A0A087YD38_POEFO Loading...

IQ motif and Sec7 domain ArfGEF 1

AlphaFold DB , UniProt , Accession A0A087YD38, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,098 aa.

						>A0A087YD38_POEFO|A0A087YD38
MDCPTENPTRAAEYLKELNKIIETQQGLLERQRGRIEELEQQVSDLCAENACLKEQYQRHLATCRLLQGTSSLVTLGAIKEHVTHDKLEFDPTRMVRRHASLPVEATENPGRLGSEGCKRVIPCRKWKSASFGVEGDGRPSESGPSLDGRANYGQGPVTHGSAISPDRFDGPLYSHGVQPGPQRPRRPKLQHSQSILRKQAEEEAIKRSRSLSESYELSADLQDKQVEMLERKYGGRFITRHAARTIQTAFRQYQMNKNFERLRSSMSENRMSRRIVLSNMRMQLSFEGPEKVHSSYFEGRQVSMTEDGTPLSMVQSERGDVEVHQQANMTSHPPPQADLTDAITELEDAFSRQVKSLAESIDDALNCRSLQGDEGPDPEAMGCSKVQGEVPYQMKSHRRPAGRMRDETVASYSDVTLFIDEDDISHPAALRSGDQPSSTESDLRLQSVNSSQEYWPIDSKDEGRDTDTSCRSTPSLECQEQRLRVDHLPLLTIEPPSDSSAELSDRSDRGSVKRPPVYEPHGHIVTSSQASPKHISHGPPPRAPSRDDDAPLRHRHRQLESHLAINGSANRQSKSESDFSDGDNDSINSTSNSNDTINCSSESSSRDSLREQTLSKQTYHKETRNSWDSPIFSNDVIRKRHYRIGLNLFNKKPEKGIQYLTERGFIPDTPVGVAHFLLQRKGLSRQMIGEFLGNRQKQFNRDVLDCVVDEMDFQSMELDEALRKFQNHIRVQGEAQKVERLIEAFSQRYCICNPTVVRQFRNPDTIFILAFAIILLNTDMYSPNVKPERKMKLEDFIKNLRGVDDGEDIPRETLVGIYERIRKRELKTNEDHVSQVQKVEKLIVGKKPIGSLHHGLGCVLSLPHRRLVCYCRLFEVPDPNKPQKLGLHQREIFLFNDLLVVTKIFQKKKNSVTYSFRQSFSLYGMQVMLFENQYYPNGIRLTSAIPGADIKVLINFNAPNPQDRKKFTDDLRESIAEVQEMEKYRIESELEKQKGVVRPSMSQSSGLKKEAGNGGMNRASLDDSYAMGEGLKRSALSSSLRDLSEAGKRGRRSSAGSLDSNMEVSWKQLVSELLSLCDDVHCETLHLFFWSYTSFAS
					

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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	42.1	Very low	47.7	Very low	236 Å²	236	117.3 Å²	117.3	100%	1.163	65%	0.645	S	S	*	*				0	110.3	0	-87.9	-68.3	-162.3	0	0	106.9
2	D	32.6	Very low	48.6	Very low	174 Å²	174	111.1 Å²	111.1	93%	0.93	62%	0.62	S	S	*	*			trans	-161.5	144.5	156.1	-102.3	-40.6	0	0	0	108.3
3	C	33.4	Very low	49.6	Very low	108 Å²	108	112.1 Å²	112.1	73%	0.73	62%	0.617	S	S	*	*			trans	-131.4	119.6	-172.7	-173.8	0	0	0	0	109.5	T5	C3-T5 PolarHBondContact O-N 3.37Å
4	P	45.3	Very low	50	Low	120 Å²	120	111.9 Å²	111.9	78%	0.779	60%	0.604	S	S	*	*			trans	-64.2	128.5	174.5	27.3	-32.8	0	0	0	109.4	E6	P4-E6 PolarHBondContact O-N 3.33Å
5	T	47.1	Very low	51	Low	138 Å²	138	110 Å²	110	85%	0.847	59%	0.593	S	S	*	*			trans	-68.2	126.2	-172	34.1	0	0	0	0	112.2	C3 N7	C3-T5 PolarHBondContact O-N 3.37Å; T5-N7 PolarHBondContact O-N 3.31Å
6	E	47.7	Very low	52.1	Low	116 Å²	116	113.1 Å²	113.1	54%	0.542	60%	0.599	S	S	.	*			trans	-71.6	115.8	168.9	-79.4	-176.3	156.1	0	0	109.9	P4 R252	P4-E6 PolarHBondContact O-N 3.33Å; E6-R252 IonicContact OE1-CZ 2.7Å; E6-R252 IonicContact OE1-NE 3.48Å; E6-R252 PolarHBondContact OE1-NE 3Å; E6-R252 IonicContact OE1-NH2 2.84Å; E6-R252 PolarHBondContact OE1-NH2 3.4Å; E6-R252 IonicContact OE2-CZ 2.73Å; E6-R252 IonicContact OE2-NH2 3.55Å; E6-R252 PolarHBondContact OE2-NH2 3.11Å
7	N	54.3	Low	53.3	Low	86 Å²	86	112 Å²	112	46%	0.46	59%	0.59	S	S	.	*			trans	-65.4	120.8	-173.1	-167.9	-29.9	0	0	0	111.4	T5 T9 R10	T5-N7 PolarHBondContact O-N 3.31Å; N7-T9 VanDerWaalsContact C-N 3.25Å; N7-T9 VanDerWaalsContact CG-OG1 3.32Å; N7-T9 PolarHBondContact O-N 2.9Å; N7-T9 PolarHBondContact OD1-N 3.01Å; N7-T9 PolarHBondContact OD1-OG1 3.09Å; N7-R10 PolarHBondContact O-N 3.2Å
8	P	56.6	Low	54.1	Low	63 Å²	63	110.2 Å²	110.2	41%	0.409	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.4	-23.2	-169.5	25.6	-35.4	0	0	0	114	R10 A11 V227	P8-R10 VanDerWaalsContact C-N 3.29Å; P8-R10 PolarHBondContact O-N 2.68Å; P8-A11 WeakPolarHBondContact O-CB 3.44Å; P8-A11 PolarHBondContact O-N 3.18Å; P8-V227 HydrophobicContact CB-CG2 4.23Å
9	T	54.2	Low	55.3	Low	53 Å²	53	109.4 Å²	109.4	33%	0.325	58%	0.576	S	S	.	*	H	α-helix	trans	-51.4	-44.2	175.3	48.2	0	0	0	0	112.8	N7 A11 A12 E13	N7-T9 VanDerWaalsContact C-N 3.25Å; N7-T9 VanDerWaalsContact CG-OG1 3.32Å; N7-T9 PolarHBondContact O-N 2.9Å; N7-T9 PolarHBondContact OD1-N 3.01Å; N7-T9 PolarHBondContact OD1-OG1 3.09Å; T9-A11 VanDerWaalsContact C-N 3.25Å; T9-A11 PolarHBondContact O-N 3.19Å; T9-A12 WeakPolarHBondContact O-CB 3.24Å; T9-A12 PolarHBondContact O-N 3.02Å; T9-A12 VanDerWaalsContact O-N 3.1Å; T9-E13 PolarHBondContact O-N 3.36Å
10	R	56.1	Low	56.6	Low	159 Å²	159	109.2 Å²	109.2	60%	0.6	57%	0.57	S	S	*	*	H	α-helix	trans	-60.1	-31	177.5	-83.1	-176.9	169	169.4	-0.2	113.6	N7 P8 A12 E13 Y14	N7-R10 PolarHBondContact O-N 3.2Å; P8-R10 VanDerWaalsContact C-N 3.29Å; P8-R10 PolarHBondContact O-N 2.68Å; R10-A12 VanDerWaalsContact C-N 3.32Å; R10-E13 PolarHBondContact O-N 3.43Å; R10-Y14 HydrophobicContact CB-CD2 4.49Å; R10-Y14 HydrophobicContact CB-CE2 4.21Å; R10-Y14 WeakPolarHBondContact O-CD2 3.43Å; R10-Y14 PolarHBondContact O-N 3.13Å
11	A	55.6	Low	57.7	Low	37 Å²	37	108 Å²	108	31%	0.306	56%	0.564	S	S	.	*	H	α-helix	trans	-67.2	-36.2	178.1	0	0	0	0	0	111.5	P8 T9 L15	P8-A11 WeakPolarHBondContact O-CB 3.44Å; P8-A11 PolarHBondContact O-N 3.18Å; T9-A11 VanDerWaalsContact C-N 3.25Å; T9-A11 PolarHBondContact O-N 3.19Å; A11-L15 WeakPolarHBondContact O-CG 3.42Å; A11-L15 PolarHBondContact O-N 3.17Å; A11-L15 VanDerWaalsContact O-N 3.11Å
12	A	57.8	Low	59.6	Low	43 Å²	43	100.2 Å²	100.2	36%	0.355	53%	0.526	S	S	.	.	H	α-helix	trans	-69.5	-35.7	175.2	0	0	0	0	0	112.4	T9 R10 K16	T9-A12 WeakPolarHBondContact O-CB 3.24Å; T9-A12 PolarHBondContact O-N 3.02Å; T9-A12 VanDerWaalsContact O-N 3.1Å; R10-A12 VanDerWaalsContact C-N 3.32Å; A12-K16 WeakPolarHBondContact O-CG 3.41Å; A12-K16 PolarHBondContact O-N 2.9Å; A12-K16 VanDerWaalsContact O-N 3.16Å
13	E	62.4	Low	61.9	Low	124 Å²	124	97.7 Å²	97.7	58%	0.579	51%	0.509	S	S	*	.	H	α-helix	trans	-65.3	-46.6	173.6	-63	-178.8	136.7	0	0	111.8	T9 R10 L15 K16 E17	T9-E13 PolarHBondContact O-N 3.36Å; R10-E13 PolarHBondContact O-N 3.43Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 2.92Å; E13-K16 PolarHBondContact O-N 3.19Å; E13-E17 PolarHBondContact O-N 2.98Å; E13-E17 VanDerWaalsContact O-N 3.08Å
14	Y	55	Low	64.2	Low	110 Å²	110	97 Å²	97	43%	0.431	50%	0.501	S	S	.	.	H	α-helix	trans	-61	-40	177.1	-72.1	-51.8	0	0	0	112.3	R10 E17 L18 F251	R10-Y14 HydrophobicContact CB-CD2 4.49Å; R10-Y14 HydrophobicContact CB-CE2 4.21Å; R10-Y14 WeakPolarHBondContact O-CD2 3.43Å; R10-Y14 PolarHBondContact O-N 3.13Å; Y14-E17 PolarHBondContact O-N 3.07Å; Y14-L18 WeakPolarHBondContact O-CB 3.36Å; Y14-L18 PolarHBondContact O-N 3.1Å; Y14-F251 AromaticContact CD1-CE1 4Å; Y14-F251 HydrophobicContact CD1-CE1 4Å; Y14-F251 HydrophobicContact CD1-CE2 4.27Å; Y14-F251 AromaticContact CD1-CZ 3.61Å; Y14-F251 HydrophobicContact CD1-CZ 3.61Å; Y14-F251 HydrophobicContact CD2-CE1 4.2Å; Y14-F251 AromaticContact CE1-CE1 3.6Å; Y14-F251 HydrophobicContact CE1-CE1 3.6Å; Y14-F251 HydrophobicContact CE1-CE2 4.41Å; Y14-F251 AromaticContact CE1-CZ 3.37Å; Y14-F251 HydrophobicContact CE1-CZ 3.37Å; Y14-F251 HydrophobicContact CE2-CD1 4.47Å; Y14-F251 AromaticContact CE2-CE1 3.82Å; Y14-F251 HydrophobicContact CE2-CE1 3.82Å; Y14-F251 HydrophobicContact CE2-CZ 4.41Å; Y14-F251 HydrophobicContact CG-CE1 4.3Å; Y14-F251 HydrophobicContact CG-CZ 4.26Å; Y14-F251 AromaticContact CZ-CE1 3.5Å; Y14-F251 VanDerWaalsContact CZ-CE1 3.5Å; Y14-F251 AromaticContact CZ-CZ 3.81Å
15	L	65	Low	65.6	Low	83 Å²	83	97 Å²	97	44%	0.435	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-37.1	175.9	-73	169.4	0	0	0	112.9	A11 E13 L18 N19	A11-L15 WeakPolarHBondContact O-CG 3.42Å; A11-L15 PolarHBondContact O-N 3.17Å; A11-L15 VanDerWaalsContact O-N 3.11Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 2.92Å; L15-L18 PolarHBondContact O-N 3.37Å; L15-N19 PolarHBondContact O-N 2.82Å; L15-N19 VanDerWaalsContact O-N 3.08Å
16	K	68	Low	67.1	Low	160 Å²	160	95.7 Å²	95.7	70%	0.696	48%	0.475	S	S	*	.	H	α-helix	trans	-64.2	-46.9	174.6	-76.6	178	177.8	178.7	0	112.3	A12 E13 L18 N19 K20	A12-K16 WeakPolarHBondContact O-CG 3.41Å; A12-K16 PolarHBondContact O-N 2.9Å; A12-K16 VanDerWaalsContact O-N 3.16Å; E13-K16 PolarHBondContact O-N 3.19Å; K16-L18 VanDerWaalsContact C-N 3.29Å; K16-L18 PolarHBondContact O-N 3.25Å; K16-N19 PolarHBondContact O-N 3.08Å; K16-K20 PolarHBondContact O-N 2.89Å; K16-K20 VanDerWaalsContact O-N 3.14Å
17	E	72.8	Confident	68.9	Low	94 Å²	94	91.1 Å²	91.1	44%	0.439	46%	0.459	S	S	.	.	H	α-helix	trans	-69.4	-29.6	179.8	-162.9	66.1	-165.5	0	0	111.5	E13 Y14 K20 I21	E13-E17 PolarHBondContact O-N 2.98Å; E13-E17 VanDerWaalsContact O-N 3.08Å; Y14-E17 PolarHBondContact O-N 3.07Å; E17-K20 PolarHBondContact O-N 3.26Å; E17-K20 IonicContact OE1-NZ 3.4Å; E17-K20 PolarHBondContact OE1-NZ 3.08Å; E17-K20 WeakPolarHBondContact OE2-CD 3.33Å; E17-K20 IonicContact OE2-NZ 2.73Å; E17-K20 PolarHBondContact OE2-NZ 3.42Å; E17-I21 WeakPolarHBondContact O-CD1 3.48Å; E17-I21 VanDerWaalsContact O-CG1 3.25Å; E17-I21 WeakPolarHBondContact O-CG1 3.36Å; E17-I21 PolarHBondContact O-N 2.73Å
18	L	68.4	Low	70.3	Confident	80 Å²	80	91.2 Å²	91.2	42%	0.419	46%	0.459	S	S	.	.	H	α-helix	trans	-67.2	-45.4	174.3	-148.4	167.6	0	0	0	111.7	Y14 L15 K16 K20 I21 I22	Y14-L18 WeakPolarHBondContact O-CB 3.36Å; Y14-L18 PolarHBondContact O-N 3.1Å; L15-L18 PolarHBondContact O-N 3.37Å; K16-L18 VanDerWaalsContact C-N 3.29Å; K16-L18 PolarHBondContact O-N 3.25Å; L18-K20 VanDerWaalsContact C-N 3.35Å; L18-K20 PolarHBondContact O-N 2.9Å; L18-I21 WeakPolarHBondContact O-CB 3.36Å; L18-I21 PolarHBondContact O-N 2.87Å; L18-I22 HydrophobicContact CD2-CD1 3.55Å; L18-I22 HydrophobicContact CD2-CG1 4.05Å; L18-I22 WeakPolarHBondContact O-CG1 3.49Å; L18-I22 PolarHBondContact O-N 2.7Å
19	N	77.2	Confident	71.6	Confident	95 Å²	95	93.3 Å²	93.3	51%	0.508	47%	0.467	S	S	.	.	H	α-helix	trans	-57.5	-46.8	172.7	-84	9.4	0	0	0	112	L15 K16 I21 I22 E23	L15-N19 PolarHBondContact O-N 2.82Å; L15-N19 VanDerWaalsContact O-N 3.08Å; K16-N19 PolarHBondContact O-N 3.08Å; N19-I21 VanDerWaalsContact C-N 3.27Å; N19-I21 PolarHBondContact O-N 2.98Å; N19-I22 WeakPolarHBondContact O-CA 3.31Å; N19-I22 WeakPolarHBondContact O-CB 3.37Å; N19-I22 PolarHBondContact O-N 2.81Å; N19-E23 WeakPolarHBondContact O-CG 3.48Å; N19-E23 PolarHBondContact O-N 3.33Å
20	K	81.1	Confident	73.1	Confident	104 Å²	104	97.2 Å²	97.2	45%	0.452	48%	0.481	S	S	.	.	H	α-helix	trans	-60.9	-33.6	177.5	178.2	-179.5	162.8	-143	0	112.9	K16 E17 L18 T24	K16-K20 PolarHBondContact O-N 2.89Å; K16-K20 VanDerWaalsContact O-N 3.14Å; E17-K20 PolarHBondContact O-N 3.26Å; E17-K20 IonicContact OE1-NZ 3.4Å; E17-K20 PolarHBondContact OE1-NZ 3.08Å; E17-K20 WeakPolarHBondContact OE2-CD 3.33Å; E17-K20 IonicContact OE2-NZ 2.73Å; E17-K20 PolarHBondContact OE2-NZ 3.42Å; L18-K20 VanDerWaalsContact C-N 3.35Å; L18-K20 PolarHBondContact O-N 2.9Å; K20-T24 VanDerWaalsContact O-CB 3.31Å; K20-T24 WeakPolarHBondContact O-CB 3.33Å; K20-T24 PolarHBondContact O-N 3.25Å; K20-T24 PolarHBondContact O-OG1 3.12Å
21	I	79	Confident	74.5	Confident	84 Å²	84	98 Å²	98	43%	0.431	48%	0.484	S	S	.	.	H	α-helix	trans	-68.4	-42.5	171.5	-71	163.5	0	0	0	110.9	E17 L18 N19 T24 Q25	E17-I21 WeakPolarHBondContact O-CD1 3.48Å; E17-I21 VanDerWaalsContact O-CG1 3.25Å; E17-I21 WeakPolarHBondContact O-CG1 3.36Å; E17-I21 PolarHBondContact O-N 2.73Å; L18-I21 WeakPolarHBondContact O-CB 3.36Å; L18-I21 PolarHBondContact O-N 2.87Å; N19-I21 VanDerWaalsContact C-N 3.27Å; N19-I21 PolarHBondContact O-N 2.98Å; I21-T24 PolarHBondContact O-N 3.27Å; I21-Q25 WeakPolarHBondContact O-CG 3.39Å; I21-Q25 PolarHBondContact O-N 3.29Å
22	I	81.4	Confident	75.6	Confident	73 Å²	73	101.1 Å²	101.1	37%	0.374	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-49.6	176.5	-68.4	165.3	0	0	0	110.8	L18 N19 T24 Q25 Q26	L18-I22 HydrophobicContact CD2-CD1 3.55Å; L18-I22 HydrophobicContact CD2-CG1 4.05Å; L18-I22 WeakPolarHBondContact O-CG1 3.49Å; L18-I22 PolarHBondContact O-N 2.7Å; N19-I22 WeakPolarHBondContact O-CA 3.31Å; N19-I22 WeakPolarHBondContact O-CB 3.37Å; N19-I22 PolarHBondContact O-N 2.81Å; I22-T24 VanDerWaalsContact C-N 3.31Å; I22-T24 PolarHBondContact O-N 3.14Å; I22-Q25 PolarHBondContact O-N 2.77Å; I22-Q25 VanDerWaalsContact O-N 3.09Å; I22-Q26 HydrophobicContact CG2-CG 4.46Å; I22-Q26 PolarHBondContact O-N 2.87Å
23	E	80.6	Confident	76.9	Confident	121 Å²	121	106.9 Å²	106.9	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-57.1	-43.6	175.8	-70.4	165.3	-168.5	0	0	111.4	N19 Q25 Q26 G27	N19-E23 WeakPolarHBondContact O-CG 3.48Å; N19-E23 PolarHBondContact O-N 3.33Å; E23-Q25 VanDerWaalsContact C-N 3.33Å; E23-Q25 PolarHBondContact O-N 2.68Å; E23-Q26 PolarHBondContact O-N 2.84Å; E23-G27 PolarHBondContact O-N 3.34Å
24	T	82.9	Confident	78.1	Confident	94 Å²	94	102.6 Å²	102.6	58%	0.577	49%	0.494	S	S	*	.	H	α-helix	trans	-64.6	-35.2	176.7	-58.8	0	0	0	0	112.3	K20 I21 I22 L28	K20-T24 VanDerWaalsContact O-CB 3.31Å; K20-T24 WeakPolarHBondContact O-CB 3.33Å; K20-T24 PolarHBondContact O-N 3.25Å; K20-T24 PolarHBondContact O-OG1 3.12Å; I21-T24 PolarHBondContact O-N 3.27Å; I22-T24 VanDerWaalsContact C-N 3.31Å; I22-T24 PolarHBondContact O-N 3.14Å; T24-L28 PolarHBondContact O-N 2.82Å
25	Q	74.2	Confident	79.5	Confident	120 Å²	120	103.3 Å²	103.3	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-76.3	-39.6	176.6	-74.8	-175.7	-9.9	0	0	112.5	I21 I22 E23 L28 L29	I21-Q25 WeakPolarHBondContact O-CG 3.39Å; I21-Q25 PolarHBondContact O-N 3.29Å; I22-Q25 PolarHBondContact O-N 2.77Å; I22-Q25 VanDerWaalsContact O-N 3.09Å; E23-Q25 VanDerWaalsContact C-N 3.33Å; E23-Q25 PolarHBondContact O-N 2.68Å; Q25-L28 WeakPolarHBondContact O-CB 3.4Å; Q25-L28 PolarHBondContact O-N 3.28Å; Q25-L28 VanDerWaalsContact O-N 3.11Å; Q25-L29 WeakPolarHBondContact O-CG 3.42Å; Q25-L29 PolarHBondContact O-N 3.3Å
26	Q	79.3	Confident	80.5	Confident	110 Å²	110	103.8 Å²	103.8	51%	0.514	50%	0.497	S	S	.	.	H	α-helix	trans	-59.2	-51.4	172	-75.1	178.6	-40.9	0	0	110.7	I22 E23 L28 L29 E30	I22-Q26 HydrophobicContact CG2-CG 4.46Å; I22-Q26 PolarHBondContact O-N 2.87Å; E23-Q26 PolarHBondContact O-N 2.84Å; Q26-L28 PolarHBondContact O-N 3.26Å; Q26-L29 PolarHBondContact O-N 3.47Å; Q26-E30 WeakPolarHBondContact O-CG 3.38Å; Q26-E30 PolarHBondContact O-N 3.17Å
27	G	85.6	Confident	81.5	Confident	20 Å²	20	101.1 Å²	101.1	21%	0.206	49%	0.488	C	S	.	.	H	α-helix	trans	-66.1	-6.8	175.5	0	0	0	0	0	114.8	E23 R31	E23-G27 PolarHBondContact O-N 3.34Å; G27-R31 VanDerWaalsContact O-CZ 3.24Å; G27-R31 PolarHBondContact O-NE 3.24Å; G27-R31 PolarHBondContact O-NH2 3.48Å
28	L	82.5	Confident	82.2	Confident	89 Å²	89	100.7 Å²	100.7	47%	0.466	49%	0.485	S	S	.	.	H	α-helix	trans	-91.6	-43.3	167.4	-176.1	66.3	0	0	0	111.2	T24 Q25 Q26 E30 R31 Q32	T24-L28 PolarHBondContact O-N 2.82Å; Q25-L28 WeakPolarHBondContact O-CB 3.4Å; Q25-L28 PolarHBondContact O-N 3.28Å; Q25-L28 VanDerWaalsContact O-N 3.11Å; Q26-L28 PolarHBondContact O-N 3.26Å; L28-E30 VanDerWaalsContact C-N 3.35Å; L28-R31 PolarHBondContact O-N 3.13Å; L28-Q32 WeakPolarHBondContact O-CG 3.24Å; L28-Q32 PolarHBondContact O-N 3.21Å
29	L	84.8	Confident	82.7	Confident	107 Å²	107	100.7 Å²	100.7	56%	0.56	49%	0.485	S	S	*	.	H	α-helix	trans	-62.8	-38.2	176.5	-71.6	167.5	0	0	0	112.2	Q25 Q26 Q32 R33	Q25-L29 WeakPolarHBondContact O-CG 3.42Å; Q25-L29 PolarHBondContact O-N 3.3Å; Q26-L29 PolarHBondContact O-N 3.47Å; L29-Q32 PolarHBondContact O-N 3.01Å; L29-R33 WeakPolarHBondContact O-CB 3.45Å; L29-R33 PolarHBondContact O-N 3.1Å
30	E	84.8	Confident	83	Confident	135 Å²	135	102.2 Å²	102.2	63%	0.631	49%	0.49	S	S	*	.	H	α-helix	trans	-63.7	-42.2	174.1	-71.5	174.7	162.9	0	0	112.1	Q26 L28 Q32 R33 G34	Q26-E30 WeakPolarHBondContact O-CG 3.38Å; Q26-E30 PolarHBondContact O-N 3.17Å; L28-E30 VanDerWaalsContact C-N 3.35Å; E30-Q32 VanDerWaalsContact C-N 3.33Å; E30-Q32 PolarHBondContact O-N 3.22Å; E30-R33 PolarHBondContact O-N 3.48Å; E30-G34 PolarHBondContact O-N 2.91Å
31	R	86.9	Confident	83.4	Confident	174 Å²	174	102.4 Å²	102.4	66%	0.657	49%	0.492	S	S	*	.	H	α-helix	trans	-67.3	-32.2	174	-86.6	177.9	-72.9	173.2	-3.5	112.7	G27 L28 R35	G27-R31 VanDerWaalsContact O-CZ 3.24Å; G27-R31 PolarHBondContact O-NE 3.24Å; G27-R31 PolarHBondContact O-NH2 3.48Å; L28-R31 PolarHBondContact O-N 3.13Å; R31-R35 WeakPolarHBondContact O-CB 3.42Å; R31-R35 PolarHBondContact O-N 2.95Å
32	Q	78.5	Confident	83.8	Confident	103 Å²	103	102.5 Å²	102.5	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-70.1	-43.2	172.3	-73.8	177.6	-15	0	0	111.4	L28 L29 E30 R35 I36	L28-Q32 WeakPolarHBondContact O-CG 3.24Å; L28-Q32 PolarHBondContact O-N 3.21Å; L29-Q32 PolarHBondContact O-N 3.01Å; E30-Q32 VanDerWaalsContact C-N 3.33Å; E30-Q32 PolarHBondContact O-N 3.22Å; Q32-R35 PolarHBondContact O-N 3.48Å; Q32-I36 WeakPolarHBondContact O-CG1 3.36Å; Q32-I36 PolarHBondContact O-N 3.24Å
33	R	84.9	Confident	84	Confident	165 Å²	165	103.2 Å²	103.2	62%	0.623	50%	0.499	S	S	*	.	H	α-helix	trans	-57.6	-55.1	174.7	178.3	-172.3	-65.1	-85.3	1.7	111.6	L29 E30 R35 I36 E37	L29-R33 WeakPolarHBondContact O-CB 3.45Å; L29-R33 PolarHBondContact O-N 3.1Å; E30-R33 PolarHBondContact O-N 3.48Å; R33-R35 PolarHBondContact O-N 3.44Å; R33-I36 WeakPolarHBondContact O-CA 3.38Å; R33-I36 WeakPolarHBondContact O-CB 3.48Å; R33-I36 PolarHBondContact O-N 3.01Å; R33-E37 WeakPolarHBondContact CD-OE1 3.34Å; R33-E37 WeakPolarHBondContact CG-OE1 3.42Å; R33-E37 PolarHBondContact O-N 3.34Å
34	G	86.4	Confident	84.4	Confident	33 Å²	33	100.8 Å²	100.8	34%	0.34	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-30.5	179.3	0	0	0	0	0	113.1	E30 E38	E30-G34 PolarHBondContact O-N 2.91Å; G34-E38 WeakPolarHBondContact O-CB 3.42Å; G34-E38 PolarHBondContact O-N 3.33Å
35	R	85.2	Confident	84.7	Confident	126 Å²	126	100.5 Å²	100.5	48%	0.475	49%	0.49	S	S	.	.	H	α-helix	trans	-76.1	-25.8	174.2	-170.5	56.5	179.4	-168.3	12.5	113.5	R31 Q32 R33 E38 L39	R31-R35 WeakPolarHBondContact O-CB 3.42Å; R31-R35 PolarHBondContact O-N 2.95Å; Q32-R35 PolarHBondContact O-N 3.48Å; R33-R35 PolarHBondContact O-N 3.44Å; R35-E38 WeakPolarHBondContact CD-OE2 3.4Å; R35-E38 IonicContact CZ-OE1 2.73Å; R35-E38 IonicContact CZ-OE2 2.94Å; R35-E38 IonicContact NE-OE2 3.16Å; R35-E38 IonicContact NH1-OE1 2.73Å; R35-E38 PolarHBondContact NH1-OE1 2.87Å; R35-E38 IonicContact NH1-OE2 2.79Å; R35-E38 PolarHBondContact NH1-OE2 3.19Å; R35-E38 IonicContact NH2-OE1 3.64Å; R35-L39 WeakPolarHBondContact O-CD1 3.4Å; R35-L39 VanDerWaalsContact O-CG 3.24Å; R35-L39 WeakPolarHBondContact O-CG 3.49Å; R35-L39 PolarHBondContact O-N 2.84Å
36	I	86.6	Confident	85.2	Confident	92 Å²	92	99.2 Å²	99.2	47%	0.472	49%	0.486	S	S	.	.	H	α-helix	trans	-70.9	-48.6	170.4	-69.6	161.1	0	0	0	109.2	Q32 R33 E38 L39 E40	Q32-I36 WeakPolarHBondContact O-CG1 3.36Å; Q32-I36 PolarHBondContact O-N 3.24Å; R33-I36 WeakPolarHBondContact O-CA 3.38Å; R33-I36 WeakPolarHBondContact O-CB 3.48Å; R33-I36 PolarHBondContact O-N 3.01Å; I36-E38 VanDerWaalsContact C-N 3.31Å; I36-E38 PolarHBondContact O-N 2.96Å; I36-L39 PolarHBondContact O-N 2.84Å; I36-E40 HydrophobicContact CG2-CG 4.26Å; I36-E40 WeakPolarHBondContact O-CG 3.38Å; I36-E40 PolarHBondContact O-N 3.4Å
37	E	87.9	Confident	85.4	Confident	105 Å²	105	97.8 Å²	97.8	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-57.2	-42	177	-67.8	164.4	-172.2	0	0	111.9	R33 L39 E40 Q41	R33-E37 WeakPolarHBondContact CD-OE1 3.34Å; R33-E37 WeakPolarHBondContact CG-OE1 3.42Å; R33-E37 PolarHBondContact O-N 3.34Å; E37-L39 VanDerWaalsContact C-N 3.34Å; E37-L39 PolarHBondContact O-N 3.37Å; E37-E40 PolarHBondContact O-N 3.05Å; E37-Q41 PolarHBondContact O-N 2.86Å; E37-Q41 VanDerWaalsContact O-N 3.08Å
38	E	87.1	Confident	85.5	Confident	84 Å²	84	100 Å²	100	39%	0.393	50%	0.503	S	S	.	.	H	α-helix	trans	-62	-36.9	174.2	-167.9	-166.4	156	0	0	113	G34 R35 I36 Q42	G34-E38 WeakPolarHBondContact O-CB 3.42Å; G34-E38 PolarHBondContact O-N 3.33Å; R35-E38 WeakPolarHBondContact CD-OE2 3.4Å; R35-E38 IonicContact CZ-OE1 2.73Å; R35-E38 IonicContact CZ-OE2 2.94Å; R35-E38 IonicContact NE-OE2 3.16Å; R35-E38 IonicContact NH1-OE1 2.73Å; R35-E38 PolarHBondContact NH1-OE1 2.87Å; R35-E38 IonicContact NH1-OE2 2.79Å; R35-E38 PolarHBondContact NH1-OE2 3.19Å; R35-E38 IonicContact NH2-OE1 3.64Å; I36-E38 VanDerWaalsContact C-N 3.31Å; I36-E38 PolarHBondContact O-N 2.96Å; E38-Q42 WeakPolarHBondContact O-CG 3.49Å; E38-Q42 PolarHBondContact O-N 3.31Å
39	L	80.2	Confident	85.8	Confident	80 Å²	80	101 Å²	101	42%	0.419	51%	0.506	S	S	.	.	H	α-helix	trans	-77.2	-36.4	177.9	-73.1	168.5	0	0	0	112.1	R35 I36 E37 Q41 Q42 V43	R35-L39 WeakPolarHBondContact O-CD1 3.4Å; R35-L39 VanDerWaalsContact O-CG 3.24Å; R35-L39 WeakPolarHBondContact O-CG 3.49Å; R35-L39 PolarHBondContact O-N 2.84Å; I36-L39 PolarHBondContact O-N 2.84Å; E37-L39 VanDerWaalsContact C-N 3.34Å; E37-L39 PolarHBondContact O-N 3.37Å; L39-Q41 VanDerWaalsContact C-N 3.34Å; L39-Q42 PolarHBondContact O-N 3.06Å; L39-V43 WeakPolarHBondContact O-CG2 3.38Å; L39-V43 PolarHBondContact O-N 2.92Å
40	E	83.6	Confident	85.6	Confident	127 Å²	127	99.8 Å²	99.8	59%	0.593	50%	0.5	S	S	*	.	H	α-helix	trans	-64.2	-39.6	175.7	-73	177.6	164.8	0	0	111.2	I36 E37 V43 S44	I36-E40 HydrophobicContact CG2-CG 4.26Å; I36-E40 WeakPolarHBondContact O-CG 3.38Å; I36-E40 PolarHBondContact O-N 3.4Å; E37-E40 PolarHBondContact O-N 3.05Å; E40-V43 PolarHBondContact O-N 3.39Å; E40-S44 PolarHBondContact O-N 3.4Å
41	Q	90.1	Very high	85.7	Confident	108 Å²	108	96.1 Å²	96.1	51%	0.505	49%	0.493	S	S	.	.	H	α-helix	trans	-62.1	-46.9	171.5	-174	62.3	57.1	0	0	111.9	E37 L39 V43 S44 D45	E37-Q41 PolarHBondContact O-N 2.86Å; E37-Q41 VanDerWaalsContact O-N 3.08Å; L39-Q41 VanDerWaalsContact C-N 3.34Å; Q41-V43 VanDerWaalsContact C-N 3.29Å; Q41-V43 PolarHBondContact O-N 3.05Å; Q41-S44 VanDerWaalsContact O-CB 3.3Å; Q41-S44 WeakPolarHBondContact O-CB 3.43Å; Q41-S44 PolarHBondContact O-N 2.89Å; Q41-S44 VanDerWaalsContact O-N 3.08Å; Q41-D45 PolarHBondContact NE2-OD1 3.22Å; Q41-D45 VanDerWaalsContact O-CG 3.28Å; Q41-D45 PolarHBondContact O-N 2.94Å
42	Q	85.6	Confident	85.8	Confident	86 Å²	86	90.9 Å²	90.9	40%	0.402	48%	0.482	S	S	.	.	H	α-helix	trans	-60.6	-37	178	-73.1	169.9	19	0	0	112.6	E38 L39 L46	E38-Q42 WeakPolarHBondContact O-CG 3.49Å; E38-Q42 PolarHBondContact O-N 3.31Å; L39-Q42 PolarHBondContact O-N 3.06Å; Q42-L46 WeakPolarHBondContact O-CB 3.45Å; Q42-L46 VanDerWaalsContact O-CG 3.3Å; Q42-L46 WeakPolarHBondContact O-CG 3.26Å; Q42-L46 PolarHBondContact O-N 3.16Å
43	V	86.8	Confident	86	Confident	89 Å²	89	90 Å²	90	54%	0.539	48%	0.48	S	S	.	.	H	α-helix	trans	-67.2	-39.7	173.9	169.5	0	0	0	0	111.5	L39 E40 Q41 C47	L39-V43 WeakPolarHBondContact O-CG2 3.38Å; L39-V43 PolarHBondContact O-N 2.92Å; E40-V43 PolarHBondContact O-N 3.39Å; Q41-V43 VanDerWaalsContact C-N 3.29Å; Q41-V43 PolarHBondContact O-N 3.05Å; V43-C47 WeakPolarHBondContact O-CB 3.4Å; V43-C47 PolarHBondContact O-N 2.98Å; V43-C47 PolarHBondContact O-SG 3.12Å
44	S	89	Confident	85.9	Confident	69 Å²	69	88.7 Å²	88.7	48%	0.483	48%	0.479	S	S	.	.	H	α-helix	trans	-60.3	-49.3	174.7	-165.1	0	0	0	0	111.7	E40 Q41 L46 C47 A48	E40-S44 PolarHBondContact O-N 3.4Å; Q41-S44 VanDerWaalsContact O-CB 3.3Å; Q41-S44 WeakPolarHBondContact O-CB 3.43Å; Q41-S44 PolarHBondContact O-N 2.89Å; Q41-S44 VanDerWaalsContact O-N 3.08Å; S44-L46 PolarHBondContact O-N 3.18Å; S44-C47 WeakPolarHBondContact O-CB 3.21Å; S44-C47 PolarHBondContact O-N 3.49Å; S44-C47 VanDerWaalsContact O-N 3.11Å; S44-A48 PolarHBondContact O-N 3.22Å
45	D	88.1	Confident	86	Confident	88 Å²	88	91.7 Å²	91.7	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-61.7	-45.2	-179.5	-62	-17.8	0	0	0	111.4	Q41 C47 A48 E49	Q41-D45 PolarHBondContact NE2-OD1 3.22Å; Q41-D45 VanDerWaalsContact O-CG 3.28Å; Q41-D45 PolarHBondContact O-N 2.94Å; D45-C47 VanDerWaalsContact C-N 3.29Å; D45-C47 PolarHBondContact O-N 2.93Å; D45-A48 PolarHBondContact O-N 2.85Å; D45-E49 PolarHBondContact O-N 2.87Å
46	L	84.9	Confident	85.9	Confident	94 Å²	94	91.1 Å²	91.1	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-63.8	-31.7	175.3	-75.5	169.6	0	0	0	112.9	Q42 S44 N50	Q42-L46 WeakPolarHBondContact O-CB 3.45Å; Q42-L46 VanDerWaalsContact O-CG 3.3Å; Q42-L46 WeakPolarHBondContact O-CG 3.26Å; Q42-L46 PolarHBondContact O-N 3.16Å; S44-L46 PolarHBondContact O-N 3.18Å; L46-N50 WeakPolarHBondContact O-CB 3.4Å; L46-N50 PolarHBondContact O-N 2.78Å; L46-N50 PolarHBondContact O-ND2 2.91Å
47	C	84.3	Confident	85.6	Confident	80 Å²	80	93.7 Å²	93.7	54%	0.541	49%	0.492	S	S	.	.	H	α-helix	trans	-70.9	-38	174.7	-72.8	0	0	0	0	111.8	V43 S44 D45 N50 A51	V43-C47 WeakPolarHBondContact O-CB 3.4Å; V43-C47 PolarHBondContact O-N 2.98Å; V43-C47 PolarHBondContact O-SG 3.12Å; S44-C47 WeakPolarHBondContact O-CB 3.21Å; S44-C47 PolarHBondContact O-N 3.49Å; S44-C47 VanDerWaalsContact O-N 3.11Å; D45-C47 VanDerWaalsContact C-N 3.29Å; D45-C47 PolarHBondContact O-N 2.93Å; C47-N50 PolarHBondContact O-N 3.2Å; C47-A51 PolarHBondContact O-N 3.35Å
48	A	87.4	Confident	85.3	Confident	65 Å²	65	95.1 Å²	95.1	54%	0.537	50%	0.498	S	S	.	.	H	α-helix	trans	-65.3	-43.4	173.5	0	0	0	0	0	112	S44 D45 A51 C52	S44-A48 PolarHBondContact O-N 3.22Å; D45-A48 PolarHBondContact O-N 2.85Å; A48-A51 PolarHBondContact O-N 3.35Å; A48-C52 PolarHBondContact O-N 3.24Å
49	E	88.3	Confident	85.1	Confident	111 Å²	111	97.3 Å²	97.3	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-62	-45.2	174.7	-172.8	177.2	-161.8	0	0	111.6	D45 A51 C52 L53	D45-E49 PolarHBondContact O-N 2.87Å; E49-A51 VanDerWaalsContact C-N 3.28Å; E49-A51 PolarHBondContact O-N 3.2Å; E49-C52 WeakPolarHBondContact O-CB 3.45Å; E49-C52 PolarHBondContact O-N 2.69Å; E49-C52 VanDerWaalsContact O-N 3.17Å; E49-L53 HydrophobicContact CG-CD1 4.01Å; E49-L53 HydrophobicContact CG-CG 4.4Å; E49-L53 WeakPolarHBondContact O-CG 3.47Å; E49-L53 PolarHBondContact O-N 3.07Å
50	N	81.6	Confident	85.2	Confident	82 Å²	82	99 Å²	99	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-32.6	176.2	-89.6	-89.1	0	0	0	113.2	L46 C47 K54	L46-N50 WeakPolarHBondContact O-CB 3.4Å; L46-N50 PolarHBondContact O-N 2.78Å; L46-N50 PolarHBondContact O-ND2 2.91Å; C47-N50 PolarHBondContact O-N 3.2Å; N50-K54 WeakPolarHBondContact O-CB 3.35Å; N50-K54 WeakPolarHBondContact O-CD 3.25Å; N50-K54 VanDerWaalsContact O-CG 3.25Å; N50-K54 WeakPolarHBondContact O-CG 3.16Å; N50-K54 PolarHBondContact O-N 3.42Å; N50-K54 VanDerWaalsContact O-N 3.13Å
51	A	86.6	Confident	84.9	Confident	58 Å²	58	96 Å²	96	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-67.3	-46.7	172.9	0	0	0	0	0	111.3	C47 A48 E49 L53 K54 E55	C47-A51 PolarHBondContact O-N 3.35Å; A48-A51 PolarHBondContact O-N 3.35Å; E49-A51 VanDerWaalsContact C-N 3.28Å; E49-A51 PolarHBondContact O-N 3.2Å; A51-L53 PolarHBondContact O-N 2.99Å; A51-K54 PolarHBondContact O-N 3.05Å; A51-E55 PolarHBondContact O-N 3.23Å
52	C	87.9	Confident	84.2	Confident	63 Å²	63	93.2 Å²	93.2	43%	0.426	49%	0.492	S	S	.	.	H	α-helix	trans	-59.6	-45.7	176.7	-174.4	0	0	0	0	112.3	A48 E49 K54 E55 Q56	A48-C52 PolarHBondContact O-N 3.24Å; E49-C52 WeakPolarHBondContact O-CB 3.45Å; E49-C52 PolarHBondContact O-N 2.69Å; E49-C52 VanDerWaalsContact O-N 3.17Å; C52-K54 PolarHBondContact O-N 3.44Å; C52-E55 PolarHBondContact O-N 2.97Å; C52-Q56 PolarHBondContact O-N 3.13Å
53	L	84.8	Confident	83.8	Confident	86 Å²	86	92.6 Å²	92.6	45%	0.45	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-39.5	178	-71.5	171.1	0	0	0	112.6	E49 A51 E55 Q56 Y57	E49-L53 HydrophobicContact CG-CD1 4.01Å; E49-L53 HydrophobicContact CG-CG 4.4Å; E49-L53 WeakPolarHBondContact O-CG 3.47Å; E49-L53 PolarHBondContact O-N 3.07Å; A51-L53 PolarHBondContact O-N 2.99Å; L53-E55 VanDerWaalsContact C-N 3.33Å; L53-E55 PolarHBondContact O-N 3.1Å; L53-Q56 PolarHBondContact O-N 3.29Å; L53-Y57 WeakPolarHBondContact O-CB 3.45Å; L53-Y57 PolarHBondContact O-N 3.39Å
54	K	82.9	Confident	83.2	Confident	137 Å²	137	90.6 Å²	90.6	60%	0.596	48%	0.483	S	S	*	.	H	α-helix	trans	-62.5	-40.3	172.6	-76.9	169.8	-177	172.8	0	111.8	N50 A51 C52 Y57 Q58	N50-K54 WeakPolarHBondContact O-CB 3.35Å; N50-K54 WeakPolarHBondContact O-CD 3.25Å; N50-K54 VanDerWaalsContact O-CG 3.25Å; N50-K54 WeakPolarHBondContact O-CG 3.16Å; N50-K54 PolarHBondContact O-N 3.42Å; N50-K54 VanDerWaalsContact O-N 3.13Å; A51-K54 PolarHBondContact O-N 3.05Å; C52-K54 PolarHBondContact O-N 3.44Å; K54-Y57 PolarHBondContact O-N 3.4Å; K54-Q58 WeakPolarHBondContact O-CG 3.36Å; K54-Q58 PolarHBondContact O-N 2.86Å
55	E	87.6	Confident	82.4	Confident	95 Å²	95	96.3 Å²	96.3	44%	0.444	49%	0.494	S	S	.	.	H	α-helix	trans	-68.5	-40.3	178	-153	-162.3	-168.1	0	0	111.7	A51 C52 L53 Q58 R59	A51-E55 PolarHBondContact O-N 3.23Å; C52-E55 PolarHBondContact O-N 2.97Å; L53-E55 VanDerWaalsContact C-N 3.33Å; L53-E55 PolarHBondContact O-N 3.1Å; E55-Q58 PolarHBondContact O-N 3.19Å; E55-R59 WeakPolarHBondContact O-CG 3.32Å; E55-R59 PolarHBondContact O-N 3.43Å; E55-R59 IonicContact OE1-CZ 2.69Å; E55-R59 IonicContact OE1-NH1 3.83Å; E55-R59 IonicContact OE1-NH2 3.89Å; E55-R59 PolarHBondContact OE1-NH2 2.95Å; E55-R59 IonicContact OE2-CZ 3.87Å; E55-R59 IonicContact OE2-NH1 3.28Å; E55-R59 PolarHBondContact OE2-NH1 3.03Å; E55-R59 IonicContact OE2-NH2 2.94Å; E55-R59 PolarHBondContact OE2-NH2 3.03Å
56	Q	83.6	Confident	81.3	Confident	114 Å²	114	98.3 Å²	98.3	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-60.4	-43.4	170.2	-75.2	-168	-2	0	0	112.2	C52 L53 R59 H60	C52-Q56 PolarHBondContact O-N 3.13Å; L53-Q56 PolarHBondContact O-N 3.29Å; Q56-R59 PolarHBondContact O-N 3.07Å; Q56-H60 WeakPolarHBondContact O-CB 3.38Å; Q56-H60 PolarHBondContact O-N 3.28Å
57	Y	79.3	Confident	80.1	Confident	147 Å²	147	99 Å²	99	58%	0.576	51%	0.508	S	S	*	.	H	α-helix	trans	-63.9	-41.2	177.7	-177.8	-110.9	0	0	0	112.2	L53 K54 H60 L61	L53-Y57 WeakPolarHBondContact O-CB 3.45Å; L53-Y57 PolarHBondContact O-N 3.39Å; K54-Y57 PolarHBondContact O-N 3.4Å; Y57-H60 PolarHBondContact O-N 3.23Å; Y57-L61 HydrophobicContact CD1-CD1 4Å; Y57-L61 HydrophobicContact CE1-CD1 3.53Å; Y57-L61 HydrophobicContact CE1-CG 4.27Å; Y57-L61 HydrophobicContact CE2-CG 4.47Å; Y57-L61 WeakPolarHBondContact O-CG 3.33Å; Y57-L61 PolarHBondContact O-N 2.91Å
58	Q	82	Confident	78.6	Confident	134 Å²	134	102.2 Å²	102.2	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-63.9	-42.4	173.3	-74.8	-178.5	-7.9	0	0	112.4	K54 E55 L61 A62	K54-Q58 WeakPolarHBondContact O-CG 3.36Å; K54-Q58 PolarHBondContact O-N 2.86Å; E55-Q58 PolarHBondContact O-N 3.19Å; Q58-L61 PolarHBondContact O-N 3.38Å; Q58-A62 PolarHBondContact O-N 2.89Å
59	R	83.1	Confident	76.8	Confident	131 Å²	131	101.8 Å²	101.8	49%	0.494	52%	0.517	S	S	.	.	H	α-helix	trans	-59.6	-45	172.4	-72.7	-179.8	-174.9	104.8	-1	111.6	E55 Q56 L61 A62 T63	E55-R59 WeakPolarHBondContact O-CG 3.32Å; E55-R59 PolarHBondContact O-N 3.43Å; E55-R59 IonicContact OE1-CZ 2.69Å; E55-R59 IonicContact OE1-NH1 3.83Å; E55-R59 IonicContact OE1-NH2 3.89Å; E55-R59 PolarHBondContact OE1-NH2 2.95Å; E55-R59 IonicContact OE2-CZ 3.87Å; E55-R59 IonicContact OE2-NH1 3.28Å; E55-R59 PolarHBondContact OE2-NH1 3.03Å; E55-R59 IonicContact OE2-NH2 2.94Å; E55-R59 PolarHBondContact OE2-NH2 3.03Å; Q56-R59 PolarHBondContact O-N 3.07Å; R59-L61 PolarHBondContact O-N 2.98Å; R59-A62 WeakPolarHBondContact O-CB 3.43Å; R59-A62 PolarHBondContact O-N 3.23Å; R59-T63 PolarHBondContact O-N 2.77Å; R59-T63 PolarHBondContact O-OG1 2.7Å; R59-T63 VanDerWaalsContact O-OG1 3.12Å
60	H	81.8	Confident	75	Confident	114 Å²	114	102 Å²	102	53%	0.528	53%	0.526	S	S	.	.	H	α-helix	trans	-60.8	-44.9	177.7	-178.1	68.5	0	0	0	111.9	Q56 Y57 A62 T63 C64	Q56-H60 WeakPolarHBondContact O-CB 3.38Å; Q56-H60 PolarHBondContact O-N 3.28Å; Y57-H60 PolarHBondContact O-N 3.23Å; H60-A62 VanDerWaalsContact C-N 3.32Å; H60-A62 PolarHBondContact O-N 2.93Å; H60-T63 PolarHBondContact O-N 2.71Å; H60-C64 PolarHBondContact O-N 3.42Å; H60-C64 PolarHBondContact O-SG 3.44Å; H60-C64 VanDerWaalsContact O-SG 3.33Å
61	L	77.5	Confident	73.1	Confident	65 Å²	65	102.8 Å²	102.8	34%	0.34	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-36.8	174	-73	175.4	0	0	0	112.9	Y57 Q58 R59 R65	Y57-L61 HydrophobicContact CD1-CD1 4Å; Y57-L61 HydrophobicContact CE1-CD1 3.53Å; Y57-L61 HydrophobicContact CE1-CG 4.27Å; Y57-L61 HydrophobicContact CE2-CG 4.47Å; Y57-L61 WeakPolarHBondContact O-CG 3.33Å; Y57-L61 PolarHBondContact O-N 2.91Å; Q58-L61 PolarHBondContact O-N 3.38Å; R59-L61 PolarHBondContact O-N 2.98Å; L61-R65 WeakPolarHBondContact O-CG 3.49Å; L61-R65 PolarHBondContact O-N 2.87Å; L61-R65 VanDerWaalsContact O-N 3.07Å
62	A	75.9	Confident	70.9	Confident	50 Å²	50	104.7 Å²	104.7	41%	0.413	55%	0.547	S	S	.	.	H	α-helix	trans	-65.6	-44.5	174.1	0	0	0	0	0	111.8	Q58 R59 H60 C64 R65 L66	Q58-A62 PolarHBondContact O-N 2.89Å; R59-A62 WeakPolarHBondContact O-CB 3.43Å; R59-A62 PolarHBondContact O-N 3.23Å; H60-A62 VanDerWaalsContact C-N 3.32Å; H60-A62 PolarHBondContact O-N 2.93Å; A62-C64 PolarHBondContact O-N 3.11Å; A62-R65 PolarHBondContact O-N 3.07Å; A62-L66 PolarHBondContact O-N 3.08Å
63	T	77.6	Confident	68.6	Low	73 Å²	73	109 Å²	109	45%	0.448	57%	0.566	S	S	.	*	H	α-helix	trans	-60.7	-43	174.7	-55.2	0	0	0	0	112	R59 H60 R65 L66 L67	R59-T63 PolarHBondContact O-N 2.77Å; R59-T63 PolarHBondContact O-OG1 2.7Å; R59-T63 VanDerWaalsContact O-OG1 3.12Å; H60-T63 PolarHBondContact O-N 2.71Å; T63-R65 VanDerWaalsContact C-N 3.35Å; T63-R65 PolarHBondContact O-N 3.43Å; T63-L66 PolarHBondContact O-N 3.5Å; T63-L67 HydrophobicContact CG2-CD1 4.18Å; T63-L67 WeakPolarHBondContact O-CG 3.29Å; T63-L67 PolarHBondContact O-N 3.25Å
64	C	72.4	Confident	66.5	Low	47 Å²	47	111.5 Å²	111.5	32%	0.318	58%	0.584	S	S	.	*	H	α-helix	trans	-64.5	-36.5	177.1	-69.7	0	0	0	0	112.7	H60 A62 L67 Q68	H60-C64 PolarHBondContact O-N 3.42Å; H60-C64 PolarHBondContact O-SG 3.44Å; H60-C64 VanDerWaalsContact O-SG 3.33Å; A62-C64 PolarHBondContact O-N 3.11Å; C64-L67 PolarHBondContact O-N 2.91Å; C64-Q68 WeakPolarHBondContact O-CG 3.45Å; C64-Q68 PolarHBondContact O-N 3.18Å; C64-Q68 VanDerWaalsContact O-N 3.09Å
65	R	73.2	Confident	64.2	Low	188 Å²	188	111.4 Å²	111.4	71%	0.709	60%	0.595	S	S	*	*	H	α-helix	trans	-66.5	-40	173.1	-74	172.1	177.8	177.6	-0.8	112.4	L61 A62 T63 Q68 G69	L61-R65 WeakPolarHBondContact O-CG 3.49Å; L61-R65 PolarHBondContact O-N 2.87Å; L61-R65 VanDerWaalsContact O-N 3.07Å; A62-R65 PolarHBondContact O-N 3.07Å; T63-R65 VanDerWaalsContact C-N 3.35Å; T63-R65 PolarHBondContact O-N 3.43Å; R65-Q68 PolarHBondContact O-N 2.98Å; R65-G69 PolarHBondContact O-N 2.91Å; R65-G69 VanDerWaalsContact O-N 3.16Å
66	L	64.1	Low	61.7	Low	130 Å²	130	115.2 Å²	115.2	68%	0.681	62%	0.618	S	S	*	*	H	α-helix	trans	-62.6	-41.8	174.3	-78.4	161.4	0	0	0	111.9	A62 T63 Q68 G69 T70	A62-L66 PolarHBondContact O-N 3.08Å; T63-L66 PolarHBondContact O-N 3.5Å; L66-Q68 PolarHBondContact O-N 3.25Å; L66-G69 PolarHBondContact O-N 3.35Å; L66-G69 VanDerWaalsContact O-N 3.16Å; L66-T70 PolarHBondContact O-N 3.23Å
67	L	59.9	Low	59.1	Low	108 Å²	108	113 Å²	113	57%	0.565	63%	0.626	S	S	*	*	H	α-helix	trans	-66.9	-32.1	176.9	-71.9	167.1	0	0	0	113.4	T63 C64 G69 T70	T63-L67 HydrophobicContact CG2-CD1 4.18Å; T63-L67 WeakPolarHBondContact O-CG 3.29Å; T63-L67 PolarHBondContact O-N 3.25Å; C64-L67 PolarHBondContact O-N 2.91Å; L67-G69 VanDerWaalsContact C-N 3.34Å; L67-T70 PolarHBondContact O-OG1 3.33Å; L67-T70 VanDerWaalsContact O-OG1 3.07Å
68	Q	54	Low	56.9	Low	149 Å²	149	110.6 Å²	110.6	70%	0.696	64%	0.636	S	S	*	*	H	α-helix	trans	-69.5	-31.5	171.7	-74.8	179	-27.7	0	0	112.4	C64 R65 L66 T70	C64-Q68 WeakPolarHBondContact O-CG 3.45Å; C64-Q68 PolarHBondContact O-N 3.18Å; C64-Q68 VanDerWaalsContact O-N 3.09Å; R65-Q68 PolarHBondContact O-N 2.98Å; L66-Q68 PolarHBondContact O-N 3.25Å; Q68-T70 VanDerWaalsContact C-N 3.27Å; Q68-T70 PolarHBondContact O-N 3.23Å
69	G	49	Very low	54.6	Low	56 Å²	56	111.8 Å²	111.8	58%	0.577	65%	0.645	S	S	*	*	H	α-helix	trans	-68.1	-20.4	176.3	0	0	0	0	0	114.9	R65 L66 L67	R65-G69 PolarHBondContact O-N 2.91Å; R65-G69 VanDerWaalsContact O-N 3.16Å; L66-G69 PolarHBondContact O-N 3.35Å; L66-G69 VanDerWaalsContact O-N 3.16Å; L67-G69 VanDerWaalsContact C-N 3.34Å
70	T	49.4	Very low	52	Low	116 Å²	116	112.7 Å²	112.7	71%	0.712	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-3	-177.3	49.8	0	0	0	0	114.8	L66 L67 Q68	L66-T70 PolarHBondContact O-N 3.23Å; L67-T70 PolarHBondContact O-OG1 3.33Å; L67-T70 VanDerWaalsContact O-OG1 3.07Å; Q68-T70 VanDerWaalsContact C-N 3.27Å; Q68-T70 PolarHBondContact O-N 3.23Å
71	S	42.3	Very low	49.6	Very low	98 Å²	98	113.5 Å²	113.5	69%	0.685	66%	0.656	S	S	*	*	S	Bend	trans	-114.9	18.7	-172.2	-167	0	0	0	0	114.2
72	S	39.6	Very low	47.5	Very low	97 Å²	97	117.5 Å²	117.5	68%	0.678	67%	0.673	S	S	*	*			trans	-104.8	13.3	-172.1	55.2	0	0	0	0	114.9
73	L	40.2	Very low	45.5	Very low	155 Å²	155	120.1 Å²	120.1	81%	0.812	68%	0.684	S	S	*	*	S	Bend	trans	-111.6	142.4	165.6	-115.5	79.2	0	0	0	110.3
74	V	40.3	Very low	43.2	Very low	138 Å²	138	122.5 Å²	122.5	84%	0.836	70%	0.698	S	S	*	*	S	Bend	trans	63.7	87.3	-173.5	-165.5	0	0	0	0	111.6
75	T	34.5	Very low	41.2	Very low	135 Å²	135	127.4 Å²	127.4	83%	0.828	72%	0.716	S	S	*	*				-158.8	143.5	73.9	-60.2	0	0	0	0	111.2
76	L	37	Very low	39.2	Very low	175 Å²	175	123 Å²	123	92%	0.916	71%	0.707	S	S	*	*			trans	-126.9	135.8	-178.9	-131.9	173.2	0	0	0	108.8
77	G	27.9	Very low	37.6	Very low	68 Å²	68	124.6 Å²	124.6	70%	0.701	71%	0.708	S	S	*	*			trans	-170.8	36.2	-166.5	0	0	0	0	0	121.1
78	A	32.8	Very low	36.1	Very low	96 Å²	96	125.2 Å²	125.2	79%	0.793	71%	0.712	S	S	*	*			trans	64.2	170.8	166	0	0	0	0	0	116.1
79	I	34.1	Very low	34.8	Very low	159 Å²	159	126.2 Å²	126.2	82%	0.815	72%	0.716	S	S	*	*			cis	-131.4	135.8	11.7	-64.4	171.9	0	0	0	111.9
80	K	28.5	Very low	33.7	Very low	150 Å²	150	133 Å²	133	65%	0.652	73%	0.73	S	S	*	*			trans	2.8	129.8	150.7	-78.1	-165.8	171.7	-80.5	0	120.3
81	E	31.9	Very low	32.7	Very low	130 Å²	130	133.5 Å²	133.5	61%	0.607	73%	0.729	S	S	*	*				77.1	151.1	75.6	-71.4	171.6	-147.9	0	0	113.7
82	H	32.9	Very low	32.8	Very low	149 Å²	149	133.7 Å²	133.7	69%	0.69	73%	0.727	S	S	*	*			cis	-148.8	158	11.8	-112.9	-174	0	0	0	108.9
83	V	33.1	Very low	32.3	Very low	105 Å²	105	134.3 Å²	134.3	64%	0.636	73%	0.727	S	S	*	*			cis	103.5	132.3	31.8	164.4	0	0	0	0	114.5
84	T	31	Very low	31.8	Very low	123 Å²	123	137.3 Å²	137.3	76%	0.755	73%	0.728	S	S	*	*			trans	-176.2	157	153.1	47.7	0	0	0	0	106.7
85	H	30	Very low	31.2	Very low	151 Å²	151	137.7 Å²	137.7	70%	0.699	72%	0.722	S	S	*	*			cis	-176.9	158	-26.9	-99.6	-50.8	0	0	0	105.1
86	D	30.3	Very low	30.9	Very low	96 Å²	96	136 Å²	136	51%	0.513	71%	0.711	S	S	.	*			cis	-164.9	158.2	-0.5	-131	-1.4	0	0	0	111.9
87	K	30	Very low	30.6	Very low	163 Å²	163	137.1 Å²	137.1	71%	0.709	70%	0.704	S	S	*	*			trans	66.1	156.8	142.1	-76.2	168.2	-170.9	143.7	0	121.2
88	L	28.8	Very low	30.7	Very low	121 Å²	121	143.4 Å²	143.4	63%	0.634	71%	0.706	S	S	*	*			cis	-157.7	149.5	10.9	-119.7	156.2	0	0	0	111.9
89	E	26.8	Very low	30.6	Very low	169 Å²	169	147.5 Å²	147.5	79%	0.79	71%	0.709	S	S	*	*			trans	44	155.9	147	-82.9	165.5	-155.8	0	0	124.2
90	F	25.9	Very low	30.4	Very low	199 Å²	199	144.4 Å²	144.4	87%	0.873	71%	0.707	S	S	*	*			cis	-163	172.2	-21.8	-151.8	-105.9	0	0	0	110.9
91	D	28.8	Very low	30.5	Very low	127 Å²	127	142.6 Å²	142.6	68%	0.679	71%	0.713	S	S	*	*			trans	-97.8	157.7	-176.5	-178.7	43.1	0	0	0	113.8
92	P	43.7	Very low	30.5	Very low	101 Å²	101	143.1 Å²	143.1	66%	0.656	72%	0.719	S	S	*	*				-158.2	144.2	105.7	38.7	-17.6	0	0	0	120.9
93	T	29.1	Very low	31.1	Very low	111 Å²	111	141.6 Å²	141.6	68%	0.681	72%	0.722	S	S	*	*			trans	88	119.2	130.9	54.4	0	0	0	0	127.4
94	R	31.1	Very low	31	Very low	217 Å²	217	141.9 Å²	141.9	82%	0.819	72%	0.724	S	S	*	*				90.8	129.3	123	-86.4	-173	161.2	-172.2	-2.4	125.9
95	M	27.3	Very low	30.8	Very low	146 Å²	146	144.7 Å²	144.7	72%	0.719	73%	0.728	S	S	*	*			trans	80.7	145.8	134.4	-75.7	-179	76.2	0	0	121.3
96	V	28.6	Very low	30.7	Very low	99 Å²	99	142 Å²	142	60%	0.6	73%	0.733	S	S	*	*			cis	-168.5	161.5	-14.8	78	0	0	0	0	113.6
97	R	30.7	Very low	30.7	Very low	200 Å²	200	143.7 Å²	143.7	76%	0.755	75%	0.746	S	S	*	*			trans	72.4	157.2	163	-73.2	171.9	-177.1	161.8	0.6	117.6
98	R	29.5	Very low	30.5	Very low	200 Å²	200	144.8 Å²	144.8	76%	0.755	75%	0.754	S	S	*	*			cis	-152	170.6	4	-134	163.5	-173.5	176.6	-0.9	113.6
99	H	31	Very low	30.7	Very low	182 Å²	182	146.4 Å²	146.4	84%	0.843	76%	0.764	S	S	*	*			trans	-58.9	174.3	175.6	-47.2	-103.3	0	0	0	114.5
100	A	29.2	Very low	31.7	Very low	94 Å²	94	144.1 Å²	144.1	78%	0.777	76%	0.763	S	S	*	*			cis	-153.3	-167	15.7	0	0	0	0	0	110.2
101	S	30.5	Very low	31.7	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	76%	0.759	S	S	*	*			cis	-160.7	-168.9	5.8	-154.6	0	0	0	0	111.7
102	L	32.7	Very low	31.8	Very low	142 Å²	142	143.4 Å²	143.4	74%	0.743	77%	0.769	S	S	*	*			trans	-113	165.4	162.9	-66.6	170.8	0	0	0	110.6	V104	L102-V104 HydrophobicContact CB-CG2 4.46Å
103	P	45.7	Very low	31.1	Very low	116 Å²	116	147.2 Å²	147.2	75%	0.753	78%	0.782	S	S	*	*				-128.2	162.7	79.7	41.9	-31.9	0	0	0	112.4
104	V	29.6	Very low	31	Very low	112 Å²	112	145.6 Å²	145.6	68%	0.679	79%	0.788	S	S	*	*			cis	72.2	132.3	39	-177.4	0	0	0	0	111.4	L102	L102-V104 HydrophobicContact CB-CG2 4.46Å
105	E	27.9	Very low	31	Very low	181 Å²	181	141 Å²	141	85%	0.846	79%	0.789	S	S	*	*			cis	-89.8	-136.1	9.8	-50.9	178.5	95.1	0	0	113
106	A	27.9	Very low	31	Very low	95 Å²	95	143.2 Å²	143.2	79%	0.785	80%	0.797	S	S	*	*			cis	-152.2	170.8	8.2	0	0	0	0	0	113.6
107	T	29.4	Very low	30.9	Very low	131 Å²	131	141.9 Å²	141.9	80%	0.804	80%	0.804	S	S	*	*			trans	-92.5	168.1	-177.2	1.9	0	0	0	0	111.9
108	E	27.2	Very low	30.6	Very low	187 Å²	187	137.6 Å²	137.6	87%	0.874	80%	0.803	S	S	*	*			cis	-141.1	178	19.7	-66.7	-171.4	131.9	0	0	114.4
109	N	31	Very low	30.6	Very low	155 Å²	155	136.8 Å²	136.8	83%	0.829	81%	0.805	S	S	*	*			trans	-145.8	162.7	170.9	-133.8	-24.8	0	0	0	106
110	P	49.1	Very low	30.3	Very low	121 Å²	121	139.8 Å²	139.8	79%	0.786	81%	0.809	S	S	*	*			cis	-134.7	-170.8	-0.8	43.2	-25.5	0	0	0	114.3
111	G	26.4	Very low	30.2	Very low	75 Å²	75	141.2 Å²	141.2	77%	0.773	81%	0.808	S	S	*	*			trans	-161.4	145.9	170.7	0	0	0	0	0	115.1
112	R	29.6	Very low	30.2	Very low	236 Å²	236	142.5 Å²	142.5	89%	0.891	81%	0.805	S	S	*	*			trans	-126.9	168.9	178.2	-95.9	-170.6	173.9	-141.7	2.5	111.1
113	L	29.2	Very low	29.9	Very low	180 Å²	180	141.1 Å²	141.1	94%	0.942	80%	0.804	S	S	*	*			trans	73	148.8	176.4	-55.1	111.3	0	0	0	114.3
114	G	27	Very low	29	Very low	77 Å²	77	141.1 Å²	141.1	79%	0.794	81%	0.805	S	S	*	*			cis	-157.5	-173.4	0.5	0	0	0	0	0	112.5
115	S	30.8	Very low	28.8	Very low	120 Å²	120	147.4 Å²	147.4	84%	0.839	82%	0.817	S	S	*	*			trans	-106.7	171.4	174.3	-166.2	0	0	0	0	110.8
116	E	27.6	Very low	28.8	Very low	193 Å²	193	147.3 Å²	147.3	90%	0.902	81%	0.814	S	S	*	*			trans	68.8	145.5	-171.7	-47	-168.7	148.7	0	0	114.4
117	G	27	Very low	28.6	Very low	71 Å²	71	153.6 Å²	153.6	73%	0.732	82%	0.817	S	S	*	*			cis	175.9	-178.4	-5.9	0	0	0	0	0	113.1
118	C	24.8	Very low	28.3	Very low	110 Å²	110	156.3 Å²	156.3	74%	0.743	82%	0.818	S	S	*	*			trans	72.2	105.3	165.3	-95.4	0	0	0	0	122.7
119	K	28.1	Very low	28.3	Very low	184 Å²	184	153 Å²	153	80%	0.8	82%	0.815	S	S	*	*				53.9	102.9	121.6	-58.7	171.6	-169	168	0	121.2
120	R	25.9	Very low	28	Very low	244 Å²	244	149.4 Å²	149.4	92%	0.921	81%	0.807	S	S	*	*				-141.3	125.4	124.3	-74.8	-173.4	-179.3	157.6	1.6	106.6
121	V	26.5	Very low	26.9	Very low	124 Å²	124	149.5 Å²	149.5	75%	0.752	81%	0.811	S	S	*	*				62.9	78.3	54.9	-169.3	0	0	0	0	112.3
122	I	30.9	Very low	26.8	Very low	139 Å²	139	155.8 Å²	155.8	71%	0.713	82%	0.817	S	S	*	*			trans	23.9	126.9	138.5	-55.6	173.6	0	0	0	117.1	C124	I122-C124 HydrophobicContact CG2-CB 4.46Å; I122-C124 VanDerWaalsContact CG2-N 3.31Å
123	P	27.3	Very low	26.6	Very low	113 Å²	113	147.9 Å²	147.9	73%	0.734	81%	0.809	S	S	*	*				-123.4	112	126	34.1	-28.7	0	0	0	112.6	R125	P123-R125 PolarHBondContact O-N 3.24Å; P123-R125 VanDerWaalsContact O-N 3.1Å
124	C	26.5	Very low	26.5	Very low	115 Å²	115	146 Å²	146	78%	0.777	81%	0.805	S	S	*	*			trans	-67	103.8	160.7	-66.3	0	0	0	0	108.7	I122 K126	I122-C124 HydrophobicContact CG2-CB 4.46Å; I122-C124 VanDerWaalsContact CG2-N 3.31Å; C124-K126 PolarHBondContact O-N 2.88Å
125	R	25.8	Very low	26.5	Very low	245 Å²	245	152.1 Å²	152.1	93%	0.925	81%	0.813	S	S	*	*			trans	-84.6	100.8	167.5	-77.2	-163.9	172.2	-148.3	-0.7	110.3	P123	P123-R125 PolarHBondContact O-N 3.24Å; P123-R125 VanDerWaalsContact O-N 3.1Å
126	K	28	Very low	26.4	Very low	179 Å²	179	149.7 Å²	149.7	78%	0.778	81%	0.807	S	S	*	*			trans	-98.8	171.4	164.4	-171.4	177.8	-177.4	-179.5	0	108	C124	C124-K126 PolarHBondContact O-N 2.88Å
127	W	22.9	Very low	26.3	Very low	227 Å²	227	149 Å²	149	86%	0.86	81%	0.809	S	S	*	*			trans	76.7	149.5	-179.3	-57	64.7	0	0	0	113.6
128	K	22.1	Very low	26.2	Very low	188 Å²	188	149 Å²	149	82%	0.817	81%	0.809	S	S	*	*			cis	-121.2	135.5	13.9	-74.6	-177.8	175.6	-175.8	0	114
129	S	27.4	Very low	26.3	Very low	116 Å²	116	155.5 Å²	155.5	81%	0.811	82%	0.818	S	S	*	*			trans	-75.4	146.4	138.3	-51	0	0	0	0	108.1
130	A	24.6	Very low	26.8	Very low	80 Å²	80	152.2 Å²	152.2	66%	0.661	82%	0.815	S	S	*	*			trans	-136.7	104	172.9	0	0	0	0	0	110.2
131	S	25.8	Very low	27	Very low	123 Å²	123	144.6 Å²	144.6	86%	0.86	80%	0.799	S	S	*	*			trans	-79.7	138.5	159.4	-49.1	0	0	0	0	108.4
132	F	25.2	Very low	27.1	Very low	208 Å²	208	147.3 Å²	147.3	91%	0.912	80%	0.804	S	S	*	*			trans	-102.3	155.1	158.6	-82.3	-85.2	0	0	0	109.1
133	G	24.9	Very low	27.1	Very low	69 Å²	69	146.2 Å²	146.2	71%	0.711	81%	0.809	S	S	*	*			trans	-171.6	154.8	175.8	0	0	0	0	0	114.7
134	V	28.3	Very low	27	Very low	142 Å²	142	144 Å²	144	86%	0.861	81%	0.806	S	S	*	*			trans	63.7	92.4	158.6	-165.5	0	0	0	0	117.8
135	E	26.2	Very low	28	Very low	205 Å²	205	145 Å²	145	96%	0.958	81%	0.811	S	S	*	*				-139.7	150.7	118.6	-73.8	-174.7	155.2	0	0	107.3
136	G	27.9	Very low	28.1	Very low	69 Å²	69	138 Å²	138	71%	0.711	80%	0.8	S	S	*	*			cis	160.1	48.2	-10.2	0	0	0	0	0	118.9
137	D	25.9	Very low	28.2	Very low	178 Å²	178	136.9 Å²	136.9	95%	0.952	80%	0.802	S	S	*	*			trans	-164.9	166.7	153.5	-133.7	-34.7	0	0	0	115.2
138	G	24.4	Very low	28.4	Very low	71 Å²	71	133.6 Å²	133.6	73%	0.732	80%	0.801	S	S	*	*			trans	119.3	77.1	162.3	0	0	0	0	0	118.7
139	R	28.1	Very low	28.7	Very low	246 Å²	246	127.6 Å²	127.6	93%	0.928	79%	0.793	S	S	*	*			trans	-121.4	169.2	158.2	-100.3	-171.7	-178.8	-156.6	1.5	108.5
140	P	39.4	Very low	28.6	Very low	115 Å²	115	133.3 Å²	133.3	75%	0.747	80%	0.797	S	S	*	*			cis	-130	-160.7	26.9	45.7	-27.6	0	0	0	112.5
141	S	29.1	Very low	29	Very low	84 Å²	84	134.6 Å²	134.6	59%	0.587	81%	0.807	S	S	*	*			cis	-150.9	154.1	10.7	-132.1	0	0	0	0	112.3
142	E	29.4	Very low	29.2	Very low	181 Å²	181	133.7 Å²	133.7	85%	0.846	79%	0.793	S	S	*	*			trans	43.2	152.1	137.4	-66.2	177.4	137.2	0	0	122.4
143	S	29.9	Very low	29.4	Very low	116 Å²	116	133.9 Å²	133.9	81%	0.811	79%	0.789	S	S	*	*			cis	-153.2	171.8	9.1	39.5	0	0	0	0	112.5
144	G	26.4	Very low	29.5	Very low	66 Å²	66	134 Å²	134	68%	0.68	79%	0.791	S	S	*	*			trans	-103.3	-156.1	161	0	0	0	0	0	111.6
145	P	47.6	Very low	29.6	Very low	137 Å²	137	137 Å²	137	89%	0.89	80%	0.795	S	S	*	*			cis	-134.2	-127.3	12.3	42.2	-21.7	0	0	0	113.6
146	S	27.9	Very low	29.7	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	78%	0.782	S	S	*	*			trans	-120.5	-166.5	-167.9	60.2	0	0	0	0	113.8
147	L	29.7	Very low	30.6	Very low	155 Å²	155	133 Å²	133	81%	0.812	79%	0.786	S	S	*	*			trans	77.4	148.5	-170.7	-46.2	175	0	0	0	111.9
148	D	27.4	Very low	30.8	Very low	157 Å²	157	130 Å²	130	84%	0.84	77%	0.774	S	S	*	*			cis	-131.6	-172.5	8	-103.6	-48.1	0	0	0	109.2
149	G	26.3	Very low	31.1	Very low	63 Å²	63	131.5 Å²	131.5	65%	0.649	77%	0.769	S	S	*	*			cis	147.5	91.2	1.9	0	0	0	0	0	111.4
150	R	26.6	Very low	31.2	Very low	235 Å²	235	128.7 Å²	128.7	89%	0.887	77%	0.766	S	S	*	*			trans	35	99.1	152.4	-167.1	-169.4	-164.6	-166.9	6.4	119.2
151	A	31.9	Very low	30.7	Very low	107 Å²	107	126.3 Å²	126.3	88%	0.884	76%	0.763	S	S	*	*			trans	-110.9	146.1	150.8	0	0	0	0	0	109.9
152	N	29.8	Very low	30.9	Very low	104 Å²	104	128.2 Å²	128.2	56%	0.556	78%	0.776	S	S	*	*			trans	-150.1	160.1	-170.5	-166.5	39.3	0	0	0	112.2
153	Y	29.8	Very low	30.8	Very low	213 Å²	213	123.8 Å²	123.8	84%	0.835	77%	0.77	S	S	*	*			trans	67.7	139.3	-177.4	-42.4	-75.3	0	0	0	114.9
154	G	28	Very low	30.8	Very low	72 Å²	72	126.3 Å²	126.3	74%	0.742	77%	0.773	S	S	*	*			cis	118.2	114.7	-14.2	0	0	0	0	0	115.1
155	Q	30.9	Very low	31.1	Very low	204 Å²	204	128.1 Å²	128.1	95%	0.953	78%	0.775	S	S	*	*			trans	-157.9	144.6	163.1	-108.6	172	4.9	0	0	110.6
156	G	27.3	Very low	31	Very low	67 Å²	67	127.6 Å²	127.6	69%	0.691	77%	0.772	S	S	*	*			trans	-134.6	-138.8	164.3	0	0	0	0	0	107.5
157	P	46.8	Very low	31.3	Very low	123 Å²	123	130 Å²	130	80%	0.799	78%	0.777	S	S	*	*			cis	-137.3	-141	-15.9	23.6	4.1	0	0	0	111.3
158	V	29.3	Very low	31.4	Very low	115 Å²	115	134 Å²	134	70%	0.697	78%	0.781	S	S	*	*			trans	93.1	90.2	148.3	177.1	0	0	0	0	121.2
159	T	30.9	Very low	31.6	Very low	102 Å²	102	135.5 Å²	135.5	63%	0.626	78%	0.781	S	S	*	*				48.5	159.7	123.1	62.8	0	0	0	0	126.4
160	H	31.2	Very low	31.7	Very low	187 Å²	187	140.4 Å²	140.4	87%	0.866	79%	0.792	S	S	*	*			trans	77.1	155.4	163.9	-55.3	-67.1	0	0	0	117.2
161	G	28.5	Very low	31.7	Very low	65 Å²	65	132.3 Å²	132.3	67%	0.67	78%	0.781	S	S	*	*			cis	162.7	124.8	-12.9	0	0	0	0	0	114.9
162	S	32.4	Very low	32.9	Very low	124 Å²	124	133.1 Å²	133.1	87%	0.867	78%	0.778	S	S	*	*			trans	53.3	119.8	156.7	-60.7	0	0	0	0	123.5
163	A	28.8	Very low	32.9	Very low	88 Å²	88	135.1 Å²	135.1	73%	0.727	79%	0.788	S	S	*	*				85.5	138.2	124.6	0	0	0	0	0	124.3
164	I	29.2	Very low	32.9	Very low	169 Å²	169	135.6 Å²	135.6	87%	0.867	79%	0.79	S	S	*	*			trans	82.2	140.5	149.1	-67.7	157.1	0	0	0	120.1
165	S	32.3	Very low	32.9	Very low	104 Å²	104	136 Å²	136	73%	0.727	78%	0.781	S	S	*	*			trans	-83.5	175.3	179.2	-40.3	0	0	0	0	113.7
166	P	45.4	Very low	32.8	Very low	127 Å²	127	135.4 Å²	135.4	83%	0.825	78%	0.778	S	S	*	*				-152	-177.7	94.5	39.9	-21.3	0	0	0	116.4
167	D	35.5	Very low	32.9	Very low	149 Å²	149	135.2 Å²	135.2	80%	0.797	78%	0.776	S	S	*	*			trans	-77.6	161	-179	-59.4	-76.9	0	0	0	116.7
168	R	31	Very low	32	Very low	238 Å²	238	136.5 Å²	136.5	90%	0.898	78%	0.781	S	S	*	*				-174.9	124.5	129.9	-97.6	172.7	-179.7	-137.5	-2.2	109.6
169	F	30.9	Very low	32.3	Very low	189 Å²	189	139.4 Å²	139.4	83%	0.829	79%	0.787	S	S	*	*				77.4	120.3	77.5	-104.2	-88	0	0	0	115.5
170	D	28.8	Very low	32.8	Very low	167 Å²	167	140.1 Å²	140.1	89%	0.893	79%	0.793	S	S	*	*				-175.3	168.2	125.5	-100.7	-15	0	0	0	113.5
171	G	27.3	Very low	32.7	Very low	64 Å²	64	134 Å²	134	66%	0.66	78%	0.781	S	S	*	*			trans	-179.1	-162.8	176.5	0	0	0	0	0	109.2
172	P	56.9	Low	34.2	Very low	124 Å²	124	136.9 Å²	136.9	81%	0.805	79%	0.788	S	S	*	*			cis	-119.9	-154.1	-14.6	42.1	-26.6	0	0	0	110.7
173	L	28.8	Very low	34	Very low	146 Å²	146	140.5 Å²	140.5	76%	0.764	79%	0.791	S	S	*	*			trans	175	133.6	135.1	-92.9	159.8	0	0	0	114.8
174	Y	30.4	Very low	34.2	Very low	224 Å²	224	147.6 Å²	147.6	88%	0.878	80%	0.799	S	S	*	*			trans	62.6	171	161.7	-75.8	-64	0	0	0	122.8
175	S	27.4	Very low	34.8	Very low	81 Å²	81	144.9 Å²	144.9	57%	0.566	79%	0.792	S	S	*	*			trans	-154.6	164.4	-140.5	-174.3	0	0	0	0	114.7
176	H	30.4	Very low	34.6	Very low	190 Å²	190	151.6 Å²	151.6	88%	0.88	80%	0.802	S	S	*	*			trans	67.6	147.8	173.1	-49	-70.3	0	0	0	116.9
177	G	27.9	Very low	34.1	Very low	63 Å²	63	156.9 Å²	156.9	65%	0.649	81%	0.805	S	S	*	*			cis	168.3	-178.1	-7.3	0	0	0	0	0	113.3
178	V	29	Very low	33.7	Very low	151 Å²	151	156 Å²	156	92%	0.915	81%	0.808	S	S	*	*			trans	74.2	139.9	167.3	-173.9	0	0	0	0	117.7
179	Q	35.6	Very low	34.2	Very low	176 Å²	176	154.4 Å²	154.4	82%	0.822	81%	0.807	S	S	*	*			trans	-116.9	147.2	168.4	-146.9	-160.1	91	0	0	108.3
180	P	41.1	Very low	34.2	Very low	116 Å²	116	153.3 Å²	153.3	75%	0.753	81%	0.809	S	S	*	*				-150	173.5	104.5	38.3	-21.4	0	0	0	115
181	G	28.7	Very low	34.3	Very low	59 Å²	59	154 Å²	154	61%	0.608	81%	0.807	S	S	*	*			trans	-98.3	-144.2	163.5	0	0	0	0	0	111.9
182	P	59.4	Low	34.7	Very low	126 Å²	126	158 Å²	158	82%	0.818	81%	0.809	S	S	*	*			cis	-139.6	139.8	-23.6	36.6	-19.4	0	0	0	114.2
183	Q	29.8	Very low	33.5	Very low	200 Å²	200	157.9 Å²	157.9	94%	0.935	81%	0.811	S	S	*	*			trans	-144.3	154.4	168.8	-74.9	-160.7	-2.9	0	0	115.8
184	R	33.3	Very low	33.9	Very low	236 Å²	236	159.6 Å²	159.6	89%	0.891	82%	0.815	S	S	*	*			trans	-106.8	176.1	167.4	-63.3	176.8	175	171.4	-1.6	108.4
185	P	41.3	Very low	34.8	Very low	112 Å²	112	152.4 Å²	152.4	73%	0.727	80%	0.797	S	S	*	*			cis	-135.5	-168.3	-18.9	25.6	-0.8	0	0	0	114.3
186	R	27.6	Very low	35.9	Very low	245 Å²	245	155.1 Å²	155.1	93%	0.925	80%	0.804	S	S	*	*			trans	97.2	159.4	158.4	-62	-168.1	168.7	-164.7	-2.6	118.3
187	R	34.8	Very low	36.7	Very low	238 Å²	238	153.1 Å²	153.1	90%	0.898	80%	0.799	S	S	*	*			trans	-101.1	155.9	-153.5	-71.3	175.8	170.1	161.2	-5.8	114.2
188	P	28.3	Very low	37.7	Very low	130 Å²	130	159.6 Å²	159.6	84%	0.844	80%	0.804	S	S	*	*				-112.6	-175.7	120.6	-11	30	0	0	0	114.5
189	K	39.9	Very low	38.7	Very low	205 Å²	205	159.3 Å²	159.3	89%	0.891	79%	0.79	S	S	*	*			trans	-104.1	139.1	-177.6	-58.5	171	-179.6	173.7	0	112.1
190	L	32.3	Very low	39.4	Very low	166 Å²	166	157.1 Å²	157.1	87%	0.869	78%	0.78	S	S	*	*			trans	-157.1	127.1	154	-87.6	123	0	0	0	106.2
191	Q	30.5	Very low	40	Very low	181 Å²	181	154.6 Å²	154.6	85%	0.846	77%	0.769	S	S	*	*				73.8	101.1	59.4	-81.1	-158.7	-7.5	0	0	116.5
192	H	34.4	Very low	40.9	Very low	150 Å²	150	157.4 Å²	157.4	69%	0.694	77%	0.766	S	S	*	*			trans	50.6	118.9	137	-162.1	88.7	0	0	0	121.1
193	S	33	Very low	40.4	Very low	121 Å²	121	156.2 Å²	156.2	85%	0.846	75%	0.75	S	S	*	*			trans	-144.4	42.2	178.1	56.1	0	0	0	0	115.9
194	Q	37.1	Very low	41.3	Very low	182 Å²	182	151.1 Å²	151.1	85%	0.85	73%	0.726	S	S	*	*			trans	-137.9	70.9	164.7	-72.5	-160.6	7.3	0	0	112.9
195	S	49.4	Very low	42	Very low	73 Å²	73	142.6 Å²	142.6	51%	0.51	71%	0.706	S	S	.	*			trans	-144.3	71.1	176.6	-164.6	0	0	0	0	113.4
196	I	50.3	Low	42.6	Very low	138 Å²	138	141.4 Å²	141.4	71%	0.708	69%	0.692	S	S	*	*	S	Bend	trans	-130.5	-60	167.2	-60.7	-178.5	0	0	0	110	R198 K199 Q200	I196-R198 VanDerWaalsContact C-N 3.25Å; I196-R198 PolarHBondContact O-N 3.36Å; I196-R198 VanDerWaalsContact O-N 3.16Å; I196-K199 PolarHBondContact O-N 3.26Å; I196-K199 VanDerWaalsContact O-N 3.08Å; I196-Q200 PolarHBondContact O-N 2.9Å
197	L	46.8	Very low	43.5	Very low	147 Å²	147	135.8 Å²	135.8	77%	0.77	68%	0.675	S	S	*	*	H	α-helix	trans	-57.8	-32.2	-178.2	-73.9	168.1	0	0	0	114.2	A201	L197-A201 PolarHBondContact O-N 2.72Å
198	R	49.8	Very low	43.9	Very low	200 Å²	200	131.2 Å²	131.2	76%	0.755	66%	0.657	S	S	*	*	H	α-helix	trans	-69.4	-39.6	178	-163.4	171.6	-172.7	155.4	1.3	112.1	I196 Q200 A201 E202	I196-R198 VanDerWaalsContact C-N 3.25Å; I196-R198 PolarHBondContact O-N 3.36Å; I196-R198 VanDerWaalsContact O-N 3.16Å; R198-Q200 PolarHBondContact O-N 3.06Å; R198-A201 PolarHBondContact O-N 2.9Å; R198-E202 WeakPolarHBondContact O-CB 3.03Å; R198-E202 PolarHBondContact O-N 3.27Å; R198-E202 VanDerWaalsContact O-N 3.07Å
199	K	50.3	Low	44.5	Very low	145 Å²	145	128.8 Å²	128.8	63%	0.63	64%	0.644	S	S	*	*	H	α-helix	trans	-67.6	-36.6	-177.8	-160.1	174.5	-174.3	-179.9	0	111.9	I196 E202 E203	I196-K199 PolarHBondContact O-N 3.26Å; I196-K199 VanDerWaalsContact O-N 3.08Å; K199-E202 PolarHBondContact O-N 2.91Å; K199-E203 PolarHBondContact O-N 3.21Å
200	Q	48.4	Very low	44.5	Very low	129 Å²	129	128.2 Å²	128.2	60%	0.603	64%	0.636	S	S	*	*	H	α-helix	trans	-69.5	-38.2	177.1	-162.3	172.1	18.6	0	0	112.5	I196 R198 E202 E204	I196-Q200 PolarHBondContact O-N 2.9Å; R198-Q200 PolarHBondContact O-N 3.06Å; Q200-E202 VanDerWaalsContact C-N 3.35Å; Q200-E204 WeakPolarHBondContact O-CB 3.23Å; Q200-E204 WeakPolarHBondContact O-CG 3.36Å; Q200-E204 PolarHBondContact O-N 3.42Å; Q200-E204 VanDerWaalsContact O-N 3.07Å
201	A	53.6	Low	44.9	Very low	64 Å²	64	124.5 Å²	124.5	53%	0.529	62%	0.624	S	S	.	*	H	α-helix	trans	-68.5	-33.1	173.9	0	0	0	0	0	112.9	L197 R198 A205	L197-A201 PolarHBondContact O-N 2.72Å; R198-A201 PolarHBondContact O-N 2.9Å; A201-A205 PolarHBondContact O-N 3.39Å
202	E	48.8	Very low	45.4	Very low	117 Å²	117	123.4 Å²	123.4	55%	0.547	62%	0.623	S	S	.	*	H	α-helix	trans	-71	-41.2	177	-164.4	158.5	-127.9	0	0	111.6	R198 K199 Q200 A205 I206	R198-E202 WeakPolarHBondContact O-CB 3.03Å; R198-E202 PolarHBondContact O-N 3.27Å; R198-E202 VanDerWaalsContact O-N 3.07Å; K199-E202 PolarHBondContact O-N 2.91Å; Q200-E202 VanDerWaalsContact C-N 3.35Å; E202-A205 WeakPolarHBondContact O-CB 3.41Å; E202-A205 PolarHBondContact O-N 2.89Å; E202-I206 HydrophobicContact CG-CD1 4.4Å; E202-I206 VanDerWaalsContact O-CG1 3.3Å; E202-I206 WeakPolarHBondContact O-CG1 3.34Å; E202-I206 PolarHBondContact O-N 2.99Å
203	E	49.3	Very low	45.8	Very low	101 Å²	101	120 Å²	120	47%	0.472	62%	0.616	S	S	.	*	H	α-helix	trans	-66.6	-39	173.4	-159.5	-170.6	138.1	0	0	112.5	K199 A205 I206 K207	K199-E203 PolarHBondContact O-N 3.21Å; E203-A205 VanDerWaalsContact C-N 3.28Å; E203-A205 PolarHBondContact O-N 2.63Å; E203-I206 PolarHBondContact O-N 3.06Å; E203-K207 WeakPolarHBondContact O-CG 3.41Å; E203-K207 PolarHBondContact O-N 3.47Å; E203-K207 VanDerWaalsContact OE1-CE 3.23Å; E203-K207 WeakPolarHBondContact OE1-CE 3.23Å; E203-K207 IonicContact OE1-NZ 2.72Å; E203-K207 PolarHBondContact OE1-NZ 3.29Å
204	E	48.2	Very low	46.1	Very low	93 Å²	93	123.7 Å²	123.7	44%	0.435	62%	0.62	S	S	.	*	H	α-helix	trans	-61	-32.4	171	-89.5	-88.8	118.7	0	0	113	Q200 R208	Q200-E204 WeakPolarHBondContact O-CB 3.23Å; Q200-E204 WeakPolarHBondContact O-CG 3.36Å; Q200-E204 PolarHBondContact O-N 3.42Å; Q200-E204 VanDerWaalsContact O-N 3.07Å; E204-R208 PolarHBondContact O-N 3.21Å; E204-R208 PolarHBondContact O-NH1 2.83Å; E204-R208 IonicContact OE2-CZ 3.7Å; E204-R208 IonicContact OE2-NH1 3.54Å; E204-R208 PolarHBondContact OE2-NH1 2.82Å; E204-R208 IonicContact OE2-NH2 2.88Å; E204-R208 PolarHBondContact OE2-NH2 3.07Å
205	A	48.6	Very low	46	Very low	57 Å²	57	119.9 Å²	119.9	47%	0.471	61%	0.614	S	S	.	*	H	α-helix	trans	-74.8	-44.7	173.9	0	0	0	0	0	111.6	A201 E202 E203 K207 R208 S209	A201-A205 PolarHBondContact O-N 3.39Å; E202-A205 WeakPolarHBondContact O-CB 3.41Å; E202-A205 PolarHBondContact O-N 2.89Å; E203-A205 VanDerWaalsContact C-N 3.28Å; E203-A205 PolarHBondContact O-N 2.63Å; A205-K207 VanDerWaalsContact C-N 3.29Å; A205-K207 PolarHBondContact O-N 2.88Å; A205-R208 PolarHBondContact O-N 3.34Å; A205-R208 VanDerWaalsContact O-N 3.16Å; A205-S209 PolarHBondContact O-N 3.16Å; A205-S209 PolarHBondContact O-OG 3.38Å
206	I	53.1	Low	45.8	Very low	87 Å²	87	127.5 Å²	127.5	45%	0.446	63%	0.633	S	S	.	*	H	α-helix	trans	-63.3	-33.6	178.3	-68.2	163.5	0	0	0	111.8	E202 E203 S209 R210	E202-I206 HydrophobicContact CG-CD1 4.4Å; E202-I206 VanDerWaalsContact O-CG1 3.3Å; E202-I206 WeakPolarHBondContact O-CG1 3.34Å; E202-I206 PolarHBondContact O-N 2.99Å; E203-I206 PolarHBondContact O-N 3.06Å; I206-S209 WeakPolarHBondContact CA-OG 3.43Å; I206-S209 PolarHBondContact O-OG 2.99Å; I206-S209 VanDerWaalsContact O-OG 3.11Å; I206-R210 PolarHBondContact O-N 3.26Å
207	K	46.1	Very low	45.6	Very low	128 Å²	128	129.2 Å²	129.2	56%	0.557	64%	0.638	S	S	*	*	H	α-helix	trans	-68.7	-38	173.7	-77	172.2	-178.4	168.3	0	112.6	E203 A205	E203-K207 WeakPolarHBondContact O-CG 3.41Å; E203-K207 PolarHBondContact O-N 3.47Å; E203-K207 VanDerWaalsContact OE1-CE 3.23Å; E203-K207 WeakPolarHBondContact OE1-CE 3.23Å; E203-K207 IonicContact OE1-NZ 2.72Å; E203-K207 PolarHBondContact OE1-NZ 3.29Å; A205-K207 VanDerWaalsContact C-N 3.29Å; A205-K207 PolarHBondContact O-N 2.88Å
208	R	42.6	Very low	46	Very low	141 Å²	141	126 Å²	126	53%	0.532	62%	0.621	S	S	.	*	H	α-helix	trans	-75.4	-28	176.5	-71.7	-176.4	-173.1	81.5	-1.3	114.1	E204 A205 R210 S211	E204-R208 PolarHBondContact O-N 3.21Å; E204-R208 PolarHBondContact O-NH1 2.83Å; E204-R208 IonicContact OE2-CZ 3.7Å; E204-R208 IonicContact OE2-NH1 3.54Å; E204-R208 PolarHBondContact OE2-NH1 2.82Å; E204-R208 IonicContact OE2-NH2 2.88Å; E204-R208 PolarHBondContact OE2-NH2 3.07Å; A205-R208 PolarHBondContact O-N 3.34Å; A205-R208 VanDerWaalsContact O-N 3.16Å; R208-R210 VanDerWaalsContact C-N 3.32Å; R208-S211 PolarHBondContact O-OG 3.28Å
209	S	41.5	Very low	46.8	Very low	79 Å²	79	119.5 Å²	119.5	55%	0.552	61%	0.606	S	S	*	*	H	α-helix	trans	-75.4	-20.9	175.3	59.1	0	0	0	0	113.3	A205 I206	A205-S209 PolarHBondContact O-N 3.16Å; A205-S209 PolarHBondContact O-OG 3.38Å; I206-S209 WeakPolarHBondContact CA-OG 3.43Å; I206-S209 PolarHBondContact O-OG 2.99Å; I206-S209 VanDerWaalsContact O-OG 3.11Å
210	R	39.9	Very low	47.3	Very low	194 Å²	194	115.6 Å²	115.6	73%	0.732	60%	0.601	S	S	*	*	S	Bend	trans	-85.6	-11.1	173.6	-72	-177.7	175.3	-174.2	-1.5	114.7	I206 R208	I206-R210 PolarHBondContact O-N 3.26Å; R208-R210 VanDerWaalsContact C-N 3.32Å
211	S	40.4	Very low	48.2	Very low	88 Å²	88	114.9 Å²	114.9	62%	0.615	60%	0.601	S	S	*	*	S	Bend	trans	-99.5	21.8	-178.7	69.1	0	0	0	0	114	R208	R208-S211 PolarHBondContact O-OG 3.28Å
212	L	42.5	Very low	49	Very low	158 Å²	158	115.9 Å²	115.9	83%	0.827	60%	0.597	S	S	*	*	S	Bend	trans	-135.4	14.3	178.3	-79.5	172.8	0	0	0	112.7
213	S	41.2	Very low	49.8	Very low	79 Å²	79	112.3 Å²	112.3	55%	0.552	58%	0.58	S	S	*	*			trans	-124.8	40	-174.8	63.2	0	0	0	0	113
214	E	40.1	Very low	50.9	Low	197 Å²	197	112.7 Å²	112.7	92%	0.921	59%	0.586	S	S	*	*			trans	-122.4	65.6	171.1	-73.3	-165.2	132.8	0	0	110.7
215	S	36.2	Very low	52.3	Low	103 Å²	103	114.6 Å²	114.6	72%	0.72	59%	0.593	S	S	*	*	S	Bend	trans	-147.8	70.9	171.7	64.4	0	0	0	0	111.6
216	Y	43.2	Very low	53.4	Low	232 Å²	232	116.5 Å²	116.5	91%	0.91	59%	0.592	S	S	*	*			trans	37.7	79.8	163.5	-124.4	-84.8	0	0	0	115.8	L218	Y216-L218 PolarHBondContact O-N 3.25Å
217	E	47.5	Very low	54.5	Low	174 Å²	174	114.1 Å²	114.1	81%	0.813	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-63.5	126.8	176	-63.5	-167.2	144.6	0	0	111.3
218	L	55.6	Low	55.9	Low	80 Å²	80	111.5 Å²	111.5	42%	0.419	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-67	136.6	173.9	-74.1	164.8	0	0	0	110	Y216 L222 Q223	Y216-L218 PolarHBondContact O-N 3.25Å; L218-L222 HydrophobicContact CD2-CB 4.44Å; L218-L222 HydrophobicContact CD2-CD1 4Å; L218-Q223 HydrophobicContact CB-CG 4.04Å; L218-Q223 PolarHBondContact O-NE2 2.98Å
219	S	66.6	Low	57.6	Low	64 Å²	64	110.7 Å²	110.7	45%	0.448	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-59.5	151.6	175	60.9	0	0	0	0	111.9	D221 L222 Q223	S219-D221 VanDerWaalsContact C-N 3.29Å; S219-D221 PolarHBondContact O-N 3.5Å; S219-L222 WeakPolarHBondContact O-CB 3.44Å; S219-L222 PolarHBondContact O-N 3.11Å; S219-Q223 PolarHBondContact O-N 3.08Å; S219-Q223 VanDerWaalsContact O-N 3.14Å
220	A	60.9	Low	59.2	Low	62 Å²	62	110.1 Å²	110.1	51%	0.512	57%	0.565	S	S	.	*	H	α-helix	trans	-51.2	-47.2	-177.8	0	0	0	0	0	112.2	L222 Q223 D224	A220-L222 PolarHBondContact O-N 2.99Å; A220-L222 VanDerWaalsContact O-N 3.13Å; A220-Q223 WeakPolarHBondContact O-CA 3.43Å; A220-Q223 WeakPolarHBondContact O-CB 3.48Å; A220-Q223 PolarHBondContact O-N 2.76Å; A220-D224 PolarHBondContact O-N 3.26Å
221	D	66.1	Low	61.3	Low	115 Å²	115	101.4 Å²	101.4	62%	0.615	53%	0.533	S	S	*	.	H	α-helix	trans	-55.8	-30.8	177.5	-51.5	-3.5	0	0	0	114.1	S219 K225	S219-D221 VanDerWaalsContact C-N 3.29Å; S219-D221 PolarHBondContact O-N 3.5Å; D221-K225 WeakPolarHBondContact O-CB 3.47Å; D221-K225 WeakPolarHBondContact O-CD 3.2Å; D221-K225 VanDerWaalsContact O-CG 3.26Å; D221-K225 WeakPolarHBondContact O-CG 3.49Å; D221-K225 PolarHBondContact O-N 3.27Å
222	L	71.7	Confident	63.1	Low	85 Å²	85	105.6 Å²	105.6	45%	0.445	54%	0.535	S	S	.	.	H	α-helix	trans	-81.4	-33.6	175.9	-71.5	173.6	0	0	0	111.8	L218 S219 A220 Q226	L218-L222 HydrophobicContact CD2-CB 4.44Å; L218-L222 HydrophobicContact CD2-CD1 4Å; S219-L222 WeakPolarHBondContact O-CB 3.44Å; S219-L222 PolarHBondContact O-N 3.11Å; A220-L222 PolarHBondContact O-N 2.99Å; A220-L222 VanDerWaalsContact O-N 3.13Å; L222-Q226 WeakPolarHBondContact O-CG 3.29Å; L222-Q226 PolarHBondContact O-N 3.35Å; L222-Q226 VanDerWaalsContact O-N 3.12Å
223	Q	63.9	Low	64.7	Low	41 Å²	41	105.1 Å²	105.1	19%	0.192	53%	0.526	C	S	.	.	H	α-helix	trans	-68.4	-45.7	173.9	-59.3	-172	33.4	0	0	111	L218 S219 A220 K225 Q226 V227	L218-Q223 HydrophobicContact CB-CG 4.04Å; L218-Q223 PolarHBondContact O-NE2 2.98Å; S219-Q223 PolarHBondContact O-N 3.08Å; S219-Q223 VanDerWaalsContact O-N 3.14Å; A220-Q223 WeakPolarHBondContact O-CA 3.43Å; A220-Q223 WeakPolarHBondContact O-CB 3.48Å; A220-Q223 PolarHBondContact O-N 2.76Å; Q223-K225 PolarHBondContact O-N 3.43Å; Q223-Q226 WeakPolarHBondContact O-CB 3.35Å; Q223-Q226 PolarHBondContact O-N 3.15Å; Q223-Q226 VanDerWaalsContact O-N 3.12Å; Q223-V227 PolarHBondContact O-N 2.02Å
224	D	73.7	Confident	65.9	Low	110 Å²	110	107.5 Å²	107.5	59%	0.588	52%	0.524	S	S	*	.	H	α-helix	trans	-62.7	-40.4	176.7	-83.7	-33.6	0	0	0	111.8	A220 Q226 V227 E228	A220-D224 PolarHBondContact O-N 3.26Å; D224-Q226 VanDerWaalsContact C-N 3.32Å; D224-Q226 PolarHBondContact O-N 3.25Å; D224-V227 PolarHBondContact O-N 3.42Å; D224-E228 WeakPolarHBondContact O-CB 3.39Å; D224-E228 PolarHBondContact O-N 3.45Å
225	K	76.9	Confident	67.8	Low	133 Å²	133	100.8 Å²	100.8	58%	0.578	51%	0.507	S	S	*	.	H	α-helix	trans	-63.1	-34	172.7	-79.6	173.2	179.8	170	0	113.2	D221 Q223 M229	D221-K225 WeakPolarHBondContact O-CB 3.47Å; D221-K225 WeakPolarHBondContact O-CD 3.2Å; D221-K225 VanDerWaalsContact O-CG 3.26Å; D221-K225 WeakPolarHBondContact O-CG 3.49Å; D221-K225 PolarHBondContact O-N 3.27Å; Q223-K225 PolarHBondContact O-N 3.43Å; K225-M229 WeakPolarHBondContact O-CB 3.34Å; K225-M229 PolarHBondContact O-N 3.12Å
226	Q	72.1	Confident	69.7	Low	96 Å²	96	97.2 Å²	97.2	45%	0.449	49%	0.487	S	S	.	.	H	α-helix	trans	-68.2	-41.6	172.6	-75.7	-177.7	9.9	0	0	111.9	L222 Q223 D224 M229 L230	L222-Q226 WeakPolarHBondContact O-CG 3.29Å; L222-Q226 PolarHBondContact O-N 3.35Å; L222-Q226 VanDerWaalsContact O-N 3.12Å; Q223-Q226 WeakPolarHBondContact O-CB 3.35Å; Q223-Q226 PolarHBondContact O-N 3.15Å; Q223-Q226 VanDerWaalsContact O-N 3.12Å; D224-Q226 VanDerWaalsContact C-N 3.32Å; D224-Q226 PolarHBondContact O-N 3.25Å; Q226-M229 PolarHBondContact O-N 3.35Å; Q226-L230 WeakPolarHBondContact O-CG 3.34Å; Q226-L230 PolarHBondContact O-N 3.35Å
227	V	75.1	Confident	71.2	Confident	38 Å²	38	92.2 Å²	92.2	23%	0.23	47%	0.466	C	S	.	.	H	α-helix	trans	-61.7	-46.5	173.7	173.9	0	0	0	0	110.5	P8 Q223 D224 M229 L230 E231	P8-V227 HydrophobicContact CB-CG2 4.23Å; Q223-V227 PolarHBondContact O-N 2.02Å; D224-V227 PolarHBondContact O-N 3.42Å; V227-M229 VanDerWaalsContact C-N 3.32Å; V227-M229 PolarHBondContact O-N 2.76Å; V227-L230 PolarHBondContact O-N 2.84Å; V227-E231 HydrophobicContact CG1-CG 4.32Å; V227-E231 WeakPolarHBondContact O-CB 3.29Å; V227-E231 VanDerWaalsContact O-CG 3.26Å; V227-E231 WeakPolarHBondContact O-CG 3.41Å; V227-E231 PolarHBondContact O-N 3.31Å
228	E	77.4	Confident	72.3	Confident	72 Å²	72	92.9 Å²	92.9	34%	0.336	47%	0.467	S	S	.	.	H	α-helix	trans	-63.2	-35.4	178.7	-155.2	-160.7	153.8	0	0	112.6	D224 R232	D224-E228 WeakPolarHBondContact O-CB 3.39Å; D224-E228 PolarHBondContact O-N 3.45Å; E228-R232 PolarHBondContact O-N 3.23Å; E228-R232 IonicContact OE1-CZ 3.14Å; E228-R232 IonicContact OE1-NH1 3.15Å; E228-R232 PolarHBondContact OE1-NH1 3.46Å; E228-R232 IonicContact OE1-NH2 2.71Å; E228-R232 PolarHBondContact OE1-NH2 3.44Å; E228-R232 IonicContact OE2-NH1 3.46Å
229	M	78.3	Confident	73	Confident	124 Å²	124	94.1 Å²	94.1	61%	0.611	47%	0.473	S	S	*	.	H	α-helix	trans	-71	-39.1	174.7	-166.6	-171.5	74.6	0	0	112.2	K225 Q226 V227 R232 K233	K225-M229 WeakPolarHBondContact O-CB 3.34Å; K225-M229 PolarHBondContact O-N 3.12Å; Q226-M229 PolarHBondContact O-N 3.35Å; V227-M229 VanDerWaalsContact C-N 3.32Å; V227-M229 PolarHBondContact O-N 2.76Å; M229-R232 PolarHBondContact O-N 2.94Å; M229-K233 WeakPolarHBondContact O-CB 3.5Å; M229-K233 PolarHBondContact O-N 3.44Å
230	L	75.1	Confident	73.5	Confident	68 Å²	68	92.1 Å²	92.1	36%	0.356	46%	0.458	S	S	.	.	H	α-helix	trans	-64.6	-42.2	172.5	-73	168	0	0	0	111.2	Q226 V227 R232 K233 Y234 T240	Q226-L230 WeakPolarHBondContact O-CG 3.34Å; Q226-L230 PolarHBondContact O-N 3.35Å; V227-L230 PolarHBondContact O-N 2.84Å; L230-R232 VanDerWaalsContact C-N 3.34Å; L230-R232 PolarHBondContact O-N 3.38Å; L230-K233 PolarHBondContact O-N 3.02Å; L230-K233 VanDerWaalsContact O-N 3.1Å; L230-Y234 HydrophobicContact CD2-CD2 4.25Å; L230-Y234 HydrophobicContact CD2-CE2 3.82Å; L230-Y234 PolarHBondContact O-N 3.48Å; L230-T240 HydrophobicContact CB-CG2 4.34Å; L230-T240 PolarHBondContact O-OG1 2.95Å
231	E	83.2	Confident	74.3	Confident	10 Å²	10	94.6 Å²	94.6	5%	0.047	45%	0.454	C	S	.	.	H	α-helix	trans	-61.7	-38.2	175.3	-72.5	176	168.7	0	0	112.2	V227 G236 R237 T240 R241	V227-E231 HydrophobicContact CG1-CG 4.32Å; V227-E231 WeakPolarHBondContact O-CB 3.29Å; V227-E231 VanDerWaalsContact O-CG 3.26Å; V227-E231 WeakPolarHBondContact O-CG 3.41Å; V227-E231 PolarHBondContact O-N 3.31Å; E231-G236 CarbonylContact O-C 3.36Å; E231-G236 WeakPolarHBondContact O-CA 3.3Å; E231-G236 PolarHBondContact O-N 3.22Å; E231-R237 HydrophobicContact CG-CB 4.42Å; E231-R237 IonicContact OE1-CZ 2.71Å; E231-R237 IonicContact OE1-NE 3.72Å; E231-R237 PolarHBondContact OE1-NE 3.27Å; E231-R237 IonicContact OE1-NH2 3.13Å; E231-R237 IonicContact OE2-CZ 2.75Å; E231-R237 IonicContact OE2-NE 3.27Å; E231-R237 PolarHBondContact OE2-NE 3.36Å; E231-R237 IonicContact OE2-NH2 3.19Å; E231-R237 PolarHBondContact OE2-NH2 3Å; E231-T240 WeakPolarHBondContact CA-OG1 3.4Å; E231-T240 HydrophobicContact CG-CG2 4.19Å; E231-R241 IonicContact OE1-CZ 3.55Å; E231-R241 IonicContact OE1-NE 2.69Å; E231-R241 PolarHBondContact OE1-NE 3.4Å; E231-R241 IonicContact OE1-NH2 2.61Å; E231-R241 PolarHBondContact OE1-NH2 3.18Å; E231-R241 IonicContact OE2-NH2 2.73Å
232	R	77.4	Confident	74.2	Confident	177 Å²	177	95.3 Å²	95.3	67%	0.668	45%	0.453	S	S	*	.	H	α-helix	trans	-67.5	-38.8	170.1	-75.5	-169.3	-177.9	83.5	4.1	112.9	E228 M229 L230	E228-R232 PolarHBondContact O-N 3.23Å; E228-R232 IonicContact OE1-CZ 3.14Å; E228-R232 IonicContact OE1-NH1 3.15Å; E228-R232 PolarHBondContact OE1-NH1 3.46Å; E228-R232 IonicContact OE1-NH2 2.71Å; E228-R232 PolarHBondContact OE1-NH2 3.44Å; E228-R232 IonicContact OE2-NH1 3.46Å; M229-R232 PolarHBondContact O-N 2.94Å; L230-R232 VanDerWaalsContact C-N 3.34Å; L230-R232 PolarHBondContact O-N 3.38Å
233	K	76.9	Confident	73.9	Confident	147 Å²	147	93.3 Å²	93.3	64%	0.639	45%	0.449	S	S	*	.	H	α-helix	trans	-73.3	-31.5	-174	-170.9	172.3	-179.5	-179.8	0	113.9	M229 L230	M229-K233 WeakPolarHBondContact O-CB 3.5Å; M229-K233 PolarHBondContact O-N 3.44Å; L230-K233 PolarHBondContact O-N 3.02Å; L230-K233 VanDerWaalsContact O-N 3.1Å
234	Y	67.1	Low	74.2	Confident	130 Å²	130	93.2 Å²	93.2	51%	0.51	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	52.7	-174.1	-60.5	-72.4	0	0	0	113.1	L230 G236 T240	L230-Y234 HydrophobicContact CD2-CD2 4.25Å; L230-Y234 HydrophobicContact CD2-CE2 3.82Å; L230-Y234 PolarHBondContact O-N 3.48Å; Y234-G236 PolarHBondContact O-N 2.96Å; Y234-T240 WeakPolarHBondContact CB-OG1 3.18Å; Y234-T240 PolarHBondContact O-OG1 3.43Å
235	G	78.6	Confident	74.1	Confident	55 Å²	55	96.4 Å²	96.4	57%	0.567	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	20.9	167	0	0	0	0	0	115.9	I239	G235-I239 WeakPolarHBondContact O-CD1 3.29Å; G235-I239 WeakPolarHBondContact O-CG1 3.25Å
236	G	77.6	Confident	73.8	Confident	28 Å²	28	93.7 Å²	93.7	29%	0.289	45%	0.454	S	S	.	.	H	α-helix	trans	96.5	167.8	174.2	0	0	0	0	0	114.8	E231 Y234 F238 I239 T240	E231-G236 CarbonylContact O-C 3.36Å; E231-G236 WeakPolarHBondContact O-CA 3.3Å; E231-G236 PolarHBondContact O-N 3.22Å; Y234-G236 PolarHBondContact O-N 2.96Å; G236-F238 VanDerWaalsContact C-N 3.25Å; G236-F238 PolarHBondContact O-N 2.73Å; G236-F238 VanDerWaalsContact O-N 3.13Å; G236-I239 PolarHBondContact O-N 3.02Å; G236-T240 PolarHBondContact O-N 3.4Å; G236-T240 PolarHBondContact O-OG1 2.94Å
237	R	73.9	Confident	73.7	Confident	128 Å²	128	93.3 Å²	93.3	48%	0.483	45%	0.454	S	S	.	.	H	α-helix	trans	-52	-36.5	-174.8	177.1	159.9	-74.7	-157	-7.7	114.1	E231 R241	E231-R237 HydrophobicContact CG-CB 4.42Å; E231-R237 IonicContact OE1-CZ 2.71Å; E231-R237 IonicContact OE1-NE 3.72Å; E231-R237 PolarHBondContact OE1-NE 3.27Å; E231-R237 IonicContact OE1-NH2 3.13Å; E231-R237 IonicContact OE2-CZ 2.75Å; E231-R237 IonicContact OE2-NE 3.27Å; E231-R237 PolarHBondContact OE2-NE 3.36Å; E231-R237 IonicContact OE2-NH2 3.19Å; E231-R237 PolarHBondContact OE2-NH2 3Å; R237-R241 VanDerWaalsContact O-CB 3.25Å; R237-R241 WeakPolarHBondContact O-CB 3.11Å; R237-R241 VanDerWaalsContact O-CD 3.31Å; R237-R241 WeakPolarHBondContact O-CD 3.43Å; R237-R241 WeakPolarHBondContact O-CG 3.42Å; R237-R241 PolarHBondContact O-N 3.3Å
238	F	71	Confident	73.1	Confident	187 Å²	187	94.7 Å²	94.7	82%	0.82	46%	0.458	S	S	*	.	H	α-helix	trans	-75.9	-48.7	178.1	-81	-86.4	0	0	0	113	G236 R241 H242	G236-F238 VanDerWaalsContact C-N 3.25Å; G236-F238 PolarHBondContact O-N 2.73Å; G236-F238 VanDerWaalsContact O-N 3.13Å; F238-R241 PolarHBondContact O-N 2.94Å; F238-H242 VanDerWaalsContact O-CB 3.27Å; F238-H242 WeakPolarHBondContact O-CB 3.32Å; F238-H242 PolarHBondContact O-N 2.79Å
239	I	68.9	Low	72.4	Confident	107 Å²	107	94.8 Å²	94.8	55%	0.549	46%	0.463	S	S	.	.	H	α-helix	trans	-65	-46.9	-178	-59.7	-173.6	0	0	0	110.4	G235 G236 R241 H242 A243	G235-I239 WeakPolarHBondContact O-CD1 3.29Å; G235-I239 WeakPolarHBondContact O-CG1 3.25Å; G236-I239 PolarHBondContact O-N 3.02Å; I239-R241 VanDerWaalsContact C-N 3.34Å; I239-R241 PolarHBondContact O-N 2.97Å; I239-H242 PolarHBondContact O-N 2.92Å; I239-A243 WeakPolarHBondContact O-CB 3.24Å; I239-A243 PolarHBondContact O-N 2.8Å
240	T	77.9	Confident	71.6	Confident	22 Å²	22	91.4 Å²	91.4	14%	0.135	46%	0.455	C	S	.	.	H	α-helix	trans	-62.4	-40.1	179.7	-56.4	0	0	0	0	111.9	L230 E231 Y234 G236 A244	L230-T240 HydrophobicContact CB-CG2 4.34Å; L230-T240 PolarHBondContact O-OG1 2.95Å; E231-T240 WeakPolarHBondContact CA-OG1 3.4Å; E231-T240 HydrophobicContact CG-CG2 4.19Å; Y234-T240 WeakPolarHBondContact CB-OG1 3.18Å; Y234-T240 PolarHBondContact O-OG1 3.43Å; G236-T240 PolarHBondContact O-N 3.4Å; G236-T240 PolarHBondContact O-OG1 2.94Å; T240-A244 VanDerWaalsContact O-CB 3.23Å; T240-A244 WeakPolarHBondContact O-CB 3.15Å; T240-A244 PolarHBondContact O-N 3.26Å
241	R	77.3	Confident	71.2	Confident	114 Å²	114	91 Å²	91	43%	0.43	45%	0.451	S	S	.	.	H	α-helix	trans	-73.9	-32.7	176	-70.4	176.8	-172.4	-154.2	-4.1	113.2	E231 R237 F238 I239 R245	E231-R241 IonicContact OE1-CZ 3.55Å; E231-R241 IonicContact OE1-NE 2.69Å; E231-R241 PolarHBondContact OE1-NE 3.4Å; E231-R241 IonicContact OE1-NH2 2.61Å; E231-R241 PolarHBondContact OE1-NH2 3.18Å; E231-R241 IonicContact OE2-NH2 2.73Å; R237-R241 VanDerWaalsContact O-CB 3.25Å; R237-R241 WeakPolarHBondContact O-CB 3.11Å; R237-R241 VanDerWaalsContact O-CD 3.31Å; R237-R241 WeakPolarHBondContact O-CD 3.43Å; R237-R241 WeakPolarHBondContact O-CG 3.42Å; R237-R241 PolarHBondContact O-N 3.3Å; F238-R241 PolarHBondContact O-N 2.94Å; I239-R241 VanDerWaalsContact C-N 3.34Å; I239-R241 PolarHBondContact O-N 2.97Å; R241-R245 WeakPolarHBondContact O-CB 3.23Å; R241-R245 VanDerWaalsContact O-CG 3.27Å; R241-R245 WeakPolarHBondContact O-CG 3.31Å; R241-R245 PolarHBondContact O-N 3.19Å
242	H	63.8	Low	70.6	Confident	129 Å²	129	97 Å²	97	60%	0.597	47%	0.473	S	S	*	.	H	α-helix	trans	-67.9	-49	174.3	-176.2	80.5	0	0	0	110.2	F238 I239 A244 R245 T246	F238-H242 VanDerWaalsContact O-CB 3.27Å; F238-H242 WeakPolarHBondContact O-CB 3.32Å; F238-H242 PolarHBondContact O-N 2.79Å; I239-H242 PolarHBondContact O-N 2.92Å; H242-A244 VanDerWaalsContact C-N 3.35Å; H242-A244 PolarHBondContact O-N 3.25Å; H242-R245 PolarHBondContact O-N 2.82Å; H242-R245 VanDerWaalsContact O-N 3.16Å; H242-T246 WeakPolarHBondContact O-CB 3.33Å; H242-T246 PolarHBondContact O-N 3.45Å; H242-T246 PolarHBondContact O-OG1 2.98Å; H242-T246 VanDerWaalsContact O-OG1 3.08Å
243	A	66.7	Low	69.7	Low	43 Å²	43	94.1 Å²	94.1	36%	0.355	47%	0.467	S	S	.	.	H	α-helix	trans	-56.9	-45.7	172.5	0	0	0	0	0	111.9	I239 R245 T246 I247	I239-A243 WeakPolarHBondContact O-CB 3.24Å; I239-A243 PolarHBondContact O-N 2.8Å; A243-R245 PolarHBondContact O-N 3.24Å; A243-T246 PolarHBondContact O-N 2.92Å; A243-I247 WeakPolarHBondContact O-CB 3.22Å; A243-I247 VanDerWaalsContact O-CG1 3.27Å; A243-I247 WeakPolarHBondContact O-CG1 3.48Å; A243-I247 PolarHBondContact O-N 3.47Å
244	A	69.6	Low	69.6	Low	40 Å²	40	93 Å²	93	33%	0.331	46%	0.46	S	S	.	.	H	α-helix	trans	-60.1	-44.1	175.1	0	0	0	0	0	112.2	T240 H242 I247 Q248	T240-A244 VanDerWaalsContact O-CB 3.23Å; T240-A244 WeakPolarHBondContact O-CB 3.15Å; T240-A244 PolarHBondContact O-N 3.26Å; H242-A244 VanDerWaalsContact C-N 3.35Å; H242-A244 PolarHBondContact O-N 3.25Å; A244-I247 PolarHBondContact O-N 2.89Å; A244-Q248 VanDerWaalsContact O-CB 3.22Å; A244-Q248 WeakPolarHBondContact O-CB 2.96Å; A244-Q248 WeakPolarHBondContact O-CG 3.43Å; A244-Q248 PolarHBondContact O-N 3.02Å; A244-Q248 PolarHBondContact O-OE1 3.48Å
245	R	71.8	Confident	69.7	Low	177 Å²	177	89.5 Å²	89.5	67%	0.668	45%	0.448	S	S	*	.	H	α-helix	trans	-65.4	-38.4	175.6	-78.8	175.2	174.8	-174.8	-2	112.8	R241 H242 A243 Q248 T249	R241-R245 WeakPolarHBondContact O-CB 3.23Å; R241-R245 VanDerWaalsContact O-CG 3.27Å; R241-R245 WeakPolarHBondContact O-CG 3.31Å; R241-R245 PolarHBondContact O-N 3.19Å; H242-R245 PolarHBondContact O-N 2.82Å; H242-R245 VanDerWaalsContact O-N 3.16Å; A243-R245 PolarHBondContact O-N 3.24Å; R245-Q248 PolarHBondContact O-N 3.32Å; R245-T249 VanDerWaalsContact O-CB 3.23Å; R245-T249 WeakPolarHBondContact O-CB 3.14Å; R245-T249 PolarHBondContact O-N 3.1Å; R245-T249 PolarHBondContact O-OG1 3.3Å
246	T	70.1	Confident	68.9	Low	75 Å²	75	91.6 Å²	91.6	46%	0.46	44%	0.444	S	S	.	.	H	α-helix	trans	-68.2	-43.9	176.6	-61.2	0	0	0	0	110.6	H242 A243 T249 A250	H242-T246 WeakPolarHBondContact O-CB 3.33Å; H242-T246 PolarHBondContact O-N 3.45Å; H242-T246 PolarHBondContact O-OG1 2.98Å; H242-T246 VanDerWaalsContact O-OG1 3.08Å; A243-T246 PolarHBondContact O-N 2.92Å; T246-T249 PolarHBondContact O-N 3.28Å; T246-A250 VanDerWaalsContact O-CB 3.29Å; T246-A250 WeakPolarHBondContact O-CB 3.33Å; T246-A250 PolarHBondContact O-N 3.23Å
247	I	71.1	Confident	68.4	Low	89 Å²	89	94.7 Å²	94.7	46%	0.456	45%	0.454	S	S	.	.	H	α-helix	trans	-65.7	-41.2	174	-67.1	164.6	0	0	0	111	A243 A244 T249 F251	A243-I247 WeakPolarHBondContact O-CB 3.22Å; A243-I247 VanDerWaalsContact O-CG1 3.27Å; A243-I247 WeakPolarHBondContact O-CG1 3.48Å; A243-I247 PolarHBondContact O-N 3.47Å; A244-I247 PolarHBondContact O-N 2.89Å; I247-T249 VanDerWaalsContact C-N 3.33Å; I247-T249 PolarHBondContact O-N 2.92Å; I247-F251 WeakPolarHBondContact O-CA 3.42Å; I247-F251 WeakPolarHBondContact O-CB 3.45Å; I247-F251 PolarHBondContact O-N 3.47Å
248	Q	60.8	Low	68.3	Low	67 Å²	67	92.3 Å²	92.3	31%	0.313	45%	0.447	S	S	.	.	H	α-helix	trans	-63.6	-37.7	172.9	-77.3	168.9	-24.3	0	0	111.8	A244 R245 R252	A244-Q248 VanDerWaalsContact O-CB 3.22Å; A244-Q248 WeakPolarHBondContact O-CB 2.96Å; A244-Q248 WeakPolarHBondContact O-CG 3.43Å; A244-Q248 PolarHBondContact O-N 3.02Å; A244-Q248 PolarHBondContact O-OE1 3.48Å; R245-Q248 PolarHBondContact O-N 3.32Å; Q248-R252 VanDerWaalsContact O-CB 3.24Å; Q248-R252 WeakPolarHBondContact O-CB 3.44Å; Q248-R252 VanDerWaalsContact O-CG 3.26Å; Q248-R252 WeakPolarHBondContact O-CG 2.96Å; Q248-R252 PolarHBondContact O-N 3.45Å
249	T	63.3	Low	67.9	Low	73 Å²	73	87.1 Å²	87.1	45%	0.448	43%	0.428	S	S	.	.	H	α-helix	trans	-72.5	-44.6	178.6	-58.7	0	0	0	0	110.8	R245 T246 I247 F251 R252 Q253	R245-T249 VanDerWaalsContact O-CB 3.23Å; R245-T249 WeakPolarHBondContact O-CB 3.14Å; R245-T249 PolarHBondContact O-N 3.1Å; R245-T249 PolarHBondContact O-OG1 3.3Å; T246-T249 PolarHBondContact O-N 3.28Å; I247-T249 VanDerWaalsContact C-N 3.33Å; I247-T249 PolarHBondContact O-N 2.92Å; T249-F251 VanDerWaalsContact C-N 3.33Å; T249-F251 PolarHBondContact O-N 3.37Å; T249-R252 PolarHBondContact O-N 2.97Å; T249-Q253 WeakPolarHBondContact O-CB 3.15Å; T249-Q253 PolarHBondContact O-N 2.95Å
250	A	61.7	Low	67.3	Low	53 Å²	53	87.4 Å²	87.4	44%	0.438	43%	0.426	S	S	.	.	H	α-helix	trans	-65.1	-34.5	173.2	0	0	0	0	0	112.1	T246 Y254	T246-A250 VanDerWaalsContact O-CB 3.29Å; T246-A250 WeakPolarHBondContact O-CB 3.33Å; T246-A250 PolarHBondContact O-N 3.23Å; A250-Y254 VanDerWaalsContact O-CB 3.25Å; A250-Y254 WeakPolarHBondContact O-CB 3.4Å; A250-Y254 PolarHBondContact O-N 3.02Å
251	F	65.9	Low	66.3	Low	61 Å²	61	90.9 Å²	90.9	27%	0.268	44%	0.44	S	S	.	.	H	α-helix	trans	-77.9	-34.1	175.4	-171.2	-103.6	0	0	0	112.5	Y14 I247 T249 Y254 Q255	Y14-F251 AromaticContact CD1-CE1 4Å; Y14-F251 HydrophobicContact CD1-CE1 4Å; Y14-F251 HydrophobicContact CD1-CE2 4.27Å; Y14-F251 AromaticContact CD1-CZ 3.61Å; Y14-F251 HydrophobicContact CD1-CZ 3.61Å; Y14-F251 HydrophobicContact CD2-CE1 4.2Å; Y14-F251 AromaticContact CE1-CE1 3.6Å; Y14-F251 HydrophobicContact CE1-CE1 3.6Å; Y14-F251 HydrophobicContact CE1-CE2 4.41Å; Y14-F251 AromaticContact CE1-CZ 3.37Å; Y14-F251 HydrophobicContact CE1-CZ 3.37Å; Y14-F251 HydrophobicContact CE2-CD1 4.47Å; Y14-F251 AromaticContact CE2-CE1 3.82Å; Y14-F251 HydrophobicContact CE2-CE1 3.82Å; Y14-F251 HydrophobicContact CE2-CZ 4.41Å; Y14-F251 HydrophobicContact CG-CE1 4.3Å; Y14-F251 HydrophobicContact CG-CZ 4.26Å; Y14-F251 AromaticContact CZ-CE1 3.5Å; Y14-F251 VanDerWaalsContact CZ-CE1 3.5Å; Y14-F251 AromaticContact CZ-CZ 3.81Å; I247-F251 WeakPolarHBondContact O-CA 3.42Å; I247-F251 WeakPolarHBondContact O-CB 3.45Å; I247-F251 PolarHBondContact O-N 3.47Å; T249-F251 VanDerWaalsContact C-N 3.33Å; T249-F251 PolarHBondContact O-N 3.37Å; F251-Y254 HydrophobicContact CD2-CD1 4.23Å; F251-Y254 HydrophobicContact CE2-CD1 4.23Å; F251-Y254 PolarHBondContact O-N 3.15Å; F251-Q255 HydrophobicContact CD1-CG 3.97Å; F251-Q255 HydrophobicContact CE1-CG 3.6Å; F251-Q255 HydrophobicContact CE2-CG 4.2Å; F251-Q255 HydrophobicContact CG-CG 4.43Å; F251-Q255 HydrophobicContact CZ-CG 3.75Å; F251-Q255 VanDerWaalsContact CZ-NE2 3.26Å; F251-Q255 VanDerWaalsContact O-CB 3.28Å; F251-Q255 WeakPolarHBondContact O-CB 3.48Å; F251-Q255 VanDerWaalsContact O-CG 3.29Å; F251-Q255 WeakPolarHBondContact O-CG 3.36Å; F251-Q255 PolarHBondContact O-N 3.06Å
252	R	71.4	Confident	65.7	Low	135 Å²	135	91.6 Å²	91.6	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-66.1	-40.8	167.1	-78.5	-173.2	-162.6	144.9	1.5	110.6	E6 Q248 T249 Q255 M256	E6-R252 IonicContact OE1-CZ 2.7Å; E6-R252 IonicContact OE1-NE 3.48Å; E6-R252 PolarHBondContact OE1-NE 3Å; E6-R252 IonicContact OE1-NH2 2.84Å; E6-R252 PolarHBondContact OE1-NH2 3.4Å; E6-R252 IonicContact OE2-CZ 2.73Å; E6-R252 IonicContact OE2-NH2 3.55Å; E6-R252 PolarHBondContact OE2-NH2 3.11Å; Q248-R252 VanDerWaalsContact O-CB 3.24Å; Q248-R252 WeakPolarHBondContact O-CB 3.44Å; Q248-R252 VanDerWaalsContact O-CG 3.26Å; Q248-R252 WeakPolarHBondContact O-CG 2.96Å; Q248-R252 PolarHBondContact O-N 3.45Å; T249-R252 PolarHBondContact O-N 2.97Å; R252-Q255 PolarHBondContact O-N 3.25Å; R252-M256 WeakPolarHBondContact O-CA 3.37Å; R252-M256 WeakPolarHBondContact O-CB 3.47Å; R252-M256 PolarHBondContact O-N 2.9Å
253	Q	58.9	Low	65.2	Low	117 Å²	117	89.5 Å²	89.5	55%	0.547	44%	0.436	S	S	.	.	H	α-helix	trans	-65.8	-38.4	171.4	-86.5	-175.5	-26.7	0	0	111.7	T249 N257	T249-Q253 WeakPolarHBondContact O-CB 3.15Å; T249-Q253 PolarHBondContact O-N 2.95Å; Q253-N257 WeakPolarHBondContact O-CA 3.31Å; Q253-N257 WeakPolarHBondContact O-CB 3.19Å; Q253-N257 VanDerWaalsContact O-CG 3.26Å; Q253-N257 PolarHBondContact O-N 3.49Å; Q253-N257 PolarHBondContact O-OD1 2.93Å
254	Y	73.4	Confident	64.7	Low	124 Å²	124	94.5 Å²	94.5	49%	0.486	45%	0.446	S	S	.	.	H	α-helix	trans	-68.6	-40.3	174.8	173.6	-105.2	0	0	0	111.7	A250 F251 K258	A250-Y254 VanDerWaalsContact O-CB 3.25Å; A250-Y254 WeakPolarHBondContact O-CB 3.4Å; A250-Y254 PolarHBondContact O-N 3.02Å; F251-Y254 HydrophobicContact CD2-CD1 4.23Å; F251-Y254 HydrophobicContact CE2-CD1 4.23Å; F251-Y254 PolarHBondContact O-N 3.15Å; Y254-K258 HydrophobicContact CE1-CD 3.81Å; Y254-K258 WeakPolarHBondContact O-CA 3.3Å; Y254-K258 WeakPolarHBondContact O-CB 3.5Å; Y254-K258 PolarHBondContact O-N 3.39Å; Y254-K258 PolarHBondContact OH-NZ 3.16Å
255	Q	70.8	Confident	63.5	Low	55 Å²	55	95.2 Å²	95.2	26%	0.257	45%	0.448	S	S	.	.	H	α-helix	trans	-76.6	-29.4	176	-71.1	-79.1	27.6	0	0	112.5	F251 R252 N259	F251-Q255 HydrophobicContact CD1-CG 3.97Å; F251-Q255 HydrophobicContact CE1-CG 3.6Å; F251-Q255 HydrophobicContact CE2-CG 4.2Å; F251-Q255 HydrophobicContact CG-CG 4.43Å; F251-Q255 HydrophobicContact CZ-CG 3.75Å; F251-Q255 VanDerWaalsContact CZ-NE2 3.26Å; F251-Q255 VanDerWaalsContact O-CB 3.28Å; F251-Q255 WeakPolarHBondContact O-CB 3.48Å; F251-Q255 VanDerWaalsContact O-CG 3.29Å; F251-Q255 WeakPolarHBondContact O-CG 3.36Å; F251-Q255 PolarHBondContact O-N 3.06Å; R252-Q255 PolarHBondContact O-N 3.25Å; Q255-N259 WeakPolarHBondContact O-CB 3.33Å; Q255-N259 VanDerWaalsContact O-CG 3.24Å; Q255-N259 PolarHBondContact O-N 3.06Å
256	M	61	Low	62.2	Low	100 Å²	100	88.9 Å²	88.9	49%	0.493	43%	0.431	S	S	.	.	H	α-helix	trans	-72.7	-45.5	171.8	-174.4	-173.5	78.8	0	0	109.6	R252 N259 F260	R252-M256 WeakPolarHBondContact O-CA 3.37Å; R252-M256 WeakPolarHBondContact O-CB 3.47Å; R252-M256 PolarHBondContact O-N 2.9Å; M256-N259 CarbonylContact O-C 3.42Å; M256-N259 PolarHBondContact O-N 2.96Å; M256-F260 HydrophobicContact CG-CD2 4.2Å; M256-F260 WeakPolarHBondContact O-CB 3.44Å; M256-F260 PolarHBondContact O-N 3.27Å
257	N	66.6	Low	60.7	Low	93 Å²	93	89.2 Å²	89.2	50%	0.497	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-37.5	171.8	-76.3	10.6	0	0	0	111	Q253 N259 F260 E261	Q253-N257 WeakPolarHBondContact O-CA 3.31Å; Q253-N257 WeakPolarHBondContact O-CB 3.19Å; Q253-N257 VanDerWaalsContact O-CG 3.26Å; Q253-N257 PolarHBondContact O-N 3.49Å; Q253-N257 PolarHBondContact O-OD1 2.93Å; N257-N259 VanDerWaalsContact C-N 3.33Å; N257-F260 CarbonylContact O-C 3.5Å; N257-F260 WeakPolarHBondContact O-CB 3.33Å; N257-F260 PolarHBondContact O-N 3.44Å; N257-E261 VanDerWaalsContact O-CB 3.27Å; N257-E261 WeakPolarHBondContact O-CB 3.42Å; N257-E261 PolarHBondContact O-N 3.43Å
258	K	71.5	Confident	59.7	Low	78 Å²	78	88.8 Å²	88.8	34%	0.339	43%	0.433	S	S	.	.	H	α-helix	trans	-72.7	-25.8	173.7	-172	174.5	-165.3	164	0	112.2	Y254 R262	Y254-K258 HydrophobicContact CE1-CD 3.81Å; Y254-K258 WeakPolarHBondContact O-CA 3.3Å; Y254-K258 WeakPolarHBondContact O-CB 3.5Å; Y254-K258 PolarHBondContact O-N 3.39Å; Y254-K258 PolarHBondContact OH-NZ 3.16Å; K258-R262 VanDerWaalsContact O-CB 3.23Å; K258-R262 WeakPolarHBondContact O-CB 3.3Å; K258-R262 WeakPolarHBondContact O-CD 3.33Å; K258-R262 WeakPolarHBondContact O-CG 3.46Å; K258-R262 PolarHBondContact O-N 3.22Å
259	N	63.9	Low	58.8	Low	78 Å²	78	92.4 Å²	92.4	42%	0.417	45%	0.45	S	S	.	.	H	α-helix	trans	-79.7	-28.3	166.8	-79.7	-10.1	0	0	0	112.1	Q255 M256 N257 R262 L263	Q255-N259 WeakPolarHBondContact O-CB 3.33Å; Q255-N259 VanDerWaalsContact O-CG 3.24Å; Q255-N259 PolarHBondContact O-N 3.06Å; M256-N259 CarbonylContact O-C 3.42Å; M256-N259 PolarHBondContact O-N 2.96Å; N257-N259 VanDerWaalsContact C-N 3.33Å; N259-R262 CarbonylContact O-C 3.47Å; N259-R262 PolarHBondContact OD1-NH1 2.89Å; N259-L263 WeakPolarHBondContact O-CA 3.24Å; N259-L263 WeakPolarHBondContact O-CB 3.3Å; N259-L263 WeakPolarHBondContact O-CD1 3.33Å; N259-L263 WeakPolarHBondContact O-CG 3.45Å; N259-L263 PolarHBondContact O-N 3.44Å
260	F	56.7	Low	57.9	Low	112 Å²	112	92.9 Å²	92.9	49%	0.491	45%	0.45	S	S	.	.	H	α-helix	trans	-73.2	-33.7	169.9	-109	-89.1	0	0	0	111.3	M256 N257 L263 R264	M256-F260 HydrophobicContact CG-CD2 4.2Å; M256-F260 WeakPolarHBondContact O-CB 3.44Å; M256-F260 PolarHBondContact O-N 3.27Å; N257-F260 CarbonylContact O-C 3.5Å; N257-F260 WeakPolarHBondContact O-CB 3.33Å; N257-F260 PolarHBondContact O-N 3.44Å; F260-L263 CarbonylContact O-C 3.57Å; F260-L263 PolarHBondContact O-N 3.38Å; F260-R264 WeakPolarHBondContact O-CB 3.32Å; F260-R264 VanDerWaalsContact O-CG 3.26Å; F260-R264 WeakPolarHBondContact O-CG 3.14Å; F260-R264 PolarHBondContact O-N 2.98Å
261	E	56.6	Low	56.9	Low	95 Å²	95	97.3 Å²	97.3	44%	0.444	46%	0.455	S	S	.	.	H	α-helix	trans	-75.9	-40.9	172.9	-142.3	58.3	-111.9	0	0	109.1	N257 L263 R264 S265	N257-E261 VanDerWaalsContact O-CB 3.27Å; N257-E261 WeakPolarHBondContact O-CB 3.42Å; N257-E261 PolarHBondContact O-N 3.43Å; E261-L263 VanDerWaalsContact C-N 3.26Å; E261-L263 PolarHBondContact O-N 3.3Å; E261-R264 PolarHBondContact O-N 2.87Å; E261-R264 VanDerWaalsContact OE1-CD 3.32Å; E261-R264 WeakPolarHBondContact OE1-CD 2.97Å; E261-R264 IonicContact OE2-NH1 3.91Å; E261-R264 PolarHBondContact OE2-NH1 2.87Å; E261-S265 WeakPolarHBondContact O-CA 3.34Å; E261-S265 WeakPolarHBondContact O-CB 3.43Å; E261-S265 PolarHBondContact O-N 2.66Å; E261-S265 PolarHBondContact O-OG 3.42Å
262	R	63.5	Low	55.5	Low	129 Å²	129	101.9 Å²	101.9	49%	0.487	48%	0.479	S	S	.	.	H	α-helix	trans	-64.6	-25.8	164.9	-73	163.4	177	152	-4.9	112.7	K258 N259 S266	K258-R262 VanDerWaalsContact O-CB 3.23Å; K258-R262 WeakPolarHBondContact O-CB 3.3Å; K258-R262 WeakPolarHBondContact O-CD 3.33Å; K258-R262 WeakPolarHBondContact O-CG 3.46Å; K258-R262 PolarHBondContact O-N 3.22Å; N259-R262 CarbonylContact O-C 3.47Å; N259-R262 PolarHBondContact OD1-NH1 2.89Å; R262-S266 WeakPolarHBondContact O-CA 3.24Å; R262-S266 WeakPolarHBondContact O-CB 3.38Å; R262-S266 PolarHBondContact O-N 2.87Å; R262-S266 PolarHBondContact O-OG 3.18Å
263	L	54.5	Low	54.1	Low	86 Å²	86	99.7 Å²	99.7	45%	0.45	49%	0.485	S	S	.	.	H	α-helix	trans	-81.5	-32.2	174.5	-96.1	150.3	0	0	0	111.2	N259 F260 E261 M267	N259-L263 WeakPolarHBondContact O-CA 3.24Å; N259-L263 WeakPolarHBondContact O-CB 3.3Å; N259-L263 WeakPolarHBondContact O-CD1 3.33Å; N259-L263 WeakPolarHBondContact O-CG 3.45Å; N259-L263 PolarHBondContact O-N 3.44Å; F260-L263 CarbonylContact O-C 3.57Å; F260-L263 PolarHBondContact O-N 3.38Å; E261-L263 VanDerWaalsContact C-N 3.26Å; E261-L263 PolarHBondContact O-N 3.3Å; L263-M267 WeakPolarHBondContact O-CA 3.43Å; L263-M267 WeakPolarHBondContact O-CB 3.41Å; L263-M267 WeakPolarHBondContact O-CG 3.46Å; L263-M267 PolarHBondContact O-N 3.31Å
264	R	55.5	Low	52.9	Low	148 Å²	148	102.9 Å²	102.9	56%	0.558	49%	0.492	S	S	*	.	H	α-helix	trans	-66.7	-55.1	167.4	-75.5	166	174.4	167.1	-3.1	109.4	F260 E261 S266 M267 S268	F260-R264 WeakPolarHBondContact O-CB 3.32Å; F260-R264 VanDerWaalsContact O-CG 3.26Å; F260-R264 WeakPolarHBondContact O-CG 3.14Å; F260-R264 PolarHBondContact O-N 2.98Å; E261-R264 PolarHBondContact O-N 2.87Å; E261-R264 VanDerWaalsContact OE1-CD 3.32Å; E261-R264 WeakPolarHBondContact OE1-CD 2.97Å; E261-R264 IonicContact OE2-NH1 3.91Å; E261-R264 PolarHBondContact OE2-NH1 2.87Å; R264-S266 PolarHBondContact O-N 3.5Å; R264-M267 CarbonylContact O-C 3.45Å; R264-M267 PolarHBondContact O-N 3.44Å; R264-S268 PolarHBondContact O-N 3.15Å; R264-S268 PolarHBondContact O-OG 3.13Å
265	S	44.5	Very low	51.2	Low	54 Å²	54	106.1 Å²	106.1	38%	0.378	50%	0.503	S	S	.	.	H	α-helix	trans	-59.9	-38.9	176.3	-61.2	0	0	0	0	113.6	E261 S268 E269	E261-S265 WeakPolarHBondContact O-CA 3.34Å; E261-S265 WeakPolarHBondContact O-CB 3.43Å; E261-S265 PolarHBondContact O-N 2.66Å; E261-S265 PolarHBondContact O-OG 3.42Å; S265-S268 VanDerWaalsContact CA-OG 3.25Å; S265-S268 WeakPolarHBondContact CA-OG 3.48Å; S265-S268 PolarHBondContact O-N 3.4Å; S265-S268 PolarHBondContact O-OG 2.86Å; S265-E269 WeakPolarHBondContact O-CB 3.41Å; S265-E269 WeakPolarHBondContact O-CG 3.27Å; S265-E269 PolarHBondContact O-N 3.23Å
266	S	44.2	Very low	49.8	Very low	44 Å²	44	109.9 Å²	109.9	31%	0.308	52%	0.524	S	S	.	.	H	α-helix	trans	-86.6	-17.1	175.4	70.6	0	0	0	0	113.9	R262 R264 S268 N270 R271	R262-S266 WeakPolarHBondContact O-CA 3.24Å; R262-S266 WeakPolarHBondContact O-CB 3.38Å; R262-S266 PolarHBondContact O-N 2.87Å; R262-S266 PolarHBondContact O-OG 3.18Å; R264-S266 PolarHBondContact O-N 3.5Å; S266-S268 VanDerWaalsContact C-N 3.34Å; S266-N270 VanDerWaalsContact O-CA 3.27Å; S266-N270 WeakPolarHBondContact O-CA 3.42Å; S266-N270 WeakPolarHBondContact O-CB 3.26Å; S266-N270 PolarHBondContact O-N 3.28Å; S266-R271 PolarHBondContact O-N 3.42Å
267	M	39.6	Very low	48.7	Very low	82 Å²	82	110.5 Å²	110.5	40%	0.404	53%	0.533	S	S	.	.	H	α-helix	trans	-76.9	-19.5	160.2	-74.2	-166.8	-66.2	0	0	112.5	L263 R264 R271	L263-M267 WeakPolarHBondContact O-CA 3.43Å; L263-M267 WeakPolarHBondContact O-CB 3.41Å; L263-M267 WeakPolarHBondContact O-CG 3.46Å; L263-M267 PolarHBondContact O-N 3.31Å; R264-M267 CarbonylContact O-C 3.45Å; R264-M267 PolarHBondContact O-N 3.44Å; M267-R271 HydrophobicContact CB-CG 4.45Å; M267-R271 HydrophobicContact CG-CG 4.43Å; M267-R271 WeakPolarHBondContact O-CB 3.49Å; M267-R271 VanDerWaalsContact SD-CZ 3.54Å
268	S	49.4	Very low	47	Very low	80 Å²	80	113.3 Å²	113.3	56%	0.559	55%	0.547	S	S	*	.	H	α-helix	trans	-86.7	-35.8	168.3	57.3	0	0	0	0	113.6	R264 S265 S266	R264-S268 PolarHBondContact O-N 3.15Å; R264-S268 PolarHBondContact O-OG 3.13Å; S265-S268 VanDerWaalsContact CA-OG 3.25Å; S265-S268 WeakPolarHBondContact CA-OG 3.48Å; S265-S268 PolarHBondContact O-N 3.4Å; S265-S268 PolarHBondContact O-OG 2.86Å; S266-S268 VanDerWaalsContact C-N 3.34Å
269	E	42.2	Very low	45.2	Very low	144 Å²	144	114.4 Å²	114.4	67%	0.673	56%	0.564	S	S	*	*	H	α-helix	trans	-88.8	-48.4	178.5	-69.9	-173.2	122.9	0	0	113.3	S265 S273	S265-E269 WeakPolarHBondContact O-CB 3.41Å; S265-E269 WeakPolarHBondContact O-CG 3.27Å; S265-E269 PolarHBondContact O-N 3.23Å; E269-S273 PolarHBondContact O-OG 3.07Å
270	N	43.3	Very low	43.7	Very low	82 Å²	82	113.3 Å²	113.3	44%	0.439	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.4	-19.8	-166	-135.4	-33.6	0	0	0	113.6	S266 R274	S266-N270 VanDerWaalsContact O-CA 3.27Å; S266-N270 WeakPolarHBondContact O-CA 3.42Å; S266-N270 WeakPolarHBondContact O-CB 3.26Å; S266-N270 PolarHBondContact O-N 3.28Å; N270-R274 PolarHBondContact OD1-NH2 3.35Å
271	R	40.4	Very low	42.3	Very low	146 Å²	146	117 Å²	117	55%	0.551	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-33.4	164	-75	-175.6	163.5	178.5	-3	111.9	S266 M267 S273 R275	S266-R271 PolarHBondContact O-N 3.42Å; M267-R271 HydrophobicContact CB-CG 4.45Å; M267-R271 HydrophobicContact CG-CG 4.43Å; M267-R271 WeakPolarHBondContact O-CB 3.49Å; M267-R271 VanDerWaalsContact SD-CZ 3.54Å; R271-S273 PolarHBondContact O-N 3.47Å; R271-R275 PolarHBondContact O-N 3.21Å
272	M	37.9	Very low	40.9	Very low	157 Å²	157	123.4 Å²	123.4	77%	0.773	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-24.3	-177	-146.2	65.1	175.5	0	0	113.2
273	S	40.8	Very low	39.3	Very low	90 Å²	90	124 Å²	124	63%	0.629	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-5.1	-173.8	-58.3	0	0	0	0	114.9	E269 R271	E269-S273 PolarHBondContact O-OG 3.07Å; R271-S273 PolarHBondContact O-N 3.47Å
274	R	34.8	Very low	37.9	Very low	184 Å²	184	128.6 Å²	128.6	69%	0.694	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.4	5.1	-172.5	-110.2	-177.9	-65.5	-129.2	-1.9	117.4	N270 I276	N270-R274 PolarHBondContact OD1-NH2 3.35Å; R274-I276 VanDerWaalsContact C-N 3.3Å; R274-I276 CarbonylContact C-O 3.54Å
275	R	37.3	Very low	36.5	Very low	192 Å²	192	128.3 Å²	128.3	73%	0.725	64%	0.637	S	S	*	*	S	Bend	trans	-83.8	-9.1	163.4	-171.9	172.8	-87.6	-169.9	-8.1	112.4	R271	R271-R275 PolarHBondContact O-N 3.21Å
276	I	41.7	Very low	35.5	Very low	134 Å²	134	131.2 Å²	131.2	69%	0.687	66%	0.658	S	S	*	*	S	Bend	trans	-77.7	133	157.9	-53.2	175.7	0	0	0	106.6	R274	R274-I276 VanDerWaalsContact C-N 3.3Å; R274-I276 CarbonylContact C-O 3.54Å
277	V	37.4	Very low	34.6	Very low	113 Å²	113	138.1 Å²	138.1	69%	0.685	68%	0.683	S	S	*	*	S	Bend	trans	81.3	104.2	-170.7	-169.7	0	0	0	0	115
278	L	30.7	Very low	33.9	Very low	152 Å²	152	142.9 Å²	142.9	80%	0.796	70%	0.704	S	S	*	*			trans	62.4	78.6	155.7	-57.3	175.8	0	0	0	120.2
279	S	35.2	Very low	32.8	Very low	100 Å²	100	142 Å²	142	70%	0.699	71%	0.708	S	S	*	*			trans	-138.7	44.2	139.4	76.5	0	0	0	0	112.3
280	N	31.1	Very low	32.7	Very low	55 Å²	55	140.3 Å²	140.3	29%	0.294	71%	0.709	S	S	.	*			trans	-79.9	164.3	142.8	-77.8	-4.2	0	0	0	106.7	E789 R790	N280-E789 PolarHBondContact ND2-OE2 3.33Å; N280-R790 PolarHBondContact OD1-NH2 3.07Å
281	M	27	Very low	31.9	Very low	189 Å²	189	143.8 Å²	143.8	93%	0.931	72%	0.723	S	S	*	*			trans	74.3	81.3	-159.2	-53.8	-171.7	71.1	0	0	111.4
282	R	28	Very low	31.2	Very low	230 Å²	230	145.4 Å²	145.4	87%	0.868	73%	0.734	S	S	*	*			cis	92.2	100.5	41.8	-166.2	-174.9	-176.9	-179.2	2.5	113.4
283	M	29.2	Very low	30.6	Very low	142 Å²	142	143.3 Å²	143.3	70%	0.7	73%	0.73	S	S	*	*			trans	62.4	119.4	143.8	-56.3	-76.1	-81.3	0	0	120.8
284	Q	26.9	Very low	29.8	Very low	183 Å²	183	148.1 Å²	148.1	86%	0.855	74%	0.742	S	S	*	*				-165	112.8	124.5	-100.3	156.1	5.9	0	0	105.8
285	L	24.8	Very low	29.4	Very low	141 Å²	141	144.2 Å²	144.2	74%	0.738	74%	0.743	S	S	*	*				86.8	154	71.7	-80.6	169.6	0	0	0	112.8
286	S	24.5	Very low	29.1	Very low	116 Å²	116	139.6 Å²	139.6	81%	0.811	74%	0.74	S	S	*	*			trans	75.6	110.8	-159.6	-57.6	0	0	0	0	113.1
287	F	24.6	Very low	28.2	Very low	188 Å²	188	143.6 Å²	143.6	83%	0.825	75%	0.748	S	S	*	*			cis	71.3	94.1	19.7	-161.1	-79.9	0	0	0	114.6
288	E	25.2	Very low	27.7	Very low	182 Å²	182	147 Å²	147	85%	0.85	75%	0.754	S	S	*	*			trans	-171.9	153.3	133	-109.9	169.2	157.4	0	0	112
289	G	26.8	Very low	27.9	Very low	62 Å²	62	147.8 Å²	147.8	64%	0.639	75%	0.754	S	S	*	*			trans	-118.5	-145.2	156.2	0	0	0	0	0	107.8
290	P	40.3	Very low	27.6	Very low	109 Å²	109	145.8 Å²	145.8	71%	0.708	75%	0.749	S	S	*	*			cis	-135.3	-169.8	-10.5	44	-27.5	0	0	0	113.2
291	E	26.3	Very low	27.3	Very low	155 Å²	155	155.2 Å²	155.2	72%	0.724	78%	0.78	S	S	*	*			trans	63.9	165.5	161.2	-62.9	173.6	-160.8	0	0	117.2
292	K	25.7	Very low	27.3	Very low	179 Å²	179	154.8 Å²	154.8	78%	0.778	78%	0.776	S	S	*	*			cis	-128.3	135.8	12.2	-75.4	176.8	-178.5	-179.3	0	109.9
293	V	24.9	Very low	27.2	Very low	113 Å²	113	149.5 Å²	149.5	69%	0.685	77%	0.769	S	S	*	*				62.7	115.6	75.2	176.3	0	0	0	0	113.9
294	H	24.9	Very low	27	Very low	191 Å²	191	147.7 Å²	147.7	88%	0.884	77%	0.77	S	S	*	*				-155.4	158.5	126.8	-117.4	-81.7	0	0	0	111.5
295	S	24.5	Very low	26.9	Very low	103 Å²	103	147.3 Å²	147.3	72%	0.72	77%	0.771	S	S	*	*			trans	-138.5	179.5	-170.8	-175.2	0	0	0	0	111.5
296	S	31.1	Very low	27.1	Very low	94 Å²	94	145.6 Å²	145.6	66%	0.657	77%	0.766	S	S	*	*			trans	74.5	144.2	-176.8	73	0	0	0	0	114.8
297	Y	24	Very low	27.3	Very low	218 Å²	218	148 Å²	148	86%	0.855	76%	0.764	S	S	*	*			cis	-139.7	167.6	47	-105.2	-97.2	0	0	0	117.5
298	F	26.9	Very low	27.5	Very low	184 Å²	184	146.9 Å²	146.9	81%	0.807	77%	0.767	S	S	*	*			trans	-74.4	170.3	164.5	-126.1	-126.4	0	0	0	110.4
299	E	34.1	Very low	27.7	Very low	170 Å²	170	141.4 Å²	141.4	79%	0.794	76%	0.759	S	S	*	*			cis	-157.3	163.2	20.9	-175	171	-83.1	0	0	107.4
300	G	28.4	Very low	27.7	Very low	58 Å²	58	145.3 Å²	145.3	60%	0.598	77%	0.771	S	S	*	*			cis	130.8	135.2	1.5	0	0	0	0	0	112
301	R	26.1	Very low	28	Very low	252 Å²	252	145 Å²	145	95%	0.951	77%	0.769	S	S	*	*			trans	-159.2	134.5	169.7	-116.8	-176.3	-174.5	-158.5	0.7	114.8
302	Q	27.1	Very low	28	Very low	181 Å²	181	145.3 Å²	145.3	85%	0.846	78%	0.775	S	S	*	*			trans	-29.8	159	165.5	-65.2	176.3	-9.9	0	0	118.3
303	V	24.8	Very low	28	Very low	119 Å²	119	141.2 Å²	141.2	72%	0.721	77%	0.769	S	S	*	*			cis	-165.9	171	1.2	121.3	0	0	0	0	111.6
304	S	24.7	Very low	28	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	78%	0.775	S	S	*	*			trans	72.6	131.1	173.9	61.3	0	0	0	0	116
305	M	25.8	Very low	28.1	Very low	175 Å²	175	139.3 Å²	139.3	86%	0.862	76%	0.761	S	S	*	*			cis	80	132.5	26.8	-52.7	-163.9	84	0	0	114.4
306	T	29.5	Very low	28.1	Very low	105 Å²	105	142.9 Å²	142.9	64%	0.644	77%	0.767	S	S	*	*			cis	-142.3	154.5	16.2	46.7	0	0	0	0	114.9
307	E	28.6	Very low	28	Very low	166 Å²	166	143.1 Å²	143.1	78%	0.776	77%	0.768	S	S	*	*			trans	49.7	128.2	137.7	-62.8	173.2	165.9	0	0	124.1
308	D	28.2	Very low	28.1	Very low	164 Å²	164	139.4 Å²	139.4	88%	0.877	76%	0.759	S	S	*	*			trans	57.3	159.2	131.6	-62.4	7.4	0	0	0	124
309	G	28.5	Very low	28.2	Very low	67 Å²	67	141.1 Å²	141.1	69%	0.691	76%	0.76	S	S	*	*			trans	169.2	-72.2	154.9	0	0	0	0	0	118.6
310	T	27.4	Very low	27.7	Very low	144 Å²	144	136 Å²	136	88%	0.883	75%	0.753	S	S	*	*			trans	70.2	-169	-168.9	-15.8	0	0	0	0	112.7
311	P	46.5	Very low	27.6	Very low	103 Å²	103	141.1 Å²	141.1	67%	0.669	77%	0.766	S	S	*	*				-123.8	173.6	-123.7	38.7	-20	0	0	0	117.7
312	L	27.4	Very low	27.8	Very low	161 Å²	161	136 Å²	136	84%	0.843	76%	0.762	S	S	*	*			trans	136.5	125.6	136.7	-73	169.1	0	0	0	117.5
313	S	24.4	Very low	27.7	Very low	94 Å²	94	136.2 Å²	136.2	66%	0.657	76%	0.764	S	S	*	*				62.7	135.2	128.1	-150.3	0	0	0	0	124.5
314	M	25.5	Very low	27.8	Very low	166 Å²	166	137.4 Å²	137.4	82%	0.818	77%	0.771	S	S	*	*			trans	67.9	157.9	148.8	-81.6	179	74.4	0	0	119.7
315	V	25.6	Very low	27.9	Very low	97 Å²	97	141.2 Å²	141.2	59%	0.588	78%	0.777	S	S	*	*			cis	-167.8	163.7	-30.8	108.2	0	0	0	0	109.9
316	Q	26.5	Very low	28	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	78%	0.78	S	S	*	*			trans	70.2	133.5	170.1	-82.1	152.4	7.5	0	0	117.1
317	S	27.4	Very low	28	Very low	98 Å²	98	146.8 Å²	146.8	69%	0.685	79%	0.794	S	S	*	*				94.8	142.1	69.5	-145.4	0	0	0	0	111.2
318	E	27.6	Very low	27.8	Very low	141 Å²	141	143 Å²	143	66%	0.659	79%	0.79	S	S	*	*			cis	-162.7	167.3	14.7	-152.7	-176.2	118.5	0	0	112
319	R	27.7	Very low	27.8	Very low	220 Å²	220	141.7 Å²	141.7	83%	0.83	78%	0.783	S	S	*	*			trans	74.2	143.4	159.4	-59.1	-173.6	-180	-164	-5.1	122.7
320	G	24.9	Very low	27.8	Very low	63 Å²	63	145.5 Å²	145.5	65%	0.649	79%	0.785	S	S	*	*			trans	-99	-162.5	160.6	0	0	0	0	0	112.2
321	D	25.2	Very low	28.1	Very low	164 Å²	164	145.4 Å²	145.4	88%	0.877	78%	0.784	S	S	*	*			cis	-146.2	175	13	-75.6	-46.7	0	0	0	111.7
322	V	29.6	Very low	27.1	Very low	144 Å²	144	145.9 Å²	145.9	87%	0.873	79%	0.79	S	S	*	*			trans	137.5	133.1	150.1	169.9	0	0	0	0	112.7
323	E	26	Very low	27.1	Very low	187 Å²	187	146.6 Å²	146.6	87%	0.874	79%	0.789	S	S	*	*			trans	-93.7	138.6	-169.3	-54.2	167.8	105.8	0	0	114.2
324	V	26.7	Very low	27.5	Very low	143 Å²	143	147.8 Å²	147.8	87%	0.867	79%	0.794	S	S	*	*			trans	-141.6	146.1	149	179.2	0	0	0	0	108.5	Q326	V324-Q326 PolarHBondContact O-N 3.39Å
325	H	27.5	Very low	27.9	Very low	185 Å²	185	145.3 Å²	145.3	86%	0.856	79%	0.79	S	S	*	*			trans	-57.1	124.6	-178.6	-71.7	22.9	0	0	0	113.9
326	Q	26.5	Very low	28.4	Very low	198 Å²	198	146.3 Å²	146.3	93%	0.925	80%	0.799	S	S	*	*			trans	-154.1	166.8	138.3	-121.8	173.7	21.4	0	0	113.5	V324	V324-Q326 PolarHBondContact O-N 3.39Å
327	Q	30.9	Very low	28.8	Very low	199 Å²	199	146.2 Å²	146.2	93%	0.93	80%	0.799	S	S	*	*			trans	-100.7	104.2	-157	-174.1	173.8	-2.2	0	0	112.1
328	A	23.9	Very low	29.7	Very low	85 Å²	85	144.6 Å²	144.6	70%	0.702	79%	0.791	S	S	*	*			trans	-141.3	146.1	173	0	0	0	0	0	108.7
329	N	28.1	Very low	30.5	Very low	137 Å²	137	143.5 Å²	143.5	73%	0.733	79%	0.79	S	S	*	*				53.5	124	64.6	-86.2	-8.3	0	0	0	112
330	M	28.2	Very low	31.1	Very low	147 Å²	147	139.1 Å²	139.1	72%	0.724	78%	0.783	S	S	*	*			cis	-140.3	-169.6	23.5	-76.9	-63.3	-172.8	0	0	113.3
331	T	34.7	Very low	32	Very low	143 Å²	143	140.6 Å²	140.6	88%	0.877	78%	0.779	S	S	*	*			trans	89.1	55.3	163.6	69.8	0	0	0	0	118.5
332	S	25.2	Very low	32.8	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	76%	0.763	S	S	*	*			trans	-106.4	137.9	145.2	56.6	0	0	0	0	110.5
333	H	28.1	Very low	33.7	Very low	176 Å²	176	133 Å²	133	82%	0.815	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-52.8	139.9	-174.2	-51.8	-93.6	0	0	0	114.6
334	P	31.2	Very low	34.9	Very low	119 Å²	119	128 Å²	128	77%	0.773	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-59.1	137.6	148.3	-15.5	30.4	0	0	0	109
335	P	34.7	Very low	36.2	Very low	113 Å²	113	124.7 Å²	124.7	73%	0.734	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-72.6	151.6	-174.6	29.5	-35.3	0	0	0	112.3
336	P	35.9	Very low	37.4	Very low	119 Å²	119	122.4 Å²	122.4	77%	0.773	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-66.1	137.4	168.3	29.7	-33.9	0	0	0	110	A338	P336-A338 PolarHBondContact O-N 3Å
337	Q	35.2	Very low	38.9	Very low	176 Å²	176	118.9 Å²	118.9	82%	0.822	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-64.6	120	-175.4	-69.3	-173.5	-70.2	0	0	112.5
338	A	45.4	Very low	39.7	Very low	65 Å²	65	115.7 Å²	115.7	54%	0.537	66%	0.66	S	S	.	*			trans	-112.6	82	164.1	0	0	0	0	0	108.1	P336	P336-A338 PolarHBondContact O-N 3Å
339	D	44.1	Very low	41.2	Very low	117 Å²	117	115.5 Å²	115.5	63%	0.626	65%	0.647	S	S	*	*			trans	-132.5	7.7	-171.9	-95.1	-50.2	0	0	0	114.6
340	L	42	Very low	42.7	Very low	129 Å²	129	110.6 Å²	110.6	68%	0.675	63%	0.626	S	S	*	*	S	Bend	trans	-103.1	-34.4	170.5	-170.6	63.4	0	0	0	112.3	I344	L340-I344 HydrophobicContact CD1-CD1 4.2Å; L340-I344 HydrophobicContact CG-CD1 3.97Å; L340-I344 WeakPolarHBondContact O-CB 3.33Å; L340-I344 WeakPolarHBondContact O-CD1 3.44Å; L340-I344 VanDerWaalsContact O-CG1 3.27Å; L340-I344 WeakPolarHBondContact O-CG1 3.39Å; L340-I344 PolarHBondContact O-N 3.14Å
341	T	42.8	Very low	43.9	Very low	93 Å²	93	110 Å²	110	57%	0.571	62%	0.62	S	S	*	*	H	α-helix	trans	-66.7	-39.6	178.8	-12.6	0	0	0	0	112.1	T345	T341-T345 WeakPolarHBondContact O-CB 3.47Å; T341-T345 PolarHBondContact O-N 3.19Å; T341-T345 PolarHBondContact O-OG1 3.43Å
342	D	43.1	Very low	44.8	Very low	102 Å²	102	106.2 Å²	106.2	55%	0.545	60%	0.599	S	S	.	*	H	α-helix	trans	-78.6	-38.8	-173	-69.7	4.7	0	0	0	110.8	I344 T345 E346	D342-I344 PolarHBondContact O-N 2.69Å; D342-T345 PolarHBondContact O-N 2.59Å; D342-E346 WeakPolarHBondContact O-CB 3.22Å; D342-E346 PolarHBondContact O-N 2.88Å
343	A	48.6	Very low	46.6	Very low	46 Å²	46	106.9 Å²	106.9	38%	0.38	58%	0.584	S	S	.	*	H	α-helix	trans	-61.9	-40.4	170.7	0	0	0	0	0	113	L347	A343-L347 WeakPolarHBondContact O-CB 3.41Å; A343-L347 WeakPolarHBondContact O-CG 3.41Å; A343-L347 PolarHBondContact O-N 3.06Å; A343-L347 VanDerWaalsContact O-N 3.09Å
344	I	50.1	Low	48.1	Very low	83 Å²	83	105.1 Å²	105.1	43%	0.426	58%	0.576	S	S	.	*	H	α-helix	trans	-67.9	-41.9	174.2	-69.3	170.8	0	0	0	110.6	L340 D342 L347 E348	L340-I344 HydrophobicContact CD1-CD1 4.2Å; L340-I344 HydrophobicContact CG-CD1 3.97Å; L340-I344 WeakPolarHBondContact O-CB 3.33Å; L340-I344 WeakPolarHBondContact O-CD1 3.44Å; L340-I344 VanDerWaalsContact O-CG1 3.27Å; L340-I344 WeakPolarHBondContact O-CG1 3.39Å; L340-I344 PolarHBondContact O-N 3.14Å; D342-I344 PolarHBondContact O-N 2.69Å; I344-L347 PolarHBondContact O-N 3.21Å; I344-E348 HydrophobicContact CG2-CG 4.49Å; I344-E348 PolarHBondContact O-N 2.77Å
345	T	53.3	Low	49.6	Very low	74 Å²	74	103 Å²	103	45%	0.454	56%	0.561	S	S	.	*	H	α-helix	trans	-62.4	-46.5	176.9	-57	0	0	0	0	110.2	T341 D342 L347 E348 D349	T341-T345 WeakPolarHBondContact O-CB 3.47Å; T341-T345 PolarHBondContact O-N 3.19Å; T341-T345 PolarHBondContact O-OG1 3.43Å; D342-T345 PolarHBondContact O-N 2.59Å; T345-L347 VanDerWaalsContact C-N 3.3Å; T345-L347 PolarHBondContact O-N 2.69Å; T345-E348 PolarHBondContact O-N 3.43Å; T345-D349 WeakPolarHBondContact O-CB 3.35Å; T345-D349 PolarHBondContact O-N 3.27Å
346	E	53.6	Low	50.5	Low	136 Å²	136	104 Å²	104	64%	0.636	55%	0.554	S	S	*	*	H	α-helix	trans	-60	-37.7	177.5	-174.4	172.9	-150.2	0	0	112.4	D342 A350	D342-E346 WeakPolarHBondContact O-CB 3.22Å; D342-E346 PolarHBondContact O-N 2.88Å; E346-A350 WeakPolarHBondContact O-CB 3.44Å; E346-A350 PolarHBondContact O-N 3.47Å
347	L	57.7	Low	51.9	Low	125 Å²	125	101.8 Å²	101.8	65%	0.654	54%	0.541	S	S	*	.	H	α-helix	trans	-68.6	-45.1	173.7	-82.5	163.9	0	0	0	113.1	A343 I344 T345 D349 A350 F351	A343-L347 WeakPolarHBondContact O-CB 3.41Å; A343-L347 WeakPolarHBondContact O-CG 3.41Å; A343-L347 PolarHBondContact O-N 3.06Å; A343-L347 VanDerWaalsContact O-N 3.09Å; I344-L347 PolarHBondContact O-N 3.21Å; T345-L347 VanDerWaalsContact C-N 3.3Å; T345-L347 PolarHBondContact O-N 2.69Å; L347-D349 VanDerWaalsContact C-N 3.28Å; L347-D349 PolarHBondContact O-N 2.99Å; L347-A350 PolarHBondContact O-N 3.36Å; L347-F351 WeakPolarHBondContact O-CB 3.25Å; L347-F351 PolarHBondContact O-N 3.24Å
348	E	48.4	Very low	53.2	Low	131 Å²	131	98.7 Å²	98.7	61%	0.612	53%	0.53	S	S	*	.	H	α-helix	trans	-64.4	-35.1	175.1	-73.2	-169.3	163.3	0	0	111.7	I344 T345 S352	I344-E348 HydrophobicContact CG2-CG 4.49Å; I344-E348 PolarHBondContact O-N 2.77Å; T345-E348 PolarHBondContact O-N 3.43Å; E348-S352 VanDerWaalsContact O-CB 3.24Å; E348-S352 WeakPolarHBondContact O-CB 3.5Å; E348-S352 PolarHBondContact O-N 3.32Å; E348-S352 PolarHBondContact O-OG 3.44Å
349	D	55.7	Low	53.8	Low	81 Å²	81	97.8 Å²	97.8	43%	0.433	52%	0.522	S	S	.	.	H	α-helix	trans	-77.8	-34.2	179.5	-145.6	41.5	0	0	0	111.1	T345 L347 S352 R353	T345-D349 WeakPolarHBondContact O-CB 3.35Å; T345-D349 PolarHBondContact O-N 3.27Å; L347-D349 VanDerWaalsContact C-N 3.28Å; L347-D349 PolarHBondContact O-N 2.99Å; D349-S352 PolarHBondContact O-N 3.39Å; D349-R353 VanDerWaalsContact CG-NH1 3.32Å; D349-R353 WeakPolarHBondContact O-CB 3.03Å; D349-R353 VanDerWaalsContact O-CG 3.28Å; D349-R353 WeakPolarHBondContact O-CG 3.11Å; D349-R353 PolarHBondContact O-N 3.35Å; D349-R353 PolarHBondContact O-NE 3.15Å; D349-R353 IonicContact OD2-CZ 2.82Å; D349-R353 IonicContact OD2-NH1 2.85Å; D349-R353 PolarHBondContact OD2-NH1 2.9Å; D349-R353 IonicContact OD2-NH2 3.62Å
350	A	58.2	Low	54.3	Low	35 Å²	35	97.2 Å²	97.2	29%	0.289	52%	0.516	S	S	.	.	H	α-helix	trans	-66.7	-43.7	169.6	0	0	0	0	0	112.1	E346 L347 S352 R353 Q354	E346-A350 WeakPolarHBondContact O-CB 3.44Å; E346-A350 PolarHBondContact O-N 3.47Å; L347-A350 PolarHBondContact O-N 3.36Å; A350-S352 VanDerWaalsContact C-N 3.35Å; A350-R353 PolarHBondContact O-N 2.69Å; A350-Q354 WeakPolarHBondContact O-CG 3.44Å; A350-Q354 PolarHBondContact O-N 3.07Å
351	F	54	Low	55.1	Low	134 Å²	134	94.5 Å²	94.5	59%	0.588	51%	0.507	S	S	*	.	H	α-helix	trans	-63.1	-41.9	172.6	-176.8	-104.7	0	0	0	111.3	L347 R353 Q354 V355	L347-F351 WeakPolarHBondContact O-CB 3.25Å; L347-F351 PolarHBondContact O-N 3.24Å; F351-R353 PolarHBondContact O-N 3.42Å; F351-Q354 PolarHBondContact O-N 3.33Å; F351-V355 HydrophobicContact CD1-CG2 4.23Å; F351-V355 HydrophobicContact CE1-CG2 3.87Å; F351-V355 HydrophobicContact CE2-CG2 4.25Å; F351-V355 HydrophobicContact CZ-CG2 3.88Å; F351-V355 WeakPolarHBondContact O-CG2 3.5Å; F351-V355 PolarHBondContact O-N 3.5Å
352	S	53.5	Low	56	Low	63 Å²	63	94.3 Å²	94.3	44%	0.441	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-37.3	175.3	-62.4	0	0	0	0	112.6	E348 D349 A350 K356	E348-S352 VanDerWaalsContact O-CB 3.24Å; E348-S352 WeakPolarHBondContact O-CB 3.5Å; E348-S352 PolarHBondContact O-N 3.32Å; E348-S352 PolarHBondContact O-OG 3.44Å; D349-S352 PolarHBondContact O-N 3.39Å; A350-S352 VanDerWaalsContact C-N 3.35Å; S352-K356 WeakPolarHBondContact O-CB 3.38Å; S352-K356 PolarHBondContact O-N 3.29Å
353	R	64.1	Low	56.5	Low	128 Å²	128	93.7 Å²	93.7	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-42.5	171	-80.7	-178	-79.5	-87.9	2.9	111.9	D349 A350 F351 S357	D349-R353 VanDerWaalsContact CG-NH1 3.32Å; D349-R353 WeakPolarHBondContact O-CB 3.03Å; D349-R353 VanDerWaalsContact O-CG 3.28Å; D349-R353 WeakPolarHBondContact O-CG 3.11Å; D349-R353 PolarHBondContact O-N 3.35Å; D349-R353 PolarHBondContact O-NE 3.15Å; D349-R353 IonicContact OD2-CZ 2.82Å; D349-R353 IonicContact OD2-NH1 2.85Å; D349-R353 PolarHBondContact OD2-NH1 2.9Å; D349-R353 IonicContact OD2-NH2 3.62Å; A350-R353 PolarHBondContact O-N 2.69Å; F351-R353 PolarHBondContact O-N 3.42Å; R353-S357 VanDerWaalsContact O-CB 3.26Å; R353-S357 WeakPolarHBondContact O-CB 3.33Å; R353-S357 PolarHBondContact O-N 2.89Å
354	Q	58.9	Low	56.7	Low	138 Å²	138	96.3 Å²	96.3	65%	0.645	51%	0.506	S	S	*	.	H	α-helix	trans	-66.1	-43	175.9	-73.6	176.8	-4	0	0	112.3	A350 F351 S357 L358	A350-Q354 WeakPolarHBondContact O-CG 3.44Å; A350-Q354 PolarHBondContact O-N 3.07Å; F351-Q354 PolarHBondContact O-N 3.33Å; Q354-S357 PolarHBondContact O-N 2.9Å; Q354-L358 VanDerWaalsContact O-CB 3.3Å; Q354-L358 WeakPolarHBondContact O-CB 3.4Å; Q354-L358 PolarHBondContact O-N 3.2Å
355	V	63.1	Low	56.9	Low	76 Å²	76	95.8 Å²	95.8	46%	0.461	51%	0.514	S	S	.	.	H	α-helix	trans	-67.6	-37.8	177	172.4	0	0	0	0	111.6	F351 A359	F351-V355 HydrophobicContact CD1-CG2 4.23Å; F351-V355 HydrophobicContact CE1-CG2 3.87Å; F351-V355 HydrophobicContact CE2-CG2 4.25Å; F351-V355 HydrophobicContact CZ-CG2 3.88Å; F351-V355 WeakPolarHBondContact O-CG2 3.5Å; F351-V355 PolarHBondContact O-N 3.5Å; V355-A359 WeakPolarHBondContact O-CB 3.27Å; V355-A359 PolarHBondContact O-N 2.99Å
356	K	52.9	Low	56.6	Low	134 Å²	134	97.6 Å²	97.6	58%	0.583	52%	0.521	S	S	*	.	H	α-helix	trans	-64.2	-50.8	170.9	-90.7	-165.9	161.1	-150.6	0	112.5	S352 L358 A359 E360	S352-K356 WeakPolarHBondContact O-CB 3.38Å; S352-K356 PolarHBondContact O-N 3.29Å; K356-L358 PolarHBondContact O-N 2.69Å; K356-A359 CarbonylContact O-C 3.59Å; K356-A359 WeakPolarHBondContact O-CA 3.47Å; K356-A359 WeakPolarHBondContact O-CB 3.5Å; K356-A359 PolarHBondContact O-N 3.28Å; K356-E360 WeakPolarHBondContact O-CB 3.34Å; K356-E360 WeakPolarHBondContact O-CG 3.47Å; K356-E360 PolarHBondContact O-N 2.87Å
357	S	65.8	Low	56.3	Low	72 Å²	72	96.3 Å²	96.3	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-60	-33.2	178.6	177.9	0	0	0	0	111.9	R353 Q354 S361	R353-S357 VanDerWaalsContact O-CB 3.26Å; R353-S357 WeakPolarHBondContact O-CB 3.33Å; R353-S357 PolarHBondContact O-N 2.89Å; Q354-S357 PolarHBondContact O-N 2.9Å; S357-S361 WeakPolarHBondContact O-CB 3.48Å; S357-S361 PolarHBondContact O-N 3.18Å
358	L	63	Low	55.6	Low	111 Å²	111	95.7 Å²	95.7	58%	0.581	52%	0.523	S	S	*	.	H	α-helix	trans	-70	-39.7	172	-178.2	61.4	0	0	0	112.7	Q354 K356 I362	Q354-L358 VanDerWaalsContact O-CB 3.3Å; Q354-L358 WeakPolarHBondContact O-CB 3.4Å; Q354-L358 PolarHBondContact O-N 3.2Å; K356-L358 PolarHBondContact O-N 2.69Å; L358-I362 HydrophobicContact CD1-CD1 4.32Å; L358-I362 HydrophobicContact CG-CD1 4.23Å; L358-I362 WeakPolarHBondContact O-CD1 3.36Å; L358-I362 VanDerWaalsContact O-CG1 3.22Å; L358-I362 WeakPolarHBondContact O-CG1 3.48Å; L358-I362 PolarHBondContact O-N 3.01Å; L358-I362 VanDerWaalsContact O-N 3.09Å
359	A	58	Low	55.5	Low	46 Å²	46	100.1 Å²	100.1	38%	0.38	53%	0.534	S	S	.	.	H	α-helix	trans	-68	-47	175.2	0	0	0	0	0	111.7	V355 K356 S361 I362 D363	V355-A359 WeakPolarHBondContact O-CB 3.27Å; V355-A359 PolarHBondContact O-N 2.99Å; K356-A359 CarbonylContact O-C 3.59Å; K356-A359 WeakPolarHBondContact O-CA 3.47Å; K356-A359 WeakPolarHBondContact O-CB 3.5Å; K356-A359 PolarHBondContact O-N 3.28Å; A359-S361 VanDerWaalsContact C-N 3.32Å; A359-S361 PolarHBondContact O-N 2.91Å; A359-I362 CarbonylContact O-C 3.57Å; A359-I362 WeakPolarHBondContact O-CA 3.22Å; A359-I362 WeakPolarHBondContact O-CB 3.35Å; A359-I362 PolarHBondContact O-N 3.19Å; A359-D363 PolarHBondContact O-N 3.23Å
360	E	54.7	Low	54.6	Low	105 Å²	105	100.7 Å²	100.7	49%	0.491	54%	0.544	S	S	.	.	H	α-helix	trans	-59.8	-41.6	174.4	-70.5	159.7	-175.6	0	0	110.4	K356 I362 D363 D364	K356-E360 WeakPolarHBondContact O-CB 3.34Å; K356-E360 WeakPolarHBondContact O-CG 3.47Å; K356-E360 PolarHBondContact O-N 2.87Å; E360-I362 VanDerWaalsContact C-N 3.27Å; E360-I362 PolarHBondContact O-N 3.36Å; E360-D363 PolarHBondContact O-N 3.37Å; E360-D364 VanDerWaalsContact O-CB 3.3Å; E360-D364 WeakPolarHBondContact O-CB 3.5Å; E360-D364 PolarHBondContact O-N 3.11Å
361	S	57.8	Low	53.5	Low	71 Å²	71	107.2 Å²	107.2	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-66.2	-21.9	172.4	180	0	0	0	0	114.4	S357 A359 A365	S357-S361 WeakPolarHBondContact O-CB 3.48Å; S357-S361 PolarHBondContact O-N 3.18Å; A359-S361 VanDerWaalsContact C-N 3.32Å; A359-S361 PolarHBondContact O-N 2.91Å; S361-A365 WeakPolarHBondContact O-CB 3.32Å; S361-A365 PolarHBondContact O-N 3.35Å
362	I	60.9	Low	52.5	Low	90 Å²	90	110.5 Å²	110.5	46%	0.462	59%	0.59	S	S	.	*	H	α-helix	trans	-84.6	-44.7	174.6	-73.6	164.1	0	0	0	109.7	L358 A359 E360 A365 L366	L358-I362 HydrophobicContact CD1-CD1 4.32Å; L358-I362 HydrophobicContact CG-CD1 4.23Å; L358-I362 WeakPolarHBondContact O-CD1 3.36Å; L358-I362 VanDerWaalsContact O-CG1 3.22Å; L358-I362 WeakPolarHBondContact O-CG1 3.48Å; L358-I362 PolarHBondContact O-N 3.01Å; L358-I362 VanDerWaalsContact O-N 3.09Å; A359-I362 CarbonylContact O-C 3.57Å; A359-I362 WeakPolarHBondContact O-CA 3.22Å; A359-I362 WeakPolarHBondContact O-CB 3.35Å; A359-I362 PolarHBondContact O-N 3.19Å; E360-I362 VanDerWaalsContact C-N 3.27Å; E360-I362 PolarHBondContact O-N 3.36Å; I362-A365 WeakPolarHBondContact O-CB 3.27Å; I362-A365 PolarHBondContact O-N 3.42Å; I362-L366 HydrophobicContact CG2-CD1 4.09Å; I362-L366 VanDerWaalsContact O-CG 3.3Å; I362-L366 WeakPolarHBondContact O-CG 3.42Å; I362-L366 PolarHBondContact O-N 3.34Å
363	D	55.1	Low	51.3	Low	89 Å²	89	111.2 Å²	111.2	48%	0.476	61%	0.607	S	S	.	*	H	α-helix	trans	-66.8	-37.7	177.4	-74.2	-22.4	0	0	0	111.5	A359 E360 A365 L366 N367	A359-D363 PolarHBondContact O-N 3.23Å; E360-D363 PolarHBondContact O-N 3.37Å; D363-A365 VanDerWaalsContact C-N 3.35Å; D363-A365 PolarHBondContact O-N 3.48Å; D363-L366 PolarHBondContact O-N 3.48Å; D363-N367 VanDerWaalsContact O-CB 3.27Å; D363-N367 WeakPolarHBondContact O-CB 3.41Å; D363-N367 PolarHBondContact O-N 2.81Å; D363-N367 PolarHBondContact O-ND2 3.31Å; D363-N367 VanDerWaalsContact O-ND2 3.1Å
364	D	52.5	Low	49.9	Very low	101 Å²	101	112.6 Å²	112.6	54%	0.54	62%	0.624	S	S	.	*	H	α-helix	trans	-62.9	-40.3	170	-81.7	-17.1	0	0	0	111.5	E360 L366 N367 C368	E360-D364 VanDerWaalsContact O-CB 3.3Å; E360-D364 WeakPolarHBondContact O-CB 3.5Å; E360-D364 PolarHBondContact O-N 3.11Å; D364-L366 PolarHBondContact O-N 2.83Å; D364-N367 PolarHBondContact O-N 3.4Å; D364-C368 WeakPolarHBondContact O-CB 3.16Å; D364-C368 PolarHBondContact O-N 2.83Å; D364-C368 PolarHBondContact O-SG 3.15Å
365	A	53.3	Low	48.6	Very low	71 Å²	71	114.7 Å²	114.7	59%	0.587	63%	0.634	S	S	*	*	H	α-helix	trans	-67.5	-21.4	176.6	0	0	0	0	0	113.3	S361 I362 D363	S361-A365 WeakPolarHBondContact O-CB 3.32Å; S361-A365 PolarHBondContact O-N 3.35Å; I362-A365 WeakPolarHBondContact O-CB 3.27Å; I362-A365 PolarHBondContact O-N 3.42Å; D363-A365 VanDerWaalsContact C-N 3.35Å; D363-A365 PolarHBondContact O-N 3.48Å
366	L	46.8	Very low	47.1	Very low	113 Å²	113	114.6 Å²	114.6	59%	0.592	65%	0.649	S	S	*	*	H	α-helix	trans	-87.4	-45.2	173.4	-67	168.3	0	0	0	111.5	I362 D363 D364 R369	I362-L366 HydrophobicContact CG2-CD1 4.09Å; I362-L366 VanDerWaalsContact O-CG 3.3Å; I362-L366 WeakPolarHBondContact O-CG 3.42Å; I362-L366 PolarHBondContact O-N 3.34Å; D363-L366 PolarHBondContact O-N 3.48Å; D364-L366 PolarHBondContact O-N 2.83Å; L366-R369 PolarHBondContact O-N 3.14Å
367	N	47.9	Very low	46.2	Very low	109 Å²	109	114.5 Å²	114.5	58%	0.583	66%	0.661	S	S	*	*	H	α-helix	trans	-69.2	-37.3	-179.2	-71.6	-34.5	0	0	0	112.7	D363 D364 R369 S370	D363-N367 VanDerWaalsContact O-CB 3.27Å; D363-N367 WeakPolarHBondContact O-CB 3.41Å; D363-N367 PolarHBondContact O-N 2.81Å; D363-N367 PolarHBondContact O-ND2 3.31Å; D363-N367 VanDerWaalsContact O-ND2 3.1Å; D364-N367 PolarHBondContact O-N 3.4Å; N367-R369 PolarHBondContact O-N 3.4Å; N367-S370 PolarHBondContact O-N 2.98Å; N367-S370 VanDerWaalsContact O-N 3.08Å
368	C	42.2	Very low	44.4	Very low	111 Å²	111	117.5 Å²	117.5	75%	0.75	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	1.5	173.9	-67	0	0	0	0	114.1	D364	D364-C368 WeakPolarHBondContact O-CB 3.16Å; D364-C368 PolarHBondContact O-N 2.83Å; D364-C368 PolarHBondContact O-SG 3.15Å
369	R	46.3	Very low	43.3	Very low	225 Å²	225	117.7 Å²	117.7	85%	0.849	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	0.5	176	-130.8	-178.7	-165.9	-70.2	-6.3	115	L366 N367	L366-R369 PolarHBondContact O-N 3.14Å; N367-R369 PolarHBondContact O-N 3.4Å
370	S	38.2	Very low	42	Very low	93 Å²	93	123.9 Å²	123.9	65%	0.65	70%	0.701	S	S	*	*	S	Bend	trans	-109.1	-4.5	-170.1	-162.1	0	0	0	0	116.2	N367	N367-S370 PolarHBondContact O-N 2.98Å; N367-S370 VanDerWaalsContact O-N 3.08Å
371	L	34.4	Very low	40.7	Very low	171 Å²	171	123.9 Å²	123.9	90%	0.895	72%	0.719	S	S	*	*			trans	-134.3	69.1	-179.7	-75.4	176.5	0	0	0	113.2
372	Q	32.2	Very low	39.3	Very low	204 Å²	204	129.9 Å²	129.9	95%	0.953	74%	0.741	S	S	*	*	S	Bend	trans	-155.6	103.7	156	-168.2	162.8	64.8	0	0	109
373	G	29.3	Very low	37.6	Very low	77 Å²	77	128.7 Å²	128.7	79%	0.794	75%	0.752	S	S	*	*			cis	-147.2	-176.5	-1.1	0	0	0	0	0	112.5
374	D	35.6	Very low	36.2	Very low	157 Å²	157	130.4 Å²	130.4	84%	0.84	77%	0.769	S	S	*	*			trans	-103.6	-178.7	-169.7	-164.7	11.5	0	0	0	112.7
375	E	30.4	Very low	34.8	Very low	183 Å²	183	130.5 Å²	130.5	86%	0.855	78%	0.778	S	S	*	*			trans	80.9	145.2	172.3	-53.9	-159.6	97.6	0	0	118.5
376	G	30.8	Very low	33.5	Very low	74 Å²	74	136.4 Å²	136.4	76%	0.763	79%	0.79	S	S	*	*			trans	-103.4	-135.7	-173.2	0	0	0	0	0	114
377	P	35.3	Very low	32.6	Very low	131 Å²	131	136.7 Å²	136.7	85%	0.851	80%	0.796	S	S	*	*			cis	-128.6	-171	15.1	42.7	-26.6	0	0	0	115.5
378	D	28.3	Very low	31.4	Very low	136 Å²	136	140.1 Å²	140.1	73%	0.727	81%	0.809	S	S	*	*			trans	-58.6	158.9	166.9	-128.5	-30.1	0	0	0	112.3	E380	D378-E380 PolarHBondContact OD1-N 2.72Å
379	P	39	Very low	30.6	Very low	114 Å²	114	138 Å²	138	74%	0.74	81%	0.806	S	S	*	*				-145.4	149.3	64.8	38.3	-19.2	0	0	0	118.6
380	E	30.2	Very low	29.4	Very low	177 Å²	177	136.2 Å²	136.2	83%	0.827	81%	0.807	S	S	*	*			trans	25.3	113.2	139.1	-56.4	-169.3	129.9	0	0	120.6	D378	D378-E380 PolarHBondContact OD1-N 2.72Å
381	A	28	Very low	28.7	Very low	105 Å²	105	138 Å²	138	87%	0.868	81%	0.814	S	S	*	*				167.9	148.7	119.2	0	0	0	0	0	115.4
382	M	27.8	Very low	28.7	Very low	196 Å²	196	135.4 Å²	135.4	97%	0.966	81%	0.807	S	S	*	*			trans	-27.5	140.8	165.7	-130	69.8	161.5	0	0	117.2
383	G	27	Very low	28.1	Very low	66 Å²	66	135.4 Å²	135.4	68%	0.68	80%	0.8	S	S	*	*			cis	160.6	159.3	-6.9	0	0	0	0	0	113.7
384	C	23.9	Very low	27.8	Very low	125 Å²	125	139.3 Å²	139.3	85%	0.845	80%	0.797	S	S	*	*			trans	75	128.9	167.5	-157.2	0	0	0	0	120.9
385	S	24.4	Very low	27.1	Very low	102 Å²	102	138.1 Å²	138.1	71%	0.713	79%	0.788	S	S	*	*			trans	68.8	99.9	153.4	-69	0	0	0	0	123.5
386	K	25.8	Very low	26.7	Very low	195 Å²	195	137.7 Å²	137.7	85%	0.848	78%	0.784	S	S	*	*				77	153.8	113.2	-153	-173.7	-175.8	-177.5	0	120.2
387	V	26.9	Very low	26.3	Very low	119 Å²	119	138 Å²	138	72%	0.721	78%	0.775	S	S	*	*			trans	99.3	153.8	161.5	-172.7	0	0	0	0	117.2
388	Q	24.2	Very low	25.9	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	77%	0.765	S	S	*	*			trans	-60.4	167.7	176.2	-59.8	126.3	-66.8	0	0	113
389	G	24.2	Very low	25.9	Very low	67 Å²	67	141.7 Å²	141.7	69%	0.691	77%	0.767	S	S	*	*			cis	152.4	-175.9	-0.7	0	0	0	0	0	112.1
390	E	21.3	Very low	25.3	Very low	186 Å²	186	145.6 Å²	145.6	87%	0.869	77%	0.767	S	S	*	*			trans	67.7	120.3	161.7	-72.9	-166.7	161.3	0	0	122.7
391	V	23.2	Very low	26.2	Very low	132 Å²	132	143.2 Å²	143.2	80%	0.8	77%	0.767	S	S	*	*			trans	55.4	172.4	155.3	-89.2	0	0	0	0	120.2
392	P	34.3	Very low	26.3	Very low	115 Å²	115	142.5 Å²	142.5	75%	0.747	76%	0.761	S	S	*	*			cis	-131.1	163.1	-5.2	24.2	0.2	0	0	0	118.8
393	Y	21	Very low	26.2	Very low	205 Å²	205	135.7 Å²	135.7	80%	0.804	74%	0.741	S	S	*	*			trans	16.6	142.7	144	-89	-87.8	0	0	0	126.9
394	Q	22	Very low	26.3	Very low	158 Å²	158	144.1 Å²	144.1	74%	0.738	75%	0.753	S	S	*	*			trans	81.9	142.2	142.9	-111.7	175.6	96.4	0	0	118.8
395	M	21	Very low	26.5	Very low	133 Å²	133	146.1 Å²	146.1	66%	0.655	75%	0.752	S	S	*	*			cis	176.3	130.2	46.2	175.7	147.6	130.2	0	0	115.6
396	K	22.2	Very low	26.7	Very low	173 Å²	173	150.9 Å²	150.9	75%	0.752	75%	0.754	S	S	*	*			trans	67.7	163.6	147.8	-76.9	172.6	-166	164.2	0	120.8
397	S	23.4	Very low	26.8	Very low	82 Å²	82	146.3 Å²	146.3	57%	0.573	74%	0.739	S	S	*	*			cis	-166.3	160.9	5.8	-125.3	0	0	0	0	117.7
398	H	26.4	Very low	26.9	Very low	141 Å²	141	148.2 Å²	148.2	65%	0.653	74%	0.74	S	S	*	*			trans	77.7	152.9	144.9	-70.3	6.4	0	0	0	121.2
399	R	28.2	Very low	27.2	Very low	202 Å²	202	145.3 Å²	145.3	76%	0.762	73%	0.734	S	S	*	*			cis	-160.4	148.2	-16.8	-103.5	176.9	-160.2	-152.3	10.7	107.5
400	R	27.1	Very low	27.6	Very low	196 Å²	196	149 Å²	149	74%	0.74	74%	0.743	S	S	*	*				67.2	137.4	57.4	-114.9	-165	179.1	-168.6	-0.7	115
401	P	47.3	Very low	27.9	Very low	127 Å²	127	144.6 Å²	144.6	83%	0.825	74%	0.739	S	S	*	*				-135.9	-178	62.4	23.5	0.1	0	0	0	114.8
402	A	31.8	Very low	28.1	Very low	90 Å²	90	143.8 Å²	143.8	74%	0.744	74%	0.739	S	S	*	*			cis	-165.1	154.9	-30.8	0	0	0	0	0	111.4
403	G	25.9	Very low	27.9	Very low	54 Å²	54	149.4 Å²	149.4	56%	0.557	75%	0.747	S	S	*	*			trans	177.9	154.6	175.4	0	0	0	0	0	110.5
404	R	29.1	Very low	28.3	Very low	243 Å²	243	145.5 Å²	145.5	92%	0.917	75%	0.75	S	S	*	*			trans	-111.5	140.5	179.6	-60	-173.7	-174.8	-151.6	3.6	108.7
405	M	27.8	Very low	28.6	Very low	167 Å²	167	145.2 Å²	145.2	82%	0.823	75%	0.753	S	S	*	*				56.8	134	63.4	-70.4	-63.4	-147.3	0	0	112.2
406	R	27.5	Very low	28.7	Very low	202 Å²	202	144.2 Å²	144.2	76%	0.762	76%	0.755	S	S	*	*			cis	-167.6	147.4	45.2	-175.2	177.3	-179.8	-145.9	-19.7	114
407	D	28.1	Very low	28.9	Very low	99 Å²	99	141.4 Å²	141.4	53%	0.529	75%	0.752	S	S	.	*			trans	44.1	157.4	154.4	-53.2	-14.5	0	0	0	120.5
408	E	29.4	Very low	29.1	Very low	158 Å²	158	144 Å²	144	74%	0.738	76%	0.758	S	S	*	*			cis	-158.8	179.4	13.9	-143.5	158.2	-143.4	0	0	114
409	T	31.3	Very low	29	Very low	121 Å²	121	145.6 Å²	145.6	74%	0.742	76%	0.764	S	S	*	*			trans	68.1	100.5	157.6	51	0	0	0	0	124.7
410	V	32	Very low	29	Very low	145 Å²	145	141.6 Å²	141.6	88%	0.879	76%	0.757	S	S	*	*				34.9	118.7	122	-173.4	0	0	0	0	122.9
411	A	27.9	Very low	29	Very low	94 Å²	94	139.1 Å²	139.1	78%	0.777	76%	0.758	S	S	*	*			trans	-159.7	145.1	135	0	0	0	0	0	107.8
412	S	26.1	Very low	28	Very low	115 Å²	115	140.4 Å²	140.4	80%	0.804	75%	0.753	S	S	*	*			cis	85.6	135.5	26.3	-155.4	0	0	0	0	115.5
413	Y	31.5	Very low	27.8	Very low	232 Å²	232	142.7 Å²	142.7	91%	0.91	75%	0.752	S	S	*	*			trans	-78.5	149.1	-171.8	-84.1	-110.4	0	0	0	114
414	S	28.1	Very low	27.9	Very low	123 Å²	123	146.4 Å²	146.4	86%	0.86	76%	0.76	S	S	*	*			trans	-158.5	-178.2	145.6	58	0	0	0	0	110.7
415	D	27.9	Very low	27.7	Very low	152 Å²	152	141 Å²	141	81%	0.813	75%	0.748	S	S	*	*			trans	-128.1	160.3	-149.3	-119.3	-34.9	0	0	0	114.6
416	V	24.8	Very low	27.6	Very low	113 Å²	113	138.3 Å²	138.3	69%	0.685	75%	0.745	S	S	*	*			trans	75.9	113.6	142.6	165.6	0	0	0	0	122.7
417	T	26.5	Very low	27.4	Very low	114 Å²	114	137.4 Å²	137.4	70%	0.699	75%	0.749	S	S	*	*			trans	68.1	131.8	145.5	53.4	0	0	0	0	126.2
418	L	26.6	Very low	27.8	Very low	135 Å²	135	138.9 Å²	138.9	71%	0.707	76%	0.764	S	S	*	*			trans	63.8	158.8	149.5	-58	167.5	0	0	0	116.5
419	F	25	Very low	27.6	Very low	175 Å²	175	135.5 Å²	135.5	77%	0.768	76%	0.764	S	S	*	*			cis	-124.3	170	13.3	-79	-105.3	0	0	0	109.4
420	I	27.9	Very low	27.4	Very low	119 Å²	119	134.5 Å²	134.5	61%	0.61	77%	0.767	S	S	*	*			cis	73	129.7	46.3	-58.9	176.5	0	0	0	114
421	D	26.6	Very low	27.2	Very low	144 Å²	144	135 Å²	135	77%	0.77	76%	0.764	S	S	*	*			trans	68.9	149.6	168.2	-65.3	-9.7	0	0	0	119
422	E	25.4	Very low	27.1	Very low	154 Å²	154	142 Å²	142	72%	0.72	77%	0.77	S	S	*	*			cis	-155	-175.8	-3.3	-101.2	-106.1	75.7	0	0	109.7
423	D	28	Very low	27	Very low	137 Å²	137	141.3 Å²	141.3	73%	0.733	77%	0.766	S	S	*	*			trans	72.2	144.7	159.8	-57.7	-37.7	0	0	0	119.4
424	D	28.9	Very low	26.8	Very low	133 Å²	133	133.6 Å²	133.6	71%	0.711	76%	0.757	S	S	*	*			cis	-162.3	172.6	3.7	-148.8	-14.2	0	0	0	114.5
425	I	25.4	Very low	26.6	Very low	130 Å²	130	135.4 Å²	135.4	67%	0.667	76%	0.757	S	S	*	*			trans	77.9	97.8	144.6	-84	157.2	0	0	0	123
426	S	25	Very low	26.5	Very low	110 Å²	110	136.7 Å²	136.7	77%	0.769	76%	0.758	S	S	*	*				98.2	140.7	123.4	-66.4	0	0	0	0	125
427	H	23	Very low	27.5	Very low	182 Å²	182	135.8 Å²	135.8	84%	0.843	76%	0.755	S	S	*	*			trans	-100.7	179.4	175.6	-51.2	-88	0	0	0	112.8
428	P	35.8	Very low	27.4	Very low	130 Å²	130	135.5 Å²	135.5	84%	0.844	76%	0.757	S	S	*	*				-146.6	-177.6	81.7	38.5	-21.1	0	0	0	114.9
429	A	26.5	Very low	27.5	Very low	88 Å²	88	133.8 Å²	133.8	73%	0.727	76%	0.757	S	S	*	*			cis	-174.9	122.4	-46.7	0	0	0	0	0	110.8
430	A	26.5	Very low	27.7	Very low	99 Å²	99	131.5 Å²	131.5	82%	0.818	76%	0.757	S	S	*	*			trans	177.9	104.7	159.5	0	0	0	0	0	108.8
431	L	26.8	Very low	27.7	Very low	156 Å²	156	134.5 Å²	134.5	82%	0.817	77%	0.769	S	S	*	*				69.6	82.5	51.8	-72.4	171.2	0	0	0	116.8
432	R	26	Very low	27.8	Very low	240 Å²	240	132.8 Å²	132.8	91%	0.906	77%	0.768	S	S	*	*				-149.3	136.7	106.4	-68.4	-157.2	175	-164.8	-4	108.9
433	S	25	Very low	28	Very low	101 Å²	101	132.2 Å²	132.2	71%	0.706	77%	0.77	S	S	*	*			cis	89.9	106.1	21.5	83.3	0	0	0	0	115.9
434	G	26.6	Very low	28.1	Very low	70 Å²	70	131.4 Å²	131.4	72%	0.722	77%	0.765	S	S	*	*			trans	178.4	142.8	172.7	0	0	0	0	0	109.9
435	D	25.4	Very low	28.2	Very low	162 Å²	162	135.1 Å²	135.1	87%	0.866	77%	0.769	S	S	*	*			trans	-109.5	160.2	-146	-63.3	-74.7	0	0	0	119
436	Q	24.3	Very low	28.3	Very low	178 Å²	178	136.5 Å²	136.5	83%	0.832	78%	0.777	S	S	*	*			trans	-23.7	175.4	142.7	-83.4	-164.3	-15.5	0	0	118.9
437	P	47.3	Very low	28.3	Very low	95 Å²	95	139.2 Å²	139.2	62%	0.617	78%	0.777	S	S	*	*			cis	-144.8	-149.7	-44.2	43.2	-23.3	0	0	0	111.8
438	S	23	Very low	28.4	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	77%	0.773	S	S	*	*			trans	75.9	156.4	154	75.7	0	0	0	0	119.8
439	S	28.9	Very low	28	Very low	99 Å²	99	134.9 Å²	134.9	69%	0.692	77%	0.766	S	S	*	*			cis	-170.2	-174.6	-25.6	56.6	0	0	0	0	111.8
440	T	28.8	Very low	27.9	Very low	127 Å²	127	137.9 Å²	137.9	78%	0.779	77%	0.769	S	S	*	*			trans	77.8	132.5	171.5	68.8	0	0	0	0	119
441	E	28.7	Very low	27.9	Very low	182 Å²	182	138.6 Å²	138.6	85%	0.85	77%	0.769	S	S	*	*			cis	95	146.4	15	-70.7	-141.7	101.7	0	0	119.6
442	S	28.3	Very low	27.8	Very low	107 Å²	107	135.9 Å²	135.9	75%	0.748	76%	0.762	S	S	*	*			trans	73	121.8	174.8	-53.5	0	0	0	0	116.4
443	D	31.1	Very low	27.7	Very low	142 Å²	142	132 Å²	132	76%	0.759	76%	0.755	S	S	*	*			cis	85.7	149.2	22.6	-162.5	32.7	0	0	0	116.8
444	L	29.1	Very low	27.7	Very low	120 Å²	120	134.4 Å²	134.4	63%	0.628	76%	0.755	S	S	*	*			trans	135.9	94.7	149.8	-68.3	177.7	0	0	0	118.1
445	R	31.9	Very low	27.5	Very low	211 Å²	211	138.6 Å²	138.6	80%	0.796	75%	0.75	S	S	*	*				60.2	136.5	126.7	-62.2	-179.7	-174.1	171.5	2.6	124
446	L	26.2	Very low	27.5	Very low	159 Å²	159	139.8 Å²	139.8	83%	0.832	74%	0.742	S	S	*	*				-175.2	-176.9	118.1	-94.1	168.8	0	0	0	110.6
447	Q	25.1	Very low	28.4	Very low	167 Å²	167	136.5 Å²	136.5	78%	0.78	74%	0.736	S	S	*	*				-155.1	117.2	-94.8	177.3	177.7	-87.2	0	0	115.9
448	S	26.2	Very low	27.3	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	74%	0.74	S	S	*	*			trans	68.2	162.7	159.6	-136.4	0	0	0	0	117.5
449	V	26.2	Very low	27.4	Very low	113 Å²	113	140.1 Å²	140.1	69%	0.685	74%	0.74	S	S	*	*			cis	-154.5	139	22.2	-177.3	0	0	0	0	112.7
450	N	25.3	Very low	27.4	Very low	150 Å²	150	141.2 Å²	141.2	80%	0.802	75%	0.748	S	S	*	*			trans	45.9	171.8	154.6	-53.7	-4.9	0	0	0	121.6
451	S	25	Very low	27.4	Very low	115 Å²	115	143.4 Å²	143.4	80%	0.804	75%	0.747	S	S	*	*			cis	-155.5	171.5	14.8	-158.7	0	0	0	0	116.3
452	S	26.2	Very low	27.4	Very low	98 Å²	98	140.4 Å²	140.4	69%	0.685	74%	0.737	S	S	*	*			trans	-72.8	148.4	-164	-33.2	0	0	0	0	122.2
453	Q	24	Very low	27.5	Very low	160 Å²	160	143.7 Å²	143.7	75%	0.748	74%	0.74	S	S	*	*				54	126.5	111.4	-158.2	168.9	-9	0	0	124.4
454	E	25	Very low	27.4	Very low	150 Å²	150	140 Å²	140	70%	0.701	74%	0.736	S	S	*	*			trans	71.1	158.5	148.4	-77.9	-175.2	-115	0	0	122.4
455	Y	22.3	Very low	27.7	Very low	158 Å²	158	144.6 Å²	144.6	62%	0.62	75%	0.745	S	S	*	*			cis	-176.8	162.4	-20.3	-168.3	-166.9	0	0	0	113.5
456	W	25.8	Very low	27.5	Very low	188 Å²	188	139.8 Å²	139.8	71%	0.712	74%	0.735	S	S	*	*			trans	63.7	176	162.3	-83.9	158.1	0	0	0	120.5
457	P	41.3	Very low	27.9	Very low	108 Å²	108	137.7 Å²	137.7	70%	0.701	73%	0.729	S	S	*	*			cis	-139.3	152.8	3.7	37	-15.9	0	0	0	121.1
458	I	25.2	Very low	28.1	Very low	136 Å²	136	136.1 Å²	136.1	70%	0.697	73%	0.726	S	S	*	*				61.8	124.3	125.8	-56.5	172.9	0	0	0	125.6
459	D	25.7	Very low	28.2	Very low	143 Å²	143	136.9 Å²	136.9	77%	0.765	73%	0.726	S	S	*	*			trans	28	147	143.3	-55.9	-25.3	0	0	0	127.5
460	S	27.7	Very low	28.3	Very low	123 Å²	123	136.8 Å²	136.8	86%	0.86	73%	0.73	S	S	*	*				-156.7	117.9	126.3	-78.2	0	0	0	0	114.4
461	K	29.1	Very low	28.4	Very low	173 Å²	173	135.1 Å²	135.1	75%	0.752	73%	0.729	S	S	*	*			trans	-0.2	158.8	142	-72.2	-176.1	140.8	-73.2	0	120.1
462	D	29.3	Very low	28.4	Very low	118 Å²	118	140.8 Å²	140.8	63%	0.631	73%	0.733	S	S	*	*			cis	-161	173.8	0.1	-91.9	-24.8	0	0	0	105.2
463	E	30.1	Very low	28.4	Very low	177 Å²	177	140.6 Å²	140.6	83%	0.827	73%	0.732	S	S	*	*			cis	-161.7	170.3	-4.8	-123.7	-78.4	-119.6	0	0	107.2
464	G	29.6	Very low	28.6	Very low	65 Å²	65	139.2 Å²	139.2	67%	0.67	73%	0.734	S	S	*	*			trans	147.2	158.3	167.4	0	0	0	0	0	116.5
465	R	34.5	Very low	29.3	Very low	216 Å²	216	137.9 Å²	137.9	82%	0.815	74%	0.739	S	S	*	*			trans	-143.1	165.9	-162	-150.8	-178.5	-178.3	-99.4	5.4	114.5
466	D	28.5	Very low	29.4	Very low	109 Å²	109	134.9 Å²	134.9	58%	0.583	74%	0.741	S	S	*	*			trans	87.6	113	155.9	-62.3	-41.8	0	0	0	122.3
467	T	34.3	Very low	29.7	Very low	116 Å²	116	132.4 Å²	132.4	71%	0.712	74%	0.741	S	S	*	*			trans	36.6	125.9	131.8	0.4	0	0	0	0	124.7
468	D	28.2	Very low	29.1	Very low	134 Å²	134	135.2 Å²	135.2	72%	0.717	75%	0.745	S	S	*	*			trans	57.1	110	134.7	-74.8	-4.1	0	0	0	125.2
469	T	29.3	Very low	29.2	Very low	125 Å²	125	133.5 Å²	133.5	77%	0.767	74%	0.744	S	S	*	*				79.7	123.6	125.8	66.6	0	0	0	0	124.5
470	S	27.8	Very low	29.2	Very low	110 Å²	110	134.2 Å²	134.2	77%	0.769	74%	0.742	S	S	*	*				90	149.3	129.3	-158.8	0	0	0	0	122.9
471	C	27.4	Very low	29.2	Very low	115 Å²	115	134.7 Å²	134.7	78%	0.777	73%	0.731	S	S	*	*			trans	68.3	141	175.3	-53.3	0	0	0	0	114.8
472	R	24.7	Very low	29	Very low	235 Å²	235	133.8 Å²	133.8	89%	0.887	73%	0.729	S	S	*	*			cis	-153.3	176.2	24.1	-87.7	-161.6	173.7	-149.5	-1.5	109.7
473	S	26.5	Very low	28.8	Very low	94 Å²	94	137.5 Å²	137.5	66%	0.657	74%	0.735	S	S	*	*			cis	-166.2	175.5	-13	-100	0	0	0	0	111.2
474	T	28.4	Very low	28.7	Very low	130 Å²	130	137.1 Å²	137.1	80%	0.798	74%	0.737	S	S	*	*			trans	-67.1	171.3	164.7	41.5	0	0	0	0	114
475	P	39.8	Very low	28.5	Very low	122 Å²	122	143.4 Å²	143.4	79%	0.792	74%	0.741	S	S	*	*			cis	-134.9	-166.9	35.1	42.2	-20.3	0	0	0	114.6
476	S	25.1	Very low	28.2	Very low	95 Å²	95	138.4 Å²	138.4	66%	0.664	73%	0.734	S	S	*	*			cis	-160.6	138.9	21.4	-171.3	0	0	0	0	115
477	L	32	Very low	28	Very low	137 Å²	137	139.9 Å²	139.9	72%	0.717	74%	0.742	S	S	*	*			trans	42	124.2	144.2	-56.5	177.6	0	0	0	120.7
478	E	28.2	Very low	27.5	Very low	167 Å²	167	142.1 Å²	142.1	78%	0.78	74%	0.744	S	S	*	*				80.8	148.9	60.1	-80	-166.7	162.5	0	0	114.9
479	C	26.7	Very low	27.3	Very low	100 Å²	100	143.8 Å²	143.8	68%	0.676	75%	0.752	S	S	*	*			cis	-132.7	-142.8	-11.3	-144.5	0	0	0	0	108
480	Q	27.1	Very low	27.6	Very low	157 Å²	157	143 Å²	143	73%	0.734	75%	0.749	S	S	*	*			cis	-161.2	146.7	-3.2	-139.9	177.8	-37.1	0	0	104.2
481	E	26.7	Very low	27.6	Very low	133 Å²	133	145.5 Å²	145.5	62%	0.621	75%	0.753	S	S	*	*			cis	-152.5	-155.1	-4.4	-135	-175.7	85	0	0	105.8
482	Q	24.3	Very low	27.6	Very low	155 Å²	155	148.4 Å²	148.4	72%	0.724	76%	0.76	S	S	*	*			cis	-142.6	155.9	-3.4	-175.7	162.6	96.5	0	0	108.9
483	R	26.5	Very low	27.8	Very low	196 Å²	196	143.2 Å²	143.2	74%	0.74	75%	0.754	S	S	*	*			trans	-158.1	126	169.4	174	-175	-75.7	177.2	-6.2	110.5
484	L	26.2	Very low	28	Very low	169 Å²	169	147 Å²	147	89%	0.885	77%	0.765	S	S	*	*			trans	-80	146.8	164.8	-72.2	173.5	0	0	0	111.1
485	R	26.8	Very low	28.1	Very low	196 Å²	196	148.5 Å²	148.5	74%	0.74	76%	0.763	S	S	*	*			trans	-131.6	129.8	178.4	-104.8	-172.7	170.5	141	-7	110.9
486	V	26.9	Very low	27.9	Very low	112 Å²	112	147.2 Å²	147.2	68%	0.679	76%	0.755	S	S	*	*				43.5	121.5	118.8	-177.4	0	0	0	0	117.3
487	D	24.6	Very low	28.4	Very low	139 Å²	139	149 Å²	149	74%	0.743	77%	0.765	S	S	*	*				-167.9	173	108	-119.7	-53	0	0	0	116.7
488	H	24.1	Very low	28.3	Very low	164 Å²	164	148 Å²	148	76%	0.759	77%	0.769	S	S	*	*			trans	-71.6	172.2	-168.3	-58.5	-67.8	0	0	0	118.4
489	L	24.4	Very low	28.2	Very low	168 Å²	168	148 Å²	148	88%	0.88	77%	0.774	S	S	*	*				170.3	178.8	129.2	-85.3	162.5	0	0	0	110.2
490	P	35.2	Very low	28.3	Very low	108 Å²	108	148.1 Å²	148.1	70%	0.701	78%	0.776	S	S	*	*				-129.1	-179.5	-67.1	38.3	-22.2	0	0	0	115.5
491	L	28.6	Very low	28.4	Very low	164 Å²	164	146.8 Å²	146.8	86%	0.859	78%	0.784	S	S	*	*			trans	-69.1	149.4	167.1	-72.7	149.4	0	0	0	112.6
492	L	27.5	Very low	28.6	Very low	175 Å²	175	145 Å²	145	92%	0.916	79%	0.792	S	S	*	*			trans	-108.3	105.9	165.4	-74.6	177.4	0	0	0	112
493	T	29	Very low	28.9	Very low	126 Å²	126	145.8 Å²	145.8	77%	0.773	80%	0.796	S	S	*	*			trans	-89.7	144.1	161.5	42.3	0	0	0	0	110.6
494	I	30.4	Very low	29.2	Very low	173 Å²	173	143.3 Å²	143.3	89%	0.887	80%	0.797	S	S	*	*			trans	-92.6	125.3	173.3	-57	172.4	0	0	0	109.3
495	E	30.2	Very low	29.4	Very low	163 Å²	163	140.9 Å²	140.9	76%	0.762	79%	0.793	S	S	*	*			trans	-125.5	161.1	173.1	-89.4	-92.7	99	0	0	110.1
496	P	35.4	Very low	29.6	Very low	95 Å²	95	137.6 Å²	137.6	62%	0.617	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-76.3	170.1	-173.7	31.9	-35.5	0	0	0	113.5
497	P	36.5	Very low	29.8	Very low	133 Å²	133	142.1 Å²	142.1	86%	0.864	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.8	146	-172.4	26.8	-36.6	0	0	0	113.6
498	S	29.1	Very low	30.1	Very low	116 Å²	116	140.2 Å²	140.2	81%	0.811	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-76.7	149.8	178.7	-45.6	0	0	0	0	112.6
499	D	26.1	Very low	30.4	Very low	167 Å²	167	138.5 Å²	138.5	89%	0.893	79%	0.79	S	S	*	*			trans	-130	148.6	152.8	-149.4	-17.3	0	0	0	107.7
500	S	29.5	Very low	30.7	Very low	102 Å²	102	141.5 Å²	141.5	71%	0.713	79%	0.789	S	S	*	*			trans	-115.9	130.1	-161	-61.4	0	0	0	0	114.1
501	S	29.2	Very low	30.4	Very low	129 Å²	129	140.2 Å²	140.2	90%	0.902	80%	0.796	S	S	*	*			trans	-163.8	142	147.7	-79.5	0	0	0	0	109.4
502	A	31.1	Very low	30.5	Very low	96 Å²	96	138.3 Å²	138.3	79%	0.793	80%	0.796	S	S	*	*			trans	-107.6	162.1	175.2	0	0	0	0	0	110.1
503	E	30.4	Very low	30.6	Very low	171 Å²	171	135.4 Å²	135.4	80%	0.799	79%	0.786	S	S	*	*				-168.6	143.5	124.9	-101.9	-160.9	141.5	0	0	113.1
504	L	31.5	Very low	30.7	Very low	144 Å²	144	137.7 Å²	137.7	75%	0.754	79%	0.785	S	S	*	*			trans	44.3	119	140.2	-56.4	178.3	0	0	0	122.8
505	S	31.1	Very low	30.7	Very low	117 Å²	117	139.8 Å²	139.8	82%	0.818	78%	0.782	S	S	*	*				107.8	132	119.6	-136.2	0	0	0	0	122.5
506	D	29.9	Very low	31.3	Very low	127 Å²	127	137.5 Å²	137.5	68%	0.679	78%	0.78	S	S	*	*			trans	71.2	160.9	144.1	-131.7	9.4	0	0	0	124.6
507	R	31.6	Very low	32.2	Very low	208 Å²	208	138.1 Å²	138.1	79%	0.785	79%	0.785	S	S	*	*			trans	-61.1	168	-161.9	-74.4	152.9	170.8	151	-8.1	120.5
508	S	30.7	Very low	31.7	Very low	98 Å²	98	138.6 Å²	138.6	69%	0.685	79%	0.785	S	S	*	*			trans	87.7	110.1	137.8	-84.3	0	0	0	0	120.6
509	D	30.9	Very low	31.7	Very low	129 Å²	129	143.7 Å²	143.7	69%	0.69	79%	0.788	S	S	*	*				60.3	137.7	119	-88.4	-69.6	0	0	0	122.9
510	R	31.7	Very low	31.9	Very low	230 Å²	230	142.3 Å²	142.3	87%	0.868	78%	0.776	S	S	*	*			trans	55.3	92.6	147.9	-64.9	172.7	-177.4	-157	-4.7	117
511	G	28.7	Very low	32.5	Very low	82 Å²	82	143 Å²	143	85%	0.845	78%	0.778	S	S	*	*			trans	-71.3	171.9	160	0	0	0	0	0	113.4
512	S	30.9	Very low	32.5	Very low	124 Å²	124	144.2 Å²	144.2	87%	0.867	77%	0.769	S	S	*	*			trans	-138.4	167.7	162.1	-166.3	0	0	0	0	110.5
513	V	29.8	Very low	32.3	Very low	114 Å²	114	143.2 Å²	143.2	69%	0.691	77%	0.768	S	S	*	*			trans	-126.6	154.4	-168.5	167	0	0	0	0	108.9
514	K	29.6	Very low	32.3	Very low	173 Å²	173	143.2 Å²	143.2	75%	0.752	77%	0.768	S	S	*	*			trans	79.5	152.1	178.7	-71	140.4	-176.6	178.7	0	114.5
515	R	31.2	Very low	32.1	Very low	218 Å²	218	143 Å²	143	82%	0.823	77%	0.765	S	S	*	*			cis	-174.8	-177.2	-23.7	-120.4	-173.3	-157.6	163.2	2.5	107.3
516	P	42.7	Very low	31.9	Very low	114 Å²	114	143.3 Å²	143.3	74%	0.74	76%	0.762	S	S	*	*				-110.5	-107.9	-117.6	23.4	0.7	0	0	0	117.3
517	P	53.6	Low	31.7	Very low	109 Å²	109	142.4 Å²	142.4	71%	0.708	76%	0.761	S	S	*	*				-122.1	164.4	-118	38.5	-23	0	0	0	115
518	V	26.1	Very low	31.5	Very low	143 Å²	143	137.1 Å²	137.1	87%	0.867	76%	0.756	S	S	*	*			trans	-133.9	111.7	161.9	-178	0	0	0	0	110.4
519	Y	29.5	Very low	31.4	Very low	223 Å²	223	137.2 Å²	137.2	88%	0.875	76%	0.757	S	S	*	*			trans	48.5	142.2	147.8	-119	-114.7	0	0	0	123.9
520	E	30.4	Very low	31.3	Very low	138 Å²	138	140.3 Å²	140.3	65%	0.645	77%	0.767	S	S	*	*			trans	-62.4	173.6	157.1	-89.9	-173	124.6	0	0	112.2	H522	E520-H522 IonicContact OE1-CE1 3.93Å; E520-H522 PolarHBondContact OE1-CE1 2.79Å; E520-H522 IonicContact OE1-ND1 2.71Å
521	P	41.8	Very low	31.1	Very low	115 Å²	115	134 Å²	134	75%	0.747	77%	0.765	S	S	*	*			cis	-144.5	-176	32.4	41.5	-19.3	0	0	0	119.3
522	H	29.8	Very low	31.1	Very low	156 Å²	156	135.6 Å²	135.6	72%	0.722	76%	0.763	S	S	*	*			trans	-48.5	153.7	-174.3	-30.7	-51.3	0	0	0	117.6	E520	E520-H522 IonicContact OE1-CE1 3.93Å; E520-H522 PolarHBondContact OE1-CE1 2.79Å; E520-H522 IonicContact OE1-ND1 2.71Å
523	G	27.1	Very low	31.8	Very low	74 Å²	74	135.6 Å²	135.6	76%	0.763	76%	0.76	S	S	*	*			trans	-173.6	92.3	172.9	0	0	0	0	0	116
524	H	29.5	Very low	32	Very low	172 Å²	172	139.5 Å²	139.5	80%	0.796	77%	0.768	S	S	*	*			trans	-34.1	162.8	155.3	-66.4	-76.4	0	0	0	116.6
525	I	26.7	Very low	32	Very low	138 Å²	138	139.2 Å²	139.2	71%	0.708	77%	0.769	S	S	*	*			cis	179.2	159.7	-18.2	-149.8	169.9	0	0	0	106.5
526	V	28.6	Very low	31.8	Very low	124 Å²	124	134.9 Å²	134.9	75%	0.752	76%	0.761	S	S	*	*			trans	66.6	153.6	164	162.3	0	0	0	0	117.1
527	T	26	Very low	31.1	Very low	108 Å²	108	134 Å²	134	66%	0.663	76%	0.757	S	S	*	*			cis	-156.9	164.8	-41.4	43	0	0	0	0	108.8
528	S	26.2	Very low	30.2	Very low	97 Å²	97	137.7 Å²	137.7	68%	0.678	77%	0.765	S	S	*	*			trans	53.3	135.8	142	65.5	0	0	0	0	120.6
529	S	28.6	Very low	30.1	Very low	101 Å²	101	134.3 Å²	134.3	71%	0.706	76%	0.759	S	S	*	*				-170.6	150.1	58.9	-69.3	0	0	0	0	115
530	Q	28.3	Very low	31.2	Very low	193 Å²	193	130 Å²	130	90%	0.902	76%	0.758	S	S	*	*			trans	34.4	125.7	141.2	-59.1	-176	-0.7	0	0	122.8
531	A	27.3	Very low	32.8	Very low	98 Å²	98	128.7 Å²	128.7	81%	0.81	76%	0.762	S	S	*	*				-152.2	163.7	127	0	0	0	0	0	110.9
532	S	29.6	Very low	33.2	Very low	115 Å²	115	129.4 Å²	129.4	80%	0.804	77%	0.766	S	S	*	*			trans	-156.3	-176.3	-177.1	-67.5	0	0	0	0	107.8
533	P	46.3	Very low	33.2	Very low	125 Å²	125	133.8 Å²	133.8	81%	0.812	78%	0.776	S	S	*	*			cis	-141.9	-171.3	6.8	43.8	-23.2	0	0	0	117.7
534	K	32.6	Very low	33.4	Very low	195 Å²	195	135 Å²	135	85%	0.848	78%	0.779	S	S	*	*			trans	-59.7	164.9	179.5	-45.5	157.6	-179.7	175.2	0	117.4
535	H	29.5	Very low	34.1	Very low	168 Å²	168	132.1 Å²	132.1	78%	0.778	78%	0.776	S	S	*	*			trans	-164.7	134.5	132.3	-125.9	-128.3	0	0	0	115.9
536	I	28.3	Very low	34	Very low	127 Å²	127	130.2 Å²	130.2	65%	0.651	77%	0.774	S	S	*	*			trans	48.7	150.3	143.1	-64.8	-171.5	0	0	0	120.3
537	S	27.1	Very low	33.9	Very low	96 Å²	96	134.9 Å²	134.9	67%	0.671	78%	0.779	S	S	*	*			cis	-147.9	144	11.9	21.2	0	0	0	0	111.4
538	H	34.6	Very low	34	Very low	186 Å²	186	135.7 Å²	135.7	86%	0.861	78%	0.779	S	S	*	*				64	138	91	-57.8	-74.6	0	0	0	119
539	G	24.9	Very low	34	Very low	72 Å²	72	138.3 Å²	138.3	74%	0.742	79%	0.785	S	S	*	*			trans	-118.3	-144.7	174	0	0	0	0	0	112.7
540	P	52.5	Low	33.9	Very low	132 Å²	132	140.9 Å²	140.9	86%	0.857	79%	0.791	S	S	*	*			cis	-136.7	-123	5	41.9	-16.7	0	0	0	115.1
541	P	64.4	Low	34	Very low	111 Å²	111	135.6 Å²	135.6	72%	0.721	78%	0.78	S	S	*	*			trans	-116.5	-175	-147	46.3	-29.2	0	0	0	116.5
542	P	48.8	Very low	35	Very low	130 Å²	130	136 Å²	136	84%	0.844	77%	0.774	S	S	*	*				-154.8	-157.9	92.4	43.2	-22.4	0	0	0	116.7
543	R	30.5	Very low	34.8	Very low	247 Å²	247	137.1 Å²	137.1	93%	0.932	77%	0.771	S	S	*	*			trans	-92	157.5	-169.4	-47.5	161.2	176.3	151.6	-5.2	115.2
544	A	31.2	Very low	34	Very low	99 Å²	99	142.8 Å²	142.8	82%	0.818	78%	0.776	S	S	*	*			trans	-167.4	165.1	142.6	0	0	0	0	0	112
545	P	43.8	Very low	33.8	Very low	113 Å²	113	140.1 Å²	140.1	73%	0.734	77%	0.766	S	S	*	*			trans	-131.3	174.1	-160.3	42.9	-27.5	0	0	0	118.7
546	S	25	Very low	33.7	Very low	97 Å²	97	140.7 Å²	140.7	68%	0.678	76%	0.762	S	S	*	*			trans	67.9	135.8	143.6	64.6	0	0	0	0	123.1
547	R	27.5	Very low	33.7	Very low	222 Å²	222	141.2 Å²	141.2	84%	0.838	76%	0.761	S	S	*	*			trans	69.6	155.9	144.9	-79.1	-170.8	166.9	161.7	-2.1	117.6
548	D	26.5	Very low	33.8	Very low	126 Å²	126	146.9 Å²	146.9	67%	0.674	77%	0.768	S	S	*	*			cis	-138.2	141	-4.1	-93	-37.2	0	0	0	106.8
549	D	26.6	Very low	33.4	Very low	151 Å²	151	144.4 Å²	144.4	81%	0.807	76%	0.756	S	S	*	*				83.5	164.2	98.2	-147.5	-6.7	0	0	0	114.6
550	D	27.1	Very low	33.6	Very low	156 Å²	156	147 Å²	147	83%	0.834	75%	0.753	S	S	*	*			trans	67.2	147.1	175	-99.5	-41.5	0	0	0	122.1
551	A	31	Very low	32.3	Very low	81 Å²	81	148.5 Å²	148.5	67%	0.669	75%	0.748	S	S	*	*			trans	-125.2	-153.9	166.8	0	0	0	0	0	107.2
552	P	46.8	Very low	30.5	Very low	106 Å²	106	147.3 Å²	147.3	69%	0.688	74%	0.743	S	S	*	*			cis	-133.6	-158.5	-19.5	28.7	-3.3	0	0	0	112.3
553	L	26.5	Very low	29.5	Very low	139 Å²	139	147.9 Å²	147.9	73%	0.728	73%	0.734	S	S	*	*			trans	67.9	114.8	154.9	-59.6	173.4	0	0	0	121.9
554	R	28.2	Very low	29.3	Very low	244 Å²	244	142.8 Å²	142.8	92%	0.921	73%	0.725	S	S	*	*				-146.4	137.2	112.9	-66.3	-159.6	172.5	-180	-2.5	108.6
555	H	28.4	Very low	29.1	Very low	140 Å²	140	142.2 Å²	142.2	65%	0.648	72%	0.72	S	S	*	*			cis	69.2	140.2	46.7	-89.3	21.9	0	0	0	114.1
556	R	27.9	Very low	28.3	Very low	180 Å²	180	143.3 Å²	143.3	68%	0.679	72%	0.718	S	S	*	*			cis	-167.5	171.8	-2	-129.4	-172.4	153.6	160.3	-14.3	107.3
557	H	29	Very low	28.2	Very low	137 Å²	137	146.3 Å²	146.3	63%	0.634	73%	0.727	S	S	*	*			cis	-168.9	147.3	-5.3	-153.1	19.3	0	0	0	109.6
558	R	27.6	Very low	28	Very low	215 Å²	215	139.5 Å²	139.5	81%	0.811	73%	0.725	S	S	*	*			trans	173.3	148.7	142.4	-102.7	177.8	169.9	168.8	-2.3	111.9
559	Q	26.4	Very low	28.1	Very low	134 Å²	134	139.1 Å²	139.1	63%	0.626	73%	0.732	S	S	*	*			cis	-146	168	-8	-160	158.8	-39.9	0	0	111.3
560	L	30.6	Very low	28.2	Very low	128 Å²	128	136.2 Å²	136.2	67%	0.67	73%	0.729	S	S	*	*			trans	-26.1	159.9	175.2	-82.7	50.3	0	0	0	118.7
561	E	25.3	Very low	28.3	Very low	162 Å²	162	135.4 Å²	135.4	76%	0.757	73%	0.725	S	S	*	*			cis	-146	169.4	21.2	-150.4	140.7	-139.4	0	0	115
562	S	25.5	Very low	28.5	Very low	87 Å²	87	141.3 Å²	141.3	61%	0.608	73%	0.73	S	S	*	*			trans	-99.1	-179.2	-179.7	53.2	0	0	0	0	113
563	H	28	Very low	27.7	Very low	142 Å²	142	143 Å²	143	66%	0.657	73%	0.729	S	S	*	*				-175.7	140.2	83.3	-92	-77.5	0	0	0	113.4
564	L	27.1	Very low	28.1	Very low	140 Å²	140	140.4 Å²	140.4	73%	0.733	72%	0.722	S	S	*	*			trans	57	135.6	148.4	-52.6	172	0	0	0	118.6
565	A	26.6	Very low	28.2	Very low	87 Å²	87	137.9 Å²	137.9	72%	0.719	72%	0.718	S	S	*	*			cis	79.6	149.1	21.8	0	0	0	0	0	117.1
566	I	25.6	Very low	28.3	Very low	135 Å²	135	135.4 Å²	135.4	69%	0.692	72%	0.716	S	S	*	*			trans	97.6	116.4	161.5	-57.2	174.8	0	0	0	118.7
567	N	24	Very low	28.4	Very low	161 Å²	161	135.1 Å²	135.1	86%	0.861	72%	0.723	S	S	*	*			trans	56.7	153.3	151.1	-58.5	-7.6	0	0	0	123
568	G	23.2	Very low	28.4	Very low	78 Å²	78	133.4 Å²	133.4	80%	0.804	73%	0.726	S	S	*	*			trans	168.7	68.9	164.1	0	0	0	0	0	119.2
569	S	28.6	Very low	28.6	Very low	118 Å²	118	129.6 Å²	129.6	83%	0.825	72%	0.722	S	S	*	*			trans	-42	154.3	170.8	52.9	0	0	0	0	121.2
570	A	28.8	Very low	28.7	Very low	91 Å²	91	132.5 Å²	132.5	75%	0.752	73%	0.733	S	S	*	*			trans	99.2	150.4	137.8	0	0	0	0	0	122.7
571	N	28.3	Very low	28.8	Very low	139 Å²	139	130.8 Å²	130.8	74%	0.743	73%	0.731	S	S	*	*			trans	67.2	132.9	172.6	-79.4	-11.8	0	0	0	117.8
572	R	35.3	Very low	29	Very low	204 Å²	204	130.5 Å²	130.5	77%	0.77	74%	0.735	S	S	*	*				65.9	136	61.2	-67.7	-173.8	176.3	-143.4	13.3	111.9
573	Q	31.7	Very low	29.3	Very low	143 Å²	143	130 Å²	130	67%	0.668	74%	0.743	S	S	*	*			cis	-166.6	170.6	0.8	-118.9	-178	-88.5	0	0	107.6
574	S	33.8	Very low	29.6	Very low	83 Å²	83	131 Å²	131	58%	0.58	75%	0.754	S	S	*	*			cis	-166.8	171.4	3.5	-140.5	0	0	0	0	109.5
575	K	31.3	Very low	30	Very low	191 Å²	191	131.5 Å²	131.5	83%	0.83	76%	0.757	S	S	*	*			trans	76.3	145.2	165.3	-62.3	177	178.3	-171.4	0	116.7
576	S	29.4	Very low	30.5	Very low	89 Å²	89	134.5 Å²	134.5	62%	0.622	76%	0.761	S	S	*	*			cis	-156.4	134.3	-5	30.6	0	0	0	0	107.7
577	E	29.8	Very low	30.9	Very low	174 Å²	174	133.2 Å²	133.2	81%	0.813	76%	0.764	S	S	*	*				59.5	132.1	94.2	-57.8	162.4	128.7	0	0	113.3
578	S	30.3	Very low	31.4	Very low	101 Å²	101	133.5 Å²	133.5	71%	0.706	76%	0.764	S	S	*	*			cis	-169	156	0.4	51.2	0	0	0	0	112.9
579	D	30.6	Very low	31.7	Very low	135 Å²	135	136.8 Å²	136.8	72%	0.722	76%	0.763	S	S	*	*			trans	46.2	127.9	135.1	-69.8	14.5	0	0	0	125.2
580	F	29.6	Very low	31.8	Very low	195 Å²	195	135.4 Å²	135.4	86%	0.855	75%	0.754	S	S	*	*			trans	68.9	151.6	136.4	-75.8	-64.4	0	0	0	124.4
581	S	31.7	Very low	31.9	Very low	91 Å²	91	137.1 Å²	137.1	64%	0.636	76%	0.755	S	S	*	*			trans	71.3	122	162.7	-81.7	0	0	0	0	121.4
582	D	30.7	Very low	32	Very low	156 Å²	156	136.4 Å²	136.4	83%	0.834	76%	0.76	S	S	*	*				44.3	137.8	115.1	-42.1	-46.4	0	0	0	120.3
583	G	31.9	Very low	31.8	Very low	76 Å²	76	134.3 Å²	134.3	78%	0.784	77%	0.765	S	S	*	*			trans	153.1	108.7	162.1	0	0	0	0	0	114
584	D	33.2	Very low	31.8	Very low	163 Å²	163	132.7 Å²	132.7	87%	0.872	77%	0.769	S	S	*	*			trans	-51	150.6	167	-45.1	-66	0	0	0	112.7
585	N	34.9	Very low	31.6	Very low	152 Å²	152	136.5 Å²	136.5	81%	0.813	78%	0.783	S	S	*	*				172.1	161.6	94.1	-156.1	-0.8	0	0	0	111.8
586	D	37.6	Very low	31.7	Very low	150 Å²	150	134.4 Å²	134.4	80%	0.802	78%	0.781	S	S	*	*			trans	-72.1	136.7	-178.3	-74	-63	0	0	0	113.9
587	S	33.9	Very low	31.8	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	79%	0.789	S	S	*	*			trans	-162.7	103.1	145.6	3.3	0	0	0	0	113.9
588	I	35	Very low	31.7	Very low	166 Å²	166	136.3 Å²	136.3	85%	0.851	79%	0.793	S	S	*	*			trans	30.8	149.8	140.2	60.8	168.5	0	0	0	123.5
589	N	29.8	Very low	31.6	Very low	148 Å²	148	138 Å²	138	79%	0.791	79%	0.794	S	S	*	*			trans	95	143.9	157.7	-160.2	13.1	0	0	0	118.2
590	S	30.8	Very low	31.3	Very low	89 Å²	89	136 Å²	136	62%	0.622	79%	0.79	S	S	*	*			trans	66.9	88.4	174.4	-58.6	0	0	0	0	116.9
591	T	29.3	Very low	31.2	Very low	126 Å²	126	132 Å²	132	77%	0.773	79%	0.785	S	S	*	*				53.3	99.6	73.8	75.6	0	0	0	0	115.7
592	S	31.7	Very low	31	Very low	124 Å²	124	133.4 Å²	133.4	87%	0.867	80%	0.795	S	S	*	*			trans	-160.2	133.6	135	-84.9	0	0	0	0	111
593	N	30.3	Very low	30.9	Very low	160 Å²	160	134.8 Å²	134.8	86%	0.856	80%	0.797	S	S	*	*			trans	-89.2	133.7	171.5	-72.7	-46.8	0	0	0	109.6
594	S	32.2	Very low	30.6	Very low	109 Å²	109	136.8 Å²	136.8	76%	0.762	80%	0.799	S	S	*	*			trans	-134	86	158.7	47.3	0	0	0	0	110.1	D596	S594-D596 PolarHBondContact O-N 2.92Å
595	N	30.3	Very low	30.4	Very low	163 Å²	163	134.4 Å²	134.4	87%	0.872	80%	0.795	S	S	*	*			trans	-74.5	101.7	159.8	-84.6	-59.5	0	0	0	107.5
596	D	31.8	Very low	30.1	Very low	147 Å²	147	133.1 Å²	133.1	79%	0.786	80%	0.798	S	S	*	*			trans	-120.3	144.7	169.2	-115.1	-49.1	0	0	0	112	S594	S594-D596 PolarHBondContact O-N 2.92Å
597	T	31.6	Very low	29.9	Very low	131 Å²	131	138.1 Å²	138.1	80%	0.804	81%	0.806	S	S	*	*			trans	-83.7	122.4	-167.9	50.9	0	0	0	0	112.3
598	I	29	Very low	29.6	Very low	173 Å²	173	140.8 Å²	140.8	89%	0.887	81%	0.812	S	S	*	*			trans	-95.3	118.3	159.7	-54.8	-178.2	0	0	0	108.8
599	N	26.9	Very low	29.7	Very low	135 Å²	135	137.5 Å²	137.5	72%	0.722	80%	0.803	S	S	*	*			trans	-110	153	171	-180	39.9	0	0	0	109.5
600	C	24.4	Very low	29.8	Very low	94 Å²	94	138.2 Å²	138.2	64%	0.635	81%	0.806	S	S	*	*			trans	64	116.9	168	-77.1	0	0	0	0	119.6
601	S	27.3	Very low	29.8	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	82%	0.816	S	S	*	*				76.2	112.4	124.5	-53.9	0	0	0	0	120
602	S	29	Very low	29.6	Very low	121 Å²	121	145.5 Å²	145.5	85%	0.846	81%	0.812	S	S	*	*			trans	-68.2	130.7	158.3	-40.8	0	0	0	0	111.4
603	E	27.5	Very low	29.4	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.864	81%	0.809	S	S	*	*			trans	-117.6	165.5	150.5	-76.6	-160.5	100.6	0	0	109
604	S	26.3	Very low	29.4	Very low	118 Å²	118	145.8 Å²	145.8	83%	0.825	80%	0.803	S	S	*	*			trans	78.4	136	-165.4	-45.9	0	0	0	0	114.3
605	S	29.1	Very low	29.2	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	81%	0.809	S	S	*	*			cis	-163.4	141.9	-14.5	54.3	0	0	0	0	110.9
606	S	29.3	Very low	29	Very low	126 Å²	126	146.4 Å²	146.4	88%	0.881	81%	0.806	S	S	*	*			trans	-158.3	103.5	155.6	47.1	0	0	0	0	111.9
607	R	33.3	Very low	29.1	Very low	255 Å²	255	148.4 Å²	148.4	96%	0.962	81%	0.808	S	S	*	*			trans	-115.8	105.4	158.2	-102.2	-175.7	165.9	-176.2	-4.1	107.1
608	D	27.4	Very low	29	Very low	164 Å²	164	150.9 Å²	150.9	88%	0.877	81%	0.81	S	S	*	*			trans	-154.1	171.5	134.5	-147.5	-15.6	0	0	0	109.5
609	S	35.7	Very low	28.9	Very low	96 Å²	96	148.6 Å²	148.6	67%	0.671	80%	0.804	S	S	*	*			trans	-150.8	163.6	-159.1	-143.7	0	0	0	0	116.8
610	L	31.7	Very low	29.1	Very low	164 Å²	164	152.2 Å²	152.2	86%	0.859	81%	0.81	S	S	*	*			trans	77.5	158.3	162.5	-64.9	166.2	0	0	0	119.3
611	R	30.8	Very low	29.2	Very low	217 Å²	217	156.3 Å²	156.3	82%	0.819	82%	0.819	S	S	*	*			trans	78.5	128.4	175.4	-147.5	157.7	-173.3	169	5.2	114.1
612	E	26.6	Very low	29.5	Very low	151 Å²	151	159.7 Å²	159.7	71%	0.706	82%	0.82	S	S	*	*			cis	-142.9	174.6	7	-148.6	146.1	-141.4	0	0	112.2
613	Q	27.8	Very low	29.4	Very low	171 Å²	171	162.6 Å²	162.6	80%	0.799	82%	0.82	S	S	*	*			trans	-104.9	149.6	176.2	-66.5	179.3	-18.1	0	0	111.5
614	T	29.3	Very low	29.4	Very low	119 Å²	119	159.7 Å²	159.7	73%	0.73	82%	0.815	S	S	*	*				159.4	148.4	115.7	42.6	0	0	0	0	113.7
615	L	29	Very low	29.6	Very low	168 Å²	168	165.4 Å²	165.4	88%	0.88	82%	0.818	S	S	*	*			trans	63.7	149.4	162.3	-62.1	157.9	0	0	0	117.1
616	S	25.7	Very low	29.8	Very low	116 Å²	116	166.4 Å²	166.4	81%	0.811	82%	0.815	S	S	*	*			cis	-147.5	176.4	-10.5	45.8	0	0	0	0	110.6
617	K	33.6	Very low	30	Very low	189 Å²	189	165.4 Å²	165.4	82%	0.822	81%	0.808	S	S	*	*			trans	-96.4	168.8	-166.2	-62.6	176.5	179.1	172.9	0	115.1
618	Q	28.8	Very low	30	Very low	183 Å²	183	164.4 Å²	164.4	86%	0.855	80%	0.804	S	S	*	*			trans	75.5	141.1	155.6	-83.7	164.7	-13.3	0	0	116.4
619	T	27.5	Very low	30.4	Very low	125 Å²	125	163.1 Å²	163.1	77%	0.767	80%	0.797	S	S	*	*			cis	-143.4	167.2	8.5	-66.8	0	0	0	0	111.8
620	Y	30.1	Very low	30.3	Very low	212 Å²	212	161.5 Å²	161.5	83%	0.831	79%	0.786	S	S	*	*			trans	-54.2	137.8	175	-83.3	-118.7	0	0	0	114.9
621	H	28.4	Very low	31.1	Very low	180 Å²	180	157.9 Å²	157.9	83%	0.833	77%	0.772	S	S	*	*				-161.8	129.1	108.2	-120	-91.5	0	0	0	115.3
622	K	33.5	Very low	31.8	Very low	180 Å²	180	154.1 Å²	154.1	78%	0.783	77%	0.767	S	S	*	*			trans	-15.4	117.9	162.8	178.6	-166.7	179.3	-173.1	0	118.5
623	E	25.2	Very low	32.7	Very low	183 Å²	183	154.4 Å²	154.4	86%	0.855	77%	0.766	S	S	*	*				-158.2	109	129	-130.1	172	-131.9	0	0	113.1	R625	E623-R625 PolarHBondContact O-N 2.92Å; E623-R625 VanDerWaalsContact O-N 3.09Å
624	T	27.8	Very low	34.2	Very low	123 Å²	123	148.2 Å²	148.2	76%	0.755	74%	0.742	S	S	*	*			trans	-84.3	84.2	-179.3	-41.9	0	0	0	0	110.5	N626	T624-N626 PolarHBondContact O-N 3.26Å; T624-N626 PolarHBondContact O-OD1 2.88Å
625	R	32	Very low	36.4	Very low	238 Å²	238	147.6 Å²	147.6	90%	0.898	73%	0.734	S	S	*	*			trans	-69.9	93.6	175	-170.2	171.7	179.9	170.1	-1.6	109.8	E623 S627	E623-R625 PolarHBondContact O-N 2.92Å; E623-R625 VanDerWaalsContact O-N 3.09Å; R625-S627 PolarHBondContact O-N 3.18Å
626	N	31.5	Very low	39.1	Very low	135 Å²	135	143 Å²	143	72%	0.722	71%	0.71	S	S	*	*			trans	-63.9	86.2	-173.8	-76.9	-10	0	0	0	113.1	T624 W628	T624-N626 PolarHBondContact O-N 3.26Å; T624-N626 PolarHBondContact O-OD1 2.88Å; N626-W628 PolarHBondContact O-N 2.86Å; N626-W628 VanDerWaalsContact O-N 3.16Å
627	S	34.8	Very low	42.3	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	69%	0.692	S	S	*	*			trans	-79.9	86.4	175.3	180	0	0	0	0	111.4	R625	R625-S627 PolarHBondContact O-N 3.18Å
628	W	33.7	Very low	45.2	Very low	234 Å²	234	135.2 Å²	135.2	89%	0.886	67%	0.67	S	S	*	*			trans	-137.9	2.8	175.4	-78.6	114.3	0	0	0	115.5	N626 S630	N626-W628 PolarHBondContact O-N 2.86Å; N626-W628 VanDerWaalsContact O-N 3.16Å; W628-S630 PolarHBondContact O-N 3.44Å
629	D	35.6	Very low	48.4	Very low	136 Å²	136	132.7 Å²	132.7	73%	0.727	65%	0.653	S	S	*	*			trans	-86.3	110.6	170.5	-163.7	0.6	0	0	0	109.8	S634	D629-S634 PolarHBondContact OD1-OG 3.03Å
630	S	33.1	Very low	51.6	Low	62 Å²	62	132 Å²	132	43%	0.434	64%	0.64	S	S	.	*			trans	-118.6	117.5	173.9	-71.1	0	0	0	0	107.8	W628 I632 F633 S634	W628-S630 PolarHBondContact O-N 3.44Å; S630-I632 PolarHBondContact O-N 3.15Å; S630-F633 PolarHBondContact O-N 3.31Å; S630-S634 PolarHBondContact O-N 3.04Å; S630-S634 PolarHBondContact O-OG 2.89Å
631	P	48.5	Very low	54.8	Low	88 Å²	88	124.4 Å²	124.4	57%	0.571	61%	0.609	S	S	*	*	H	α-helix	trans	-64	-16.2	-162	22.9	-34.4	0	0	0	114.8	S634 N635	P631-S634 WeakPolarHBondContact CA-OG 3.34Å; P631-N635 WeakPolarHBondContact O-CB 3.25Å; P631-N635 PolarHBondContact O-N 3.39Å; P631-N635 PolarHBondContact O-ND2 2.89Å
632	I	44.6	Very low	58.1	Low	138 Å²	138	117 Å²	117	71%	0.708	58%	0.575	S	S	*	*	H	α-helix	trans	-72.5	-46.3	176.7	-58	175	0	0	0	110.7	S630 D636	S630-I632 PolarHBondContact O-N 3.15Å; I632-D636 PolarHBondContact O-N 2.82Å
633	F	46.9	Very low	61.2	Low	157 Å²	157	111.1 Å²	111.1	69%	0.689	55%	0.548	S	S	*	.	H	α-helix	trans	-75.5	-33.5	-177.2	-68.2	-74.6	0	0	0	112.8	S630 D636 V637	S630-F633 PolarHBondContact O-N 3.31Å; F633-D636 PolarHBondContact O-N 3.45Å; F633-V637 PolarHBondContact O-N 3.43Å
634	S	59.3	Low	64.7	Low	41 Å²	41	104.9 Å²	104.9	29%	0.287	52%	0.517	S	S	.	.	H	α-helix	trans	-70.6	-37	176.1	44.6	0	0	0	0	112.4	D629 S630 P631 D636 V637 I638	D629-S634 PolarHBondContact OD1-OG 3.03Å; S630-S634 PolarHBondContact O-N 3.04Å; S630-S634 PolarHBondContact O-OG 2.89Å; P631-S634 WeakPolarHBondContact CA-OG 3.34Å; S634-D636 VanDerWaalsContact C-N 3.25Å; S634-D636 PolarHBondContact O-N 2.82Å; S634-V637 PolarHBondContact O-N 3.01Å; S634-I638 WeakPolarHBondContact O-CD1 3.32Å; S634-I638 WeakPolarHBondContact O-CG1 3.46Å; S634-I638 PolarHBondContact O-N 3.43Å
635	N	74.3	Confident	68	Low	106 Å²	106	99 Å²	99	57%	0.567	48%	0.481	S	S	*	.	H	α-helix	trans	-55.6	-41.2	168.9	-99.3	-80.8	0	0	0	112.3	P631 I638 R639	P631-N635 WeakPolarHBondContact O-CB 3.25Å; P631-N635 PolarHBondContact O-N 3.39Å; P631-N635 PolarHBondContact O-ND2 2.89Å; N635-I638 PolarHBondContact O-N 3.33Å; N635-R639 WeakPolarHBondContact O-CB 3.48Å; N635-R639 PolarHBondContact O-N 3.46Å
636	D	87.3	Confident	71.1	Confident	72 Å²	72	87.7 Å²	87.7	39%	0.385	44%	0.438	S	S	.	.	H	α-helix	trans	-69.1	-37.6	-173.9	-157.9	38.5	0	0	0	112.3	I632 F633 S634 K640	I632-D636 PolarHBondContact O-N 2.82Å; F633-D636 PolarHBondContact O-N 3.45Å; S634-D636 VanDerWaalsContact C-N 3.25Å; S634-D636 PolarHBondContact O-N 2.82Å; D636-K640 WeakPolarHBondContact O-CB 3.32Å; D636-K640 WeakPolarHBondContact O-CD 3.33Å; D636-K640 WeakPolarHBondContact O-CG 3.21Å; D636-K640 PolarHBondContact O-N 3.07Å; D636-K640 IonicContact OD1-NZ 3.27Å; D636-K640 WeakPolarHBondContact OD2-CE 3.17Å; D636-K640 IonicContact OD2-NZ 2.95Å; D636-K640 PolarHBondContact OD2-NZ 3.27Å
637	V	92.4	Very high	74.3	Confident	69 Å²	69	82 Å²	82	42%	0.418	41%	0.407	S	S	.	.	H	α-helix	trans	-63.7	-46.2	170.3	178.5	0	0	0	0	111.1	F633 S634 K640 R641	F633-V637 PolarHBondContact O-N 3.43Å; S634-V637 PolarHBondContact O-N 3.01Å; V637-K640 PolarHBondContact O-N 3.18Å; V637-R641 WeakPolarHBondContact O-CB 3.4Å; V637-R641 PolarHBondContact O-N 3.04Å
638	I	93.8	Very high	77.3	Confident	73 Å²	73	77.3 Å²	77.3	37%	0.374	37%	0.374	S	S	.	.	H	α-helix	trans	-64.4	-42.3	-180	-67.8	166	0	0	0	111.1	S634 N635 R641 H642	S634-I638 WeakPolarHBondContact O-CD1 3.32Å; S634-I638 WeakPolarHBondContact O-CG1 3.46Å; S634-I638 PolarHBondContact O-N 3.43Å; N635-I638 PolarHBondContact O-N 3.33Å; I638-R641 WeakPolarHBondContact O-CB 3.48Å; I638-R641 PolarHBondContact O-N 2.92Å; I638-H642 PolarHBondContact O-CD2 2.95Å; I638-H642 VanDerWaalsContact O-CD2 3.28Å; I638-H642 PolarHBondContact O-N 2.97Å
639	R	95.3	Very high	80.4	Confident	129 Å²	129	67.3 Å²	67.3	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-43.1	176.2	-171.3	168.1	-176.2	79.7	7.2	111.1	N635 R641 H642 Y643 G665 F666	N635-R639 WeakPolarHBondContact O-CB 3.48Å; N635-R639 PolarHBondContact O-N 3.46Å; R639-R641 VanDerWaalsContact C-N 3.3Å; R639-R641 PolarHBondContact O-N 3.48Å; R639-H642 PolarHBondContact O-N 3.46Å; R639-Y643 PolarHBondContact O-N 3.3Å; R639-G665 PolarHBondContact NH2-O 3.09Å; R639-F666 HydrophobicContact CG-CE1 3.71Å; R639-F666 HydrophobicContact CG-CZ 3.94Å; R639-F666 WeakPolarHBondContact O-CZ 3.4Å
640	K	96.6	Very high	83.4	Confident	112 Å²	112	60.8 Å²	60.8	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-34.1	172.9	-73	163.3	-175.2	167.4	0	112.1	D636 V637 R644	D636-K640 WeakPolarHBondContact O-CB 3.32Å; D636-K640 WeakPolarHBondContact O-CD 3.33Å; D636-K640 WeakPolarHBondContact O-CG 3.21Å; D636-K640 PolarHBondContact O-N 3.07Å; D636-K640 IonicContact OD1-NZ 3.27Å; D636-K640 WeakPolarHBondContact OD2-CE 3.17Å; D636-K640 IonicContact OD2-NZ 2.95Å; D636-K640 PolarHBondContact OD2-NZ 3.27Å; V637-K640 PolarHBondContact O-N 3.18Å; K640-R644 WeakPolarHBondContact O-CG 3.33Å; K640-R644 PolarHBondContact O-N 3.12Å; K640-R644 PolarHBondContact O-NH1 2.92Å
641	R	97.3	Very high	86.5	Confident	52 Å²	52	58 Å²	58	20%	0.196	28%	0.284	C	S	.	.	H	α-helix	trans	-67	-49.7	173.5	-166.5	-174.1	-59.4	146.7	1.7	111.9	V637 I638 R639 Y643 R644 I645 E974 E978	V637-R641 WeakPolarHBondContact O-CB 3.4Å; V637-R641 PolarHBondContact O-N 3.04Å; I638-R641 WeakPolarHBondContact O-CB 3.48Å; I638-R641 PolarHBondContact O-N 2.92Å; R639-R641 VanDerWaalsContact C-N 3.3Å; R639-R641 PolarHBondContact O-N 3.48Å; R641-Y643 VanDerWaalsContact C-N 3.3Å; R641-Y643 PolarHBondContact O-N 3.39Å; R641-R644 PolarHBondContact O-N 2.88Å; R641-R644 VanDerWaalsContact O-N 3.11Å; R641-I645 HydrophobicContact CG-CD1 4.14Å; R641-I645 WeakPolarHBondContact O-CG1 3.34Å; R641-I645 PolarHBondContact O-N 3.47Å; R641-E974 WeakPolarHBondContact CB-OE1 3.45Å; R641-E974 WeakPolarHBondContact CG-OE1 3.49Å; R641-E974 IonicContact CZ-OE1 3.35Å; R641-E974 IonicContact CZ-OE2 3.41Å; R641-E974 IonicContact NE-OE1 3.38Å; R641-E974 PolarHBondContact NE-OE1 2.69Å; R641-E974 IonicContact NE-OE2 2.91Å; R641-E974 PolarHBondContact NE-OE2 2.83Å; R641-E974 IonicContact NH2-OE1 3.53Å; R641-E974 IonicContact NH2-OE2 3.58Å; R641-E974 PolarHBondContact NH2-OE2 3.38Å; R641-E978 HydrophobicContact CG-CB 4.19Å
642	H	97	Very high	88.8	Confident	24 Å²	24	58.3 Å²	58.3	11%	0.111	28%	0.276	C	S	.	.	H	α-helix	trans	-60.2	-38.1	176.8	-76.1	-61.7	0	0	0	112.6	I638 R639 R644 I645 G646 Y660 F666 E981	I638-H642 PolarHBondContact O-CD2 2.95Å; I638-H642 VanDerWaalsContact O-CD2 3.28Å; I638-H642 PolarHBondContact O-N 2.97Å; R639-H642 PolarHBondContact O-N 3.46Å; H642-R644 PolarHBondContact O-N 3.39Å; H642-I645 PolarHBondContact O-N 2.91Å; H642-G646 PolarHBondContact O-N 3.48Å; H642-Y660 PolarHBondContact ND1-OH 3.07Å; H642-F666 HydrophobicContact CB-CE2 4.04Å; H642-F666 HydrophobicContact CB-CZ 4.07Å; H642-E981 IonicContact CE1-OE1 3.25Å
643	Y	98	Very high	91.2	Very high	57 Å²	57	58.2 Å²	58.2	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-59	-47.1	172.8	-178.9	-106.1	0	0	0	111.9	R639 R641 I645 G646 L647 L661 F666 F677	R639-Y643 PolarHBondContact O-N 3.3Å; R641-Y643 VanDerWaalsContact C-N 3.3Å; R641-Y643 PolarHBondContact O-N 3.39Å; Y643-I645 VanDerWaalsContact C-N 3.34Å; Y643-I645 PolarHBondContact O-N 3.24Å; Y643-G646 PolarHBondContact O-N 3.1Å; Y643-G646 VanDerWaalsContact O-N 3.15Å; Y643-L647 HydrophobicContact CD1-CD1 4.19Å; Y643-L647 HydrophobicContact CE1-CD1 3.68Å; Y643-L647 HydrophobicContact CE1-CG 4.18Å; Y643-L647 PolarHBondContact O-N 2.98Å; Y643-L661 HydrophobicContact CD2-CD2 3.92Å; Y643-L661 HydrophobicContact CE2-CD2 4.2Å; Y643-F666 HydrophobicContact CD2-CB 4.07Å; Y643-F666 AromaticContact CD2-CD1 3.79Å; Y643-F666 HydrophobicContact CD2-CD1 3.79Å; Y643-F666 HydrophobicContact CD2-CD2 4.34Å; Y643-F666 HydrophobicContact CD2-CE1 4.29Å; Y643-F666 AromaticContact CD2-CG 3.83Å; Y643-F666 HydrophobicContact CD2-CG 3.83Å; Y643-F666 HydrophobicContact CE2-CB 4.47Å; Y643-F666 HydrophobicContact CG-CD1 4.43Å; Y643-F666 HydrophobicContact CG-CE1 4.5Å; Y643-F677 HydrophobicContact CE2-CE2 4.24Å
644	R	98.3	Very high	93.6	Very high	52 Å²	52	51.1 Å²	51.1	20%	0.196	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-34	176.8	-64.1	-178.5	-29.9	-99.2	-1.3	112.5	K640 R641 H642 L647 N648 E974 E978	K640-R644 WeakPolarHBondContact O-CG 3.33Å; K640-R644 PolarHBondContact O-N 3.12Å; K640-R644 PolarHBondContact O-NH1 2.92Å; R641-R644 PolarHBondContact O-N 2.88Å; R641-R644 VanDerWaalsContact O-N 3.11Å; H642-R644 PolarHBondContact O-N 3.39Å; R644-L647 PolarHBondContact O-N 3.16Å; R644-N648 WeakPolarHBondContact O-CB 3.48Å; R644-N648 PolarHBondContact O-N 3.4Å; R644-N648 PolarHBondContact O-ND2 3.27Å; R644-N648 PolarHBondContact O-OD1 2.9Å; R644-E974 IonicContact CZ-OE1 2.82Å; R644-E974 IonicContact NH1-OE1 3.06Å; R644-E974 PolarHBondContact NH1-OE1 2.94Å; R644-E974 IonicContact NH2-OE1 3.36Å; R644-E974 PolarHBondContact NH2-OE1 3.43Å; R644-E978 IonicContact CZ-OE2 2.69Å; R644-E978 IonicContact NE-OE2 3.99Å; R644-E978 PolarHBondContact NE-OE2 3.45Å; R644-E978 IonicContact NH2-OE2 2.66Å; R644-E978 PolarHBondContact NH2-OE2 2.98Å
645	I	97.9	Very high	95.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-42.8	171.2	-67	167	0	0	0	110.6	R641 H642 Y643 L647 N648 L649 Y660 E978 E981 M982	R641-I645 HydrophobicContact CG-CD1 4.14Å; R641-I645 WeakPolarHBondContact O-CG1 3.34Å; R641-I645 PolarHBondContact O-N 3.47Å; H642-I645 PolarHBondContact O-N 2.91Å; Y643-I645 VanDerWaalsContact C-N 3.34Å; Y643-I645 PolarHBondContact O-N 3.24Å; I645-L647 PolarHBondContact O-N 3.44Å; I645-N648 PolarHBondContact O-N 3.42Å; I645-L649 HydrophobicContact CG2-CD1 3.91Å; I645-L649 HydrophobicContact CG2-CG 4.29Å; I645-L649 WeakPolarHBondContact O-CB 3.37Å; I645-L649 VanDerWaalsContact O-CG 3.27Å; I645-L649 WeakPolarHBondContact O-CG 3.28Å; I645-L649 PolarHBondContact O-N 2.95Å; I645-Y660 HydrophobicContact CB-CE1 4.29Å; I645-Y660 HydrophobicContact CG2-CE1 3.97Å; I645-E978 HydrophobicContact CG1-CG 4.11Å; I645-E981 HydrophobicContact CD1-CB 3.71Å; I645-E981 HydrophobicContact CD1-CG 3.7Å; I645-M982 HydrophobicContact CG1-CB 4.47Å; I645-M982 HydrophobicContact CG2-CB 4.3Å
646	G	97.9	Very high	96.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-42.8	173.2	0	0	0	0	0	113.1	H642 Y643 L649 F650	H642-G646 PolarHBondContact O-N 3.48Å; Y643-G646 PolarHBondContact O-N 3.1Å; Y643-G646 VanDerWaalsContact O-N 3.15Å; G646-L649 PolarHBondContact O-N 2.94Å; G646-F650 WeakPolarHBondContact O-CB 3.2Å; G646-F650 PolarHBondContact O-N 2.73Å
647	L	98.4	Very high	96.9	Very high	14 Å²	14	46.2 Å²	46.2	7%	0.073	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-42.3	172.4	-59.7	-178.9	0	0	0	112.5	Y643 R644 I645 L649 F650 N651 F677 L684	Y643-L647 HydrophobicContact CD1-CD1 4.19Å; Y643-L647 HydrophobicContact CE1-CD1 3.68Å; Y643-L647 HydrophobicContact CE1-CG 4.18Å; Y643-L647 PolarHBondContact O-N 2.98Å; R644-L647 PolarHBondContact O-N 3.16Å; I645-L647 PolarHBondContact O-N 3.44Å; L647-L649 VanDerWaalsContact C-N 3.31Å; L647-L649 PolarHBondContact O-N 2.81Å; L647-F650 PolarHBondContact O-N 2.97Å; L647-N651 WeakPolarHBondContact O-CB 3.4Å; L647-N651 PolarHBondContact O-N 3.06Å; L647-N651 PolarHBondContact O-ND2 2.79Å; L647-F677 HydrophobicContact CD2-CE2 4.48Å; L647-F677 HydrophobicContact CD2-CZ 3.88Å; L647-L684 HydrophobicContact CD2-CD2 3.56Å; L647-L684 HydrophobicContact CD2-CG 4.09Å
648	N	98	Very high	97.1	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.043	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-35.9	176.9	-67.5	-18.4	0	0	0	112.1	R644 I645 K652 N897 E978 M982	R644-N648 WeakPolarHBondContact O-CB 3.48Å; R644-N648 PolarHBondContact O-N 3.4Å; R644-N648 PolarHBondContact O-ND2 3.27Å; R644-N648 PolarHBondContact O-OD1 2.9Å; I645-N648 PolarHBondContact O-N 3.42Å; N648-K652 WeakPolarHBondContact O-CG 3.27Å; N648-K652 PolarHBondContact O-N 2.73Å; N648-N897 PolarHBondContact OD1-ND2 2.76Å; N648-E978 PolarHBondContact ND2-OE1 3.44Å; N648-M982 HydrophobicContact CB-SD 3.96Å
649	L	97.8	Very high	97.3	Very high	23 Å²	23	44.3 Å²	44.3	12%	0.12	19%	0.191	C	C	.	.	H	α-helix	trans	-67.9	-46.1	173.6	-72.9	167.8	0	0	0	110.7	I645 G646 L647 N651 K652 K653 Y660 Y985	I645-L649 HydrophobicContact CG2-CD1 3.91Å; I645-L649 HydrophobicContact CG2-CG 4.29Å; I645-L649 WeakPolarHBondContact O-CB 3.37Å; I645-L649 VanDerWaalsContact O-CG 3.27Å; I645-L649 WeakPolarHBondContact O-CG 3.28Å; I645-L649 PolarHBondContact O-N 2.95Å; G646-L649 PolarHBondContact O-N 2.94Å; L647-L649 VanDerWaalsContact C-N 3.31Å; L647-L649 PolarHBondContact O-N 2.81Å; L649-N651 VanDerWaalsContact C-N 3.32Å; L649-N651 PolarHBondContact O-N 2.89Å; L649-K652 PolarHBondContact O-N 2.97Å; L649-K653 CarbonylContact O-C 3.56Å; L649-K653 PolarHBondContact O-N 2.92Å; L649-Y660 HydrophobicContact CD1-CD1 3.88Å; L649-Y660 HydrophobicContact CD1-CD2 3.78Å; L649-Y660 HydrophobicContact CD1-CE1 4.3Å; L649-Y660 HydrophobicContact CD1-CE2 4.18Å; L649-Y660 HydrophobicContact CD1-CG 3.58Å; L649-Y985 HydrophobicContact CD1-CD1 3.72Å; L649-Y985 HydrophobicContact CD1-CE1 3.48Å; L649-Y985 VanDerWaalsContact CD1-CE1 3.48Å; L649-Y985 HydrophobicContact CD2-CD1 4.01Å; L649-Y985 HydrophobicContact CD2-CE1 3.94Å; L649-Y985 HydrophobicContact CG-CD1 4.49Å; L649-Y985 HydrophobicContact CG-CE1 4.38Å
650	F	98.4	Very high	97.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.3	-48.4	174.6	-178.8	-88.2	0	0	0	111	G646 L647 K652 K653 P654 I658 L678 L684 M688 I689 F692	G646-F650 WeakPolarHBondContact O-CB 3.2Å; G646-F650 PolarHBondContact O-N 2.73Å; L647-F650 PolarHBondContact O-N 2.97Å; F650-K652 PolarHBondContact O-N 3.37Å; F650-K653 CarbonylContact O-C 3.59Å; F650-K653 PolarHBondContact O-N 3.47Å; F650-P654 HydrophobicContact CD2-CB 3.96Å; F650-P654 WeakPolarHBondContact CD2-O 3.5Å; F650-P654 HydrophobicContact CE2-CB 3.7Å; F650-P654 HydrophobicContact CZ-CB 4.06Å; F650-P654 WeakPolarHBondContact O-CA 3.31Å; F650-P654 WeakPolarHBondContact O-CG 3.38Å; F650-I658 HydrophobicContact CD2-CD1 3.71Å; F650-I658 HydrophobicContact CD2-CG1 3.92Å; F650-I658 HydrophobicContact CE2-CD1 3.79Å; F650-I658 HydrophobicContact CE2-CG1 3.96Å; F650-L678 HydrophobicContact CE1-CD2 4.4Å; F650-L678 HydrophobicContact CE2-CD2 3.6Å; F650-L678 HydrophobicContact CZ-CD2 3.48Å; F650-L678 VanDerWaalsContact CZ-CD2 3.48Å; F650-L684 HydrophobicContact CB-CD2 4.23Å; F650-L684 HydrophobicContact CD1-CD2 3.45Å; F650-L684 VanDerWaalsContact CD1-CD2 3.45Å; F650-L684 HydrophobicContact CD2-CD2 4.42Å; F650-L684 HydrophobicContact CE1-CB 4.4Å; F650-L684 HydrophobicContact CE1-CD2 3.87Å; F650-L684 HydrophobicContact CG-CD2 3.77Å; F650-M688 HydrophobicContact CD1-CB 4.23Å; F650-M688 HydrophobicContact CE1-CB 3.81Å; F650-I689 HydrophobicContact CE1-CG1 4.06Å; F650-I689 HydrophobicContact CZ-CG1 4.15Å; F650-F692 HydrophobicContact CE2-CB 4.36Å; F650-F692 HydrophobicContact CE2-CG 4.34Å; F650-F692 HydrophobicContact CZ-CB 4.29Å
651	N	98	Very high	97.4	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	7.3	179.6	-64.8	-36.6	0	0	0	114.6	L647 L649 G683 S685 H865	L647-N651 WeakPolarHBondContact O-CB 3.4Å; L647-N651 PolarHBondContact O-N 3.06Å; L647-N651 PolarHBondContact O-ND2 2.79Å; L649-N651 VanDerWaalsContact C-N 3.32Å; L649-N651 PolarHBondContact O-N 2.89Å; N651-G683 PolarHBondContact ND2-O 3.46Å; N651-S685 PolarHBondContact OD1-N 3.06Å; N651-H865 VanDerWaalsContact CB-CA 3.47Å; N651-H865 HydrophobicContact CB-CB 3.65Å; N651-H865 WeakPolarHBondContact O-CB 3.27Å
652	K	96.3	Very high	97.3	Very high	93 Å²	93	31.8 Å²	31.8	40%	0.404	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122	-42.3	171.5	-75.2	-176.3	178.7	-173.5	0	112.7	N648 L649 F650 H865	N648-K652 WeakPolarHBondContact O-CG 3.27Å; N648-K652 PolarHBondContact O-N 2.73Å; L649-K652 PolarHBondContact O-N 2.97Å; F650-K652 PolarHBondContact O-N 3.37Å; K652-H865 WeakPolarHBondContact CE-CD2 3.43Å; K652-H865 VanDerWaalsContact CE-CE1 3.49Å; K652-H865 WeakPolarHBondContact CE-CE1 3.49Å; K652-H865 WeakPolarHBondContact CE-ND1 3.36Å; K652-H865 VanDerWaalsContact CE-NE2 3.33Å; K652-H865 WeakPolarHBondContact CE-NE2 3.35Å; K652-H865 HydrophobicContact CG-CB 3.87Å; K652-H865 WeakPolarHBondContact CG-ND1 3.25Å
653	K	96.3	Very high	97.3	Very high	137 Å²	137	36.2 Å²	36.2	60%	0.596	16%	0.164	S	C	*	.	S	Bend	trans	-148.8	90.6	-179.2	-64.1	-161.4	177.4	-155	0	107.6	L649 F650 E655 K656 G657	L649-K653 CarbonylContact O-C 3.56Å; L649-K653 PolarHBondContact O-N 2.92Å; F650-K653 CarbonylContact O-C 3.59Å; F650-K653 PolarHBondContact O-N 3.47Å; K653-E655 VanDerWaalsContact C-N 3.3Å; K653-E655 PolarHBondContact O-N 2.84Å; K653-E655 VanDerWaalsContact O-N 3.16Å; K653-K656 HydrophobicContact CB-CB 4.23Å; K653-K656 PolarHBondContact O-N 2.89Å; K653-G657 PolarHBondContact O-N 3.45Å; K653-G657 VanDerWaalsContact O-N 3.15Å
654	P	97.2	Very high	97.1	Very high	8 Å²	8	38.1 Å²	38.1	5%	0.052	17%	0.171	C	C	.	.	H	α-helix	trans	-51.1	-43.5	-166.2	-32.8	38.3	0	0	0	115	F650 K656 G657 I658 M688 F692	F650-P654 HydrophobicContact CD2-CB 3.96Å; F650-P654 WeakPolarHBondContact CD2-O 3.5Å; F650-P654 HydrophobicContact CE2-CB 3.7Å; F650-P654 HydrophobicContact CZ-CB 4.06Å; F650-P654 WeakPolarHBondContact O-CA 3.31Å; F650-P654 WeakPolarHBondContact O-CG 3.38Å; P654-K656 VanDerWaalsContact C-N 3.35Å; P654-K656 PolarHBondContact O-N 2.78Å; P654-G657 WeakPolarHBondContact O-CA 3.41Å; P654-G657 PolarHBondContact O-N 3.35Å; P654-I658 PolarHBondContact O-N 2.79Å; P654-M688 HydrophobicContact CG-CB 4.26Å; P654-M688 HydrophobicContact CG-CE 3.73Å; P654-F692 HydrophobicContact CB-CB 3.67Å; P654-F692 HydrophobicContact CB-CD2 3.69Å; P654-F692 HydrophobicContact CB-CG 4.08Å; P654-F692 HydrophobicContact CG-CB 4.34Å
655	E	95.9	Very high	97	Very high	53 Å²	53	38 Å²	38	25%	0.248	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-39.5	179.6	-58.3	80.4	-180	0	0	112.3	K653 G657 Q659 F692 N695 K698	K653-E655 VanDerWaalsContact C-N 3.3Å; K653-E655 PolarHBondContact O-N 2.84Å; K653-E655 VanDerWaalsContact O-N 3.16Å; E655-G657 VanDerWaalsContact C-N 3.3Å; E655-Q659 VanDerWaalsContact O-CB 3.31Å; E655-Q659 WeakPolarHBondContact O-CB 3.32Å; E655-Q659 PolarHBondContact O-N 3.31Å; E655-F692 HydrophobicContact CG-CD2 4.26Å; E655-F692 HydrophobicContact CG-CE2 4.19Å; E655-N695 PolarHBondContact OE1-ND2 3.43Å; E655-K698 HydrophobicContact CG-CD 4.28Å
656	K	95.8	Very high	96.9	Very high	63 Å²	63	40.3 Å²	40.3	27%	0.274	20%	0.197	S	C	.	.	H	α-helix	trans	-70	-28.3	174.1	-79.4	-156	166	-156.7	0	112.4	K653 P654 Y660 S989	K653-K656 HydrophobicContact CB-CB 4.23Å; K653-K656 PolarHBondContact O-N 2.89Å; P654-K656 VanDerWaalsContact C-N 3.35Å; P654-K656 PolarHBondContact O-N 2.78Å; K656-Y660 VanDerWaalsContact O-CB 3.27Å; K656-Y660 WeakPolarHBondContact O-CB 3.45Å; K656-Y660 PolarHBondContact O-N 3.13Å; K656-Y660 VanDerWaalsContact O-N 3.11Å; K656-S989 PolarHBondContact NZ-OG 3.08Å
657	G	97.4	Very high	96.9	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-68.8	-50.2	173.8	0	0	0	0	0	112.3	K653 P654 E655 Y660 L661	K653-G657 PolarHBondContact O-N 3.45Å; K653-G657 VanDerWaalsContact O-N 3.15Å; P654-G657 WeakPolarHBondContact O-CA 3.41Å; P654-G657 PolarHBondContact O-N 3.35Å; E655-G657 VanDerWaalsContact C-N 3.3Å; G657-Y660 PolarHBondContact O-N 3.14Å; G657-L661 WeakPolarHBondContact O-CB 3.14Å; G657-L661 WeakPolarHBondContact O-CD1 3.49Å; G657-L661 VanDerWaalsContact O-CG 3.24Å; G657-L661 WeakPolarHBondContact O-CG 2.98Å; G657-L661 PolarHBondContact O-N 2.79Å
658	I	98.1	Very high	96.7	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.036	22%	0.219	C	C	.	.	H	α-helix	trans	-58.8	-52.5	175.3	-62.8	-50.5	0	0	0	110.1	F650 P654 Y660 L661 T662 I667 V674 F677 L678 F692 F700	F650-I658 HydrophobicContact CD2-CD1 3.71Å; F650-I658 HydrophobicContact CD2-CG1 3.92Å; F650-I658 HydrophobicContact CE2-CD1 3.79Å; F650-I658 HydrophobicContact CE2-CG1 3.96Å; P654-I658 PolarHBondContact O-N 2.79Å; I658-Y660 VanDerWaalsContact C-N 3.35Å; I658-Y660 PolarHBondContact O-N 2.96Å; I658-L661 PolarHBondContact O-N 3.01Å; I658-T662 PolarHBondContact O-N 3.44Å; I658-T662 PolarHBondContact O-OG1 2.73Å; I658-I667 HydrophobicContact CD1-CD1 4.16Å; I658-I667 HydrophobicContact CG2-CD1 4.02Å; I658-V674 HydrophobicContact CD1-CG1 3.92Å; I658-V674 HydrophobicContact CG1-CG1 4.28Å; I658-V674 HydrophobicContact CG2-CG1 4.29Å; I658-V674 HydrophobicContact CG2-CG2 3.97Å; I658-F677 HydrophobicContact CD1-CD1 4.15Å; I658-F677 HydrophobicContact CD1-CE1 3.95Å; I658-L678 HydrophobicContact CD1-CD2 4.34Å; I658-F692 HydrophobicContact CG1-CD2 4.44Å; I658-F692 HydrophobicContact CG1-CE2 3.87Å; I658-F692 HydrophobicContact CG1-CZ 3.95Å; I658-F700 HydrophobicContact CG2-CE1 4.41Å
659	Q	96.4	Very high	96.5	Very high	95 Å²	95	49.1 Å²	49.1	44%	0.444	25%	0.247	S	C	.	.	H	α-helix	trans	-50.7	-51.4	176.8	179.2	-179.5	-1.5	0	0	112.3	E655 L661 T662 E663	E655-Q659 VanDerWaalsContact O-CB 3.31Å; E655-Q659 WeakPolarHBondContact O-CB 3.32Å; E655-Q659 PolarHBondContact O-N 3.31Å; Q659-L661 VanDerWaalsContact C-N 3.32Å; Q659-L661 PolarHBondContact O-N 3.31Å; Q659-T662 PolarHBondContact O-N 2.91Å; Q659-E663 HydrophobicContact CG-CG 4.31Å; Q659-E663 VanDerWaalsContact CG-OE1 3.23Å; Q659-E663 WeakPolarHBondContact CG-OE1 3.38Å; Q659-E663 PolarHBondContact NE2-OE1 3.1Å; Q659-E663 WeakPolarHBondContact O-CB 3.16Å; Q659-E663 VanDerWaalsContact O-CG 3.3Å; Q659-E663 WeakPolarHBondContact O-CG 3.21Å; Q659-E663 PolarHBondContact O-N 3.05Å
660	Y	96.9	Very high	96.5	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-64.8	-33.6	-179.5	-174.5	-91	0	0	0	113.3	H642 I645 L649 K656 G657 I658 R664 Y985	H642-Y660 PolarHBondContact ND1-OH 3.07Å; I645-Y660 HydrophobicContact CB-CE1 4.29Å; I645-Y660 HydrophobicContact CG2-CE1 3.97Å; L649-Y660 HydrophobicContact CD1-CD1 3.88Å; L649-Y660 HydrophobicContact CD1-CD2 3.78Å; L649-Y660 HydrophobicContact CD1-CE1 4.3Å; L649-Y660 HydrophobicContact CD1-CE2 4.18Å; L649-Y660 HydrophobicContact CD1-CG 3.58Å; K656-Y660 VanDerWaalsContact O-CB 3.27Å; K656-Y660 WeakPolarHBondContact O-CB 3.45Å; K656-Y660 PolarHBondContact O-N 3.13Å; K656-Y660 VanDerWaalsContact O-N 3.11Å; G657-Y660 PolarHBondContact O-N 3.14Å; I658-Y660 VanDerWaalsContact C-N 3.35Å; I658-Y660 PolarHBondContact O-N 2.96Å; Y660-R664 HydrophobicContact CD1-CG 4.3Å; Y660-R664 HydrophobicContact CE1-CG 4.14Å; Y660-R664 WeakPolarHBondContact O-CB 3.39Å; Y660-R664 WeakPolarHBondContact O-CG 3.16Å; Y660-R664 PolarHBondContact O-N 3.12Å; Y660-Y985 HydrophobicContact CD2-CD1 4.26Å; Y660-Y985 HydrophobicContact CD2-CD2 4.22Å; Y660-Y985 AromaticContact CD2-CE1 3.76Å; Y660-Y985 HydrophobicContact CD2-CE1 3.76Å; Y660-Y985 AromaticContact CD2-CE2 3.74Å; Y660-Y985 HydrophobicContact CD2-CE2 3.74Å; Y660-Y985 HydrophobicContact CD2-CG 4.46Å; Y660-Y985 AromaticContact CD2-CZ 3.48Å; Y660-Y985 VanDerWaalsContact CD2-CZ 3.48Å; Y660-Y985 HydrophobicContact CE2-CD1 4.11Å; Y660-Y985 AromaticContact CE2-CD2 3.82Å; Y660-Y985 HydrophobicContact CE2-CD2 3.82Å; Y660-Y985 HydrophobicContact CE2-CE1 4.09Å; Y660-Y985 AromaticContact CE2-CE2 3.8Å; Y660-Y985 HydrophobicContact CE2-CE2 3.8Å; Y660-Y985 AromaticContact CE2-CG 3.97Å; Y660-Y985 HydrophobicContact CE2-CG 3.97Å; Y660-Y985 AromaticContact CE2-CZ 3.94Å
661	L	97.7	Very high	96.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-72.1	-37.4	176.7	-72.5	165.3	0	0	0	111.5	Y643 G657 I658 Q659 G665 F666 I667 F677	Y643-L661 HydrophobicContact CD2-CD2 3.92Å; Y643-L661 HydrophobicContact CE2-CD2 4.2Å; G657-L661 WeakPolarHBondContact O-CB 3.14Å; G657-L661 WeakPolarHBondContact O-CD1 3.49Å; G657-L661 VanDerWaalsContact O-CG 3.24Å; G657-L661 WeakPolarHBondContact O-CG 2.98Å; G657-L661 PolarHBondContact O-N 2.79Å; I658-L661 PolarHBondContact O-N 3.01Å; Q659-L661 VanDerWaalsContact C-N 3.32Å; Q659-L661 PolarHBondContact O-N 3.31Å; L661-G665 PolarHBondContact O-N 3.13Å; L661-F666 HydrophobicContact CB-CB 4.36Å; L661-F666 HydrophobicContact CD2-CB 3.91Å; L661-F666 HydrophobicContact CD2-CD2 3.83Å; L661-F666 HydrophobicContact CD2-CG 4.16Å; L661-F666 WeakPolarHBondContact O-CB 3.35Å; L661-F666 PolarHBondContact O-N 3.42Å; L661-I667 HydrophobicContact CB-CD1 3.6Å; L661-I667 HydrophobicContact CB-CG1 3.84Å; L661-I667 HydrophobicContact CD1-CD1 4.45Å; L661-F677 HydrophobicContact CD1-CE1 3.91Å; L661-F677 HydrophobicContact CD1-CE2 4.21Å; L661-F677 HydrophobicContact CD1-CZ 3.45Å; L661-F677 VanDerWaalsContact CD1-CZ 3.45Å
662	T	96.7	Very high	96.4	Very high	28 Å²	28	56.1 Å²	56.1	17%	0.172	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-53.6	173.1	-57.9	0	0	0	0	111.1	I658 Q659 R664 G665 D669	I658-T662 PolarHBondContact O-N 3.44Å; I658-T662 PolarHBondContact O-OG1 2.73Å; Q659-T662 PolarHBondContact O-N 2.91Å; T662-R664 PolarHBondContact O-N 2.82Å; T662-G665 PolarHBondContact O-N 2.9Å; T662-D669 HydrophobicContact CG2-CB 3.5Å; T662-D669 VanDerWaalsContact CG2-CB 3.5Å
663	E	95.7	Very high	96.5	Very high	117 Å²	117	52.3 Å²	52.3	55%	0.547	28%	0.279	S	S	.	.	H	α-helix	trans	-56.3	-26.5	179.4	-74.5	172.2	178.7	0	0	113.4	Q659	Q659-E663 HydrophobicContact CG-CG 4.31Å; Q659-E663 VanDerWaalsContact CG-OE1 3.23Å; Q659-E663 WeakPolarHBondContact CG-OE1 3.38Å; Q659-E663 PolarHBondContact NE2-OE1 3.1Å; Q659-E663 WeakPolarHBondContact O-CB 3.16Å; Q659-E663 VanDerWaalsContact O-CG 3.3Å; Q659-E663 WeakPolarHBondContact O-CG 3.21Å; Q659-E663 PolarHBondContact O-N 3.05Å
664	R	94.6	Very high	96.6	Very high	98 Å²	98	45.8 Å²	45.8	37%	0.37	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	1.2	178.4	-64.8	-69.9	-179.3	143.7	-1.3	114.1	Y660 T662 F666	Y660-R664 HydrophobicContact CD1-CG 4.3Å; Y660-R664 HydrophobicContact CE1-CG 4.14Å; Y660-R664 WeakPolarHBondContact O-CB 3.39Å; Y660-R664 WeakPolarHBondContact O-CG 3.16Å; Y660-R664 PolarHBondContact O-N 3.12Å; T662-R664 PolarHBondContact O-N 2.82Å; R664-F666 HydrophobicContact CB-CD2 3.53Å; R664-F666 HydrophobicContact CB-CE2 3.49Å; R664-F666 VanDerWaalsContact CB-CE2 3.49Å; R664-F666 HydrophobicContact CG-CE2 4.29Å
665	G	95.5	Very high	96.6	Very high	50 Å²	50	45.4 Å²	45.4	52%	0.515	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	43.8	-179.1	0	0	0	0	0	113.1	R639 L661 T662	R639-G665 PolarHBondContact NH2-O 3.09Å; L661-G665 PolarHBondContact O-N 3.13Å; T662-G665 PolarHBondContact O-N 2.9Å
666	F	96.6	Very high	96.7	Very high	48 Å²	48	45.8 Å²	45.8	21%	0.211	25%	0.25	C	S	.	.	S	Bend	trans	-99.1	-24.7	170.2	-67	-62.7	0	0	0	113	R639 H642 Y643 L661 R664	R639-F666 HydrophobicContact CG-CE1 3.71Å; R639-F666 HydrophobicContact CG-CZ 3.94Å; R639-F666 WeakPolarHBondContact O-CZ 3.4Å; H642-F666 HydrophobicContact CB-CE2 4.04Å; H642-F666 HydrophobicContact CB-CZ 4.07Å; Y643-F666 HydrophobicContact CD2-CB 4.07Å; Y643-F666 AromaticContact CD2-CD1 3.79Å; Y643-F666 HydrophobicContact CD2-CD1 3.79Å; Y643-F666 HydrophobicContact CD2-CD2 4.34Å; Y643-F666 HydrophobicContact CD2-CE1 4.29Å; Y643-F666 AromaticContact CD2-CG 3.83Å; Y643-F666 HydrophobicContact CD2-CG 3.83Å; Y643-F666 HydrophobicContact CE2-CB 4.47Å; Y643-F666 HydrophobicContact CG-CD1 4.43Å; Y643-F666 HydrophobicContact CG-CE1 4.5Å; L661-F666 HydrophobicContact CB-CB 4.36Å; L661-F666 HydrophobicContact CD2-CB 3.91Å; L661-F666 HydrophobicContact CD2-CD2 3.83Å; L661-F666 HydrophobicContact CD2-CG 4.16Å; L661-F666 WeakPolarHBondContact O-CB 3.35Å; L661-F666 PolarHBondContact O-N 3.42Å; R664-F666 HydrophobicContact CB-CD2 3.53Å; R664-F666 HydrophobicContact CB-CE2 3.49Å; R664-F666 VanDerWaalsContact CB-CE2 3.49Å; R664-F666 HydrophobicContact CG-CE2 4.29Å
667	I	96.5	Very high	96.8	Very high	14 Å²	14	43.1 Å²	43.1	7%	0.072	24%	0.239	C	C	.	.	S	Bend	trans	-138	150.3	174.5	61.6	-174	0	0	0	108.6	I658 L661 V674 F677	I658-I667 HydrophobicContact CD1-CD1 4.16Å; I658-I667 HydrophobicContact CG2-CD1 4.02Å; L661-I667 HydrophobicContact CB-CD1 3.6Å; L661-I667 HydrophobicContact CB-CG1 3.84Å; L661-I667 HydrophobicContact CD1-CD1 4.45Å; I667-V674 HydrophobicContact CD1-CG2 4.27Å; I667-F677 HydrophobicContact CG2-CB 4.02Å; I667-F677 HydrophobicContact CG2-CD1 4.34Å; I667-F677 HydrophobicContact CG2-CD2 3.32Å; I667-F677 HydrophobicContact CG2-CE2 3.84Å; I667-F677 HydrophobicContact CG2-CG 3.64Å
668	P	94.2	Very high	96.8	Very high	73 Å²	73	43.2 Å²	43.2	47%	0.474	24%	0.239	S	C	.	.			trans	-76.1	155.1	172.5	34.6	-36.4	0	0	0	110.7	T670	P668-T670 PolarHBondContact O-N 2.7Å
669	D	94.4	Very high	96.6	Very high	119 Å²	119	44.1 Å²	44.1	64%	0.636	24%	0.244	S	C	*	.	S	Bend	trans	-82.5	58.3	179.4	-154.1	22.3	0	0	0	112	T662	T662-D669 HydrophobicContact CG2-CB 3.5Å; T662-D669 VanDerWaalsContact CG2-CB 3.5Å
670	T	97.8	Very high	96.5	Very high	65 Å²	65	45.5 Å²	45.5	40%	0.399	25%	0.25	S	S	.	.	S	Bend	trans	-137.4	143.5	-178.1	64.3	0	0	0	0	111.7	P668 V672 G673 V674	P668-T670 PolarHBondContact O-N 2.7Å; T670-V672 VanDerWaalsContact C-N 3.33Å; T670-V672 PolarHBondContact O-N 3.33Å; T670-G673 PolarHBondContact O-N 3.32Å; T670-G673 VanDerWaalsContact O-N 3.13Å; T670-G673 PolarHBondContact OG1-N 3.47Å; T670-V674 WeakPolarHBondContact O-CG2 3.11Å; T670-V674 PolarHBondContact O-N 3.34Å
671	P	97.9	Very high	96.3	Very high	36 Å²	36	51.9 Å²	51.9	23%	0.234	27%	0.274	C	S	.	.	H	α-helix	trans	-56	-45	-179.6	-28.9	36.3	0	0	0	113.6	G673 V674 A675 F700 D703 V704	P671-G673 PolarHBondContact O-N 2.82Å; P671-V674 PolarHBondContact O-N 3.09Å; P671-A675 WeakPolarHBondContact O-CB 3.35Å; P671-A675 PolarHBondContact O-N 2.79Å; P671-F700 HydrophobicContact CG-CD2 4.11Å; P671-F700 HydrophobicContact CG-CE2 3.95Å; P671-D703 HydrophobicContact CB-CB 3.87Å; P671-D703 HydrophobicContact CG-CB 3.79Å; P671-V704 HydrophobicContact CB-CG2 3.94Å
672	V	97.6	Very high	96.2	Very high	73 Å²	73	61.2 Å²	61.2	44%	0.442	32%	0.315	S	S	.	.	H	α-helix	trans	-60.6	-43.7	176.2	-179.9	0	0	0	0	112	T670 V674 A675 H676 C707	T670-V672 VanDerWaalsContact C-N 3.33Å; T670-V672 PolarHBondContact O-N 3.33Å; V672-V674 PolarHBondContact O-N 3.24Å; V672-A675 WeakPolarHBondContact O-CB 3.24Å; V672-A675 PolarHBondContact O-N 2.91Å; V672-H676 WeakPolarHBondContact CG1-NE2 3.39Å; V672-H676 PolarHBondContact O-CD2 3.16Å; V672-H676 PolarHBondContact O-N 2.65Å; V672-C707 HydrophobicContact CG2-CB 4.4Å; V672-C707 VanDerWaalsContact CG2-SG 3.59Å
673	G	97.4	Very high	96.1	Very high	14 Å²	14	60.9 Å²	60.9	14%	0.144	32%	0.317	C	S	.	.	H	α-helix	trans	-67.1	-36.4	179.6	0	0	0	0	0	113.2	T670 P671 F677	T670-G673 PolarHBondContact O-N 3.32Å; T670-G673 VanDerWaalsContact O-N 3.13Å; T670-G673 PolarHBondContact OG1-N 3.47Å; P671-G673 PolarHBondContact O-N 2.82Å; G673-F677 WeakPolarHBondContact O-CB 3.39Å; G673-F677 PolarHBondContact O-N 3.24Å
674	V	98.2	Very high	96.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.6	-39.8	171.1	179.3	0	0	0	0	110.9	I658 I667 T670 P671 V672 F677 L678 F692 F700 V704	I658-V674 HydrophobicContact CD1-CG1 3.92Å; I658-V674 HydrophobicContact CG1-CG1 4.28Å; I658-V674 HydrophobicContact CG2-CG1 4.29Å; I658-V674 HydrophobicContact CG2-CG2 3.97Å; I667-V674 HydrophobicContact CD1-CG2 4.27Å; T670-V674 WeakPolarHBondContact O-CG2 3.11Å; T670-V674 PolarHBondContact O-N 3.34Å; P671-V674 PolarHBondContact O-N 3.09Å; V672-V674 PolarHBondContact O-N 3.24Å; V674-F677 WeakPolarHBondContact O-CB 3.46Å; V674-F677 PolarHBondContact O-N 3.45Å; V674-L678 HydrophobicContact CG1-CD1 3.99Å; V674-L678 HydrophobicContact CG1-CG 4.15Å; V674-L678 VanDerWaalsContact O-CG 3.29Å; V674-L678 WeakPolarHBondContact O-CG 3.37Å; V674-L678 PolarHBondContact O-N 3.14Å; V674-F692 HydrophobicContact CG1-CE1 4.19Å; V674-F692 HydrophobicContact CG1-CZ 4.46Å; V674-F700 HydrophobicContact CG2-CE1 4.22Å; V674-F700 HydrophobicContact CG2-CZ 3.89Å; V674-V704 HydrophobicContact CB-CG1 4.27Å; V674-V704 HydrophobicContact CB-CG2 4.01Å; V674-V704 HydrophobicContact CG1-CG1 3.94Å; V674-V704 HydrophobicContact CG1-CG2 4.1Å
675	A	97.9	Very high	96.3	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.6	-54.2	177.1	0	0	0	0	0	112.3	P671 V672 F677 L678 L679 V704 C707 V708	P671-A675 WeakPolarHBondContact O-CB 3.35Å; P671-A675 PolarHBondContact O-N 2.79Å; V672-A675 WeakPolarHBondContact O-CB 3.24Å; V672-A675 PolarHBondContact O-N 2.91Å; A675-F677 VanDerWaalsContact C-N 3.27Å; A675-F677 PolarHBondContact O-N 3.36Å; A675-L678 PolarHBondContact O-N 2.73Å; A675-L679 WeakPolarHBondContact O-CG 3.3Å; A675-L679 PolarHBondContact O-N 3.45Å; A675-L679 VanDerWaalsContact O-N 3.08Å; A675-V704 HydrophobicContact CB-CG1 4.26Å; A675-C707 HydrophobicContact CB-CB 3.69Å; A675-V708 HydrophobicContact CB-CB 4.46Å; A675-V708 HydrophobicContact CB-CG2 3.49Å; A675-V708 VanDerWaalsContact CB-CG2 3.49Å
676	H	97.1	Very high	96.3	Very high	60 Å²	60	50.4 Å²	50.4	28%	0.278	26%	0.257	S	S	.	.	H	α-helix	trans	-59.4	-38.8	175	-59.1	-60.6	0	0	0	111.7	V672 L679 Q680 E711	V672-H676 WeakPolarHBondContact CG1-NE2 3.39Å; V672-H676 PolarHBondContact O-CD2 3.16Å; V672-H676 PolarHBondContact O-N 2.65Å; H676-L679 PolarHBondContact O-N 2.94Å; H676-Q680 VanDerWaalsContact O-CB 3.23Å; H676-Q680 WeakPolarHBondContact O-CB 3.34Å; H676-Q680 VanDerWaalsContact O-CG 3.23Å; H676-Q680 WeakPolarHBondContact O-CG 3.38Å; H676-Q680 PolarHBondContact O-N 2.88Å; H676-E711 IonicContact CE1-OE1 3.33Å; H676-E711 PolarHBondContact CE1-OE1 3.46Å; H676-E711 VanDerWaalsContact CE1-OE1 3.29Å; H676-E711 IonicContact CE1-OE2 2.81Å; H676-E711 PolarHBondContact CE1-OE2 2.84Å; H676-E711 VanDerWaalsContact ND1-CD 3.29Å; H676-E711 IonicContact ND1-OE1 3.27Å; H676-E711 IonicContact ND1-OE2 3.67Å; H676-E711 PolarHBondContact ND1-OE2 2.82Å
677	F	97.5	Very high	96.2	Very high	8 Å²	8	51 Å²	51	4%	0.035	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-47.8	176.9	168	-95.4	0	0	0	112.2	Y643 L647 I658 L661 I667 G673 V674 A675 L679 R681 L684	Y643-F677 HydrophobicContact CE2-CE2 4.24Å; L647-F677 HydrophobicContact CD2-CE2 4.48Å; L647-F677 HydrophobicContact CD2-CZ 3.88Å; I658-F677 HydrophobicContact CD1-CD1 4.15Å; I658-F677 HydrophobicContact CD1-CE1 3.95Å; L661-F677 HydrophobicContact CD1-CE1 3.91Å; L661-F677 HydrophobicContact CD1-CE2 4.21Å; L661-F677 HydrophobicContact CD1-CZ 3.45Å; L661-F677 VanDerWaalsContact CD1-CZ 3.45Å; I667-F677 HydrophobicContact CG2-CB 4.02Å; I667-F677 HydrophobicContact CG2-CD1 4.34Å; I667-F677 HydrophobicContact CG2-CD2 3.32Å; I667-F677 HydrophobicContact CG2-CE2 3.84Å; I667-F677 HydrophobicContact CG2-CG 3.64Å; G673-F677 WeakPolarHBondContact O-CB 3.39Å; G673-F677 PolarHBondContact O-N 3.24Å; V674-F677 WeakPolarHBondContact O-CB 3.46Å; V674-F677 PolarHBondContact O-N 3.45Å; A675-F677 VanDerWaalsContact C-N 3.27Å; A675-F677 PolarHBondContact O-N 3.36Å; F677-L679 PolarHBondContact O-N 2.69Å; F677-R681 HydrophobicContact CD2-CB 4.08Å; F677-R681 HydrophobicContact CD2-CG 3.45Å; F677-R681 VanDerWaalsContact CD2-CG 3.45Å; F677-R681 HydrophobicContact CE2-CB 4.04Å; F677-R681 HydrophobicContact CE2-CG 3.79Å; F677-R681 HydrophobicContact CG-CG 4.23Å; F677-R681 WeakPolarHBondContact O-CB 3.28Å; F677-R681 WeakPolarHBondContact O-CG 3.44Å; F677-R681 PolarHBondContact O-N 2.72Å; F677-L684 HydrophobicContact CD1-CD1 4.08Å; F677-L684 HydrophobicContact CE1-CD1 3.65Å; F677-L684 HydrophobicContact CE1-CD2 3.8Å; F677-L684 HydrophobicContact CE1-CG 4.29Å; F677-L684 HydrophobicContact CZ-CD1 3.99Å; F677-L684 HydrophobicContact CZ-CD2 3.88Å; F677-L684 HydrophobicContact CZ-CG 4.32Å
678	L	97.4	Very high	96.2	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-37.3	179.5	-65.9	174.2	0	0	0	112.6	F650 I658 V674 A675 L684 I689 F692 L693 V704	F650-L678 HydrophobicContact CE1-CD2 4.4Å; F650-L678 HydrophobicContact CE2-CD2 3.6Å; F650-L678 HydrophobicContact CZ-CD2 3.48Å; F650-L678 VanDerWaalsContact CZ-CD2 3.48Å; I658-L678 HydrophobicContact CD1-CD2 4.34Å; V674-L678 HydrophobicContact CG1-CD1 3.99Å; V674-L678 HydrophobicContact CG1-CG 4.15Å; V674-L678 VanDerWaalsContact O-CG 3.29Å; V674-L678 WeakPolarHBondContact O-CG 3.37Å; V674-L678 PolarHBondContact O-N 3.14Å; A675-L678 PolarHBondContact O-N 2.73Å; L678-L684 HydrophobicContact CD2-CD1 4.15Å; L678-I689 HydrophobicContact CB-CG2 4.41Å; L678-I689 HydrophobicContact CD2-CG1 4.25Å; L678-I689 WeakPolarHBondContact O-CD1 3.48Å; L678-F692 HydrophobicContact CD1-CD1 3.79Å; L678-F692 HydrophobicContact CD1-CE1 4.02Å; L678-L693 HydrophobicContact CD1-CD2 3.85Å; L678-L693 HydrophobicContact CD1-CG 4.33Å; L678-V704 HydrophobicContact CD1-CG1 3.88Å
679	L	94	Very high	96.3	Very high	26 Å²	26	47.4 Å²	47.4	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-72.3	-48.8	178.3	-69.7	174.4	0	0	0	112	A675 H676 F677 R686 V708 E711 M712 H729	A675-L679 WeakPolarHBondContact O-CG 3.3Å; A675-L679 PolarHBondContact O-N 3.45Å; A675-L679 VanDerWaalsContact O-N 3.08Å; H676-L679 PolarHBondContact O-N 2.94Å; F677-L679 PolarHBondContact O-N 2.69Å; L679-R686 PolarHBondContact O-NH2 3.27Å; L679-V708 HydrophobicContact CD2-CG1 4.18Å; L679-V708 HydrophobicContact CG-CG1 4.5Å; L679-E711 HydrophobicContact CD1-CB 3.85Å; L679-E711 HydrophobicContact CD1-CG 4.35Å; L679-M712 HydrophobicContact CD2-CE 3.85Å; L679-H729 HydrophobicContact CD2-CB 3.85Å
680	Q	93.9	Very high	96.4	Very high	124 Å²	124	41.9 Å²	41.9	58%	0.579	21%	0.209	S	C	*	.	H	α-helix	trans	-90.7	-32.2	-166	-60.3	173.6	7.3	0	0	115	H676	H676-Q680 VanDerWaalsContact O-CB 3.23Å; H676-Q680 WeakPolarHBondContact O-CB 3.34Å; H676-Q680 VanDerWaalsContact O-CG 3.23Å; H676-Q680 WeakPolarHBondContact O-CG 3.38Å; H676-Q680 PolarHBondContact O-N 2.88Å
681	R	94.6	Very high	96.3	Very high	136 Å²	136	41.3 Å²	41.3	51%	0.513	20%	0.202	S	C	.	.			trans	-85.6	132.3	-169	-59.1	-56	-176.7	167.8	-0.4	113	F677 L684	F677-R681 HydrophobicContact CD2-CB 4.08Å; F677-R681 HydrophobicContact CD2-CG 3.45Å; F677-R681 VanDerWaalsContact CD2-CG 3.45Å; F677-R681 HydrophobicContact CE2-CB 4.04Å; F677-R681 HydrophobicContact CE2-CG 3.79Å; F677-R681 HydrophobicContact CG-CG 4.23Å; F677-R681 WeakPolarHBondContact O-CB 3.28Å; F677-R681 WeakPolarHBondContact O-CG 3.44Å; F677-R681 PolarHBondContact O-N 2.72Å; R681-L684 HydrophobicContact CB-CD1 4.34Å
682	K	94.4	Very high	96.3	Very high	196 Å²	196	39.8 Å²	39.8	85%	0.852	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	149.4	175.7	-61.8	177.8	-177.2	174.9	0	110.7
683	G	94.6	Very high	96.2	Very high	20 Å²	20	36.3 Å²	36.3	21%	0.206	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	0.4	-178.2	0	0	0	0	0	114.5	N651 H833	N651-G683 PolarHBondContact ND2-O 3.46Å; G683-H833 VanDerWaalsContact C-CE1 3.48Å; G683-H833 WeakPolarHBondContact CA-ND1 3.43Å; G683-H833 PolarHBondContact O-CE1 2.71Å; G683-H833 PolarHBondContact O-ND1 2.72Å
684	L	97.3	Very high	96.1	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.026	17%	0.166	C	C	.	.	S	Bend	trans	-88.9	136.3	163.9	-59.4	169.8	0	0	0	108.9	L647 F650 F677 L678 R681 I689	L647-L684 HydrophobicContact CD2-CD2 3.56Å; L647-L684 HydrophobicContact CD2-CG 4.09Å; F650-L684 HydrophobicContact CB-CD2 4.23Å; F650-L684 HydrophobicContact CD1-CD2 3.45Å; F650-L684 VanDerWaalsContact CD1-CD2 3.45Å; F650-L684 HydrophobicContact CD2-CD2 4.42Å; F650-L684 HydrophobicContact CE1-CB 4.4Å; F650-L684 HydrophobicContact CE1-CD2 3.87Å; F650-L684 HydrophobicContact CG-CD2 3.77Å; F677-L684 HydrophobicContact CD1-CD1 4.08Å; F677-L684 HydrophobicContact CE1-CD1 3.65Å; F677-L684 HydrophobicContact CE1-CD2 3.8Å; F677-L684 HydrophobicContact CE1-CG 4.29Å; F677-L684 HydrophobicContact CZ-CD1 3.99Å; F677-L684 HydrophobicContact CZ-CD2 3.88Å; F677-L684 HydrophobicContact CZ-CG 4.32Å; L678-L684 HydrophobicContact CD2-CD1 4.15Å; R681-L684 HydrophobicContact CB-CD1 4.34Å; L684-I689 HydrophobicContact CB-CD1 3.94Å; L684-I689 HydrophobicContact CB-CG1 4.24Å; L684-I689 HydrophobicContact CD1-CD1 4.47Å
685	S	97	Very high	95.9	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.021	17%	0.173	C	C	.	.			trans	-81.4	133.2	176.1	178.5	0	0	0	0	110.4	N651 Q687 M688 I689 D832 H833 V834	N651-S685 PolarHBondContact OD1-N 3.06Å; S685-Q687 PolarHBondContact O-N 3.5Å; S685-M688 PolarHBondContact O-N 3.47Å; S685-I689 WeakPolarHBondContact O-CG1 3.48Å; S685-I689 PolarHBondContact O-N 3.09Å; S685-I689 VanDerWaalsContact O-N 3.07Å; S685-D832 WeakPolarHBondContact CA-OD2 3.47Å; S685-D832 PolarHBondContact OG-OD2 3.24Å; S685-D832 VanDerWaalsContact OG-OD2 3.09Å; S685-H833 PolarHBondContact N-CE1 3.02Å; S685-V834 WeakPolarHBondContact OG-CG2 3.34Å
686	R	95.3	Very high	95.6	Very high	37 Å²	37	44.5 Å²	44.5	14%	0.14	20%	0.2	C	C	.	.	H	α-helix	trans	-65.5	-21.3	-175.8	-67.2	-80.8	174.3	-147.2	-4.8	113.3	L679 H729 R731 T829 D832	L679-R686 PolarHBondContact O-NH2 3.27Å; R686-H729 WeakPolarHBondContact CD-O 3.16Å; R686-H729 PolarHBondContact NH1-O 3.3Å; R686-R731 HydrophobicContact CB-CB 4.43Å; R686-R731 VanDerWaalsContact O-CB 3.31Å; R686-R731 WeakPolarHBondContact O-CB 3.23Å; R686-R731 PolarHBondContact O-N 2.83Å; R686-T829 HydrophobicContact CB-CG2 3.58Å; R686-T829 HydrophobicContact CG-CG2 3.86Å; R686-D832 HydrophobicContact CG-CB 4.02Å; R686-D832 PolarHBondContact N-OD2 2.79Å; R686-D832 VanDerWaalsContact N-OD2 3.07Å
687	Q	94.5	Very high	95.4	Very high	61 Å²	61	50.2 Å²	50.2	29%	0.285	23%	0.227	S	C	.	.	H	α-helix	trans	-69.2	-52.1	167.6	173.6	173.9	-26.2	0	0	111.7	S685 I689 G690 E691	S685-Q687 PolarHBondContact O-N 3.5Å; Q687-I689 PolarHBondContact O-N 3.07Å; Q687-G690 WeakPolarHBondContact O-CA 3.15Å; Q687-G690 PolarHBondContact O-N 3.41Å; Q687-E691 HydrophobicContact CG-CG 4.47Å; Q687-E691 WeakPolarHBondContact CG-OE1 3.48Å; Q687-E691 PolarHBondContact NE2-OE1 3.09Å; Q687-E691 PolarHBondContact O-N 3.07Å
688	M	96.9	Very high	95.2	Very high	9 Å²	9	54.6 Å²	54.6	4%	0.044	25%	0.246	C	C	.	.	H	α-helix	trans	-68	-25.2	-174.6	-53.7	-55.8	-51.4	0	0	112.3	F650 P654 S685 E691 F692 P864	F650-M688 HydrophobicContact CD1-CB 4.23Å; F650-M688 HydrophobicContact CE1-CB 3.81Å; P654-M688 HydrophobicContact CG-CB 4.26Å; P654-M688 HydrophobicContact CG-CE 3.73Å; S685-M688 PolarHBondContact O-N 3.47Å; M688-E691 WeakPolarHBondContact CE-OE2 3.48Å; M688-F692 WeakPolarHBondContact O-CB 3.35Å; M688-F692 PolarHBondContact O-N 2.71Å; M688-P864 HydrophobicContact CG-CB 3.54Å; M688-P864 HydrophobicContact CG-CG 4.33Å; M688-P864 HydrophobicContact SD-CB 3.66Å; M688-P864 HydrophobicContact SD-CG 3.82Å
689	I	97.5	Very high	95.2	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-48.5	166.1	-64.2	171.1	0	0	0	110.6	F650 L678 L684 S685 Q687 E691 F692 L693 I730	F650-I689 HydrophobicContact CE1-CG1 4.06Å; F650-I689 HydrophobicContact CZ-CG1 4.15Å; L678-I689 HydrophobicContact CB-CG2 4.41Å; L678-I689 HydrophobicContact CD2-CG1 4.25Å; L678-I689 WeakPolarHBondContact O-CD1 3.48Å; L684-I689 HydrophobicContact CB-CD1 3.94Å; L684-I689 HydrophobicContact CB-CG1 4.24Å; L684-I689 HydrophobicContact CD1-CD1 4.47Å; S685-I689 WeakPolarHBondContact O-CG1 3.48Å; S685-I689 PolarHBondContact O-N 3.09Å; S685-I689 VanDerWaalsContact O-N 3.07Å; Q687-I689 PolarHBondContact O-N 3.07Å; I689-E691 PolarHBondContact O-N 2.82Å; I689-F692 PolarHBondContact O-N 3.03Å; I689-L693 HydrophobicContact CG2-CD1 3.74Å; I689-L693 HydrophobicContact CG2-CG 4.37Å; I689-L693 WeakPolarHBondContact O-CB 3.13Å; I689-L693 VanDerWaalsContact O-CG 3.29Å; I689-L693 WeakPolarHBondContact O-CG 3.4Å; I689-L693 PolarHBondContact O-N 3.17Å; I689-I730 HydrophobicContact CG2-CG1 4.14Å
690	G	95.4	Very high	95.3	Very high	4 Å²	4	61.2 Å²	61.2	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-62.5	-39.6	176.3	0	0	0	0	0	113	Q687 L693 G694	Q687-G690 WeakPolarHBondContact O-CA 3.15Å; Q687-G690 PolarHBondContact O-N 3.41Å; G690-L693 PolarHBondContact O-N 3Å; G690-G694 PolarHBondContact O-N 2.88Å
691	E	95.3	Very high	95.5	Very high	53 Å²	53	55.4 Å²	55.4	25%	0.248	25%	0.249	C	C	.	.	H	α-helix	trans	-65.3	-36.3	176.1	-70.1	177.6	-150.2	0	0	113.3	Q687 M688 I689	Q687-E691 HydrophobicContact CG-CG 4.47Å; Q687-E691 WeakPolarHBondContact CG-OE1 3.48Å; Q687-E691 PolarHBondContact NE2-OE1 3.09Å; Q687-E691 PolarHBondContact O-N 3.07Å; M688-E691 WeakPolarHBondContact CE-OE2 3.48Å; I689-E691 PolarHBondContact O-N 2.82Å
692	F	97.4	Very high	95.6	Very high	3 Å²	3	52.9 Å²	52.9	1%	0.013	24%	0.239	C	C	.	.	H	α-helix	trans	-68.9	-49	174.5	-178.2	-101.9	0	0	0	112.1	F650 P654 E655 I658 V674 L678 M688 I689 N695 F700 N701 V704	F650-F692 HydrophobicContact CE2-CB 4.36Å; F650-F692 HydrophobicContact CE2-CG 4.34Å; F650-F692 HydrophobicContact CZ-CB 4.29Å; P654-F692 HydrophobicContact CB-CB 3.67Å; P654-F692 HydrophobicContact CB-CD2 3.69Å; P654-F692 HydrophobicContact CB-CG 4.08Å; P654-F692 HydrophobicContact CG-CB 4.34Å; E655-F692 HydrophobicContact CG-CD2 4.26Å; E655-F692 HydrophobicContact CG-CE2 4.19Å; I658-F692 HydrophobicContact CG1-CD2 4.44Å; I658-F692 HydrophobicContact CG1-CE2 3.87Å; I658-F692 HydrophobicContact CG1-CZ 3.95Å; V674-F692 HydrophobicContact CG1-CE1 4.19Å; V674-F692 HydrophobicContact CG1-CZ 4.46Å; L678-F692 HydrophobicContact CD1-CD1 3.79Å; L678-F692 HydrophobicContact CD1-CE1 4.02Å; M688-F692 WeakPolarHBondContact O-CB 3.35Å; M688-F692 PolarHBondContact O-N 2.71Å; I689-F692 PolarHBondContact O-N 3.03Å; F692-N695 VanDerWaalsContact O-CB 3.29Å; F692-N695 WeakPolarHBondContact O-CB 2.96Å; F692-N695 PolarHBondContact O-N 3.4Å; F692-F700 HydrophobicContact CZ-CD1 4.4Å; F692-F700 HydrophobicContact CZ-CE1 4.35Å; F692-N701 VanDerWaalsContact CD2-ND2 3.26Å; F692-N701 WeakPolarHBondContact CD2-ND2 2.87Å; F692-N701 WeakPolarHBondContact CE2-ND2 3.45Å; F692-N701 PolarHBondContact O-ND2 2.75Å; F692-V704 HydrophobicContact CE1-CB 4.24Å; F692-V704 HydrophobicContact CE1-CG1 4.05Å; F692-V704 HydrophobicContact CE1-CG2 4.34Å
693	L	97.4	Very high	95.8	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-73	-33.6	-174.6	-65.7	177.2	0	0	0	112.6	L678 I689 G690 N695 V704 L705 V708 I730 L742	L678-L693 HydrophobicContact CD1-CD2 3.85Å; L678-L693 HydrophobicContact CD1-CG 4.33Å; I689-L693 HydrophobicContact CG2-CD1 3.74Å; I689-L693 HydrophobicContact CG2-CG 4.37Å; I689-L693 WeakPolarHBondContact O-CB 3.13Å; I689-L693 VanDerWaalsContact O-CG 3.29Å; I689-L693 WeakPolarHBondContact O-CG 3.4Å; I689-L693 PolarHBondContact O-N 3.17Å; G690-L693 PolarHBondContact O-N 3Å; L693-N695 PolarHBondContact O-N 3.47Å; L693-V704 HydrophobicContact CD2-CB 4.33Å; L693-V704 HydrophobicContact CD2-CG1 3.71Å; L693-L705 HydrophobicContact CB-CB 4.31Å; L693-L705 HydrophobicContact CB-CD1 4.22Å; L693-L705 HydrophobicContact CD1-CD1 4.44Å; L693-L705 HydrophobicContact CD2-CB 4.13Å; L693-V708 HydrophobicContact CD1-CB 4.5Å; L693-V708 HydrophobicContact CD1-CG1 4.05Å; L693-V708 HydrophobicContact CD1-CG2 4.33Å; L693-V708 HydrophobicContact CD2-CG2 4.19Å; L693-I730 HydrophobicContact CD1-CD1 3.71Å; L693-I730 HydrophobicContact CD1-CG1 4.08Å; L693-L742 HydrophobicContact CB-CD2 3.74Å
694	G	95.1	Very high	96	Very high	4 Å²	4	45.2 Å²	45.2	4%	0.041	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	1.1	173.9	0	0	0	0	0	114.8	G690 R696	G690-G694 PolarHBondContact O-N 2.88Å; G694-R696 PolarHBondContact O-N 3.27Å
695	N	93.3	Very high	96	Very high	27 Å²	27	45 Å²	45	14%	0.144	20%	0.201	C	C	.	.			trans	-78.4	82.4	-177.9	-170.2	-13.4	0	0	0	112	E655 F692 L693 Q697 K698 N701	E655-N695 PolarHBondContact OE1-ND2 3.43Å; F692-N695 VanDerWaalsContact O-CB 3.29Å; F692-N695 WeakPolarHBondContact O-CB 2.96Å; F692-N695 PolarHBondContact O-N 3.4Å; L693-N695 PolarHBondContact O-N 3.47Å; N695-Q697 PolarHBondContact O-N 3.07Å; N695-Q697 VanDerWaalsContact O-N 3.12Å; N695-Q697 WeakPolarHBondContact OD1-CB 3.43Å; N695-Q697 PolarHBondContact OD1-N 3.45Å; N695-K698 PolarHBondContact O-N 2.84Å; N695-N701 HydrophobicContact CB-CB 4.11Å
696	R	90.8	Very high	96	Very high	154 Å²	154	47.3 Å²	47.3	58%	0.581	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-20.9	177.9	-172.5	174.3	175.3	-177.1	-2.9	114.2	G694 K698 E740 R741	G694-R696 PolarHBondContact O-N 3.27Å; R696-K698 VanDerWaalsContact C-N 3.33Å; R696-K698 PolarHBondContact O-N 2.93Å; R696-E740 IonicContact NH1-OE1 2.84Å; R696-E740 PolarHBondContact NH1-OE1 3.26Å; R696-R741 HydrophobicContact CB-CG 4.46Å
697	Q	92.9	Very high	96.2	Very high	181 Å²	181	46.8 Å²	46.8	85%	0.846	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.2	-174.9	-60.5	-178.3	-5.4	0	0	114.3	N695	N695-Q697 PolarHBondContact O-N 3.07Å; N695-Q697 VanDerWaalsContact O-N 3.12Å; N695-Q697 WeakPolarHBondContact OD1-CB 3.43Å; N695-Q697 PolarHBondContact OD1-N 3.45Å
698	K	94.4	Very high	96.3	Very high	99 Å²	99	44 Å²	44	43%	0.43	20%	0.202	S	C	.	.			trans	-117.9	123	-175.9	-74.2	-172	169.9	-164.3	0	110.9	E655 N695 R696 F700 N701 R702	E655-K698 HydrophobicContact CG-CD 4.28Å; N695-K698 PolarHBondContact O-N 2.84Å; R696-K698 VanDerWaalsContact C-N 3.33Å; R696-K698 PolarHBondContact O-N 2.93Å; K698-F700 PolarHBondContact O-N 3.42Å; K698-N701 HydrophobicContact CB-CB 3.99Å; K698-N701 WeakPolarHBondContact CB-OD1 3.32Å; K698-N701 WeakPolarHBondContact CD-OD1 3.47Å; K698-N701 WeakPolarHBondContact O-CB 3.34Å; K698-N701 PolarHBondContact O-N 2.93Å; K698-N701 VanDerWaalsContact O-N 3.07Å; K698-R702 PolarHBondContact O-N 2.91Å
699	Q	96.5	Very high	96.4	Very high	104 Å²	104	43.8 Å²	43.8	49%	0.486	20%	0.202	S	C	.	.	H	α-helix	trans	-58.1	-47.7	-179.8	-169.8	55.7	38.4	0	0	111.9	N701 R702 D703	Q699-N701 PolarHBondContact O-N 3.3Å; Q699-N701 VanDerWaalsContact O-N 3.13Å; Q699-R702 CarbonylContact O-C 3.5Å; Q699-R702 WeakPolarHBondContact O-CA 3.47Å; Q699-R702 VanDerWaalsContact O-CB 3.29Å; Q699-R702 WeakPolarHBondContact O-CB 3.45Å; Q699-R702 PolarHBondContact O-N 3.36Å; Q699-D703 VanDerWaalsContact C-OD2 3.32Å; Q699-D703 PolarHBondContact NE2-OD1 3.46Å; Q699-D703 PolarHBondContact O-N 2.95Å
700	F	97.6	Very high	96.3	Very high	62 Å²	62	48 Å²	48	27%	0.272	22%	0.224	S	C	.	.	H	α-helix	trans	-53.6	-36.8	175.5	-174	-95.2	0	0	0	113.8	I658 P671 V674 F692 K698 D703 V704	I658-F700 HydrophobicContact CG2-CE1 4.41Å; P671-F700 HydrophobicContact CG-CD2 4.11Å; P671-F700 HydrophobicContact CG-CE2 3.95Å; V674-F700 HydrophobicContact CG2-CE1 4.22Å; V674-F700 HydrophobicContact CG2-CZ 3.89Å; F692-F700 HydrophobicContact CZ-CD1 4.4Å; F692-F700 HydrophobicContact CZ-CE1 4.35Å; K698-F700 PolarHBondContact O-N 3.42Å; F700-D703 WeakPolarHBondContact CA-OD2 3.22Å; F700-D703 PolarHBondContact N-OD2 2.99Å; F700-D703 PolarHBondContact O-N 2.91Å; F700-V704 HydrophobicContact CD1-CG2 4.05Å; F700-V704 HydrophobicContact CE1-CG2 3.77Å; F700-V704 HydrophobicContact CZ-CG2 4.11Å; F700-V704 WeakPolarHBondContact O-CG2 3.33Å; F700-V704 PolarHBondContact O-N 2.78Å
701	N	97.4	Very high	96.3	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-69.8	-34.1	176.8	-69.5	61.6	0	0	0	111.9	F692 N695 K698 Q699 L705	F692-N701 VanDerWaalsContact CD2-ND2 3.26Å; F692-N701 WeakPolarHBondContact CD2-ND2 2.87Å; F692-N701 WeakPolarHBondContact CE2-ND2 3.45Å; F692-N701 PolarHBondContact O-ND2 2.75Å; N695-N701 HydrophobicContact CB-CB 4.11Å; K698-N701 HydrophobicContact CB-CB 3.99Å; K698-N701 WeakPolarHBondContact CB-OD1 3.32Å; K698-N701 WeakPolarHBondContact CD-OD1 3.47Å; K698-N701 WeakPolarHBondContact O-CB 3.34Å; K698-N701 PolarHBondContact O-N 2.93Å; K698-N701 VanDerWaalsContact O-N 3.07Å; Q699-N701 PolarHBondContact O-N 3.3Å; Q699-N701 VanDerWaalsContact O-N 3.13Å; N701-L705 PolarHBondContact O-N 3.49Å; N701-L705 VanDerWaalsContact O-N 3.12Å
702	R	96.9	Very high	96.3	Very high	83 Å²	83	50.5 Å²	50.5	31%	0.313	24%	0.235	S	C	.	.	H	α-helix	trans	-67.2	-51	171.7	-58.4	172.6	68.4	-156.1	7	110.3	K698 Q699 V704 L705 D706	K698-R702 PolarHBondContact O-N 2.91Å; Q699-R702 CarbonylContact O-C 3.5Å; Q699-R702 WeakPolarHBondContact O-CA 3.47Å; Q699-R702 VanDerWaalsContact O-CB 3.29Å; Q699-R702 WeakPolarHBondContact O-CB 3.45Å; Q699-R702 PolarHBondContact O-N 3.36Å; R702-V704 PolarHBondContact O-N 3.37Å; R702-L705 WeakPolarHBondContact O-CA 3.19Å; R702-L705 WeakPolarHBondContact O-CB 3.48Å; R702-L705 PolarHBondContact O-N 3.07Å; R702-D706 PolarHBondContact O-N 3.09Å
703	D	98.1	Very high	96.2	Very high	54 Å²	54	53.9 Å²	53.9	29%	0.289	25%	0.253	S	S	.	.	H	α-helix	trans	-55.1	-40.2	178.8	-50	-33.8	0	0	0	111.3	P671 Q699 F700 C707	P671-D703 HydrophobicContact CB-CB 3.87Å; P671-D703 HydrophobicContact CG-CB 3.79Å; Q699-D703 VanDerWaalsContact C-OD2 3.32Å; Q699-D703 PolarHBondContact NE2-OD1 3.46Å; Q699-D703 PolarHBondContact O-N 2.95Å; F700-D703 WeakPolarHBondContact CA-OD2 3.22Å; F700-D703 PolarHBondContact N-OD2 2.99Å; F700-D703 PolarHBondContact O-N 2.91Å; D703-C707 PolarHBondContact O-N 3.36Å; D703-C707 PolarHBondContact O-SG 3.06Å
704	V	98.4	Very high	96.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68.2	-41.8	174.6	177.2	0	0	0	0	111.8	P671 V674 A675 L678 F692 L693 F700 R702 D706 C707 V708	P671-V704 HydrophobicContact CB-CG2 3.94Å; V674-V704 HydrophobicContact CB-CG1 4.27Å; V674-V704 HydrophobicContact CB-CG2 4.01Å; V674-V704 HydrophobicContact CG1-CG1 3.94Å; V674-V704 HydrophobicContact CG1-CG2 4.1Å; A675-V704 HydrophobicContact CB-CG1 4.26Å; L678-V704 HydrophobicContact CD1-CG1 3.88Å; F692-V704 HydrophobicContact CE1-CB 4.24Å; F692-V704 HydrophobicContact CE1-CG1 4.05Å; F692-V704 HydrophobicContact CE1-CG2 4.34Å; L693-V704 HydrophobicContact CD2-CB 4.33Å; L693-V704 HydrophobicContact CD2-CG1 3.71Å; F700-V704 HydrophobicContact CD1-CG2 4.05Å; F700-V704 HydrophobicContact CE1-CG2 3.77Å; F700-V704 HydrophobicContact CZ-CG2 4.11Å; F700-V704 WeakPolarHBondContact O-CG2 3.33Å; F700-V704 PolarHBondContact O-N 2.78Å; R702-V704 PolarHBondContact O-N 3.37Å; V704-D706 VanDerWaalsContact C-N 3.33Å; V704-C707 PolarHBondContact O-N 3.48Å; V704-V708 HydrophobicContact CG1-CG2 4.25Å; V704-V708 WeakPolarHBondContact O-CB 3.45Å; V704-V708 VanDerWaalsContact O-CG2 3.26Å; V704-V708 WeakPolarHBondContact O-CG2 3.44Å; V704-V708 PolarHBondContact O-N 3.32Å
705	L	98.2	Very high	96.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.6	-41.9	175.8	172.1	58	0	0	0	111.5	L693 N701 R702 V708 V709 R741 L742 A745	L693-L705 HydrophobicContact CB-CB 4.31Å; L693-L705 HydrophobicContact CB-CD1 4.22Å; L693-L705 HydrophobicContact CD1-CD1 4.44Å; L693-L705 HydrophobicContact CD2-CB 4.13Å; N701-L705 PolarHBondContact O-N 3.49Å; N701-L705 VanDerWaalsContact O-N 3.12Å; R702-L705 WeakPolarHBondContact O-CA 3.19Å; R702-L705 WeakPolarHBondContact O-CB 3.48Å; R702-L705 PolarHBondContact O-N 3.07Å; L705-V708 CarbonylContact O-C 3.6Å; L705-V708 WeakPolarHBondContact O-CA 3.23Å; L705-V708 WeakPolarHBondContact O-CB 3.45Å; L705-V708 PolarHBondContact O-N 3.16Å; L705-V709 HydrophobicContact CD1-CG1 4.14Å; L705-V709 PolarHBondContact O-N 2.94Å; L705-R741 HydrophobicContact CD2-CG 3.99Å; L705-L742 HydrophobicContact CD1-CD2 3.95Å; L705-L742 HydrophobicContact CD2-CD2 4.24Å; L705-A745 HydrophobicContact CD1-CB 4.25Å; L705-A745 HydrophobicContact CD2-CB 3.73Å; L705-A745 HydrophobicContact CG-CB 3.77Å
706	D	97.6	Very high	96.3	Very high	52 Å²	52	64.4 Å²	64.4	28%	0.278	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-45.2	178.6	-58.1	-26.5	0	0	0	109.5	R702 V704 V708 V709 D710 R741	R702-D706 PolarHBondContact O-N 3.09Å; V704-D706 VanDerWaalsContact C-N 3.33Å; D706-V708 VanDerWaalsContact C-N 3.34Å; D706-V708 PolarHBondContact O-N 3.01Å; D706-V709 WeakPolarHBondContact O-CG2 3.46Å; D706-V709 PolarHBondContact O-N 3.12Å; D706-D710 WeakPolarHBondContact O-CB 3.35Å; D706-D710 PolarHBondContact O-N 3.05Å; D706-R741 IonicContact OD1-CZ 3.12Å; D706-R741 IonicContact OD1-NH2 2.77Å; D706-R741 PolarHBondContact OD1-NH2 2.9Å; D706-R741 IonicContact OD2-NH2 2.72Å
707	C	98.1	Very high	96.6	Very high	27 Å²	27	59.1 Å²	59.1	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-36.7	170	-64.6	0	0	0	0	113.6	V672 A675 D703 V704 D710 E711	V672-C707 HydrophobicContact CG2-CB 4.4Å; V672-C707 VanDerWaalsContact CG2-SG 3.59Å; A675-C707 HydrophobicContact CB-CB 3.69Å; D703-C707 PolarHBondContact O-N 3.36Å; D703-C707 PolarHBondContact O-SG 3.06Å; V704-C707 PolarHBondContact O-N 3.48Å; C707-D710 PolarHBondContact O-N 2.87Å; C707-E711 WeakPolarHBondContact O-CG 3.46Å; C707-E711 PolarHBondContact O-N 3.26Å; C707-E711 VanDerWaalsContact O-N 3.1Å
708	V	98.1	Very high	96.8	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-69.5	-34	179	161.6	0	0	0	0	112.2	A675 L679 L693 V704 L705 D706 M712 I730	A675-V708 HydrophobicContact CB-CB 4.46Å; A675-V708 HydrophobicContact CB-CG2 3.49Å; A675-V708 VanDerWaalsContact CB-CG2 3.49Å; L679-V708 HydrophobicContact CD2-CG1 4.18Å; L679-V708 HydrophobicContact CG-CG1 4.5Å; L693-V708 HydrophobicContact CD1-CB 4.5Å; L693-V708 HydrophobicContact CD1-CG1 4.05Å; L693-V708 HydrophobicContact CD1-CG2 4.33Å; L693-V708 HydrophobicContact CD2-CG2 4.19Å; V704-V708 HydrophobicContact CG1-CG2 4.25Å; V704-V708 WeakPolarHBondContact O-CB 3.45Å; V704-V708 VanDerWaalsContact O-CG2 3.26Å; V704-V708 WeakPolarHBondContact O-CG2 3.44Å; V704-V708 PolarHBondContact O-N 3.32Å; L705-V708 CarbonylContact O-C 3.6Å; L705-V708 WeakPolarHBondContact O-CA 3.23Å; L705-V708 WeakPolarHBondContact O-CB 3.45Å; L705-V708 PolarHBondContact O-N 3.16Å; D706-V708 VanDerWaalsContact C-N 3.34Å; D706-V708 PolarHBondContact O-N 3.01Å; V708-M712 HydrophobicContact CG1-CE 4.19Å; V708-I730 HydrophobicContact CG1-CD1 3.8Å
709	V	97.5	Very high	96.9	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.036	26%	0.255	C	S	.	.	H	α-helix	trans	-79.7	-30.7	173	-63.3	0	0	0	0	111.8	L705 D706 E711 M712 F726 A745 R749	L705-V709 HydrophobicContact CD1-CG1 4.14Å; L705-V709 PolarHBondContact O-N 2.94Å; D706-V709 WeakPolarHBondContact O-CG2 3.46Å; D706-V709 PolarHBondContact O-N 3.12Å; V709-E711 VanDerWaalsContact C-N 3.34Å; V709-E711 PolarHBondContact O-N 3.05Å; V709-M712 CarbonylContact O-C 3.57Å; V709-M712 WeakPolarHBondContact O-CA 3.43Å; V709-M712 WeakPolarHBondContact O-CB 3.35Å; V709-M712 PolarHBondContact O-N 2.76Å; V709-M712 VanDerWaalsContact O-O 3.06Å; V709-F726 HydrophobicContact CG1-CD2 4.29Å; V709-F726 HydrophobicContact CG1-CE2 3.69Å; V709-A745 HydrophobicContact CG1-CB 4.3Å; V709-A745 HydrophobicContact CG2-CB 4.48Å; V709-R749 HydrophobicContact CB-CB 3.87Å; V709-R749 HydrophobicContact CB-CG 3.95Å; V709-R749 HydrophobicContact CG2-CB 3.94Å; V709-R749 HydrophobicContact CG2-CG 4.28Å; V709-R749 WeakPolarHBondContact O-CD 3.42Å; V709-R749 WeakPolarHBondContact O-CG 3.41Å; V709-R749 PolarHBondContact O-NE 2.75Å; V709-R749 VanDerWaalsContact O-NE 3.09Å
710	D	96.3	Very high	97	Very high	90 Å²	90	44.8 Å²	44.8	48%	0.481	23%	0.231	S	C	.	.	H	α-helix	trans	-66.5	-34	175.2	-81.1	-18	0	0	0	113.4	D706 C707 M712 R749	D706-D710 WeakPolarHBondContact O-CB 3.35Å; D706-D710 PolarHBondContact O-N 3.05Å; C707-D710 PolarHBondContact O-N 2.87Å; D710-M712 PolarHBondContact O-N 3.38Å; D710-R749 PolarHBondContact O-NH2 3.4Å; D710-R749 WeakPolarHBondContact OD1-CD 2.98Å; D710-R749 IonicContact OD1-CZ 3.4Å; D710-R749 IonicContact OD1-NE 3.67Å; D710-R749 IonicContact OD1-NH1 2.68Å; D710-R749 PolarHBondContact OD1-NH1 2.97Å
711	E	95.6	Very high	97	Very high	101 Å²	101	45.8 Å²	45.8	47%	0.472	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.5	167	-76.4	-79.8	108.6	0	0	113.6	H676 L679 C707 V709	H676-E711 IonicContact CE1-OE1 3.33Å; H676-E711 PolarHBondContact CE1-OE1 3.46Å; H676-E711 VanDerWaalsContact CE1-OE1 3.29Å; H676-E711 IonicContact CE1-OE2 2.81Å; H676-E711 PolarHBondContact CE1-OE2 2.84Å; H676-E711 VanDerWaalsContact ND1-CD 3.29Å; H676-E711 IonicContact ND1-OE1 3.27Å; H676-E711 IonicContact ND1-OE2 3.67Å; H676-E711 PolarHBondContact ND1-OE2 2.82Å; L679-E711 HydrophobicContact CD1-CB 3.85Å; L679-E711 HydrophobicContact CD1-CG 4.35Å; C707-E711 WeakPolarHBondContact O-CG 3.46Å; C707-E711 PolarHBondContact O-N 3.26Å; C707-E711 VanDerWaalsContact O-N 3.1Å; V709-E711 VanDerWaalsContact C-N 3.34Å; V709-E711 PolarHBondContact O-N 3.05Å
712	M	95.1	Very high	97	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.039	24%	0.236	C	C	.	.			trans	-102.9	114	173.3	-56.5	-160.6	-159.9	0	0	111.4	L679 V708 V709 D710 F714 F726 H729 I730 R749	L679-M712 HydrophobicContact CD2-CE 3.85Å; V708-M712 HydrophobicContact CG1-CE 4.19Å; V709-M712 CarbonylContact O-C 3.57Å; V709-M712 WeakPolarHBondContact O-CA 3.43Å; V709-M712 WeakPolarHBondContact O-CB 3.35Å; V709-M712 PolarHBondContact O-N 2.76Å; V709-M712 VanDerWaalsContact O-O 3.06Å; D710-M712 PolarHBondContact O-N 3.38Å; M712-F714 HydrophobicContact CB-CD1 4.41Å; M712-F714 HydrophobicContact CB-CE1 3.69Å; M712-F714 HydrophobicContact CB-CE2 4.07Å; M712-F714 HydrophobicContact CB-CZ 3.48Å; M712-F714 VanDerWaalsContact CB-CZ 3.48Å; M712-F714 HydrophobicContact CG-CZ 4.25Å; M712-F714 HydrophobicContact SD-CE1 4.12Å; M712-F714 HydrophobicContact SD-CZ 3.91Å; M712-F726 HydrophobicContact CE-CD2 3.93Å; M712-F726 HydrophobicContact SD-CB 4.17Å; M712-F726 HydrophobicContact SD-CD2 3.86Å; M712-H729 HydrophobicContact CE-CB 4.05Å; M712-I730 HydrophobicContact CE-CD1 4.4Å; M712-R749 PolarHBondContact O-NE 3.46Å; M712-R749 PolarHBondContact O-NH2 3.44Å
713	D	94.8	Very high	97	Very high	75 Å²	75	41.7 Å²	41.7	40%	0.401	22%	0.221	S	C	.	.			trans	-71.6	131.1	160.6	157.5	49.1	0	0	0	110.1	Q715 K725	D713-Q715 WeakPolarHBondContact OD1-CB 3.49Å; D713-Q715 WeakPolarHBondContact OD1-CG 3.43Å; D713-Q715 PolarHBondContact OD1-N 2.91Å; D713-K725 WeakPolarHBondContact O-CD 3.18Å; D713-K725 VanDerWaalsContact O-CE 3.24Å; D713-K725 WeakPolarHBondContact O-CE 3.49Å; D713-K725 PolarHBondContact O-NZ 3.29Å; D713-K725 IonicContact OD2-NZ 2.66Å; D713-K725 PolarHBondContact OD2-NZ 3.41Å
714	F	97.4	Very high	96.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.			trans	-125.7	14	171.3	-57.6	-48.9	0	0	0	112.4	M712 S716 M717 A722 K725 F726 F746 R749 Y750 C753 N754	M712-F714 HydrophobicContact CB-CD1 4.41Å; M712-F714 HydrophobicContact CB-CE1 3.69Å; M712-F714 HydrophobicContact CB-CE2 4.07Å; M712-F714 HydrophobicContact CB-CZ 3.48Å; M712-F714 VanDerWaalsContact CB-CZ 3.48Å; M712-F714 HydrophobicContact CG-CZ 4.25Å; M712-F714 HydrophobicContact SD-CE1 4.12Å; M712-F714 HydrophobicContact SD-CZ 3.91Å; F714-S716 PolarHBondContact O-N 2.71Å; F714-M717 HydrophobicContact CD1-SD 4.42Å; F714-M717 WeakPolarHBondContact O-CB 3.35Å; F714-M717 PolarHBondContact O-N 3.44Å; F714-A722 HydrophobicContact CB-CB 3.98Å; F714-A722 HydrophobicContact CD1-CB 3.67Å; F714-A722 HydrophobicContact CE1-CB 4.33Å; F714-A722 WeakPolarHBondContact CE1-O 3.43Å; F714-A722 HydrophobicContact CG-CB 3.89Å; F714-K725 HydrophobicContact CD1-CD 4.24Å; F714-K725 HydrophobicContact CE1-CB 4.24Å; F714-K725 HydrophobicContact CE1-CD 4.34Å; F714-K725 HydrophobicContact CE1-CG 4.4Å; F714-F726 HydrophobicContact CE1-CB 4.46Å; F714-F726 HydrophobicContact CZ-CB 4.17Å; F714-F746 HydrophobicContact CD2-CD2 4.5Å; F714-F746 HydrophobicContact CD2-CE2 4.24Å; F714-F746 HydrophobicContact CE1-CD2 4.48Å; F714-F746 HydrophobicContact CE1-CE2 4.12Å; F714-F746 AromaticContact CE2-CD2 3.68Å; F714-F746 HydrophobicContact CE2-CD2 3.68Å; F714-F746 AromaticContact CE2-CE2 3.78Å; F714-F746 HydrophobicContact CE2-CE2 3.78Å; F714-F746 AromaticContact CZ-CD2 3.67Å; F714-F746 HydrophobicContact CZ-CD2 3.67Å; F714-F746 AromaticContact CZ-CE2 3.72Å; F714-F746 HydrophobicContact CZ-CE2 3.72Å; F714-R749 HydrophobicContact CD2-CB 4.3Å; F714-R749 HydrophobicContact CD2-CG 3.71Å; F714-R749 HydrophobicContact CE2-CB 4.09Å; F714-R749 HydrophobicContact CE2-CG 3.65Å; F714-Y750 HydrophobicContact CB-CD2 4.28Å; F714-C753 HydrophobicContact CB-CB 3.95Å; F714-N754 PolarHBondContact O-ND2 3.48Å; F714-N754 PolarHBondContact O-OD1 2.96Å
715	Q	96.4	Very high	96.8	Very high	129 Å²	129	42.8 Å²	42.8	60%	0.603	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	134.6	-173.5	-64.4	-177.7	4.8	0	0	111.4	D713 M717 C753	D713-Q715 WeakPolarHBondContact OD1-CB 3.49Å; D713-Q715 WeakPolarHBondContact OD1-CG 3.43Å; D713-Q715 PolarHBondContact OD1-N 2.91Å; Q715-M717 PolarHBondContact O-N 3.44Å; Q715-M717 VanDerWaalsContact O-N 3.14Å; Q715-C753 HydrophobicContact CG-CB 4.05Å
716	S	94.9	Very high	96.7	Very high	124 Å²	124	42.8 Å²	42.8	87%	0.867	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	22.5	180	-51.5	0	0	0	0	114.1	F714 N754	F714-S716 PolarHBondContact O-N 2.71Å; S716-N754 PolarHBondContact N-OD1 3.41Å
717	M	97.1	Very high	96.6	Very high	43 Å²	43	40.5 Å²	40.5	21%	0.212	21%	0.211	C	C	.	.			trans	-98.5	142.7	172.5	-60.5	-167.2	72.8	0	0	110.6	F714 Q715 E721 A722 K725 Y750	F714-M717 HydrophobicContact CD1-SD 4.42Å; F714-M717 WeakPolarHBondContact O-CB 3.35Å; F714-M717 PolarHBondContact O-N 3.44Å; Q715-M717 PolarHBondContact O-N 3.44Å; Q715-M717 VanDerWaalsContact O-N 3.14Å; M717-E721 HydrophobicContact CE-CB 3.9Å; M717-E721 WeakPolarHBondContact CE-O 3.33Å; M717-A722 HydrophobicContact CB-CB 4.11Å; M717-K725 HydrophobicContact CE-CB 4.33Å; M717-K725 HydrophobicContact CE-CD 4.19Å; M717-K725 HydrophobicContact SD-CD 3.7Å; M717-Y750 WeakPolarHBondContact O-CE2 3.43Å; M717-Y750 PolarHBondContact O-OH 2.97Å
718	E	96.5	Very high	96.3	Very high	76 Å²	76	41 Å²	41	36%	0.355	21%	0.211	S	C	.	.			trans	-69.4	151.8	167.5	-68.1	-88.2	105.7	0	0	110.7	D720 E721 A722 R821	E718-D720 PolarHBondContact O-N 3.31Å; E718-E721 HydrophobicContact CB-CB 4.46Å; E718-E721 HydrophobicContact CB-CG 4.17Å; E718-E721 WeakPolarHBondContact O-CA 3.48Å; E718-E721 WeakPolarHBondContact O-CB 3.49Å; E718-E721 PolarHBondContact O-N 3.26Å; E718-A722 PolarHBondContact O-N 2.7Å; E718-R821 IonicContact OE2-CZ 3.66Å; E718-R821 IonicContact OE2-NH1 3.2Å; E718-R821 PolarHBondContact OE2-NH1 3.37Å; E718-R821 IonicContact OE2-NH2 2.78Å; E718-R821 PolarHBondContact OE2-NH2 2.99Å
719	L	96.9	Very high	96	Very high	7 Å²	7	43.7 Å²	43.7	4%	0.037	22%	0.224	C	C	.	.	H	α-helix	trans	-55.9	-42.9	-172.1	-174.7	62.3	0	0	0	113.9	E721 L723 F746 Y750 I767 L770 A771 I774	L719-E721 VanDerWaalsContact C-N 3.28Å; L719-E721 PolarHBondContact O-N 3.16Å; L719-L723 WeakPolarHBondContact O-CB 3.44Å; L719-L723 PolarHBondContact O-N 3.42Å; L719-F746 HydrophobicContact CD1-CE1 3.79Å; L719-F746 HydrophobicContact CD1-CZ 3.96Å; L719-Y750 HydrophobicContact CB-CE1 4.45Å; L719-Y750 HydrophobicContact CB-CE2 4.23Å; L719-Y750 HydrophobicContact CD1-CD1 3.8Å; L719-Y750 HydrophobicContact CD1-CD2 3.9Å; L719-Y750 HydrophobicContact CD1-CE1 3.87Å; L719-Y750 HydrophobicContact CD1-CE2 3.96Å; L719-Y750 HydrophobicContact CD1-CG 3.8Å; L719-Y750 PolarHBondContact N-OH 3.02Å; L719-I767 HydrophobicContact CD1-CG2 3.86Å; L719-I767 HydrophobicContact CD2-CG2 4.28Å; L719-L770 HydrophobicContact CD2-CB 3.94Å; L719-L770 HydrophobicContact CD2-CD2 3.8Å; L719-L770 HydrophobicContact CD2-CG 3.78Å; L719-A771 HydrophobicContact CD2-CB 4.49Å; L719-I774 HydrophobicContact CB-CD1 4.39Å; L719-I774 HydrophobicContact CD2-CD1 3.95Å; L719-I774 HydrophobicContact CG-CD1 3.98Å
720	D	97.3	Very high	95.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-74	-17.4	177.2	78.5	-83.7	0	0	0	113.6	E718 R724 I774 I818 R821 I822	E718-D720 PolarHBondContact O-N 3.31Å; D720-R724 WeakPolarHBondContact O-CB 3.47Å; D720-R724 PolarHBondContact O-N 2.95Å; D720-R724 IonicContact OD2-NH2 2.67Å; D720-R724 PolarHBondContact OD2-NH2 3.16Å; D720-I774 HydrophobicContact CB-CD1 4.03Å; D720-I774 HydrophobicContact CB-CG2 4.02Å; D720-I818 HydrophobicContact CB-CG2 4.49Å; D720-R821 IonicContact OD1-CZ 3.74Å; D720-R821 IonicContact OD1-NE 2.71Å; D720-R821 PolarHBondContact OD1-NE 2.84Å; D720-R821 IonicContact OD1-NH2 2.69Å; D720-R821 PolarHBondContact OD1-NH2 3.44Å; D720-R821 VanDerWaalsContact OD2-CB 3.3Å; D720-R821 WeakPolarHBondContact OD2-CB 3.34Å; D720-R821 IonicContact OD2-NE 2.77Å; D720-I822 HydrophobicContact CB-CD1 4.18Å; D720-I822 HydrophobicContact CB-CG1 4.37Å
721	E	97.5	Very high	95.4	Very high	82 Å²	82	43.1 Å²	43.1	38%	0.383	21%	0.214	S	C	.	.	H	α-helix	trans	-84.7	-39.8	174.9	-59.9	-167.4	152.5	0	0	111.2	M717 E718 L719 R724 K725 R821	M717-E721 HydrophobicContact CE-CB 3.9Å; M717-E721 WeakPolarHBondContact CE-O 3.33Å; E718-E721 HydrophobicContact CB-CB 4.46Å; E718-E721 HydrophobicContact CB-CG 4.17Å; E718-E721 WeakPolarHBondContact O-CA 3.48Å; E718-E721 WeakPolarHBondContact O-CB 3.49Å; E718-E721 PolarHBondContact O-N 3.26Å; L719-E721 VanDerWaalsContact C-N 3.28Å; L719-E721 PolarHBondContact O-N 3.16Å; E721-R724 WeakPolarHBondContact O-CB 3.49Å; E721-R724 PolarHBondContact O-N 2.8Å; E721-K725 PolarHBondContact O-N 3.46Å; E721-R821 WeakPolarHBondContact OE1-CD 3.26Å
722	A	97.9	Very high	94.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-48.5	169.7	0	0	0	0	0	111.3	F714 M717 E718 R724 K725 F726 F746 Y750	F714-A722 HydrophobicContact CB-CB 3.98Å; F714-A722 HydrophobicContact CD1-CB 3.67Å; F714-A722 HydrophobicContact CE1-CB 4.33Å; F714-A722 WeakPolarHBondContact CE1-O 3.43Å; F714-A722 HydrophobicContact CG-CB 3.89Å; M717-A722 HydrophobicContact CB-CB 4.11Å; E718-A722 PolarHBondContact O-N 2.7Å; A722-R724 PolarHBondContact O-N 2.86Å; A722-K725 WeakPolarHBondContact O-CA 3.5Å; A722-K725 WeakPolarHBondContact O-CB 3.34Å; A722-K725 PolarHBondContact O-N 3.44Å; A722-F726 PolarHBondContact O-N 2.91Å; A722-F746 HydrophobicContact CB-CE2 3.93Å; A722-F746 HydrophobicContact CB-CZ 3.91Å; A722-Y750 HydrophobicContact CB-CD2 3.58Å; A722-Y750 HydrophobicContact CB-CE2 3.82Å
723	L	97	Very high	94.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.1	-34.2	176.9	179.2	59.9	0	0	0	111.7	L719 F726 Q727 I743 F746 I774 I775 L827	L719-L723 WeakPolarHBondContact O-CB 3.44Å; L719-L723 PolarHBondContact O-N 3.42Å; L723-F726 HydrophobicContact CD1-CD1 4.39Å; L723-F726 PolarHBondContact O-N 3.04Å; L723-Q727 VanDerWaalsContact O-CB 3.3Å; L723-Q727 WeakPolarHBondContact O-CB 3.41Å; L723-Q727 PolarHBondContact O-N 3.36Å; L723-I743 HydrophobicContact CD1-CD1 3.59Å; L723-F746 VanDerWaalsContact CA-CZ 3.42Å; L723-F746 HydrophobicContact CB-CE1 3.9Å; L723-F746 HydrophobicContact CB-CE2 4.3Å; L723-F746 HydrophobicContact CB-CZ 3.64Å; L723-F746 HydrophobicContact CD1-CD1 4.01Å; L723-F746 HydrophobicContact CD1-CE1 3.92Å; L723-F746 HydrophobicContact CD1-CG 4.44Å; L723-F746 HydrophobicContact CD1-CZ 4.29Å; L723-F746 HydrophobicContact CG-CE1 4.43Å; L723-F746 VanDerWaalsContact N-CZ 3.27Å; L723-I774 HydrophobicContact CD2-CB 4.01Å; L723-I774 HydrophobicContact CD2-CG2 3.68Å; L723-I775 HydrophobicContact CD2-CG1 3.99Å; L723-L827 HydrophobicContact CD2-CD1 4.42Å
724	R	96.9	Very high	93.3	Very high	13 Å²	13	39.5 Å²	39.5	5%	0.049	20%	0.203	C	C	.	.	H	α-helix	trans	-68.4	-40.7	172.7	-170.5	-174.7	-49.6	-93.9	7.6	112.4	D720 E721 A722 F726 Q727 N728 R825 E826 L827	D720-R724 WeakPolarHBondContact O-CB 3.47Å; D720-R724 PolarHBondContact O-N 2.95Å; D720-R724 IonicContact OD2-NH2 2.67Å; D720-R724 PolarHBondContact OD2-NH2 3.16Å; E721-R724 WeakPolarHBondContact O-CB 3.49Å; E721-R724 PolarHBondContact O-N 2.8Å; A722-R724 PolarHBondContact O-N 2.86Å; R724-F726 VanDerWaalsContact C-N 3.29Å; R724-F726 PolarHBondContact O-N 2.82Å; R724-Q727 PolarHBondContact O-N 3.44Å; R724-N728 WeakPolarHBondContact O-CB 3.37Å; R724-N728 PolarHBondContact O-N 3.09Å; R724-N728 PolarHBondContact O-ND2 2.79Å; R724-N728 PolarHBondContact O-OD1 2.99Å; R724-R825 PolarHBondContact NH1-O 3.19Å; R724-E826 PolarHBondContact NH1-O 3.41Å; R724-L827 HydrophobicContact CB-CD2 3.59Å; R724-L827 HydrophobicContact CG-CD2 3.81Å
725	K	96.1	Very high	92.5	Very high	65 Å²	65	43 Å²	43	28%	0.283	22%	0.22	S	C	.	.	H	α-helix	trans	-60.3	-38.7	173.4	-172.2	175.2	-179.5	177.6	0	111.4	D713 F714 M717 E721 A722 H729	D713-K725 WeakPolarHBondContact O-CD 3.18Å; D713-K725 VanDerWaalsContact O-CE 3.24Å; D713-K725 WeakPolarHBondContact O-CE 3.49Å; D713-K725 PolarHBondContact O-NZ 3.29Å; D713-K725 IonicContact OD2-NZ 2.66Å; D713-K725 PolarHBondContact OD2-NZ 3.41Å; F714-K725 HydrophobicContact CD1-CD 4.24Å; F714-K725 HydrophobicContact CE1-CB 4.24Å; F714-K725 HydrophobicContact CE1-CD 4.34Å; F714-K725 HydrophobicContact CE1-CG 4.4Å; M717-K725 HydrophobicContact CE-CB 4.33Å; M717-K725 HydrophobicContact CE-CD 4.19Å; M717-K725 HydrophobicContact SD-CD 3.7Å; E721-K725 PolarHBondContact O-N 3.46Å; A722-K725 WeakPolarHBondContact O-CA 3.5Å; A722-K725 WeakPolarHBondContact O-CB 3.34Å; A722-K725 PolarHBondContact O-N 3.44Å; K725-H729 PolarHBondContact O-ND1 3.29Å
726	F	96.4	Very high	91.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-68	-56	172.9	-177.1	-109.1	0	0	0	112.6	V709 M712 F714 A722 L723 R724 N728 H729 I730 V732 L742 I743 F746	V709-F726 HydrophobicContact CG1-CD2 4.29Å; V709-F726 HydrophobicContact CG1-CE2 3.69Å; M712-F726 HydrophobicContact CE-CD2 3.93Å; M712-F726 HydrophobicContact SD-CB 4.17Å; M712-F726 HydrophobicContact SD-CD2 3.86Å; F714-F726 HydrophobicContact CE1-CB 4.46Å; F714-F726 HydrophobicContact CZ-CB 4.17Å; A722-F726 PolarHBondContact O-N 2.91Å; L723-F726 HydrophobicContact CD1-CD1 4.39Å; L723-F726 PolarHBondContact O-N 3.04Å; R724-F726 VanDerWaalsContact C-N 3.29Å; R724-F726 PolarHBondContact O-N 2.82Å; F726-N728 PolarHBondContact O-N 3.5Å; F726-H729 PolarHBondContact O-N 2.63Å; F726-I730 HydrophobicContact CD2-CD1 4Å; F726-I730 HydrophobicContact CE1-CD1 4.5Å; F726-I730 HydrophobicContact CE2-CD1 3.45Å; F726-I730 VanDerWaalsContact CE2-CD1 3.45Å; F726-I730 HydrophobicContact CZ-CD1 3.75Å; F726-I730 PolarHBondContact O-N 3.21Å; F726-V732 HydrophobicContact CD1-CG2 3.89Å; F726-V732 HydrophobicContact CE1-CG2 3.64Å; F726-L742 HydrophobicContact CE1-CB 4.29Å; F726-L742 HydrophobicContact CZ-CB 4.26Å; F726-L742 HydrophobicContact CZ-CD2 4.22Å; F726-L742 WeakPolarHBondContact CZ-O 3.36Å; F726-I743 HydrophobicContact CE1-CD1 4.45Å; F726-F746 HydrophobicContact CB-CD2 3.84Å; F726-F746 HydrophobicContact CB-CE2 4.2Å; F726-F746 HydrophobicContact CD1-CB 4.2Å; F726-F746 HydrophobicContact CD1-CD2 4.22Å; F726-F746 HydrophobicContact CD1-CG 4.28Å; F726-F746 HydrophobicContact CD2-CB 4.49Å; F726-F746 HydrophobicContact CD2-CD2 4.3Å; F726-F746 HydrophobicContact CE1-CB 4.05Å; F726-F746 HydrophobicContact CE2-CB 4.37Å; F726-F746 HydrophobicContact CG-CB 4.41Å; F726-F746 AromaticContact CG-CD2 3.9Å; F726-F746 HydrophobicContact CG-CD2 3.9Å; F726-F746 HydrophobicContact CG-CG 4.38Å; F726-F746 HydrophobicContact CZ-CB 4.14Å
727	Q	93.8	Very high	91.2	Very high	4 Å²	4	36 Å²	36	2%	0.019	17%	0.173	C	C	.	.	H	α-helix	trans	-64.2	-24.5	-177.1	-172.4	178.6	-23.4	0	0	113.5	L723 R724 H729 I730 V732 L827 T829	L723-Q727 VanDerWaalsContact O-CB 3.3Å; L723-Q727 WeakPolarHBondContact O-CB 3.41Å; L723-Q727 PolarHBondContact O-N 3.36Å; R724-Q727 PolarHBondContact O-N 3.44Å; Q727-H729 PolarHBondContact O-N 2.66Å; Q727-I730 CarbonylContact C-O 3.6Å; Q727-I730 WeakPolarHBondContact CA-O 3.35Å; Q727-V732 HydrophobicContact CG-CG2 4.49Å; Q727-L827 PolarHBondContact NE2-O 2.97Å; Q727-L827 VanDerWaalsContact NE2-O 3.14Å; Q727-T829 WeakPolarHBondContact O-CA 3.47Å; Q727-T829 VanDerWaalsContact O-CB 3.28Å; Q727-T829 WeakPolarHBondContact O-CB 3.47Å; Q727-T829 WeakPolarHBondContact O-CG2 3.35Å; Q727-T829 PolarHBondContact O-OG1 2.98Å
728	N	93.4	Very high	90.7	Very high	36 Å²	36	36.1 Å²	36.1	19%	0.193	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-36.7	168.8	-74.1	-22.8	0	0	0	111.8	R724 F726 K828 N830	R724-N728 WeakPolarHBondContact O-CB 3.37Å; R724-N728 PolarHBondContact O-N 3.09Å; R724-N728 PolarHBondContact O-ND2 2.79Å; R724-N728 PolarHBondContact O-OD1 2.99Å; F726-N728 PolarHBondContact O-N 3.5Å; N728-K828 PolarHBondContact OD1-O 3.38Å; N728-N830 WeakPolarHBondContact O-CB 3.45Å; N728-N830 VanDerWaalsContact O-CG 3.25Å; N728-N830 PolarHBondContact O-N 2.91Å; N728-N830 PolarHBondContact O-ND2 3.35Å; N728-N830 VanDerWaalsContact O-ND2 3.15Å
729	H	91.3	Very high	90.3	Very high	58 Å²	58	32.9 Å²	32.9	27%	0.269	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-25	-174.2	-64	97.3	0	0	0	114.1	L679 R686 M712 K725 F726 Q727	L679-H729 HydrophobicContact CD2-CB 3.85Å; R686-H729 WeakPolarHBondContact CD-O 3.16Å; R686-H729 PolarHBondContact NH1-O 3.3Å; M712-H729 HydrophobicContact CE-CB 4.05Å; K725-H729 PolarHBondContact O-ND1 3.29Å; F726-H729 PolarHBondContact O-N 2.63Å; Q727-H729 PolarHBondContact O-N 2.66Å
730	I	92.4	Very high	90	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	S	Bend	trans	-132.7	131	-174.1	-56.9	162	0	0	0	108.5	I689 L693 V708 M712 F726 Q727 V732 L742	I689-I730 HydrophobicContact CG2-CG1 4.14Å; L693-I730 HydrophobicContact CD1-CD1 3.71Å; L693-I730 HydrophobicContact CD1-CG1 4.08Å; V708-I730 HydrophobicContact CG1-CD1 3.8Å; M712-I730 HydrophobicContact CE-CD1 4.4Å; F726-I730 HydrophobicContact CD2-CD1 4Å; F726-I730 HydrophobicContact CE1-CD1 4.5Å; F726-I730 HydrophobicContact CE2-CD1 3.45Å; F726-I730 VanDerWaalsContact CE2-CD1 3.45Å; F726-I730 HydrophobicContact CZ-CD1 3.75Å; F726-I730 PolarHBondContact O-N 3.21Å; Q727-I730 CarbonylContact C-O 3.6Å; Q727-I730 WeakPolarHBondContact CA-O 3.35Å; I730-V732 HydrophobicContact CG2-CG2 4.49Å; I730-V732 PolarHBondContact O-N 2.94Å; I730-V732 VanDerWaalsContact O-N 3.1Å; I730-L742 HydrophobicContact CG2-CD1 4.12Å; I730-L742 HydrophobicContact CG2-CD2 4.19Å
731	R	89.1	Confident	89.8	Confident	84 Å²	84	34.5 Å²	34.5	32%	0.317	17%	0.166	S	C	.	.			trans	-79.5	96.4	175.1	-172.6	-173.3	174.1	-138.3	-13.1	109.8	R686 Q733 T829	R686-R731 HydrophobicContact CB-CB 4.43Å; R686-R731 VanDerWaalsContact O-CB 3.31Å; R686-R731 WeakPolarHBondContact O-CB 3.23Å; R686-R731 PolarHBondContact O-N 2.83Å; R731-Q733 HydrophobicContact CG-CB 4.16Å; R731-Q733 HydrophobicContact CG-CG 4.37Å; R731-Q733 VanDerWaalsContact CZ-OE1 3.3Å; R731-Q733 PolarHBondContact O-N 3.34Å; R731-T829 HydrophobicContact CB-CG2 4.25Å
732	V	85.7	Confident	89.7	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.012	15%	0.148	C	C	.	.			trans	-79.1	63.8	177.7	-164.7	0	0	0	0	111	F726 Q727 I730 V739 L742 I743 I775	F726-V732 HydrophobicContact CD1-CG2 3.89Å; F726-V732 HydrophobicContact CE1-CG2 3.64Å; Q727-V732 HydrophobicContact CG-CG2 4.49Å; I730-V732 HydrophobicContact CG2-CG2 4.49Å; I730-V732 PolarHBondContact O-N 2.94Å; I730-V732 VanDerWaalsContact O-N 3.1Å; V732-V739 HydrophobicContact CG1-CG1 4.02Å; V732-V739 HydrophobicContact CG1-CG2 4.47Å; V732-L742 HydrophobicContact CG1-CB 4.29Å; V732-L742 HydrophobicContact CG1-CD1 4.33Å; V732-I743 HydrophobicContact CG1-CD1 3.95Å; V732-I743 HydrophobicContact CG1-CG1 4.02Å; V732-I775 HydrophobicContact CG1-CD1 4.37Å
733	Q	77.8	Confident	89.5	Confident	76 Å²	76	30.8 Å²	30.8	36%	0.355	15%	0.148	S	C	.	.			trans	-150.8	127.6	179.5	-62.8	179.2	-19.9	0	0	109.9	R731	R731-Q733 HydrophobicContact CG-CB 4.16Å; R731-Q733 HydrophobicContact CG-CG 4.37Å; R731-Q733 VanDerWaalsContact CZ-OE1 3.3Å; R731-Q733 PolarHBondContact O-N 3.34Å
734	G	78.3	Confident	89.4	Confident	30 Å²	30	33.2 Å²	33.2	31%	0.309	16%	0.159	S	C	.	.	S	Bend	trans	160.4	-140.8	-179.9	0	0	0	0	0	112.1	L1070	G734-L1070 WeakPolarHBondContact O-CD1 3.31Å
735	E	80.6	Confident	89.4	Confident	75 Å²	75	32.6 Å²	32.6	35%	0.35	16%	0.157	S	C	.	.	S	Bend	trans	-59.4	143.6	171.8	-65.7	145.9	-125.4	0	0	112.1	Q737 K738 V739 M1063	E735-Q737 PolarHBondContact O-N 2.73Å; E735-K738 HydrophobicContact CB-CB 4.49Å; E735-K738 HydrophobicContact CB-CD 4.26Å; E735-K738 HydrophobicContact CB-CG 4.43Å; E735-K738 PolarHBondContact O-N 3.05Å; E735-K738 IonicContact OE1-NZ 3.02Å; E735-K738 PolarHBondContact OE1-NZ 2.92Å; E735-K738 WeakPolarHBondContact OE2-CD 3.35Å; E735-K738 WeakPolarHBondContact OE2-CE 3.22Å; E735-K738 IonicContact OE2-NZ 2.73Å; E735-K738 PolarHBondContact OE2-NZ 3.37Å; E735-V739 PolarHBondContact O-N 3.03Å; E735-V739 VanDerWaalsContact O-N 3.16Å; E735-M1063 HydrophobicContact CG-CE 4.02Å
736	A	80	Confident	89.5	Confident	2 Å²	2	29.5 Å²	29.5	2%	0.017	14%	0.144	C	C	.	.	H	α-helix	trans	-49.1	-58.9	-179.7	0	0	0	0	0	113.2	K738 V739 E740 L1070 E1073 L1074	A736-K738 PolarHBondContact O-N 3.37Å; A736-V739 PolarHBondContact O-N 3.3Å; A736-E740 WeakPolarHBondContact O-CB 3.2Å; A736-E740 PolarHBondContact O-N 2.84Å; A736-L1070 HydrophobicContact CB-CD2 3.92Å; A736-L1070 HydrophobicContact CB-CG 4.13Å; A736-E1073 HydrophobicContact CB-CB 4.33Å; A736-L1074 HydrophobicContact CB-CD2 3.9Å; A736-L1074 HydrophobicContact CB-CG 3.86Å
737	Q	83	Confident	89.5	Confident	102 Å²	102	29.8 Å²	29.8	48%	0.477	15%	0.146	S	C	.	.	H	α-helix	trans	-58.5	-31	-177.2	-65.9	174.6	-7.1	0	0	113.9	E735 R741 L1077	E735-Q737 PolarHBondContact O-N 2.73Å; Q737-R741 PolarHBondContact O-N 3.01Å; Q737-R741 VanDerWaalsContact O-N 3.15Å; Q737-L1077 HydrophobicContact CG-CD1 3.61Å; Q737-L1077 VanDerWaalsContact NE2-CD1 3.28Å
738	K	87.2	Confident	89.6	Confident	46 Å²	46	34 Å²	34	20%	0.2	17%	0.165	C	C	.	.	H	α-helix	trans	-76.5	-38.7	177.4	-71.8	175.7	177.4	158.4	0	111.4	E735 A736 L742	E735-K738 HydrophobicContact CB-CB 4.49Å; E735-K738 HydrophobicContact CB-CD 4.26Å; E735-K738 HydrophobicContact CB-CG 4.43Å; E735-K738 PolarHBondContact O-N 3.05Å; E735-K738 IonicContact OE1-NZ 3.02Å; E735-K738 PolarHBondContact OE1-NZ 2.92Å; E735-K738 WeakPolarHBondContact OE2-CD 3.35Å; E735-K738 WeakPolarHBondContact OE2-CE 3.22Å; E735-K738 IonicContact OE2-NZ 2.73Å; E735-K738 PolarHBondContact OE2-NZ 3.37Å; A736-K738 PolarHBondContact O-N 3.37Å; K738-L742 WeakPolarHBondContact O-CD1 3.39Å; K738-L742 VanDerWaalsContact O-CG 3.22Å; K738-L742 WeakPolarHBondContact O-CG 3.24Å; K738-L742 PolarHBondContact O-N 3.15Å
739	V	88.7	Confident	89.8	Confident	9 Å²	9	34.6 Å²	34.6	6%	0.055	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-44.5	173.4	170.8	0	0	0	0	110.4	V732 E735 A736 L742 I743 F772	V732-V739 HydrophobicContact CG1-CG1 4.02Å; V732-V739 HydrophobicContact CG1-CG2 4.47Å; E735-V739 PolarHBondContact O-N 3.03Å; E735-V739 VanDerWaalsContact O-N 3.16Å; A736-V739 PolarHBondContact O-N 3.3Å; V739-L742 PolarHBondContact O-N 3.37Å; V739-I743 HydrophobicContact CG1-CG1 4.43Å; V739-I743 WeakPolarHBondContact O-CG1 3.28Å; V739-I743 PolarHBondContact O-N 3.26Å; V739-F772 HydrophobicContact CG1-CE1 3.74Å; V739-F772 HydrophobicContact CG1-CZ 3.95Å
740	E	89.1	Confident	90.2	Very high	39 Å²	39	32 Å²	32	18%	0.182	15%	0.153	C	C	.	.	H	α-helix	trans	-51.8	-59.3	174.6	-177	-158.9	130	0	0	112	R696 A736 L742 I743 E744 F768 F772 L1074	R696-E740 IonicContact NH1-OE1 2.84Å; R696-E740 PolarHBondContact NH1-OE1 3.26Å; A736-E740 WeakPolarHBondContact O-CB 3.2Å; A736-E740 PolarHBondContact O-N 2.84Å; E740-L742 VanDerWaalsContact C-N 3.28Å; E740-L742 PolarHBondContact O-N 2.87Å; E740-I743 PolarHBondContact O-N 3.06Å; E740-E744 WeakPolarHBondContact O-CB 3.35Å; E740-E744 PolarHBondContact O-N 2.75Å; E740-F768 HydrophobicContact CG-CZ 4.26Å; E740-F772 HydrophobicContact CB-CZ 4.25Å; E740-L1074 HydrophobicContact CB-CD2 4.5Å
741	R	93.3	Very high	90.3	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-33.5	179.7	176.5	55	-170	155.4	12.7	113.4	R696 L705 D706 Q737 E744 A745	R696-R741 HydrophobicContact CB-CG 4.46Å; L705-R741 HydrophobicContact CD2-CG 3.99Å; D706-R741 IonicContact OD1-CZ 3.12Å; D706-R741 IonicContact OD1-NH2 2.77Å; D706-R741 PolarHBondContact OD1-NH2 2.9Å; D706-R741 IonicContact OD2-NH2 2.72Å; Q737-R741 PolarHBondContact O-N 3.01Å; Q737-R741 VanDerWaalsContact O-N 3.15Å; R741-E744 WeakPolarHBondContact CD-OE2 3.47Å; R741-E744 IonicContact CZ-OE2 3.29Å; R741-E744 IonicContact NE-OE2 3.65Å; R741-E744 IonicContact NH1-OE1 3.83Å; R741-E744 PolarHBondContact NH1-OE1 2.83Å; R741-E744 IonicContact NH1-OE2 3.78Å; R741-E744 PolarHBondContact NH1-OE2 2.73Å; R741-A745 PolarHBondContact O-N 2.91Å
742	L	95.1	Very high	90.7	Very high	3 Å²	3	35 Å²	35	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-68.1	-37.6	175.3	-73	171.8	0	0	0	112.3	L693 L705 F726 I730 V732 K738 V739 E740 F746	L693-L742 HydrophobicContact CB-CD2 3.74Å; L705-L742 HydrophobicContact CD1-CD2 3.95Å; L705-L742 HydrophobicContact CD2-CD2 4.24Å; F726-L742 HydrophobicContact CE1-CB 4.29Å; F726-L742 HydrophobicContact CZ-CB 4.26Å; F726-L742 HydrophobicContact CZ-CD2 4.22Å; F726-L742 WeakPolarHBondContact CZ-O 3.36Å; I730-L742 HydrophobicContact CG2-CD1 4.12Å; I730-L742 HydrophobicContact CG2-CD2 4.19Å; V732-L742 HydrophobicContact CG1-CB 4.29Å; V732-L742 HydrophobicContact CG1-CD1 4.33Å; K738-L742 WeakPolarHBondContact O-CD1 3.39Å; K738-L742 VanDerWaalsContact O-CG 3.22Å; K738-L742 WeakPolarHBondContact O-CG 3.24Å; K738-L742 PolarHBondContact O-N 3.15Å; V739-L742 PolarHBondContact O-N 3.37Å; E740-L742 VanDerWaalsContact C-N 3.28Å; E740-L742 PolarHBondContact O-N 2.87Å; L742-F746 WeakPolarHBondContact O-CB 3.46Å; L742-F746 PolarHBondContact O-N 2.84Å
743	I	95.1	Very high	91.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-83	-28.6	-179.4	-65.3	-55.3	0	0	0	112.6	L723 F726 V732 V739 E740 F746 S747 F768 A771 F772 I775	L723-I743 HydrophobicContact CD1-CD1 3.59Å; F726-I743 HydrophobicContact CE1-CD1 4.45Å; V732-I743 HydrophobicContact CG1-CD1 3.95Å; V732-I743 HydrophobicContact CG1-CG1 4.02Å; V739-I743 HydrophobicContact CG1-CG1 4.43Å; V739-I743 WeakPolarHBondContact O-CG1 3.28Å; V739-I743 PolarHBondContact O-N 3.26Å; E740-I743 PolarHBondContact O-N 3.06Å; I743-F746 HydrophobicContact CD1-CD1 4.33Å; I743-S747 VanDerWaalsContact O-CB 3.25Å; I743-S747 WeakPolarHBondContact O-CB 3.38Å; I743-S747 PolarHBondContact O-N 3.2Å; I743-S747 PolarHBondContact O-OG 3.43Å; I743-F768 HydrophobicContact CB-CE2 4.46Å; I743-F768 HydrophobicContact CG2-CD2 3.91Å; I743-F768 HydrophobicContact CG2-CE2 4.17Å; I743-A771 HydrophobicContact CG2-CB 3.75Å; I743-F772 HydrophobicContact CB-CD2 4.39Å; I743-F772 HydrophobicContact CB-CE2 4.08Å; I743-F772 HydrophobicContact CG2-CD2 3.84Å; I743-F772 HydrophobicContact CG2-CE2 4.01Å; I743-I775 HydrophobicContact CD1-CD1 3.61Å; I743-I775 HydrophobicContact CG1-CD1 3.62Å
744	E	94.8	Very high	92.1	Very high	51 Å²	51	32.2 Å²	32.2	24%	0.238	16%	0.164	C	C	.	.	H	α-helix	trans	-55.3	-60.1	168.5	-170.8	-145.9	156.3	0	0	110.3	E740 R741 F746 S747 Q748 F768	E740-E744 WeakPolarHBondContact O-CB 3.35Å; E740-E744 PolarHBondContact O-N 2.75Å; R741-E744 WeakPolarHBondContact CD-OE2 3.47Å; R741-E744 IonicContact CZ-OE2 3.29Å; R741-E744 IonicContact NE-OE2 3.65Å; R741-E744 IonicContact NH1-OE1 3.83Å; R741-E744 PolarHBondContact NH1-OE1 2.83Å; R741-E744 IonicContact NH1-OE2 3.78Å; R741-E744 PolarHBondContact NH1-OE2 2.73Å; E744-F746 PolarHBondContact O-N 3.48Å; E744-S747 PolarHBondContact O-N 3.49Å; E744-Q748 WeakPolarHBondContact O-CG 3.19Å; E744-Q748 PolarHBondContact O-N 3.39Å; E744-Q748 PolarHBondContact OE1-NE2 2.84Å; E744-F768 HydrophobicContact CB-CE2 4.08Å
745	A	96.7	Very high	92.9	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-64.2	-38.2	-179	0	0	0	0	0	112.8	L705 V709 R741 R749	L705-A745 HydrophobicContact CD1-CB 4.25Å; L705-A745 HydrophobicContact CD2-CB 3.73Å; L705-A745 HydrophobicContact CG-CB 3.77Å; V709-A745 HydrophobicContact CG1-CB 4.3Å; V709-A745 HydrophobicContact CG2-CB 4.48Å; R741-A745 PolarHBondContact O-N 2.91Å; A745-R749 WeakPolarHBondContact O-CB 3.39Å; A745-R749 PolarHBondContact O-N 2.67Å
746	F	97.8	Very high	93.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-45.4	173.2	163.8	-100.1	0	0	0	112	F714 L719 A722 L723 F726 L742 I743 E744 R749 Y750 A771	F714-F746 HydrophobicContact CD2-CD2 4.5Å; F714-F746 HydrophobicContact CD2-CE2 4.24Å; F714-F746 HydrophobicContact CE1-CD2 4.48Å; F714-F746 HydrophobicContact CE1-CE2 4.12Å; F714-F746 AromaticContact CE2-CD2 3.68Å; F714-F746 HydrophobicContact CE2-CD2 3.68Å; F714-F746 AromaticContact CE2-CE2 3.78Å; F714-F746 HydrophobicContact CE2-CE2 3.78Å; F714-F746 AromaticContact CZ-CD2 3.67Å; F714-F746 HydrophobicContact CZ-CD2 3.67Å; F714-F746 AromaticContact CZ-CE2 3.72Å; F714-F746 HydrophobicContact CZ-CE2 3.72Å; L719-F746 HydrophobicContact CD1-CE1 3.79Å; L719-F746 HydrophobicContact CD1-CZ 3.96Å; A722-F746 HydrophobicContact CB-CE2 3.93Å; A722-F746 HydrophobicContact CB-CZ 3.91Å; L723-F746 VanDerWaalsContact CA-CZ 3.42Å; L723-F746 HydrophobicContact CB-CE1 3.9Å; L723-F746 HydrophobicContact CB-CE2 4.3Å; L723-F746 HydrophobicContact CB-CZ 3.64Å; L723-F746 HydrophobicContact CD1-CD1 4.01Å; L723-F746 HydrophobicContact CD1-CE1 3.92Å; L723-F746 HydrophobicContact CD1-CG 4.44Å; L723-F746 HydrophobicContact CD1-CZ 4.29Å; L723-F746 HydrophobicContact CG-CE1 4.43Å; L723-F746 VanDerWaalsContact N-CZ 3.27Å; F726-F746 HydrophobicContact CB-CD2 3.84Å; F726-F746 HydrophobicContact CB-CE2 4.2Å; F726-F746 HydrophobicContact CD1-CB 4.2Å; F726-F746 HydrophobicContact CD1-CD2 4.22Å; F726-F746 HydrophobicContact CD1-CG 4.28Å; F726-F746 HydrophobicContact CD2-CB 4.49Å; F726-F746 HydrophobicContact CD2-CD2 4.3Å; F726-F746 HydrophobicContact CE1-CB 4.05Å; F726-F746 HydrophobicContact CE2-CB 4.37Å; F726-F746 HydrophobicContact CG-CB 4.41Å; F726-F746 AromaticContact CG-CD2 3.9Å; F726-F746 HydrophobicContact CG-CD2 3.9Å; F726-F746 HydrophobicContact CG-CG 4.38Å; F726-F746 HydrophobicContact CZ-CB 4.14Å; L742-F746 WeakPolarHBondContact O-CB 3.46Å; L742-F746 PolarHBondContact O-N 2.84Å; I743-F746 HydrophobicContact CD1-CD1 4.33Å; E744-F746 PolarHBondContact O-N 3.48Å; F746-R749 PolarHBondContact O-N 2.95Å; F746-Y750 HydrophobicContact CZ-CD2 4.47Å; F746-Y750 WeakPolarHBondContact O-CB 3.24Å; F746-Y750 PolarHBondContact O-N 2.99Å; F746-A771 HydrophobicContact CD1-CB 4.43Å; F746-A771 HydrophobicContact CE1-CB 4.21Å
747	S	96.8	Very high	93.9	Very high	5 Å²	5	36.5 Å²	36.5	4%	0.035	19%	0.19	C	C	.	.	H	α-helix	trans	-70	-42.6	-177.5	-57.1	0	0	0	0	111.2	I743 E744 R749 Y750 C751 F768	I743-S747 VanDerWaalsContact O-CB 3.25Å; I743-S747 WeakPolarHBondContact O-CB 3.38Å; I743-S747 PolarHBondContact O-N 3.2Å; I743-S747 PolarHBondContact O-OG 3.43Å; E744-S747 PolarHBondContact O-N 3.49Å; S747-R749 VanDerWaalsContact C-N 3.33Å; S747-R749 PolarHBondContact O-N 3Å; S747-Y750 PolarHBondContact O-N 3.26Å; S747-C751 WeakPolarHBondContact O-CB 3.36Å; S747-C751 PolarHBondContact O-N 3.45Å; S747-C751 PolarHBondContact O-SG 3.27Å; S747-F768 WeakPolarHBondContact OG-CA 3.38Å
748	Q	96.4	Very high	94.3	Very high	93 Å²	93	32.9 Å²	32.9	44%	0.435	18%	0.175	S	C	.	.	H	α-helix	trans	-53.7	-49.5	171.7	-72.6	164.1	-4.6	0	0	111	E744 C751 I752	E744-Q748 WeakPolarHBondContact O-CG 3.19Å; E744-Q748 PolarHBondContact O-N 3.39Å; E744-Q748 PolarHBondContact OE1-NE2 2.84Å; Q748-C751 PolarHBondContact O-N 3.33Å; Q748-I752 WeakPolarHBondContact O-CG1 3.46Å; Q748-I752 PolarHBondContact O-N 3.07Å; Q748-I752 VanDerWaalsContact O-N 3.13Å
749	R	97.6	Very high	94.5	Very high	49 Å²	49	40.7 Å²	40.7	19%	0.185	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-40.8	176.7	-177.4	69.8	-176.6	172.5	3.1	113.1	V709 D710 M712 F714 A745 F746 S747 I752 C753	V709-R749 HydrophobicContact CB-CB 3.87Å; V709-R749 HydrophobicContact CB-CG 3.95Å; V709-R749 HydrophobicContact CG2-CB 3.94Å; V709-R749 HydrophobicContact CG2-CG 4.28Å; V709-R749 WeakPolarHBondContact O-CD 3.42Å; V709-R749 WeakPolarHBondContact O-CG 3.41Å; V709-R749 PolarHBondContact O-NE 2.75Å; V709-R749 VanDerWaalsContact O-NE 3.09Å; D710-R749 PolarHBondContact O-NH2 3.4Å; D710-R749 WeakPolarHBondContact OD1-CD 2.98Å; D710-R749 IonicContact OD1-CZ 3.4Å; D710-R749 IonicContact OD1-NE 3.67Å; D710-R749 IonicContact OD1-NH1 2.68Å; D710-R749 PolarHBondContact OD1-NH1 2.97Å; M712-R749 PolarHBondContact O-NE 3.46Å; M712-R749 PolarHBondContact O-NH2 3.44Å; F714-R749 HydrophobicContact CD2-CB 4.3Å; F714-R749 HydrophobicContact CD2-CG 3.71Å; F714-R749 HydrophobicContact CE2-CB 4.09Å; F714-R749 HydrophobicContact CE2-CG 3.65Å; A745-R749 WeakPolarHBondContact O-CB 3.39Å; A745-R749 PolarHBondContact O-N 2.67Å; F746-R749 PolarHBondContact O-N 2.95Å; S747-R749 VanDerWaalsContact C-N 3.33Å; S747-R749 PolarHBondContact O-N 3Å; R749-I752 PolarHBondContact O-N 3.09Å; R749-C753 PolarHBondContact O-N 3.22Å; R749-C753 PolarHBondContact O-SG 2.91Å
750	Y	97.9	Very high	94.6	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-42.7	176.7	178.8	-89.3	0	0	0	111.7	F714 M717 L719 A722 F746 S747 C753 N754 V757 I767	F714-Y750 HydrophobicContact CB-CD2 4.28Å; M717-Y750 WeakPolarHBondContact O-CE2 3.43Å; M717-Y750 PolarHBondContact O-OH 2.97Å; L719-Y750 HydrophobicContact CB-CE1 4.45Å; L719-Y750 HydrophobicContact CB-CE2 4.23Å; L719-Y750 HydrophobicContact CD1-CD1 3.8Å; L719-Y750 HydrophobicContact CD1-CD2 3.9Å; L719-Y750 HydrophobicContact CD1-CE1 3.87Å; L719-Y750 HydrophobicContact CD1-CE2 3.96Å; L719-Y750 HydrophobicContact CD1-CG 3.8Å; L719-Y750 PolarHBondContact N-OH 3.02Å; A722-Y750 HydrophobicContact CB-CD2 3.58Å; A722-Y750 HydrophobicContact CB-CE2 3.82Å; F746-Y750 HydrophobicContact CZ-CD2 4.47Å; F746-Y750 WeakPolarHBondContact O-CB 3.24Å; F746-Y750 PolarHBondContact O-N 2.99Å; S747-Y750 PolarHBondContact O-N 3.26Å; Y750-C753 PolarHBondContact O-N 3.48Å; Y750-N754 WeakPolarHBondContact CD2-ND2 3.45Å; Y750-N754 HydrophobicContact CE1-CB 4.26Å; Y750-N754 WeakPolarHBondContact CE2-ND2 3.45Å; Y750-N754 PolarHBondContact O-N 2.95Å; Y750-N754 PolarHBondContact O-ND2 3.37Å; Y750-V757 HydrophobicContact CE1-CG1 4.39Å; Y750-I767 HydrophobicContact CD1-CG2 3.8Å; Y750-I767 HydrophobicContact CE1-CD1 4.22Å; Y750-I767 HydrophobicContact CE1-CG2 4.34Å
751	C	96.4	Very high	94.6	Very high	27 Å²	27	45 Å²	45	18%	0.182	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-41	177	-69.8	0	0	0	0	112.3	S747 Q748 C753 N754 V758	S747-C751 WeakPolarHBondContact O-CB 3.36Å; S747-C751 PolarHBondContact O-N 3.45Å; S747-C751 PolarHBondContact O-SG 3.27Å; Q748-C751 PolarHBondContact O-N 3.33Å; C751-C753 VanDerWaalsContact C-N 3.34Å; C751-N754 PolarHBondContact O-N 3.24Å; C751-V758 HydrophobicContact CB-CG2 3.69Å
752	I	95.9	Very high	94.5	Very high	119 Å²	119	52.1 Å²	52.1	61%	0.61	25%	0.25	S	C	*	.	H	α-helix	trans	-62.6	-39.9	173.5	-67.5	164.5	0	0	0	111.3	Q748 R749	Q748-I752 WeakPolarHBondContact O-CG1 3.46Å; Q748-I752 PolarHBondContact O-N 3.07Å; Q748-I752 VanDerWaalsContact O-N 3.13Å; R749-I752 PolarHBondContact O-N 3.09Å
753	C	96.9	Very high	94	Very high	15 Å²	15	52.9 Å²	52.9	10%	0.101	25%	0.254	C	S	.	.	H	α-helix	trans	-74.8	-28.7	179.7	-65.6	0	0	0	0	113.8	F714 Q715 R749 Y750 C751 P755	F714-C753 HydrophobicContact CB-CB 3.95Å; Q715-C753 HydrophobicContact CG-CB 4.05Å; R749-C753 PolarHBondContact O-N 3.22Å; R749-C753 PolarHBondContact O-SG 2.91Å; Y750-C753 PolarHBondContact O-N 3.48Å; C751-C753 VanDerWaalsContact C-N 3.34Å; C753-P755 VanDerWaalsContact C-CD 3.45Å
754	N	96.2	Very high	93.6	Very high	5 Å²	5	56.1 Å²	56.1	3%	0.027	28%	0.275	C	S	.	.			trans	-130.2	54.8	-170.3	-59.1	-68.4	0	0	0	113.5	F714 S716 Y750 C751 T756 V757 V758	F714-N754 PolarHBondContact O-ND2 3.48Å; F714-N754 PolarHBondContact O-OD1 2.96Å; S716-N754 PolarHBondContact N-OD1 3.41Å; Y750-N754 WeakPolarHBondContact CD2-ND2 3.45Å; Y750-N754 HydrophobicContact CE1-CB 4.26Å; Y750-N754 WeakPolarHBondContact CE2-ND2 3.45Å; Y750-N754 PolarHBondContact O-N 2.95Å; Y750-N754 PolarHBondContact O-ND2 3.37Å; C751-N754 PolarHBondContact O-N 3.24Å; N754-T756 PolarHBondContact O-N 2.99Å; N754-T756 VanDerWaalsContact O-N 3.08Å; N754-V757 HydrophobicContact CB-CB 4.13Å; N754-V757 HydrophobicContact CB-CG2 4.1Å; N754-V757 WeakPolarHBondContact O-CB 3.47Å; N754-V757 PolarHBondContact O-N 3.17Å; N754-V758 PolarHBondContact O-N 3.45Å
755	P	94.7	Very high	93.2	Very high	65 Å²	65	57.1 Å²	57.1	42%	0.422	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-19.6	-176.2	27.2	-36.4	0	0	0	113.7	C753 R759	C753-P755 VanDerWaalsContact C-CD 3.45Å; P755-R759 WeakPolarHBondContact O-CD 3.46Å; P755-R759 VanDerWaalsContact O-CG 3.24Å; P755-R759 WeakPolarHBondContact O-CG 3.3Å; P755-R759 PolarHBondContact O-N 3.3Å
756	T	91.3	Very high	93	Very high	99 Å²	99	57.1 Å²	57.1	61%	0.607	28%	0.282	S	S	*	.	H	α-helix	trans	-72.6	-26.4	172	46.9	0	0	0	0	113.5	N754 Q760	N754-T756 PolarHBondContact O-N 2.99Å; N754-T756 VanDerWaalsContact O-N 3.08Å; T756-Q760 PolarHBondContact O-NE2 2.86Å
757	V	90.9	Very high	92.8	Very high	32 Å²	32	57.1 Å²	57.1	19%	0.194	28%	0.282	C	S	.	.	H	α-helix	trans	-83.6	-42.9	175	177.5	0	0	0	0	109.9	Y750 N754 R759 Q760 F761	Y750-V757 HydrophobicContact CE1-CG1 4.39Å; N754-V757 HydrophobicContact CB-CB 4.13Å; N754-V757 HydrophobicContact CB-CG2 4.1Å; N754-V757 WeakPolarHBondContact O-CB 3.47Å; N754-V757 PolarHBondContact O-N 3.17Å; V757-R759 VanDerWaalsContact C-N 3.25Å; V757-R759 PolarHBondContact O-N 3.48Å; V757-Q760 WeakPolarHBondContact O-CB 3.16Å; V757-Q760 PolarHBondContact O-N 3.32Å; V757-F761 HydrophobicContact CG1-CE2 4.06Å; V757-F761 WeakPolarHBondContact O-CD2 3.41Å
758	V	90.8	Very high	92.6	Very high	27 Å²	27	59 Å²	59	16%	0.164	29%	0.289	C	S	.	.	H	α-helix	trans	-55.8	-41	177	-177.2	0	0	0	0	111.6	C751 N754 Q760 F761 P764	C751-V758 HydrophobicContact CB-CG2 3.69Å; N754-V758 PolarHBondContact O-N 3.45Å; V758-Q760 PolarHBondContact O-N 2.88Å; V758-F761 PolarHBondContact O-N 3.23Å; V758-F761 VanDerWaalsContact O-N 3.08Å; V758-P764 HydrophobicContact CG1-CB 4.04Å
759	R	91.8	Very high	92.3	Very high	209 Å²	209	54.9 Å²	54.9	79%	0.789	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-4	176.8	-72.5	171.5	-174.8	-179.1	2.6	115.6	P755 V757	P755-R759 WeakPolarHBondContact O-CD 3.46Å; P755-R759 VanDerWaalsContact O-CG 3.24Å; P755-R759 WeakPolarHBondContact O-CG 3.3Å; P755-R759 PolarHBondContact O-N 3.3Å; V757-R759 VanDerWaalsContact C-N 3.25Å; V757-R759 PolarHBondContact O-N 3.48Å
760	Q	90.5	Very high	92.1	Very high	119 Å²	119	52.7 Å²	52.7	56%	0.556	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-16.2	173.9	-58	175.9	21.9	0	0	112.2	T756 V757 V758	T756-Q760 PolarHBondContact O-NE2 2.86Å; V757-Q760 WeakPolarHBondContact O-CB 3.16Å; V757-Q760 PolarHBondContact O-N 3.32Å; V758-Q760 PolarHBondContact O-N 2.88Å
761	F	90.8	Very high	92	Very high	20 Å²	20	52.5 Å²	52.5	9%	0.088	26%	0.261	C	S	.	.	S	Bend	trans	-96.5	153.8	172.5	-58.6	-90.5	0	0	0	109.3	V757 V758 T766 I767 L770 D805 I810	V757-F761 HydrophobicContact CG1-CE2 4.06Å; V757-F761 WeakPolarHBondContact O-CD2 3.41Å; V758-F761 PolarHBondContact O-N 3.23Å; V758-F761 VanDerWaalsContact O-N 3.08Å; F761-T766 HydrophobicContact CD1-CG2 3.5Å; F761-T766 VanDerWaalsContact CD1-CG2 3.5Å; F761-T766 HydrophobicContact CE1-CG2 3.84Å; F761-T766 HydrophobicContact CG-CG2 4.43Å; F761-I767 HydrophobicContact CD2-CD1 3.83Å; F761-I767 HydrophobicContact CE2-CD1 3.49Å; F761-I767 VanDerWaalsContact CE2-CD1 3.49Å; F761-I767 HydrophobicContact CZ-CD1 3.96Å; F761-L770 HydrophobicContact CZ-CD2 4.34Å; F761-D805 VanDerWaalsContact CA-OD2 3.31Å; F761-D805 WeakPolarHBondContact CA-OD2 3.4Å; F761-I810 HydrophobicContact CE1-CD1 4.44Å; F761-I810 HydrophobicContact CE1-CG1 4.2Å; F761-I810 HydrophobicContact CE1-CG2 3.84Å
762	R	90.1	Very high	91.7	Very high	151 Å²	151	51.8 Å²	51.8	57%	0.57	26%	0.255	S	S	*	.	S	Bend	trans	-71.6	-43	167.3	-65	-173.3	170.7	172.6	8.8	110.7	D805 D806 E808	R762-D805 WeakPolarHBondContact CA-OD1 3.39Å; R762-D805 WeakPolarHBondContact CB-OD1 3.43Å; R762-D805 PolarHBondContact N-OD1 2.92Å; R762-D805 PolarHBondContact N-OD2 2.85Å; R762-D806 HydrophobicContact CB-CB 4.27Å; R762-E808 IonicContact CZ-OE1 3.57Å; R762-E808 IonicContact NH1-OE1 2.7Å; R762-E808 PolarHBondContact NH1-OE1 2.86Å; R762-E808 VanDerWaalsContact NH2-CD 3.31Å; R762-E808 IonicContact NH2-OE1 3.1Å; R762-E808 PolarHBondContact NH2-OE1 2.82Å
763	N	84.7	Confident	91.6	Very high	19 Å²	19	46.2 Å²	46.2	10%	0.102	23%	0.227	C	C	.	.			trans	-113.5	126.3	-174.8	-169.2	-28.1	0	0	0	111.5	D765 T766 D805 D806 H1082	N763-D765 PolarHBondContact O-N 3.34Å; N763-D765 WeakPolarHBondContact OD1-CB 3.08Å; N763-D765 PolarHBondContact OD1-N 3.01Å; N763-T766 WeakPolarHBondContact O-CB 3.49Å; N763-T766 PolarHBondContact O-N 2.92Å; N763-T766 PolarHBondContact O-OG1 2.97Å; N763-D805 PolarHBondContact N-OD1 2.99Å; N763-D806 WeakPolarHBondContact CB-OD1 3.47Å; N763-D806 PolarHBondContact ND2-OD1 2.94Å; N763-H1082 PolarHBondContact ND2-NE2 3.22Å
764	P	86.3	Confident	91.5	Very high	68 Å²	68	45.5 Å²	45.5	44%	0.442	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.9	175.1	26.4	-35.5	0	0	0	113.2	V758 T766 I767	V758-P764 HydrophobicContact CG1-CB 4.04Å; P764-T766 PolarHBondContact O-N 3.07Å; P764-I767 WeakPolarHBondContact O-CB 3.42Å; P764-I767 WeakPolarHBondContact O-CG1 3.4Å; P764-I767 PolarHBondContact O-N 2.97Å; P764-I767 VanDerWaalsContact O-N 3.16Å
765	D	87.8	Confident	91.2	Very high	72 Å²	72	45.8 Å²	45.8	39%	0.385	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-12.4	-178.4	-63.6	-49.7	0	0	0	112.8	N763 I767 F768 I769 H1082	N763-D765 PolarHBondContact O-N 3.34Å; N763-D765 WeakPolarHBondContact OD1-CB 3.08Å; N763-D765 PolarHBondContact OD1-N 3.01Å; D765-I767 PolarHBondContact O-N 2.94Å; D765-F768 WeakPolarHBondContact O-CB 3.06Å; D765-F768 PolarHBondContact O-N 3.13Å; D765-I769 PolarHBondContact O-N 3.27Å; D765-I769 VanDerWaalsContact O-N 3.07Å; D765-H1082 IonicContact OD2-CE1 2.63Å; D765-H1082 IonicContact OD2-NE2 2.71Å; D765-H1082 PolarHBondContact OD2-NE2 2.99Å
766	T	90.8	Very high	91	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-27.4	166.2	-61.5	0	0	0	0	112.1	F761 N763 P764 L770 V804 D805 I810	F761-T766 HydrophobicContact CD1-CG2 3.5Å; F761-T766 VanDerWaalsContact CD1-CG2 3.5Å; F761-T766 HydrophobicContact CE1-CG2 3.84Å; F761-T766 HydrophobicContact CG-CG2 4.43Å; N763-T766 WeakPolarHBondContact O-CB 3.49Å; N763-T766 PolarHBondContact O-N 2.92Å; N763-T766 PolarHBondContact O-OG1 2.97Å; P764-T766 PolarHBondContact O-N 3.07Å; T766-L770 WeakPolarHBondContact O-CB 3.44Å; T766-L770 PolarHBondContact O-N 3.39Å; T766-V804 HydrophobicContact CG2-CG1 4.24Å; T766-V804 PolarHBondContact OG1-O 2.97Å; T766-V804 VanDerWaalsContact OG1-O 3.05Å; T766-D805 HydrophobicContact CG2-CB 4.22Å; T766-D805 PolarHBondContact OG1-OD1 2.86Å; T766-I810 HydrophobicContact CG2-CD1 3.65Å; T766-I810 HydrophobicContact CG2-CG1 3.95Å
767	I	95.1	Very high	91.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-41.6	171.4	-61.8	-62.5	0	0	0	111.5	L719 Y750 F761 P764 D765 L770 A771	L719-I767 HydrophobicContact CD1-CG2 3.86Å; L719-I767 HydrophobicContact CD2-CG2 4.28Å; Y750-I767 HydrophobicContact CD1-CG2 3.8Å; Y750-I767 HydrophobicContact CE1-CD1 4.22Å; Y750-I767 HydrophobicContact CE1-CG2 4.34Å; F761-I767 HydrophobicContact CD2-CD1 3.83Å; F761-I767 HydrophobicContact CE2-CD1 3.49Å; F761-I767 VanDerWaalsContact CE2-CD1 3.49Å; F761-I767 HydrophobicContact CZ-CD1 3.96Å; P764-I767 WeakPolarHBondContact O-CB 3.42Å; P764-I767 WeakPolarHBondContact O-CG1 3.4Å; P764-I767 PolarHBondContact O-N 2.97Å; P764-I767 VanDerWaalsContact O-N 3.16Å; D765-I767 PolarHBondContact O-N 2.94Å; I767-L770 PolarHBondContact O-N 3.28Å; I767-A771 WeakPolarHBondContact O-CB 3.46Å; I767-A771 PolarHBondContact O-N 3.43Å
768	F	92.2	Very high	91.1	Very high	43 Å²	43	37 Å²	37	19%	0.189	17%	0.168	C	C	.	.	H	α-helix	trans	-67.8	-44	178.3	169.3	-98.4	0	0	0	111.3	E740 I743 E744 S747 D765 L770 A771 F772	E740-F768 HydrophobicContact CG-CZ 4.26Å; I743-F768 HydrophobicContact CB-CE2 4.46Å; I743-F768 HydrophobicContact CG2-CD2 3.91Å; I743-F768 HydrophobicContact CG2-CE2 4.17Å; E744-F768 HydrophobicContact CB-CE2 4.08Å; S747-F768 WeakPolarHBondContact OG-CA 3.38Å; D765-F768 WeakPolarHBondContact O-CB 3.06Å; D765-F768 PolarHBondContact O-N 3.13Å; F768-L770 PolarHBondContact O-N 3.1Å; F768-A771 PolarHBondContact O-N 2.81Å; F768-F772 HydrophobicContact CE1-CD2 4.29Å; F768-F772 HydrophobicContact CE1-CE2 4.24Å; F768-F772 HydrophobicContact CE2-CD2 4.16Å; F768-F772 AromaticContact CE2-CE2 3.76Å; F768-F772 HydrophobicContact CE2-CE2 3.76Å; F768-F772 HydrophobicContact CZ-CD2 4.05Å; F768-F772 AromaticContact CZ-CE2 3.61Å; F768-F772 HydrophobicContact CZ-CE2 3.61Å; F768-F772 PolarHBondContact O-N 3.18Å; F768-F772 VanDerWaalsContact O-N 3.11Å
769	I	90.1	Very high	91	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-61.1	-45.5	174.5	-59.6	172.4	0	0	0	110.8	D765 F772 A773 V804 T1085 L1086	D765-I769 PolarHBondContact O-N 3.27Å; D765-I769 VanDerWaalsContact O-N 3.07Å; I769-F772 WeakPolarHBondContact O-CB 3.42Å; I769-F772 PolarHBondContact O-N 3.48Å; I769-A773 PolarHBondContact O-N 3.17Å; I769-V804 HydrophobicContact CB-CG1 4.12Å; I769-V804 HydrophobicContact CD1-CG1 4.19Å; I769-V804 HydrophobicContact CG2-CG1 3.55Å; I769-T1085 HydrophobicContact CD1-CG2 4.27Å; I769-L1086 HydrophobicContact CB-CD2 4.33Å; I769-L1086 HydrophobicContact CD1-CG 4.33Å; I769-L1086 HydrophobicContact CG1-CD1 4.2Å; I769-L1086 HydrophobicContact CG1-CD2 4.07Å; I769-L1086 HydrophobicContact CG1-CG 4Å; I769-L1086 HydrophobicContact CG2-CD2 3.8Å; I769-L1086 HydrophobicContact CG2-CG 4.37Å
770	L	94.1	Very high	91	Very high	2 Å²	2	27 Å²	27	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-67	-37.9	-179.9	-173.7	60	0	0	0	112.2	L719 F761 T766 I767 F768 F772 A773 I774 L801 I810 L815 I818	L719-L770 HydrophobicContact CD2-CB 3.94Å; L719-L770 HydrophobicContact CD2-CD2 3.8Å; L719-L770 HydrophobicContact CD2-CG 3.78Å; F761-L770 HydrophobicContact CZ-CD2 4.34Å; T766-L770 WeakPolarHBondContact O-CB 3.44Å; T766-L770 PolarHBondContact O-N 3.39Å; I767-L770 PolarHBondContact O-N 3.28Å; F768-L770 PolarHBondContact O-N 3.1Å; L770-F772 VanDerWaalsContact C-N 3.34Å; L770-F772 PolarHBondContact O-N 3.26Å; L770-A773 PolarHBondContact O-N 3.4Å; L770-I774 HydrophobicContact CG-CD1 4.37Å; L770-I774 WeakPolarHBondContact O-CD1 3.08Å; L770-I774 VanDerWaalsContact O-CG1 3.24Å; L770-I774 WeakPolarHBondContact O-CG1 3.26Å; L770-I774 PolarHBondContact O-N 2.84Å; L770-L801 HydrophobicContact CD1-CD1 3.62Å; L770-I810 HydrophobicContact CD1-CD1 4.29Å; L770-L815 HydrophobicContact CD1-CD2 3.73Å; L770-I818 HydrophobicContact CD1-CD1 4.22Å; L770-I818 HydrophobicContact CD2-CD1 3.85Å; L770-I818 HydrophobicContact CG-CD1 4.19Å
771	A	95.1	Very high	91.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.1	-42.5	172.8	0	0	0	0	0	111.8	L719 I743 F746 I767 F768 I774 I775	L719-A771 HydrophobicContact CD2-CB 4.49Å; I743-A771 HydrophobicContact CG2-CB 3.75Å; F746-A771 HydrophobicContact CD1-CB 4.43Å; F746-A771 HydrophobicContact CE1-CB 4.21Å; I767-A771 WeakPolarHBondContact O-CB 3.46Å; I767-A771 PolarHBondContact O-N 3.43Å; F768-A771 PolarHBondContact O-N 2.81Å; A771-I774 PolarHBondContact O-N 3.14Å; A771-I775 WeakPolarHBondContact O-CG1 3.44Å; A771-I775 PolarHBondContact O-N 2.91Å
772	F	90.8	Very high	91.1	Very high	13 Å²	13	25 Å²	25	6%	0.057	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-45.6	172	-101.4	-76.5	0	0	0	112.7	V739 E740 I743 F768 I769 L770 I774 I775 L776 L1074	V739-F772 HydrophobicContact CG1-CE1 3.74Å; V739-F772 HydrophobicContact CG1-CZ 3.95Å; E740-F772 HydrophobicContact CB-CZ 4.25Å; I743-F772 HydrophobicContact CB-CD2 4.39Å; I743-F772 HydrophobicContact CB-CE2 4.08Å; I743-F772 HydrophobicContact CG2-CD2 3.84Å; I743-F772 HydrophobicContact CG2-CE2 4.01Å; F768-F772 HydrophobicContact CE1-CD2 4.29Å; F768-F772 HydrophobicContact CE1-CE2 4.24Å; F768-F772 HydrophobicContact CE2-CD2 4.16Å; F768-F772 AromaticContact CE2-CE2 3.76Å; F768-F772 HydrophobicContact CE2-CE2 3.76Å; F768-F772 HydrophobicContact CZ-CD2 4.05Å; F768-F772 AromaticContact CZ-CE2 3.61Å; F768-F772 HydrophobicContact CZ-CE2 3.61Å; F768-F772 PolarHBondContact O-N 3.18Å; F768-F772 VanDerWaalsContact O-N 3.11Å; I769-F772 WeakPolarHBondContact O-CB 3.42Å; I769-F772 PolarHBondContact O-N 3.48Å; L770-F772 VanDerWaalsContact C-N 3.34Å; L770-F772 PolarHBondContact O-N 3.26Å; F772-I774 VanDerWaalsContact C-N 3.25Å; F772-I774 PolarHBondContact O-N 2.8Å; F772-I775 PolarHBondContact O-N 3.29Å; F772-I775 VanDerWaalsContact O-N 3.12Å; F772-L776 WeakPolarHBondContact O-CD1 3.42Å; F772-L776 WeakPolarHBondContact O-CG 3.34Å; F772-L776 PolarHBondContact O-N 3.1Å; F772-L776 VanDerWaalsContact O-N 3.07Å; F772-L1074 HydrophobicContact CE1-CD1 4.09Å
773	A	92.3	Very high	90.9	Very high	1 Å²	1	19 Å²	19	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-59.7	-34.9	177.7	0	0	0	0	0	112.7	I769 L770 L776 L777 F797 L801 F1089	I769-A773 PolarHBondContact O-N 3.17Å; L770-A773 PolarHBondContact O-N 3.4Å; A773-L776 PolarHBondContact O-N 3.46Å; A773-L777 WeakPolarHBondContact O-CB 3.31Å; A773-L777 PolarHBondContact O-N 2.85Å; A773-F797 HydrophobicContact CB-CE2 4.11Å; A773-L801 HydrophobicContact CB-CD1 4.28Å; A773-L801 HydrophobicContact CB-CD2 3.82Å; A773-L801 HydrophobicContact CB-CG 4.46Å; A773-F1089 HydrophobicContact CB-CE1 4.46Å; A773-F1089 HydrophobicContact CB-CE2 4.08Å; A773-F1089 HydrophobicContact CB-CZ 3.76Å
774	I	95.4	Very high	90.9	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.9	-41.8	174.3	-68.7	161.3	0	0	0	111.9	L719 D720 L723 L770 A771 F772 L776 L777 N778 I818 I822 L827	L719-I774 HydrophobicContact CB-CD1 4.39Å; L719-I774 HydrophobicContact CD2-CD1 3.95Å; L719-I774 HydrophobicContact CG-CD1 3.98Å; D720-I774 HydrophobicContact CB-CD1 4.03Å; D720-I774 HydrophobicContact CB-CG2 4.02Å; L723-I774 HydrophobicContact CD2-CB 4.01Å; L723-I774 HydrophobicContact CD2-CG2 3.68Å; L770-I774 HydrophobicContact CG-CD1 4.37Å; L770-I774 WeakPolarHBondContact O-CD1 3.08Å; L770-I774 VanDerWaalsContact O-CG1 3.24Å; L770-I774 WeakPolarHBondContact O-CG1 3.26Å; L770-I774 PolarHBondContact O-N 2.84Å; A771-I774 PolarHBondContact O-N 3.14Å; F772-I774 VanDerWaalsContact C-N 3.25Å; F772-I774 PolarHBondContact O-N 2.8Å; I774-L776 VanDerWaalsContact C-N 3.35Å; I774-L777 PolarHBondContact O-N 3.17Å; I774-N778 WeakPolarHBondContact O-CB 3.1Å; I774-N778 PolarHBondContact O-N 2.84Å; I774-I818 HydrophobicContact CD1-CD1 4.26Å; I774-I818 HydrophobicContact CD1-CG2 4.02Å; I774-I818 HydrophobicContact CG1-CG2 3.57Å; I774-I822 HydrophobicContact CG2-CD1 3.7Å; I774-I822 HydrophobicContact CG2-CG1 4.12Å; I774-L827 HydrophobicContact CG2-CD1 3.95Å
775	I	90.8	Very high	90.7	Very high	11 Å²	11	26.7 Å²	26.7	6%	0.056	14%	0.144	C	C	.	.	H	α-helix	trans	-66	-40.3	178.4	-62.3	164.4	0	0	0	110.8	L723 V732 I743 A771 F772 N778 T779	L723-I775 HydrophobicContact CD2-CG1 3.99Å; V732-I775 HydrophobicContact CG1-CD1 4.37Å; I743-I775 HydrophobicContact CD1-CD1 3.61Å; I743-I775 HydrophobicContact CG1-CD1 3.62Å; A771-I775 WeakPolarHBondContact O-CG1 3.44Å; A771-I775 PolarHBondContact O-N 2.91Å; F772-I775 PolarHBondContact O-N 3.29Å; F772-I775 VanDerWaalsContact O-N 3.12Å; I775-N778 PolarHBondContact O-N 3.04Å; I775-T779 WeakPolarHBondContact O-CB 3.21Å; I775-T779 PolarHBondContact O-N 3.24Å; I775-T779 PolarHBondContact O-OG1 3.38Å
776	L	89.1	Confident	90.5	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-67	-45.3	177.5	-67.1	160.2	0	0	0	111.1	F772 A773 I774 N778 T779 D780 W1067 F1089 F1090	F772-L776 WeakPolarHBondContact O-CD1 3.42Å; F772-L776 WeakPolarHBondContact O-CG 3.34Å; F772-L776 PolarHBondContact O-N 3.1Å; F772-L776 VanDerWaalsContact O-N 3.07Å; A773-L776 PolarHBondContact O-N 3.46Å; I774-L776 VanDerWaalsContact C-N 3.35Å; L776-N778 PolarHBondContact O-N 3.33Å; L776-T779 WeakPolarHBondContact O-CB 3.26Å; L776-T779 PolarHBondContact O-N 2.92Å; L776-D780 PolarHBondContact O-N 3.19Å; L776-W1067 HydrophobicContact CD2-CE3 3.77Å; L776-W1067 HydrophobicContact CD2-CZ3 3.71Å; L776-F1089 HydrophobicContact CD1-CE1 3.78Å; L776-F1090 HydrophobicContact CD1-CD1 4.34Å; L776-F1090 HydrophobicContact CD1-CE1 3.4Å; L776-F1090 VanDerWaalsContact CD1-CE1 3.4Å; L776-F1090 HydrophobicContact CD1-CZ 3.93Å; L776-F1090 HydrophobicContact CD2-CE1 4.21Å; L776-F1090 HydrophobicContact CG-CE1 4.46Å
777	L	93.1	Very high	90.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.5	-47.2	172.3	174.9	67.4	0	0	0	111.9	A773 I774 T779 D780 M781 M792 F797 Y819 I822	A773-L777 WeakPolarHBondContact O-CB 3.31Å; A773-L777 PolarHBondContact O-N 2.85Å; I774-L777 PolarHBondContact O-N 3.17Å; L777-T779 VanDerWaalsContact C-N 3.33Å; L777-T779 PolarHBondContact O-N 2.63Å; L777-D780 PolarHBondContact O-N 3.1Å; L777-M781 HydrophobicContact CD1-CE 3.62Å; L777-M781 HydrophobicContact CD2-CE 4.48Å; L777-M781 HydrophobicContact CG-CE 4.03Å; L777-M781 WeakPolarHBondContact O-CB 3.26Å; L777-M781 PolarHBondContact O-N 3.4Å; L777-M792 HydrophobicContact CB-CE 3.9Å; L777-M792 HydrophobicContact CD1-CE 3.69Å; L777-M792 HydrophobicContact CG-CE 4.41Å; L777-F797 HydrophobicContact CB-CD2 4.23Å; L777-F797 HydrophobicContact CB-CE2 4.08Å; L777-F797 HydrophobicContact CD1-CD2 4.28Å; L777-F797 HydrophobicContact CD1-CG 4.5Å; L777-F797 HydrophobicContact CD2-CD1 4.44Å; L777-F797 HydrophobicContact CD2-CD2 4.11Å; L777-F797 HydrophobicContact CD2-CE1 4.31Å; L777-F797 HydrophobicContact CD2-CE2 3.96Å; L777-F797 HydrophobicContact CD2-CG 4.35Å; L777-F797 HydrophobicContact CD2-CZ 4.07Å; L777-F797 HydrophobicContact CG-CD2 4.44Å; L777-F797 HydrophobicContact CG-CE2 4.5Å; L777-Y819 HydrophobicContact CD1-CD2 3.61Å; L777-Y819 HydrophobicContact CD1-CE2 3.62Å; L777-Y819 HydrophobicContact CD2-CD2 3.8Å; L777-Y819 HydrophobicContact CD2-CG 4.4Å; L777-Y819 HydrophobicContact CG-CD2 4.37Å; L777-I822 HydrophobicContact CD2-CB 4.11Å; L777-I822 HydrophobicContact CD2-CG1 4.29Å; L777-I822 HydrophobicContact CD2-CG2 4.06Å; L777-I822 HydrophobicContact CG-CG2 4.08Å
778	N	92.6	Very high	90	Very high	8 Å²	8	35 Å²	35	4%	0.043	19%	0.192	C	C	.	.	H	α-helix	trans	-62.3	-41.3	178	177.8	79.3	0	0	0	111.9	I774 I775 L776 Y782 I822 L827	I774-N778 WeakPolarHBondContact O-CB 3.1Å; I774-N778 PolarHBondContact O-N 2.84Å; I775-N778 PolarHBondContact O-N 3.04Å; L776-N778 PolarHBondContact O-N 3.33Å; N778-Y782 WeakPolarHBondContact O-CB 3.49Å; N778-Y782 WeakPolarHBondContact O-CD2 3.48Å; N778-Y782 PolarHBondContact O-N 3.02Å; N778-Y782 WeakPolarHBondContact OD1-CD2 3.49Å; N778-I822 HydrophobicContact CB-CG2 4.25Å; N778-L827 HydrophobicContact CB-CB 4.47Å; N778-L827 HydrophobicContact CB-CD1 3.82Å; N778-L827 HydrophobicContact CB-CG 4.19Å; N778-L827 PolarHBondContact OD1-N 3.13Å
779	T	88.9	Confident	89.7	Confident	16 Å²	16	40 Å²	40	10%	0.098	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-53.6	175.1	-69.2	0	0	0	0	111.5	I775 L776 L777 M781 S783 W1067	I775-T779 WeakPolarHBondContact O-CB 3.21Å; I775-T779 PolarHBondContact O-N 3.24Å; I775-T779 PolarHBondContact O-OG1 3.38Å; L776-T779 WeakPolarHBondContact O-CB 3.26Å; L776-T779 PolarHBondContact O-N 2.92Å; L777-T779 VanDerWaalsContact C-N 3.33Å; L777-T779 PolarHBondContact O-N 2.63Å; T779-M781 VanDerWaalsContact C-N 3.33Å; T779-M781 PolarHBondContact O-N 2.88Å; T779-S783 WeakPolarHBondContact O-CA 3.46Å; T779-S783 WeakPolarHBondContact O-CB 3.49Å; T779-S783 PolarHBondContact O-N 3.1Å; T779-W1067 HydrophobicContact CG2-CD2 3.88Å; T779-W1067 HydrophobicContact CG2-CE3 4.31Å; T779-W1067 HydrophobicContact CG2-CH2 3.77Å; T779-W1067 HydrophobicContact CG2-CZ2 3.26Å; T779-W1067 HydrophobicContact CG2-CZ3 4.26Å; T779-W1067 WeakPolarHBondContact OG1-CH2 3.11Å
780	D	90.1	Very high	89.6	Confident	8 Å²	8	44 Å²	44	4%	0.043	23%	0.23	C	C	.	.	H	α-helix	trans	-55.9	-50.4	178.5	176.7	78	0	0	0	111.1	L776 L777 Y782 V786 K791 M792	L776-D780 PolarHBondContact O-N 3.19Å; L777-D780 PolarHBondContact O-N 3.1Å; D780-Y782 PolarHBondContact O-N 3.25Å; D780-V786 WeakPolarHBondContact OD1-CG1 3.48Å; D780-K791 WeakPolarHBondContact O-CD 3.43Å; D780-K791 WeakPolarHBondContact O-CE 3.5Å; D780-K791 PolarHBondContact O-NZ 2.95Å; D780-K791 VanDerWaalsContact O-NZ 3.15Å; D780-K791 WeakPolarHBondContact OD2-CA 3.47Å; D780-K791 WeakPolarHBondContact OD2-CB 3.5Å; D780-M792 PolarHBondContact OD2-N 3.35Å
781	M	92.8	Very high	89.4	Confident	26 Å²	26	46.1 Å²	46.1	13%	0.128	24%	0.239	C	C	.	.	H	α-helix	trans	-67.5	-35.1	-172.1	-160.7	178.6	-57.8	0	0	112.9	L777 T779 K791 Y819 I822 R823	L777-M781 HydrophobicContact CD1-CE 3.62Å; L777-M781 HydrophobicContact CD2-CE 4.48Å; L777-M781 HydrophobicContact CG-CE 4.03Å; L777-M781 WeakPolarHBondContact O-CB 3.26Å; L777-M781 PolarHBondContact O-N 3.4Å; T779-M781 VanDerWaalsContact C-N 3.33Å; T779-M781 PolarHBondContact O-N 2.88Å; M781-K791 PolarHBondContact O-NZ 3.41Å; M781-Y819 HydrophobicContact CE-CD2 4.28Å; M781-Y819 HydrophobicContact CE-CE1 4.47Å; M781-Y819 HydrophobicContact CE-CE2 3.78Å; M781-I822 HydrophobicContact CE-CG2 4.25Å; M781-I822 HydrophobicContact SD-CG2 4.46Å; M781-R823 HydrophobicContact CE-CB 4.08Å; M781-R823 HydrophobicContact CE-CG 4.44Å; M781-R823 WeakPolarHBondContact SD-CA 3.5Å; M781-R823 HydrophobicContact SD-CB 3.63Å; M781-R823 HydrophobicContact SD-CG 3.7Å
782	Y	91.6	Very high	89.1	Confident	72 Å²	72	46.7 Å²	46.7	28%	0.282	24%	0.242	S	C	.	.	H	α-helix	trans	-109.8	-10.8	-174.8	-66.5	-74.1	0	0	0	115.7	N778 D780 I822 R823 E826	N778-Y782 WeakPolarHBondContact O-CB 3.49Å; N778-Y782 WeakPolarHBondContact O-CD2 3.48Å; N778-Y782 PolarHBondContact O-N 3.02Å; N778-Y782 WeakPolarHBondContact OD1-CD2 3.49Å; D780-Y782 PolarHBondContact O-N 3.25Å; Y782-I822 HydrophobicContact CE2-CG2 4.36Å; Y782-I822 WeakPolarHBondContact CE2-O 3.46Å; Y782-I822 PolarHBondContact OH-O 3.09Å; Y782-R823 PolarHBondContact OH-O 3.36Å; Y782-E826 HydrophobicContact CD1-CB 3.84Å; Y782-E826 HydrophobicContact CD1-CG 3.86Å; Y782-E826 WeakPolarHBondContact CD1-OE2 3.45Å; Y782-E826 HydrophobicContact CD2-CB 3.72Å; Y782-E826 HydrophobicContact CD2-CG 3.57Å; Y782-E826 HydrophobicContact CE1-CB 3.82Å; Y782-E826 HydrophobicContact CE1-CG 4.36Å; Y782-E826 VanDerWaalsContact CE2-CA 3.45Å; Y782-E826 HydrophobicContact CE2-CB 3.68Å; Y782-E826 HydrophobicContact CE2-CG 4.09Å; Y782-E826 HydrophobicContact CG-CB 3.79Å; Y782-E826 HydrophobicContact CG-CG 3.43Å; Y782-E826 VanDerWaalsContact CG-CG 3.43Å; Y782-E826 PolarHBondContact OH-N 2.84Å
783	S	86.7	Confident	89.3	Confident	24 Å²	24	52.5 Å²	52.5	17%	0.168	27%	0.267	C	S	.	.			trans	-60.9	133.2	173.3	176.5	0	0	0	0	111.5	T779 N785 K791	T779-S783 WeakPolarHBondContact O-CA 3.46Å; T779-S783 WeakPolarHBondContact O-CB 3.49Å; T779-S783 PolarHBondContact O-N 3.1Å; S783-N785 PolarHBondContact O-N 2.7Å; S783-N785 PolarHBondContact OG-N 2.86Å; S783-K791 PolarHBondContact O-NZ 2.93Å
784	P	83.4	Confident	89.5	Confident	124 Å²	124	54 Å²	54	81%	0.805	28%	0.275	S	S	*	.	S	Bend	trans	-75	-16.1	173.1	32.6	-35.9	0	0	0	112.4
785	N	82	Confident	89.5	Confident	125 Å²	125	58.8 Å²	58.8	67%	0.668	30%	0.297	S	S	*	.	S	Bend	trans	-81.8	-19.3	-178.5	-63	-16.7	0	0	0	111.9	S783	S783-N785 PolarHBondContact O-N 2.7Å; S783-N785 PolarHBondContact OG-N 2.86Å
786	V	84.1	Confident	89.5	Confident	39 Å²	39	59.8 Å²	59.8	24%	0.236	30%	0.303	C	S	.	.	S	Bend	trans	-90.4	124.9	175.1	-176	0	0	0	0	109.9	D780 R790 K791	D780-V786 WeakPolarHBondContact OD1-CG1 3.48Å; V786-R790 HydrophobicContact CG1-CB 4.44Å; V786-K791 HydrophobicContact CB-CG 4.4Å; V786-K791 HydrophobicContact CG1-CD 4.48Å; V786-K791 HydrophobicContact CG1-CG 3.62Å; V786-K791 WeakPolarHBondContact O-CE 3.15Å
787	K	85.2	Confident	89.7	Confident	96 Å²	96	59.6 Å²	59.6	42%	0.417	30%	0.302	S	S	.	.			trans	-69.4	139.9	177.3	-64.8	-179.7	-177.5	174.8	0	110.8	E789 R790 K791	K787-E789 PolarHBondContact O-N 3.12Å; K787-E789 VanDerWaalsContact O-N 3.1Å; K787-R790 PolarHBondContact O-N 2.87Å; K787-K791 PolarHBondContact O-N 3.3Å
788	P	89.3	Confident	89.7	Confident	115 Å²	115	60.4 Å²	60.4	75%	0.747	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-52.2	-35.7	178.4	-28.9	35.8	0	0	0	115	R790 K791	P788-R790 PolarHBondContact O-N 2.9Å; P788-K791 PolarHBondContact O-N 2.67Å
789	E	87.3	Confident	89.5	Confident	148 Å²	148	65.7 Å²	65.7	69%	0.692	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-60.9	-24.1	175.5	-66.2	164.6	-150.7	0	0	114.6	N280 K787	N280-E789 PolarHBondContact ND2-OE2 3.33Å; K787-E789 PolarHBondContact O-N 3.12Å; K787-E789 VanDerWaalsContact O-N 3.1Å
790	R	87.8	Confident	89.4	Confident	92 Å²	92	65.4 Å²	65.4	35%	0.347	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-105.8	-2.3	-174.7	-69.7	-177.8	167	-135.6	-6.2	113.3	N280 V786 K787 P788 A1097 S1098	N280-R790 PolarHBondContact OD1-NH2 3.07Å; V786-R790 HydrophobicContact CG1-CB 4.44Å; K787-R790 PolarHBondContact O-N 2.87Å; P788-R790 PolarHBondContact O-N 2.9Å; R790-A1097 PolarHBondContact NH1-O 2.71Å; R790-S1098 VanDerWaalsContact CZ-O 3.22Å; R790-S1098 VanDerWaalsContact NH1-C 3.27Å; R790-S1098 PolarHBondContact NH1-O 3.33Å; R790-S1098 PolarHBondContact NH2-O 3.25Å
791	K	89.4	Confident	89.4	Confident	46 Å²	46	65 Å²	65	20%	0.2	32%	0.324	C	S	.	.	S	Bend	trans	-71.1	137.6	-179.1	-69.3	-173.3	174.5	-156.3	0	110.6	D780 M781 S783 V786 K787 P788 K793	D780-K791 WeakPolarHBondContact O-CD 3.43Å; D780-K791 WeakPolarHBondContact O-CE 3.5Å; D780-K791 PolarHBondContact O-NZ 2.95Å; D780-K791 VanDerWaalsContact O-NZ 3.15Å; D780-K791 WeakPolarHBondContact OD2-CA 3.47Å; D780-K791 WeakPolarHBondContact OD2-CB 3.5Å; M781-K791 PolarHBondContact O-NZ 3.41Å; S783-K791 PolarHBondContact O-NZ 2.93Å; V786-K791 HydrophobicContact CB-CG 4.4Å; V786-K791 HydrophobicContact CG1-CD 4.48Å; V786-K791 HydrophobicContact CG1-CG 3.62Å; V786-K791 WeakPolarHBondContact O-CE 3.15Å; K787-K791 PolarHBondContact O-N 3.3Å; P788-K791 PolarHBondContact O-N 2.67Å; K791-K793 PolarHBondContact O-N 3.2Å
792	M	88.2	Confident	89.2	Confident	12 Å²	12	71 Å²	71	6%	0.059	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-60.9	119.1	-177.6	-176.4	161.4	56	0	0	109.6	L777 D780 D796 F797 N800 Y819 Y1093	L777-M792 HydrophobicContact CB-CE 3.9Å; L777-M792 HydrophobicContact CD1-CE 3.69Å; L777-M792 HydrophobicContact CG-CE 4.41Å; D780-M792 PolarHBondContact OD2-N 3.35Å; M792-D796 HydrophobicContact CG-CB 3.8Å; M792-F797 HydrophobicContact CE-CD2 3.9Å; M792-F797 HydrophobicContact CG-CB 4.1Å; M792-F797 HydrophobicContact SD-CB 4.19Å; M792-F797 HydrophobicContact SD-CD2 4.34Å; M792-N800 PolarHBondContact SD-ND2 2.93Å; M792-Y819 WeakPolarHBondContact O-CE2 3.31Å; M792-Y819 PolarHBondContact O-OH 3.49Å; M792-Y1093 HydrophobicContact CE-CD2 4.44Å; M792-Y1093 HydrophobicContact CE-CE2 4.12Å; M792-Y1093 HydrophobicContact SD-CD2 4.16Å; M792-Y1093 HydrophobicContact SD-CE2 4.28Å
793	K	94.7	Very high	89	Confident	134 Å²	134	68.6 Å²	68.6	58%	0.583	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-81	172.5	176.8	-56.6	165.4	-171.4	162.5	0	110.4	K791 E795 D796 F797 Y819	K791-K793 PolarHBondContact O-N 3.2Å; K793-E795 PolarHBondContact O-N 3.33Å; K793-D796 WeakPolarHBondContact CB-OD2 3.49Å; K793-D796 WeakPolarHBondContact CG-OD2 3.36Å; K793-D796 PolarHBondContact N-OD2 2.91Å; K793-D796 WeakPolarHBondContact O-CB 3.44Å; K793-D796 PolarHBondContact O-N 3.5Å; K793-D796 VanDerWaalsContact O-N 3.1Å; K793-F797 PolarHBondContact O-N 3.45Å; K793-Y819 VanDerWaalsContact C-CE2 3.47Å; K793-Y819 WeakPolarHBondContact CA-OH 3.37Å
794	L	96.5	Very high	89	Confident	34 Å²	34	67.7 Å²	67.7	18%	0.178	34%	0.336	C	S	.	.	H	α-helix	trans	-52.4	-52.1	175.7	175.4	59.3	0	0	0	112.3	D796 F797 I798 V816 Y819	L794-D796 VanDerWaalsContact C-N 3.3Å; L794-D796 PolarHBondContact O-N 3Å; L794-F797 PolarHBondContact O-N 3.5Å; L794-I798 HydrophobicContact CD1-CD1 3.81Å; L794-I798 HydrophobicContact CD1-CG1 4.34Å; L794-I798 HydrophobicContact CG-CD1 3.92Å; L794-I798 WeakPolarHBondContact O-CG1 3.47Å; L794-I798 PolarHBondContact O-N 3.13Å; L794-V816 HydrophobicContact CD1-CB 4.31Å; L794-V816 HydrophobicContact CD1-CG2 3.97Å; L794-V816 HydrophobicContact CD2-CG1 4.43Å; L794-V816 HydrophobicContact CD2-CG2 4.29Å; L794-Y819 HydrophobicContact CB-CD1 3.9Å; L794-Y819 HydrophobicContact CB-CE1 3.82Å; L794-Y819 HydrophobicContact CB-CG 4.32Å; L794-Y819 HydrophobicContact CD1-CD1 3.72Å; L794-Y819 HydrophobicContact CD1-CD2 4.42Å; L794-Y819 HydrophobicContact CD1-CG 3.69Å; L794-Y819 HydrophobicContact CG-CD1 4.35Å; L794-Y819 VanDerWaalsContact N-CZ 3.28Å; L794-Y819 PolarHBondContact N-OH 2.82Å
795	E	95.7	Very high	89.3	Confident	99 Å²	99	62.2 Å²	62.2	46%	0.463	30%	0.3	S	S	.	.	H	α-helix	trans	-69.3	-27.1	179.8	-50.5	-50.6	136.8	0	0	112.8	K793 K799 R812	K793-E795 PolarHBondContact O-N 3.33Å; E795-K799 WeakPolarHBondContact O-CB 3.21Å; E795-K799 PolarHBondContact O-N 2.88Å; E795-R812 IonicContact OE1-NH2 3.63Å; E795-R812 PolarHBondContact OE1-NH2 3.09Å; E795-R812 IonicContact OE2-CZ 2.7Å; E795-R812 IonicContact OE2-NH2 3.7Å; E795-R812 PolarHBondContact OE2-NH2 2.84Å
796	D	91.8	Very high	89.6	Confident	33 Å²	33	61 Å²	61	18%	0.176	29%	0.293	C	S	.	.	H	α-helix	trans	-71.4	-41.7	175.2	-56.3	-42.4	0	0	0	110.2	M792 K793 L794 K799 N800 F1096	M792-D796 HydrophobicContact CG-CB 3.8Å; K793-D796 WeakPolarHBondContact CB-OD2 3.49Å; K793-D796 WeakPolarHBondContact CG-OD2 3.36Å; K793-D796 PolarHBondContact N-OD2 2.91Å; K793-D796 WeakPolarHBondContact O-CB 3.44Å; K793-D796 PolarHBondContact O-N 3.5Å; K793-D796 VanDerWaalsContact O-N 3.1Å; L794-D796 VanDerWaalsContact C-N 3.3Å; L794-D796 PolarHBondContact O-N 3Å; D796-K799 PolarHBondContact O-N 2.95Å; D796-N800 WeakPolarHBondContact O-CB 3.29Å; D796-N800 PolarHBondContact O-N 3.42Å; D796-N800 PolarHBondContact O-ND2 2.98Å; D796-F1096 HydrophobicContact CB-CE1 4.38Å; D796-F1096 WeakPolarHBondContact OD1-CE1 3.45Å
797	F	92.6	Very high	89.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-46.8	174.1	178	-112.8	0	0	0	111.9	A773 L777 M792 K793 L794 N800 L801 L815 I818 Y819	A773-F797 HydrophobicContact CB-CE2 4.11Å; L777-F797 HydrophobicContact CB-CD2 4.23Å; L777-F797 HydrophobicContact CB-CE2 4.08Å; L777-F797 HydrophobicContact CD1-CD2 4.28Å; L777-F797 HydrophobicContact CD1-CG 4.5Å; L777-F797 HydrophobicContact CD2-CD1 4.44Å; L777-F797 HydrophobicContact CD2-CD2 4.11Å; L777-F797 HydrophobicContact CD2-CE1 4.31Å; L777-F797 HydrophobicContact CD2-CE2 3.96Å; L777-F797 HydrophobicContact CD2-CG 4.35Å; L777-F797 HydrophobicContact CD2-CZ 4.07Å; L777-F797 HydrophobicContact CG-CD2 4.44Å; L777-F797 HydrophobicContact CG-CE2 4.5Å; M792-F797 HydrophobicContact CE-CD2 3.9Å; M792-F797 HydrophobicContact CG-CB 4.1Å; M792-F797 HydrophobicContact SD-CB 4.19Å; M792-F797 HydrophobicContact SD-CD2 4.34Å; K793-F797 PolarHBondContact O-N 3.45Å; L794-F797 PolarHBondContact O-N 3.5Å; F797-N800 PolarHBondContact O-N 2.77Å; F797-L801 HydrophobicContact CD1-CD1 4.45Å; F797-L801 HydrophobicContact CD2-CD1 4.29Å; F797-L801 HydrophobicContact CE1-CD1 3.94Å; F797-L801 HydrophobicContact CE2-CD1 3.76Å; F797-L801 HydrophobicContact CZ-CD1 3.57Å; F797-L801 PolarHBondContact O-N 2.99Å; F797-L815 HydrophobicContact CE1-CB 4.28Å; F797-L815 HydrophobicContact CE1-CD2 4.36Å; F797-I818 HydrophobicContact CE1-CG2 4.08Å; F797-I818 HydrophobicContact CZ-CG2 4Å; F797-Y819 HydrophobicContact CB-CD2 3.94Å; F797-Y819 HydrophobicContact CB-CE2 4.41Å; F797-Y819 HydrophobicContact CD1-CD2 4.12Å; F797-Y819 HydrophobicContact CG-CD2 4.15Å
798	I	92.8	Very high	89.9	Confident	17 Å²	17	61.6 Å²	61.6	9%	0.087	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-45.2	174.7	-66.1	163.4	0	0	0	110.7	L794 N800 L801 R812 L815 V816	L794-I798 HydrophobicContact CD1-CD1 3.81Å; L794-I798 HydrophobicContact CD1-CG1 4.34Å; L794-I798 HydrophobicContact CG-CD1 3.92Å; L794-I798 WeakPolarHBondContact O-CG1 3.47Å; L794-I798 PolarHBondContact O-N 3.13Å; I798-N800 VanDerWaalsContact C-N 3.35Å; I798-N800 PolarHBondContact O-N 3.25Å; I798-L801 PolarHBondContact O-N 2.87Å; I798-R812 HydrophobicContact CD1-CG 4.09Å; I798-L815 HydrophobicContact CB-CD1 4.44Å; I798-L815 HydrophobicContact CG1-CB 3.98Å; I798-L815 HydrophobicContact CG1-CD1 4.25Å; I798-L815 HydrophobicContact CG2-CD1 4.36Å; I798-V816 HydrophobicContact CD1-CG2 3.99Å
799	K	88.6	Confident	90	Very high	119 Å²	119	59.6 Å²	59.6	52%	0.517	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-40.7	179.8	-177.3	-172.3	173.3	-169.6	0	112.3	E795 D796 L801 R802	E795-K799 WeakPolarHBondContact O-CB 3.21Å; E795-K799 PolarHBondContact O-N 2.88Å; D796-K799 PolarHBondContact O-N 2.95Å; K799-L801 VanDerWaalsContact C-N 3.26Å; K799-L801 PolarHBondContact O-N 3.28Å; K799-R802 WeakPolarHBondContact O-CB 3.31Å; K799-R802 WeakPolarHBondContact O-CG 3.46Å; K799-R802 PolarHBondContact O-N 2.73Å
800	N	87.6	Confident	90.3	Very high	10 Å²	10	52.9 Å²	52.9	5%	0.053	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-31.4	179.7	-69.4	-20.9	0	0	0	111.7	M792 D796 F797 I798 R802 F1089	M792-N800 PolarHBondContact SD-ND2 2.93Å; D796-N800 WeakPolarHBondContact O-CB 3.29Å; D796-N800 PolarHBondContact O-N 3.42Å; D796-N800 PolarHBondContact O-ND2 2.98Å; F797-N800 PolarHBondContact O-N 2.77Å; I798-N800 VanDerWaalsContact C-N 3.35Å; I798-N800 PolarHBondContact O-N 3.25Å; N800-R802 VanDerWaalsContact C-N 3.32Å; N800-R802 PolarHBondContact O-N 3.34Å; N800-F1089 HydrophobicContact CB-CD2 3.94Å; N800-F1089 HydrophobicContact CB-CE2 3.62Å; N800-F1089 HydrophobicContact CB-CZ 4.37Å; N800-F1089 VanDerWaalsContact O-CD2 3.25Å; N800-F1089 WeakPolarHBondContact O-CD2 3.47Å
801	L	90	Very high	90.6	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	18.2	178.8	-70.9	173.4	0	0	0	115	L770 A773 F797 I798 K799 V804 L815 F1089	L770-L801 HydrophobicContact CD1-CD1 3.62Å; A773-L801 HydrophobicContact CB-CD1 4.28Å; A773-L801 HydrophobicContact CB-CD2 3.82Å; A773-L801 HydrophobicContact CB-CG 4.46Å; F797-L801 HydrophobicContact CD1-CD1 4.45Å; F797-L801 HydrophobicContact CD2-CD1 4.29Å; F797-L801 HydrophobicContact CE1-CD1 3.94Å; F797-L801 HydrophobicContact CE2-CD1 3.76Å; F797-L801 HydrophobicContact CZ-CD1 3.57Å; F797-L801 PolarHBondContact O-N 2.99Å; I798-L801 PolarHBondContact O-N 2.87Å; K799-L801 VanDerWaalsContact C-N 3.26Å; K799-L801 PolarHBondContact O-N 3.28Å; L801-V804 HydrophobicContact CB-CG2 4.47Å; L801-V804 HydrophobicContact CD2-CG1 4.46Å; L801-V804 HydrophobicContact CD2-CG2 4.19Å; L801-V804 WeakPolarHBondContact O-CG2 3.42Å; L801-L815 HydrophobicContact CB-CD1 3.95Å; L801-L815 HydrophobicContact CD1-CD1 4.07Å; L801-L815 HydrophobicContact CD1-CD2 3.56Å; L801-L815 HydrophobicContact CD1-CG 4.43Å; L801-F1089 HydrophobicContact CD2-CD2 3.79Å; L801-F1089 HydrophobicContact CD2-CE2 3.55Å; L801-F1089 HydrophobicContact CG-CD2 4.34Å; L801-F1089 HydrophobicContact CG-CE2 3.82Å
802	R	88.8	Confident	90.9	Very high	151 Å²	151	53.9 Å²	53.9	57%	0.57	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	140.7	175.2	-74.4	-177.9	160.2	-81.6	-6.8	112	K799 N800 V804 D809	K799-R802 WeakPolarHBondContact O-CB 3.31Å; K799-R802 WeakPolarHBondContact O-CG 3.46Å; K799-R802 PolarHBondContact O-N 2.73Å; N800-R802 VanDerWaalsContact C-N 3.32Å; N800-R802 PolarHBondContact O-N 3.34Å; R802-V804 PolarHBondContact O-N 3.15Å; R802-D809 WeakPolarHBondContact CA-OD1 3.46Å; R802-D809 VanDerWaalsContact CB-OD1 3.24Å; R802-D809 WeakPolarHBondContact CB-OD1 3.49Å; R802-D809 VanDerWaalsContact CG-OD1 3.32Å; R802-D809 WeakPolarHBondContact CG-OD1 3.3Å; R802-D809 IonicContact CZ-OD2 3.72Å; R802-D809 VanDerWaalsContact CZ-OD2 3.27Å; R802-D809 IonicContact NH1-OD1 3.87Å; R802-D809 IonicContact NH1-OD2 2.75Å; R802-D809 PolarHBondContact NH1-OD2 3.22Å; R802-D809 IonicContact NH2-OD2 3.82Å
803	G	85.8	Confident	91.3	Very high	21 Å²	21	60 Å²	60	22%	0.216	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	69	12.8	179.5	0	0	0	0	0	116	G807 E808 D809	G803-G807 WeakPolarHBondContact CA-O 3.45Å; G803-G807 WeakPolarHBondContact O-CA 3.25Å; G803-G807 PolarHBondContact O-N 3.35Å; G803-E808 CarbonylContact C-O 3.58Å; G803-E808 WeakPolarHBondContact CA-O 3.37Å; G803-E808 PolarHBondContact N-O 3.02Å; G803-D809 PolarHBondContact N-OD1 2.9Å; G803-D809 VanDerWaalsContact N-OD1 3.08Å
804	V	88.1	Confident	91.3	Very high	5 Å²	5	55.4 Å²	55.4	3%	0.03	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-14	-171.2	176.1	0	0	0	0	114.1	T766 I769 L801 R802 E808 I810 T1085	T766-V804 HydrophobicContact CG2-CG1 4.24Å; T766-V804 PolarHBondContact OG1-O 2.97Å; T766-V804 VanDerWaalsContact OG1-O 3.05Å; I769-V804 HydrophobicContact CB-CG1 4.12Å; I769-V804 HydrophobicContact CD1-CG1 4.19Å; I769-V804 HydrophobicContact CG2-CG1 3.55Å; L801-V804 HydrophobicContact CB-CG2 4.47Å; L801-V804 HydrophobicContact CD2-CG1 4.46Å; L801-V804 HydrophobicContact CD2-CG2 4.19Å; L801-V804 WeakPolarHBondContact O-CG2 3.42Å; R802-V804 PolarHBondContact O-N 3.15Å; V804-E808 PolarHBondContact N-O 3.38Å; V804-I810 HydrophobicContact CB-CD1 4.22Å; V804-I810 HydrophobicContact CG1-CD1 4.12Å; V804-T1085 HydrophobicContact CB-CG2 4.01Å; V804-T1085 HydrophobicContact CG1-CG2 4Å; V804-T1085 HydrophobicContact CG2-CG2 3.77Å
805	D	89.8	Confident	91.3	Very high	9 Å²	9	53.9 Å²	53.9	5%	0.048	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-105.8	80.5	176.6	-170	28.7	0	0	0	110.3	F761 R762 N763 T766 G807 E808 I810	F761-D805 VanDerWaalsContact CA-OD2 3.31Å; F761-D805 WeakPolarHBondContact CA-OD2 3.4Å; R762-D805 WeakPolarHBondContact CA-OD1 3.39Å; R762-D805 WeakPolarHBondContact CB-OD1 3.43Å; R762-D805 PolarHBondContact N-OD1 2.92Å; R762-D805 PolarHBondContact N-OD2 2.85Å; N763-D805 PolarHBondContact N-OD1 2.99Å; T766-D805 HydrophobicContact CG2-CB 4.22Å; T766-D805 PolarHBondContact OG1-OD1 2.86Å; D805-G807 VanDerWaalsContact C-N 3.28Å; D805-G807 PolarHBondContact O-N 2.82Å; D805-E808 PolarHBondContact N-O 2.82Å; D805-E808 VanDerWaalsContact N-O 3.1Å; D805-E808 WeakPolarHBondContact O-CB 3.36Å; D805-E808 PolarHBondContact O-N 2.9Å; D805-I810 HydrophobicContact CB-CG1 4.36Å
806	D	87.9	Confident	91.4	Very high	99 Å²	99	51 Å²	51	53%	0.529	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.2	50.6	-172.2	-70.4	-7.6	0	0	0	113.6	R762 N763	R762-D806 HydrophobicContact CB-CB 4.27Å; N763-D806 WeakPolarHBondContact CB-OD1 3.47Å; N763-D806 PolarHBondContact ND2-OD1 2.94Å
807	G	85.3	Confident	91.7	Very high	58 Å²	58	50.3 Å²	50.3	60%	0.598	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	-6.2	179.5	0	0	0	0	0	115.4	G803 D805	G803-G807 WeakPolarHBondContact CA-O 3.45Å; G803-G807 WeakPolarHBondContact O-CA 3.25Å; G803-G807 PolarHBondContact O-N 3.35Å; D805-G807 VanDerWaalsContact C-N 3.28Å; D805-G807 PolarHBondContact O-N 2.82Å
808	E	90.9	Very high	92	Very high	90 Å²	90	50.4 Å²	50.4	42%	0.421	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-100.8	163.2	177.2	-54.6	-69.6	174.6	0	0	113.9	R762 G803 V804 D805	R762-E808 IonicContact CZ-OE1 3.57Å; R762-E808 IonicContact NH1-OE1 2.7Å; R762-E808 PolarHBondContact NH1-OE1 2.86Å; R762-E808 VanDerWaalsContact NH2-CD 3.31Å; R762-E808 IonicContact NH2-OE1 3.1Å; R762-E808 PolarHBondContact NH2-OE1 2.82Å; G803-E808 CarbonylContact C-O 3.58Å; G803-E808 WeakPolarHBondContact CA-O 3.37Å; G803-E808 PolarHBondContact N-O 3.02Å; V804-E808 PolarHBondContact N-O 3.38Å; D805-E808 PolarHBondContact N-O 2.82Å; D805-E808 VanDerWaalsContact N-O 3.1Å; D805-E808 WeakPolarHBondContact O-CB 3.36Å; D805-E808 PolarHBondContact O-N 2.9Å
809	D	90.3	Very high	92.2	Very high	74 Å²	74	50.6 Å²	50.6	40%	0.396	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-80.5	128.7	171.9	-70.5	-9	0	0	0	111.4	R802 G803	R802-D809 WeakPolarHBondContact CA-OD1 3.46Å; R802-D809 VanDerWaalsContact CB-OD1 3.24Å; R802-D809 WeakPolarHBondContact CB-OD1 3.49Å; R802-D809 VanDerWaalsContact CG-OD1 3.32Å; R802-D809 WeakPolarHBondContact CG-OD1 3.3Å; R802-D809 IonicContact CZ-OD2 3.72Å; R802-D809 VanDerWaalsContact CZ-OD2 3.27Å; R802-D809 IonicContact NH1-OD1 3.87Å; R802-D809 IonicContact NH1-OD2 2.75Å; R802-D809 PolarHBondContact NH1-OD2 3.22Å; R802-D809 IonicContact NH2-OD2 3.82Å; G803-D809 PolarHBondContact N-OD1 2.9Å; G803-D809 VanDerWaalsContact N-OD1 3.08Å
810	I	92.8	Very high	92.7	Very high	6 Å²	6	46.6 Å²	46.6	3%	0.031	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-58.3	138.7	170.5	-63.2	170.7	0	0	0	109.9	F761 T766 L770 V804 D805 R812 L815	F761-I810 HydrophobicContact CE1-CD1 4.44Å; F761-I810 HydrophobicContact CE1-CG1 4.2Å; F761-I810 HydrophobicContact CE1-CG2 3.84Å; T766-I810 HydrophobicContact CG2-CD1 3.65Å; T766-I810 HydrophobicContact CG2-CG1 3.95Å; L770-I810 HydrophobicContact CD1-CD1 4.29Å; V804-I810 HydrophobicContact CB-CD1 4.22Å; V804-I810 HydrophobicContact CG1-CD1 4.12Å; D805-I810 HydrophobicContact CB-CG1 4.36Å; I810-R812 PolarHBondContact O-N 3.37Å; I810-L815 HydrophobicContact CB-CD1 4.22Å; I810-L815 HydrophobicContact CB-CD2 4.15Å; I810-L815 HydrophobicContact CB-CG 4.25Å; I810-L815 HydrophobicContact CD1-CD2 4.43Å; I810-L815 HydrophobicContact CG2-CD1 4.46Å; I810-L815 HydrophobicContact CG2-CD2 3.66Å; I810-L815 HydrophobicContact CG2-CG 3.94Å
811	P	95.1	Very high	93.2	Very high	51 Å²	51	48.6 Å²	48.6	33%	0.331	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-46.6	125.3	179.7	-32.6	36.5	0	0	0	113.9	E813 T814 L815	P811-E813 VanDerWaalsContact C-N 3.26Å; P811-E813 PolarHBondContact O-N 2.86Å; P811-T814 WeakPolarHBondContact O-CB 3.38Å; P811-T814 PolarHBondContact O-N 2.82Å; P811-T814 VanDerWaalsContact O-N 3.11Å; P811-L815 PolarHBondContact O-N 2.84Å
812	R	95.7	Very high	93.6	Very high	108 Å²	108	48.6 Å²	48.6	41%	0.408	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-37.5	-167.8	-169.2	178.4	-173.8	-78.3	-6.1	111.9	E795 I798 I810 T814 L815 V816	E795-R812 IonicContact OE1-NH2 3.63Å; E795-R812 PolarHBondContact OE1-NH2 3.09Å; E795-R812 IonicContact OE2-CZ 2.7Å; E795-R812 IonicContact OE2-NH2 3.7Å; E795-R812 PolarHBondContact OE2-NH2 2.84Å; I798-R812 HydrophobicContact CD1-CG 4.09Å; I810-R812 PolarHBondContact O-N 3.37Å; R812-T814 VanDerWaalsContact C-N 3.3Å; R812-T814 PolarHBondContact O-N 3.04Å; R812-L815 PolarHBondContact O-N 3.37Å; R812-V816 HydrophobicContact CG-CG2 4.24Å; R812-V816 WeakPolarHBondContact O-CB 3.48Å; R812-V816 WeakPolarHBondContact O-CG2 3.46Å; R812-V816 PolarHBondContact O-N 3.05Å
813	E	95.8	Very high	94	Very high	141 Å²	141	47.3 Å²	47.3	66%	0.659	25%	0.25	S	S	*	.	H	α-helix	trans	-60	-41.2	-179.8	-68.4	58.6	-129.6	0	0	111	P811 V816 G817	P811-E813 VanDerWaalsContact C-N 3.26Å; P811-E813 PolarHBondContact O-N 2.86Å; E813-V816 PolarHBondContact O-N 2.86Å; E813-G817 PolarHBondContact O-N 2.87Å
814	T	95.3	Very high	94.5	Very high	37 Å²	37	53.7 Å²	53.7	23%	0.227	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-47.7	175.9	-51.5	0	0	0	0	110.9	P811 R812 V816 G817 I818	P811-T814 WeakPolarHBondContact O-CB 3.38Å; P811-T814 PolarHBondContact O-N 2.82Å; P811-T814 VanDerWaalsContact O-N 3.11Å; R812-T814 VanDerWaalsContact C-N 3.3Å; R812-T814 PolarHBondContact O-N 3.04Å; T814-V816 PolarHBondContact O-N 2.81Å; T814-G817 PolarHBondContact O-N 2.69Å; T814-I818 HydrophobicContact CG2-CD1 4Å; T814-I818 WeakPolarHBondContact O-CB 3.33Å; T814-I818 VanDerWaalsContact O-CG1 3.3Å; T814-I818 WeakPolarHBondContact O-CG1 3.47Å; T814-I818 PolarHBondContact O-N 3.48Å
815	L	96.9	Very high	94.9	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-65.2	-38.2	178.3	-59.6	-170.5	0	0	0	112.5	L770 F797 I798 L801 I810 P811 R812 Y819	L770-L815 HydrophobicContact CD1-CD2 3.73Å; F797-L815 HydrophobicContact CE1-CB 4.28Å; F797-L815 HydrophobicContact CE1-CD2 4.36Å; I798-L815 HydrophobicContact CB-CD1 4.44Å; I798-L815 HydrophobicContact CG1-CB 3.98Å; I798-L815 HydrophobicContact CG1-CD1 4.25Å; I798-L815 HydrophobicContact CG2-CD1 4.36Å; L801-L815 HydrophobicContact CB-CD1 3.95Å; L801-L815 HydrophobicContact CD1-CD1 4.07Å; L801-L815 HydrophobicContact CD1-CD2 3.56Å; L801-L815 HydrophobicContact CD1-CG 4.43Å; I810-L815 HydrophobicContact CB-CD1 4.22Å; I810-L815 HydrophobicContact CB-CD2 4.15Å; I810-L815 HydrophobicContact CB-CG 4.25Å; I810-L815 HydrophobicContact CD1-CD2 4.43Å; I810-L815 HydrophobicContact CG2-CD1 4.46Å; I810-L815 HydrophobicContact CG2-CD2 3.66Å; I810-L815 HydrophobicContact CG2-CG 3.94Å; P811-L815 PolarHBondContact O-N 2.84Å; R812-L815 PolarHBondContact O-N 3.37Å; L815-Y819 WeakPolarHBondContact O-CB 3.39Å; L815-Y819 PolarHBondContact O-N 3Å
816	V	98.2	Very high	95.2	Very high	37 Å²	37	63.1 Å²	63.1	22%	0.224	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-46	173.8	173.8	0	0	0	0	110.9	L794 I798 R812 E813 T814 Y819 E820	L794-V816 HydrophobicContact CD1-CB 4.31Å; L794-V816 HydrophobicContact CD1-CG2 3.97Å; L794-V816 HydrophobicContact CD2-CG1 4.43Å; L794-V816 HydrophobicContact CD2-CG2 4.29Å; I798-V816 HydrophobicContact CD1-CG2 3.99Å; R812-V816 HydrophobicContact CG-CG2 4.24Å; R812-V816 WeakPolarHBondContact O-CB 3.48Å; R812-V816 WeakPolarHBondContact O-CG2 3.46Å; R812-V816 PolarHBondContact O-N 3.05Å; E813-V816 PolarHBondContact O-N 2.86Å; T814-V816 PolarHBondContact O-N 2.81Å; V816-Y819 PolarHBondContact O-N 3.3Å; V816-E820 HydrophobicContact CG1-CG 4.39Å; V816-E820 VanDerWaalsContact O-CB 3.31Å; V816-E820 WeakPolarHBondContact O-CB 3.11Å; V816-E820 WeakPolarHBondContact O-CG 3.46Å; V816-E820 PolarHBondContact O-N 3.3Å
817	G	98	Very high	95.4	Very high	20 Å²	20	58.6 Å²	58.6	21%	0.206	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-50.5	177.6	0	0	0	0	0	112.2	E813 T814 E820 R821	E813-G817 PolarHBondContact O-N 2.87Å; T814-G817 PolarHBondContact O-N 2.69Å; G817-E820 PolarHBondContact O-N 2.88Å; G817-R821 WeakPolarHBondContact O-CB 3.35Å; G817-R821 WeakPolarHBondContact O-CG 3.44Å; G817-R821 PolarHBondContact O-N 2.89Å
818	I	98.1	Very high	95.7	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-55.6	-54.3	175	-73.8	166.3	0	0	0	111.1	D720 L770 I774 F797 T814 E820 R821 I822	D720-I818 HydrophobicContact CB-CG2 4.49Å; L770-I818 HydrophobicContact CD1-CD1 4.22Å; L770-I818 HydrophobicContact CD2-CD1 3.85Å; L770-I818 HydrophobicContact CG-CD1 4.19Å; I774-I818 HydrophobicContact CD1-CD1 4.26Å; I774-I818 HydrophobicContact CD1-CG2 4.02Å; I774-I818 HydrophobicContact CG1-CG2 3.57Å; F797-I818 HydrophobicContact CE1-CG2 4.08Å; F797-I818 HydrophobicContact CZ-CG2 4Å; T814-I818 HydrophobicContact CG2-CD1 4Å; T814-I818 WeakPolarHBondContact O-CB 3.33Å; T814-I818 VanDerWaalsContact O-CG1 3.3Å; T814-I818 WeakPolarHBondContact O-CG1 3.47Å; T814-I818 PolarHBondContact O-N 3.48Å; I818-E820 VanDerWaalsContact C-N 3.32Å; I818-E820 PolarHBondContact O-N 3.17Å; I818-R821 PolarHBondContact O-N 3.33Å; I818-I822 WeakPolarHBondContact O-CG1 3.37Å; I818-I822 PolarHBondContact O-N 2.83Å
819	Y	98.3	Very high	95.8	Very high	21 Å²	21	59 Å²	59	8%	0.082	27%	0.272	C	S	.	.	H	α-helix	trans	-60.5	-42.3	-177.4	179.5	-83	0	0	0	111.8	L777 M781 M792 K793 L794 F797 L815 V816 R823	L777-Y819 HydrophobicContact CD1-CD2 3.61Å; L777-Y819 HydrophobicContact CD1-CE2 3.62Å; L777-Y819 HydrophobicContact CD2-CD2 3.8Å; L777-Y819 HydrophobicContact CD2-CG 4.4Å; L777-Y819 HydrophobicContact CG-CD2 4.37Å; M781-Y819 HydrophobicContact CE-CD2 4.28Å; M781-Y819 HydrophobicContact CE-CE1 4.47Å; M781-Y819 HydrophobicContact CE-CE2 3.78Å; M792-Y819 WeakPolarHBondContact O-CE2 3.31Å; M792-Y819 PolarHBondContact O-OH 3.49Å; K793-Y819 VanDerWaalsContact C-CE2 3.47Å; K793-Y819 WeakPolarHBondContact CA-OH 3.37Å; L794-Y819 HydrophobicContact CB-CD1 3.9Å; L794-Y819 HydrophobicContact CB-CE1 3.82Å; L794-Y819 HydrophobicContact CB-CG 4.32Å; L794-Y819 HydrophobicContact CD1-CD1 3.72Å; L794-Y819 HydrophobicContact CD1-CD2 4.42Å; L794-Y819 HydrophobicContact CD1-CG 3.69Å; L794-Y819 HydrophobicContact CG-CD1 4.35Å; L794-Y819 VanDerWaalsContact N-CZ 3.28Å; L794-Y819 PolarHBondContact N-OH 2.82Å; F797-Y819 HydrophobicContact CB-CD2 3.94Å; F797-Y819 HydrophobicContact CB-CE2 4.41Å; F797-Y819 HydrophobicContact CD1-CD2 4.12Å; F797-Y819 HydrophobicContact CG-CD2 4.15Å; L815-Y819 WeakPolarHBondContact O-CB 3.39Å; L815-Y819 PolarHBondContact O-N 3Å; V816-Y819 PolarHBondContact O-N 3.3Å; Y819-R823 WeakPolarHBondContact O-CB 3.26Å; Y819-R823 PolarHBondContact O-N 2.8Å
820	E	98.3	Very high	95.9	Very high	36 Å²	36	59 Å²	59	17%	0.168	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-39.5	177.9	-78.7	-65.6	146.8	0	0	113.2	V816 G817 I818 R823 K824	V816-E820 HydrophobicContact CG1-CG 4.39Å; V816-E820 VanDerWaalsContact O-CB 3.31Å; V816-E820 WeakPolarHBondContact O-CB 3.11Å; V816-E820 WeakPolarHBondContact O-CG 3.46Å; V816-E820 PolarHBondContact O-N 3.3Å; G817-E820 PolarHBondContact O-N 2.88Å; I818-E820 VanDerWaalsContact C-N 3.32Å; I818-E820 PolarHBondContact O-N 3.17Å; E820-R823 VanDerWaalsContact CD-CZ 3.47Å; E820-R823 PolarHBondContact O-N 3.43Å; E820-R823 IonicContact OE1-CZ 3.8Å; E820-R823 IonicContact OE1-NE 3.16Å; E820-R823 IonicContact OE1-NH1 2.69Å; E820-R823 PolarHBondContact OE1-NH1 3.05Å; E820-R823 IonicContact OE1-NH2 2.66Å; E820-R823 PolarHBondContact OE1-NH2 3.4Å; E820-R823 IonicContact OE2-CZ 3.17Å; E820-R823 VanDerWaalsContact OE2-CZ 3.28Å; E820-R823 IonicContact OE2-NE 2.63Å; E820-R823 IonicContact OE2-NH1 2.7Å; E820-R823 IonicContact OE2-NH2 3.34Å; E820-R823 PolarHBondContact OE2-NH2 3.26Å; E820-K824 WeakPolarHBondContact O-CB 3.33Å; E820-K824 VanDerWaalsContact O-CD 3.25Å; E820-K824 WeakPolarHBondContact O-CD 3.22Å; E820-K824 WeakPolarHBondContact O-CG 3.47Å; E820-K824 PolarHBondContact O-N 2.85Å; E820-K824 WeakPolarHBondContact OE2-CE 3.35Å; E820-K824 IonicContact OE2-NZ 2.63Å
821	R	98.4	Very high	95.9	Very high	52 Å²	52	64.5 Å²	64.5	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-68.7	-39.6	176.2	-74.4	-175.3	-60.6	-108.6	-1.3	112.1	E718 D720 E721 G817 I818 K824 R825	E718-R821 IonicContact OE2-CZ 3.66Å; E718-R821 IonicContact OE2-NH1 3.2Å; E718-R821 PolarHBondContact OE2-NH1 3.37Å; E718-R821 IonicContact OE2-NH2 2.78Å; E718-R821 PolarHBondContact OE2-NH2 2.99Å; D720-R821 IonicContact OD1-CZ 3.74Å; D720-R821 IonicContact OD1-NE 2.71Å; D720-R821 PolarHBondContact OD1-NE 2.84Å; D720-R821 IonicContact OD1-NH2 2.69Å; D720-R821 PolarHBondContact OD1-NH2 3.44Å; D720-R821 VanDerWaalsContact OD2-CB 3.3Å; D720-R821 WeakPolarHBondContact OD2-CB 3.34Å; D720-R821 IonicContact OD2-NE 2.77Å; E721-R821 WeakPolarHBondContact OE1-CD 3.26Å; G817-R821 WeakPolarHBondContact O-CB 3.35Å; G817-R821 WeakPolarHBondContact O-CG 3.44Å; G817-R821 PolarHBondContact O-N 2.89Å; I818-R821 PolarHBondContact O-N 3.33Å; R821-K824 PolarHBondContact O-N 3.02Å; R821-R825 PolarHBondContact O-N 3.15Å
822	I	97.6	Very high	95.9	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-46.9	171	-65.7	-69	0	0	0	110.6	D720 I774 L777 N778 M781 Y782 I818 K824 R825 L827	D720-I822 HydrophobicContact CB-CD1 4.18Å; D720-I822 HydrophobicContact CB-CG1 4.37Å; I774-I822 HydrophobicContact CG2-CD1 3.7Å; I774-I822 HydrophobicContact CG2-CG1 4.12Å; L777-I822 HydrophobicContact CD2-CB 4.11Å; L777-I822 HydrophobicContact CD2-CG1 4.29Å; L777-I822 HydrophobicContact CD2-CG2 4.06Å; L777-I822 HydrophobicContact CG-CG2 4.08Å; N778-I822 HydrophobicContact CB-CG2 4.25Å; M781-I822 HydrophobicContact CE-CG2 4.25Å; M781-I822 HydrophobicContact SD-CG2 4.46Å; Y782-I822 HydrophobicContact CE2-CG2 4.36Å; Y782-I822 WeakPolarHBondContact CE2-O 3.46Å; Y782-I822 PolarHBondContact OH-O 3.09Å; I818-I822 WeakPolarHBondContact O-CG1 3.37Å; I818-I822 PolarHBondContact O-N 2.83Å; I822-K824 VanDerWaalsContact C-N 3.32Å; I822-K824 PolarHBondContact O-N 3.31Å; I822-R825 CarbonylContact O-C 3.45Å; I822-R825 PolarHBondContact O-N 3.1Å; I822-R825 VanDerWaalsContact O-N 3.07Å; I822-L827 HydrophobicContact CD1-CD1 3.76Å; I822-L827 HydrophobicContact CD1-CD2 3.85Å; I822-L827 HydrophobicContact CD1-CG 3.63Å
823	R	97	Very high	95.9	Very high	124 Å²	124	58.8 Å²	58.8	47%	0.468	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-32.9	179.3	-166.9	-175.6	77.4	-158.4	-1.1	114.4	M781 Y782 Y819 E820 R825	M781-R823 HydrophobicContact CE-CB 4.08Å; M781-R823 HydrophobicContact CE-CG 4.44Å; M781-R823 WeakPolarHBondContact SD-CA 3.5Å; M781-R823 HydrophobicContact SD-CB 3.63Å; M781-R823 HydrophobicContact SD-CG 3.7Å; Y782-R823 PolarHBondContact OH-O 3.36Å; Y819-R823 WeakPolarHBondContact O-CB 3.26Å; Y819-R823 PolarHBondContact O-N 2.8Å; E820-R823 VanDerWaalsContact CD-CZ 3.47Å; E820-R823 PolarHBondContact O-N 3.43Å; E820-R823 IonicContact OE1-CZ 3.8Å; E820-R823 IonicContact OE1-NE 3.16Å; E820-R823 IonicContact OE1-NH1 2.69Å; E820-R823 PolarHBondContact OE1-NH1 3.05Å; E820-R823 IonicContact OE1-NH2 2.66Å; E820-R823 PolarHBondContact OE1-NH2 3.4Å; E820-R823 IonicContact OE2-CZ 3.17Å; E820-R823 VanDerWaalsContact OE2-CZ 3.28Å; E820-R823 IonicContact OE2-NE 2.63Å; E820-R823 IonicContact OE2-NH1 2.7Å; E820-R823 IonicContact OE2-NH2 3.34Å; E820-R823 PolarHBondContact OE2-NH2 3.26Å; R823-R825 VanDerWaalsContact C-N 3.34Å
824	K	97.4	Very high	95.9	Very high	155 Å²	155	52.5 Å²	52.5	67%	0.674	24%	0.243	S	C	*	.	H	α-helix	trans	-74	-25.7	175.5	-70.9	160.5	-166.7	168.3	0	112.2	E820 R821 I822	E820-K824 WeakPolarHBondContact O-CB 3.33Å; E820-K824 VanDerWaalsContact O-CD 3.25Å; E820-K824 WeakPolarHBondContact O-CD 3.22Å; E820-K824 WeakPolarHBondContact O-CG 3.47Å; E820-K824 PolarHBondContact O-N 2.85Å; E820-K824 WeakPolarHBondContact OE2-CE 3.35Å; E820-K824 IonicContact OE2-NZ 2.63Å; R821-K824 PolarHBondContact O-N 3.02Å; I822-K824 VanDerWaalsContact C-N 3.32Å; I822-K824 PolarHBondContact O-N 3.31Å
825	R	96.6	Very high	95.9	Very high	149 Å²	149	51.8 Å²	51.8	56%	0.562	24%	0.24	S	C	*	.	S	Bend	trans	-157.1	113.9	-171.7	-174.4	-179.3	166.5	-166.7	-3.9	111.3	R724 R821 I822 R823	R724-R825 PolarHBondContact NH1-O 3.19Å; R821-R825 PolarHBondContact O-N 3.15Å; I822-R825 CarbonylContact O-C 3.45Å; I822-R825 PolarHBondContact O-N 3.1Å; I822-R825 VanDerWaalsContact O-N 3.07Å; R823-R825 VanDerWaalsContact C-N 3.34Å
826	E	94.8	Very high	95.8	Very high	63 Å²	63	56.8 Å²	56.8	29%	0.294	26%	0.263	S	S	.	.			trans	-55.2	141.3	170	-172.4	177.9	151.5	0	0	112.3	R724 Y782 K828	R724-E826 PolarHBondContact NH1-O 3.41Å; Y782-E826 HydrophobicContact CD1-CB 3.84Å; Y782-E826 HydrophobicContact CD1-CG 3.86Å; Y782-E826 WeakPolarHBondContact CD1-OE2 3.45Å; Y782-E826 HydrophobicContact CD2-CB 3.72Å; Y782-E826 HydrophobicContact CD2-CG 3.57Å; Y782-E826 HydrophobicContact CE1-CB 3.82Å; Y782-E826 HydrophobicContact CE1-CG 4.36Å; Y782-E826 VanDerWaalsContact CE2-CA 3.45Å; Y782-E826 HydrophobicContact CE2-CB 3.68Å; Y782-E826 HydrophobicContact CE2-CG 4.09Å; Y782-E826 HydrophobicContact CG-CB 3.79Å; Y782-E826 HydrophobicContact CG-CG 3.43Å; Y782-E826 VanDerWaalsContact CG-CG 3.43Å; Y782-E826 PolarHBondContact OH-N 2.84Å; E826-K828 HydrophobicContact CB-CG 4.34Å; E826-K828 HydrophobicContact CG-CG 4.03Å; E826-K828 PolarHBondContact O-N 3.16Å; E826-K828 WeakPolarHBondContact OE1-CE 3.34Å; E826-K828 IonicContact OE1-NZ 3.69Å; E826-K828 WeakPolarHBondContact OE2-CE 3.43Å; E826-K828 IonicContact OE2-NZ 2.84Å; E826-K828 PolarHBondContact OE2-NZ 2.93Å
827	L	93.1	Very high	95.7	Very high	5 Å²	5	55 Å²	55	3%	0.026	25%	0.252	C	S	.	.			trans	-74.6	106.7	167.8	-58.9	173	0	0	0	109	L723 R724 Q727 I774 N778 I822	L723-L827 HydrophobicContact CD2-CD1 4.42Å; R724-L827 HydrophobicContact CB-CD2 3.59Å; R724-L827 HydrophobicContact CG-CD2 3.81Å; Q727-L827 PolarHBondContact NE2-O 2.97Å; Q727-L827 VanDerWaalsContact NE2-O 3.14Å; I774-L827 HydrophobicContact CG2-CD1 3.95Å; N778-L827 HydrophobicContact CB-CB 4.47Å; N778-L827 HydrophobicContact CB-CD1 3.82Å; N778-L827 HydrophobicContact CB-CG 4.19Å; N778-L827 PolarHBondContact OD1-N 3.13Å; I822-L827 HydrophobicContact CD1-CD1 3.76Å; I822-L827 HydrophobicContact CD1-CD2 3.85Å; I822-L827 HydrophobicContact CD1-CG 3.63Å
828	K	90.9	Very high	95.5	Very high	120 Å²	120	57.7 Å²	57.7	52%	0.522	26%	0.259	S	S	.	.			trans	-116	133.9	179	-69.7	-175.8	174.6	163	0	110.6	N728 E826	N728-K828 PolarHBondContact OD1-O 3.38Å; E826-K828 HydrophobicContact CB-CG 4.34Å; E826-K828 HydrophobicContact CG-CG 4.03Å; E826-K828 PolarHBondContact O-N 3.16Å; E826-K828 WeakPolarHBondContact OE1-CE 3.34Å; E826-K828 IonicContact OE1-NZ 3.69Å; E826-K828 WeakPolarHBondContact OE2-CE 3.43Å; E826-K828 IonicContact OE2-NZ 2.84Å; E826-K828 PolarHBondContact OE2-NZ 2.93Å
829	T	92.4	Very high	95.3	Very high	35 Å²	35	62.7 Å²	62.7	22%	0.215	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-73.9	146	164.4	-57	0	0	0	0	109.8	R686 Q727 R731	R686-T829 HydrophobicContact CB-CG2 3.58Å; R686-T829 HydrophobicContact CG-CG2 3.86Å; Q727-T829 WeakPolarHBondContact O-CA 3.47Å; Q727-T829 VanDerWaalsContact O-CB 3.28Å; Q727-T829 WeakPolarHBondContact O-CB 3.47Å; Q727-T829 WeakPolarHBondContact O-CG2 3.35Å; Q727-T829 PolarHBondContact O-OG1 2.98Å; R731-T829 HydrophobicContact CB-CG2 4.25Å
830	N	92.5	Very high	95.1	Very high	76 Å²	76	62.5 Å²	62.5	41%	0.406	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-61.6	146.7	179	-75.7	-33.8	0	0	0	111.8	N728	N728-N830 WeakPolarHBondContact O-CB 3.45Å; N728-N830 VanDerWaalsContact O-CG 3.25Å; N728-N830 PolarHBondContact O-N 2.91Å; N728-N830 PolarHBondContact O-ND2 3.35Å; N728-N830 VanDerWaalsContact O-ND2 3.15Å
831	E	93.4	Very high	94.9	Very high	121 Å²	121	61.7 Å²	61.7	57%	0.565	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-59.5	133.9	177.3	-69.7	-107.3	177.8	0	0	112.5	S835 K839	E831-S835 WeakPolarHBondContact OE2-CB 3.44Å; E831-K839 WeakPolarHBondContact OE1-CE 3.39Å; E831-K839 IonicContact OE1-NZ 2.59Å; E831-K839 PolarHBondContact OE1-NZ 2.86Å; E831-K839 WeakPolarHBondContact OE2-CE 3.33Å; E831-K839 IonicContact OE2-NZ 3.69Å; E831-K839 PolarHBondContact OE2-NZ 3.37Å
832	D	94.3	Very high	94.6	Very high	24 Å²	24	66.6 Å²	66.6	13%	0.128	30%	0.301	C	S	.	.			trans	-119.1	-172.3	176.2	71.1	-2.8	0	0	0	111.8	S685 R686 V834 S835	S685-D832 WeakPolarHBondContact CA-OD2 3.47Å; S685-D832 PolarHBondContact OG-OD2 3.24Å; S685-D832 VanDerWaalsContact OG-OD2 3.09Å; R686-D832 HydrophobicContact CG-CB 4.02Å; R686-D832 PolarHBondContact N-OD2 2.79Å; R686-D832 VanDerWaalsContact N-OD2 3.07Å; D832-V834 VanDerWaalsContact C-N 3.28Å; D832-V834 PolarHBondContact O-N 3.38Å; D832-V834 WeakPolarHBondContact OD1-CA 3.46Å; D832-V834 WeakPolarHBondContact OD1-CB 3.22Å; D832-V834 PolarHBondContact OD1-N 3.12Å; D832-S835 PolarHBondContact N-OG 2.57Å; D832-S835 VanDerWaalsContact N-OG 3.14Å; D832-S835 WeakPolarHBondContact O-CB 3.39Å; D832-S835 PolarHBondContact O-N 2.82Å; D832-S835 PolarHBondContact OD1-N 2.74Å; D832-S835 PolarHBondContact OD1-OG 2.91Å
833	H	95.9	Very high	94.3	Very high	14 Å²	14	69.9 Å²	69.9	7%	0.065	32%	0.318	C	S	.	.	H	α-helix	trans	-67.8	-28.9	177	59.7	-88.9	0	0	0	112.9	G683 S685 S835 Q836 V837 P864 R866 R867	G683-H833 VanDerWaalsContact C-CE1 3.48Å; G683-H833 WeakPolarHBondContact CA-ND1 3.43Å; G683-H833 PolarHBondContact O-CE1 2.71Å; G683-H833 PolarHBondContact O-ND1 2.72Å; S685-H833 PolarHBondContact N-CE1 3.02Å; H833-S835 VanDerWaalsContact C-N 3.31Å; H833-Q836 WeakPolarHBondContact O-CB 3.37Å; H833-Q836 PolarHBondContact O-N 2.86Å; H833-V837 PolarHBondContact O-N 2.79Å; H833-P864 PolarHBondContact NE2-O 2.84Å; H833-R866 PolarHBondContact CD2-O 3.01Å; H833-R867 HydrophobicContact CB-CB 4.35Å; H833-R867 HydrophobicContact CB-CG 4.04Å
834	V	96.3	Very high	94	Very high	9 Å²	9	64.3 Å²	64.3	6%	0.055	30%	0.298	C	S	.	.	H	α-helix	trans	-67.4	-37.8	177	-169.1	0	0	0	0	109.9	S685 D832 Q836 V837 Q838 P864	S685-V834 WeakPolarHBondContact OG-CG2 3.34Å; D832-V834 VanDerWaalsContact C-N 3.28Å; D832-V834 PolarHBondContact O-N 3.38Å; D832-V834 WeakPolarHBondContact OD1-CA 3.46Å; D832-V834 WeakPolarHBondContact OD1-CB 3.22Å; D832-V834 PolarHBondContact OD1-N 3.12Å; V834-Q836 PolarHBondContact O-N 2.83Å; V834-V837 CarbonylContact O-C 3.52Å; V834-V837 WeakPolarHBondContact O-CA 3.3Å; V834-V837 WeakPolarHBondContact O-CB 3.29Å; V834-V837 PolarHBondContact O-N 2.97Å; V834-Q838 WeakPolarHBondContact O-CG 3.37Å; V834-Q838 PolarHBondContact O-N 2.73Å; V834-P864 WeakPolarHBondContact CG2-O 3.48Å
835	S	94.9	Very high	93.5	Very high	22 Å²	22	59.5 Å²	59.5	15%	0.154	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-34.5	175.6	-51.2	0	0	0	0	112.2	E831 D832 H833 K839	E831-S835 WeakPolarHBondContact OE2-CB 3.44Å; D832-S835 PolarHBondContact N-OG 2.57Å; D832-S835 VanDerWaalsContact N-OG 3.14Å; D832-S835 WeakPolarHBondContact O-CB 3.39Å; D832-S835 PolarHBondContact O-N 2.82Å; D832-S835 PolarHBondContact OD1-N 2.74Å; D832-S835 PolarHBondContact OD1-OG 2.91Å; H833-S835 VanDerWaalsContact C-N 3.31Å; S835-K839 WeakPolarHBondContact O-CG 3.4Å; S835-K839 PolarHBondContact O-N 3Å
836	Q	94.9	Very high	92.2	Very high	108 Å²	108	54.9 Å²	54.9	51%	0.505	28%	0.28	S	S	.	.	H	α-helix	trans	-70.3	-40.8	171.7	-56.9	-178.9	20.5	0	0	112.2	H833 V834 K839 V840	H833-Q836 WeakPolarHBondContact O-CB 3.37Å; H833-Q836 PolarHBondContact O-N 2.86Å; V834-Q836 PolarHBondContact O-N 2.83Å; Q836-K839 WeakPolarHBondContact O-CB 3.47Å; Q836-K839 PolarHBondContact O-N 3.38Å; Q836-V840 PolarHBondContact O-N 3.5Å; Q836-V840 VanDerWaalsContact O-N 3.1Å
837	V	96.2	Very high	90.6	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-42.1	174.9	-178.9	0	0	0	0	110.8	H833 V834 K839 V840 E841 L861 R866 F896	H833-V837 PolarHBondContact O-N 2.79Å; V834-V837 CarbonylContact O-C 3.52Å; V834-V837 WeakPolarHBondContact O-CA 3.3Å; V834-V837 WeakPolarHBondContact O-CB 3.29Å; V834-V837 PolarHBondContact O-N 2.97Å; V837-K839 PolarHBondContact O-N 3.3Å; V837-V840 PolarHBondContact O-N 3.5Å; V837-E841 WeakPolarHBondContact O-CB 3.39Å; V837-E841 PolarHBondContact O-N 2.85Å; V837-L861 HydrophobicContact CG1-CB 3.84Å; V837-L861 WeakPolarHBondContact CG1-O 3.43Å; V837-R866 WeakPolarHBondContact CG2-O 3.46Å; V837-F896 HydrophobicContact CB-CE1 4.34Å; V837-F896 HydrophobicContact CG1-CD1 4.38Å; V837-F896 HydrophobicContact CG1-CE1 3.76Å; V837-F896 HydrophobicContact CG1-CZ 4.41Å; V837-F896 HydrophobicContact CG2-CD1 4.04Å; V837-F896 HydrophobicContact CG2-CE1 3.87Å
838	Q	94.1	Very high	88.4	Confident	76 Å²	76	62.7 Å²	62.7	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-58.1	-35.5	173.4	-70.2	-177	9.1	0	0	112.7	V834 K842	V834-Q838 WeakPolarHBondContact O-CG 3.37Å; V834-Q838 PolarHBondContact O-N 2.73Å; Q838-K842 WeakPolarHBondContact O-CB 3.39Å; Q838-K842 WeakPolarHBondContact O-CD 3.42Å; Q838-K842 WeakPolarHBondContact O-CG 3.11Å; Q838-K842 PolarHBondContact O-N 3.03Å
839	K	94.1	Very high	86.2	Confident	106 Å²	106	63 Å²	63	46%	0.461	33%	0.327	S	S	.	.	H	α-helix	trans	-68.5	-48.1	176.7	-74	165.9	-178.5	173.4	0	111.5	E831 S835 Q836 V837 E841 K842 L843	E831-K839 WeakPolarHBondContact OE1-CE 3.39Å; E831-K839 IonicContact OE1-NZ 2.59Å; E831-K839 PolarHBondContact OE1-NZ 2.86Å; E831-K839 WeakPolarHBondContact OE2-CE 3.33Å; E831-K839 IonicContact OE2-NZ 3.69Å; E831-K839 PolarHBondContact OE2-NZ 3.37Å; S835-K839 WeakPolarHBondContact O-CG 3.4Å; S835-K839 PolarHBondContact O-N 3Å; Q836-K839 WeakPolarHBondContact O-CB 3.47Å; Q836-K839 PolarHBondContact O-N 3.38Å; V837-K839 PolarHBondContact O-N 3.3Å; K839-E841 VanDerWaalsContact C-N 3.29Å; K839-E841 PolarHBondContact O-N 2.81Å; K839-K842 PolarHBondContact O-N 2.91Å; K839-L843 WeakPolarHBondContact O-CG 3.47Å
840	V	94.1	Very high	83.6	Confident	18 Å²	18	67 Å²	67	11%	0.109	35%	0.346	C	S	.	.	H	α-helix	trans	-58.3	-44.5	172.6	172.8	0	0	0	0	110.8	Q836 V837 K842 L843 I844 L868 F894 F896	Q836-V840 PolarHBondContact O-N 3.5Å; Q836-V840 VanDerWaalsContact O-N 3.1Å; V837-V840 PolarHBondContact O-N 3.5Å; V840-K842 VanDerWaalsContact C-N 3.34Å; V840-K842 PolarHBondContact O-N 2.87Å; V840-L843 WeakPolarHBondContact O-CB 3.29Å; V840-L843 PolarHBondContact O-N 2.96Å; V840-I844 HydrophobicContact CG1-CD1 3.9Å; V840-I844 PolarHBondContact O-N 3.28Å; V840-L868 HydrophobicContact CG2-CD2 4.1Å; V840-F894 HydrophobicContact CG1-CD1 3.61Å; V840-F894 HydrophobicContact CG1-CD2 4.48Å; V840-F894 HydrophobicContact CG1-CE1 3.74Å; V840-F894 HydrophobicContact CG1-CG 4.01Å; V840-F894 HydrophobicContact CG1-CZ 4.25Å; V840-F894 HydrophobicContact CG2-CD1 4.42Å; V840-F894 HydrophobicContact CG2-CE1 4.39Å; V840-F896 HydrophobicContact CG1-CZ 4.23Å
841	E	93.1	Very high	81.1	Confident	19 Å²	19	67.8 Å²	67.8	9%	0.089	37%	0.372	C	S	.	.	H	α-helix	trans	-62.3	-37.4	-177.5	-180	162.5	-162.5	0	0	113.5	V837 K839 L843 I844 K847 V860 L861 S862	V837-E841 WeakPolarHBondContact O-CB 3.39Å; V837-E841 PolarHBondContact O-N 2.85Å; K839-E841 VanDerWaalsContact C-N 3.29Å; K839-E841 PolarHBondContact O-N 2.81Å; E841-L843 PolarHBondContact O-N 3.3Å; E841-I844 PolarHBondContact O-N 2.82Å; E841-K847 VanDerWaalsContact CD-NZ 3.33Å; E841-K847 IonicContact OE1-NZ 2.59Å; E841-K847 PolarHBondContact OE1-NZ 3.38Å; E841-V860 VanDerWaalsContact OE1-CA 3.31Å; E841-V860 WeakPolarHBondContact OE1-CA 3.27Å; E841-L861 HydrophobicContact CB-CB 4.25Å; E841-L861 HydrophobicContact CB-CD1 4.29Å; E841-L861 HydrophobicContact CG-CB 4.22Å; E841-L861 HydrophobicContact CG-CD1 4.3Å; E841-L861 PolarHBondContact OE1-N 2.97Å; E841-L861 WeakPolarHBondContact OE2-CA 3.39Å; E841-L861 WeakPolarHBondContact OE2-CB 3.41Å; E841-L861 PolarHBondContact OE2-N 3.21Å; E841-S862 WeakPolarHBondContact OE2-CB 3.36Å; E841-S862 PolarHBondContact OE2-N 3.38Å; E841-S862 PolarHBondContact OE2-OG 3.11Å
842	K	92	Very high	78.5	Confident	155 Å²	155	66 Å²	66	67%	0.674	37%	0.373	S	S	*	.	H	α-helix	trans	-68	-19.6	174.4	-73.4	163.2	-173.6	170.8	0	113	Q838 K839 V840	Q838-K842 WeakPolarHBondContact O-CB 3.39Å; Q838-K842 WeakPolarHBondContact O-CD 3.42Å; Q838-K842 WeakPolarHBondContact O-CG 3.11Å; Q838-K842 PolarHBondContact O-N 3.03Å; K839-K842 PolarHBondContact O-N 2.91Å; V840-K842 VanDerWaalsContact C-N 3.34Å; V840-K842 PolarHBondContact O-N 2.87Å
843	L	92.2	Very high	76.2	Confident	68 Å²	68	73 Å²	73	36%	0.356	41%	0.409	S	S	.	.	H	α-helix	trans	-87.5	-15.1	174.1	-56.4	178.3	0	0	0	113.1	K839 V840 E841 V845 T914 Y915	K839-L843 WeakPolarHBondContact O-CG 3.47Å; V840-L843 WeakPolarHBondContact O-CB 3.29Å; V840-L843 PolarHBondContact O-N 2.96Å; E841-L843 PolarHBondContact O-N 3.3Å; L843-V845 PolarHBondContact O-N 2.78Å; L843-T914 WeakPolarHBondContact O-CA 3.08Å; L843-Y915 HydrophobicContact CB-CD2 3.89Å; L843-Y915 HydrophobicContact CB-CE2 4.1Å; L843-Y915 HydrophobicContact CD1-CE2 4.2Å; L843-Y915 PolarHBondContact O-N 3.4Å
844	I	91.7	Very high	73.8	Confident	8 Å²	8	80 Å²	80	4%	0.041	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	102.6	-178	-62.4	171.1	0	0	0	110.2	V840 E841 K847 L861 F894 V901 T903 Y915 F917	V840-I844 HydrophobicContact CG1-CD1 3.9Å; V840-I844 PolarHBondContact O-N 3.28Å; E841-I844 PolarHBondContact O-N 2.82Å; I844-K847 HydrophobicContact CG2-CG 4.37Å; I844-L861 HydrophobicContact CD1-CD1 3.88Å; I844-F894 HydrophobicContact CD1-CD2 4.25Å; I844-F894 HydrophobicContact CD1-CE2 4.37Å; I844-V901 HydrophobicContact CD1-CG1 4.44Å; I844-T903 HydrophobicContact CD1-CG2 4.25Å; I844-T903 HydrophobicContact CG1-CG2 4.37Å; I844-T903 HydrophobicContact CG2-CG2 4.48Å; I844-Y915 CarbonylContact C-O 3.56Å; I844-Y915 WeakPolarHBondContact CA-O 3.27Å; I844-F917 HydrophobicContact CG2-CB 3.92Å; I844-F917 HydrophobicContact CG2-CD2 4.39Å
845	V	85.2	Confident	71	Confident	53 Å²	53	88.3 Å²	88.3	32%	0.321	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	161.3	176.5	-61.2	0	0	0	0	111.6	L843 F906 Y915 S916 F917	L843-V845 PolarHBondContact O-N 2.78Å; V845-F906 HydrophobicContact CG2-CB 4.07Å; V845-F906 HydrophobicContact CG2-CD1 3.65Å; V845-F906 HydrophobicContact CG2-CE1 4.3Å; V845-F906 HydrophobicContact CG2-CG 3.93Å; V845-Y915 WeakPolarHBondContact CG2-O 3.4Å; V845-Y915 PolarHBondContact N-O 2.85Å; V845-S916 WeakPolarHBondContact O-CA 3.27Å; V845-F917 PolarHBondContact O-N 3.03Å
846	G	69.4	Low	68.4	Low	52 Å²	52	91 Å²	91	54%	0.536	51%	0.511	S	S	.	.			trans	75.7	22.5	177.4	0	0	0	0	0	114.5	K848	G846-K848 PolarHBondContact O-N 3.2Å
847	K	62.2	Low	65.9	Low	79 Å²	79	91.1 Å²	91.1	34%	0.343	51%	0.514	S	S	.	.			trans	-63.1	77.3	161	-56.1	-172.6	-142.3	161.4	0	109.5	E841 I844	E841-K847 VanDerWaalsContact CD-NZ 3.33Å; E841-K847 IonicContact OE1-NZ 2.59Å; E841-K847 PolarHBondContact OE1-NZ 3.38Å; I844-K847 HydrophobicContact CG2-CG 4.37Å
848	K	47.5	Very low	63.7	Low	153 Å²	153	94.7 Å²	94.7	67%	0.665	55%	0.551	S	S	*	*			trans	-65.2	130.9	177.4	-68.9	-177.4	178.7	-174.2	0	109.1	G846 I850	G846-K848 PolarHBondContact O-N 3.2Å; K848-I850 HydrophobicContact CB-CD1 4.21Å; K848-I850 HydrophobicContact CB-CG1 3.42Å; K848-I850 VanDerWaalsContact CB-CG1 3.42Å; K848-I850 HydrophobicContact CD-CD1 4.33Å; K848-I850 HydrophobicContact CD-CG1 4.09Å; K848-I850 HydrophobicContact CG-CG1 4.42Å; K848-I850 PolarHBondContact O-N 3.35Å
849	P	43	Very low	62.2	Low	127 Å²	127	91.9 Å²	91.9	83%	0.825	54%	0.539	S	S	*	.			trans	-69.9	88.3	153.8	30	-30.4	0	0	0	106.9	G851	P849-G851 PolarHBondContact O-N 3.41Å
850	I	39	Very low	61.7	Low	119 Å²	119	89.9 Å²	89.9	61%	0.61	54%	0.536	S	S	*	.			trans	-79.7	117.9	-177.9	-48.5	-178.8	0	0	0	108.5	K848 S852	K848-I850 HydrophobicContact CB-CD1 4.21Å; K848-I850 HydrophobicContact CB-CG1 3.42Å; K848-I850 VanDerWaalsContact CB-CG1 3.42Å; K848-I850 HydrophobicContact CD-CD1 4.33Å; K848-I850 HydrophobicContact CD-CG1 4.09Å; K848-I850 HydrophobicContact CG-CG1 4.42Å; K848-I850 PolarHBondContact O-N 3.35Å; I850-S852 PolarHBondContact O-N 2.8Å
851	G	39.4	Very low	61.5	Low	93 Å²	93	89.2 Å²	89.2	96%	0.959	53%	0.532	S	S	*	.			trans	-68.6	72.9	161.1	0	0	0	0	0	110.6	P849	P849-G851 PolarHBondContact O-N 3.41Å
852	S	38.6	Very low	61.5	Low	84 Å²	84	89.5 Å²	89.5	59%	0.587	54%	0.536	S	S	*	.			trans	-126.9	143.4	174.2	-165.2	0	0	0	0	109.4	I850 H854	I850-S852 PolarHBondContact O-N 2.8Å; S852-H854 PolarHBondContact O-N 2.72Å
853	L	45.6	Very low	61.6	Low	169 Å²	169	85 Å²	85	89%	0.885	52%	0.519	S	S	*	.	S	Bend	trans	-71.9	117.4	-178.2	-137.5	66.2	0	0	0	108.5
854	H	45.9	Very low	61.8	Low	161 Å²	161	83.1 Å²	83.1	75%	0.745	51%	0.511	S	S	*	.	S	Bend	trans	70.2	153.5	-166.4	-69.6	-115.1	0	0	0	116.1	S852	S852-H854 PolarHBondContact O-N 2.72Å
855	H	38.6	Very low	62.1	Low	185 Å²	185	84 Å²	84	86%	0.856	52%	0.515	S	S	*	.			trans	76.7	48.8	-167.5	-48.4	85.1	0	0	0	114.9	L857	H855-L857 PolarHBondContact O-N 3.41Å
856	G	39	Very low	62.7	Low	78 Å²	78	82.2 Å²	82.2	80%	0.804	50%	0.502	S	S	*	.			trans	-67	117.7	166.3	0	0	0	0	0	111.6
857	L	43.2	Very low	64	Low	111 Å²	111	82.9 Å²	82.9	58%	0.581	49%	0.488	S	S	*	.			trans	-165.9	106.5	157.5	-109.1	168.6	0	0	0	108.6	H855 C859	H855-L857 PolarHBondContact O-N 3.41Å; L857-C859 HydrophobicContact CB-CB 4.03Å; L857-C859 HydrophobicContact CD2-CB 4.31Å; L857-C859 PolarHBondContact O-N 3.19Å
858	G	49.3	Very low	65.7	Low	74 Å²	74	81 Å²	81	76%	0.763	48%	0.482	S	S	*	.			trans	-69.3	74.6	155.9	0	0	0	0	0	107.9	V860	G858-V860 PolarHBondContact O-N 2.8Å
859	C	64.1	Low	68.1	Low	17 Å²	17	75.7 Å²	75.7	12%	0.115	46%	0.462	C	S	.	.			trans	-72.8	93.1	-153.1	-158.2	0	0	0	0	112.9	L857 L861	L857-C859 HydrophobicContact CB-CB 4.03Å; L857-C859 HydrophobicContact CD2-CB 4.31Å; L857-C859 PolarHBondContact O-N 3.19Å; C859-L861 PolarHBondContact O-N 3.03Å
860	V	82.1	Confident	70.7	Confident	65 Å²	65	70.4 Å²	70.4	39%	0.394	43%	0.428	S	S	.	.			trans	-67.9	108.5	153.6	-180	0	0	0	0	106.8	E841 G858 R866	E841-V860 VanDerWaalsContact OE1-CA 3.31Å; E841-V860 WeakPolarHBondContact OE1-CA 3.27Å; G858-V860 PolarHBondContact O-N 2.8Å; V860-R866 PolarHBondContact O-NH1 3.33Å
861	L	89.8	Confident	73.5	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.021	42%	0.419	C	S	.	.			trans	-74.4	-35.8	176.5	-68.4	170.5	0	0	0	110.2	V837 E841 I844 C859 L863 R866 F896 L899 V901	V837-L861 HydrophobicContact CG1-CB 3.84Å; V837-L861 WeakPolarHBondContact CG1-O 3.43Å; E841-L861 HydrophobicContact CB-CB 4.25Å; E841-L861 HydrophobicContact CB-CD1 4.29Å; E841-L861 HydrophobicContact CG-CB 4.22Å; E841-L861 HydrophobicContact CG-CD1 4.3Å; E841-L861 PolarHBondContact OE1-N 2.97Å; E841-L861 WeakPolarHBondContact OE2-CA 3.39Å; E841-L861 WeakPolarHBondContact OE2-CB 3.41Å; E841-L861 PolarHBondContact OE2-N 3.21Å; I844-L861 HydrophobicContact CD1-CD1 3.88Å; C859-L861 PolarHBondContact O-N 3.03Å; L861-L863 PolarHBondContact O-N 3.01Å; L861-R866 VanDerWaalsContact O-CD 3.29Å; L861-R866 WeakPolarHBondContact O-CD 3.3Å; L861-R866 PolarHBondContact O-NH1 3.4Å; L861-F896 HydrophobicContact CD1-CZ 4.5Å; L861-F896 HydrophobicContact CD2-CE2 4.48Å; L861-L899 HydrophobicContact CD2-CD2 3.79Å; L861-V901 HydrophobicContact CD2-CG2 4.01Å
862	S	93.1	Very high	76.3	Confident	25 Å²	25	66 Å²	66	18%	0.175	38%	0.377	C	S	.	.			trans	-74.5	55.1	-178.2	73.6	0	0	0	0	114.7	E841	E841-S862 WeakPolarHBondContact OE2-CB 3.36Å; E841-S862 PolarHBondContact OE2-N 3.38Å; E841-S862 PolarHBondContact OE2-OG 3.11Å
863	L	95.2	Very high	79.1	Confident	61 Å²	61	66.7 Å²	66.7	32%	0.319	37%	0.367	S	S	.	.			trans	-71.4	147.2	166.2	-56.9	-177.6	0	0	0	109.7	L861 H865 R866	L861-L863 PolarHBondContact O-N 3.01Å; L863-H865 PolarHBondContact O-N 3.46Å; L863-H865 VanDerWaalsContact O-N 3.07Å; L863-R866 HydrophobicContact CB-CB 4.33Å; L863-R866 PolarHBondContact O-N 3.08Å
864	P	96.6	Very high	81.6	Confident	27 Å²	27	58.6 Å²	58.6	18%	0.175	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.2	-172.8	-27.6	35.3	0	0	0	115.4	M688 H833 V834	M688-P864 HydrophobicContact CG-CB 3.54Å; M688-P864 HydrophobicContact CG-CG 4.33Å; M688-P864 HydrophobicContact SD-CB 3.66Å; M688-P864 HydrophobicContact SD-CG 3.82Å; H833-P864 PolarHBondContact NE2-O 2.84Å; V834-P864 WeakPolarHBondContact CG2-O 3.48Å
865	H	96.5	Very high	84.1	Confident	28 Å²	28	52.5 Å²	52.5	13%	0.13	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.3	176.9	59.2	-91.4	0	0	0	114.7	N651 K652 L863 N897	N651-H865 VanDerWaalsContact CB-CA 3.47Å; N651-H865 HydrophobicContact CB-CB 3.65Å; N651-H865 WeakPolarHBondContact O-CB 3.27Å; K652-H865 WeakPolarHBondContact CE-CD2 3.43Å; K652-H865 VanDerWaalsContact CE-CE1 3.49Å; K652-H865 WeakPolarHBondContact CE-CE1 3.49Å; K652-H865 WeakPolarHBondContact CE-ND1 3.36Å; K652-H865 VanDerWaalsContact CE-NE2 3.33Å; K652-H865 WeakPolarHBondContact CE-NE2 3.35Å; K652-H865 HydrophobicContact CG-CB 3.87Å; K652-H865 WeakPolarHBondContact CG-ND1 3.25Å; L863-H865 PolarHBondContact O-N 3.46Å; L863-H865 VanDerWaalsContact O-N 3.07Å; H865-N897 PolarHBondContact O-ND2 3.07Å; H865-N897 PolarHBondContact O-OD1 2.94Å
866	R	97.6	Very high	86.9	Confident	15 Å²	15	45.5 Å²	45.5	6%	0.057	26%	0.264	C	S	.	.			trans	-85.3	125.5	-179.1	-169.8	165.8	-61.5	120.2	-2	110	H833 V837 V860 L861 L863 F896 N897 D898	H833-R866 PolarHBondContact CD2-O 3.01Å; V837-R866 WeakPolarHBondContact CG2-O 3.46Å; V860-R866 PolarHBondContact O-NH1 3.33Å; L861-R866 VanDerWaalsContact O-CD 3.29Å; L861-R866 WeakPolarHBondContact O-CD 3.3Å; L861-R866 PolarHBondContact O-NH1 3.4Å; L863-R866 HydrophobicContact CB-CB 4.33Å; L863-R866 PolarHBondContact O-N 3.08Å; R866-F896 HydrophobicContact CG-CB 3.65Å; R866-F896 HydrophobicContact CG-CD1 3.76Å; R866-F896 HydrophobicContact CG-CG 3.83Å; R866-N897 WeakPolarHBondContact CA-OD1 3.49Å; R866-D898 WeakPolarHBondContact CD-OD1 3.16Å; R866-D898 WeakPolarHBondContact CG-OD1 3.27Å; R866-D898 IonicContact CZ-OD1 3.44Å; R866-D898 IonicContact CZ-OD2 3.71Å; R866-D898 IonicContact NE-OD1 3.53Å; R866-D898 PolarHBondContact NE-OD1 2.9Å; R866-D898 IonicContact NE-OD2 2.69Å; R866-D898 PolarHBondContact NE-OD2 3Å; R866-D898 VanDerWaalsContact NE-OD2 3.17Å; R866-D898 IonicContact NH2-OD1 2.66Å; R866-D898 IonicContact NH2-OD2 2.76Å; R866-D898 PolarHBondContact NH2-OD2 2.8Å
867	R	97.6	Very high	89.7	Confident	65 Å²	65	41.8 Å²	41.8	25%	0.245	23%	0.226	C	C	.	.			trans	-127.9	134.9	-179.9	174.2	-176.5	61.4	72.7	0.2	109.2	H833 V869 F896 N897	H833-R867 HydrophobicContact CB-CB 4.35Å; H833-R867 HydrophobicContact CB-CG 4.04Å; R867-V869 PolarHBondContact O-N 3.36Å; R867-F896 CarbonylContact O-C 3.1Å; R867-F896 VanDerWaalsContact O-CA 3.24Å; R867-F896 WeakPolarHBondContact O-CA 3.4Å; R867-N897 PolarHBondContact N-OD1 2.96Å; R867-N897 PolarHBondContact O-N 2.69Å; R867-N897 PolarHBondContact O-OD1 3.29Å
868	L	98.1	Very high	92.2	Very high	40 Å²	40	40.4 Å²	40.4	21%	0.209	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	131.8	170.7	-172.4	71.5	0	0	0	109.9	V840 F894 F896	V840-L868 HydrophobicContact CG2-CD2 4.1Å; L868-F894 HydrophobicContact CD1-CB 4.27Å; L868-F894 HydrophobicContact CD1-CD1 4.23Å; L868-F896 HydrophobicContact CB-CD1 4.24Å; L868-F896 HydrophobicContact CB-CE1 4.25Å; L868-F896 HydrophobicContact CD1-CD1 4.08Å; L868-F896 HydrophobicContact CD1-CE1 3.76Å; L868-F896 HydrophobicContact CD1-CZ 4.16Å
869	V	98.1	Very high	94.4	Very high	42 Å²	42	39.1 Å²	39.1	26%	0.255	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-58.4	175.1	179.4	0	0	0	0	109.1	R867 L895 N897 D971	R867-V869 PolarHBondContact O-N 3.36Å; V869-L895 HydrophobicContact CB-CB 4.43Å; V869-L895 HydrophobicContact CB-CD2 4.09Å; V869-L895 HydrophobicContact CB-CG 3.98Å; V869-L895 HydrophobicContact CG1-CD2 3.95Å; V869-L895 HydrophobicContact CG1-CG 4.4Å; V869-L895 HydrophobicContact CG2-CG 4.44Å; V869-L895 PolarHBondContact N-O 2.71Å; V869-N897 HydrophobicContact CG2-CB 4.25Å; V869-D971 HydrophobicContact CG1-CB 4.16Å
870	C	97.7	Very high	95.9	Very high	16 Å²	16	38.7 Å²	38.7	11%	0.108	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	161	178.3	79.3	0	0	0	0	112.9	L895	C870-L895 PolarHBondContact N-O 3.33Å; C870-L895 PolarHBondContact O-N 3.27Å
871	Y	97.7	Very high	96.5	Very high	105 Å²	105	41.5 Å²	41.5	41%	0.412	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.3	163.4	156.2	-104.6	0	0	0	108.3	R873 E892 I893 F894	Y871-R873 PolarHBondContact OH-NH2 3.02Å; Y871-E892 HydrophobicContact CE2-CB 4.13Å; Y871-E892 PolarHBondContact OH-OE2 2.74Å; Y871-I893 WeakPolarHBondContact CA-O 3.44Å; Y871-F894 HydrophobicContact CD2-CD1 4.15Å; Y871-F894 AromaticContact CD2-CE1 3.71Å; Y871-F894 HydrophobicContact CD2-CE1 3.71Å; Y871-F894 AromaticContact CD2-CZ 3.98Å; Y871-F894 HydrophobicContact CD2-CZ 3.98Å; Y871-F894 HydrophobicContact CE2-CE1 4.49Å; Y871-F894 HydrophobicContact CE2-CZ 4.35Å; Y871-F894 HydrophobicContact CG-CE1 4.31Å
872	C	97.3	Very high	96.8	Very high	13 Å²	13	47.4 Å²	47.4	9%	0.088	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	149.8	-177.7	-173.1	0	0	0	0	111.4	I893 F968	C872-I893 PolarHBondContact N-O 2.8Å; C872-I893 WeakPolarHBondContact O-CB 3.15Å; C872-I893 PolarHBondContact O-N 3.45Å; C872-F968 HydrophobicContact CB-CD2 3.94Å
873	R	97.7	Very high	96.8	Very high	99 Å²	99	50.4 Å²	50.4	37%	0.374	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.6	169.7	177.4	174.2	-66.6	131.5	19.1	109.9	Y871 Q890 R891 E892 P960	Y871-R873 PolarHBondContact OH-NH2 3.02Å; R873-Q890 HydrophobicContact CG-CG 3.92Å; R873-Q890 VanDerWaalsContact NE-NE2 3.12Å; R873-R891 WeakPolarHBondContact CA-O 3.5Å; R873-E892 IonicContact CZ-OE1 3.16Å; R873-E892 IonicContact CZ-OE2 2.71Å; R873-E892 IonicContact NE-OE1 3.99Å; R873-E892 PolarHBondContact NE-OE1 3.1Å; R873-E892 IonicContact NE-OE2 3.37Å; R873-E892 PolarHBondContact NE-OE2 3.42Å; R873-E892 IonicContact NH2-OE1 2.74Å; R873-E892 PolarHBondContact NH2-OE1 3.24Å; R873-E892 IonicContact NH2-OE2 2.72Å; R873-E892 PolarHBondContact NH2-OE2 3.37Å; R873-P960 WeakPolarHBondContact O-CD 3.15Å
874	L	97.9	Very high	96.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	158	176	-62.1	-179.6	0	0	0	110.2	R891 I893 I940 F957 A959 F968	L874-R891 PolarHBondContact N-O 2.82Å; L874-R891 VanDerWaalsContact N-O 3.12Å; L874-R891 PolarHBondContact O-N 3Å; L874-I893 HydrophobicContact CB-CG1 4.14Å; L874-I893 HydrophobicContact CD1-CG1 4.14Å; L874-I893 HydrophobicContact CG-CG1 4.14Å; L874-I940 HydrophobicContact CD1-CD1 4.37Å; L874-I940 HydrophobicContact CD2-CD1 4.37Å; L874-F957 HydrophobicContact CB-CB 4.11Å; L874-F957 HydrophobicContact CB-CD1 3.72Å; L874-F957 HydrophobicContact CB-CE1 4.36Å; L874-F957 HydrophobicContact CB-CG 4.05Å; L874-F957 HydrophobicContact CD1-CB 3.96Å; L874-F957 HydrophobicContact CD1-CD1 4.14Å; L874-F957 HydrophobicContact CD1-CD2 3.93Å; L874-F957 HydrophobicContact CD1-CE2 4.42Å; L874-F957 HydrophobicContact CD1-CG 3.77Å; L874-A959 HydrophobicContact CD2-CB 3.66Å; L874-F968 HydrophobicContact CD1-CD1 3.84Å; L874-F968 HydrophobicContact CD1-CE1 3.72Å; L874-F968 HydrophobicContact CD1-CG 4.29Å; L874-F968 HydrophobicContact CD1-CZ 4.09Å
875	F	98	Very high	96.5	Very high	33 Å²	33	56.6 Å²	56.6	15%	0.145	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	119.4	171.5	-56.6	-77.7	0	0	0	108.4	Q890 F957 N958 P960	F875-Q890 HydrophobicContact CD1-CB 3.89Å; F875-Q890 HydrophobicContact CD1-CG 4.33Å; F875-Q890 HydrophobicContact CE1-CB 3.78Å; F875-Q890 HydrophobicContact CE1-CG 3.89Å; F875-F957 CarbonylContact O-C 3.6Å; F875-F957 WeakPolarHBondContact O-CA 3.44Å; F875-N958 PolarHBondContact N-O 2.83Å; F875-N958 PolarHBondContact O-N 3.33Å; F875-P960 HydrophobicContact CE2-CB 4.22Å
876	E	97.8	Very high	96	Very high	37 Å²	37	62.9 Å²	62.9	17%	0.173	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	138.9	175.2	172.9	177.5	177.7	0	0	109.8	Q884 H889 R891 I955 F957	E876-Q884 PolarHBondContact O-NE2 3.04Å; E876-Q884 PolarHBondContact O-OE1 2.85Å; E876-H889 HydrophobicContact CB-CB 4.1Å; E876-H889 PolarHBondContact N-O 3.17Å; E876-H889 WeakPolarHBondContact O-CB 3.13Å; E876-R891 HydrophobicContact CB-CG 3.89Å; E876-R891 IonicContact OE2-CZ 2.72Å; E876-R891 IonicContact OE2-NE 2.79Å; E876-R891 PolarHBondContact OE2-NE 3Å; E876-R891 IonicContact OE2-NH2 3.75Å; E876-R891 PolarHBondContact OE2-NH2 2.78Å; E876-I955 HydrophobicContact CB-CD1 4.31Å; E876-I955 HydrophobicContact CG-CD1 3.71Å; E876-I955 HydrophobicContact CG-CG1 4.16Å; E876-F957 HydrophobicContact CB-CD1 4.26Å; E876-F957 HydrophobicContact CB-CE1 4.27Å
877	V	97.8	Very high	95.5	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.006	33%	0.327	C	S	.	.			trans	-119.9	99	-177.6	176	0	0	0	0	108.2	D879 P880 Y936 N956 N958	V877-D879 VanDerWaalsContact C-N 3.33Å; V877-D879 PolarHBondContact O-N 3.4Å; V877-P880 HydrophobicContact CG1-CB 4.31Å; V877-P880 HydrophobicContact CG1-CG 3.96Å; V877-Y936 HydrophobicContact CB-CE1 4.39Å; V877-Y936 HydrophobicContact CG1-CD1 4.4Å; V877-Y936 HydrophobicContact CG1-CD2 4.17Å; V877-Y936 HydrophobicContact CG1-CE1 3.88Å; V877-Y936 HydrophobicContact CG1-CE2 3.64Å; V877-Y936 VanDerWaalsContact CG1-CZ 3.49Å; V877-Y936 HydrophobicContact CG2-CD1 3.8Å; V877-Y936 HydrophobicContact CG2-CE1 3.55Å; V877-Y936 HydrophobicContact CG2-CG 4.48Å; V877-N956 HydrophobicContact CB-CB 4.1Å; V877-N956 PolarHBondContact N-O 2.71Å; V877-N956 WeakPolarHBondContact O-CB 3.1Å; V877-N956 PolarHBondContact O-ND2 2.99Å; V877-N958 HydrophobicContact CG2-CB 3.85Å
878	P	96.1	Very high	95.3	Very high	82 Å²	82	64.7 Å²	64.7	53%	0.532	33%	0.334	S	S	.	.	S	Bend	trans	-63.8	-38.1	-179	-23.6	34.9	0	0	0	112.7	Q884	P878-Q884 VanDerWaalsContact CD-OE1 3.29Å
879	D	95.1	Very high	95.2	Very high	46 Å²	46	66.3 Å²	66.3	25%	0.246	34%	0.341	C	S	.	.			trans	-136.4	102.4	178.2	-173.8	-12.2	0	0	0	110.7	V877 N881 K882	V877-D879 VanDerWaalsContact C-N 3.33Å; V877-D879 PolarHBondContact O-N 3.4Å; D879-N881 PolarHBondContact O-N 3.2Å; D879-N881 VanDerWaalsContact O-N 3.11Å; D879-N881 WeakPolarHBondContact OD1-CB 3.04Å; D879-N881 PolarHBondContact OD1-N 3.29Å; D879-K882 HydrophobicContact CB-CB 4.4Å; D879-K882 HydrophobicContact CB-CG 4.49Å; D879-K882 PolarHBondContact O-N 3.27Å; D879-K882 VanDerWaalsContact O-N 3.15Å; D879-K882 WeakPolarHBondContact OD2-CD 3.38Å; D879-K882 WeakPolarHBondContact OD2-CG 3.45Å; D879-K882 IonicContact OD2-NZ 2.65Å; D879-K882 PolarHBondContact OD2-NZ 3.5Å
880	P	95.8	Very high	95.1	Very high	8 Å²	8	67.3 Å²	67.3	5%	0.052	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-16.1	177.3	-28.7	38.4	0	0	0	115.3	V877 F931 N933 N956	V877-P880 HydrophobicContact CG1-CB 4.31Å; V877-P880 HydrophobicContact CG1-CG 3.96Å; P880-F931 HydrophobicContact CB-CE2 3.86Å; P880-F931 HydrophobicContact CB-CZ 3.9Å; P880-F931 HydrophobicContact CG-CE2 4.49Å; P880-F931 HydrophobicContact CG-CZ 4.03Å; P880-N933 PolarHBondContact O-ND2 2.73Å; P880-N956 HydrophobicContact CG-CB 3.84Å; P880-N956 VanDerWaalsContact CG-CG 3.41Å
881	N	95.5	Very high	95.1	Very high	124 Å²	124	67.1 Å²	67.1	66%	0.663	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	0.2	-180	-55.8	-42	0	0	0	112.9	D879 Y935	D879-N881 PolarHBondContact O-N 3.2Å; D879-N881 VanDerWaalsContact O-N 3.11Å; D879-N881 WeakPolarHBondContact OD1-CB 3.04Å; D879-N881 PolarHBondContact OD1-N 3.29Å; N881-Y935 WeakPolarHBondContact O-CE2 3.39Å
882	K	94.8	Very high	95.1	Very high	128 Å²	128	62.1 Å²	62.1	56%	0.557	32%	0.32	S	S	*	.	S	Bend	trans	-124.2	143.4	176.8	-66.5	-176.6	-179.9	69.2	0	110.9	D879 Y936	D879-K882 HydrophobicContact CB-CB 4.4Å; D879-K882 HydrophobicContact CB-CG 4.49Å; D879-K882 PolarHBondContact O-N 3.27Å; D879-K882 VanDerWaalsContact O-N 3.15Å; D879-K882 WeakPolarHBondContact OD2-CD 3.38Å; D879-K882 WeakPolarHBondContact OD2-CG 3.45Å; D879-K882 IonicContact OD2-NZ 2.65Å; D879-K882 PolarHBondContact OD2-NZ 3.5Å; K882-Y936 VanDerWaalsContact O-CE2 3.26Å; K882-Y936 WeakPolarHBondContact O-CE2 3.27Å; K882-Y936 PolarHBondContact O-OH 3.49Å
883	P	94.3	Very high	95.1	Very high	88 Å²	88	61.5 Å²	61.5	57%	0.571	32%	0.316	S	S	*	.			trans	-68.4	146.6	172.4	28.4	-32.1	0	0	0	111.1	Y935	P883-Y935 HydrophobicContact CB-CD1 3.61Å; P883-Y935 HydrophobicContact CB-CE1 3.93Å; P883-Y935 HydrophobicContact CB-CG 4.01Å; P883-Y935 HydrophobicContact CG-CD1 4.19Å; P883-Y935 HydrophobicContact CG-CE1 3.98Å
884	Q	94.1	Very high	95.1	Very high	45 Å²	45	57.2 Å²	57.2	21%	0.21	30%	0.3	C	S	.	.			trans	-129.6	155.3	166.9	80.7	-173.8	11.9	0	0	110.6	E876 P878 L886 L888 Y936	E876-Q884 PolarHBondContact O-NE2 3.04Å; E876-Q884 PolarHBondContact O-OE1 2.85Å; P878-Q884 VanDerWaalsContact CD-OE1 3.29Å; Q884-L886 PolarHBondContact O-N 3.08Å; Q884-L888 HydrophobicContact CB-CD2 4.07Å; Q884-L888 HydrophobicContact CG-CB 4.47Å; Q884-Y936 HydrophobicContact CG-CE1 3.97Å; Q884-Y936 WeakPolarHBondContact CG-OH 3.1Å; Q884-Y936 PolarHBondContact N-OH 2.95Å
885	K	91.1	Very high	95.2	Very high	173 Å²	173	57.2 Å²	57.2	75%	0.752	30%	0.3	S	S	*	.			trans	-61.6	136.1	177.8	-171.8	178.1	179.2	175.9	0	110.3	G887 L888	K885-G887 PolarHBondContact O-N 3.12Å; K885-L888 HydrophobicContact CB-CB 4.43Å; K885-L888 WeakPolarHBondContact O-CB 3.32Å; K885-L888 PolarHBondContact O-N 2.88Å
886	L	86	Confident	95.2	Very high	160 Å²	160	55.7 Å²	55.7	84%	0.838	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	139.3	172.2	-63.4	176.7	0	0	0	110.6	Q884 L888	Q884-L886 PolarHBondContact O-N 3.08Å; L886-L888 PolarHBondContact O-N 3.08Å
887	G	86.9	Confident	95.2	Very high	42 Å²	42	54 Å²	54	43%	0.433	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-15.1	-172.4	0	0	0	0	0	115.2	K885	K885-G887 PolarHBondContact O-N 3.12Å
888	L	93.4	Very high	95.1	Very high	76 Å²	76	55.1 Å²	55.1	40%	0.398	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	146.3	176.5	-161.2	75.1	0	0	0	110.5	Q884 K885 L886 Q890	Q884-L888 HydrophobicContact CB-CD2 4.07Å; Q884-L888 HydrophobicContact CG-CB 4.47Å; K885-L888 HydrophobicContact CB-CB 4.43Å; K885-L888 WeakPolarHBondContact O-CB 3.32Å; K885-L888 PolarHBondContact O-N 2.88Å; L886-L888 PolarHBondContact O-N 3.08Å; L888-Q890 PolarHBondContact O-N 2.92Å; L888-Q890 VanDerWaalsContact O-N 3.1Å
889	H	95.1	Very high	95.1	Very high	74 Å²	74	51.8 Å²	51.8	34%	0.343	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	32.8	178.3	-56.3	-51.4	0	0	0	115.3	E876 R891	E876-H889 HydrophobicContact CB-CB 4.1Å; E876-H889 PolarHBondContact N-O 3.17Å; E876-H889 WeakPolarHBondContact O-CB 3.13Å; H889-R891 VanDerWaalsContact C-NH1 3.26Å; H889-R891 PolarHBondContact O-N 2.9Å; H889-R891 PolarHBondContact O-NH1 3.11Å; H889-R891 VanDerWaalsContact O-NH1 3.11Å
890	Q	96.9	Very high	95.3	Very high	64 Å²	64	49.6 Å²	49.6	30%	0.299	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-47.5	131.9	168.3	-172.6	179.6	-50.1	0	0	111.9	R873 F875 L888 E892	R873-Q890 HydrophobicContact CG-CG 3.92Å; R873-Q890 VanDerWaalsContact NE-NE2 3.12Å; F875-Q890 HydrophobicContact CD1-CB 3.89Å; F875-Q890 HydrophobicContact CD1-CG 4.33Å; F875-Q890 HydrophobicContact CE1-CB 3.78Å; F875-Q890 HydrophobicContact CE1-CG 3.89Å; L888-Q890 PolarHBondContact O-N 2.92Å; L888-Q890 VanDerWaalsContact O-N 3.1Å; Q890-E892 PolarHBondContact NE2-OE1 2.77Å
891	R	97.7	Very high	95.3	Very high	11 Å²	11	49.2 Å²	49.2	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.8	174.9	-61.7	-59.2	173.5	-93.1	-14.1	110.3	R873 L874 E876 H889 I893 V902 T903 F957	R873-R891 WeakPolarHBondContact CA-O 3.5Å; L874-R891 PolarHBondContact N-O 2.82Å; L874-R891 VanDerWaalsContact N-O 3.12Å; L874-R891 PolarHBondContact O-N 3Å; E876-R891 HydrophobicContact CB-CG 3.89Å; E876-R891 IonicContact OE2-CZ 2.72Å; E876-R891 IonicContact OE2-NE 2.79Å; E876-R891 PolarHBondContact OE2-NE 3Å; E876-R891 IonicContact OE2-NH2 3.75Å; E876-R891 PolarHBondContact OE2-NH2 2.78Å; H889-R891 VanDerWaalsContact C-NH1 3.26Å; H889-R891 PolarHBondContact O-N 2.9Å; H889-R891 PolarHBondContact O-NH1 3.11Å; H889-R891 VanDerWaalsContact O-NH1 3.11Å; R891-I893 HydrophobicContact CB-CD1 3.62Å; R891-I893 HydrophobicContact CB-CG1 4.38Å; R891-V902 HydrophobicContact CB-CG1 4.08Å; R891-V902 HydrophobicContact CG-CG1 3.82Å; R891-T903 CarbonylContact C-O 3.48Å; R891-T903 VanDerWaalsContact CA-O 3.24Å; R891-T903 WeakPolarHBondContact CA-O 3.26Å; R891-T903 WeakPolarHBondContact CB-O 3.4Å; R891-T903 VanDerWaalsContact CD-O 3.27Å; R891-T903 WeakPolarHBondContact CD-O 3.24Å; R891-F957 HydrophobicContact CB-CE1 4.44Å; R891-F957 HydrophobicContact CG-CE1 4.34Å
892	E	97.5	Very high	95.3	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.6	174.9	-51.4	-62.1	141.8	0	0	105.6	Y871 R873 Q890 T903 I905 Y915	Y871-E892 HydrophobicContact CE2-CB 4.13Å; Y871-E892 PolarHBondContact OH-OE2 2.74Å; R873-E892 IonicContact CZ-OE1 3.16Å; R873-E892 IonicContact CZ-OE2 2.71Å; R873-E892 IonicContact NE-OE1 3.99Å; R873-E892 PolarHBondContact NE-OE1 3.1Å; R873-E892 IonicContact NE-OE2 3.37Å; R873-E892 PolarHBondContact NE-OE2 3.42Å; R873-E892 IonicContact NH2-OE1 2.74Å; R873-E892 PolarHBondContact NH2-OE1 3.24Å; R873-E892 IonicContact NH2-OE2 2.72Å; R873-E892 PolarHBondContact NH2-OE2 3.37Å; Q890-E892 PolarHBondContact NE2-OE1 2.77Å; E892-T903 WeakPolarHBondContact CB-OG1 3.44Å; E892-T903 PolarHBondContact N-O 3.35Å; E892-T903 PolarHBondContact O-N 2.77Å; E892-T903 PolarHBondContact O-OG1 2.76Å; E892-I905 HydrophobicContact CG-CD1 4.26Å; E892-I905 HydrophobicContact CG-CG1 3.54Å; E892-Y915 HydrophobicContact CB-CD1 3.68Å; E892-Y915 HydrophobicContact CB-CE1 3.68Å; E892-Y915 HydrophobicContact CG-CD1 3.85Å; E892-Y915 HydrophobicContact CG-CE1 3.76Å
893	I	97.9	Very high	95.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.8	-166.1	-51.7	-62.3	0	0	0	108.9	Y871 C872 L874 R891 L900 V902 F957 F968	Y871-I893 WeakPolarHBondContact CA-O 3.44Å; C872-I893 PolarHBondContact N-O 2.8Å; C872-I893 WeakPolarHBondContact O-CB 3.15Å; C872-I893 PolarHBondContact O-N 3.45Å; L874-I893 HydrophobicContact CB-CG1 4.14Å; L874-I893 HydrophobicContact CD1-CG1 4.14Å; L874-I893 HydrophobicContact CG-CG1 4.14Å; R891-I893 HydrophobicContact CB-CD1 3.62Å; R891-I893 HydrophobicContact CB-CG1 4.38Å; I893-L900 HydrophobicContact CG2-CD1 3.48Å; I893-L900 VanDerWaalsContact CG2-CD1 3.48Å; I893-L900 HydrophobicContact CG2-CG 4.41Å; I893-V902 HydrophobicContact CD1-CB 4.27Å; I893-V902 HydrophobicContact CD1-CG1 3.91Å; I893-V902 HydrophobicContact CD1-CG2 4.08Å; I893-F957 HydrophobicContact CD1-CE1 3.75Å; I893-F957 HydrophobicContact CD1-CZ 3.75Å; I893-F968 HydrophobicContact CG2-CE2 3.73Å; I893-F968 HydrophobicContact CG2-CZ 4.09Å
894	F	98	Very high	95.4	Very high	9 Å²	9	37.8 Å²	37.8	4%	0.039	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.5	172.4	-60.4	-86.1	0	0	0	108.2	V840 I844 L868 Y871 F896 V901 T903 Y915	V840-F894 HydrophobicContact CG1-CD1 3.61Å; V840-F894 HydrophobicContact CG1-CD2 4.48Å; V840-F894 HydrophobicContact CG1-CE1 3.74Å; V840-F894 HydrophobicContact CG1-CG 4.01Å; V840-F894 HydrophobicContact CG1-CZ 4.25Å; V840-F894 HydrophobicContact CG2-CD1 4.42Å; V840-F894 HydrophobicContact CG2-CE1 4.39Å; I844-F894 HydrophobicContact CD1-CD2 4.25Å; I844-F894 HydrophobicContact CD1-CE2 4.37Å; L868-F894 HydrophobicContact CD1-CB 4.27Å; L868-F894 HydrophobicContact CD1-CD1 4.23Å; Y871-F894 HydrophobicContact CD2-CD1 4.15Å; Y871-F894 AromaticContact CD2-CE1 3.71Å; Y871-F894 HydrophobicContact CD2-CE1 3.71Å; Y871-F894 AromaticContact CD2-CZ 3.98Å; Y871-F894 HydrophobicContact CD2-CZ 3.98Å; Y871-F894 HydrophobicContact CE2-CE1 4.49Å; Y871-F894 HydrophobicContact CE2-CZ 4.35Å; Y871-F894 HydrophobicContact CG-CE1 4.31Å; F894-F896 HydrophobicContact CB-CE2 3.85Å; F894-F896 HydrophobicContact CB-CZ 4.11Å; F894-V901 HydrophobicContact CB-CB 4.4Å; F894-V901 PolarHBondContact N-O 2.84Å; F894-V901 PolarHBondContact O-N 3.4Å; F894-T903 HydrophobicContact CD2-CG2 4.14Å; F894-T903 HydrophobicContact CE2-CG2 4.19Å; F894-Y915 HydrophobicContact CE2-CD1 4.31Å; F894-Y915 HydrophobicContact CE2-CD2 4.27Å; F894-Y915 HydrophobicContact CE2-CE1 4.47Å; F894-Y915 HydrophobicContact CE2-CE2 4.44Å; F894-Y915 HydrophobicContact CE2-CG 4.2Å; F894-Y915 HydrophobicContact CZ-CD1 4.39Å; F894-Y915 HydrophobicContact CZ-CD2 4.01Å; F894-Y915 HydrophobicContact CZ-CE1 4.16Å; F894-Y915 AromaticContact CZ-CE2 3.76Å; F894-Y915 HydrophobicContact CZ-CE2 3.76Å; F894-Y915 HydrophobicContact CZ-CG 4.32Å; F894-Y915 AromaticContact CZ-CZ 3.83Å
895	L	98.4	Very high	95.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	121.3	172	178.5	62.9	0	0	0	108.4	V869 C870 L900 L923 D971 L972	V869-L895 HydrophobicContact CB-CB 4.43Å; V869-L895 HydrophobicContact CB-CD2 4.09Å; V869-L895 HydrophobicContact CB-CG 3.98Å; V869-L895 HydrophobicContact CG1-CD2 3.95Å; V869-L895 HydrophobicContact CG1-CG 4.4Å; V869-L895 HydrophobicContact CG2-CG 4.44Å; V869-L895 PolarHBondContact N-O 2.71Å; C870-L895 PolarHBondContact N-O 3.33Å; C870-L895 PolarHBondContact O-N 3.27Å; L895-L900 HydrophobicContact CB-CD1 4.31Å; L895-L900 HydrophobicContact CD1-CD1 4.04Å; L895-L923 HydrophobicContact CD1-CD1 3.96Å; L895-L923 HydrophobicContact CD1-CD2 4.25Å; L895-D971 HydrophobicContact CD2-CB 3.96Å; L895-L972 HydrophobicContact CD1-CD1 3.69Å; L895-L972 HydrophobicContact CD2-CB 4.21Å
896	F	98.4	Very high	95.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	165.6	164.9	-54.3	-86.9	0	0	0	109.4	V837 V840 L861 R866 R867 L868 F894 D898 L899 V901	V837-F896 HydrophobicContact CB-CE1 4.34Å; V837-F896 HydrophobicContact CG1-CD1 4.38Å; V837-F896 HydrophobicContact CG1-CE1 3.76Å; V837-F896 HydrophobicContact CG1-CZ 4.41Å; V837-F896 HydrophobicContact CG2-CD1 4.04Å; V837-F896 HydrophobicContact CG2-CE1 3.87Å; V840-F896 HydrophobicContact CG1-CZ 4.23Å; L861-F896 HydrophobicContact CD1-CZ 4.5Å; L861-F896 HydrophobicContact CD2-CE2 4.48Å; R866-F896 HydrophobicContact CG-CB 3.65Å; R866-F896 HydrophobicContact CG-CD1 3.76Å; R866-F896 HydrophobicContact CG-CG 3.83Å; R867-F896 CarbonylContact O-C 3.1Å; R867-F896 VanDerWaalsContact O-CA 3.24Å; R867-F896 WeakPolarHBondContact O-CA 3.4Å; L868-F896 HydrophobicContact CB-CD1 4.24Å; L868-F896 HydrophobicContact CB-CE1 4.25Å; L868-F896 HydrophobicContact CD1-CD1 4.08Å; L868-F896 HydrophobicContact CD1-CE1 3.76Å; L868-F896 HydrophobicContact CD1-CZ 4.16Å; F894-F896 HydrophobicContact CB-CE2 3.85Å; F894-F896 HydrophobicContact CB-CZ 4.11Å; F896-D898 PolarHBondContact O-N 3.47Å; F896-L899 WeakPolarHBondContact CA-O 3.5Å; F896-L899 HydrophobicContact CB-CB 4.37Å; F896-L899 WeakPolarHBondContact CB-O 3.35Å; F896-L899 HydrophobicContact CD2-CB 4.47Å; F896-L899 WeakPolarHBondContact CD2-O 3.3Å; F896-L899 PolarHBondContact N-O 3.37Å; F896-L899 PolarHBondContact O-N 2.87Å; F896-V901 HydrophobicContact CD2-CG2 4.02Å; F896-V901 HydrophobicContact CE2-CB 4.12Å; F896-V901 HydrophobicContact CE2-CG2 3.69Å
897	N	97.8	Very high	95.5	Very high	3 Å²	3	32 Å²	32	2%	0.016	16%	0.161	C	C	.	.	S	Bend	trans	-59.6	-24.2	-179.8	58.2	-34.9	0	0	0	114.4	N648 H865 R866 R867 V869 V979	N648-N897 PolarHBondContact OD1-ND2 2.76Å; H865-N897 PolarHBondContact O-ND2 3.07Å; H865-N897 PolarHBondContact O-OD1 2.94Å; R866-N897 WeakPolarHBondContact CA-OD1 3.49Å; R867-N897 PolarHBondContact N-OD1 2.96Å; R867-N897 PolarHBondContact O-N 2.69Å; R867-N897 PolarHBondContact O-OD1 3.29Å; V869-N897 HydrophobicContact CG2-CB 4.25Å; N897-V979 WeakPolarHBondContact O-CG2 3.27Å
898	D	96.6	Very high	95.7	Very high	23 Å²	23	38.3 Å²	38.3	12%	0.123	18%	0.176	C	C	.	.	S	Bend	trans	-116.9	-15	179.1	72	-40.5	0	0	0	114.8	R866 F896 L923 V979	R866-D898 WeakPolarHBondContact CD-OD1 3.16Å; R866-D898 WeakPolarHBondContact CG-OD1 3.27Å; R866-D898 IonicContact CZ-OD1 3.44Å; R866-D898 IonicContact CZ-OD2 3.71Å; R866-D898 IonicContact NE-OD1 3.53Å; R866-D898 PolarHBondContact NE-OD1 2.9Å; R866-D898 IonicContact NE-OD2 2.69Å; R866-D898 PolarHBondContact NE-OD2 3Å; R866-D898 VanDerWaalsContact NE-OD2 3.17Å; R866-D898 IonicContact NH2-OD1 2.66Å; R866-D898 IonicContact NH2-OD2 2.76Å; R866-D898 PolarHBondContact NH2-OD2 2.8Å; F896-D898 PolarHBondContact O-N 3.47Å; D898-L923 PolarHBondContact O-N 2.66Å; D898-L923 VanDerWaalsContact O-N 3.1Å; D898-V979 HydrophobicContact CB-CG2 4.48Å
899	L	96.7	Very high	95.5	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.068	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	132.1	-162.3	-170.2	75.8	0	0	0	112.1	L861 F896 V901	L861-L899 HydrophobicContact CD2-CD2 3.79Å; F896-L899 WeakPolarHBondContact CA-O 3.5Å; F896-L899 HydrophobicContact CB-CB 4.37Å; F896-L899 WeakPolarHBondContact CB-O 3.35Å; F896-L899 HydrophobicContact CD2-CB 4.47Å; F896-L899 WeakPolarHBondContact CD2-O 3.3Å; F896-L899 PolarHBondContact N-O 3.37Å; F896-L899 PolarHBondContact O-N 2.87Å; L899-V901 HydrophobicContact CD2-CG2 3.62Å; L899-V901 HydrophobicContact CG-CG2 3.99Å
900	L	97.6	Very high	95.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	119.3	168.9	-176.4	68.5	0	0	0	110	I893 L895 S920 F921 L923 M926 L942 F968	I893-L900 HydrophobicContact CG2-CD1 3.48Å; I893-L900 VanDerWaalsContact CG2-CD1 3.48Å; I893-L900 HydrophobicContact CG2-CG 4.41Å; L895-L900 HydrophobicContact CB-CD1 4.31Å; L895-L900 HydrophobicContact CD1-CD1 4.04Å; L900-S920 CarbonylContact O-C 3.53Å; L900-S920 WeakPolarHBondContact O-CA 3.5Å; L900-F921 HydrophobicContact CD2-CD2 4.35Å; L900-F921 PolarHBondContact N-O 2.98Å; L900-F921 PolarHBondContact O-N 3.34Å; L900-L923 HydrophobicContact CB-CD2 4.04Å; L900-M926 HydrophobicContact CD2-CE 4.42Å; L900-L942 HydrophobicContact CD2-CD1 3.38Å; L900-F968 HydrophobicContact CD1-CE2 4.02Å; L900-F968 HydrophobicContact CD1-CZ 3.87Å; L900-F968 HydrophobicContact CD2-CZ 4.5Å
901	V	96.3	Very high	94.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.3	178.7	178.6	0	0	0	0	110.7	I844 L861 F894 F896 L899 T903 F917	I844-V901 HydrophobicContact CD1-CG1 4.44Å; L861-V901 HydrophobicContact CD2-CG2 4.01Å; F894-V901 HydrophobicContact CB-CB 4.4Å; F894-V901 PolarHBondContact N-O 2.84Å; F894-V901 PolarHBondContact O-N 3.4Å; F896-V901 HydrophobicContact CD2-CG2 4.02Å; F896-V901 HydrophobicContact CE2-CB 4.12Å; F896-V901 HydrophobicContact CE2-CG2 3.69Å; L899-V901 HydrophobicContact CD2-CG2 3.62Å; L899-V901 HydrophobicContact CG-CG2 3.99Å; V901-T903 HydrophobicContact CG1-CG2 3.92Å; V901-F917 HydrophobicContact CG1-CD2 4.05Å; V901-F917 HydrophobicContact CG1-CE2 3.97Å
902	V	96.3	Very high	94.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.8	-179.6	-176.5	0	0	0	0	109.3	R891 I893 R918 Q919 F921 F957	R891-V902 HydrophobicContact CB-CG1 4.08Å; R891-V902 HydrophobicContact CG-CG1 3.82Å; I893-V902 HydrophobicContact CD1-CB 4.27Å; I893-V902 HydrophobicContact CD1-CG1 3.91Å; I893-V902 HydrophobicContact CD1-CG2 4.08Å; V902-R918 HydrophobicContact CG1-CB 4.45Å; V902-R918 WeakPolarHBondContact O-CB 3.41Å; V902-R918 PolarHBondContact O-N 2.82Å; V902-Q919 HydrophobicContact CB-CG 3.86Å; V902-Q919 HydrophobicContact CG1-CG 4.39Å; V902-Q919 HydrophobicContact CG2-CG 4.14Å; V902-Q919 PolarHBondContact N-O 3.48Å; V902-Q919 PolarHBondContact O-N 2.96Å; V902-F921 HydrophobicContact CG2-CD2 4.36Å; V902-F921 HydrophobicContact CG2-CE2 4.06Å; V902-F957 HydrophobicContact CG2-CZ 4.11Å
903	T	95.9	Very high	94.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	170.3	179.6	76.4	0	0	0	0	111.8	I844 R891 E892 F894 V901 S916	I844-T903 HydrophobicContact CD1-CG2 4.25Å; I844-T903 HydrophobicContact CG1-CG2 4.37Å; I844-T903 HydrophobicContact CG2-CG2 4.48Å; R891-T903 CarbonylContact C-O 3.48Å; R891-T903 VanDerWaalsContact CA-O 3.24Å; R891-T903 WeakPolarHBondContact CA-O 3.26Å; R891-T903 WeakPolarHBondContact CB-O 3.4Å; R891-T903 VanDerWaalsContact CD-O 3.27Å; R891-T903 WeakPolarHBondContact CD-O 3.24Å; E892-T903 WeakPolarHBondContact CB-OG1 3.44Å; E892-T903 PolarHBondContact N-O 3.35Å; E892-T903 PolarHBondContact O-N 2.77Å; E892-T903 PolarHBondContact O-OG1 2.76Å; F894-T903 HydrophobicContact CD2-CG2 4.14Å; F894-T903 HydrophobicContact CE2-CG2 4.19Å; V901-T903 HydrophobicContact CG1-CG2 3.92Å; T903-S916 CarbonylContact C-O 3.49Å; T903-S916 VanDerWaalsContact CA-O 3.27Å; T903-S916 WeakPolarHBondContact CA-O 3.21Å; T903-S916 VanDerWaalsContact CB-O 3.29Å; T903-S916 WeakPolarHBondContact CB-O 3.47Å
904	K	94.9	Very high	94.1	Very high	99 Å²	99	57 Å²	57	43%	0.43	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.2	168.6	-178.9	-155.3	168.6	-169.8	0	108.3	F906 Y915 S916 R918	K904-F906 PolarHBondContact O-N 3.44Å; K904-Y915 CarbonylContact O-C 3.51Å; K904-S916 PolarHBondContact N-O 2.59Å; K904-S916 PolarHBondContact O-N 2.79Å; K904-S916 PolarHBondContact O-OG 3.28Å; K904-R918 HydrophobicContact CB-CG 4.48Å
905	I	93.7	Very high	94	Very high	44 Å²	44	57.6 Å²	57.6	23%	0.226	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-47.3	128.2	170.6	-57.1	-179.4	0	0	0	110.3	E892 K908 V913 Y915	E892-I905 HydrophobicContact CG-CD1 4.26Å; E892-I905 HydrophobicContact CG-CG1 3.54Å; I905-K908 HydrophobicContact CG2-CB 4.22Å; I905-V913 HydrophobicContact CG2-CG2 4.11Å; I905-Y915 HydrophobicContact CG1-CE1 4.49Å
906	F	90.7	Very high	93.7	Very high	124 Å²	124	58.7 Å²	58.7	54%	0.544	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-53.7	176.6	178.1	-114.2	0	0	0	111	V845 K904 T914	V845-F906 HydrophobicContact CG2-CB 4.07Å; V845-F906 HydrophobicContact CG2-CD1 3.65Å; V845-F906 HydrophobicContact CG2-CE1 4.3Å; V845-F906 HydrophobicContact CG2-CG 3.93Å; K904-F906 PolarHBondContact O-N 3.44Å; F906-T914 PolarHBondContact N-O 2.83Å
907	Q	89.4	Confident	93.4	Very high	90 Å²	90	61.6 Å²	61.6	42%	0.421	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139	169.5	-63.9	179.9	9.1	0	0	109.7	V913 T914	Q907-V913 WeakPolarHBondContact O-CA 3.37Å; Q907-T914 PolarHBondContact N-O 2.66Å; Q907-T914 PolarHBondContact N-OG1 3.08Å; Q907-T914 PolarHBondContact O-N 3.01Å
908	K	90	Very high	93.1	Very high	173 Å²	173	67.4 Å²	67.4	75%	0.752	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	112	166.9	-170.3	-172.6	-179.9	-167.9	0	108.1	I905	I905-K908 HydrophobicContact CG2-CB 4.22Å
909	K	90.8	Very high	92.9	Very high	130 Å²	130	69.3 Å²	69.3	57%	0.565	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.1	167.5	170.7	-60.4	-179.1	-178.7	-179.3	0	108.3	N911 S912	K909-N911 PolarHBondContact O-N 3.3Å; K909-S912 WeakPolarHBondContact CA-O 3.39Å; K909-S912 PolarHBondContact N-O 2.7Å; K909-S912 PolarHBondContact O-N 3.38Å; K909-S912 VanDerWaalsContact O-O 3.11Å
910	K	88.9	Confident	92.7	Very high	207 Å²	207	70.7 Å²	70.7	90%	0.9	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-41	-177.2	-168.1	-178.4	179.7	179.1	0	113.1
911	N	89.1	Confident	92.5	Very high	149 Å²	149	72 Å²	72	80%	0.797	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	8.1	-174.3	-59.8	36.9	0	0	0	113.5	K909	K909-N911 PolarHBondContact O-N 3.3Å
912	S	88.8	Confident	92.4	Very high	65 Å²	65	75.4 Å²	75.4	46%	0.455	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	146.2	-179.8	57.6	0	0	0	0	113.5	K909	K909-S912 WeakPolarHBondContact CA-O 3.39Å; K909-S912 PolarHBondContact N-O 2.7Å; K909-S912 PolarHBondContact O-N 3.38Å; K909-S912 VanDerWaalsContact O-O 3.11Å
913	V	94	Very high	92.4	Very high	36 Å²	36	75.4 Å²	75.4	22%	0.218	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	136.6	176.8	58	0	0	0	0	109.7	I905 Q907 Y915	I905-V913 HydrophobicContact CG2-CG2 4.11Å; Q907-V913 WeakPolarHBondContact O-CA 3.37Å; V913-Y915 HydrophobicContact CG1-CE2 3.97Å; V913-Y915 VanDerWaalsContact CG1-OH 3.31Å; V913-Y915 WeakPolarHBondContact CG1-OH 3.17Å; V913-Y915 HydrophobicContact CG2-CE1 4.02Å; V913-Y915 HydrophobicContact CG2-CE2 4.4Å
914	T	94.3	Very high	92.3	Very high	33 Å²	33	79.8 Å²	79.8	20%	0.202	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	148.4	173.5	59.1	0	0	0	0	110.4	L843 F906 Q907	L843-T914 WeakPolarHBondContact O-CA 3.08Å; F906-T914 PolarHBondContact N-O 2.83Å; Q907-T914 PolarHBondContact N-O 2.66Å; Q907-T914 PolarHBondContact N-OG1 3.08Å; Q907-T914 PolarHBondContact O-N 3.01Å
915	Y	94.9	Very high	92.1	Very high	20 Å²	20	75.5 Å²	75.5	8%	0.078	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.6	-169.8	-55.3	-86	0	0	0	110	L843 I844 V845 E892 F894 K904 I905 V913	L843-Y915 HydrophobicContact CB-CD2 3.89Å; L843-Y915 HydrophobicContact CB-CE2 4.1Å; L843-Y915 HydrophobicContact CD1-CE2 4.2Å; L843-Y915 PolarHBondContact O-N 3.4Å; I844-Y915 CarbonylContact C-O 3.56Å; I844-Y915 WeakPolarHBondContact CA-O 3.27Å; V845-Y915 WeakPolarHBondContact CG2-O 3.4Å; V845-Y915 PolarHBondContact N-O 2.85Å; E892-Y915 HydrophobicContact CB-CD1 3.68Å; E892-Y915 HydrophobicContact CB-CE1 3.68Å; E892-Y915 HydrophobicContact CG-CD1 3.85Å; E892-Y915 HydrophobicContact CG-CE1 3.76Å; F894-Y915 HydrophobicContact CE2-CD1 4.31Å; F894-Y915 HydrophobicContact CE2-CD2 4.27Å; F894-Y915 HydrophobicContact CE2-CE1 4.47Å; F894-Y915 HydrophobicContact CE2-CE2 4.44Å; F894-Y915 HydrophobicContact CE2-CG 4.2Å; F894-Y915 HydrophobicContact CZ-CD1 4.39Å; F894-Y915 HydrophobicContact CZ-CD2 4.01Å; F894-Y915 HydrophobicContact CZ-CE1 4.16Å; F894-Y915 AromaticContact CZ-CE2 3.76Å; F894-Y915 HydrophobicContact CZ-CE2 3.76Å; F894-Y915 HydrophobicContact CZ-CG 4.32Å; F894-Y915 AromaticContact CZ-CZ 3.83Å; K904-Y915 CarbonylContact O-C 3.51Å; I905-Y915 HydrophobicContact CG1-CE1 4.49Å; V913-Y915 HydrophobicContact CG1-CE2 3.97Å; V913-Y915 VanDerWaalsContact CG1-OH 3.31Å; V913-Y915 WeakPolarHBondContact CG1-OH 3.17Å; V913-Y915 HydrophobicContact CG2-CE1 4.02Å; V913-Y915 HydrophobicContact CG2-CE2 4.4Å
916	S	92.6	Very high	92.3	Very high	24 Å²	24	73.5 Å²	73.5	17%	0.168	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	120.8	167.6	56.6	0	0	0	0	109.8	V845 T903 K904	V845-S916 WeakPolarHBondContact O-CA 3.27Å; T903-S916 CarbonylContact C-O 3.49Å; T903-S916 VanDerWaalsContact CA-O 3.27Å; T903-S916 WeakPolarHBondContact CA-O 3.21Å; T903-S916 VanDerWaalsContact CB-O 3.29Å; T903-S916 WeakPolarHBondContact CB-O 3.47Å; K904-S916 PolarHBondContact N-O 2.59Å; K904-S916 PolarHBondContact O-N 2.79Å; K904-S916 PolarHBondContact O-OG 3.28Å
917	F	92.4	Very high	92.5	Very high	61 Å²	61	71.8 Å²	71.8	27%	0.268	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	142.1	171	-178.3	-95.6	0	0	0	110.8	I844 V845 V901	I844-F917 HydrophobicContact CG2-CB 3.92Å; I844-F917 HydrophobicContact CG2-CD2 4.39Å; V845-F917 PolarHBondContact O-N 3.03Å; V901-F917 HydrophobicContact CG1-CD2 4.05Å; V901-F917 HydrophobicContact CG1-CE2 3.97Å
918	R	91.2	Very high	92.9	Very high	124 Å²	124	68 Å²	68	47%	0.468	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-59.3	170.8	-68	-56.6	-164.7	100.4	-18.8	111.9	V902 K904	V902-R918 HydrophobicContact CG1-CB 4.45Å; V902-R918 WeakPolarHBondContact O-CB 3.41Å; V902-R918 PolarHBondContact O-N 2.82Å; K904-R918 HydrophobicContact CB-CG 4.48Å
919	Q	91.8	Very high	93.3	Very high	64 Å²	64	63.7 Å²	63.7	30%	0.299	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	164	-175.6	59	-164.9	10.8	0	0	110.2	V902 F921 I955	V902-Q919 HydrophobicContact CB-CG 3.86Å; V902-Q919 HydrophobicContact CG1-CG 4.39Å; V902-Q919 HydrophobicContact CG2-CG 4.14Å; V902-Q919 PolarHBondContact N-O 3.48Å; V902-Q919 PolarHBondContact O-N 2.96Å; Q919-F921 HydrophobicContact CG-CE2 3.96Å; Q919-F921 HydrophobicContact CG-CZ 3.99Å; Q919-I955 VanDerWaalsContact NE2-CD1 3.32Å
920	S	92.6	Very high	93.6	Very high	41 Å²	41	61.6 Å²	61.6	29%	0.287	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	145.1	176.1	53.9	0	0	0	0	110.7	L900	L900-S920 CarbonylContact O-C 3.53Å; L900-S920 WeakPolarHBondContact O-CA 3.5Å
921	F	94.1	Very high	94	Very high	29 Å²	29	53.6 Å²	53.6	13%	0.127	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.8	-179.7	-55.3	-74.5	0	0	0	109.9	L900 V902 Q919 M926 L954 I955	L900-F921 HydrophobicContact CD2-CD2 4.35Å; L900-F921 PolarHBondContact N-O 2.98Å; L900-F921 PolarHBondContact O-N 3.34Å; V902-F921 HydrophobicContact CG2-CD2 4.36Å; V902-F921 HydrophobicContact CG2-CE2 4.06Å; Q919-F921 HydrophobicContact CG-CE2 3.96Å; Q919-F921 HydrophobicContact CG-CZ 3.99Å; F921-M926 HydrophobicContact CB-CE 3.56Å; F921-M926 HydrophobicContact CG-CE 4.41Å; F921-L954 HydrophobicContact CD1-CB 4.14Å; F921-L954 HydrophobicContact CD1-CD1 4.11Å; F921-L954 HydrophobicContact CD1-CD2 4.21Å; F921-L954 HydrophobicContact CD1-CG 4.39Å; F921-L954 HydrophobicContact CE1-CB 3.87Å; F921-L954 HydrophobicContact CE1-CD2 4.25Å; F921-L954 HydrophobicContact CE1-CG 4.48Å; F921-L954 HydrophobicContact CG-CD1 4.46Å; F921-L954 HydrophobicContact CZ-CB 4.24Å; F921-I955 HydrophobicContact CD2-CG2 4.45Å; F921-I955 HydrophobicContact CE2-CB 4.27Å; F921-I955 HydrophobicContact CE2-CG2 3.69Å; F921-I955 HydrophobicContact CZ-CB 4.24Å; F921-I955 HydrophobicContact CZ-CG2 4.06Å
922	S	94.1	Very high	94.4	Very high	71 Å²	71	52.7 Å²	52.7	50%	0.497	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	142.4	165.2	179.4	0	0	0	0	109.5	Y924 M926	S922-Y924 VanDerWaalsContact C-N 3.29Å; S922-Y924 PolarHBondContact OG-N 2.95Å; S922-M926 WeakPolarHBondContact O-CE 3.3Å
923	L	96.3	Very high	94.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	-77.8	-15	174.1	-60.4	-173.9	0	0	0	112.9	L895 D898 L900 G925 M926 L972 I976 V979	L895-L923 HydrophobicContact CD1-CD1 3.96Å; L895-L923 HydrophobicContact CD1-CD2 4.25Å; D898-L923 PolarHBondContact O-N 2.66Å; D898-L923 VanDerWaalsContact O-N 3.1Å; L900-L923 HydrophobicContact CB-CD2 4.04Å; L923-G925 PolarHBondContact O-N 2.99Å; L923-M926 HydrophobicContact CD2-CE 3.87Å; L923-M926 HydrophobicContact CD2-SD 3.91Å; L923-M926 WeakPolarHBondContact O-CB 3.04Å; L923-M926 PolarHBondContact O-N 3.2Å; L923-M926 VanDerWaalsContact O-N 3.1Å; L923-L972 HydrophobicContact CD2-CD1 3.51Å; L923-I976 HydrophobicContact CB-CG1 4.01Å; L923-I976 HydrophobicContact CD2-CG1 4.25Å; L923-I976 HydrophobicContact CG-CG1 4.5Å; L923-V979 HydrophobicContact CB-CB 4.49Å; L923-V979 HydrophobicContact CB-CG2 4.2Å
924	Y	93.7	Very high	94.8	Very high	92 Å²	92	58.4 Å²	58.4	36%	0.361	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	130.3	175.9	178.4	-107.5	0	0	0	111.2	S922 M926 E983	S922-Y924 VanDerWaalsContact C-N 3.29Å; S922-Y924 PolarHBondContact OG-N 2.95Å; Y924-M926 PolarHBondContact O-N 3.28Å; Y924-E983 HydrophobicContact CD2-CB 4.17Å; Y924-E983 HydrophobicContact CD2-CG 3.98Å; Y924-E983 HydrophobicContact CE2-CB 4.13Å; Y924-E983 HydrophobicContact CE2-CG 3.59Å
925	G	91.9	Very high	94.8	Very high	9 Å²	9	61 Å²	61	9%	0.093	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	67	5.3	-174.3	0	0	0	0	0	114.8	L923 S944 A945	L923-G925 PolarHBondContact O-N 2.99Å; G925-S944 CarbonylContact O-C 3.55Å; G925-S944 WeakPolarHBondContact O-CA 2.96Å; G925-A945 PolarHBondContact O-N 3.45Å
926	M	96.4	Very high	94.9	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	143.7	176.7	-171	-179.1	-66.9	0	0	111.1	L900 F921 S922 L923 Y924 L942 T943 L954 L972 I976	L900-M926 HydrophobicContact CD2-CE 4.42Å; F921-M926 HydrophobicContact CB-CE 3.56Å; F921-M926 HydrophobicContact CG-CE 4.41Å; S922-M926 WeakPolarHBondContact O-CE 3.3Å; L923-M926 HydrophobicContact CD2-CE 3.87Å; L923-M926 HydrophobicContact CD2-SD 3.91Å; L923-M926 WeakPolarHBondContact O-CB 3.04Å; L923-M926 PolarHBondContact O-N 3.2Å; L923-M926 VanDerWaalsContact O-N 3.1Å; Y924-M926 PolarHBondContact O-N 3.28Å; M926-L942 HydrophobicContact SD-CB 4.41Å; M926-L942 HydrophobicContact SD-CD1 4.02Å; M926-L942 HydrophobicContact SD-CD2 4.3Å; M926-L942 HydrophobicContact SD-CG 4.48Å; M926-T943 CarbonylContact C-O 3.59Å; M926-T943 WeakPolarHBondContact CA-O 3.33Å; M926-L954 HydrophobicContact CE-CD1 4.13Å; M926-L972 HydrophobicContact SD-CD1 4.16Å; M926-L972 HydrophobicContact SD-CD2 4.45Å; M926-I976 HydrophobicContact CB-CD1 3.91Å; M926-I976 HydrophobicContact CB-CG1 4.21Å; M926-I976 HydrophobicContact CG-CD1 3.9Å; M926-I976 WeakPolarHBondContact O-CG2 3.4Å; M926-I976 HydrophobicContact SD-CD1 4Å
927	Q	95.8	Very high	95.1	Very high	87 Å²	87	62.3 Å²	62.3	41%	0.407	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	149.2	169.1	-66.7	179.7	-9.6	0	0	110.5	L942 T943 A945	Q927-L942 WeakPolarHBondContact O-CA 3.33Å; Q927-T943 PolarHBondContact N-O 2.72Å; Q927-T943 PolarHBondContact O-N 3.2Å; Q927-T943 VanDerWaalsContact O-N 3.09Å; Q927-A945 HydrophobicContact CG-CB 4.12Å
928	V	97.7	Very high	95.4	Very high	12 Å²	12	59.9 Å²	59.9	7%	0.073	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	114.6	-179.7	-172.4	0	0	0	0	109.5	I940 L942 T969 L972 R973 I976	V928-I940 HydrophobicContact CG1-CG2 4.18Å; V928-L942 HydrophobicContact CB-CD2 4.4Å; V928-L942 HydrophobicContact CG1-CD2 4.15Å; V928-L942 HydrophobicContact CG2-CD2 4.02Å; V928-T969 HydrophobicContact CG1-CG2 3.77Å; V928-L972 HydrophobicContact CG1-CD2 4.5Å; V928-L972 HydrophobicContact CG2-CD2 3.59Å; V928-L972 HydrophobicContact CG2-CG 3.78Å; V928-R973 HydrophobicContact CB-CG 4.37Å; V928-R973 HydrophobicContact CG2-CG 4.35Å; V928-R973 PolarHBondContact O-NH1 3.23Å; V928-R973 VanDerWaalsContact O-NH1 3.14Å; V928-R973 PolarHBondContact O-NH2 3.43Å; V928-I976 HydrophobicContact CG2-CD1 3.6Å
929	M	97.1	Very high	95.7	Very high	81 Å²	81	54 Å²	54	40%	0.399	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	143.2	169.7	-72.7	-178.4	-83.1	0	0	110.1	R941 T943	M929-R941 HydrophobicContact CB-CB 4.26Å; M929-R941 HydrophobicContact CE-CG 4.11Å; M929-R941 PolarHBondContact N-O 2.67Å; M929-R941 PolarHBondContact O-N 3.22Å; M929-T943 HydrophobicContact CE-CG2 3.54Å; M929-T943 WeakPolarHBondContact CE-OG1 3.44Å
930	L	98.1	Very high	96	Very high	87 Å²	87	50.9 Å²	50.9	46%	0.455	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	146	167	-54.5	-175.7	0	0	0	108.2	I940 R965 T969	L930-I940 HydrophobicContact CD2-CG1 4.41Å; L930-R965 HydrophobicContact CD2-CG 4.22Å; L930-T969 HydrophobicContact CD2-CG2 3.76Å
931	F	97.6	Very high	96.3	Very high	39 Å²	39	52.6 Å²	52.6	17%	0.171	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	158.4	169.1	72.8	-90.6	0	0	0	110.7	P880 Y936 G939 R941 N956 R965	P880-F931 HydrophobicContact CB-CE2 3.86Å; P880-F931 HydrophobicContact CB-CZ 3.9Å; P880-F931 HydrophobicContact CG-CE2 4.49Å; P880-F931 HydrophobicContact CG-CZ 4.03Å; F931-Y936 HydrophobicContact CE2-CD2 4.14Å; F931-Y936 HydrophobicContact CE2-CG 4.22Å; F931-G939 PolarHBondContact N-O 3.36Å; F931-G939 CarbonylContact O-C 3.59Å; F931-G939 WeakPolarHBondContact O-CA 3.41Å; F931-G939 PolarHBondContact O-N 3.48Å; F931-G939 VanDerWaalsContact O-O 3.11Å; F931-R941 HydrophobicContact CD1-CB 4.11Å; F931-R941 HydrophobicContact CE1-CB 4.34Å; F931-N956 HydrophobicContact CE1-CB 4.15Å; F931-N956 HydrophobicContact CZ-CB 4.4Å; F931-R965 PolarHBondContact O-NH1 2.76Å; F931-R965 VanDerWaalsContact O-NH1 3.13Å
932	E	97.4	Very high	96.5	Very high	130 Å²	130	51.2 Å²	51.2	61%	0.607	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.7	129.7	-179.8	-174.7	145.3	170.8	0	0	107.9	Y936 P937 R965	E932-Y936 WeakPolarHBondContact CA-O 3.24Å; E932-P937 WeakPolarHBondContact CG-O 3.23Å; E932-R965 IonicContact OE2-CZ 2.8Å; E932-R965 IonicContact OE2-NH1 2.72Å; E932-R965 PolarHBondContact OE2-NH1 2.76Å; E932-R965 IonicContact OE2-NH2 2.82Å; E932-R965 PolarHBondContact OE2-NH2 2.71Å
933	N	95.5	Very high	96.6	Very high	54 Å²	54	48 Å²	48	29%	0.289	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	177.3	177.1	73.3	21.6	0	0	0	111.2	P880 Y935 Y936	P880-N933 PolarHBondContact O-ND2 2.73Å; N933-Y935 PolarHBondContact O-N 2.69Å; N933-Y935 PolarHBondContact OD1-N 2.75Å; N933-Y936 PolarHBondContact N-O 3.38Å; N933-Y936 VanDerWaalsContact N-O 3.08Å; N933-Y936 CarbonylContact O-C 3.46Å; N933-Y936 PolarHBondContact O-N 3.39Å; N933-Y936 VanDerWaalsContact O-N 3.12Å; N933-Y936 PolarHBondContact OD1-N 3.46Å
934	Q	95.2	Very high	96.5	Very high	166 Å²	166	49 Å²	49	78%	0.776	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-8.2	-177.8	68.5	-175.7	11.7	0	0	116
935	Y	94.9	Very high	96.3	Very high	88 Å²	88	45.9 Å²	45.9	35%	0.345	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-27.2	176.7	-49.8	-48.1	0	0	0	113.2	N881 P883 N933	N881-Y935 WeakPolarHBondContact O-CE2 3.39Å; P883-Y935 HydrophobicContact CB-CD1 3.61Å; P883-Y935 HydrophobicContact CB-CE1 3.93Å; P883-Y935 HydrophobicContact CB-CG 4.01Å; P883-Y935 HydrophobicContact CG-CD1 4.19Å; P883-Y935 HydrophobicContact CG-CE1 3.98Å; N933-Y935 PolarHBondContact O-N 2.69Å; N933-Y935 PolarHBondContact OD1-N 2.75Å
936	Y	97.2	Very high	95.9	Very high	7 Å²	7	49 Å²	49	3%	0.027	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	93.8	-170.4	-58.3	-67.4	0	0	0	110.3	V877 K882 Q884 F931 E932 N933 N938 N958	V877-Y936 HydrophobicContact CB-CE1 4.39Å; V877-Y936 HydrophobicContact CG1-CD1 4.4Å; V877-Y936 HydrophobicContact CG1-CD2 4.17Å; V877-Y936 HydrophobicContact CG1-CE1 3.88Å; V877-Y936 HydrophobicContact CG1-CE2 3.64Å; V877-Y936 VanDerWaalsContact CG1-CZ 3.49Å; V877-Y936 HydrophobicContact CG2-CD1 3.8Å; V877-Y936 HydrophobicContact CG2-CE1 3.55Å; V877-Y936 HydrophobicContact CG2-CG 4.48Å; K882-Y936 VanDerWaalsContact O-CE2 3.26Å; K882-Y936 WeakPolarHBondContact O-CE2 3.27Å; K882-Y936 PolarHBondContact O-OH 3.49Å; Q884-Y936 HydrophobicContact CG-CE1 3.97Å; Q884-Y936 WeakPolarHBondContact CG-OH 3.1Å; Q884-Y936 PolarHBondContact N-OH 2.95Å; F931-Y936 HydrophobicContact CE2-CD2 4.14Å; F931-Y936 HydrophobicContact CE2-CG 4.22Å; E932-Y936 WeakPolarHBondContact CA-O 3.24Å; N933-Y936 PolarHBondContact N-O 3.38Å; N933-Y936 VanDerWaalsContact N-O 3.08Å; N933-Y936 CarbonylContact O-C 3.46Å; N933-Y936 PolarHBondContact O-N 3.39Å; N933-Y936 VanDerWaalsContact O-N 3.12Å; N933-Y936 PolarHBondContact OD1-N 3.46Å; Y936-N938 VanDerWaalsContact C-N 3.31Å; Y936-N958 HydrophobicContact CD1-CB 3.76Å; Y936-N958 HydrophobicContact CG-CB 4.48Å
937	P	96.3	Very high	95.1	Very high	64 Å²	64	54.2 Å²	54.2	42%	0.416	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	-31.5	177.5	27	-33.6	0	0	0	112	E932 R965	E932-P937 WeakPolarHBondContact CG-O 3.23Å; P937-R965 VanDerWaalsContact O-CZ 3.23Å; P937-R965 PolarHBondContact O-NH1 2.75Å; P937-R965 PolarHBondContact O-NH2 3.49Å; P937-R965 VanDerWaalsContact O-NH2 3.16Å
938	N	97.7	Very high	94.1	Very high	10 Å²	10	54.5 Å²	54.5	5%	0.053	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	41.6	-172	-61.7	-52.7	0	0	0	112.1	Y936 N958 A959 N961 P962 R965	Y936-N938 VanDerWaalsContact C-N 3.31Å; N938-N958 VanDerWaalsContact C-OD1 3.3Å; N938-N958 WeakPolarHBondContact CA-OD1 3.33Å; N938-N958 PolarHBondContact N-OD1 2.95Å; N938-N958 WeakPolarHBondContact O-CA 3.41Å; N938-A959 HydrophobicContact CB-CB 3.96Å; N938-A959 VanDerWaalsContact CB-O 3.29Å; N938-A959 WeakPolarHBondContact CB-O 3.39Å; N938-A959 PolarHBondContact ND2-O 3.27Å; N938-A959 PolarHBondContact O-N 3.48Å; N938-N961 WeakPolarHBondContact ND2-CA 3.25Å; N938-P962 WeakPolarHBondContact OD1-CA 2.99Å; N938-P962 WeakPolarHBondContact OD1-CG 3.29Å; N938-R965 HydrophobicContact CB-CB 4.36Å
939	G	97.9	Very high	93.4	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	138.9	-177.5	0	0	0	0	0	114.1	F931 F957	F931-G939 PolarHBondContact N-O 3.36Å; F931-G939 CarbonylContact O-C 3.59Å; F931-G939 WeakPolarHBondContact O-CA 3.41Å; F931-G939 PolarHBondContact O-N 3.48Å; F931-G939 VanDerWaalsContact O-O 3.11Å; G939-F957 WeakPolarHBondContact CA-O 3.47Å
940	I	98.7	Very high	93	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	127.6	174.3	-54.3	165.3	0	0	0	107.5	L874 V928 L930 L942 N956 F957 A959 R965 F968 T969	L874-I940 HydrophobicContact CD1-CD1 4.37Å; L874-I940 HydrophobicContact CD2-CD1 4.37Å; V928-I940 HydrophobicContact CG1-CG2 4.18Å; L930-I940 HydrophobicContact CD2-CG1 4.41Å; I940-L942 HydrophobicContact CG2-CD2 4.12Å; I940-N956 CarbonylContact O-C 3.57Å; I940-N956 WeakPolarHBondContact O-CA 3.4Å; I940-F957 HydrophobicContact CB-CB 4.4Å; I940-F957 PolarHBondContact N-O 3.47Å; I940-F957 PolarHBondContact O-N 2.99Å; I940-A959 HydrophobicContact CD1-CB 4.48Å; I940-R965 HydrophobicContact CD1-CB 4.45Å; I940-R965 HydrophobicContact CD1-CG 4.21Å; I940-R965 HydrophobicContact CG1-CG 4Å; I940-F968 HydrophobicContact CD1-CD1 4.05Å; I940-T969 HydrophobicContact CD1-CG2 3.89Å; I940-T969 HydrophobicContact CG1-CG2 4.01Å; I940-T969 HydrophobicContact CG2-CG2 3.87Å
941	R	98.4	Very high	92.7	Very high	77 Å²	77	61.6 Å²	61.6	29%	0.291	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129	173.7	170.7	173.1	-71.5	-173.6	2.2	109.5	M929 F931 T943 V953 N956	M929-R941 HydrophobicContact CB-CB 4.26Å; M929-R941 HydrophobicContact CE-CG 4.11Å; M929-R941 PolarHBondContact N-O 2.67Å; M929-R941 PolarHBondContact O-N 3.22Å; F931-R941 HydrophobicContact CD1-CB 4.11Å; F931-R941 HydrophobicContact CE1-CB 4.34Å; R941-T943 HydrophobicContact CG-CG2 4.34Å; R941-V953 HydrophobicContact CG-CG1 4.26Å; R941-N956 PolarHBondContact NE-OD1 3.23Å; R941-N956 PolarHBondContact NH2-OD1 2.93Å
942	L	98.3	Very high	92.5	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.5	171.9	-53.9	-173.8	0	0	0	109.2	L900 M926 Q927 V928 I940 L954 I955 F957 L972	L900-L942 HydrophobicContact CD2-CD1 3.38Å; M926-L942 HydrophobicContact SD-CB 4.41Å; M926-L942 HydrophobicContact SD-CD1 4.02Å; M926-L942 HydrophobicContact SD-CD2 4.3Å; M926-L942 HydrophobicContact SD-CG 4.48Å; Q927-L942 WeakPolarHBondContact O-CA 3.33Å; V928-L942 HydrophobicContact CB-CD2 4.4Å; V928-L942 HydrophobicContact CG1-CD2 4.15Å; V928-L942 HydrophobicContact CG2-CD2 4.02Å; I940-L942 HydrophobicContact CG2-CD2 4.12Å; L942-L954 HydrophobicContact CB-CB 4.44Å; L942-L954 PolarHBondContact O-N 3.15Å; L942-I955 HydrophobicContact CB-CG2 4.07Å; L942-I955 HydrophobicContact CD1-CG2 3.83Å; L942-I955 HydrophobicContact CG-CG2 4.16Å; L942-I955 PolarHBondContact N-O 2.66Å; L942-I955 PolarHBondContact O-N 2.85Å; L942-F957 HydrophobicContact CD1-CE2 4.02Å; L942-L972 HydrophobicContact CD1-CD2 4.35Å; L942-L972 HydrophobicContact CD2-CD2 3.64Å
943	T	96.8	Very high	92.4	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.012	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	155.1	174.5	37.7	0	0	0	0	110.5	M926 Q927 M929 R941 I951 K952 V953	M926-T943 CarbonylContact C-O 3.59Å; M926-T943 WeakPolarHBondContact CA-O 3.33Å; Q927-T943 PolarHBondContact N-O 2.72Å; Q927-T943 PolarHBondContact O-N 3.2Å; Q927-T943 VanDerWaalsContact O-N 3.09Å; M929-T943 HydrophobicContact CE-CG2 3.54Å; M929-T943 WeakPolarHBondContact CE-OG1 3.44Å; R941-T943 HydrophobicContact CG-CG2 4.34Å; T943-I951 HydrophobicContact CG2-CG2 3.77Å; T943-K952 CarbonylContact C-O 3.51Å; T943-K952 VanDerWaalsContact CA-O 3.27Å; T943-K952 WeakPolarHBondContact CA-O 3.47Å; T943-V953 HydrophobicContact CG2-CB 4.43Å; T943-V953 HydrophobicContact CG2-CG2 3.95Å
944	S	93.5	Very high	92.5	Very high	23 Å²	23	63.1 Å²	63.1	16%	0.161	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	133.3	161.4	-174.2	0	0	0	0	108.5	G925 I951 K952	G925-S944 CarbonylContact O-C 3.55Å; G925-S944 WeakPolarHBondContact O-CA 2.96Å; S944-I951 CarbonylContact O-C 3.48Å; S944-I951 WeakPolarHBondContact O-CA 3.43Å; S944-K952 PolarHBondContact N-O 3.29Å; S944-K952 PolarHBondContact O-N 2.72Å
945	A	89.6	Confident	92.6	Very high	25 Å²	25	55.7 Å²	55.7	21%	0.207	32%	0.324	C	S	.	.			trans	-134.4	68.7	175.7	0	0	0	0	0	108.1	G925 Q927 I951	G925-A945 PolarHBondContact O-N 3.45Å; Q927-A945 HydrophobicContact CG-CB 4.12Å; A945-I951 HydrophobicContact CB-CG1 4.35Å
946	I	84.9	Confident	92.7	Very high	74 Å²	74	52 Å²	52	38%	0.379	31%	0.311	S	S	.	.			trans	-77	132.4	174.7	-65.7	166.9	0	0	0	107.8	G948 A949	I946-G948 PolarHBondContact O-N 2.89Å; I946-A949 PolarHBondContact O-N 2.9Å
947	P	77.9	Confident	92.8	Very high	112 Å²	112	51.7 Å²	51.7	73%	0.727	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	129.5	178	-27.3	35.3	0	0	0	112.2
948	G	75.3	Confident	92.9	Very high	94 Å²	94	49.4 Å²	49.4	97%	0.969	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	8.2	-176.8	0	0	0	0	0	115.5	I946	I946-G948 PolarHBondContact O-N 2.89Å
949	A	84.3	Confident	92.9	Very high	63 Å²	63	49 Å²	49	52%	0.521	29%	0.291	S	S	.	.	S	Bend	trans	-131.5	152.4	174.2	0	0	0	0	0	112.1	I946	I946-A949 PolarHBondContact O-N 2.9Å
950	D	87.8	Confident	92.8	Very high	152 Å²	152	52 Å²	52	81%	0.813	31%	0.311	S	S	*	.			trans	-60.4	149.5	177.4	-69.3	-48.2	0	0	0	113.2	K952	D950-K952 PolarHBondContact O-N 3.11Å
951	I	92.1	Very high	92.8	Very high	114 Å²	114	54.6 Å²	54.6	59%	0.585	33%	0.325	S	S	*	.			trans	-70.4	92.6	178.3	-56.3	179.7	0	0	0	110.1	T943 S944 A945	T943-I951 HydrophobicContact CG2-CG2 3.77Å; S944-I951 CarbonylContact O-C 3.48Å; S944-I951 WeakPolarHBondContact O-CA 3.43Å; A945-I951 HydrophobicContact CB-CG1 4.35Å
952	K	93.7	Very high	92.7	Very high	145 Å²	145	54.1 Å²	54.1	63%	0.63	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.2	-177.8	-176	173.6	-178.3	176	0	111.4	T943 S944 D950 L954	T943-K952 CarbonylContact C-O 3.51Å; T943-K952 VanDerWaalsContact CA-O 3.27Å; T943-K952 WeakPolarHBondContact CA-O 3.47Å; S944-K952 PolarHBondContact N-O 3.29Å; S944-K952 PolarHBondContact O-N 2.72Å; D950-K952 PolarHBondContact O-N 3.11Å; K952-L954 PolarHBondContact O-N 2.97Å
953	V	95.7	Very high	92.7	Very high	64 Å²	64	60.5 Å²	60.5	39%	0.388	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	125.7	167.5	-177.5	0	0	0	0	109.3	R941 T943	R941-V953 HydrophobicContact CG-CG1 4.26Å; T943-V953 HydrophobicContact CG2-CB 4.43Å; T943-V953 HydrophobicContact CG2-CG2 3.95Å
954	L	95.8	Very high	92.8	Very high	46 Å²	46	63.3 Å²	63.3	24%	0.241	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-50	-179.2	-63.7	177.6	0	0	0	111.5	F921 M926 L942 K952	F921-L954 HydrophobicContact CD1-CB 4.14Å; F921-L954 HydrophobicContact CD1-CD1 4.11Å; F921-L954 HydrophobicContact CD1-CD2 4.21Å; F921-L954 HydrophobicContact CD1-CG 4.39Å; F921-L954 HydrophobicContact CE1-CB 3.87Å; F921-L954 HydrophobicContact CE1-CD2 4.25Å; F921-L954 HydrophobicContact CE1-CG 4.48Å; F921-L954 HydrophobicContact CG-CD1 4.46Å; F921-L954 HydrophobicContact CZ-CB 4.24Å; M926-L954 HydrophobicContact CE-CD1 4.13Å; L942-L954 HydrophobicContact CB-CB 4.44Å; L942-L954 PolarHBondContact O-N 3.15Å; K952-L954 PolarHBondContact O-N 2.97Å
955	I	97.7	Very high	93	Very high	9 Å²	9	63.8 Å²	63.8	5%	0.046	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	151.5	178.6	-179.5	153.8	0	0	0	109.8	E876 Q919 F921 L942 F957	E876-I955 HydrophobicContact CB-CD1 4.31Å; E876-I955 HydrophobicContact CG-CD1 3.71Å; E876-I955 HydrophobicContact CG-CG1 4.16Å; Q919-I955 VanDerWaalsContact NE2-CD1 3.32Å; F921-I955 HydrophobicContact CD2-CG2 4.45Å; F921-I955 HydrophobicContact CE2-CB 4.27Å; F921-I955 HydrophobicContact CE2-CG2 3.69Å; F921-I955 HydrophobicContact CZ-CB 4.24Å; F921-I955 HydrophobicContact CZ-CG2 4.06Å; L942-I955 HydrophobicContact CB-CG2 4.07Å; L942-I955 HydrophobicContact CD1-CG2 3.83Å; L942-I955 HydrophobicContact CG-CG2 4.16Å; L942-I955 PolarHBondContact N-O 2.66Å; L942-I955 PolarHBondContact O-N 2.85Å; I955-F957 HydrophobicContact CB-CE2 4.4Å; I955-F957 HydrophobicContact CD1-CD1 4.35Å; I955-F957 HydrophobicContact CD1-CE1 3.56Å; I955-F957 HydrophobicContact CD1-CE2 4.04Å; I955-F957 HydrophobicContact CD1-CZ 3.37Å; I955-F957 HydrophobicContact CG1-CD1 4.47Å; I955-F957 HydrophobicContact CG1-CD2 4.33Å; I955-F957 HydrophobicContact CG1-CE1 4.06Å; I955-F957 HydrophobicContact CG1-CE2 3.92Å; I955-F957 HydrophobicContact CG1-CZ 3.78Å; I955-F957 HydrophobicContact CG2-CD2 4.3Å; I955-F957 HydrophobicContact CG2-CE2 3.57Å; I955-F957 HydrophobicContact CG2-CZ 3.99Å
956	N	98.3	Very high	93.4	Very high	12 Å²	12	68.7 Å²	68.7	6%	0.064	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	148.2	164.3	-40.5	-91.5	0	0	0	109.5	V877 P880 F931 I940 R941	V877-N956 HydrophobicContact CB-CB 4.1Å; V877-N956 PolarHBondContact N-O 2.71Å; V877-N956 WeakPolarHBondContact O-CB 3.1Å; V877-N956 PolarHBondContact O-ND2 2.99Å; P880-N956 HydrophobicContact CG-CB 3.84Å; P880-N956 VanDerWaalsContact CG-CG 3.41Å; F931-N956 HydrophobicContact CE1-CB 4.15Å; F931-N956 HydrophobicContact CZ-CB 4.4Å; I940-N956 CarbonylContact O-C 3.57Å; I940-N956 WeakPolarHBondContact O-CA 3.4Å; R941-N956 PolarHBondContact NE-OD1 3.23Å; R941-N956 PolarHBondContact NH2-OD1 2.93Å
957	F	98.3	Very high	94	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	161.3	172.9	-63.5	-74.9	0	0	0	110.5	L874 F875 E876 R891 I893 V902 G939 I940 L942 I955	L874-F957 HydrophobicContact CB-CB 4.11Å; L874-F957 HydrophobicContact CB-CD1 3.72Å; L874-F957 HydrophobicContact CB-CE1 4.36Å; L874-F957 HydrophobicContact CB-CG 4.05Å; L874-F957 HydrophobicContact CD1-CB 3.96Å; L874-F957 HydrophobicContact CD1-CD1 4.14Å; L874-F957 HydrophobicContact CD1-CD2 3.93Å; L874-F957 HydrophobicContact CD1-CE2 4.42Å; L874-F957 HydrophobicContact CD1-CG 3.77Å; F875-F957 CarbonylContact O-C 3.6Å; F875-F957 WeakPolarHBondContact O-CA 3.44Å; E876-F957 HydrophobicContact CB-CD1 4.26Å; E876-F957 HydrophobicContact CB-CE1 4.27Å; R891-F957 HydrophobicContact CB-CE1 4.44Å; R891-F957 HydrophobicContact CG-CE1 4.34Å; I893-F957 HydrophobicContact CD1-CE1 3.75Å; I893-F957 HydrophobicContact CD1-CZ 3.75Å; V902-F957 HydrophobicContact CG2-CZ 4.11Å; G939-F957 WeakPolarHBondContact CA-O 3.47Å; I940-F957 HydrophobicContact CB-CB 4.4Å; I940-F957 PolarHBondContact N-O 3.47Å; I940-F957 PolarHBondContact O-N 2.99Å; L942-F957 HydrophobicContact CD1-CE2 4.02Å; I955-F957 HydrophobicContact CB-CE2 4.4Å; I955-F957 HydrophobicContact CD1-CD1 4.35Å; I955-F957 HydrophobicContact CD1-CE1 3.56Å; I955-F957 HydrophobicContact CD1-CE2 4.04Å; I955-F957 HydrophobicContact CD1-CZ 3.37Å; I955-F957 HydrophobicContact CG1-CD1 4.47Å; I955-F957 HydrophobicContact CG1-CD2 4.33Å; I955-F957 HydrophobicContact CG1-CE1 4.06Å; I955-F957 HydrophobicContact CG1-CE2 3.92Å; I955-F957 HydrophobicContact CG1-CZ 3.78Å; I955-F957 HydrophobicContact CG2-CD2 4.3Å; I955-F957 HydrophobicContact CG2-CE2 3.57Å; I955-F957 HydrophobicContact CG2-CZ 3.99Å
958	N	97.9	Very high	95	Very high	16 Å²	16	66.4 Å²	66.4	9%	0.086	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.5	159	175.6	84	0	0	0	108.4	F875 V877 Y936 N938	F875-N958 PolarHBondContact N-O 2.83Å; F875-N958 PolarHBondContact O-N 3.33Å; V877-N958 HydrophobicContact CG2-CB 3.85Å; Y936-N958 HydrophobicContact CD1-CB 3.76Å; Y936-N958 HydrophobicContact CG-CB 4.48Å; N938-N958 VanDerWaalsContact C-OD1 3.3Å; N938-N958 WeakPolarHBondContact CA-OD1 3.33Å; N938-N958 PolarHBondContact N-OD1 2.95Å; N938-N958 WeakPolarHBondContact O-CA 3.41Å
959	A	97.9	Very high	96.1	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.322	C	S	.	.			trans	-79.5	156	176.6	0	0	0	0	0	111.5	L874 N938 I940 N961 D964 R965	L874-A959 HydrophobicContact CD2-CB 3.66Å; N938-A959 HydrophobicContact CB-CB 3.96Å; N938-A959 VanDerWaalsContact CB-O 3.29Å; N938-A959 WeakPolarHBondContact CB-O 3.39Å; N938-A959 PolarHBondContact ND2-O 3.27Å; N938-A959 PolarHBondContact O-N 3.48Å; I940-A959 HydrophobicContact CD1-CB 4.48Å; A959-N961 VanDerWaalsContact C-N 3.27Å; A959-N961 PolarHBondContact O-N 2.95Å; A959-D964 HydrophobicContact CB-CB 4.44Å; A959-R965 HydrophobicContact CB-CB 3.77Å
960	P	97.1	Very high	96.8	Very high	64 Å²	64	62.5 Å²	62.5	42%	0.416	32%	0.316	S	S	.	.	S	Bend	trans	-61.6	-33.9	176.5	24.4	-34.7	0	0	0	113.1	R873 F875 D964	R873-P960 WeakPolarHBondContact O-CD 3.15Å; F875-P960 HydrophobicContact CE2-CB 4.22Å; P960-D964 HydrophobicContact CG-CB 4.13Å; P960-D964 WeakPolarHBondContact CG-OD2 3.38Å
961	N	97.1	Very high	97.3	Very high	55 Å²	55	57.6 Å²	57.6	29%	0.294	29%	0.29	S	S	.	.	S	Bend	trans	-148.9	168.1	-179.2	63.7	70.3	0	0	0	111.1	N938 A959 Q963 D964 R965	N938-N961 WeakPolarHBondContact ND2-CA 3.25Å; A959-N961 VanDerWaalsContact C-N 3.27Å; A959-N961 PolarHBondContact O-N 2.95Å; N961-Q963 VanDerWaalsContact C-N 3.26Å; N961-Q963 PolarHBondContact O-N 3.28Å; N961-Q963 WeakPolarHBondContact OD1-CA 3.37Å; N961-Q963 WeakPolarHBondContact OD1-CB 3.23Å; N961-Q963 PolarHBondContact OD1-N 3.04Å; N961-D964 PolarHBondContact ND2-OD2 2.92Å; N961-D964 PolarHBondContact OD1-N 2.92Å; N961-R965 PolarHBondContact O-N 2.9Å; N961-R965 VanDerWaalsContact O-N 3.15Å
962	P	97.8	Very high	97.6	Very high	67 Å²	67	52.2 Å²	52.2	44%	0.435	26%	0.262	S	S	.	.	H	α-helix	trans	-63.9	-25.4	-178.9	-24	34.3	0	0	0	114.9	N938 R965 K966	N938-P962 WeakPolarHBondContact OD1-CA 2.99Å; N938-P962 WeakPolarHBondContact OD1-CG 3.29Å; P962-R965 WeakPolarHBondContact O-CB 3.26Å; P962-K966 WeakPolarHBondContact O-CB 3.37Å; P962-K966 PolarHBondContact O-N 2.75Å
963	Q	98	Very high	97.8	Very high	134 Å²	134	50.3 Å²	50.3	63%	0.626	25%	0.251	S	S	*	.	H	α-helix	trans	-81.6	-40.1	-174.3	-41.1	-53.8	3	0	0	111.2	N961 R965 K966 K967	N961-Q963 VanDerWaalsContact C-N 3.26Å; N961-Q963 PolarHBondContact O-N 3.28Å; N961-Q963 WeakPolarHBondContact OD1-CA 3.37Å; N961-Q963 WeakPolarHBondContact OD1-CB 3.23Å; N961-Q963 PolarHBondContact OD1-N 3.04Å; Q963-R965 VanDerWaalsContact C-N 3.33Å; Q963-K966 PolarHBondContact O-N 2.8Å; Q963-K967 VanDerWaalsContact O-CB 3.31Å; Q963-K967 WeakPolarHBondContact O-CB 3.4Å; Q963-K967 PolarHBondContact O-N 3.46Å
964	D	97.4	Very high	97.9	Very high	61 Å²	61	49.2 Å²	49.2	33%	0.326	24%	0.241	S	C	.	.	H	α-helix	trans	-64.6	-37.2	168	-74.9	-39.1	0	0	0	111.3	A959 P960 N961 F968	A959-D964 HydrophobicContact CB-CB 4.44Å; P960-D964 HydrophobicContact CG-CB 4.13Å; P960-D964 WeakPolarHBondContact CG-OD2 3.38Å; N961-D964 PolarHBondContact ND2-OD2 2.92Å; N961-D964 PolarHBondContact OD1-N 2.92Å; D964-F968 VanDerWaalsContact O-CB 3.26Å; D964-F968 WeakPolarHBondContact O-CB 3.05Å; D964-F968 PolarHBondContact O-N 2.84Å; D964-F968 VanDerWaalsContact O-N 3.13Å
965	R	98.3	Very high	98	Very high	33 Å²	33	47.2 Å²	47.2	13%	0.125	23%	0.231	C	C	.	.	H	α-helix	trans	-55.9	-58.2	169	169.3	164.4	71.8	171.7	-3.8	110	L930 F931 E932 P937 N938 I940 A959 N961 P962 Q963 T969	L930-R965 HydrophobicContact CD2-CG 4.22Å; F931-R965 PolarHBondContact O-NH1 2.76Å; F931-R965 VanDerWaalsContact O-NH1 3.13Å; E932-R965 IonicContact OE2-CZ 2.8Å; E932-R965 IonicContact OE2-NH1 2.72Å; E932-R965 PolarHBondContact OE2-NH1 2.76Å; E932-R965 IonicContact OE2-NH2 2.82Å; E932-R965 PolarHBondContact OE2-NH2 2.71Å; P937-R965 VanDerWaalsContact O-CZ 3.23Å; P937-R965 PolarHBondContact O-NH1 2.75Å; P937-R965 PolarHBondContact O-NH2 3.49Å; P937-R965 VanDerWaalsContact O-NH2 3.16Å; N938-R965 HydrophobicContact CB-CB 4.36Å; I940-R965 HydrophobicContact CD1-CB 4.45Å; I940-R965 HydrophobicContact CD1-CG 4.21Å; I940-R965 HydrophobicContact CG1-CG 4Å; A959-R965 HydrophobicContact CB-CB 3.77Å; N961-R965 PolarHBondContact O-N 2.9Å; N961-R965 VanDerWaalsContact O-N 3.15Å; P962-R965 WeakPolarHBondContact O-CB 3.26Å; Q963-R965 VanDerWaalsContact C-N 3.33Å; R965-T969 WeakPolarHBondContact O-CG2 3.4Å; R965-T969 PolarHBondContact O-N 3.47Å; R965-T969 VanDerWaalsContact O-N 3.07Å; R965-T969 PolarHBondContact O-OG1 2.82Å
966	K	98	Very high	98.1	Very high	127 Å²	127	47.2 Å²	47.2	55%	0.552	23%	0.231	S	C	*	.	H	α-helix	trans	-55.6	-61	-177.6	179.1	176.5	177.4	-174.4	0	111.1	P962 Q963 F968 T969 D970	P962-K966 WeakPolarHBondContact O-CB 3.37Å; P962-K966 PolarHBondContact O-N 2.75Å; Q963-K966 PolarHBondContact O-N 2.8Å; K966-F968 PolarHBondContact O-N 2.79Å; K966-T969 CarbonylContact O-C 3.12Å; K966-T969 PolarHBondContact O-N 3.25Å; K966-T969 PolarHBondContact O-OG1 2.77Å; K966-D970 WeakPolarHBondContact CE-OD2 3.33Å; K966-D970 WeakPolarHBondContact CG-OD2 3.49Å; K966-D970 VanDerWaalsContact O-CG 3.29Å; K966-D970 PolarHBondContact O-N 3.5Å
967	K	98	Very high	98	Very high	135 Å²	135	47.6 Å²	47.6	59%	0.587	24%	0.236	S	C	*	.	H	α-helix	trans	-53.6	-51.2	-175.2	-177.4	179.4	178.8	-179.4	0	112.3	Q963 T969 D970 D971	Q963-K967 VanDerWaalsContact O-CB 3.31Å; Q963-K967 WeakPolarHBondContact O-CB 3.4Å; Q963-K967 PolarHBondContact O-N 3.46Å; K967-T969 VanDerWaalsContact C-N 3.31Å; K967-T969 PolarHBondContact O-N 3.29Å; K967-D970 PolarHBondContact O-N 3.08Å; K967-D971 WeakPolarHBondContact O-CB 3.19Å; K967-D971 PolarHBondContact O-N 2.76Å
968	F	98.6	Very high	98	Very high	3 Å²	3	47.7 Å²	47.7	1%	0.013	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-39.6	178.3	173	-99.2	0	0	0	112	C872 L874 I893 L900 I940 D964 K966 L972	C872-F968 HydrophobicContact CB-CD2 3.94Å; L874-F968 HydrophobicContact CD1-CD1 3.84Å; L874-F968 HydrophobicContact CD1-CE1 3.72Å; L874-F968 HydrophobicContact CD1-CG 4.29Å; L874-F968 HydrophobicContact CD1-CZ 4.09Å; I893-F968 HydrophobicContact CG2-CE2 3.73Å; I893-F968 HydrophobicContact CG2-CZ 4.09Å; L900-F968 HydrophobicContact CD1-CE2 4.02Å; L900-F968 HydrophobicContact CD1-CZ 3.87Å; L900-F968 HydrophobicContact CD2-CZ 4.5Å; I940-F968 HydrophobicContact CD1-CD1 4.05Å; D964-F968 VanDerWaalsContact O-CB 3.26Å; D964-F968 WeakPolarHBondContact O-CB 3.05Å; D964-F968 PolarHBondContact O-N 2.84Å; D964-F968 VanDerWaalsContact O-N 3.13Å; K966-F968 PolarHBondContact O-N 2.79Å; F968-L972 HydrophobicContact CE1-CD2 3.8Å; F968-L972 HydrophobicContact CZ-CD2 3.96Å; F968-L972 WeakPolarHBondContact O-CB 3.14Å; F968-L972 PolarHBondContact O-N 3.46Å
969	T	98.5	Very high	97.9	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-75.4	-27.3	178.6	60.4	0	0	0	0	113.9	V928 L930 I940 R965 K966 K967 R973	V928-T969 HydrophobicContact CG1-CG2 3.77Å; L930-T969 HydrophobicContact CD2-CG2 3.76Å; I940-T969 HydrophobicContact CD1-CG2 3.89Å; I940-T969 HydrophobicContact CG1-CG2 4.01Å; I940-T969 HydrophobicContact CG2-CG2 3.87Å; R965-T969 WeakPolarHBondContact O-CG2 3.4Å; R965-T969 PolarHBondContact O-N 3.47Å; R965-T969 VanDerWaalsContact O-N 3.07Å; R965-T969 PolarHBondContact O-OG1 2.82Å; K966-T969 CarbonylContact O-C 3.12Å; K966-T969 PolarHBondContact O-N 3.25Å; K966-T969 PolarHBondContact O-OG1 2.77Å; K967-T969 VanDerWaalsContact C-N 3.31Å; K967-T969 PolarHBondContact O-N 3.29Å; T969-R973 VanDerWaalsContact O-CB 3.26Å; T969-R973 WeakPolarHBondContact O-CB 3.36Å; T969-R973 WeakPolarHBondContact O-CD 3.45Å; T969-R973 WeakPolarHBondContact O-CG 3.42Å; T969-R973 PolarHBondContact O-N 2.68Å
970	D	98	Very high	97.8	Very high	74 Å²	74	51.7 Å²	51.7	40%	0.396	26%	0.256	S	S	.	.	H	α-helix	trans	-70.8	-50	173.8	-66.5	-11.6	0	0	0	109.8	K966 K967 L972 R973 E974	K966-D970 WeakPolarHBondContact CE-OD2 3.33Å; K966-D970 WeakPolarHBondContact CG-OD2 3.49Å; K966-D970 VanDerWaalsContact O-CG 3.29Å; K966-D970 PolarHBondContact O-N 3.5Å; K967-D970 PolarHBondContact O-N 3.08Å; D970-L972 VanDerWaalsContact C-N 3.31Å; D970-L972 PolarHBondContact O-N 2.84Å; D970-R973 PolarHBondContact O-N 3.41Å; D970-E974 PolarHBondContact O-N 2.59Å
971	D	98.4	Very high	97.7	Very high	49 Å²	49	50.7 Å²	50.7	26%	0.262	25%	0.245	S	C	.	.	H	α-helix	trans	-56.6	-43	174	-74	-28.2	0	0	0	111.8	V869 L895 K967 S975	V869-D971 HydrophobicContact CG1-CB 4.16Å; L895-D971 HydrophobicContact CD2-CB 3.96Å; K967-D971 WeakPolarHBondContact O-CB 3.19Å; K967-D971 PolarHBondContact O-N 2.76Å; D971-S975 WeakPolarHBondContact O-CB 3.24Å; D971-S975 PolarHBondContact O-N 3.04Å; D971-S975 PolarHBondContact O-OG 2.85Å
972	L	98.6	Very high	97.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-69.4	-41.9	179	179	61.5	0	0	0	112.6	L895 L923 M926 V928 L942 F968 D970 S975 I976	L895-L972 HydrophobicContact CD1-CD1 3.69Å; L895-L972 HydrophobicContact CD2-CB 4.21Å; L923-L972 HydrophobicContact CD2-CD1 3.51Å; M926-L972 HydrophobicContact SD-CD1 4.16Å; M926-L972 HydrophobicContact SD-CD2 4.45Å; V928-L972 HydrophobicContact CG1-CD2 4.5Å; V928-L972 HydrophobicContact CG2-CD2 3.59Å; V928-L972 HydrophobicContact CG2-CG 3.78Å; L942-L972 HydrophobicContact CD1-CD2 4.35Å; L942-L972 HydrophobicContact CD2-CD2 3.64Å; F968-L972 HydrophobicContact CE1-CD2 3.8Å; F968-L972 HydrophobicContact CZ-CD2 3.96Å; F968-L972 WeakPolarHBondContact O-CB 3.14Å; F968-L972 PolarHBondContact O-N 3.46Å; D970-L972 VanDerWaalsContact C-N 3.31Å; D970-L972 PolarHBondContact O-N 2.84Å; L972-S975 PolarHBondContact O-N 3.35Å; L972-I976 HydrophobicContact CD1-CD1 4Å; L972-I976 HydrophobicContact CD1-CG1 4.29Å; L972-I976 HydrophobicContact CG-CD1 3.9Å; L972-I976 WeakPolarHBondContact O-CB 3.38Å; L972-I976 WeakPolarHBondContact O-CD1 3.28Å; L972-I976 VanDerWaalsContact O-CG1 3.26Å; L972-I976 WeakPolarHBondContact O-CG1 3.29Å; L972-I976 PolarHBondContact O-N 2.85Å
973	R	98.3	Very high	97.3	Very high	106 Å²	106	48.2 Å²	48.2	40%	0.4	23%	0.226	S	C	.	.	H	α-helix	trans	-62.6	-44.6	176.8	-79.4	171.2	-166.9	-64.4	-6.3	111.4	V928 T969 D970 S975 I976 A977	V928-R973 HydrophobicContact CB-CG 4.37Å; V928-R973 HydrophobicContact CG2-CG 4.35Å; V928-R973 PolarHBondContact O-NH1 3.23Å; V928-R973 VanDerWaalsContact O-NH1 3.14Å; V928-R973 PolarHBondContact O-NH2 3.43Å; T969-R973 VanDerWaalsContact O-CB 3.26Å; T969-R973 WeakPolarHBondContact O-CB 3.36Å; T969-R973 WeakPolarHBondContact O-CD 3.45Å; T969-R973 WeakPolarHBondContact O-CG 3.42Å; T969-R973 PolarHBondContact O-N 2.68Å; D970-R973 PolarHBondContact O-N 3.41Å; R973-S975 VanDerWaalsContact C-N 3.34Å; R973-I976 PolarHBondContact O-N 3.05Å; R973-A977 PolarHBondContact O-N 3.11Å
974	E	98.1	Very high	97.1	Very high	40 Å²	40	46 Å²	46	19%	0.187	21%	0.214	C	C	.	.	H	α-helix	trans	-67	-36.5	178.3	-178.5	55.4	-156	0	0	111.8	R641 R644 D970 A977 E978	R641-E974 WeakPolarHBondContact CB-OE1 3.45Å; R641-E974 WeakPolarHBondContact CG-OE1 3.49Å; R641-E974 IonicContact CZ-OE1 3.35Å; R641-E974 IonicContact CZ-OE2 3.41Å; R641-E974 IonicContact NE-OE1 3.38Å; R641-E974 PolarHBondContact NE-OE1 2.69Å; R641-E974 IonicContact NE-OE2 2.91Å; R641-E974 PolarHBondContact NE-OE2 2.83Å; R641-E974 IonicContact NH2-OE1 3.53Å; R641-E974 IonicContact NH2-OE2 3.58Å; R641-E974 PolarHBondContact NH2-OE2 3.38Å; R644-E974 IonicContact CZ-OE1 2.82Å; R644-E974 IonicContact NH1-OE1 3.06Å; R644-E974 PolarHBondContact NH1-OE1 2.94Å; R644-E974 IonicContact NH2-OE1 3.36Å; R644-E974 PolarHBondContact NH2-OE1 3.43Å; D970-E974 PolarHBondContact O-N 2.59Å; E974-A977 PolarHBondContact O-N 3.09Å; E974-E978 WeakPolarHBondContact O-CB 3.09Å; E974-E978 PolarHBondContact O-N 2.93Å
975	S	98.6	Very high	96.8	Very high	4 Å²	4	44.4 Å²	44.4	3%	0.028	20%	0.204	C	C	.	.	H	α-helix	trans	-66.8	-39.7	174	-55.5	0	0	0	0	112.2	D971 L972 R973 E978 V979	D971-S975 WeakPolarHBondContact O-CB 3.24Å; D971-S975 PolarHBondContact O-N 3.04Å; D971-S975 PolarHBondContact O-OG 2.85Å; L972-S975 PolarHBondContact O-N 3.35Å; R973-S975 VanDerWaalsContact C-N 3.34Å; S975-E978 PolarHBondContact O-N 3.18Å; S975-V979 WeakPolarHBondContact O-CG2 3.35Å; S975-V979 PolarHBondContact O-N 3.46Å
976	I	98	Very high	96.5	Very high	10 Å²	10	48.6 Å²	48.6	5%	0.051	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-43.6	172.9	-71.8	164.1	0	0	0	110.9	L923 M926 V928 L972 R973 V979 Q980	L923-I976 HydrophobicContact CB-CG1 4.01Å; L923-I976 HydrophobicContact CD2-CG1 4.25Å; L923-I976 HydrophobicContact CG-CG1 4.5Å; M926-I976 HydrophobicContact CB-CD1 3.91Å; M926-I976 HydrophobicContact CB-CG1 4.21Å; M926-I976 HydrophobicContact CG-CD1 3.9Å; M926-I976 WeakPolarHBondContact O-CG2 3.4Å; M926-I976 HydrophobicContact SD-CD1 4Å; V928-I976 HydrophobicContact CG2-CD1 3.6Å; L972-I976 HydrophobicContact CD1-CD1 4Å; L972-I976 HydrophobicContact CD1-CG1 4.29Å; L972-I976 HydrophobicContact CG-CD1 3.9Å; L972-I976 WeakPolarHBondContact O-CB 3.38Å; L972-I976 WeakPolarHBondContact O-CD1 3.28Å; L972-I976 VanDerWaalsContact O-CG1 3.26Å; L972-I976 WeakPolarHBondContact O-CG1 3.29Å; L972-I976 PolarHBondContact O-N 2.85Å; R973-I976 PolarHBondContact O-N 3.05Å; I976-V979 PolarHBondContact O-N 3.02Å; I976-Q980 HydrophobicContact CG2-CG 4.28Å; I976-Q980 WeakPolarHBondContact O-CB 3.26Å; I976-Q980 VanDerWaalsContact O-CG 3.3Å; I976-Q980 WeakPolarHBondContact O-CG 3.27Å; I976-Q980 PolarHBondContact O-N 2.98Å
977	A	97.6	Very high	96.1	Very high	20 Å²	20	45.9 Å²	45.9	17%	0.165	21%	0.211	C	C	.	.	H	α-helix	trans	-65.6	-37.1	177.6	0	0	0	0	0	112.7	R973 E974 E981	R973-A977 PolarHBondContact O-N 3.11Å; E974-A977 PolarHBondContact O-N 3.09Å; A977-E981 WeakPolarHBondContact O-CB 3.48Å; A977-E981 PolarHBondContact O-N 3.31Å
978	E	97.6	Very high	95.8	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-42.7	172	-177.3	175.7	139.7	0	0	111.7	R641 R644 I645 N648 E974 S975 M982	R641-E978 HydrophobicContact CG-CB 4.19Å; R644-E978 IonicContact CZ-OE2 2.69Å; R644-E978 IonicContact NE-OE2 3.99Å; R644-E978 PolarHBondContact NE-OE2 3.45Å; R644-E978 IonicContact NH2-OE2 2.66Å; R644-E978 PolarHBondContact NH2-OE2 2.98Å; I645-E978 HydrophobicContact CG1-CG 4.11Å; N648-E978 PolarHBondContact ND2-OE1 3.44Å; E974-E978 WeakPolarHBondContact O-CB 3.09Å; E974-E978 PolarHBondContact O-N 2.93Å; S975-E978 PolarHBondContact O-N 3.18Å; E978-M982 VanDerWaalsContact O-CB 3.23Å; E978-M982 WeakPolarHBondContact O-CB 3.27Å; E978-M982 PolarHBondContact O-N 3Å; E978-M982 VanDerWaalsContact O-N 3.09Å
979	V	97	Very high	95.2	Very high	10 Å²	10	44.8 Å²	44.8	6%	0.061	21%	0.211	C	C	.	.	H	α-helix	trans	-71.5	-41	177.4	171.8	0	0	0	0	112.6	N897 D898 L923 S975 I976 M982 E983	N897-V979 WeakPolarHBondContact O-CG2 3.27Å; D898-V979 HydrophobicContact CB-CG2 4.48Å; L923-V979 HydrophobicContact CB-CB 4.49Å; L923-V979 HydrophobicContact CB-CG2 4.2Å; S975-V979 WeakPolarHBondContact O-CG2 3.35Å; S975-V979 PolarHBondContact O-N 3.46Å; I976-V979 PolarHBondContact O-N 3.02Å; V979-M982 HydrophobicContact CG2-CE 4.37Å; V979-M982 PolarHBondContact O-N 2.8Å; V979-E983 WeakPolarHBondContact O-CB 3.33Å; V979-E983 PolarHBondContact O-N 3.5Å
980	Q	95	Very high	94.7	Very high	91 Å²	91	48.2 Å²	48.2	43%	0.425	23%	0.226	S	C	.	.	H	α-helix	trans	-63	-46.9	178.5	-75.5	173.7	-4.2	0	0	111.8	I976 E983 K984	I976-Q980 HydrophobicContact CG2-CG 4.28Å; I976-Q980 WeakPolarHBondContact O-CB 3.26Å; I976-Q980 VanDerWaalsContact O-CG 3.3Å; I976-Q980 WeakPolarHBondContact O-CG 3.27Å; I976-Q980 PolarHBondContact O-N 2.98Å; Q980-E983 PolarHBondContact O-N 3.49Å; Q980-K984 WeakPolarHBondContact O-CB 3.48Å; Q980-K984 PolarHBondContact O-N 3.08Å
981	E	95.6	Very high	94.3	Very high	42 Å²	42	48.8 Å²	48.8	20%	0.196	23%	0.229	C	C	.	.	H	α-helix	trans	-71.5	-32.7	179.2	-172.2	67.3	-159.5	0	0	111.9	H642 I645 A977 K984 Y985	H642-E981 IonicContact CE1-OE1 3.25Å; I645-E981 HydrophobicContact CD1-CB 3.71Å; I645-E981 HydrophobicContact CD1-CG 3.7Å; A977-E981 WeakPolarHBondContact O-CB 3.48Å; A977-E981 PolarHBondContact O-N 3.31Å; E981-K984 IonicContact OE1-NZ 3.61Å; E981-K984 PolarHBondContact OE1-NZ 3.34Å; E981-K984 WeakPolarHBondContact OE2-CD 3.47Å; E981-K984 IonicContact OE2-NZ 3.17Å; E981-K984 PolarHBondContact OE2-NZ 2.97Å; E981-Y985 WeakPolarHBondContact O-CB 3.42Å; E981-Y985 PolarHBondContact O-N 2.76Å
982	M	93.9	Very high	93.8	Very high	23 Å²	23	51.6 Å²	51.6	11%	0.113	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-41.9	171	178.2	179.4	55.8	0	0	112.3	I645 N648 E978 V979 R986	I645-M982 HydrophobicContact CG1-CB 4.47Å; I645-M982 HydrophobicContact CG2-CB 4.3Å; N648-M982 HydrophobicContact CB-SD 3.96Å; E978-M982 VanDerWaalsContact O-CB 3.23Å; E978-M982 WeakPolarHBondContact O-CB 3.27Å; E978-M982 PolarHBondContact O-N 3Å; E978-M982 VanDerWaalsContact O-N 3.09Å; V979-M982 HydrophobicContact CG2-CE 4.37Å; V979-M982 PolarHBondContact O-N 2.8Å; M982-R986 PolarHBondContact O-N 2.99Å
983	E	92.5	Very high	93.2	Very high	47 Å²	47	56.7 Å²	56.7	22%	0.22	26%	0.263	C	S	.	.	H	α-helix	trans	-74.2	-37.4	179.3	-179.5	58.3	-167.3	0	0	112.1	Y924 V979 Q980 R986 I987	Y924-E983 HydrophobicContact CD2-CB 4.17Å; Y924-E983 HydrophobicContact CD2-CG 3.98Å; Y924-E983 HydrophobicContact CE2-CB 4.13Å; Y924-E983 HydrophobicContact CE2-CG 3.59Å; V979-E983 WeakPolarHBondContact O-CB 3.33Å; V979-E983 PolarHBondContact O-N 3.5Å; Q980-E983 PolarHBondContact O-N 3.49Å; E983-R986 WeakPolarHBondContact O-CB 3.5Å; E983-R986 PolarHBondContact O-N 3.19Å; E983-R986 VanDerWaalsContact O-N 3.16Å; E983-R986 IonicContact OE1-CZ 3.55Å; E983-R986 IonicContact OE1-NE 3.46Å; E983-R986 PolarHBondContact OE1-NE 3.16Å; E983-R986 IonicContact OE1-NH2 3.86Å; E983-R986 PolarHBondContact OE1-NH2 2.9Å; E983-R986 WeakPolarHBondContact OE2-CD 3.41Å; E983-R986 IonicContact OE2-CZ 2.71Å; E983-R986 IonicContact OE2-NE 3.68Å; E983-R986 PolarHBondContact OE2-NE 3.23Å; E983-I987 HydrophobicContact CG-CD1 4.26Å; E983-I987 WeakPolarHBondContact O-CG1 3.31Å; E983-I987 PolarHBondContact O-N 2.89Å
984	K	92.4	Very high	92.3	Very high	87 Å²	87	57.2 Å²	57.2	38%	0.378	27%	0.27	S	S	.	.	H	α-helix	trans	-55.5	-51	168.5	170.8	-173.6	155.2	-147.1	0	111.1	Q980 E981 R986 I987 E988	Q980-K984 WeakPolarHBondContact O-CB 3.48Å; Q980-K984 PolarHBondContact O-N 3.08Å; E981-K984 IonicContact OE1-NZ 3.61Å; E981-K984 PolarHBondContact OE1-NZ 3.34Å; E981-K984 WeakPolarHBondContact OE2-CD 3.47Å; E981-K984 IonicContact OE2-NZ 3.17Å; E981-K984 PolarHBondContact OE2-NZ 2.97Å; K984-R986 VanDerWaalsContact C-N 3.27Å; K984-R986 PolarHBondContact O-N 3.39Å; K984-I987 WeakPolarHBondContact O-CB 3.25Å; K984-I987 PolarHBondContact O-N 2.83Å; K984-E988 WeakPolarHBondContact CE-OE1 3.45Å; K984-E988 HydrophobicContact CG-CG 4.44Å; K984-E988 WeakPolarHBondContact CG-OE1 3.04Å; K984-E988 WeakPolarHBondContact O-CG 3.44Å; K984-E988 PolarHBondContact O-N 3.41Å
985	Y	91.6	Very high	91.3	Very high	29 Å²	29	61.3 Å²	61.3	11%	0.114	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-35.2	176	175.6	-109.2	0	0	0	112.5	L649 Y660 E981 S989	L649-Y985 HydrophobicContact CD1-CD1 3.72Å; L649-Y985 HydrophobicContact CD1-CE1 3.48Å; L649-Y985 VanDerWaalsContact CD1-CE1 3.48Å; L649-Y985 HydrophobicContact CD2-CD1 4.01Å; L649-Y985 HydrophobicContact CD2-CE1 3.94Å; L649-Y985 HydrophobicContact CG-CD1 4.49Å; L649-Y985 HydrophobicContact CG-CE1 4.38Å; Y660-Y985 HydrophobicContact CD2-CD1 4.26Å; Y660-Y985 HydrophobicContact CD2-CD2 4.22Å; Y660-Y985 AromaticContact CD2-CE1 3.76Å; Y660-Y985 HydrophobicContact CD2-CE1 3.76Å; Y660-Y985 AromaticContact CD2-CE2 3.74Å; Y660-Y985 HydrophobicContact CD2-CE2 3.74Å; Y660-Y985 HydrophobicContact CD2-CG 4.46Å; Y660-Y985 AromaticContact CD2-CZ 3.48Å; Y660-Y985 VanDerWaalsContact CD2-CZ 3.48Å; Y660-Y985 HydrophobicContact CE2-CD1 4.11Å; Y660-Y985 AromaticContact CE2-CD2 3.82Å; Y660-Y985 HydrophobicContact CE2-CD2 3.82Å; Y660-Y985 HydrophobicContact CE2-CE1 4.09Å; Y660-Y985 AromaticContact CE2-CE2 3.8Å; Y660-Y985 HydrophobicContact CE2-CE2 3.8Å; Y660-Y985 AromaticContact CE2-CG 3.97Å; Y660-Y985 HydrophobicContact CE2-CG 3.97Å; Y660-Y985 AromaticContact CE2-CZ 3.94Å; E981-Y985 WeakPolarHBondContact O-CB 3.42Å; E981-Y985 PolarHBondContact O-N 2.76Å; Y985-S989 WeakPolarHBondContact O-CB 3.47Å; Y985-S989 PolarHBondContact O-N 3.47Å
986	R	91.9	Very high	89.3	Confident	121 Å²	121	64.1 Å²	64.1	46%	0.457	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-42.7	173	-166.6	-160.4	64.9	70.4	-0.7	111.6	M982 E983 K984 E990	M982-R986 PolarHBondContact O-N 2.99Å; E983-R986 WeakPolarHBondContact O-CB 3.5Å; E983-R986 PolarHBondContact O-N 3.19Å; E983-R986 VanDerWaalsContact O-N 3.16Å; E983-R986 IonicContact OE1-CZ 3.55Å; E983-R986 IonicContact OE1-NE 3.46Å; E983-R986 PolarHBondContact OE1-NE 3.16Å; E983-R986 IonicContact OE1-NH2 3.86Å; E983-R986 PolarHBondContact OE1-NH2 2.9Å; E983-R986 WeakPolarHBondContact OE2-CD 3.41Å; E983-R986 IonicContact OE2-CZ 2.71Å; E983-R986 IonicContact OE2-NE 3.68Å; E983-R986 PolarHBondContact OE2-NE 3.23Å; K984-R986 VanDerWaalsContact C-N 3.27Å; K984-R986 PolarHBondContact O-N 3.39Å; R986-E990 WeakPolarHBondContact O-CB 3.22Å; R986-E990 PolarHBondContact O-N 3.49Å; R986-E990 VanDerWaalsContact O-N 3.14Å
987	I	90.8	Very high	87.2	Confident	70 Å²	70	69.7 Å²	69.7	36%	0.359	35%	0.351	S	S	.	.	H	α-helix	trans	-67.4	-48.4	178.1	-67.2	162.8	0	0	0	110.5	E983 K984 S989 E990 L991	E983-I987 HydrophobicContact CG-CD1 4.26Å; E983-I987 WeakPolarHBondContact O-CG1 3.31Å; E983-I987 PolarHBondContact O-N 2.89Å; K984-I987 WeakPolarHBondContact O-CB 3.25Å; K984-I987 PolarHBondContact O-N 2.83Å; I987-S989 PolarHBondContact O-N 3.42Å; I987-E990 PolarHBondContact O-N 3.07Å; I987-E990 VanDerWaalsContact O-N 3.13Å; I987-L991 HydrophobicContact CG2-CD1 3.89Å; I987-L991 HydrophobicContact CG2-CG 4.39Å; I987-L991 WeakPolarHBondContact O-CG 3.41Å; I987-L991 PolarHBondContact O-N 3.2Å
988	E	90.8	Very high	84.7	Confident	89 Å²	89	74.3 Å²	74.3	42%	0.416	38%	0.377	S	S	.	.	H	α-helix	trans	-57.2	-47.2	176.6	-70.3	167.7	170.2	0	0	111.4	K984 E990 L991 E992	K984-E988 WeakPolarHBondContact CE-OE1 3.45Å; K984-E988 HydrophobicContact CG-CG 4.44Å; K984-E988 WeakPolarHBondContact CG-OE1 3.04Å; K984-E988 WeakPolarHBondContact O-CG 3.44Å; K984-E988 PolarHBondContact O-N 3.41Å; E988-E990 VanDerWaalsContact C-N 3.26Å; E988-E990 PolarHBondContact O-N 3.13Å; E988-L991 PolarHBondContact O-N 3.1Å; E988-E992 PolarHBondContact O-N 3.37Å
989	S	87	Confident	81.8	Confident	26 Å²	26	85.1 Å²	85.1	18%	0.182	42%	0.417	C	S	.	.	H	α-helix	trans	-66.6	-23.2	178	-167.4	0	0	0	0	113.7	K656 Y985 I987 K993	K656-S989 PolarHBondContact NZ-OG 3.08Å; Y985-S989 WeakPolarHBondContact O-CB 3.47Å; Y985-S989 PolarHBondContact O-N 3.47Å; I987-S989 PolarHBondContact O-N 3.42Å; S989-K993 WeakPolarHBondContact O-CG 3.15Å
990	E	88.3	Confident	79	Confident	73 Å²	73	89.9 Å²	89.9	34%	0.341	45%	0.448	S	S	.	.	H	α-helix	trans	-87.2	-34.1	175.4	-151.2	64.1	-140.3	0	0	112.1	R986 I987 E988 K993 Q994	R986-E990 WeakPolarHBondContact O-CB 3.22Å; R986-E990 PolarHBondContact O-N 3.49Å; R986-E990 VanDerWaalsContact O-N 3.14Å; I987-E990 PolarHBondContact O-N 3.07Å; I987-E990 VanDerWaalsContact O-N 3.13Å; E988-E990 VanDerWaalsContact C-N 3.26Å; E988-E990 PolarHBondContact O-N 3.13Å; E990-K993 VanDerWaalsContact OE1-CD 3.23Å; E990-K993 WeakPolarHBondContact OE1-CD 3.25Å; E990-K993 IonicContact OE1-NZ 3.81Å; E990-K993 PolarHBondContact OE1-NZ 3.42Å; E990-K993 IonicContact OE2-NZ 3.56Å; E990-K993 PolarHBondContact OE2-NZ 3.16Å; E990-Q994 WeakPolarHBondContact O-CG 3.23Å; E990-Q994 PolarHBondContact O-N 3Å
991	L	89.7	Confident	76.1	Confident	87 Å²	87	91.2 Å²	91.2	46%	0.455	47%	0.468	S	S	.	.	H	α-helix	trans	-65.2	-39.6	172.2	-72.6	169.3	0	0	0	111.8	I987 E988 K993 Q994 K995	I987-L991 HydrophobicContact CG2-CD1 3.89Å; I987-L991 HydrophobicContact CG2-CG 4.39Å; I987-L991 WeakPolarHBondContact O-CG 3.41Å; I987-L991 PolarHBondContact O-N 3.2Å; E988-L991 PolarHBondContact O-N 3.1Å; L991-K993 PolarHBondContact O-N 3.14Å; L991-Q994 WeakPolarHBondContact O-CB 3.36Å; L991-Q994 PolarHBondContact O-N 3.36Å; L991-Q994 VanDerWaalsContact O-N 3.09Å; L991-K995 PolarHBondContact O-N 3.4Å; L991-K995 VanDerWaalsContact O-N 3.07Å
992	E	86.6	Confident	73.3	Confident	108 Å²	108	96.9 Å²	96.9	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-66.3	-37.7	-179	-156.3	58.9	-137.9	0	0	112.4	E988 Q994 K995 G996	E988-E992 PolarHBondContact O-N 3.37Å; E992-Q994 VanDerWaalsContact C-N 3.27Å; E992-Q994 PolarHBondContact O-N 3.07Å; E992-K995 PolarHBondContact O-N 3.2Å; E992-K995 WeakPolarHBondContact OE1-CD 3.39Å; E992-K995 IonicContact OE1-NZ 3.09Å; E992-K995 WeakPolarHBondContact OE2-CE 3.12Å; E992-K995 IonicContact OE2-NZ 3.22Å; E992-K995 PolarHBondContact OE2-NZ 2.72Å; E992-G996 PolarHBondContact O-N 2.82Å; E992-G996 VanDerWaalsContact O-N 3.07Å
993	K	85.5	Confident	70.4	Confident	107 Å²	107	100.9 Å²	100.9	47%	0.465	53%	0.527	S	S	.	.	H	α-helix	trans	-56.4	-42.2	169.7	-67.5	169.2	178.2	175.4	0	112	S989 E990 L991 G996 V997	S989-K993 WeakPolarHBondContact O-CG 3.15Å; E990-K993 VanDerWaalsContact OE1-CD 3.23Å; E990-K993 WeakPolarHBondContact OE1-CD 3.25Å; E990-K993 IonicContact OE1-NZ 3.81Å; E990-K993 PolarHBondContact OE1-NZ 3.42Å; E990-K993 IonicContact OE2-NZ 3.56Å; E990-K993 PolarHBondContact OE2-NZ 3.16Å; L991-K993 PolarHBondContact O-N 3.14Å; K993-G996 PolarHBondContact O-N 3.44Å; K993-V997 PolarHBondContact O-N 3.08Å
994	Q	80.7	Confident	67.8	Low	117 Å²	117	108.2 Å²	108.2	55%	0.547	56%	0.561	S	S	.	*	H	α-helix	trans	-67.4	-39.1	-178.2	-67.5	172.5	20.4	0	0	111.1	E990 L991 E992 G996 V997	E990-Q994 WeakPolarHBondContact O-CG 3.23Å; E990-Q994 PolarHBondContact O-N 3Å; L991-Q994 WeakPolarHBondContact O-CB 3.36Å; L991-Q994 PolarHBondContact O-N 3.36Å; L991-Q994 VanDerWaalsContact O-N 3.09Å; E992-Q994 VanDerWaalsContact C-N 3.27Å; E992-Q994 PolarHBondContact O-N 3.07Å; Q994-G996 VanDerWaalsContact C-N 3.3Å; Q994-G996 PolarHBondContact O-N 3.36Å; Q994-V997 PolarHBondContact O-N 3.27Å
995	K	76.4	Confident	64.7	Low	126 Å²	126	109.4 Å²	109.4	55%	0.548	58%	0.58	S	S	.	*	H	α-helix	trans	-59.8	-40.7	171	-61.6	-179.1	-158.7	160.7	0	112	L991 E992 V997 V998	L991-K995 PolarHBondContact O-N 3.4Å; L991-K995 VanDerWaalsContact O-N 3.07Å; E992-K995 PolarHBondContact O-N 3.2Å; E992-K995 WeakPolarHBondContact OE1-CD 3.39Å; E992-K995 IonicContact OE1-NZ 3.09Å; E992-K995 WeakPolarHBondContact OE2-CE 3.12Å; E992-K995 IonicContact OE2-NZ 3.22Å; E992-K995 PolarHBondContact OE2-NZ 2.72Å; K995-V997 PolarHBondContact O-N 3.16Å; K995-V997 VanDerWaalsContact O-N 3.14Å; K995-V998 PolarHBondContact O-N 3.11Å
996	G	56.6	Low	62	Low	63 Å²	63	113.8 Å²	113.8	65%	0.649	62%	0.615	S	S	*	*	H	α-helix	trans	-58.7	-22.1	176.9	0	0	0	0	0	114.9	E992 K993 Q994	E992-G996 PolarHBondContact O-N 2.82Å; E992-G996 VanDerWaalsContact O-N 3.07Å; K993-G996 PolarHBondContact O-N 3.44Å; Q994-G996 VanDerWaalsContact C-N 3.3Å; Q994-G996 PolarHBondContact O-N 3.36Å
997	V	53.8	Low	59.1	Low	126 Å²	126	111.1 Å²	111.1	76%	0.764	63%	0.626	S	S	*	*	H	α-helix	trans	-88.5	-20.2	176.2	178.9	0	0	0	0	112.4	K993 Q994 K995 R999	K993-V997 PolarHBondContact O-N 3.08Å; Q994-V997 PolarHBondContact O-N 3.27Å; K995-V997 PolarHBondContact O-N 3.16Å; K995-V997 VanDerWaalsContact O-N 3.14Å; V997-R999 PolarHBondContact O-N 3.1Å
998	V	44.5	Very low	56.2	Low	117 Å²	117	116.6 Å²	116.6	71%	0.709	65%	0.654	S	S	*	*			trans	-104.1	54.5	-175.2	-166.5	0	0	0	0	111.1	K995	K995-V998 PolarHBondContact O-N 3.11Å
999	R	36.9	Very low	53.5	Low	228 Å²	228	121.7 Å²	121.7	86%	0.86	68%	0.675	S	S	*	*			trans	-116.6	97.8	167.4	-164.3	173.1	-167.3	159.2	3.7	109.7	V997 S1001	V997-R999 PolarHBondContact O-N 3.1Å; R999-S1001 PolarHBondContact O-N 3.01Å
1000	P	39.8	Very low	50.9	Low	110 Å²	110	130.1 Å²	130.1	71%	0.714	71%	0.709	S	S	*	*			trans	-58.5	135.4	174.8	-22.9	33.9	0	0	0	110.8	M1002	P1000-M1002 PolarHBondContact O-N 3.23Å
1001	S	33.3	Very low	48	Very low	120 Å²	120	135 Å²	135	84%	0.839	73%	0.731	S	S	*	*			trans	-73	115.3	171.7	-173.3	0	0	0	0	109.5	R999	R999-S1001 PolarHBondContact O-N 3.01Å
1002	M	36.4	Very low	45.2	Very low	160 Å²	160	135.8 Å²	135.8	79%	0.788	75%	0.751	S	S	*	*			trans	-132.8	132.5	166.5	-78.8	-89.6	70.1	0	0	108.7	P1000	P1000-M1002 PolarHBondContact O-N 3.23Å
1003	S	32.4	Very low	42.3	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	77%	0.765	S	S	*	*			trans	47.3	92.5	173.7	57.8	0	0	0	0	116.7
1004	Q	38.1	Very low	39.6	Very low	201 Å²	201	137.5 Å²	137.5	94%	0.939	79%	0.787	S	S	*	*				-93.9	132.4	127.5	-80.2	-165.9	-3.9	0	0	108.6
1005	S	28.1	Very low	37.1	Very low	112 Å²	112	136 Å²	136	78%	0.783	80%	0.803	S	S	*	*			trans	-143	135.2	154.9	52.3	0	0	0	0	107.8
1006	S	34	Very low	34.9	Very low	121 Å²	121	133.5 Å²	133.5	85%	0.846	81%	0.813	S	S	*	*			trans	-57.2	152.3	178.8	39	0	0	0	0	112.4
1007	G	30.6	Very low	33.7	Very low	66 Å²	66	138.4 Å²	138.4	68%	0.68	82%	0.821	S	S	*	*			cis	111.7	140.1	5.7	0	0	0	0	0	112.2
1008	L	30.2	Very low	32.4	Very low	184 Å²	184	138.3 Å²	138.3	96%	0.963	82%	0.816	S	S	*	*			trans	-171	168	167.7	-109.6	168.9	0	0	0	112.4
1009	K	35.6	Very low	31.5	Very low	196 Å²	196	143.7 Å²	143.7	85%	0.852	82%	0.824	S	S	*	*			trans	-97.6	146.8	174.2	-61.4	174.9	178.6	176.5	0	110.9
1010	K	31	Very low	31	Very low	204 Å²	204	137.4 Å²	137.4	89%	0.887	82%	0.82	S	S	*	*				169.7	176.8	105.7	-152.8	169.4	177.3	-173.5	0	110.1
1011	E	28.2	Very low	30.2	Very low	174 Å²	174	136.5 Å²	136.5	81%	0.813	82%	0.817	S	S	*	*			trans	-83.3	165.2	-170.6	-53.8	-176.9	124.6	0	0	115.8
1012	A	29.7	Very low	30	Very low	105 Å²	105	138.3 Å²	138.3	87%	0.868	82%	0.816	S	S	*	*			trans	69.3	143.4	147.4	0	0	0	0	0	119.9
1013	G	26.6	Very low	29.4	Very low	78 Å²	78	137.2 Å²	137.2	80%	0.804	81%	0.813	S	S	*	*			trans	131.8	131.4	159.5	0	0	0	0	0	115.8
1014	N	27.8	Very low	29.2	Very low	173 Å²	173	138.4 Å²	138.4	93%	0.925	81%	0.812	S	S	*	*			trans	-57.8	134.8	171.2	-75.8	-23	0	0	0	113.4
1015	G	29.6	Very low	28.6	Very low	85 Å²	85	134.8 Å²	134.8	88%	0.876	81%	0.809	S	S	*	*				61.8	158.6	123.5	0	0	0	0	0	121.5
1016	G	29.3	Very low	28.5	Very low	74 Å²	74	139.6 Å²	139.6	76%	0.763	81%	0.811	S	S	*	*			trans	124.6	89.6	161.7	0	0	0	0	0	117.3
1017	M	31.1	Very low	28.3	Very low	166 Å²	166	138.3 Å²	138.3	82%	0.818	81%	0.808	S	S	*	*			trans	43.3	125.3	132.9	-60.5	178.2	66.4	0	0	122.5
1018	N	26.3	Very low	28	Very low	124 Å²	124	143.6 Å²	143.6	66%	0.663	82%	0.817	S	S	*	*				78.5	115.5	128.2	-77.3	-11.5	0	0	0	124
1019	R	27.4	Very low	27.9	Very low	230 Å²	230	137.7 Å²	137.7	87%	0.868	80%	0.8	S	S	*	*				74.1	126.2	122.6	-89	-177.9	159.4	174.5	-5.5	122.8
1020	A	25.4	Very low	27.6	Very low	95 Å²	95	137.5 Å²	137.5	79%	0.785	80%	0.802	S	S	*	*			trans	71.2	168.4	135.8	0	0	0	0	0	117.3
1021	S	24	Very low	27.6	Very low	92 Å²	92	130.9 Å²	130.9	64%	0.643	79%	0.792	S	S	*	*			cis	-157.3	150.3	-3	59	0	0	0	0	111.7
1022	L	28.7	Very low	27.6	Very low	158 Å²	158	129.3 Å²	129.3	83%	0.827	79%	0.788	S	S	*	*			trans	61.8	170	149.7	-64.3	162.6	0	0	0	116.4
1023	D	24.3	Very low	27.7	Very low	136 Å²	136	132.6 Å²	132.6	73%	0.727	78%	0.783	S	S	*	*			cis	-143.8	177.2	5.1	-148.2	-6.1	0	0	0	113.5
1024	D	26.7	Very low	27.9	Very low	133 Å²	133	139.2 Å²	139.2	71%	0.711	78%	0.784	S	S	*	*			trans	-62.9	157.9	179.2	-90.6	-43.8	0	0	0	116.4
1025	S	27	Very low	28	Very low	125 Å²	125	136.3 Å²	136.3	87%	0.874	78%	0.777	S	S	*	*				-174.2	130.9	120.3	-83.6	0	0	0	0	116.6
1026	Y	26.1	Very low	28	Very low	212 Å²	212	137.1 Å²	137.1	83%	0.831	78%	0.775	S	S	*	*			trans	-52.4	145.9	174	-95	-120.9	0	0	0	118.4
1027	A	27.8	Very low	28	Very low	94 Å²	94	141.9 Å²	141.9	78%	0.777	78%	0.783	S	S	*	*				177.3	122.5	112.5	0	0	0	0	0	110.5
1028	M	25.3	Very low	27.8	Very low	178 Å²	178	139.1 Å²	139.1	88%	0.877	78%	0.779	S	S	*	*				80.1	136.1	65.2	-114.3	-56.5	-166.9	0	0	116.2
1029	G	27.2	Very low	28	Very low	60 Å²	60	138.1 Å²	138.1	62%	0.619	78%	0.782	S	S	*	*			trans	123.5	82.7	-176.1	0	0	0	0	0	112.5
1030	E	30.6	Very low	28.1	Very low	191 Å²	191	132.6 Å²	132.6	89%	0.893	78%	0.779	S	S	*	*				62	126.8	97.4	-65.9	-158.8	122.9	0	0	116.1
1031	G	29.8	Very low	28.2	Very low	65 Å²	65	134.9 Å²	134.9	67%	0.67	78%	0.777	S	S	*	*			cis	169.4	167.9	-6.9	0	0	0	0	0	114.4
1032	L	29.9	Very low	28.5	Very low	141 Å²	141	140.3 Å²	140.3	74%	0.738	78%	0.783	S	S	*	*			trans	38.9	121.5	153.4	-73.5	94.2	0	0	0	119.5
1033	K	31.1	Very low	28.5	Very low	174 Å²	174	138.5 Å²	138.5	76%	0.757	78%	0.775	S	S	*	*				-167.6	144.9	60.2	-96.6	119	-178.6	178.3	0	114.1
1034	R	31	Very low	28.5	Very low	218 Å²	218	140.2 Å²	140.2	82%	0.823	78%	0.783	S	S	*	*				29.7	115.9	129	-58.7	-179.2	-176.9	-169.3	-0.7	118.5
1035	S	29.7	Very low	28.5	Very low	112 Å²	112	138.6 Å²	138.6	78%	0.783	78%	0.782	S	S	*	*				81.5	111.5	55.8	76.7	0	0	0	0	116.3
1036	A	28.5	Very low	28.6	Very low	101 Å²	101	141.8 Å²	141.8	84%	0.835	78%	0.783	S	S	*	*			trans	-161.1	170.4	160.9	0	0	0	0	0	110.7
1037	L	29.4	Very low	28.6	Very low	175 Å²	175	136.7 Å²	136.7	92%	0.916	79%	0.785	S	S	*	*			trans	-132.8	163.4	-174.4	-69.1	170.7	0	0	0	112.8
1038	S	28.3	Very low	28.6	Very low	107 Å²	107	135.6 Å²	135.6	75%	0.748	78%	0.783	S	S	*	*			trans	99.8	112.2	148.5	-149.7	0	0	0	0	121.1
1039	S	30.3	Very low	28.7	Very low	103 Å²	103	137.3 Å²	137.3	72%	0.72	79%	0.785	S	S	*	*				65.5	113.9	129.5	67.4	0	0	0	0	123.8
1040	S	28.2	Very low	28.7	Very low	115 Å²	115	147 Å²	147	80%	0.804	80%	0.803	S	S	*	*				111.4	154	121.6	-145.2	0	0	0	0	120.6
1041	L	28	Very low	28.5	Very low	142 Å²	142	141.1 Å²	141.1	74%	0.743	79%	0.794	S	S	*	*			trans	72.1	100.8	165.5	-71.9	166.8	0	0	0	121.9
1042	R	31	Very low	28.2	Very low	206 Å²	206	149.5 Å²	149.5	78%	0.777	81%	0.806	S	S	*	*				62.8	135.9	120.4	-87.1	-177.5	178.9	-125.9	7.5	124.3
1043	D	28.2	Very low	28	Very low	120 Å²	120	154.8 Å²	154.8	64%	0.642	82%	0.816	S	S	*	*			trans	73	126.9	141.4	-59	-28.3	0	0	0	121.1
1044	L	24.9	Very low	27.7	Very low	172 Å²	172	151.1 Å²	151.1	90%	0.901	81%	0.812	S	S	*	*			trans	65.8	147.1	170.2	-54	178	0	0	0	116.6
1045	S	26.7	Very low	27.7	Very low	100 Å²	100	146.6 Å²	146.6	70%	0.699	81%	0.814	S	S	*	*			cis	-160.4	152.7	-17.3	45.5	0	0	0	0	110.6
1046	E	28.6	Very low	27.4	Very low	191 Å²	191	146.2 Å²	146.2	89%	0.893	82%	0.818	S	S	*	*			trans	47.1	95	150.6	-169.3	162.9	-153.1	0	0	120.1
1047	A	26.6	Very low	27.7	Very low	105 Å²	105	145.4 Å²	145.4	87%	0.868	82%	0.819	S	S	*	*			trans	-160.9	143.2	144.2	0	0	0	0	0	112.9
1048	G	27	Very low	27.5	Very low	71 Å²	71	142.1 Å²	142.1	73%	0.732	81%	0.811	S	S	*	*			trans	88.1	86.3	149.6	0	0	0	0	0	119.2
1049	K	27.2	Very low	27.5	Very low	214 Å²	214	145.4 Å²	145.4	93%	0.93	82%	0.819	S	S	*	*			trans	-166.3	77.9	141.1	-106.4	150.9	-169.9	169.1	0	112.9
1050	R	27.2	Very low	27.3	Very low	263 Å²	263	147.9 Å²	147.9	99%	0.992	82%	0.824	S	S	*	*			trans	-77.9	120	152.9	-74	-170.7	-177.5	-169	1.9	107.6
1051	G	26	Very low	27.3	Very low	69 Å²	69	146.9 Å²	146.9	71%	0.711	82%	0.817	S	S	*	*			trans	-151	114.6	177.1	0	0	0	0	0	109.6
1052	R	25	Very low	27.2	Very low	241 Å²	241	147.4 Å²	147.4	91%	0.909	82%	0.821	S	S	*	*			trans	-58.3	137.5	-172.5	-69.1	175	170.8	169.6	-5.6	111.5
1053	R	25.1	Very low	27.2	Very low	252 Å²	252	142.2 Å²	142.2	95%	0.951	81%	0.806	S	S	*	*			trans	-114.5	93.7	155.3	-85	-166.2	171.7	-146.7	-1.4	109.2
1054	S	25.5	Very low	27.4	Very low	96 Å²	96	144.4 Å²	144.4	67%	0.671	81%	0.813	S	S	*	*			trans	-79.1	137.2	166.4	-59.3	0	0	0	0	110.2
1055	S	30.4	Very low	27.9	Very low	123 Å²	123	137.2 Å²	137.2	86%	0.86	78%	0.776	S	S	*	*			trans	38.9	96.4	136.5	-46	0	0	0	0	118.4
1056	A	24.3	Very low	28.3	Very low	105 Å²	105	135.7 Å²	135.7	87%	0.868	77%	0.765	S	S	*	*			trans	-121.1	87.3	154.7	0	0	0	0	0	108.6
1057	G	33.3	Very low	28.9	Very low	84 Å²	84	131 Å²	131	87%	0.866	74%	0.74	S	S	*	*			trans	-70.2	138.6	175.7	0	0	0	0	0	111.4
1058	S	24.8	Very low	29.3	Very low	106 Å²	106	131 Å²	131	74%	0.741	72%	0.72	S	S	*	*			trans	-141.5	94.6	169.9	-168.4	0	0	0	0	108.9	D1060	S1058-D1060 PolarHBondContact O-N 3.29Å
1059	L	29.6	Very low	29.9	Very low	175 Å²	175	132.5 Å²	132.5	92%	0.916	71%	0.708	S	S	*	*			trans	-67.9	114.4	168.3	-69.9	166	0	0	0	108.2
1060	D	25.4	Very low	30.5	Very low	156 Å²	156	123 Å²	123	83%	0.834	67%	0.667	S	S	*	*			trans	-153.9	61.7	172.5	-142.4	-18.4	0	0	0	110	S1058	S1058-D1060 PolarHBondContact O-N 3.29Å
1061	S	27.6	Very low	31.4	Very low	94 Å²	94	110.6 Å²	110.6	66%	0.657	62%	0.621	S	S	*	*			trans	-116.7	117.3	173	56.4	0	0	0	0	109.4	M1063	S1061-M1063 PolarHBondContact O-N 3.36Å; S1061-M1063 VanDerWaalsContact O-N 3.09Å
1062	N	27.5	Very low	32.1	Very low	152 Å²	152	110.7 Å²	110.7	81%	0.813	61%	0.61	S	S	*	*			trans	-51	113	-173.7	-173.4	35.7	0	0	0	112.3	E1064	N1062-E1064 PolarHBondContact O-N 3.28Å
1063	M	31.1	Very low	32.9	Very low	97 Å²	97	101.9 Å²	101.9	48%	0.478	58%	0.579	S	S	.	*			trans	-85	73.9	-160.3	-168.1	73.3	135	0	0	112.7	E735 S1061 V1065	E735-M1063 HydrophobicContact CG-CE 4.02Å; S1061-M1063 PolarHBondContact O-N 3.36Å; S1061-M1063 VanDerWaalsContact O-N 3.09Å; M1063-V1065 HydrophobicContact CE-CG2 4.12Å; M1063-V1065 HydrophobicContact CG-CG2 3.47Å; M1063-V1065 VanDerWaalsContact CG-CG2 3.47Å; M1063-V1065 PolarHBondContact O-N 3.21Å; M1063-V1065 VanDerWaalsContact O-N 3.12Å; M1063-V1065 HydrophobicContact SD-CG2 4Å
1064	E	32.6	Very low	33.9	Very low	166 Å²	166	90.9 Å²	90.9	78%	0.776	54%	0.539	S	S	*	.			trans	-74.4	82.8	148.9	-81.8	-163.8	121.9	0	0	107.9	N1062 S1066	N1062-E1064 PolarHBondContact O-N 3.28Å; E1064-S1066 PolarHBondContact O-N 3.48Å
1065	V	34.2	Very low	34.6	Very low	21 Å²	21	88.3 Å²	88.3	13%	0.127	52%	0.518	C	S	.	.			trans	-56.2	127.5	167.3	-152.7	0	0	0	0	106.9	M1063 W1067 Q1069 L1070	M1063-V1065 HydrophobicContact CE-CG2 4.12Å; M1063-V1065 HydrophobicContact CG-CG2 3.47Å; M1063-V1065 VanDerWaalsContact CG-CG2 3.47Å; M1063-V1065 PolarHBondContact O-N 3.21Å; M1063-V1065 VanDerWaalsContact O-N 3.12Å; M1063-V1065 HydrophobicContact SD-CG2 4Å; V1065-W1067 PolarHBondContact O-N 3.42Å; V1065-Q1069 HydrophobicContact CG1-CB 4.08Å; V1065-Q1069 HydrophobicContact CG1-CG 4.2Å; V1065-L1070 HydrophobicContact CB-CB 4.22Å; V1065-L1070 HydrophobicContact CG1-CB 3.82Å; V1065-L1070 HydrophobicContact CG2-CD1 4.4Å
1066	S	35.2	Very low	35	Very low	68 Å²	68	86.6 Å²	86.6	48%	0.476	51%	0.506	S	S	.	.			trans	-56.2	130.2	161.6	176.1	0	0	0	0	107.1	E1064 K1068 Q1069 L1070	E1064-S1066 PolarHBondContact O-N 3.48Å; S1066-K1068 PolarHBondContact O-N 3.1Å; S1066-Q1069 WeakPolarHBondContact O-CA 3.49Å; S1066-Q1069 PolarHBondContact O-N 3.32Å; S1066-L1070 PolarHBondContact O-N 3.46Å
1067	W	41.8	Very low	35.8	Very low	93 Å²	93	85.5 Å²	85.5	35%	0.352	49%	0.485	S	S	.	.	H	α-helix	trans	-56.3	-29.7	178.4	-75.7	87.1	0	0	0	111.7	L776 T779 V1065 Q1069 L1070 V1071	L776-W1067 HydrophobicContact CD2-CE3 3.77Å; L776-W1067 HydrophobicContact CD2-CZ3 3.71Å; T779-W1067 HydrophobicContact CG2-CD2 3.88Å; T779-W1067 HydrophobicContact CG2-CE3 4.31Å; T779-W1067 HydrophobicContact CG2-CH2 3.77Å; T779-W1067 HydrophobicContact CG2-CZ2 3.26Å; T779-W1067 HydrophobicContact CG2-CZ3 4.26Å; T779-W1067 WeakPolarHBondContact OG1-CH2 3.11Å; V1065-W1067 PolarHBondContact O-N 3.42Å; W1067-Q1069 VanDerWaalsContact C-N 3.28Å; W1067-Q1069 PolarHBondContact O-N 3.01Å; W1067-L1070 HydrophobicContact CZ3-CD1 4.31Å; W1067-V1071 VanDerWaalsContact O-CB 3.24Å; W1067-V1071 WeakPolarHBondContact O-CB 3.44Å; W1067-V1071 WeakPolarHBondContact O-CG2 3.42Å; W1067-V1071 PolarHBondContact O-N 2.97Å
1068	K	35.4	Very low	36.1	Very low	105 Å²	105	83.9 Å²	83.9	46%	0.457	46%	0.46	S	S	.	.	H	α-helix	trans	-65.2	-26.3	172.3	-59.9	-162.8	173	-159.8	0	114.2	S1066 S1072 T1094 S1098	S1066-K1068 PolarHBondContact O-N 3.1Å; K1068-S1072 WeakPolarHBondContact O-CB 3.33Å; K1068-S1072 PolarHBondContact O-N 2.71Å; K1068-T1094 HydrophobicContact CG-CG2 4.29Å; K1068-S1098 PolarHBondContact NZ-OG 2.95Å
1069	Q	39.1	Very low	36.6	Very low	103 Å²	103	87.1 Å²	87.1	48%	0.481	47%	0.469	S	S	.	.	H	α-helix	trans	-89.3	-38.7	177.5	178.9	168	-8.3	0	0	112.3	V1065 S1066 W1067 V1071 S1072 E1073	V1065-Q1069 HydrophobicContact CG1-CB 4.08Å; V1065-Q1069 HydrophobicContact CG1-CG 4.2Å; S1066-Q1069 WeakPolarHBondContact O-CA 3.49Å; S1066-Q1069 PolarHBondContact O-N 3.32Å; W1067-Q1069 VanDerWaalsContact C-N 3.28Å; W1067-Q1069 PolarHBondContact O-N 3.01Å; Q1069-V1071 PolarHBondContact O-N 2.83Å; Q1069-S1072 PolarHBondContact O-N 2.72Å; Q1069-S1072 VanDerWaalsContact O-N 3.13Å; Q1069-E1073 HydrophobicContact CG-CG 4.31Å; Q1069-E1073 VanDerWaalsContact CG-OE1 3.22Å; Q1069-E1073 WeakPolarHBondContact CG-OE1 3.45Å; Q1069-E1073 PolarHBondContact NE2-OE1 2.73Å; Q1069-E1073 WeakPolarHBondContact O-CB 3.34Å; Q1069-E1073 WeakPolarHBondContact O-CG 3.36Å; Q1069-E1073 PolarHBondContact O-N 3.37Å
1070	L	40.5	Very low	37.1	Very low	13 Å²	13	84.8 Å²	84.8	7%	0.068	46%	0.457	C	S	.	.	H	α-helix	trans	-58.1	-42.8	169.3	-159.9	165.5	0	0	0	109.5	G734 A736 V1065 S1066 W1067 L1074	G734-L1070 WeakPolarHBondContact O-CD1 3.31Å; A736-L1070 HydrophobicContact CB-CD2 3.92Å; A736-L1070 HydrophobicContact CB-CG 4.13Å; V1065-L1070 HydrophobicContact CB-CB 4.22Å; V1065-L1070 HydrophobicContact CG1-CB 3.82Å; V1065-L1070 HydrophobicContact CG2-CD1 4.4Å; S1066-L1070 PolarHBondContact O-N 3.46Å; W1067-L1070 HydrophobicContact CZ3-CD1 4.31Å; L1070-L1074 HydrophobicContact CD2-CD1 3.73Å; L1070-L1074 HydrophobicContact CD2-CG 4.24Å; L1070-L1074 WeakPolarHBondContact O-CG 2.99Å; L1070-L1074 PolarHBondContact O-N 2.71Å; L1070-L1074 VanDerWaalsContact O-N 3.1Å
1071	V	45	Very low	37.8	Very low	4 Å²	4	83.4 Å²	83.4	2%	0.024	46%	0.455	C	S	.	.	H	α-helix	trans	-59.9	-56.6	168.3	168.9	0	0	0	0	111.5	W1067 Q1069 E1073 L1074 L1075 F1090 T1094	W1067-V1071 VanDerWaalsContact O-CB 3.24Å; W1067-V1071 WeakPolarHBondContact O-CB 3.44Å; W1067-V1071 WeakPolarHBondContact O-CG2 3.42Å; W1067-V1071 PolarHBondContact O-N 2.97Å; Q1069-V1071 PolarHBondContact O-N 2.83Å; V1071-E1073 PolarHBondContact O-N 2.74Å; V1071-E1073 VanDerWaalsContact O-N 3.12Å; V1071-L1074 WeakPolarHBondContact O-CB 3.45Å; V1071-L1074 PolarHBondContact O-N 2.86Å; V1071-L1075 HydrophobicContact CG1-CD1 3.72Å; V1071-L1075 HydrophobicContact CG1-CG 4.03Å; V1071-L1075 VanDerWaalsContact O-CG 3.28Å; V1071-L1075 WeakPolarHBondContact O-CG 3.49Å; V1071-L1075 PolarHBondContact O-N 3.02Å; V1071-F1090 HydrophobicContact CB-CD1 4.25Å; V1071-F1090 HydrophobicContact CG1-CB 3.66Å; V1071-F1090 HydrophobicContact CG1-CD1 3.89Å; V1071-F1090 HydrophobicContact CG1-CG 3.81Å; V1071-F1090 HydrophobicContact CG2-CD1 3.4Å; V1071-F1090 HydrophobicContact CG2-CE1 3.58Å; V1071-F1090 HydrophobicContact CG2-CG 4.17Å; V1071-F1090 HydrophobicContact CG2-CZ 4.48Å; V1071-T1094 HydrophobicContact CG1-CG2 4.12Å
1072	S	40.1	Very low	38.5	Very low	70 Å²	70	82.9 Å²	82.9	49%	0.49	44%	0.442	S	S	.	.	H	α-helix	trans	-60.4	-25.7	-176.6	-169	0	0	0	0	114.4	K1068 Q1069 S1076	K1068-S1072 WeakPolarHBondContact O-CB 3.33Å; K1068-S1072 PolarHBondContact O-N 2.71Å; Q1069-S1072 PolarHBondContact O-N 2.72Å; Q1069-S1072 VanDerWaalsContact O-N 3.13Å; S1072-S1076 WeakPolarHBondContact O-CB 3.44Å; S1072-S1076 PolarHBondContact O-N 3.16Å; S1072-S1076 PolarHBondContact O-OG 3.44Å
1073	E	42.5	Very low	39.3	Very low	56 Å²	56	76.2 Å²	76.2	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-78.3	-41.8	174.1	-73	165.5	-169.2	0	0	111	A736 Q1069 V1071 L1075 S1076 L1077	A736-E1073 HydrophobicContact CB-CB 4.33Å; Q1069-E1073 HydrophobicContact CG-CG 4.31Å; Q1069-E1073 VanDerWaalsContact CG-OE1 3.22Å; Q1069-E1073 WeakPolarHBondContact CG-OE1 3.45Å; Q1069-E1073 PolarHBondContact NE2-OE1 2.73Å; Q1069-E1073 WeakPolarHBondContact O-CB 3.34Å; Q1069-E1073 WeakPolarHBondContact O-CG 3.36Å; Q1069-E1073 PolarHBondContact O-N 3.37Å; V1071-E1073 PolarHBondContact O-N 2.74Å; V1071-E1073 VanDerWaalsContact O-N 3.12Å; E1073-L1075 VanDerWaalsContact C-N 3.29Å; E1073-L1075 PolarHBondContact O-N 3.41Å; E1073-S1076 PolarHBondContact O-N 2.75Å; E1073-S1076 VanDerWaalsContact O-N 3.13Å; E1073-S1076 PolarHBondContact O-OG 3.19Å; E1073-L1077 VanDerWaalsContact O-CD1 3.27Å; E1073-L1077 WeakPolarHBondContact O-CD1 3.37Å; E1073-L1077 VanDerWaalsContact O-CG 3.22Å; E1073-L1077 WeakPolarHBondContact O-CG 3.47Å; E1073-L1077 PolarHBondContact O-N 3.33Å
1074	L	45.2	Very low	39.8	Very low	21 Å²	21	79 Å²	79	11%	0.11	42%	0.418	C	S	.	.	H	α-helix	trans	-60	-39.1	170	-71.9	172.1	0	0	0	111.8	A736 E740 F772 L1070 V1071 S1076 C1078 F1090	A736-L1074 HydrophobicContact CB-CD2 3.9Å; A736-L1074 HydrophobicContact CB-CG 3.86Å; E740-L1074 HydrophobicContact CB-CD2 4.5Å; F772-L1074 HydrophobicContact CE1-CD1 4.09Å; L1070-L1074 HydrophobicContact CD2-CD1 3.73Å; L1070-L1074 HydrophobicContact CD2-CG 4.24Å; L1070-L1074 WeakPolarHBondContact O-CG 2.99Å; L1070-L1074 PolarHBondContact O-N 2.71Å; L1070-L1074 VanDerWaalsContact O-N 3.1Å; V1071-L1074 WeakPolarHBondContact O-CB 3.45Å; V1071-L1074 PolarHBondContact O-N 2.86Å; L1074-S1076 PolarHBondContact O-N 3.07Å; L1074-C1078 WeakPolarHBondContact O-CB 3.44Å; L1074-F1090 HydrophobicContact CD1-CE2 4.16Å; L1074-F1090 HydrophobicContact CD1-CZ 3.87Å
1075	L	42	Very low	40.3	Very low	42 Å²	42	73 Å²	73	22%	0.22	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-13	177.1	-61.2	-178.2	0	0	0	113.8	V1071 E1073 H1087 F1090	V1071-L1075 HydrophobicContact CG1-CD1 3.72Å; V1071-L1075 HydrophobicContact CG1-CG 4.03Å; V1071-L1075 VanDerWaalsContact O-CG 3.28Å; V1071-L1075 WeakPolarHBondContact O-CG 3.49Å; V1071-L1075 PolarHBondContact O-N 3.02Å; E1073-L1075 VanDerWaalsContact C-N 3.29Å; E1073-L1075 PolarHBondContact O-N 3.41Å; L1075-H1087 HydrophobicContact CD2-CB 3.92Å; L1075-F1090 HydrophobicContact CD1-CB 4.43Å; L1075-F1090 HydrophobicContact CD2-CB 4.08Å; L1075-F1090 HydrophobicContact CD2-CD2 3.9Å; L1075-F1090 HydrophobicContact CD2-CG 4.39Å
1076	S	38.8	Very low	41	Very low	88 Å²	88	72.9 Å²	72.9	62%	0.615	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	11.8	-178.3	74	0	0	0	0	114.2	S1072 E1073 L1074	S1072-S1076 WeakPolarHBondContact O-CB 3.44Å; S1072-S1076 PolarHBondContact O-N 3.16Å; S1072-S1076 PolarHBondContact O-OG 3.44Å; E1073-S1076 PolarHBondContact O-N 2.75Å; E1073-S1076 VanDerWaalsContact O-N 3.13Å; E1073-S1076 PolarHBondContact O-OG 3.19Å; L1074-S1076 PolarHBondContact O-N 3.07Å
1077	L	39.3	Very low	41.6	Very low	81 Å²	81	73.4 Å²	73.4	42%	0.424	39%	0.387	S	S	.	.	S	Bend	trans	-122.1	16.9	-177.1	-73.2	168.2	0	0	0	112.3	Q737 E1073	Q737-L1077 HydrophobicContact CG-CD1 3.61Å; Q737-L1077 VanDerWaalsContact NE2-CD1 3.28Å; E1073-L1077 VanDerWaalsContact O-CD1 3.27Å; E1073-L1077 WeakPolarHBondContact O-CD1 3.37Å; E1073-L1077 VanDerWaalsContact O-CG 3.22Å; E1073-L1077 WeakPolarHBondContact O-CG 3.47Å; E1073-L1077 PolarHBondContact O-N 3.33Å
1078	C	41.1	Very low	41.7	Very low	51 Å²	51	74.5 Å²	74.5	35%	0.345	40%	0.399	S	S	.	.			trans	-138.1	66.3	-149.9	-142.9	0	0	0	0	111.6	L1074 D1080 C1083	L1074-C1078 WeakPolarHBondContact O-CB 3.44Å; C1078-D1080 PolarHBondContact O-N 3.38Å; C1078-C1083 HydrophobicContact CB-CB 3.69Å; C1078-C1083 WeakPolarHBondContact CB-SG 3.36Å; C1078-C1083 WeakPolarHBondContact SG-CB 3.48Å; C1078-C1083 CovalentContact SG-SG 2.02Å; C1078-C1083 PolarHBondContact SG-SG 2.97Å
1079	D	35.5	Very low	42.4	Very low	173 Å²	173	69.8 Å²	69.8	93%	0.925	38%	0.378	S	S	*	.			trans	-78.7	6.9	-178.2	-61	-56	0	0	0	113.9
1080	D	39.9	Very low	43	Very low	126 Å²	126	65.1 Å²	65.1	67%	0.674	36%	0.357	S	S	*	.	S	Bend	trans	-108.8	151.7	-173.2	-104.4	-52.5	0	0	0	113.8	C1078 H1082 C1083	C1078-D1080 PolarHBondContact O-N 3.38Å; D1080-H1082 PolarHBondContact O-N 3.42Å; D1080-C1083 WeakPolarHBondContact O-CB 3.3Å; D1080-C1083 PolarHBondContact O-N 3.38Å
1081	V	39.3	Very low	43.2	Very low	128 Å²	128	72.9 Å²	72.9	78%	0.776	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-31.2	-168.7	-179.6	0	0	0	0	114.3	C1083	V1081-C1083 PolarHBondContact O-N 2.98Å
1082	H	42.7	Very low	42.8	Very low	83 Å²	83	75.1 Å²	75.1	38%	0.384	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-16.7	176.6	-68.9	95.8	0	0	0	114.1	N763 D765 D1080	N763-H1082 PolarHBondContact ND2-NE2 3.22Å; D765-H1082 IonicContact OD2-CE1 2.63Å; D765-H1082 IonicContact OD2-NE2 2.71Å; D765-H1082 PolarHBondContact OD2-NE2 2.99Å; D1080-H1082 PolarHBondContact O-N 3.42Å
1083	C	44.9	Very low	42.9	Very low	12 Å²	12	72.7 Å²	72.7	8%	0.081	38%	0.381	C	S	.	.	H	α-helix	trans	-88.6	-15.6	-170	-128.6	0	0	0	0	116.2	C1078 D1080 V1081 T1085 L1086 H1087	C1078-C1083 HydrophobicContact CB-CB 3.69Å; C1078-C1083 WeakPolarHBondContact CB-SG 3.36Å; C1078-C1083 WeakPolarHBondContact SG-CB 3.48Å; C1078-C1083 CovalentContact SG-SG 2.02Å; C1078-C1083 PolarHBondContact SG-SG 2.97Å; D1080-C1083 WeakPolarHBondContact O-CB 3.3Å; D1080-C1083 PolarHBondContact O-N 3.38Å; V1081-C1083 PolarHBondContact O-N 2.98Å; C1083-T1085 VanDerWaalsContact C-N 3.32Å; C1083-T1085 PolarHBondContact O-N 2.93Å; C1083-L1086 PolarHBondContact O-N 2.75Å; C1083-H1087 WeakPolarHBondContact O-CB 3.48Å; C1083-H1087 PolarHBondContact O-N 3.33Å
1084	E	41.3	Very low	42.9	Very low	154 Å²	154	71.3 Å²	71.3	72%	0.72	38%	0.377	S	S	*	.	H	α-helix	trans	-61.5	-43.1	174.3	-68.9	-158.5	136.5	0	0	111.3	H1087 L1088	E1084-H1087 PolarHBondContact O-N 2.99Å; E1084-L1088 WeakPolarHBondContact O-CB 3.42Å; E1084-L1088 WeakPolarHBondContact O-CG 3.44Å; E1084-L1088 PolarHBondContact O-N 3.39Å
1085	T	43.5	Very low	42.3	Very low	41 Å²	41	74.3 Å²	74.3	25%	0.252	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-47	175.7	-59.8	0	0	0	0	112.2	I769 V804 C1083 H1087 L1088 F1089	I769-T1085 HydrophobicContact CD1-CG2 4.27Å; V804-T1085 HydrophobicContact CB-CG2 4.01Å; V804-T1085 HydrophobicContact CG1-CG2 4Å; V804-T1085 HydrophobicContact CG2-CG2 3.77Å; C1083-T1085 VanDerWaalsContact C-N 3.32Å; C1083-T1085 PolarHBondContact O-N 2.93Å; T1085-H1087 VanDerWaalsContact C-N 3.35Å; T1085-L1088 PolarHBondContact O-N 3.11Å; T1085-F1089 PolarHBondContact O-N 2.85Å; T1085-F1089 WeakPolarHBondContact O-CB 3.47Å
1086	L	48.5	Very low	41.8	Very low	19 Å²	19	77.1 Å²	77.1	10%	0.099	41%	0.41	C	S	.	.	H	α-helix	trans	-63.6	-40.7	173.9	-80.7	163.9	0	0	0	111.5	I769 C1083 L1088 F1089 F1090	I769-L1086 HydrophobicContact CB-CD2 4.33Å; I769-L1086 HydrophobicContact CD1-CG 4.33Å; I769-L1086 HydrophobicContact CG1-CD1 4.2Å; I769-L1086 HydrophobicContact CG1-CD2 4.07Å; I769-L1086 HydrophobicContact CG1-CG 4Å; I769-L1086 HydrophobicContact CG2-CD2 3.8Å; I769-L1086 HydrophobicContact CG2-CG 4.37Å; C1083-L1086 PolarHBondContact O-N 2.75Å; L1086-L1088 PolarHBondContact O-N 3.5Å; L1086-F1089 PolarHBondContact O-N 3.39Å; L1086-F1090 HydrophobicContact CB-CD2 4.36Å; L1086-F1090 HydrophobicContact CB-CE2 4.44Å; L1086-F1090 HydrophobicContact CD2-CE2 4.05Å; L1086-F1090 WeakPolarHBondContact O-CB 3.26Å; L1086-F1090 WeakPolarHBondContact O-CD2 3.26Å; L1086-F1090 WeakPolarHBondContact O-CG 3.4Å; L1086-F1090 PolarHBondContact O-N 3.22Å
1087	H	47.1	Very low	41.5	Very low	79 Å²	79	75 Å²	75	37%	0.366	40%	0.397	S	S	.	.	H	α-helix	trans	-63	-42.9	178.7	-166.8	-67	0	0	0	110.9	L1075 C1083 E1084 T1085 F1090 W1091	L1075-H1087 HydrophobicContact CD2-CB 3.92Å; C1083-H1087 WeakPolarHBondContact O-CB 3.48Å; C1083-H1087 PolarHBondContact O-N 3.33Å; E1084-H1087 PolarHBondContact O-N 2.99Å; T1085-H1087 VanDerWaalsContact C-N 3.35Å; H1087-F1090 PolarHBondContact O-N 3.21Å; H1087-W1091 AromaticContact CE1-CD1 3.67Å; H1087-W1091 AromaticContact CE1-NE1 3.87Å; H1087-W1091 AromaticContact ND1-CD1 3.99Å; H1087-W1091 WeakPolarHBondContact O-CB 3.23Å; H1087-W1091 PolarHBondContact O-N 2.98Å
1088	L	44	Very low	41	Very low	116 Å²	116	75.7 Å²	75.7	61%	0.607	41%	0.409	S	S	*	.	H	α-helix	trans	-64.8	-42.5	173.5	-72.9	168.9	0	0	0	112.9	E1084 T1085 L1086 S1092	E1084-L1088 WeakPolarHBondContact O-CB 3.42Å; E1084-L1088 WeakPolarHBondContact O-CG 3.44Å; E1084-L1088 PolarHBondContact O-N 3.39Å; T1085-L1088 PolarHBondContact O-N 3.11Å; L1086-L1088 PolarHBondContact O-N 3.5Å; L1088-S1092 VanDerWaalsContact O-CB 3.3Å; L1088-S1092 WeakPolarHBondContact O-CB 3.36Å; L1088-S1092 PolarHBondContact O-N 2.61Å; L1088-S1092 PolarHBondContact O-OG 3.18Å
1089	F	49.5	Very low	41	Very low	5 Å²	5	77 Å²	77	2%	0.022	41%	0.413	C	S	.	.	H	α-helix	trans	-58.9	-48.8	173.9	-179.7	-86	0	0	0	111.1	A773 L776 N800 L801 T1085 L1086 S1092 Y1093	A773-F1089 HydrophobicContact CB-CE1 4.46Å; A773-F1089 HydrophobicContact CB-CE2 4.08Å; A773-F1089 HydrophobicContact CB-CZ 3.76Å; L776-F1089 HydrophobicContact CD1-CE1 3.78Å; N800-F1089 HydrophobicContact CB-CD2 3.94Å; N800-F1089 HydrophobicContact CB-CE2 3.62Å; N800-F1089 HydrophobicContact CB-CZ 4.37Å; N800-F1089 VanDerWaalsContact O-CD2 3.25Å; N800-F1089 WeakPolarHBondContact O-CD2 3.47Å; L801-F1089 HydrophobicContact CD2-CD2 3.79Å; L801-F1089 HydrophobicContact CD2-CE2 3.55Å; L801-F1089 HydrophobicContact CG-CD2 4.34Å; L801-F1089 HydrophobicContact CG-CE2 3.82Å; T1085-F1089 PolarHBondContact O-N 2.85Å; T1085-F1089 WeakPolarHBondContact O-CB 3.47Å; L1086-F1089 PolarHBondContact O-N 3.39Å; F1089-S1092 PolarHBondContact O-N 2.82Å; F1089-Y1093 WeakPolarHBondContact O-CB 3.47Å; F1089-Y1093 PolarHBondContact O-N 3.4Å
1090	F	51.8	Low	41.3	Very low	6 Å²	6	71.9 Å²	71.9	3%	0.026	39%	0.386	C	S	.	.	H	α-helix	trans	-71	-36	-178.4	-79.7	-53.1	0	0	0	113.6	L776 V1071 L1074 L1075 L1086 H1087 T1094	L776-F1090 HydrophobicContact CD1-CD1 4.34Å; L776-F1090 HydrophobicContact CD1-CE1 3.4Å; L776-F1090 VanDerWaalsContact CD1-CE1 3.4Å; L776-F1090 HydrophobicContact CD1-CZ 3.93Å; L776-F1090 HydrophobicContact CD2-CE1 4.21Å; L776-F1090 HydrophobicContact CG-CE1 4.46Å; V1071-F1090 HydrophobicContact CB-CD1 4.25Å; V1071-F1090 HydrophobicContact CG1-CB 3.66Å; V1071-F1090 HydrophobicContact CG1-CD1 3.89Å; V1071-F1090 HydrophobicContact CG1-CG 3.81Å; V1071-F1090 HydrophobicContact CG2-CD1 3.4Å; V1071-F1090 HydrophobicContact CG2-CE1 3.58Å; V1071-F1090 HydrophobicContact CG2-CG 4.17Å; V1071-F1090 HydrophobicContact CG2-CZ 4.48Å; L1074-F1090 HydrophobicContact CD1-CE2 4.16Å; L1074-F1090 HydrophobicContact CD1-CZ 3.87Å; L1075-F1090 HydrophobicContact CD1-CB 4.43Å; L1075-F1090 HydrophobicContact CD2-CB 4.08Å; L1075-F1090 HydrophobicContact CD2-CD2 3.9Å; L1075-F1090 HydrophobicContact CD2-CG 4.39Å; L1086-F1090 HydrophobicContact CB-CD2 4.36Å; L1086-F1090 HydrophobicContact CB-CE2 4.44Å; L1086-F1090 HydrophobicContact CD2-CE2 4.05Å; L1086-F1090 WeakPolarHBondContact O-CB 3.26Å; L1086-F1090 WeakPolarHBondContact O-CD2 3.26Å; L1086-F1090 WeakPolarHBondContact O-CG 3.4Å; L1086-F1090 PolarHBondContact O-N 3.22Å; H1087-F1090 PolarHBondContact O-N 3.21Å; F1090-T1094 WeakPolarHBondContact O-CB 3.47Å; F1090-T1094 WeakPolarHBondContact O-CG2 3.34Å; F1090-T1094 PolarHBondContact O-N 2.99Å; F1090-T1094 PolarHBondContact O-OG1 3.4Å
1091	W	44.3	Very low	41.4	Very low	176 Å²	176	68.9 Å²	68.9	67%	0.667	37%	0.37	S	S	*	.	H	α-helix	trans	-62.7	-45.9	170.2	-118.3	60.8	0	0	0	111	H1087 Y1093 T1094 S1095	H1087-W1091 AromaticContact CE1-CD1 3.67Å; H1087-W1091 AromaticContact CE1-NE1 3.87Å; H1087-W1091 AromaticContact ND1-CD1 3.99Å; H1087-W1091 WeakPolarHBondContact O-CB 3.23Å; H1087-W1091 PolarHBondContact O-N 2.98Å; W1091-Y1093 PolarHBondContact O-N 2.82Å; W1091-T1094 PolarHBondContact O-N 3.12Å; W1091-T1094 PolarHBondContact O-OG1 3.13Å; W1091-S1095 WeakPolarHBondContact O-CB 3.4Å; W1091-S1095 PolarHBondContact O-N 2.86Å
1092	S	36.8	Very low	41.5	Very low	50 Å²	50	65.4 Å²	65.4	35%	0.35	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-47.1	177.7	-61.3	0	0	0	0	111.6	L1088 F1089 S1095 F1096	L1088-S1092 VanDerWaalsContact O-CB 3.3Å; L1088-S1092 WeakPolarHBondContact O-CB 3.36Å; L1088-S1092 PolarHBondContact O-N 2.61Å; L1088-S1092 PolarHBondContact O-OG 3.18Å; F1089-S1092 PolarHBondContact O-N 2.82Å; S1092-S1095 PolarHBondContact O-N 3.41Å; S1092-F1096 PolarHBondContact O-N 2.95Å
1093	Y	43.6	Very low	41.4	Very low	19 Å²	19	64.3 Å²	64.3	8%	0.075	34%	0.343	C	S	.	.	H	α-helix	trans	-65.3	-45.9	177.9	-177.8	-101.9	0	0	0	113.1	M792 F1089 W1091 S1095 F1096 A1097	M792-Y1093 HydrophobicContact CE-CD2 4.44Å; M792-Y1093 HydrophobicContact CE-CE2 4.12Å; M792-Y1093 HydrophobicContact SD-CD2 4.16Å; M792-Y1093 HydrophobicContact SD-CE2 4.28Å; F1089-Y1093 WeakPolarHBondContact O-CB 3.47Å; F1089-Y1093 PolarHBondContact O-N 3.4Å; W1091-Y1093 PolarHBondContact O-N 2.82Å; Y1093-S1095 VanDerWaalsContact C-N 3.29Å; Y1093-S1095 PolarHBondContact O-N 3.12Å; Y1093-F1096 PolarHBondContact O-N 3.14Å; Y1093-A1097 WeakPolarHBondContact O-CB 3.45Å; Y1093-A1097 PolarHBondContact O-N 2.95Å
1094	T	41	Very low	41.2	Very low	28 Å²	28	67.8 Å²	67.8	17%	0.172	36%	0.361	C	S	.	.	H	α-helix	trans	-69.9	-26.2	178.6	54.1	0	0	0	0	113.2	K1068 V1071 F1090 W1091 S1098	K1068-T1094 HydrophobicContact CG-CG2 4.29Å; V1071-T1094 HydrophobicContact CG1-CG2 4.12Å; F1090-T1094 WeakPolarHBondContact O-CB 3.47Å; F1090-T1094 WeakPolarHBondContact O-CG2 3.34Å; F1090-T1094 PolarHBondContact O-N 2.99Å; F1090-T1094 PolarHBondContact O-OG1 3.4Å; W1091-T1094 PolarHBondContact O-N 3.12Å; W1091-T1094 PolarHBondContact O-OG1 3.13Å; T1094-S1098 PolarHBondContact O-OG 3.13Å
1095	S	32.5	Very low	41.2	Very low	84 Å²	84	61.6 Å²	61.6	59%	0.587	34%	0.335	S	S	*	.	H	α-helix	trans	-70.9	-46.6	170	-169.1	0	0	0	0	111.7	W1091 S1092 Y1093 A1097 S1098	W1091-S1095 WeakPolarHBondContact O-CB 3.4Å; W1091-S1095 PolarHBondContact O-N 2.86Å; S1092-S1095 PolarHBondContact O-N 3.41Å; Y1093-S1095 VanDerWaalsContact C-N 3.29Å; Y1093-S1095 PolarHBondContact O-N 3.12Å; S1095-A1097 VanDerWaalsContact C-N 3.35Å; S1095-A1097 PolarHBondContact O-N 3.26Å; S1095-S1098 PolarHBondContact O-N 2.71Å
1096	F	33.2	Very low	41	Very low	101 Å²	101	63.2 Å²	63.2	44%	0.443	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-34.6	175.4	-104.1	-101.3	0	0	0	113.9	D796 S1092 Y1093 S1098	D796-F1096 HydrophobicContact CB-CE1 4.38Å; D796-F1096 WeakPolarHBondContact OD1-CE1 3.45Å; S1092-F1096 PolarHBondContact O-N 2.95Å; Y1093-F1096 PolarHBondContact O-N 3.14Å; F1096-S1098 VanDerWaalsContact C-N 3.31Å; F1096-S1098 PolarHBondContact O-N 3.45Å
1097	A	32	Very low	40.4	Very low	42 Å²	42	66.9 Å²	66.9	35%	0.347	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-8.8	-175.9	0	0	0	0	0	115	R790 Y1093 S1095	R790-A1097 PolarHBondContact NH1-O 2.71Å; Y1093-A1097 WeakPolarHBondContact O-CB 3.45Å; Y1093-A1097 PolarHBondContact O-N 2.95Å; S1095-A1097 VanDerWaalsContact C-N 3.35Å; S1095-A1097 PolarHBondContact O-N 3.26Å
1098	S	29.2	Very low	39.8	Very low	97 Å²	97	65.8 Å²	65.8	68%	0.678	36%	0.361	S	S	*	.			trans	-87.9	0	-168.8	-64.1	0	0	0	0	114.6	R790 K1068 T1094 S1095 F1096	R790-S1098 VanDerWaalsContact CZ-O 3.22Å; R790-S1098 VanDerWaalsContact NH1-C 3.27Å; R790-S1098 PolarHBondContact NH1-O 3.33Å; R790-S1098 PolarHBondContact NH2-O 3.25Å; K1068-S1098 PolarHBondContact NZ-OG 2.95Å; T1094-S1098 PolarHBondContact O-OG 3.13Å; S1095-S1098 PolarHBondContact O-N 2.71Å; F1096-S1098 VanDerWaalsContact C-N 3.31Å; F1096-S1098 PolarHBondContact O-N 3.45Å

Retrieved 1,098 of 1,098 residues in 2906.4 ms (Link to these results)

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