	0.754	S	S	*	*			cis	-136.3	170.9	-18.1	40.1	-22.8	0	0	0	116.4
660	T	36.1	Very low	35.3	Very low	122 Å²	122	135 Å²	135	75%	0.748	75%	0.745	S	S	*	*			trans	51.3	121.8	146.8	48.9	0	0	0	0	122.4
661	M	40.6	Very low	35.7	Very low	167 Å²	167	135.2 Å²	135.2	82%	0.823	75%	0.746	S	S	*	*				93.6	155.7	51.7	-77.6	-85.1	97.5	0	0	113.9
662	P	40.5	Very low	35.5	Very low	89 Å²	89	136.5 Å²	136.5	58%	0.578	74%	0.742	S	S	*	*			cis	-143.1	173.3	-19.1	38.8	-20.3	0	0	0	117.7
663	K	38.3	Very low	35.7	Very low	180 Å²	180	139.7 Å²	139.7	78%	0.783	75%	0.753	S	S	*	*			trans	69.7	156.1	152.4	-73.3	161.9	-176.9	-179.6	0	118.3
664	Q	38.4	Very low	35.7	Very low	177 Å²	177	137.6 Å²	137.6	83%	0.827	75%	0.748	S	S	*	*			cis	-149.2	146.2	8.3	-141.7	152.4	-40.7	0	0	115.6
665	N	34	Very low	35.8	Very low	149 Å²	149	141 Å²	141	80%	0.797	76%	0.756	S	S	*	*			trans	-53.6	178.8	168.5	-103.1	16	0	0	0	117.2
666	P	41.2	Very low	35.4	Very low	96 Å²	96	139.4 Å²	139.4	62%	0.623	75%	0.745	S	S	*	*			cis	-149.7	-173.7	-44.7	43.8	-23.4	0	0	0	116.1
667	T	34.1	Very low	35.2	Very low	114 Å²	114	137.9 Å²	137.9	70%	0.699	74%	0.741	S	S	*	*			trans	14.4	134.3	148.4	54.8	0	0	0	0	123.6
668	N	31.3	Very low	35	Very low	132 Å²	132	137.9 Å²	137.9	71%	0.706	74%	0.735	S	S	*	*				174.9	153.4	95.5	-108.4	-2.1	0	0	0	115.9
669	E	32	Very low	34.5	Very low	167 Å²	167	141.6 Å²	141.6	78%	0.78	74%	0.737	S	S	*	*			trans	57.6	166.6	148.2	-68.4	174	132.5	0	0	122.1
670	S	31.6	Very low	34.3	Very low	101 Å²	101	142.4 Å²	142.4	71%	0.706	74%	0.742	S	S	*	*			cis	175.4	103.2	-47.6	-93.3	0	0	0	0	110.9
671	Q	33.9	Very low	34.1	Very low	189 Å²	189	142.3 Å²	142.3	88%	0.883	74%	0.742	S	S	*	*			trans	-175.2	131.5	158.8	-104.6	158.2	52.9	0	0	108.3
672	L	30.4	Very low	33.3	Very low	147 Å²	147	139.7 Å²	139.7	77%	0.77	74%	0.738	S	S	*	*			cis	85.7	91.4	41.3	-72.4	173.8	0	0	0	115.4
673	Q	34	Very low	32.7	Very low	193 Å²	193	142.9 Å²	142.9	90%	0.902	75%	0.75	S	S	*	*			trans	-176.5	160.5	142.2	-102.1	167.2	46.5	0	0	109.1
674	M	29	Very low	32.2	Very low	148 Å²	148	142.1 Å²	142.1	73%	0.729	75%	0.748	S	S	*	*				-177.7	167.5	-57.1	-107	-70.4	170.2	0	0	108
675	T	32.4	Very low	31.9	Very low	134 Å²	134	140.1 Å²	140.1	82%	0.822	74%	0.743	S	S	*	*			trans	73.5	150.9	169.4	84.7	0	0	0	0	115.8
676	S	30.2	Very low	31.6	Very low	79 Å²	79	139.4 Å²	139.4	55%	0.552	74%	0.74	S	S	*	*			cis	-178	135.2	-12.3	147.9	0	0	0	0	114.2
677	Q	32.5	Very low	31.2	Very low	149 Å²	149	141.7 Å²	141.7	70%	0.696	75%	0.747	S	S	*	*			trans	68.6	156.9	149.1	-66	175.3	71.2	0	0	118.2
678	K	33.2	Very low	31	Very low	146 Å²	146	142.7 Å²	142.7	64%	0.635	75%	0.748	S	S	*	*			cis	-166.9	140.2	-6.3	-116	174.2	179	156.7	0	112.4
679	Y	29.1	Very low	31.1	Very low	195 Å²	195	144.2 Å²	144.2	77%	0.765	76%	0.756	S	S	*	*			trans	42.6	179.4	146.9	-58.7	-48.3	0	0	0	121.9
680	P	38.2	Very low	30.9	Very low	116 Å²	116	139.3 Å²	139.3	75%	0.753	75%	0.75	S	S	*	*			cis	-107.9	161.1	-23.5	6.3	18.7	0	0	0	112
681	T	31.1	Very low	31	Very low	121 Å²	121	141.5 Å²	141.5	74%	0.742	75%	0.754	S	S	*	*				86.4	136.1	54.4	-46.2	0	0	0	0	114.6
682	C	24	Very low	30.8	Very low	112 Å²	112	139 Å²	139	76%	0.757	75%	0.747	S	S	*	*			trans	-66.7	162.9	-175.5	-33.4	0	0	0	0	114.3
683	L	29	Very low	31	Very low	155 Å²	155	138.9 Å²	138.9	81%	0.812	75%	0.747	S	S	*	*				175.8	133.2	125.5	-95	165.9	0	0	0	114.5
684	H	27.6	Very low	30.7	Very low	164 Å²	164	134.8 Å²	134.8	76%	0.759	74%	0.74	S	S	*	*			trans	36.4	155.7	138.6	-85.9	85.8	0	0	0	126
685	N	30.5	Very low	30.8	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	74%	0.744	S	S	*	*			trans	87.4	105.8	153.2	-83.4	-9.1	0	0	0	121.6
686	N	27.6	Very low	30.8	Very low	134 Å²	134	133.2 Å²	133.2	72%	0.717	74%	0.743	S	S	*	*				8.4	126.1	118.7	-59.7	-17.7	0	0	0	117.3
687	N	32.6	Very low	30.9	Very low	145 Å²	145	134.7 Å²	134.7	78%	0.775	75%	0.749	S	S	*	*				-170.4	156.2	96.9	-102.3	-47.4	0	0	0	116.2
688	N	30.8	Very low	31	Very low	134 Å²	134	135.8 Å²	135.8	72%	0.717	75%	0.754	S	S	*	*			trans	-32.1	167.7	170.3	-64.5	-48.4	0	0	0	121
689	N	32.5	Very low	30.9	Very low	165 Å²	165	137 Å²	137	88%	0.882	76%	0.762	S	S	*	*			trans	75.8	145.1	168.2	-58.2	-17.2	0	0	0	115.8
690	G	29.1	Very low	31.1	Very low	64 Å²	64	137.3 Å²	137.3	66%	0.66	77%	0.767	S	S	*	*			cis	130.5	145.6	-3.2	0	0	0	0	0	112.9
691	N	32.9	Very low	30.9	Very low	146 Å²	146	139.1 Å²	139.1	78%	0.781	77%	0.765	S	S	*	*			trans	74	103	-179.7	-59.1	-23.9	0	0	0	117.7
692	N	29.8	Very low	30.9	Very low	137 Å²	137	140.5 Å²	140.5	73%	0.733	77%	0.774	S	S	*	*				57.2	148.7	110.4	-53.2	-9.1	0	0	0	122.4
693	N	34.1	Very low	31.2	Very low	145 Å²	145	140.9 Å²	140.9	78%	0.775	77%	0.767	S	S	*	*			trans	89.1	94.2	155.7	-57.6	-19.5	0	0	0	119.7
694	S	28.5	Very low	31.3	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	76%	0.764	S	S	*	*				42.3	102.7	118.7	-50.6	0	0	0	0	120.9
695	S	32.1	Very low	31.5	Very low	117 Å²	117	138 Å²	138	82%	0.818	77%	0.767	S	S	*	*			trans	-168.4	107.3	138.8	-77.3	0	0	0	0	106.6
696	T	30.7	Very low	31.3	Very low	131 Å²	131	137.1 Å²	137.1	80%	0.804	77%	0.771	S	S	*	*				71.1	139.3	66.2	-46.2	0	0	0	0	113.2
697	V	32.3	Very low	31.7	Very low	111 Å²	111	136.7 Å²	136.7	67%	0.673	78%	0.776	S	S	*	*			trans	92.7	103.8	169.3	-167.5	0	0	0	0	117.9
698	Q	34.6	Very low	31.5	Very low	171 Å²	171	138.6 Å²	138.6	80%	0.799	78%	0.78	S	S	*	*			trans	66	159.5	147.2	-66.5	167.1	11.7	0	0	120.5
699	Q	31.6	Very low	31.5	Very low	173 Å²	173	139.4 Å²	139.4	81%	0.808	78%	0.783	S	S	*	*			cis	-174.7	128.1	-31	175.6	177.2	26.1	0	0	109.1
700	K	34.6	Very low	31.3	Very low	200 Å²	200	139.9 Å²	139.9	87%	0.87	78%	0.779	S	S	*	*			trans	172.6	143.2	134.1	-166.7	159.7	-174.7	176.6	0	109.7
701	Q	32	Very low	31.1	Very low	154 Å²	154	147 Å²	147	72%	0.72	79%	0.792	S	S	*	*			trans	-111.6	159.3	-173.4	-59.9	157.8	-56	0	0	112.1	I703	Q701-I703 HydrophobicContact CB-CD1 4.17Å; Q701-I703 HydrophobicContact CB-CG1 3.98Å; Q701-I703 HydrophobicContact CG-CD1 4.49Å
702	T	31.8	Very low	31.2	Very low	150 Å²	150	145.8 Å²	145.8	92%	0.92	80%	0.795	S	S	*	*			trans	-131.2	130.3	147.6	42.5	0	0	0	0	107.7
703	I	29.7	Very low	31.2	Very low	121 Å²	121	147.4 Å²	147.4	62%	0.621	80%	0.798	S	S	*	*			trans	-128.9	136.6	-166.1	-60.3	167.1	0	0	0	109.9	Q701	Q701-I703 HydrophobicContact CB-CD1 4.17Å; Q701-I703 HydrophobicContact CB-CG1 3.98Å; Q701-I703 HydrophobicContact CG-CD1 4.49Å
704	S	32.4	Very low	31.2	Very low	107 Å²	107	146 Å²	146	75%	0.748	79%	0.79	S	S	*	*			trans	-175.8	136.3	143.6	55.4	0	0	0	0	111.1
705	N	30.5	Very low	31.6	Very low	151 Å²	151	147 Å²	147	81%	0.807	78%	0.783	S	S	*	*			cis	-154.7	131.2	-14.9	-93.8	-29.9	0	0	0	107.3
706	S	28.2	Very low	31.5	Very low	116 Å²	116	151.7 Å²	151.7	81%	0.811	78%	0.783	S	S	*	*			trans	-155.5	118.4	169	-168.9	0	0	0	0	109.4
707	P	34.1	Very low	31.6	Very low	126 Å²	126	151.9 Å²	151.9	82%	0.818	78%	0.784	S	S	*	*			trans	-93	105	-175.4	33.7	-31.1	0	0	0	112.3
708	E	29.3	Very low	31.4	Very low	184 Å²	184	152 Å²	152	86%	0.86	78%	0.784	S	S	*	*			trans	-116.7	123.6	163.3	-173.7	167.7	-140.5	0	0	107.8
709	I	30.2	Very low	31.5	Very low	152 Å²	152	150.1 Å²	150.1	78%	0.779	79%	0.785	S	S	*	*			trans	-129.6	127	-175.5	-62.2	-178	0	0	0	109.3
710	H	28.7	Very low	31.4	Very low	175 Å²	175	151.3 Å²	151.3	81%	0.81	79%	0.788	S	S	*	*			trans	-70	144.8	179.7	-83.6	-114.7	0	0	0	112.8
711	F	24.1	Very low	31.3	Very low	212 Å²	212	145.4 Å²	145.4	93%	0.93	78%	0.784	S	S	*	*			trans	-73.6	135.4	157.9	-76.6	-94.1	0	0	0	110.2
712	S	35.9	Very low	31.6	Very low	121 Å²	121	144 Å²	144	85%	0.846	79%	0.786	S	S	*	*			trans	-135.9	145.4	163.5	60.8	0	0	0	0	109.8
713	H	28.8	Very low	31.7	Very low	172 Å²	172	146.2 Å²	146.2	80%	0.796	78%	0.783	S	S	*	*			trans	-109.5	105.6	-166.4	168	99.6	0	0	0	109.1
714	D	34.8	Very low	32.3	Very low	114 Å²	114	145.7 Å²	145.7	61%	0.61	79%	0.787	S	S	*	*				-172.7	151.8	124.8	-120.6	-32.6	0	0	0	117.9
715	Q	36.3	Very low	32.2	Very low	129 Å²	129	147.6 Å²	147.6	60%	0.603	79%	0.789	S	S	*	*			trans	30.7	113.4	148.5	-75.8	166.1	84.1	0	0	125.5
716	R	31	Very low	32.4	Very low	216 Å²	216	145.3 Å²	145.3	82%	0.815	78%	0.781	S	S	*	*				80.1	148.2	119.1	-64.7	172.1	-172.3	-132.3	1.4	122.3
717	V	33.7	Very low	32.7	Very low	135 Å²	135	145.2 Å²	145.2	82%	0.818	78%	0.775	S	S	*	*			trans	87.1	133.1	169	-170.7	0	0	0	0	116.5
718	V	27.1	Very low	32.6	Very low	112 Å²	112	145.8 Å²	145.8	68%	0.679	77%	0.772	S	S	*	*			trans	-129.7	137.8	-179.5	173.3	0	0	0	0	108.8	F720	V718-F720 HydrophobicContact CG1-CD2 3.77Å; V718-F720 HydrophobicContact CG1-CE2 3.57Å; V718-F720 HydrophobicContact CG1-CZ 4.49Å
719	T	37.7	Very low	32.8	Very low	133 Å²	133	142 Å²	142	82%	0.816	76%	0.761	S	S	*	*			trans	-142.7	123.9	165.9	53.5	0	0	0	0	110.3
720	F	28	Very low	32.9	Very low	197 Å²	197	141 Å²	141	86%	0.864	76%	0.762	S	S	*	*			trans	-103.6	139.8	172.2	-73.5	-81.3	0	0	0	110.9	V718	V718-F720 HydrophobicContact CG1-CD2 3.77Å; V718-F720 HydrophobicContact CG1-CE2 3.57Å; V718-F720 HydrophobicContact CG1-CZ 4.49Å
721	G	33.8	Very low	33.2	Very low	77 Å²	77	137.8 Å²	137.8	79%	0.794	76%	0.759	S	S	*	*			trans	-134.6	136.9	170.6	0	0	0	0	0	109.9
722	T	36.5	Very low	33.5	Very low	123 Å²	123	134.8 Å²	134.8	76%	0.755	75%	0.753	S	S	*	*			trans	-128.6	143.5	-172.4	54.3	0	0	0	0	111.9
723	K	35.1	Very low	33.4	Very low	198 Å²	198	137.1 Å²	137.1	86%	0.861	76%	0.755	S	S	*	*				178.5	160.2	107.7	-95.7	174.5	-178.4	-179.9	0	113.4
724	P	41.2	Very low	33.5	Very low	109 Å²	109	133.6 Å²	133.6	71%	0.708	75%	0.75	S	S	*	*			trans	-109.1	170.7	-176.1	41.9	-34.5	0	0	0	113.7
725	N	31.4	Very low	33.3	Very low	148 Å²	148	135 Å²	135	79%	0.791	76%	0.763	S	S	*	*			trans	167.6	159.3	147.6	-93.9	-12.8	0	0	0	110.1
726	T	35	Very low	33.1	Very low	103 Å²	103	134.6 Å²	134.6	63%	0.632	77%	0.768	S	S	*	*			cis	-158.2	147.5	4.8	8.1	0	0	0	0	112.2
727	T	34.6	Very low	33.3	Very low	114 Å²	114	130.1 Å²	130.1	70%	0.699	77%	0.767	S	S	*	*			trans	65.7	142.9	140.5	59.6	0	0	0	0	124.8
728	N	31.9	Very low	33.3	Very low	138 Å²	138	128.3 Å²	128.3	74%	0.738	76%	0.761	S	S	*	*			trans	105.2	138.5	138.9	-72.4	-26.4	0	0	0	120.7
729	T	32.3	Very low	33.5	Very low	103 Å²	103	127.3 Å²	127.3	63%	0.632	76%	0.758	S	S	*	*			cis	-174.5	149.9	-26	-111.3	0	0	0	0	111.5
730	T	32.5	Very low	33.5	Very low	132 Å²	132	129.7 Å²	129.7	81%	0.81	76%	0.76	S	S	*	*			trans	62.2	156.3	168.4	39.9	0	0	0	0	119.6
731	S	36.6	Very low	33.7	Very low	107 Å²	107	127.5 Å²	127.5	75%	0.748	76%	0.758	S	S	*	*			cis	-156.1	148.3	-6	39.7	0	0	0	0	114
732	N	30.2	Very low	33.7	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	76%	0.757	S	S	*	*			trans	-52.1	156.1	178.6	-48.5	-31.7	0	0	0	118.3
733	L	32.7	Very low	33.7	Very low	169 Å²	169	133.1 Å²	133.1	89%	0.885	76%	0.759	S	S	*	*			trans	179.8	70.1	142.8	-100.6	157.3	0	0	0	109.9
734	S	30.6	Very low	33.7	Very low	98 Å²	98	135.5 Å²	135.5	69%	0.685	76%	0.763	S	S	*	*				68.3	86.1	76.9	79.6	0	0	0	0	116.8
735	V	32.3	Very low	33.2	Very low	145 Å²	145	137.4 Å²	137.4	88%	0.879	77%	0.767	S	S	*	*			trans	-137.4	136.4	146.6	-179.5	0	0	0	0	109.5
736	V	32.1	Very low	33.3	Very low	120 Å²	120	133.1 Å²	133.1	73%	0.727	75%	0.749	S	S	*	*			trans	-49.7	143.1	-175.1	178.9	0	0	0	0	115.5
737	P	33.8	Very low	33.2	Very low	122 Å²	122	137.3 Å²	137.3	79%	0.792	76%	0.761	S	S	*	*				-122.5	136.3	124.3	35.4	-31.1	0	0	0	113.2
738	S	34.4	Very low	33.4	Very low	97 Å²	97	137.6 Å²	137.6	68%	0.678	76%	0.763	S	S	*	*			trans	-83.5	132	162.8	-76.3	0	0	0	0	108.2
739	S	30.9	Very low	33.8	Very low	90 Å²	90	136.4 Å²	136.4	63%	0.629	75%	0.753	S	S	*	*				72.7	124.5	61.3	78.9	0	0	0	0	112.4
740	E	37.8	Very low	34.2	Very low	184 Å²	184	137 Å²	137	86%	0.86	75%	0.752	S	S	*	*			trans	105	90.5	-147.9	-73	162.2	-147.1	0	0	107.8
741	D	31.5	Very low	34.6	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	75%	0.752	S	S	*	*			cis	73.3	159.5	48.5	-55.9	-51.7	0	0	0	113.5
742	D	35.7	Very low	34.8	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	75%	0.747	S	S	*	*			trans	68	108	-168.5	-52.4	-13.1	0	0	0	114.6
743	E	35.9	Very low	35.4	Very low	173 Å²	173	136.5 Å²	136.5	81%	0.808	73%	0.734	S	S	*	*				77.1	89.9	53.5	-166.7	176	-163.6	0	0	113.8
744	W	35.2	Very low	35.7	Very low	248 Å²	248	132.8 Å²	132.8	94%	0.939	72%	0.719	S	S	*	*			trans	-147.8	91.5	157.6	-84.4	94.1	0	0	0	110.8
745	D	30.8	Very low	36.1	Very low	149 Å²	149	130.5 Å²	130.5	80%	0.797	71%	0.706	S	S	*	*			trans	-80	-171.8	155.8	-99.1	-50.3	0	0	0	110.1
746	S	33	Very low	36.7	Very low	58 Å²	58	125.8 Å²	125.8	41%	0.406	68%	0.682	S	S	.	*			trans	70.4	84.6	167.1	-71.8	0	0	0	0	119.5	E749	S746-E749 VanDerWaalsContact CB-OE2 3.28Å; S746-E749 WeakPolarHBondContact CB-OE2 3.42Å; S746-E749 PolarHBondContact OG-OE2 3.17Å
747	E	32.7	Very low	37.1	Very low	190 Å²	190	124.5 Å²	124.5	89%	0.888	67%	0.668	S	S	*	*	S	Bend	trans	-101.3	20.5	141.2	-83.3	-159.8	160.8	0	0	111.7
748	T	39.2	Very low	37.6	Very low	120 Å²	120	123.5 Å²	123.5	74%	0.736	66%	0.655	S	S	*	*	S	Bend	trans	-107.3	-1.8	-177.8	38.9	0	0	0	0	115.3
749	E	40.4	Very low	38	Very low	113 Å²	113	124.6 Å²	124.6	53%	0.528	65%	0.653	S	S	.	*	S	Bend	trans	-104.1	-22.8	-173.9	-65.3	-174.9	104	0	0	114.3	S746 L751 N752 I753	S746-E749 VanDerWaalsContact CB-OE2 3.28Å; S746-E749 WeakPolarHBondContact CB-OE2 3.42Å; S746-E749 PolarHBondContact OG-OE2 3.17Å; E749-L751 PolarHBondContact O-N 2.64Å; E749-L751 VanDerWaalsContact O-N 3.11Å; E749-N752 PolarHBondContact O-N 2.99Å; E749-I753 PolarHBondContact O-N 2.88Å; E749-I753 VanDerWaalsContact O-N 3.13Å
750	D	40.5	Very low	38.6	Very low	115 Å²	115	126.2 Å²	126.2	62%	0.615	65%	0.649	S	S	*	*	H	α-helix	trans	-56.6	-30.8	-178.4	-79.9	-15.1	0	0	0	114.3	V754	D750-V754 WeakPolarHBondContact O-CG2 3.4Å; D750-V754 PolarHBondContact O-N 3.31Å
751	L	39.9	Very low	38.8	Very low	152 Å²	152	121.8 Å²	121.8	80%	0.796	64%	0.638	S	S	*	*	H	α-helix	trans	-78	-26.4	178	-68.5	175.2	0	0	0	113.2	E749	E749-L751 PolarHBondContact O-N 2.64Å; E749-L751 VanDerWaalsContact O-N 3.11Å
752	N	42.3	Very low	39.1	Very low	124 Å²	124	122 Å²	122	66%	0.663	64%	0.635	S	S	*	*	H	α-helix	trans	-82	-33.7	175.4	-89.5	-11.6	0	0	0	112.2	E749 A755 A756	E749-N752 PolarHBondContact O-N 2.99Å; N752-A755 PolarHBondContact O-N 3.09Å; N752-A756 WeakPolarHBondContact O-CB 3.27Å; N752-A756 PolarHBondContact O-N 3.25Å
753	I	41.4	Very low	39.2	Very low	103 Å²	103	123.4 Å²	123.4	53%	0.528	64%	0.637	S	S	.	*	H	α-helix	trans	-65.5	-43.3	178.8	-65.5	169.8	0	0	0	110.6	E749 A755 A756 E757	E749-I753 PolarHBondContact O-N 2.88Å; E749-I753 VanDerWaalsContact O-N 3.13Å; I753-A755 PolarHBondContact O-N 3.33Å; I753-A756 PolarHBondContact O-N 2.94Å; I753-E757 PolarHBondContact O-N 3.33Å
754	V	39.7	Very low	39	Very low	91 Å²	91	122.8 Å²	122.8	55%	0.552	64%	0.638	S	S	*	*	H	α-helix	trans	-64.4	-38.9	176.1	177.1	0	0	0	0	111.9	D750 I758	D750-V754 WeakPolarHBondContact O-CG2 3.4Å; D750-V754 PolarHBondContact O-N 3.31Å; V754-I758 HydrophobicContact CG1-CD1 4.04Å; V754-I758 WeakPolarHBondContact O-CG1 3.3Å; V754-I758 PolarHBondContact O-N 2.92Å
755	A	39.6	Very low	38.9	Very low	50 Å²	50	117.1 Å²	117.1	41%	0.413	63%	0.631	S	S	.	*	H	α-helix	trans	-67.3	-33.2	175.9	0	0	0	0	0	113.2	N752 I753 N759	N752-A755 PolarHBondContact O-N 3.09Å; I753-A755 PolarHBondContact O-N 3.33Å; A755-N759 PolarHBondContact O-ND2 3.26Å
756	A	43.4	Very low	39.1	Very low	46 Å²	46	115.8 Å²	115.8	38%	0.38	63%	0.633	S	S	.	*	H	α-helix	trans	-72.7	-40.9	175.9	0	0	0	0	0	112.6	N752 I753 N759 K760	N752-A756 WeakPolarHBondContact O-CB 3.27Å; N752-A756 PolarHBondContact O-N 3.25Å; I753-A756 PolarHBondContact O-N 2.94Å; A756-N759 PolarHBondContact O-N 3.48Å; A756-K760 PolarHBondContact O-N 2.66Å
757	E	42.3	Very low	39	Very low	93 Å²	93	116.6 Å²	116.6	44%	0.435	65%	0.65	S	S	.	*	H	α-helix	trans	-74.5	-30.9	-173.9	-145.9	60.9	-160.8	0	0	112.8	I753 N759 K760 S761	I753-E757 PolarHBondContact O-N 3.33Å; E757-N759 VanDerWaalsContact C-N 3.29Å; E757-N759 PolarHBondContact O-N 2.88Å; E757-K760 PolarHBondContact O-N 3.1Å; E757-K760 IonicContact OE1-NZ 2.92Å; E757-K760 WeakPolarHBondContact OE2-CD 3.48Å; E757-K760 IonicContact OE2-NZ 3.2Å; E757-K760 PolarHBondContact OE2-NZ 3.31Å; E757-S761 WeakPolarHBondContact O-CB 3.29Å; E757-S761 PolarHBondContact O-N 3.46Å; E757-S761 VanDerWaalsContact O-N 3.15Å; E757-S761 PolarHBondContact O-OG 3Å
758	I	42.3	Very low	39	Very low	101 Å²	101	113.7 Å²	113.7	52%	0.518	65%	0.651	S	S	.	*	H	α-helix	trans	-64	-34.5	171.2	-68.6	169.9	0	0	0	111.4	V754	V754-I758 HydrophobicContact CG1-CD1 4.04Å; V754-I758 WeakPolarHBondContact O-CG1 3.3Å; V754-I758 PolarHBondContact O-N 2.92Å
759	N	43.7	Very low	38.7	Very low	121 Å²	121	112.3 Å²	112.3	65%	0.647	65%	0.646	S	S	*	*	H	α-helix	trans	-78.6	-33.6	177.2	-84.4	-67.9	0	0	0	113.6	A755 A756 E757 S761	A755-N759 PolarHBondContact O-ND2 3.26Å; A756-N759 PolarHBondContact O-N 3.48Å; E757-N759 VanDerWaalsContact C-N 3.29Å; E757-N759 PolarHBondContact O-N 2.88Å; N759-S761 VanDerWaalsContact C-N 3.29Å; N759-S761 PolarHBondContact O-N 2.88Å
760	K	43.8	Very low	38.5	Very low	123 Å²	123	113.6 Å²	113.6	54%	0.535	66%	0.657	S	S	.	*	H	α-helix	trans	-64.7	-34	171.2	-73.5	-177.7	-163.4	150.2	0	112.8	A756 E757 Q762	A756-K760 PolarHBondContact O-N 2.66Å; E757-K760 PolarHBondContact O-N 3.1Å; E757-K760 IonicContact OE1-NZ 2.92Å; E757-K760 WeakPolarHBondContact OE2-CD 3.48Å; E757-K760 IonicContact OE2-NZ 3.2Å; E757-K760 PolarHBondContact OE2-NZ 3.31Å; K760-Q762 PolarHBondContact O-N 3.13Å; K760-Q762 VanDerWaalsContact O-N 3.07Å
761	S	40.9	Very low	38.1	Very low	91 Å²	91	117.6 Å²	117.6	64%	0.636	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-1.4	-171	-62.2	0	0	0	0	115.3	E757 N759	E757-S761 WeakPolarHBondContact O-CB 3.29Å; E757-S761 PolarHBondContact O-N 3.46Å; E757-S761 VanDerWaalsContact O-N 3.15Å; E757-S761 PolarHBondContact O-OG 3Å; N759-S761 VanDerWaalsContact C-N 3.29Å; N759-S761 PolarHBondContact O-N 2.88Å
762	Q	39.4	Very low	37.7	Very low	156 Å²	156	115.6 Å²	115.6	73%	0.729	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	-1	-177.3	-62.6	-168.9	43.4	0	0	115.3	K760	K760-Q762 PolarHBondContact O-N 3.13Å; K760-Q762 VanDerWaalsContact O-N 3.07Å
763	Q	36	Very low	37.3	Very low	175 Å²	175	116.1 Å²	116.1	82%	0.818	67%	0.672	S	S	*	*			trans	-133.9	56.6	-178.8	-70.6	-170.5	72	0	0	113.7
764	L	31.9	Very low	36.8	Very low	160 Å²	160	118.3 Å²	118.3	84%	0.838	69%	0.685	S	S	*	*			trans	-132.3	50.1	173.6	-77.1	176.9	0	0	0	113.6
765	T	34.4	Very low	36.6	Very low	129 Å²	129	119 Å²	119	79%	0.791	69%	0.692	S	S	*	*	S	Bend	trans	-138.6	153.6	165.2	53.7	0	0	0	0	112
766	S	35	Very low	36.3	Very low	121 Å²	121	124.7 Å²	124.7	85%	0.846	71%	0.714	S	S	*	*			trans	51.9	85	175.9	54.1	0	0	0	0	117.1
767	G	30.7	Very low	35.9	Very low	74 Å²	74	130.8 Å²	130.8	76%	0.763	73%	0.732	S	S	*	*			trans	-101.1	170.6	161.5	0	0	0	0	0	113.4
768	S	32.4	Very low	35.5	Very low	130 Å²	130	132.3 Å²	132.3	91%	0.909	75%	0.75	S	S	*	*			trans	89	151.9	163.6	-156.9	0	0	0	0	120
769	S	33.5	Very low	35	Very low	90 Å²	90	134.3 Å²	134.3	63%	0.629	76%	0.76	S	S	*	*			trans	84.7	88.4	156.1	-171.9	0	0	0	0	121.4
770	N	34.5	Very low	34.6	Very low	140 Å²	140	134.5 Å²	134.5	75%	0.749	77%	0.766	S	S	*	*				80.6	110.7	122.4	-67.4	-53	0	0	0	123.3
771	K	32.3	Very low	34.1	Very low	200 Å²	200	132.6 Å²	132.6	87%	0.87	77%	0.768	S	S	*	*			trans	72.9	162.5	133.9	-84	-162.1	170.5	-178.6	0	119.7
772	P	32.4	Very low	33.8	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	77%	0.773	S	S	*	*			trans	-122.2	-166.3	-153.1	44.5	-31.9	0	0	0	114.1
773	T	33.5	Very low	33.5	Very low	134 Å²	134	138.7 Å²	138.7	82%	0.822	77%	0.773	S	S	*	*			trans	110.9	127.6	159.9	-34.2	0	0	0	0	114.7
774	N	31.7	Very low	33.5	Very low	149 Å²	149	138.5 Å²	138.5	80%	0.797	77%	0.77	S	S	*	*			trans	-49.9	161.7	164	-82.2	-47.8	0	0	0	112.1
775	P	35.6	Very low	33.6	Very low	107 Å²	107	135.1 Å²	135.1	70%	0.695	76%	0.76	S	S	*	*			cis	-155.6	-164	44.8	37.6	-12.1	0	0	0	118.3
776	L	33.3	Very low	33.4	Very low	168 Å²	168	135.8 Å²	135.8	88%	0.88	76%	0.759	S	S	*	*			trans	99.4	143.3	155	-66.2	157.3	0	0	0	120.1
777	K	34.3	Very low	33.3	Very low	175 Å²	175	137 Å²	137	76%	0.761	76%	0.755	S	S	*	*			trans	-120.5	162.6	176.2	-63.4	179.5	178.3	179.1	0	109.8	I779	K777-I779 HydrophobicContact CB-CG1 4.36Å
778	P	33.8	Very low	33.2	Very low	125 Å²	125	138.8 Å²	138.8	81%	0.812	76%	0.756	S	S	*	*				-130.4	144.8	118.3	35.1	-26.5	0	0	0	110.6
779	I	32.9	Very low	33.2	Very low	142 Å²	142	139.1 Å²	139.1	73%	0.728	75%	0.746	S	S	*	*			cis	76.8	92.1	32.6	-52.4	-178.3	0	0	0	115.2	K777	K777-I779 HydrophobicContact CB-CG1 4.36Å
780	T	35	Very low	33.1	Very low	125 Å²	125	140.9 Å²	140.9	77%	0.767	75%	0.749	S	S	*	*			trans	-165.1	123.9	134	33.2	0	0	0	0	106.2
781	S	33.4	Very low	32.7	Very low	83 Å²	83	141 Å²	141	58%	0.58	75%	0.75	S	S	*	*				60.3	133.5	68.4	69.5	0	0	0	0	113.5
782	Y	33.7	Very low	32.9	Very low	187 Å²	187	137 Å²	137	73%	0.733	75%	0.746	S	S	*	*			cis	-149.9	143.9	37	-90.4	-105.1	0	0	0	114.9
783	Y	33.8	Very low	32.9	Very low	189 Å²	189	136.2 Å²	136.2	74%	0.741	74%	0.744	S	S	*	*			trans	53.9	151.6	134.2	-69.6	-129.3	0	0	0	120
784	K	36.2	Very low	32.8	Very low	170 Å²	170	136.6 Å²	136.6	74%	0.739	74%	0.739	S	S	*	*			cis	-162.9	147.8	14.2	-139.2	169.4	-179.2	175.6	0	112.7
785	S	32.5	Very low	33	Very low	90 Å²	90	137.3 Å²	137.3	63%	0.629	74%	0.738	S	S	*	*			trans	35.7	156.1	138.4	64.1	0	0	0	0	123.9
786	N	30.3	Very low	33.1	Very low	143 Å²	143	138.7 Å²	138.7	77%	0.765	74%	0.735	S	S	*	*			cis	178.4	176.3	-28.5	-102.7	6.2	0	0	0	108
787	N	33.5	Very low	33.2	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	73%	0.728	S	S	*	*			trans	77.2	125.7	174	-50.2	-14.3	0	0	0	114.3
788	S	28	Very low	33.4	Very low	112 Å²	112	136.3 Å²	136.3	78%	0.783	72%	0.724	S	S	*	*			cis	84.2	154.7	18.7	-155.5	0	0	0	0	116.6
789	I	32.9	Very low	33.5	Very low	136 Å²	136	136.9 Å²	136.9	70%	0.697	72%	0.72	S	S	*	*			trans	97.4	95.4	168.6	-56.5	178.3	0	0	0	118.1
790	N	30.8	Very low	33.5	Very low	128 Å²	128	135.3 Å²	135.3	68%	0.684	72%	0.721	S	S	*	*				64.6	122.7	126.9	-57.7	-3.1	0	0	0	124.8
791	N	27.2	Very low	33.7	Very low	143 Å²	143	134.5 Å²	134.5	77%	0.765	72%	0.718	S	S	*	*				44	130.5	118.1	-49.1	-13.9	0	0	0	122.2
792	S	35.4	Very low	33.9	Very low	114 Å²	114	139.2 Å²	139.2	80%	0.797	73%	0.731	S	S	*	*				147.4	154.8	129.1	-69.4	0	0	0	0	111.5
793	S	32.4	Very low	33.9	Very low	95 Å²	95	133.5 Å²	133.5	66%	0.664	73%	0.729	S	S	*	*			cis	-171.8	138.3	-26.8	-95.7	0	0	0	0	109.5
794	I	31.7	Very low	33.9	Very low	141 Å²	141	131.3 Å²	131.3	72%	0.723	74%	0.735	S	S	*	*			trans	52.4	103.4	138.8	-54.5	162.3	0	0	0	119.1
795	Q	36.8	Very low	33.5	Very low	164 Å²	164	132 Å²	132	77%	0.766	74%	0.738	S	S	*	*				-169.3	131.2	116.5	-108.2	158.9	106.4	0	0	114.3
796	Q	36.7	Very low	33.3	Very low	137 Å²	137	136.8 Å²	136.8	64%	0.64	75%	0.748	S	S	*	*				32.8	127.4	125.4	-59.8	-175.6	41.3	0	0	117.8
797	K	36.5	Very low	33.4	Very low	167 Å²	167	134.7 Å²	134.7	73%	0.726	74%	0.74	S	S	*	*			cis	-156.6	-179.2	17.4	-103.6	152	177.6	150.4	0	108.1
798	N	36.8	Very low	33.1	Very low	126 Å²	126	132.5 Å²	132.5	67%	0.674	74%	0.736	S	S	*	*			cis	-153.2	-170.2	15.6	-136.4	6.1	0	0	0	111.5
799	N	36	Very low	33.2	Very low	136 Å²	136	137.4 Å²	137.4	73%	0.727	74%	0.74	S	S	*	*			trans	-16	118.9	165	-50.2	-10.2	0	0	0	116.6
800	S	33.8	Very low	33.1	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	74%	0.743	S	S	*	*			cis	75.3	135.4	44.4	-165.5	0	0	0	0	114.4
801	P	40.3	Very low	33.2	Very low	109 Å²	109	140.2 Å²	140.2	71%	0.708	75%	0.747	S	S	*	*			cis	-119	-151.5	-21.1	34.4	-13	0	0	0	109.4
802	Q	37.5	Very low	33.5	Very low	182 Å²	182	141 Å²	141	85%	0.85	75%	0.747	S	S	*	*			cis	-155.9	149.4	-2	-153	163.2	39.7	0	0	111.4
803	G	32.6	Very low	33.1	Very low	67 Å²	67	142.8 Å²	142.8	69%	0.691	75%	0.747	S	S	*	*			trans	44.5	136.6	140.8	0	0	0	0	0	123.7
804	V	33.4	Very low	33.1	Very low	143 Å²	143	147.1 Å²	147.1	87%	0.867	76%	0.762	S	S	*	*			cis	-147.6	151.1	-2.9	177.7	0	0	0	0	109.1
805	K	28.5	Very low	33	Very low	185 Å²	185	148.2 Å²	148.2	80%	0.804	76%	0.761	S	S	*	*			trans	-138.2	-172.1	170.7	-84.1	-172.2	176.6	179.1	0	109.4
806	F	29.1	Very low	33.1	Very low	189 Å²	189	146.6 Å²	146.6	83%	0.829	76%	0.763	S	S	*	*			trans	89.7	136.4	173.3	-70.4	-100.2	0	0	0	115.7
807	T	32.1	Very low	33.1	Very low	99 Å²	99	145.1 Å²	145.1	61%	0.607	76%	0.759	S	S	*	*			cis	-158.4	159.5	-19.8	2.3	0	0	0	0	111
808	S	25.6	Very low	33.1	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	76%	0.762	S	S	*	*			trans	-81.2	143.4	162.5	171.3	0	0	0	0	111.3
809	Y	31.7	Very low	33.1	Very low	216 Å²	216	146 Å²	146	85%	0.847	77%	0.767	S	S	*	*			trans	-126.9	157	155.8	-81.9	-79.6	0	0	0	110.3
810	K	30.2	Very low	33.4	Very low	179 Å²	179	146.4 Å²	146.4	78%	0.778	77%	0.769	S	S	*	*			trans	-154.4	123	-159.5	174.7	-171.4	-178.5	-176.9	0	110.4
811	N	32.1	Very low	33.6	Very low	143 Å²	143	147.8 Å²	147.8	77%	0.765	77%	0.766	S	S	*	*			trans	174.8	160.9	162.1	-93.1	-17.1	0	0	0	108.8
812	Q	33.6	Very low	33.3	Very low	161 Å²	161	151.5 Å²	151.5	75%	0.752	77%	0.771	S	S	*	*			cis	-170.8	134.9	-40.8	-122.9	-174.6	8.6	0	0	106.5
813	N	27.9	Very low	33.1	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	77%	0.769	S	S	*	*			trans	25.3	120.1	165.6	-71.9	-18.9	0	0	0	120.9
814	L	32.7	Very low	33	Very low	185 Å²	185	151.4 Å²	151.4	97%	0.969	78%	0.775	S	S	*	*				-141.1	167.1	117.6	-135.7	69.4	0	0	0	109.5
815	K	29.9	Very low	33	Very low	164 Å²	164	149.3 Å²	149.3	71%	0.713	77%	0.766	S	S	*	*			trans	-136.2	131.8	-160.5	177.3	-165.3	168.9	-166.4	0	112.1	D817	K815-D817 WeakPolarHBondContact CE-OD1 3.4Å; K815-D817 IonicContact NZ-OD1 3.48Å
816	T	37.4	Very low	33.1	Very low	131 Å²	131	146.1 Å²	146.1	80%	0.804	77%	0.767	S	S	*	*			trans	-171	91.7	155.4	6.4	0	0	0	0	110.4
817	D	36.9	Very low	33.3	Very low	105 Å²	105	145 Å²	145	56%	0.561	77%	0.768	S	S	*	*				44.5	125	119.7	-44.5	-21.3	0	0	0	121.5	K815	K815-D817 WeakPolarHBondContact CE-OD1 3.4Å; K815-D817 IonicContact NZ-OD1 3.48Å
818	D	37.2	Very low	33.3	Very low	147 Å²	147	146 Å²	146	79%	0.786	77%	0.77	S	S	*	*			trans	81.3	150.5	142.6	-54.9	-17.4	0	0	0	125.1
819	E	36.9	Very low	33.6	Very low	166 Å²	166	144.7 Å²	144.7	78%	0.776	77%	0.771	S	S	*	*			trans	51	104.8	175.1	-50.3	-50.1	79.6	0	0	121.2
820	D	41.5	Very low	33.5	Very low	143 Å²	143	138 Å²	138	77%	0.765	77%	0.768	S	S	*	*				-173.3	123.3	105.4	-116.7	-24.2	0	0	0	116.9
821	I	39.3	Very low	33.6	Very low	138 Å²	138	136.8 Å²	136.8	71%	0.708	77%	0.77	S	S	*	*			trans	29.6	105.2	143.7	-57.3	171	0	0	0	121
822	F	33.2	Very low	33.8	Very low	187 Å²	187	134.5 Å²	134.5	82%	0.82	77%	0.77	S	S	*	*			trans	34.5	81.2	140.1	-67.9	-80.1	0	0	0	121.3	V824	F822-V824 HydrophobicContact CB-CG2 4.48Å; F822-V824 PolarHBondContact O-N 2.88Å
823	S	33.3	Very low	34	Very low	114 Å²	114	134.9 Å²	134.9	80%	0.797	77%	0.772	S	S	*	*			trans	-76.8	98.4	153	-71.7	0	0	0	0	111.8	S825	S823-S825 PolarHBondContact O-N 3.22Å; S823-S825 VanDerWaalsContact O-N 3.11Å
824	V	30.9	Very low	34.3	Very low	134 Å²	134	135.1 Å²	135.1	81%	0.812	77%	0.774	S	S	*	*			trans	-84.6	79.4	176.6	-174.2	0	0	0	0	111.1	F822 S826	F822-V824 HydrophobicContact CB-CG2 4.48Å; F822-V824 PolarHBondContact O-N 2.88Å; V824-S826 PolarHBondContact O-N 3.34Å
825	S	33	Very low	34.4	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	77%	0.768	S	S	*	*			trans	-79.6	111.4	174.8	-65.7	0	0	0	0	112.4	S823 I827	S823-S825 PolarHBondContact O-N 3.22Å; S823-S825 VanDerWaalsContact O-N 3.11Å; S825-I827 PolarHBondContact O-N 3.07Å
826	S	31.4	Very low	34.5	Very low	117 Å²	117	131.5 Å²	131.5	82%	0.818	77%	0.772	S	S	*	*			trans	36.7	73	147.9	-60.8	0	0	0	0	119	V824	V824-S826 PolarHBondContact O-N 3.34Å
827	I	32.7	Very low	34.3	Very low	167 Å²	167	133.7 Å²	133.7	86%	0.856	78%	0.778	S	S	*	*			trans	-100.5	81.7	154	-58.2	-177	0	0	0	109	S825	S825-I827 PolarHBondContact O-N 3.07Å
828	N	32	Very low	34.1	Very low	120 Å²	120	134.2 Å²	134.2	64%	0.642	79%	0.789	S	S	*	*			trans	-109.8	54.9	164.2	-122.8	85.8	0	0	0	108.2	G830	N828-G830 PolarHBondContact O-N 2.98Å
829	G	32	Very low	33.8	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	80%	0.795	S	S	*	*			trans	-71.4	92.9	-179.8	0	0	0	0	0	111.1	L831	G829-L831 PolarHBondContact O-N 2.91Å; G829-L831 VanDerWaalsContact O-N 3.16Å
830	G	29.7	Very low	33.6	Very low	76 Å²	76	131.5 Å²	131.5	78%	0.784	79%	0.791	S	S	*	*			trans	-74	99.5	178.3	0	0	0	0	0	112.1	N828 A832	N828-G830 PolarHBondContact O-N 2.98Å; G830-A832 PolarHBondContact O-N 3.48Å
831	L	32.8	Very low	33.3	Very low	154 Å²	154	132.7 Å²	132.7	81%	0.806	79%	0.792	S	S	*	*			trans	-84.8	83.7	157.4	-81.3	169	0	0	0	108.9	G829 E833	G829-L831 PolarHBondContact O-N 2.91Å; G829-L831 VanDerWaalsContact O-N 3.16Å; L831-E833 HydrophobicContact CD2-CG 4.36Å
832	A	34.3	Very low	32.9	Very low	94 Å²	94	133.8 Å²	133.8	78%	0.777	79%	0.794	S	S	*	*			trans	-84.6	104.7	152.5	0	0	0	0	0	106.7	G830	G830-A832 PolarHBondContact O-N 3.48Å
833	E	37.8	Very low	33	Very low	170 Å²	170	133.5 Å²	133.5	79%	0.794	80%	0.8	S	S	*	*			trans	-103	131.6	164.8	-70.6	-164	163.3	0	0	108.9	L831 N835	L831-E833 HydrophobicContact CD2-CG 4.36Å; E833-N835 PolarHBondContact O-N 3.23Å
834	D	35.6	Very low	33	Very low	156 Å²	156	133 Å²	133	83%	0.834	80%	0.797	S	S	*	*			trans	-72.5	124.5	-162.8	-55.6	-73.9	0	0	0	113.6
835	N	34.4	Very low	33.7	Very low	159 Å²	159	132.7 Å²	132.7	85%	0.85	80%	0.798	S	S	*	*			trans	-158	66.6	155	-111.4	-47.2	0	0	0	111.6	E833	E833-N835 PolarHBondContact O-N 3.23Å
836	S	33	Very low	33.8	Very low	113 Å²	113	138.6 Å²	138.6	79%	0.79	81%	0.805	S	S	*	*			trans	-144.9	70.5	174.4	-71.6	0	0	0	0	111.2	S838	S836-S838 VanDerWaalsContact C-N 3.29Å; S836-S838 PolarHBondContact O-N 2.89Å
837	L	31.9	Very low	34	Very low	177 Å²	177	141 Å²	141	93%	0.927	80%	0.803	S	S	*	*			trans	-73.4	81.4	170.3	-77.2	175.5	0	0	0	111.1	L839	L837-L839 PolarHBondContact O-N 2.86Å
838	S	32.3	Very low	34.1	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	80%	0.8	S	S	*	*			trans	-82.3	92	159.7	-69.2	0	0	0	0	109.2	S836 A840	S836-S838 VanDerWaalsContact C-N 3.29Å; S836-S838 PolarHBondContact O-N 2.89Å; S838-A840 PolarHBondContact O-N 3.02Å
839	L	31	Very low	34.3	Very low	171 Å²	171	138 Å²	138	90%	0.895	80%	0.801	S	S	*	*			trans	-90.8	95.4	171	-173.8	67.5	0	0	0	110.1	L837	L837-L839 PolarHBondContact O-N 2.86Å
840	A	33.9	Very low	34.4	Very low	85 Å²	85	145.4 Å²	145.4	70%	0.702	81%	0.807	S	S	*	*			trans	-143.4	75.7	176.9	0	0	0	0	0	111.5	S838	S838-A840 PolarHBondContact O-N 3.02Å
841	Q	35.3	Very low	34.5	Very low	169 Å²	169	147.8 Å²	147.8	79%	0.79	81%	0.806	S	S	*	*			trans	-162.6	127.3	150.9	-115.3	164	-38.2	0	0	113.8
842	E	31	Very low	34.6	Very low	161 Å²	161	144.6 Å²	144.6	75%	0.752	80%	0.796	S	S	*	*			trans	27.5	119.4	143.1	-58.3	-174.1	115.5	0	0	121.3
843	L	33.6	Very low	34.7	Very low	180 Å²	180	151.4 Å²	151.4	94%	0.942	80%	0.802	S	S	*	*			trans	-133.6	126.7	130.1	-78.5	-179.1	0	0	0	109.8
844	S	34.7	Very low	34.5	Very low	103 Å²	103	147.6 Å²	147.6	72%	0.72	79%	0.794	S	S	*	*			trans	-138.8	110.5	173.1	-171.9	0	0	0	0	110.2
845	P	45.6	Very low	34.6	Very low	129 Å²	129	148.2 Å²	148.2	84%	0.838	80%	0.797	S	S	*	*			trans	-88.1	116.9	174.7	31.9	-29.7	0	0	0	110.7
846	R	34.9	Very low	34.5	Very low	222 Å²	222	147.8 Å²	147.8	84%	0.838	80%	0.795	S	S	*	*			trans	-90.8	137.4	174.3	-86.1	-173.8	168.2	-166.4	-2.6	112.1
847	H	35.5	Very low	34.7	Very low	169 Å²	169	148 Å²	148	78%	0.782	79%	0.793	S	S	*	*			trans	50.5	116.5	153.4	-76.5	-107.6	0	0	0	119.9
848	S	35.1	Very low	34.8	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	78%	0.783	S	S	*	*				-160.9	112.3	106	-143.6	0	0	0	0	115.7
849	V	36.5	Very low	35	Very low	110 Å²	110	145.4 Å²	145.4	67%	0.667	78%	0.784	S	S	*	*				54.4	102.9	126.3	-175.9	0	0	0	0	121.5
850	R	32.5	Very low	35.2	Very low	227 Å²	227	142 Å²	142	86%	0.857	78%	0.78	S	S	*	*			trans	79.1	138.4	133.4	-89.5	-173.8	172.7	-175.9	-0.9	123.9
851	V	33	Very low	35.3	Very low	125 Å²	125	142.9 Å²	142.9	76%	0.758	79%	0.788	S	S	*	*			trans	74.3	134.6	142.3	170.5	0	0	0	0	117.6
852	S	33.8	Very low	35.5	Very low	87 Å²	87	139.2 Å²	139.2	61%	0.608	79%	0.786	S	S	*	*			cis	-175.2	148.2	-22.6	-95.5	0	0	0	0	110.2
853	R	36.8	Very low	35.9	Very low	237 Å²	237	140.6 Å²	140.6	89%	0.894	79%	0.792	S	S	*	*			trans	67.3	156.8	157	-65.6	163.7	-173.1	-177.9	0.9	116.4
854	S	34	Very low	36	Very low	91 Å²	91	137 Å²	137	64%	0.636	79%	0.788	S	S	*	*			cis	-175.2	162.2	-23.8	53.6	0	0	0	0	110.8
855	L	38.1	Very low	36	Very low	169 Å²	169	139.9 Å²	139.9	89%	0.885	79%	0.79	S	S	*	*			trans	93.2	123.1	160.3	-59.1	163.9	0	0	0	119.4
856	D	31.9	Very low	35.6	Very low	150 Å²	150	141.6 Å²	141.6	80%	0.802	79%	0.789	S	S	*	*			trans	-65.2	175.7	154	-106.8	-57.5	0	0	0	111.5
857	P	37.8	Very low	35.6	Very low	118 Å²	118	135.5 Å²	135.5	77%	0.766	79%	0.786	S	S	*	*			cis	-144.8	174.5	31.6	42.6	-22.3	0	0	0	119.5
858	S	33.4	Very low	35.7	Very low	102 Å²	102	132 Å²	132	71%	0.713	79%	0.787	S	S	*	*			trans	-57.6	150.6	160.5	171.5	0	0	0	0	114.8
859	V	35.9	Very low	35.8	Very low	136 Å²	136	135 Å²	135	82%	0.824	79%	0.793	S	S	*	*			trans	-171	133.6	136.5	133.5	0	0	0	0	114.4
860	A	35.3	Very low	35.6	Very low	99 Å²	99	133 Å²	133	82%	0.818	80%	0.795	S	S	*	*			trans	56.7	160.9	154.3	0	0	0	0	0	123.1
861	A	36.4	Very low	36	Very low	104 Å²	104	128.8 Å²	128.8	86%	0.86	80%	0.797	S	S	*	*			trans	-140.7	161.3	178.4	0	0	0	0	0	111.2
862	A	40.1	Very low	36	Very low	91 Å²	91	133.9 Å²	133.9	75%	0.752	80%	0.802	S	S	*	*			trans	-156.7	133	172.1	0	0	0	0	0	115.5
863	H	38.1	Very low	36.2	Very low	190 Å²	190	135 Å²	135	88%	0.88	81%	0.807	S	S	*	*			trans	16.2	138.4	146.7	-74.8	-98.3	0	0	0	123.5
864	A	37.1	Very low	36.2	Very low	104 Å²	104	129 Å²	129	86%	0.86	80%	0.797	S	S	*	*				-163	166.9	109.5	0	0	0	0	0	111.6
865	E	34.8	Very low	36.3	Very low	164 Å²	164	131 Å²	131	77%	0.766	81%	0.806	S	S	*	*			trans	-144.8	175.8	-168.7	-159.1	-167.7	-171.7	0	0	112.1
866	M	36.9	Very low	36	Very low	165 Å²	165	133.6 Å²	133.6	81%	0.813	80%	0.804	S	S	*	*			trans	79.9	167.6	163.7	-53.4	-176.8	-167.9	0	0	118.7
867	A	34	Very low	36.2	Very low	95 Å²	95	132.6 Å²	132.6	79%	0.785	80%	0.803	S	S	*	*				179.8	128.6	-54.7	0	0	0	0	0	110.9
868	A	37.8	Very low	35.9	Very low	96 Å²	96	130.4 Å²	130.4	79%	0.793	80%	0.802	S	S	*	*			trans	172.1	160.6	165.5	0	0	0	0	0	110.5
869	L	38.3	Very low	35.9	Very low	175 Å²	175	129 Å²	129	92%	0.916	80%	0.803	S	S	*	*			cis	-159.7	165	-22.3	-101.1	169.9	0	0	0	107.7
870	G	32.5	Very low	35.7	Very low	68 Å²	68	129.7 Å²	129.7	70%	0.701	81%	0.807	S	S	*	*			trans	-88.3	-160.3	178.3	0	0	0	0	0	114.9
871	P	39.5	Very low	35.5	Very low	138 Å²	138	130.4 Å²	130.4	90%	0.896	81%	0.807	S	S	*	*			cis	-140.3	-157.1	13	43.6	-22.8	0	0	0	116.2
872	R	33.7	Very low	35.2	Very low	232 Å²	232	137 Å²	137	88%	0.875	81%	0.809	S	S	*	*			trans	-111.9	168	-179.7	-138.1	-176.4	-176.2	174.4	1.9	110.4
873	P	38.6	Very low	34.9	Very low	110 Å²	110	141.2 Å²	141.2	71%	0.714	81%	0.814	S	S	*	*				-163	-179.1	78.6	41.1	-17.2	0	0	0	120.2
874	T	36.8	Very low	34.9	Very low	111 Å²	111	136.8 Å²	136.8	68%	0.681	80%	0.801	S	S	*	*			trans	66	109.6	146.2	43.6	0	0	0	0	126.8
875	T	35.4	Very low	34.7	Very low	134 Å²	134	139.8 Å²	139.8	82%	0.822	80%	0.8	S	S	*	*				59	156.1	128.2	65.6	0	0	0	0	121.9
876	R	31.9	Very low	34.6	Very low	223 Å²	223	138.4 Å²	138.4	84%	0.842	80%	0.803	S	S	*	*			cis	-159.5	160	12	-161.1	-170.9	169.9	-179.2	-3.2	110.7
877	V	35	Very low	34.4	Very low	130 Å²	130	134 Å²	134	79%	0.788	79%	0.792	S	S	*	*			trans	69.1	145.5	169.2	-162	0	0	0	0	113.9
878	G	32.2	Very low	34.4	Very low	72 Å²	72	138 Å²	138	74%	0.742	79%	0.792	S	S	*	*			cis	127.5	128.7	0	0	0	0	0	0	111.3
879	G	33	Very low	34.3	Very low	72 Å²	72	140 Å²	140	74%	0.742	79%	0.785	S	S	*	*			cis	-177.9	-172.1	-6.1	0	0	0	0	0	111.9
880	V	33	Very low	34	Very low	150 Å²	150	137.6 Å²	137.6	91%	0.909	78%	0.777	S	S	*	*			trans	69.2	110.9	166.8	-161.3	0	0	0	0	119.7
881	S	29.6	Very low	34	Very low	115 Å²	115	139.3 Å²	139.3	80%	0.804	78%	0.779	S	S	*	*			trans	-2.1	150.5	151.4	-157.8	0	0	0	0	122.5
882	R	31	Very low	33.5	Very low	242 Å²	242	140.5 Å²	140.5	91%	0.913	78%	0.776	S	S	*	*			trans	-111.6	136.2	166.3	-78.6	-171.1	175	-144.4	1	113.3
883	Q	34.7	Very low	33.5	Very low	180 Å²	180	133 Å²	133	84%	0.841	77%	0.771	S	S	*	*			trans	-111.7	-175.8	152.8	-107.1	-157.8	9.1	0	0	107.7
884	P	37.8	Very low	33.2	Very low	96 Å²	96	133.1 Å²	133.1	62%	0.623	77%	0.774	S	S	*	*			cis	-137.6	173.3	-42.4	40	-24.4	0	0	0	113.9
885	M	32.2	Very low	33.4	Very low	168 Å²	168	132.9 Å²	132.9	83%	0.828	78%	0.775	S	S	*	*			trans	35.7	162.2	134.3	-69.6	-72.3	169.5	0	0	125.4
886	T	32.3	Very low	33.2	Very low	135 Å²	135	134.3 Å²	134.3	83%	0.828	77%	0.772	S	S	*	*			trans	87.5	153.8	157.6	83.6	0	0	0	0	116.3
887	A	33.1	Very low	33.1	Very low	71 Å²	71	130.6 Å²	130.6	59%	0.587	77%	0.768	S	S	*	*			cis	-160.8	157.9	11.2	0	0	0	0	0	115.7
888	K	33.9	Very low	32.8	Very low	181 Å²	181	129.4 Å²	129.4	79%	0.787	77%	0.765	S	S	*	*			trans	72.8	158.4	135.4	-75.1	165	171.9	-173.8	0	119.4
889	H	36	Very low	32.5	Very low	137 Å²	137	133 Å²	133	63%	0.634	77%	0.768	S	S	*	*			cis	-156.9	138	3.7	-130	-54.2	0	0	0	114.3
890	T	31.8	Very low	32.4	Very low	124 Å²	124	136 Å²	136	76%	0.761	77%	0.772	S	S	*	*			trans	58.9	163.5	149.2	18.3	0	0	0	0	120.4
891	S	32.4	Very low	32.1	Very low	105 Å²	105	137 Å²	137	73%	0.734	77%	0.769	S	S	*	*			cis	-147.2	166.8	-3.3	-157.2	0	0	0	0	112.3
892	I	29.5	Very low	32.1	Very low	162 Å²	162	138 Å²	138	83%	0.831	77%	0.77	S	S	*	*			trans	-116.8	158.1	170.4	-72.3	170.8	0	0	0	109.5
893	G	33.9	Very low	32	Very low	75 Å²	75	132 Å²	132	77%	0.773	76%	0.76	S	S	*	*			trans	-159.3	126.5	165.8	0	0	0	0	0	113.5
894	S	32.1	Very low	31.7	Very low	113 Å²	113	128.2 Å²	128.2	79%	0.79	75%	0.753	S	S	*	*			trans	-101.6	164.2	165	-48.3	0	0	0	0	108.9
895	P	40.6	Very low	31.4	Very low	106 Å²	106	130.3 Å²	130.3	69%	0.688	76%	0.758	S	S	*	*				-149.5	150.9	81	42.2	-22.9	0	0	0	114.2
896	E	30.6	Very low	31.4	Very low	164 Å²	164	133.9 Å²	133.9	77%	0.766	76%	0.763	S	S	*	*				98.6	136	92.8	-79.4	-174.3	121.1	0	0	118.1
897	L	29.6	Very low	31.3	Very low	145 Å²	145	131 Å²	131	76%	0.759	76%	0.76	S	S	*	*			trans	42.6	118.2	141.3	-55.1	171.5	0	0	0	119.2
898	S	29.1	Very low	31.5	Very low	104 Å²	104	134.8 Å²	134.8	73%	0.727	78%	0.776	S	S	*	*				169.4	167.3	65.6	46.7	0	0	0	0	112.1
899	N	27	Very low	31.2	Very low	148 Å²	148	132.5 Å²	132.5	79%	0.791	77%	0.772	S	S	*	*			trans	1.9	140.8	158.6	-46.8	-24.9	0	0	0	118.6
900	T	31.3	Very low	31.2	Very low	136 Å²	136	131.5 Å²	131.5	83%	0.834	78%	0.781	S	S	*	*				-165.8	164.8	55.8	-51.4	0	0	0	0	111
901	M	25.8	Very low	31.1	Very low	171 Å²	171	133.7 Å²	133.7	84%	0.842	78%	0.78	S	S	*	*			trans	-65.6	151.7	169.3	-58	-174.4	-69.9	0	0	112.3
902	V	29.9	Very low	31.3	Very low	136 Å²	136	133.7 Å²	133.7	82%	0.824	79%	0.786	S	S	*	*				175	148.1	123	151	0	0	0	0	111.1
903	T	29.3	Very low	31.4	Very low	116 Å²	116	130.5 Å²	130.5	71%	0.712	78%	0.784	S	S	*	*			trans	-35.7	148.6	-176.7	60.1	0	0	0	0	121
904	S	28.5	Very low	31.5	Very low	100 Å²	100	132.6 Å²	132.6	70%	0.699	79%	0.787	S	S	*	*			trans	87.5	135.2	130.1	-76.4	0	0	0	0	123.6
905	L	31.5	Very low	31.6	Very low	139 Å²	139	132.5 Å²	132.5	73%	0.728	78%	0.784	S	S	*	*			trans	76.1	124.7	141.3	-94.7	70.4	0	0	0	121.5
906	W	32	Very low	31.2	Very low	243 Å²	243	134.9 Å²	134.9	92%	0.92	79%	0.789	S	S	*	*			trans	46.1	121.6	159.8	-56.7	88.3	0	0	0	120
907	G	29.7	Very low	31.4	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	79%	0.786	S	S	*	*			trans	-93.3	172.9	171.2	0	0	0	0	0	113.9
908	T	36.8	Very low	31.4	Very low	150 Å²	150	133.2 Å²	133.2	92%	0.92	79%	0.79	S	S	*	*			trans	-132.5	161.4	164.6	50.2	0	0	0	0	110.8
909	N	27.2	Very low	31.7	Very low	133 Å²	133	134.5 Å²	134.5	71%	0.711	79%	0.794	S	S	*	*			trans	-106.2	131.9	-170.3	-172.1	-10.8	0	0	0	110.2
910	S	36.5	Very low	31.9	Very low	117 Å²	117	134.8 Å²	134.8	82%	0.818	79%	0.794	S	S	*	*			trans	-153.7	141	171.8	-85	0	0	0	0	112.7
911	K	31	Very low	32	Very low	170 Å²	170	134 Å²	134	74%	0.739	79%	0.793	S	S	*	*			trans	-78.8	131.6	-175.2	-67.7	175.1	172.2	-178	0	111.6	A433	A433-K911 PolarHBondContact O-NZ 2.89Å
912	A	35.8	Very low	32.3	Very low	104 Å²	104	134 Å²	134	86%	0.86	79%	0.794	S	S	*	*			trans	-138.1	146.4	149.2	0	0	0	0	0	108
913	A	31.7	Very low	32.6	Very low	95 Å²	95	132.5 Å²	132.5	79%	0.785	80%	0.795	S	S	*	*			trans	-135.5	136.9	-173.3	0	0	0	0	0	111.9
914	S	35.9	Very low	32.7	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	80%	0.801	S	S	*	*			trans	-163.8	159.2	152.9	-83.5	0	0	0	0	110.2
915	P	34.3	Very low	33.3	Very low	111 Å²	111	138.4 Å²	138.4	72%	0.721	81%	0.807	S	S	*	*			trans	-110.7	-158.9	-167.3	36.8	-21.8	0	0	0	112.9
916	I	31.8	Very low	33.4	Very low	156 Å²	156	139.1 Å²	139.1	80%	0.8	81%	0.812	S	S	*	*			trans	87	139.5	171.2	-53.8	160.8	0	0	0	114.2
917	T	35.3	Very low	33.8	Very low	113 Å²	113	131 Å²	131	69%	0.693	80%	0.804	S	S	*	*			cis	-163.9	143.9	-31.3	-85.4	0	0	0	0	106.8
918	N	28.4	Very low	34.2	Very low	161 Å²	161	131.1 Å²	131.1	86%	0.861	80%	0.797	S	S	*	*			trans	-79.2	130.4	175.7	-77.8	-25.7	0	0	0	113
919	V	36.3	Very low	34.3	Very low	131 Å²	131	134.3 Å²	134.3	79%	0.794	79%	0.794	S	S	*	*			trans	-139.6	141.1	158.8	-176.5	0	0	0	0	109
920	I	31.7	Very low	35	Very low	154 Å²	154	135.2 Å²	135.2	79%	0.79	80%	0.799	S	S	*	*			trans	-104.2	141	179.7	-61.3	167.1	0	0	0	109.2
921	S	33.2	Very low	35.1	Very low	119 Å²	119	137.5 Å²	137.5	83%	0.832	80%	0.797	S	S	*	*			trans	-143.1	136.1	159.2	-82	0	0	0	0	111.1
922	M	30.5	Very low	35.7	Very low	172 Å²	172	139.6 Å²	139.6	85%	0.847	81%	0.806	S	S	*	*			trans	-98.5	158.8	169	-69.4	171.2	58.8	0	0	110.2
923	A	36.5	Very low	35.9	Very low	103 Å²	103	141.6 Å²	141.6	85%	0.851	80%	0.802	S	S	*	*			trans	-136.6	134.6	159.3	0	0	0	0	0	110.2
924	R	32.7	Very low	36.6	Very low	222 Å²	222	142.9 Å²	142.9	84%	0.838	81%	0.806	S	S	*	*			trans	-133.2	149.3	164.4	-106.7	-174.4	171.4	161.4	-5.5	106.6
925	S	40.5	Very low	36.8	Very low	119 Å²	119	145 Å²	145	83%	0.832	81%	0.807	S	S	*	*			trans	-147	117.6	170.8	53.8	0	0	0	0	108.1
926	D	34.1	Very low	37.3	Very low	153 Å²	153	151.3 Å²	151.3	82%	0.818	84%	0.835	S	S	*	*			trans	-99.1	155.9	-177.7	-64.6	-59.5	0	0	0	111.9
927	G	40.9	Very low	37.6	Very low	74 Å²	74	151.1 Å²	151.1	76%	0.763	84%	0.837	S	S	*	*			trans	124.9	163.5	154.8	0	0	0	0	0	115.9
928	A	37.6	Very low	37.7	Very low	76 Å²	76	153.1 Å²	153.1	63%	0.628	85%	0.845	S	S	*	*			cis	-173.7	145.1	-23.1	0	0	0	0	0	108
929	Y	37.9	Very low	38.3	Very low	217 Å²	217	152.6 Å²	152.6	85%	0.851	84%	0.844	S	S	*	*			trans	65.5	156.3	177	-55.2	-79.9	0	0	0	114.1
930	D	43	Very low	38.4	Very low	153 Å²	153	153.9 Å²	153.9	82%	0.818	85%	0.847	S	S	*	*			cis	-132.3	173.9	6.8	-104.5	-42.3	0	0	0	112.8
931	E	37.4	Very low	38.8	Very low	165 Å²	165	153.9 Å²	153.9	77%	0.771	85%	0.85	S	S	*	*			trans	-93.6	143.1	-177.4	169.2	-179.7	-120.3	0	0	112.6
932	F	44	Very low	39.2	Very low	213 Å²	213	156.2 Å²	156.2	93%	0.934	85%	0.851	S	S	*	*			trans	-167.9	132.5	155.1	-98.8	-62.5	0	0	0	112.7
933	D	39.8	Very low	39.8	Very low	146 Å²	146	155.1 Å²	155.1	78%	0.781	85%	0.852	S	S	*	*			trans	-81.4	157.4	173.8	-65.1	-59.7	0	0	0	113.7
934	S	46.3	Very low	40	Very low	123 Å²	123	159.1 Å²	159.1	86%	0.86	85%	0.852	S	S	*	*			trans	-170.4	142.6	138.3	-76	0	0	0	0	110.6
935	D	41	Very low	40.6	Very low	163 Å²	163	153.8 Å²	153.8	87%	0.872	85%	0.853	S	S	*	*			trans	-81	148.4	-175.4	-50	-94.3	0	0	0	115.1
936	D	45.2	Very low	40.7	Very low	244 Å²	244	157 Å²	157	100%	1.305	86%	0.855	S	S	*	*			trans	-164.7	0	135.5	-121	-7.7	0	0	0	110.4

Retrieved 936 of 936 residues in 124.3 ms (Link to these results)

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