A0A5K4ENW3_SCHMA Loading...

Protein-tyrosine-phosphatase AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4ENW3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,116 aa.

						>A0A5K4ENW3_SCHMA|A0A5K4ENW3
MMCKGTAIDLNIHSRRNSGCIKSNDQMQDHLKRIVSILRFGDFIQLIIKLQSANPKPHQHRYCCVISTYGKLETEESFVLGVDITEGQATVGLVLEIWQDMSINLCGDGGFELITKHTVNQFKPVSVQALWAAFQAINKACQVARDKAYFCRGFTHDWVSYYHNLPASSTHQIQEWLKTDESDEFIQSLSCSPLSDSATDEDECKQEFGLGNLKERRIGKQRAEMEVLIRVKLQEIMYTVDLEEVTVFQLRELLEEGFKQPLHKFRHFIEKQILTICGQMDKASVIFDHVLLGTSFNASNRDELKRLNVTHILNVTREVDNFFPGDKFEYKNIRIYDDEQSTLLPYWEETHRFINEAKIMGTRCLVHCKMGISRSASTVIAYAMKENNWDLKTALSYVKARRPCVQPNPGFMRELHTYQGILEASSNRYKPIFHNNEVKSTKTVSPEYTSVDNQQNYCPPNVLINKSTGNEQDNNLSSSTMKVNMTSEKLEQNPYNSTVMNSSLIADGCLPTTLLSSSLSNFSSLKSSTSTVITTPLSSLSSPIVGQQSSSSSKCNDHFTNIIHQDCDCNCTLNLETELFAFKHSAIPDVTTKFTTNNNYLLNNNNNNNSKLDEQKQNSPSSLQQQRQEDNQLLMNGSSPLDNVVKSLSPSQMNRPVLWYFNDTNDDKAKSSGVVNSTIVAKDSHCLRQWHPDVFENVNGSDRHCILNNTNKLQKAISPSPSLRIAATSPCAITSVSNPQQHIHQLNYADTVSSMPWDYATELKMMPSTKHAKLCIIPYEPICIPLITCQLVLHASIIVSSLNIDKSITRKKHVDIEAITDDERTKYSDRKSTNVLYMSSKLSESNLLMTSVSQGKKEKILTSYESAFTPTLKWRKNQFICNNSNTTTTTTNILTTGNDVSNATFLSYPHQCDLMTQSTTKHQYMSPNDCINKSINDNSNDLKEISFIPLSNIKMALTERRKSSYPDLFMLNTNQNVTTNHAIVVLPERSHSTRSSRTSARLRPDNSWIMNYDSCIDNTVTSNSSNSISTTSNTTTTTNHYTITNSCSLFTSSSHLSSKANRTHDSPSVVVPQISDQSVISSKSVHSSLSSNNNENMKNISSTWHQSEVECLLAEG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	28	Very low	38.8	Very low	117 Å²	117	76.1 Å²	76.1	58%	0.576	42%	0.424	S	S	*	.				0	99.2	0	-176.6	163.1	-174.1	0	0	108.7	I8 D9 L10 I21	M1-I8 HydrophobicContact CE-CG2 4.2Å; M1-I8 HydrophobicContact CG-CG2 4.34Å; M1-D9 WeakPolarHBondContact CA-O 3.22Å; M1-L10 HydrophobicContact CB-CD2 3.96Å; M1-L10 HydrophobicContact CE-CD2 4.14Å; M1-L10 HydrophobicContact CG-CD2 3.59Å; M1-L10 HydrophobicContact SD-CD2 3.75Å; M1-I21 HydrophobicContact CE-CD1 3.59Å; M1-I21 HydrophobicContact SD-CD1 3.47Å; M1-I21 WeakPolarHBondContact SD-CD1 3.32Å
2	M	25.7	Very low	39.1	Very low	126 Å²	126	75.5 Å²	75.5	62%	0.621	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	97.6	177.3	-159.4	-173.7	-158.3	0	0	107.8	K4	M2-K4 PolarHBondContact O-N 2.91Å; M2-K4 VanDerWaalsContact O-N 3.09Å
3	C	32.2	Very low	39.3	Very low	86 Å²	86	77.3 Å²	77.3	58%	0.581	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	103.7	-178.9	-64.5	0	0	0	0	110.2
4	K	31.2	Very low	39	Very low	151 Å²	151	74.6 Å²	74.6	66%	0.657	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	80.5	170	-75	-174.2	175.9	179	0	109.3	M2	M2-K4 PolarHBondContact O-N 2.91Å; M2-K4 VanDerWaalsContact O-N 3.09Å
5	G	46.2	Very low	38.7	Very low	49 Å²	49	84.1 Å²	84.1	51%	0.505	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	-142.5	177.9	0	0	0	0	0	113.8	A7	G5-A7 VanDerWaalsContact C-N 3.27Å; G5-A7 PolarHBondContact O-N 3.34Å
6	T	45.6	Very low	38.4	Very low	63 Å²	63	93.9 Å²	93.9	39%	0.387	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-0.3	-175.2	53.5	0	0	0	0	114.6	V125 S126	T6-V125 HydrophobicContact CG2-CG2 4.03Å; T6-S126 PolarHBondContact OG1-OG 3.01Å
7	A	37.7	Very low	38.1	Very low	11 Å²	11	97.7 Å²	97.7	9%	0.091	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	139.1	171.3	0	0	0	0	0	109.1	G5 L46 A132	G5-A7 VanDerWaalsContact C-N 3.27Å; G5-A7 PolarHBondContact O-N 3.34Å; A7-L46 HydrophobicContact CB-CD1 4.22Å; A7-A132 HydrophobicContact CB-CB 3.85Å
8	I	49.7	Very low	37.8	Very low	20 Å²	20	99.2 Å²	99.2	10%	0.103	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	113.2	177.8	-34.6	-179.1	0	0	0	109.4	M1 L10 L31 I47	M1-I8 HydrophobicContact CE-CG2 4.2Å; M1-I8 HydrophobicContact CG-CG2 4.34Å; I8-L10 HydrophobicContact CB-CD1 4.11Å; I8-L10 HydrophobicContact CB-CD2 4.39Å; I8-L10 HydrophobicContact CB-CG 3.95Å; I8-L10 HydrophobicContact CG2-CD1 4.02Å; I8-L10 HydrophobicContact CG2-CD2 3.47Å; I8-L10 VanDerWaalsContact CG2-CD2 3.47Å; I8-L10 HydrophobicContact CG2-CG 3.58Å; I8-L31 HydrophobicContact CD1-CD1 3.68Å; I8-L31 HydrophobicContact CD1-CD2 4.23Å; I8-I47 PolarHBondContact N-O 3.25Å
9	D	41.9	Very low	37.5	Very low	100 Å²	100	97.6 Å²	97.6	54%	0.535	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	114.5	168.2	178.2	-20.7	0	0	0	108.7	M1	M1-D9 WeakPolarHBondContact CA-O 3.22Å
10	L	47.3	Very low	37.2	Very low	4 Å²	4	98.7 Å²	98.7	2%	0.021	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	74.4	-166.4	-69.6	-176.9	0	0	0	112.2	M1 I8 I12 L31 I44 I47	M1-L10 HydrophobicContact CB-CD2 3.96Å; M1-L10 HydrophobicContact CE-CD2 4.14Å; M1-L10 HydrophobicContact CG-CD2 3.59Å; M1-L10 HydrophobicContact SD-CD2 3.75Å; I8-L10 HydrophobicContact CB-CD1 4.11Å; I8-L10 HydrophobicContact CB-CD2 4.39Å; I8-L10 HydrophobicContact CB-CG 3.95Å; I8-L10 HydrophobicContact CG2-CD1 4.02Å; I8-L10 HydrophobicContact CG2-CD2 3.47Å; I8-L10 VanDerWaalsContact CG2-CD2 3.47Å; I8-L10 HydrophobicContact CG2-CG 3.58Å; L10-I12 HydrophobicContact CB-CD1 4.33Å; L10-I12 HydrophobicContact CB-CG1 4.2Å; L10-I12 HydrophobicContact CD1-CD1 4.22Å; L10-I12 HydrophobicContact CD2-CD1 3.76Å; L10-I12 HydrophobicContact CD2-CG1 4.13Å; L10-I12 HydrophobicContact CG-CD1 4.33Å; L10-I12 PolarHBondContact O-N 2.87Å; L10-L31 HydrophobicContact CD1-CD2 4.34Å; L10-I44 CarbonylContact C-O 3.54Å; L10-I44 VanDerWaalsContact C-O 3.25Å; L10-I44 CarbonylContact O-C 3.58Å; L10-I47 HydrophobicContact CD1-CD1 4.2Å
11	N	41.3	Very low	37	Very low	110 Å²	110	98.6 Å²	98.6	59%	0.588	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	56.2	156.5	-162.4	-14.4	0	0	0	112.2	H13	N11-H13 PolarHBondContact OD1-CE1 3.34Å; N11-H13 PolarHBondContact OD1-ND1 3.32Å
12	I	42.9	Very low	37.4	Very low	69 Å²	69	101.3 Å²	101.3	35%	0.354	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	101.3	166.7	-64.5	-178.7	0	0	0	105.8	L10 F43	L10-I12 HydrophobicContact CB-CD1 4.33Å; L10-I12 HydrophobicContact CB-CG1 4.2Å; L10-I12 HydrophobicContact CD1-CD1 4.22Å; L10-I12 HydrophobicContact CD2-CD1 3.76Å; L10-I12 HydrophobicContact CD2-CG1 4.13Å; L10-I12 HydrophobicContact CG-CD1 4.33Å; L10-I12 PolarHBondContact O-N 2.87Å; I12-F43 WeakPolarHBondContact O-CB 3.35Å
13	H	40.8	Very low	38.1	Very low	99 Å²	99	100.7 Å²	100.7	46%	0.458	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.1	146.6	157.7	-68.4	44.5	0	0	0	108.8	N11 R15	N11-H13 PolarHBondContact OD1-CE1 3.34Å; N11-H13 PolarHBondContact OD1-ND1 3.32Å; H13-R15 VanDerWaalsContact C-N 3.29Å; H13-R15 PolarHBondContact O-N 3.07Å
14	S	35.8	Very low	39	Very low	39 Å²	39	100.9 Å²	100.9	27%	0.273	55%	0.545	S	S	.	.	S	Bend	trans	-66.2	80	178.9	-166.3	0	0	0	0	113	F40	S14-F40 WeakPolarHBondContact O-CE2 3.49Å
15	R	34.9	Very low	40.4	Very low	218 Å²	218	99.2 Å²	99.2	82%	0.823	54%	0.544	S	S	*	.			trans	-111.8	116.7	170	-67.2	-169.8	-178.2	-133.7	0.9	109.1	H13 N17	H13-R15 VanDerWaalsContact C-N 3.29Å; H13-R15 PolarHBondContact O-N 3.07Å; R15-N17 VanDerWaalsContact C-N 3.34Å; R15-N17 PolarHBondContact O-N 3.26Å
16	R	32.8	Very low	41.8	Very low	240 Å²	240	102.7 Å²	102.7	91%	0.906	55%	0.547	S	S	*	.			trans	-69.1	82.7	179.4	-65.7	177.7	178.9	164.6	-1.5	111.4
17	N	33.4	Very low	43.4	Very low	159 Å²	159	103.4 Å²	103.4	85%	0.85	55%	0.547	S	S	*	.			trans	-156.6	95.2	166.4	-120	-11.4	0	0	0	111.3	R15 G19	R15-N17 VanDerWaalsContact C-N 3.34Å; R15-N17 PolarHBondContact O-N 3.26Å; N17-G19 PolarHBondContact O-N 3.1Å; N17-G19 VanDerWaalsContact O-N 3.09Å
18	S	32.4	Very low	45.4	Very low	125 Å²	125	104.9 Å²	104.9	87%	0.874	55%	0.552	S	S	*	*			trans	-85	67.9	-174.6	39.1	0	0	0	0	112.9
19	G	32.6	Very low	47.1	Very low	68 Å²	68	106.8 Å²	106.8	70%	0.701	56%	0.562	S	S	*	*			trans	-89.6	109.7	-178.9	0	0	0	0	0	115.2	N17	N17-G19 PolarHBondContact O-N 3.1Å; N17-G19 VanDerWaalsContact O-N 3.09Å
20	C	31.2	Very low	49.4	Very low	119 Å²	119	102.8 Å²	102.8	80%	0.804	54%	0.54	S	S	*	.			trans	44.7	97.5	158.5	-160.8	0	0	0	0	119.5
21	I	34.4	Very low	51.5	Low	98 Å²	98	104 Å²	104	50%	0.503	55%	0.547	S	S	.	.			trans	-136.7	145.4	150.7	-55.2	179.7	0	0	0	106.7	M1 Q28	M1-I21 HydrophobicContact CE-CD1 3.59Å; M1-I21 HydrophobicContact SD-CD1 3.47Å; M1-I21 WeakPolarHBondContact SD-CD1 3.32Å; I21-Q28 PolarHBondContact O-NE2 3.16Å; I21-Q28 PolarHBondContact O-OE1 3.3Å
22	K	35.1	Very low	53.8	Low	174 Å²	174	105 Å²	105	76%	0.757	55%	0.546	S	S	*	.			trans	-126.3	169.1	175.4	-77	-166.9	174.5	-172.5	0	112.4
23	S	40	Very low	56	Low	112 Å²	112	104 Å²	104	78%	0.783	54%	0.538	S	S	*	.	S	Bend	trans	73.7	51.7	173.2	70.4	0	0	0	0	117.9
24	N	51.3	Low	58.5	Low	90 Å²	90	99.3 Å²	99.3	48%	0.481	52%	0.516	S	S	.	.				-171.9	88	125.4	-147.1	-16.7	0	0	0	109.4	Q26 M27 Q28	N24-Q26 PolarHBondContact O-N 2.89Å; N24-M27 HydrophobicContact CB-CB 4.4Å; N24-M27 HydrophobicContact CB-CE 3.89Å; N24-M27 HydrophobicContact CB-CG 4.31Å; N24-M27 PolarHBondContact O-N 2.94Å; N24-Q28 PolarHBondContact O-N 2.97Å; N24-Q28 VanDerWaalsContact O-N 3.12Å
25	D	60.7	Low	61.1	Low	117 Å²	117	100 Å²	100	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-64.9	-37.3	-154	-62.2	-5.4	0	0	0	113.9	M27 Q28 D29	D25-M27 PolarHBondContact O-N 3.19Å; D25-Q28 PolarHBondContact O-N 3.11Å; D25-D29 PolarHBondContact O-N 3.34Å
26	Q	75.7	Confident	63.8	Low	121 Å²	121	93.9 Å²	93.9	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-59.6	-45.5	172.9	-69.8	-178.1	-8.3	0	0	112	N24 Q28 D29 H30	N24-Q26 PolarHBondContact O-N 2.89Å; Q26-Q28 VanDerWaalsContact C-N 3.3Å; Q26-Q28 PolarHBondContact O-N 2.89Å; Q26-D29 PolarHBondContact O-N 3.19Å; Q26-H30 PolarHBondContact O-CD2 3.12Å; Q26-H30 PolarHBondContact O-N 2.81Å; Q26-H30 PolarHBondContact O-ND1 3.06Å; Q26-H30 PolarHBondContact O-NE2 3.4Å
27	M	80.1	Confident	66.6	Low	79 Å²	79	83.6 Å²	83.6	39%	0.389	47%	0.471	S	S	.	.	H	α-helix	trans	-65.4	-36.3	178.9	-58.8	-155	-52.5	0	0	111.6	N24 D25 H30 L31	N24-M27 HydrophobicContact CB-CB 4.4Å; N24-M27 HydrophobicContact CB-CE 3.89Å; N24-M27 HydrophobicContact CB-CG 4.31Å; N24-M27 PolarHBondContact O-N 2.94Å; D25-M27 PolarHBondContact O-N 3.19Å; M27-H30 PolarHBondContact O-N 3.27Å; M27-L31 WeakPolarHBondContact O-CB 3.37Å; M27-L31 WeakPolarHBondContact O-CD1 3.31Å; M27-L31 WeakPolarHBondContact O-CG 3.29Å; M27-L31 PolarHBondContact O-N 3.38Å
28	Q	78.9	Confident	69.4	Low	42 Å²	42	77 Å²	77	20%	0.196	44%	0.436	C	S	.	.	H	α-helix	trans	-67.1	-38.1	176.1	-64.6	-167.8	5.1	0	0	112.7	I21 N24 D25 Q26 L31 K32	I21-Q28 PolarHBondContact O-NE2 3.16Å; I21-Q28 PolarHBondContact O-OE1 3.3Å; N24-Q28 PolarHBondContact O-N 2.97Å; N24-Q28 VanDerWaalsContact O-N 3.12Å; D25-Q28 PolarHBondContact O-N 3.11Å; Q26-Q28 VanDerWaalsContact C-N 3.3Å; Q26-Q28 PolarHBondContact O-N 2.89Å; Q28-L31 PolarHBondContact O-N 2.87Å; Q28-K32 VanDerWaalsContact O-CG 3.25Å; Q28-K32 WeakPolarHBondContact O-CG 3.44Å; Q28-K32 PolarHBondContact O-N 2.89Å
29	D	86.6	Confident	72.2	Confident	60 Å²	60	76.1 Å²	76.1	32%	0.321	41%	0.414	S	S	.	.	H	α-helix	trans	-64.5	-47	173.6	-171.8	10.9	0	0	0	110.9	D25 Q26 L31 K32 R33	D25-D29 PolarHBondContact O-N 3.34Å; Q26-D29 PolarHBondContact O-N 3.19Å; D29-L31 VanDerWaalsContact C-N 3.31Å; D29-L31 PolarHBondContact O-N 2.9Å; D29-K32 WeakPolarHBondContact O-CB 3.48Å; D29-K32 PolarHBondContact O-N 3.23Å; D29-K32 VanDerWaalsContact O-N 3.1Å; D29-R33 VanDerWaalsContact CG-NE 3.27Å; D29-R33 VanDerWaalsContact O-CG 3.29Å; D29-R33 WeakPolarHBondContact O-CG 3.44Å; D29-R33 PolarHBondContact O-N 2.86Å; D29-R33 IonicContact OD1-CZ 2.83Å; D29-R33 IonicContact OD1-NE 3.8Å; D29-R33 PolarHBondContact OD1-NE 3.33Å; D29-R33 IonicContact OD1-NH2 3.77Å; D29-R33 IonicContact OD2-CZ 3.81Å; D29-R33 VanDerWaalsContact OD2-CZ 3.31Å; D29-R33 IonicContact OD2-NE 2.73Å; D29-R33 PolarHBondContact OD2-NE 2.94Å; D29-R33 IonicContact OD2-NH2 3.18Å; D29-R33 PolarHBondContact OD2-NH2 3.34Å
30	H	90.3	Very high	74.7	Confident	16 Å²	16	80.8 Å²	80.8	7%	0.074	42%	0.415	C	S	.	.	H	α-helix	trans	-55.5	-44.7	174	-61.1	166.9	0	0	0	112.4	Q26 M27 R33 I34 H60 Y62 I84	Q26-H30 PolarHBondContact O-CD2 3.12Å; Q26-H30 PolarHBondContact O-N 2.81Å; Q26-H30 PolarHBondContact O-ND1 3.06Å; Q26-H30 PolarHBondContact O-NE2 3.4Å; M27-H30 PolarHBondContact O-N 3.27Å; H30-R33 PolarHBondContact O-N 2.96Å; H30-I34 WeakPolarHBondContact O-CG1 3.37Å; H30-I34 PolarHBondContact O-N 2.89Å; H30-H60 AromaticContact CE1-CD2 3.16Å; H30-H60 PolarHBondContact CE1-CD2 3.3Å; H30-H60 AromaticContact CE1-NE2 3.84Å; H30-H60 AromaticContact ND1-CD2 3.98Å; H30-H60 AromaticContact NE2-CD2 3.63Å; H30-Y62 HydrophobicContact CB-CE2 4.12Å; H30-Y62 AromaticContact ND1-CE2 3.84Å; H30-Y62 AromaticContact ND1-CZ 3.79Å; H30-Y62 PolarHBondContact ND1-OH 2.84Å; H30-I84 HydrophobicContact CB-CD1 3.49Å; H30-I84 VanDerWaalsContact CB-CD1 3.49Å
31	L	89.9	Confident	77.3	Confident	30 Å²	30	77.1 Å²	77.1	16%	0.157	40%	0.397	C	S	.	.	H	α-helix	trans	-64.3	-40.9	176.5	-70.1	166.2	0	0	0	112.3	I8 L10 M27 Q28 D29 R33 I34 V35 I47	I8-L31 HydrophobicContact CD1-CD1 3.68Å; I8-L31 HydrophobicContact CD1-CD2 4.23Å; L10-L31 HydrophobicContact CD1-CD2 4.34Å; M27-L31 WeakPolarHBondContact O-CB 3.37Å; M27-L31 WeakPolarHBondContact O-CD1 3.31Å; M27-L31 WeakPolarHBondContact O-CG 3.29Å; M27-L31 PolarHBondContact O-N 3.38Å; Q28-L31 PolarHBondContact O-N 2.87Å; D29-L31 VanDerWaalsContact C-N 3.31Å; D29-L31 PolarHBondContact O-N 2.9Å; L31-R33 VanDerWaalsContact C-N 3.33Å; L31-R33 PolarHBondContact O-N 3.17Å; L31-I34 PolarHBondContact O-N 2.85Å; L31-V35 WeakPolarHBondContact O-CB 3.31Å; L31-V35 VanDerWaalsContact O-CG2 3.25Å; L31-V35 WeakPolarHBondContact O-CG2 3.17Å; L31-V35 PolarHBondContact O-N 2.79Å; L31-I47 HydrophobicContact CD2-CD1 3.45Å; L31-I47 VanDerWaalsContact CD2-CD1 3.45Å
32	K	89.7	Confident	80.1	Confident	129 Å²	129	72.5 Å²	72.5	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-60.9	-42.8	174.5	-72.1	163.3	-169.9	168.2	0	111.2	Q28 D29 V35 S36	Q28-K32 VanDerWaalsContact O-CG 3.25Å; Q28-K32 WeakPolarHBondContact O-CG 3.44Å; Q28-K32 PolarHBondContact O-N 2.89Å; D29-K32 WeakPolarHBondContact O-CB 3.48Å; D29-K32 PolarHBondContact O-N 3.23Å; D29-K32 VanDerWaalsContact O-N 3.1Å; K32-V35 PolarHBondContact O-N 2.85Å; K32-S36 WeakPolarHBondContact O-CB 3.45Å; K32-S36 PolarHBondContact O-N 3.3Å
33	R	90.5	Very high	82.8	Confident	50 Å²	50	64.8 Å²	64.8	19%	0.189	34%	0.34	C	S	.	.	H	α-helix	trans	-64.7	-46.8	177.8	-63.3	166.2	-169.6	-155.6	-2.8	111.5	D29 H30 L31 V35 S36 I37 G87 A89	D29-R33 VanDerWaalsContact CG-NE 3.27Å; D29-R33 VanDerWaalsContact O-CG 3.29Å; D29-R33 WeakPolarHBondContact O-CG 3.44Å; D29-R33 PolarHBondContact O-N 2.86Å; D29-R33 IonicContact OD1-CZ 2.83Å; D29-R33 IonicContact OD1-NE 3.8Å; D29-R33 PolarHBondContact OD1-NE 3.33Å; D29-R33 IonicContact OD1-NH2 3.77Å; D29-R33 IonicContact OD2-CZ 3.81Å; D29-R33 VanDerWaalsContact OD2-CZ 3.31Å; D29-R33 IonicContact OD2-NE 2.73Å; D29-R33 PolarHBondContact OD2-NE 2.94Å; D29-R33 IonicContact OD2-NH2 3.18Å; D29-R33 PolarHBondContact OD2-NH2 3.34Å; H30-R33 PolarHBondContact O-N 2.96Å; L31-R33 VanDerWaalsContact C-N 3.33Å; L31-R33 PolarHBondContact O-N 3.17Å; R33-V35 PolarHBondContact O-N 3.31Å; R33-S36 PolarHBondContact O-N 2.86Å; R33-S36 VanDerWaalsContact O-N 3.13Å; R33-S36 PolarHBondContact O-OG 3.43Å; R33-I37 PolarHBondContact O-N 3.01Å; R33-G87 WeakPolarHBondContact CD-O 3.48Å; R33-G87 VanDerWaalsContact CZ-O 3.28Å; R33-G87 PolarHBondContact NE-O 2.95Å; R33-G87 PolarHBondContact NH1-O 3.49Å; R33-G87 VanDerWaalsContact NH1-O 3.09Å; R33-A89 HydrophobicContact CB-CB 4.1Å
34	I	92.4	Very high	85.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.2	-46.9	174.7	-67.6	163.1	0	0	0	110.9	H30 L31 S36 I37 I47 Y62 V82 I84	H30-I34 WeakPolarHBondContact O-CG1 3.37Å; H30-I34 PolarHBondContact O-N 2.89Å; L31-I34 PolarHBondContact O-N 2.85Å; I34-S36 VanDerWaalsContact C-N 3.26Å; I34-S36 PolarHBondContact O-N 3.03Å; I34-I37 WeakPolarHBondContact O-CG1 3.37Å; I34-I37 PolarHBondContact O-N 2.94Å; I34-I47 HydrophobicContact CD1-CG2 4.49Å; I34-I47 HydrophobicContact CG2-CD1 4.18Å; I34-Y62 HydrophobicContact CD1-CD1 4.29Å; I34-Y62 HydrophobicContact CD1-CD2 4.1Å; I34-Y62 HydrophobicContact CD1-CG 3.87Å; I34-V82 HydrophobicContact CG1-CG1 4.2Å; I34-I84 HydrophobicContact CD1-CD1 4.1Å; I34-I84 HydrophobicContact CG1-CD1 4.06Å
35	V	91.4	Very high	87.2	Confident	54 Å²	54	56.4 Å²	56.4	33%	0.327	29%	0.286	S	S	.	.	H	α-helix	trans	-63.9	-30.5	177.1	170.8	0	0	0	0	112.1	L31 K32 R33 I37 L38 I44	L31-V35 WeakPolarHBondContact O-CB 3.31Å; L31-V35 VanDerWaalsContact O-CG2 3.25Å; L31-V35 WeakPolarHBondContact O-CG2 3.17Å; L31-V35 PolarHBondContact O-N 2.79Å; K32-V35 PolarHBondContact O-N 2.85Å; R33-V35 PolarHBondContact O-N 3.31Å; V35-I37 VanDerWaalsContact C-N 3.31Å; V35-I37 PolarHBondContact O-N 2.7Å; V35-L38 PolarHBondContact O-N 3.14Å; V35-I44 HydrophobicContact CG2-CD1 3.93Å
36	S	90.3	Very high	88.8	Confident	89 Å²	89	51.3 Å²	51.3	62%	0.622	26%	0.258	S	S	*	.	H	α-helix	trans	-70.8	-21.5	-179	75.3	0	0	0	0	114.7	K32 R33 I34	K32-S36 WeakPolarHBondContact O-CB 3.45Å; K32-S36 PolarHBondContact O-N 3.3Å; R33-S36 PolarHBondContact O-N 2.86Å; R33-S36 VanDerWaalsContact O-N 3.13Å; R33-S36 PolarHBondContact O-OG 3.43Å; I34-S36 VanDerWaalsContact C-N 3.26Å; I34-S36 PolarHBondContact O-N 3.03Å
37	I	92.6	Very high	89.7	Confident	23 Å²	23	45.8 Å²	45.8	12%	0.118	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	4.7	176.4	64.8	163.6	0	0	0	113.3	R33 I34 V35 V82 A89 V91 L165	R33-I37 PolarHBondContact O-N 3.01Å; I34-I37 WeakPolarHBondContact O-CG1 3.37Å; I34-I37 PolarHBondContact O-N 2.94Å; V35-I37 VanDerWaalsContact C-N 3.31Å; V35-I37 PolarHBondContact O-N 2.7Å; I37-V82 HydrophobicContact CD1-CG1 4.25Å; I37-V82 HydrophobicContact CD1-CG2 4.15Å; I37-A89 HydrophobicContact CD1-CB 4.33Å; I37-A89 HydrophobicContact CG2-CB 4.35Å; I37-V91 HydrophobicContact CD1-CG2 4.33Å; I37-L165 HydrophobicContact CB-CD1 4.18Å; I37-L165 HydrophobicContact CD1-CD1 4.44Å
38	L	92.1	Very high	90.2	Very high	21 Å²	21	42.1 Å²	42.1	11%	0.11	21%	0.214	C	C	.	.	S	Bend	trans	-85.2	140.2	178	-60.4	-177.5	0	0	0	112.2	V35 I44 I66 L80 Y162	V35-L38 PolarHBondContact O-N 3.14Å; L38-I44 HydrophobicContact CD1-CD1 3.55Å; L38-I44 HydrophobicContact CD1-CG1 3.5Å; L38-I44 VanDerWaalsContact CD1-CG1 3.5Å; L38-I66 HydrophobicContact CD1-CD1 4.44Å; L38-I66 HydrophobicContact CD2-CD1 3.81Å; L38-I66 HydrophobicContact CD2-CG1 4.35Å; L38-I66 HydrophobicContact CD2-CG2 4.48Å; L38-L80 HydrophobicContact CD2-CD2 4.37Å; L38-Y162 HydrophobicContact CD2-CE1 3.93Å
39	R	90.9	Very high	90.9	Very high	107 Å²	107	43.2 Å²	43.2	40%	0.404	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-63.5	145	170.2	172.1	179.8	169.3	152.6	-3.7	110.6	G41 D42 W158 Y161 Y162	R39-G41 PolarHBondContact O-N 3.02Å; R39-D42 PolarHBondContact O-N 3.36Å; R39-W158 VanDerWaalsContact NH1-CB 3.29Å; R39-Y161 HydrophobicContact CB-CD1 3.8Å; R39-Y161 HydrophobicContact CB-CE1 3.83Å; R39-Y161 HydrophobicContact CB-CG 4.34Å; R39-Y162 PolarHBondContact N-OH 3.3Å
40	F	85.5	Confident	91.1	Very high	166 Å²	166	40.8 Å²	40.8	73%	0.728	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	123.9	173.8	-177.8	-94.4	0	0	0	111.2	S14	S14-F40 WeakPolarHBondContact O-CE2 3.49Å
41	G	84.6	Confident	90.9	Very high	41 Å²	41	45.4 Å²	45.4	42%	0.423	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	118.6	-35.9	-174.6	0	0	0	0	0	112.2	R39	R39-G41 PolarHBondContact O-N 3.02Å
42	D	93	Very high	90.4	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.011	23%	0.231	C	C	.	.			trans	-75.2	153.8	-174	-57.7	1.6	0	0	0	111.9	R39 I66 S67 T68 Y162	R39-D42 PolarHBondContact O-N 3.36Å; D42-I66 HydrophobicContact CB-CG2 4.02Å; D42-S67 WeakPolarHBondContact CA-O 3.44Å; D42-T68 VanDerWaalsContact OD1-CB 3.27Å; D42-T68 WeakPolarHBondContact OD1-CB 3.47Å; D42-T68 PolarHBondContact OD1-OG1 3.16Å; D42-Y162 WeakPolarHBondContact OD2-CE2 3.47Å; D42-Y162 PolarHBondContact OD2-OH 3.3Å
43	F	91.7	Very high	89.4	Confident	12 Å²	12	43.4 Å²	43.4	5%	0.053	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	159.2	179.1	62.1	-87.9	0	0	0	111.6	I12 Q45 S67 Y69 E75	I12-F43 WeakPolarHBondContact O-CB 3.35Å; F43-Q45 HydrophobicContact CE2-CG 4.14Å; F43-S67 VanDerWaalsContact CD1-O 3.24Å; F43-S67 WeakPolarHBondContact CD1-O 3.44Å; F43-S67 WeakPolarHBondContact CE1-O 3.34Å; F43-S67 PolarHBondContact N-O 3.47Å; F43-S67 PolarHBondContact O-N 2.99Å; F43-Y69 HydrophobicContact CE1-CD2 4.04Å; F43-Y69 AromaticContact CE1-CE2 3.83Å; F43-Y69 HydrophobicContact CE1-CE2 3.83Å; F43-Y69 HydrophobicContact CZ-CE2 4.19Å; F43-E75 HydrophobicContact CZ-CG 4.42Å
44	I	93.5	Very high	88.4	Confident	2 Å²	2	46 Å²	46	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	93.8	-168.7	-44.3	176.1	0	0	0	111.2	L10 V35 L38 L46 I47 V65 I66	L10-I44 CarbonylContact C-O 3.54Å; L10-I44 VanDerWaalsContact C-O 3.25Å; L10-I44 CarbonylContact O-C 3.58Å; V35-I44 HydrophobicContact CG2-CD1 3.93Å; L38-I44 HydrophobicContact CD1-CD1 3.55Å; L38-I44 HydrophobicContact CD1-CG1 3.5Å; L38-I44 VanDerWaalsContact CD1-CG1 3.5Å; I44-L46 WeakPolarHBondContact CG2-O 3.31Å; I44-L46 PolarHBondContact O-N 3Å; I44-I47 HydrophobicContact CD1-CD1 3.91Å; I44-I47 HydrophobicContact CG2-CD1 3.98Å; I44-I47 HydrophobicContact CG2-CG1 3.43Å; I44-I47 VanDerWaalsContact CG2-CG1 3.43Å; I44-V65 CarbonylContact C-O 3.54Å; I44-I66 HydrophobicContact CB-CD1 4.21Å; I44-I66 HydrophobicContact CG1-CD1 3.87Å; I44-I66 HydrophobicContact CG2-CD1 3.89Å
45	Q	91.3	Very high	87.3	Confident	24 Å²	24	51.4 Å²	51.4	11%	0.112	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	-38.5	175.9	-75.7	-171.9	-3.9	0	0	112.4	F43 V65 S67 E75	F43-Q45 HydrophobicContact CE2-CG 4.14Å; Q45-V65 HydrophobicContact CB-CB 4.16Å; Q45-V65 HydrophobicContact CB-CG1 4.05Å; Q45-V65 PolarHBondContact N-O 3.45Å; Q45-S67 WeakPolarHBondContact CG-OG 3.42Å; Q45-S67 PolarHBondContact NE2-OG 3.1Å; Q45-S67 VanDerWaalsContact NE2-OG 3.16Å; Q45-E75 PolarHBondContact NE2-OE1 2.85Å
46	L	93.2	Very high	86.5	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.052	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	144.6	-179.1	-179.8	65.3	0	0	0	112.5	A7 I44 I48 C64 V65 A132 A133 A136	A7-L46 HydrophobicContact CB-CD1 4.22Å; I44-L46 WeakPolarHBondContact CG2-O 3.31Å; I44-L46 PolarHBondContact O-N 3Å; L46-I48 HydrophobicContact CD1-CG2 4.11Å; L46-I48 HydrophobicContact CD2-CG2 3.84Å; L46-I48 HydrophobicContact CG-CG2 3.94Å; L46-C64 CarbonylContact O-C 3.58Å; L46-C64 VanDerWaalsContact O-CA 3.27Å; L46-C64 WeakPolarHBondContact O-CA 3.43Å; L46-V65 HydrophobicContact CB-CB 4.26Å; L46-V65 HydrophobicContact CB-CG2 4.23Å; L46-V65 PolarHBondContact N-O 3.07Å; L46-V65 PolarHBondContact O-N 2.83Å; L46-A132 HydrophobicContact CD1-CB 4.07Å; L46-A132 HydrophobicContact CD2-CB 4.3Å; L46-A132 WeakPolarHBondContact CD2-O 3.36Å; L46-A133 VanDerWaalsContact CD2-CA 3.42Å; L46-A133 HydrophobicContact CD2-CB 4.16Å; L46-A136 HydrophobicContact CB-CB 4.09Å; L46-A136 HydrophobicContact CD2-CB 3.81Å
47	I	94.5	Very high	85.6	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.026	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.4	159.4	-56.1	178.7	0	0	0	109.6	I8 L10 L31 I34 I44 Y62 C64	I8-I47 PolarHBondContact N-O 3.25Å; L10-I47 HydrophobicContact CD1-CD1 4.2Å; L31-I47 HydrophobicContact CD2-CD1 3.45Å; L31-I47 VanDerWaalsContact CD2-CD1 3.45Å; I34-I47 HydrophobicContact CD1-CG2 4.49Å; I34-I47 HydrophobicContact CG2-CD1 4.18Å; I44-I47 HydrophobicContact CD1-CD1 3.91Å; I44-I47 HydrophobicContact CG2-CD1 3.98Å; I44-I47 HydrophobicContact CG2-CG1 3.43Å; I44-I47 VanDerWaalsContact CG2-CG1 3.43Å; I47-Y62 HydrophobicContact CG2-CD1 3.68Å; I47-Y62 HydrophobicContact CG2-CE1 4.41Å; I47-Y62 HydrophobicContact CG2-CG 4.45Å; I47-C64 HydrophobicContact CG1-CB 4.42Å
48	I	92.2	Very high	84.9	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.1	167.9	67.4	-172.3	0	0	0	110.5	L46 L50 Y62 C63 F111 P124 A129 A133	L46-I48 HydrophobicContact CD1-CG2 4.11Å; L46-I48 HydrophobicContact CD2-CG2 3.84Å; L46-I48 HydrophobicContact CG-CG2 3.94Å; I48-L50 HydrophobicContact CD1-CD2 3.96Å; I48-L50 HydrophobicContact CG1-CD2 4.01Å; I48-Y62 WeakPolarHBondContact O-CA 3.43Å; I48-C63 HydrophobicContact CD1-CB 3.99Å; I48-C63 HydrophobicContact CG1-CB 3.71Å; I48-C63 PolarHBondContact N-O 3.34Å; I48-C63 PolarHBondContact O-N 3.45Å; I48-F111 HydrophobicContact CD1-CE1 3.9Å; I48-F111 HydrophobicContact CD1-CZ 4.15Å; I48-P124 HydrophobicContact CD1-CB 4.45Å; I48-P124 HydrophobicContact CD1-CG 4.02Å; I48-A129 HydrophobicContact CB-CB 4.17Å; I48-A129 HydrophobicContact CG2-CB 3.99Å; I48-A133 HydrophobicContact CD1-CB 3.63Å
49	K	92.5	Very high	84.6	Confident	64 Å²	64	59.5 Å²	59.5	28%	0.278	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	137.3	165.8	-170.2	174.9	-179.1	174.1	0	109.5	H60 Y62 V125	K49-H60 PolarHBondContact NZ-ND1 3.02Å; K49-Y62 HydrophobicContact CB-CD1 4.07Å; K49-Y62 HydrophobicContact CB-CE1 3.72Å; K49-Y62 HydrophobicContact CD-CE1 4.45Å; K49-Y62 HydrophobicContact CG-CD1 4.46Å; K49-Y62 HydrophobicContact CG-CE1 4.03Å; K49-V125 HydrophobicContact CB-CG1 4.13Å; K49-V125 HydrophobicContact CB-CG2 4.03Å; K49-V125 HydrophobicContact CD-CG1 4.3Å; K49-V125 HydrophobicContact CG-CG1 3.96Å; K49-V125 PolarHBondContact O-N 2.74Å; K49-V125 VanDerWaalsContact O-N 3.09Å
50	L	91.7	Very high	84.5	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.052	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-99	158.5	173.5	-57.1	-174.6	0	0	0	111.6	I48 R61 C63 F122 K123 P124 W176	I48-L50 HydrophobicContact CD1-CD2 3.96Å; I48-L50 HydrophobicContact CG1-CD2 4.01Å; L50-R61 HydrophobicContact CB-CB 4.3Å; L50-R61 HydrophobicContact CB-CG 4.24Å; L50-R61 HydrophobicContact CD1-CG 4.02Å; L50-R61 HydrophobicContact CG-CG 4.44Å; L50-R61 PolarHBondContact N-O 3.1Å; L50-C63 HydrophobicContact CD1-CB 4.08Å; L50-C63 HydrophobicContact CD2-CB 4.11Å; L50-C63 HydrophobicContact CG-CB 4.16Å; L50-F122 HydrophobicContact CD1-CD1 3.95Å; L50-F122 HydrophobicContact CD2-CB 4.32Å; L50-K123 WeakPolarHBondContact CA-O 3.42Å; L50-P124 HydrophobicContact CD2-CG 4.3Å; L50-W176 HydrophobicContact CD1-CE3 4.46Å; L50-W176 HydrophobicContact CD1-CH2 3.77Å; L50-W176 HydrophobicContact CD1-CZ3 3.53Å
51	Q	86.1	Confident	84.8	Confident	112 Å²	112	49 Å²	49	52%	0.523	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-72	154.3	161.2	-55.6	178.5	35.7	0	0	109.2	K123 P124 V125	Q51-K123 HydrophobicContact CB-CB 4.38Å; Q51-K123 WeakPolarHBondContact CG-O 3.18Å; Q51-K123 PolarHBondContact N-O 3.47Å; Q51-P124 PolarHBondContact NE2-O 2.87Å; Q51-V125 HydrophobicContact CG-CG1 4.27Å
52	S	78.7	Confident	85.3	Confident	36 Å²	36	47.7 Å²	47.7	25%	0.252	26%	0.26	S	S	.	.			trans	-130.4	144.2	166.3	164.7	0	0	0	0	107.4	N54 E175	S52-N54 PolarHBondContact O-N 3.14Å; S52-N54 PolarHBondContact OG-N 2.7Å; S52-E175 PolarHBondContact OG-OE2 2.76Å
53	A	69.8	Low	85.4	Confident	82 Å²	82	47.7 Å²	47.7	68%	0.678	26%	0.261	S	S	*	.	S	Bend	trans	-63.7	-29.9	-179	0	0	0	0	0	112.4	P55	A53-P55 WeakPolarHBondContact O-CD 3.13Å
54	N	68.6	Low	85.6	Confident	104 Å²	104	47.1 Å²	47.1	56%	0.556	26%	0.258	S	S	*	.	S	Bend	trans	-120.7	81	-179.9	-66.6	-62.1	0	0	0	110	S52 K56	S52-N54 PolarHBondContact O-N 3.14Å; S52-N54 PolarHBondContact OG-N 2.7Å; N54-K56 PolarHBondContact O-N 3.35Å
55	P	69.3	Low	85.7	Confident	114 Å²	114	47.1 Å²	47.1	74%	0.74	26%	0.258	S	S	*	.			trans	-71	86.7	-174.6	29.4	-36	0	0	0	112.3	A53	A53-P55 WeakPolarHBondContact O-CD 3.13Å
56	K	74.8	Confident	85.9	Confident	99 Å²	99	46 Å²	46	43%	0.43	25%	0.253	S	S	.	.			trans	-75	147.3	172.7	-61.4	-176.5	-163	158.3	0	111.5	N54 Q59 H171	N54-K56 PolarHBondContact O-N 3.35Å; K56-Q59 HydrophobicContact CB-CB 4.06Å; K56-Q59 PolarHBondContact O-N 2.8Å; K56-H171 PolarHBondContact NZ-NE2 3.28Å
57	P	71.7	Confident	86	Confident	109 Å²	109	45.5 Å²	45.5	71%	0.708	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	144.6	169.9	27.7	-35.2	0	0	0	110.4	Q59	P57-Q59 PolarHBondContact O-N 2.97Å
58	H	76.9	Confident	86	Confident	126 Å²	126	46 Å²	46	58%	0.583	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	10.4	-178.9	-48.6	-73.6	0	0	0	116.8	E86	H58-E86 PolarHBondContact O-N 3.17Å
59	Q	85.7	Confident	86	Confident	22 Å²	22	52.9 Å²	52.9	10%	0.103	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.7	171.1	-175.2	175.4	-25.5	0	0	110.6	K56 P57 I84	K56-Q59 HydrophobicContact CB-CB 4.06Å; K56-Q59 PolarHBondContact O-N 2.8Å; P57-Q59 PolarHBondContact O-N 2.97Å; Q59-I84 WeakPolarHBondContact CA-O 3.32Å
60	H	89.3	Confident	85.6	Confident	37 Å²	37	50.4 Å²	50.4	17%	0.171	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	134.1	-176.6	-60.1	-41.6	0	0	0	112.8	H30 K49 Y62 I84	H30-H60 AromaticContact CE1-CD2 3.16Å; H30-H60 PolarHBondContact CE1-CD2 3.3Å; H30-H60 AromaticContact CE1-NE2 3.84Å; H30-H60 AromaticContact ND1-CD2 3.98Å; H30-H60 AromaticContact NE2-CD2 3.63Å; K49-H60 PolarHBondContact NZ-ND1 3.02Å; H60-Y62 HydrophobicContact CB-CD2 4.49Å; H60-Y62 HydrophobicContact CB-CE2 3.83Å; H60-I84 PolarHBondContact N-O 3.16Å; H60-I84 PolarHBondContact O-N 3.44Å
61	R	92.4	Very high	85.2	Confident	15 Å²	15	57.5 Å²	57.5	6%	0.057	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	136	-179.1	-171.1	169.9	-69.2	128.3	16	112.4	L50 D83 E175 W176	L50-R61 HydrophobicContact CB-CB 4.3Å; L50-R61 HydrophobicContact CB-CG 4.24Å; L50-R61 HydrophobicContact CD1-CG 4.02Å; L50-R61 HydrophobicContact CG-CG 4.44Å; L50-R61 PolarHBondContact N-O 3.1Å; R61-D83 IonicContact CZ-OD1 3.3Å; R61-D83 IonicContact NE-OD1 3.93Å; R61-D83 PolarHBondContact NE-OD1 3.35Å; R61-D83 IonicContact NH2-OD1 2.64Å; R61-D83 PolarHBondContact NH2-OD1 2.99Å; R61-E175 IonicContact CZ-OE2 3.98Å; R61-E175 VanDerWaalsContact CZ-OE2 3.23Å; R61-E175 VanDerWaalsContact NH1-CB 3.26Å; R61-E175 IonicContact NH1-OE2 2.7Å; R61-E175 PolarHBondContact NH1-OE2 2.97Å; R61-E175 IonicContact NH2-OE2 3.75Å; R61-E175 PolarHBondContact NH2-OE2 3.28Å; R61-W176 HydrophobicContact CG-CH2 3.43Å; R61-W176 VanDerWaalsContact CG-CH2 3.43Å; R61-W176 HydrophobicContact CG-CZ2 3.15Å; R61-W176 HydrophobicContact CG-CZ3 4.24Å
62	Y	94.9	Very high	85.2	Confident	14 Å²	14	57.1 Å²	57.1	6%	0.055	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	129.6	-179.6	-71.3	-87	0	0	0	111.1	H30 I34 I47 I48 K49 H60 V82 I84 W176	H30-Y62 HydrophobicContact CB-CE2 4.12Å; H30-Y62 AromaticContact ND1-CE2 3.84Å; H30-Y62 AromaticContact ND1-CZ 3.79Å; H30-Y62 PolarHBondContact ND1-OH 2.84Å; I34-Y62 HydrophobicContact CD1-CD1 4.29Å; I34-Y62 HydrophobicContact CD1-CD2 4.1Å; I34-Y62 HydrophobicContact CD1-CG 3.87Å; I47-Y62 HydrophobicContact CG2-CD1 3.68Å; I47-Y62 HydrophobicContact CG2-CE1 4.41Å; I47-Y62 HydrophobicContact CG2-CG 4.45Å; I48-Y62 WeakPolarHBondContact O-CA 3.43Å; K49-Y62 HydrophobicContact CB-CD1 4.07Å; K49-Y62 HydrophobicContact CB-CE1 3.72Å; K49-Y62 HydrophobicContact CD-CE1 4.45Å; K49-Y62 HydrophobicContact CG-CD1 4.46Å; K49-Y62 HydrophobicContact CG-CE1 4.03Å; H60-Y62 HydrophobicContact CB-CD2 4.49Å; H60-Y62 HydrophobicContact CB-CE2 3.83Å; Y62-V82 PolarHBondContact N-O 3.19Å; Y62-V82 PolarHBondContact O-N 3.34Å; Y62-I84 HydrophobicContact CD2-CD1 3.9Å; Y62-I84 HydrophobicContact CD2-CG1 4.31Å; Y62-I84 HydrophobicContact CE2-CD1 3.88Å; Y62-W176 WeakPolarHBondContact O-CH2 3.5Å
63	C	95	Very high	85.6	Confident	3 Å²	3	63.6 Å²	63.6	2%	0.02	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.8	167.6	170.2	0	0	0	0	108	I48 L50 F122 W176	I48-C63 HydrophobicContact CD1-CB 3.99Å; I48-C63 HydrophobicContact CG1-CB 3.71Å; I48-C63 PolarHBondContact N-O 3.34Å; I48-C63 PolarHBondContact O-N 3.45Å; L50-C63 HydrophobicContact CD1-CB 4.08Å; L50-C63 HydrophobicContact CD2-CB 4.11Å; L50-C63 HydrophobicContact CG-CB 4.16Å; C63-F122 HydrophobicContact CB-CD1 4.15Å; C63-F122 HydrophobicContact CB-CE1 4.41Å; C63-W176 HydrophobicContact CB-CH2 4.5Å
64	C	95.6	Very high	86.6	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.1	-179	-50	0	0	0	0	109.6	L46 I47 I66 V79 L80	L46-C64 CarbonylContact O-C 3.58Å; L46-C64 VanDerWaalsContact O-CA 3.27Å; L46-C64 WeakPolarHBondContact O-CA 3.43Å; I47-C64 HydrophobicContact CG1-CB 4.42Å; C64-I66 HydrophobicContact CB-CD1 3.85Å; C64-I66 HydrophobicContact CB-CG1 4.24Å; C64-V79 WeakPolarHBondContact O-CA 3.44Å; C64-L80 HydrophobicContact CB-CB 4.37Å; C64-L80 PolarHBondContact N-O 3.25Å; C64-L80 PolarHBondContact O-N 3.31Å
65	V	96	Very high	87.7	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.1	165.7	-174.6	0	0	0	0	106.7	I44 Q45 L46 I97 I137	I44-V65 CarbonylContact C-O 3.54Å; Q45-V65 HydrophobicContact CB-CB 4.16Å; Q45-V65 HydrophobicContact CB-CG1 4.05Å; Q45-V65 PolarHBondContact N-O 3.45Å; L46-V65 HydrophobicContact CB-CB 4.26Å; L46-V65 HydrophobicContact CB-CG2 4.23Å; L46-V65 PolarHBondContact N-O 3.07Å; L46-V65 PolarHBondContact O-N 2.83Å; V65-I97 HydrophobicContact CG1-CD1 4.31Å; V65-I137 HydrophobicContact CG2-CD1 4.25Å; V65-I137 HydrophobicContact CG2-CG1 3.68Å
66	I	95.6	Very high	88.9	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.8	-177.7	-51.8	-62.5	0	0	0	108.2	L38 D42 I44 C64 S77 F78 L80	L38-I66 HydrophobicContact CD1-CD1 4.44Å; L38-I66 HydrophobicContact CD2-CD1 3.81Å; L38-I66 HydrophobicContact CD2-CG1 4.35Å; L38-I66 HydrophobicContact CD2-CG2 4.48Å; D42-I66 HydrophobicContact CB-CG2 4.02Å; I44-I66 HydrophobicContact CB-CD1 4.21Å; I44-I66 HydrophobicContact CG1-CD1 3.87Å; I44-I66 HydrophobicContact CG2-CD1 3.89Å; C64-I66 HydrophobicContact CB-CD1 3.85Å; C64-I66 HydrophobicContact CB-CG1 4.24Å; I66-S77 CarbonylContact O-C 3.57Å; I66-S77 WeakPolarHBondContact O-CA 3.41Å; I66-F78 HydrophobicContact CB-CD1 3.83Å; I66-F78 HydrophobicContact CB-CE1 3.46Å; I66-F78 VanDerWaalsContact CB-CE1 3.46Å; I66-F78 HydrophobicContact CB-CZ 4.13Å; I66-F78 HydrophobicContact CG1-CE1 4.01Å; I66-F78 HydrophobicContact CG1-CZ 4.18Å; I66-F78 HydrophobicContact CG2-CD1 4.24Å; I66-F78 HydrophobicContact CG2-CE1 3.62Å; I66-F78 HydrophobicContact CG2-CZ 4.45Å; I66-F78 PolarHBondContact N-O 3.33Å; I66-F78 PolarHBondContact O-N 3.47Å; I66-L80 HydrophobicContact CG1-CB 3.93Å; I66-L80 HydrophobicContact CG1-CD2 4.18Å
67	S	95.1	Very high	89.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	154.4	-179.6	-57.2	0	0	0	0	111.1	D42 F43 Q45 E76 S77	D42-S67 WeakPolarHBondContact CA-O 3.44Å; F43-S67 VanDerWaalsContact CD1-O 3.24Å; F43-S67 WeakPolarHBondContact CD1-O 3.44Å; F43-S67 WeakPolarHBondContact CE1-O 3.34Å; F43-S67 PolarHBondContact N-O 3.47Å; F43-S67 PolarHBondContact O-N 2.99Å; Q45-S67 WeakPolarHBondContact CG-OG 3.42Å; Q45-S67 PolarHBondContact NE2-OG 3.1Å; Q45-S67 VanDerWaalsContact NE2-OG 3.16Å; S67-E76 CarbonylContact C-O 3.6Å; S67-E76 VanDerWaalsContact CA-O 3.24Å; S67-E76 WeakPolarHBondContact CA-O 3.46Å; S67-S77 WeakPolarHBondContact CB-OG 3.49Å; S67-S77 PolarHBondContact OG-OG 3.36Å
68	T	93.7	Very high	91	Very high	14 Å²	14	42.3 Å²	42.3	9%	0.086	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	162.7	175.5	-144.8	0	0	0	0	109.5	D42 E76 W158	D42-T68 VanDerWaalsContact OD1-CB 3.27Å; D42-T68 WeakPolarHBondContact OD1-CB 3.47Å; D42-T68 PolarHBondContact OD1-OG1 3.16Å; T68-E76 PolarHBondContact N-O 2.71Å; T68-E76 PolarHBondContact O-N 2.74Å; T68-W158 HydrophobicContact CG2-CD2 3.68Å; T68-W158 HydrophobicContact CG2-CE3 4.11Å; T68-W158 HydrophobicContact CG2-CG 4.19Å; T68-W158 HydrophobicContact CG2-CH2 3.9Å; T68-W158 HydrophobicContact CG2-CZ2 3.48Å; T68-W158 VanDerWaalsContact CG2-CZ2 3.48Å; T68-W158 HydrophobicContact CG2-CZ3 4.19Å
69	Y	92.6	Very high	91.9	Very high	147 Å²	147	36.3 Å²	36.3	58%	0.576	17%	0.17	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	108.3	168	-72.8	-81	0	0	0	108.7	F43 E75	F43-Y69 HydrophobicContact CE1-CD2 4.04Å; F43-Y69 AromaticContact CE1-CE2 3.83Å; F43-Y69 HydrophobicContact CE1-CE2 3.83Å; F43-Y69 HydrophobicContact CZ-CE2 4.19Å; Y69-E75 HydrophobicContact CE1-CB 4.32Å
70	G	85.1	Confident	92.4	Very high	13 Å²	13	35.2 Å²	35.2	13%	0.134	17%	0.166	C	C	.	.			trans	-73.2	-178.2	-176	0	0	0	0	0	113.7	L72 E73 T74 E76	G70-L72 PolarHBondContact O-N 2.86Å; G70-E73 PolarHBondContact O-N 3.43Å; G70-T74 PolarHBondContact N-O 2.98Å; G70-E76 WeakPolarHBondContact CA-OE1 3.29Å
71	K	83.2	Confident	92.7	Very high	158 Å²	158	33.5 Å²	33.5	69%	0.687	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.5	-178.5	-73.4	173.4	172.4	170.9	0	114.4	D157	K71-D157 VanDerWaalsContact CE-OD2 3.25Å; K71-D157 WeakPolarHBondContact CE-OD2 3.44Å; K71-D157 IonicContact NZ-OD2 2.62Å; K71-D157 PolarHBondContact NZ-OD2 3.48Å
72	L	84.6	Confident	92.8	Very high	105 Å²	105	32.8 Å²	32.8	55%	0.55	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	12.1	178	-55.6	-179.5	0	0	0	113.1	G70 T74 T155	G70-L72 PolarHBondContact O-N 2.86Å; L72-T74 PolarHBondContact O-N 3.13Å; L72-T74 VanDerWaalsContact O-N 3.14Å; L72-T155 HydrophobicContact CD1-CG2 3.81Å
73	E	86.9	Confident	92.8	Very high	172 Å²	172	32.1 Å²	32.1	80%	0.804	15%	0.152	S	C	*	.	S	Bend	trans	59.2	16.4	-173.6	-56.4	-170.5	154.9	0	0	114.5	G70	G70-E73 PolarHBondContact O-N 3.43Å
74	T	90.8	Very high	92.6	Very high	24 Å²	24	32 Å²	32	15%	0.147	15%	0.151	C	C	.	.	S	Bend	trans	-100.6	151.6	178.5	57.2	0	0	0	0	112.5	G70 L72 E76 K147 Y149	G70-T74 PolarHBondContact N-O 2.98Å; L72-T74 PolarHBondContact O-N 3.13Å; L72-T74 VanDerWaalsContact O-N 3.14Å; T74-E76 PolarHBondContact O-N 2.65Å; T74-E76 VanDerWaalsContact O-N 3.13Å; T74-K147 HydrophobicContact CG2-CD 3.92Å; T74-K147 HydrophobicContact CG2-CG 4.29Å; T74-Y149 WeakPolarHBondContact CB-OH 3.43Å; T74-Y149 PolarHBondContact OG1-OH 2.78Å
75	E	93.1	Very high	92.3	Very high	32 Å²	32	34 Å²	34	15%	0.15	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	100	176.9	-177.6	174.2	-146	0	0	110.6	F43 Q45 Y69 K139 V143 Y149	F43-E75 HydrophobicContact CZ-CG 4.42Å; Q45-E75 PolarHBondContact NE2-OE1 2.85Å; Y69-E75 HydrophobicContact CE1-CB 4.32Å; E75-K139 IonicContact OE2-NZ 3.54Å; E75-V143 HydrophobicContact CB-CG1 4.41Å; E75-V143 WeakPolarHBondContact O-CG1 3.3Å; E75-Y149 PolarHBondContact O-OH 3.28Å; E75-Y149 VanDerWaalsContact O-OH 3.11Å
76	E	94.6	Very high	91.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	143.6	174.2	-70.3	173.7	-159.3	0	0	108.8	S67 T68 G70 T74 Y149 T155 H156 W158	S67-E76 CarbonylContact C-O 3.6Å; S67-E76 VanDerWaalsContact CA-O 3.24Å; S67-E76 WeakPolarHBondContact CA-O 3.46Å; T68-E76 PolarHBondContact N-O 2.71Å; T68-E76 PolarHBondContact O-N 2.74Å; G70-E76 WeakPolarHBondContact CA-OE1 3.29Å; T74-E76 PolarHBondContact O-N 2.65Å; T74-E76 VanDerWaalsContact O-N 3.13Å; E76-Y149 HydrophobicContact CG-CE1 4.29Å; E76-Y149 HydrophobicContact CG-CE2 4.16Å; E76-T155 WeakPolarHBondContact OE1-CB 3.36Å; E76-T155 WeakPolarHBondContact OE1-CG2 3.28Å; E76-H156 PolarHBondContact OE2-N 3.25Å; E76-W158 HydrophobicContact CB-CZ2 3.83Å; E76-W158 PolarHBondContact OE2-NE1 3.2Å
77	S	95.7	Very high	91	Very high	4 Å²	4	43.6 Å²	43.6	3%	0.028	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	143.2	-167.6	-61.2	0	0	0	0	113.1	I66 S67 I97 H156	I66-S77 CarbonylContact O-C 3.57Å; I66-S77 WeakPolarHBondContact O-CA 3.41Å; S67-S77 WeakPolarHBondContact CB-OG 3.49Å; S67-S77 PolarHBondContact OG-OG 3.36Å; S77-I97 VanDerWaalsContact O-CB 3.31Å; S77-I97 WeakPolarHBondContact O-CB 3.35Å; S77-I97 PolarHBondContact O-N 3.44Å; S77-H156 PolarHBondContact N-NE2 2.82Å; S77-H156 PolarHBondContact O-NE2 3.07Å; S77-H156 VanDerWaalsContact O-NE2 3.16Å
78	F	95	Very high	90.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	159.9	174.3	86.9	-75.6	0	0	0	112.2	I66 L80 V94 L95 E96 W158 V159 Y162	I66-F78 HydrophobicContact CB-CD1 3.83Å; I66-F78 HydrophobicContact CB-CE1 3.46Å; I66-F78 VanDerWaalsContact CB-CE1 3.46Å; I66-F78 HydrophobicContact CB-CZ 4.13Å; I66-F78 HydrophobicContact CG1-CE1 4.01Å; I66-F78 HydrophobicContact CG1-CZ 4.18Å; I66-F78 HydrophobicContact CG2-CD1 4.24Å; I66-F78 HydrophobicContact CG2-CE1 3.62Å; I66-F78 HydrophobicContact CG2-CZ 4.45Å; I66-F78 PolarHBondContact N-O 3.33Å; I66-F78 PolarHBondContact O-N 3.47Å; F78-L80 HydrophobicContact CD2-CB 4.4Å; F78-L80 HydrophobicContact CE2-CB 3.62Å; F78-L80 HydrophobicContact CE2-CD1 3.76Å; F78-L80 HydrophobicContact CE2-CG 4.21Å; F78-L80 HydrophobicContact CZ-CB 3.88Å; F78-L80 HydrophobicContact CZ-CD1 4.06Å; F78-L80 HydrophobicContact CZ-CD2 4.4Å; F78-L80 HydrophobicContact CZ-CG 4.33Å; F78-V94 HydrophobicContact CD2-CG1 3.85Å; F78-V94 HydrophobicContact CE2-CG1 3.87Å; F78-L95 WeakPolarHBondContact CA-O 3.43Å; F78-L95 WeakPolarHBondContact CB-O 3.44Å; F78-E96 HydrophobicContact CB-CB 4.42Å; F78-W158 AromaticContact CD1-CH2 3.58Å; F78-W158 HydrophobicContact CD1-CH2 3.58Å; F78-W158 AromaticContact CD1-CZ3 3.64Å; F78-W158 HydrophobicContact CD1-CZ3 3.64Å; F78-W158 HydrophobicContact CE1-CH2 4.05Å; F78-W158 AromaticContact CE1-CZ3 3.64Å; F78-W158 HydrophobicContact CE1-CZ3 3.64Å; F78-V159 HydrophobicContact CB-CG2 4.26Å; F78-V159 HydrophobicContact CD1-CG2 4.21Å; F78-V159 HydrophobicContact CD2-CG1 4.12Å; F78-V159 HydrophobicContact CE2-CG1 4.42Å; F78-V159 HydrophobicContact CG-CG1 4.33Å; F78-V159 HydrophobicContact CG-CG2 4.19Å; F78-Y162 AromaticContact CE1-CD2 3.65Å; F78-Y162 HydrophobicContact CE1-CD2 3.65Å; F78-Y162 AromaticContact CE1-CE2 3.58Å; F78-Y162 HydrophobicContact CE1-CE2 3.58Å; F78-Y162 HydrophobicContact CE1-CG 4.23Å; F78-Y162 HydrophobicContact CE2-CD2 4.18Å; F78-Y162 HydrophobicContact CE2-CG 4.06Å; F78-Y162 AromaticContact CZ-CD1 3.81Å; F78-Y162 HydrophobicContact CZ-CD1 3.81Å; F78-Y162 AromaticContact CZ-CD2 3.31Å; F78-Y162 HydrophobicContact CZ-CD2 3.31Å; F78-Y162 HydrophobicContact CZ-CE1 4.09Å; F78-Y162 AromaticContact CZ-CE2 3.62Å; F78-Y162 HydrophobicContact CZ-CE2 3.62Å; F78-Y162 AromaticContact CZ-CG 3.42Å; F78-Y162 HydrophobicContact CZ-CG 3.42Å; F78-Y162 VanDerWaalsContact CZ-CG 3.42Å
79	V	95.6	Very high	90.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.6	173.7	-177.5	0	0	0	0	108.9	C64 L95 I97 L113 F122 I137	C64-V79 WeakPolarHBondContact O-CA 3.44Å; V79-L95 HydrophobicContact CB-CB 4.42Å; V79-L95 PolarHBondContact N-O 3.27Å; V79-L95 PolarHBondContact O-N 2.86Å; V79-I97 HydrophobicContact CG2-CD1 3.89Å; V79-I97 HydrophobicContact CG2-CG1 4.15Å; V79-L113 HydrophobicContact CB-CD1 4.41Å; V79-L113 HydrophobicContact CG1-CD1 4.29Å; V79-L113 HydrophobicContact CG2-CD1 3.92Å; V79-F122 HydrophobicContact CG1-CE1 4.4Å; V79-F122 HydrophobicContact CG1-CZ 4.44Å; V79-I137 HydrophobicContact CG2-CD1 4.39Å
80	L	95.9	Very high	90.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.8	178	-177.7	69.1	0	0	0	109.6	L38 C64 I66 F78 V82 V91 V94 Y162	L38-L80 HydrophobicContact CD2-CD2 4.37Å; C64-L80 HydrophobicContact CB-CB 4.37Å; C64-L80 PolarHBondContact N-O 3.25Å; C64-L80 PolarHBondContact O-N 3.31Å; I66-L80 HydrophobicContact CG1-CB 3.93Å; I66-L80 HydrophobicContact CG1-CD2 4.18Å; F78-L80 HydrophobicContact CD2-CB 4.4Å; F78-L80 HydrophobicContact CE2-CB 3.62Å; F78-L80 HydrophobicContact CE2-CD1 3.76Å; F78-L80 HydrophobicContact CE2-CG 4.21Å; F78-L80 HydrophobicContact CZ-CB 3.88Å; F78-L80 HydrophobicContact CZ-CD1 4.06Å; F78-L80 HydrophobicContact CZ-CD2 4.4Å; F78-L80 HydrophobicContact CZ-CG 4.33Å; L80-V82 HydrophobicContact CD2-CG2 3.75Å; L80-V82 HydrophobicContact CG-CG2 3.76Å; L80-V91 HydrophobicContact CD1-CG1 3.76Å; L80-V91 HydrophobicContact CD1-CG2 4.14Å; L80-V94 HydrophobicContact CD1-CG2 4.19Å; L80-Y162 HydrophobicContact CD1-CD1 4.12Å; L80-Y162 HydrophobicContact CD2-CD1 4.2Å; L80-Y162 HydrophobicContact CD2-CE1 4.3Å
81	G	95.3	Very high	91	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	116.9	169.1	0	0	0	0	0	111	G92 L93	G81-G92 PolarHBondContact O-N 3.06Å; G81-L93 PolarHBondContact N-O 3.22Å; G81-L93 PolarHBondContact O-N 3.04Å
82	V	95.1	Very high	91.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.7	179	-172	0	0	0	0	109.9	I34 I37 Y62 L80 I84 A89 T90	I34-V82 HydrophobicContact CG1-CG1 4.2Å; I37-V82 HydrophobicContact CD1-CG1 4.25Å; I37-V82 HydrophobicContact CD1-CG2 4.15Å; Y62-V82 PolarHBondContact N-O 3.19Å; Y62-V82 PolarHBondContact O-N 3.34Å; L80-V82 HydrophobicContact CD2-CG2 3.75Å; L80-V82 HydrophobicContact CG-CG2 3.76Å; V82-I84 HydrophobicContact CG1-CG1 4.26Å; V82-A89 HydrophobicContact CG1-CB 3.88Å; V82-T90 WeakPolarHBondContact CA-O 3.49Å
83	D	93.7	Very high	91.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	136.7	162.4	-58	-87.8	0	0	0	109	R61 T90 S168 W176	R61-D83 IonicContact CZ-OD1 3.3Å; R61-D83 IonicContact NE-OD1 3.93Å; R61-D83 PolarHBondContact NE-OD1 3.35Å; R61-D83 IonicContact NH2-OD1 2.64Å; R61-D83 PolarHBondContact NH2-OD1 2.99Å; D83-T90 PolarHBondContact N-O 3.07Å; D83-T90 PolarHBondContact O-N 2.96Å; D83-T90 PolarHBondContact O-OG1 3.31Å; D83-S168 WeakPolarHBondContact OD2-CB 3.37Å; D83-S168 PolarHBondContact OD2-OG 2.92Å; D83-W176 PolarHBondContact OD2-NE1 2.89Å
84	I	92.3	Very high	92.2	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.7	172.9	-56.9	-179.4	0	0	0	107.3	H30 I34 Q59 H60 Y62 V82 Q88 A89	H30-I84 HydrophobicContact CB-CD1 3.49Å; H30-I84 VanDerWaalsContact CB-CD1 3.49Å; I34-I84 HydrophobicContact CD1-CD1 4.1Å; I34-I84 HydrophobicContact CG1-CD1 4.06Å; Q59-I84 WeakPolarHBondContact CA-O 3.32Å; H60-I84 PolarHBondContact N-O 3.16Å; H60-I84 PolarHBondContact O-N 3.44Å; Y62-I84 HydrophobicContact CD2-CD1 3.9Å; Y62-I84 HydrophobicContact CD2-CG1 4.31Å; Y62-I84 HydrophobicContact CE2-CD1 3.88Å; V82-I84 HydrophobicContact CG1-CG1 4.26Å; I84-Q88 VanDerWaalsContact CA-O 3.31Å; I84-Q88 WeakPolarHBondContact CA-O 3.24Å; I84-A89 HydrophobicContact CG1-CB 4.37Å
85	T	87.9	Confident	92.3	Very high	41 Å²	41	25.6 Å²	25.6	25%	0.252	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	121.4	-175.3	-43.3	0	0	0	0	109.1	G87 Q88 Q172	T85-G87 PolarHBondContact O-N 2.82Å; T85-Q88 PolarHBondContact N-O 3.15Å; T85-Q88 PolarHBondContact O-N 2.82Å; T85-Q172 PolarHBondContact OG1-NE2 3.4Å
86	E	83.1	Confident	92.3	Very high	179 Å²	179	26.3 Å²	26.3	84%	0.836	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	-24	175.5	-66.5	-179.7	175.1	0	0	118.4	H58	H58-E86 PolarHBondContact O-N 3.17Å
87	G	80.6	Confident	92.3	Very high	25 Å²	25	26.4 Å²	26.4	26%	0.258	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	172.5	-38.4	-165.7	0	0	0	0	0	111.4	R33 T85	R33-G87 WeakPolarHBondContact CD-O 3.48Å; R33-G87 VanDerWaalsContact CZ-O 3.28Å; R33-G87 PolarHBondContact NE-O 2.95Å; R33-G87 PolarHBondContact NH1-O 3.49Å; R33-G87 VanDerWaalsContact NH1-O 3.09Å; T85-G87 PolarHBondContact O-N 2.82Å
88	Q	87.7	Confident	92.2	Very high	141 Å²	141	27.2 Å²	27.2	66%	0.659	15%	0.146	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	149.2	-170.6	-51.8	-52.4	-32.3	0	0	112.2	I84 T85	I84-Q88 VanDerWaalsContact CA-O 3.31Å; I84-Q88 WeakPolarHBondContact CA-O 3.24Å; T85-Q88 PolarHBondContact N-O 3.15Å; T85-Q88 PolarHBondContact O-N 2.82Å
89	A	92.3	Very high	92	Very high	13 Å²	13	30.6 Å²	30.6	11%	0.107	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.6	164	0	0	0	0	0	108.5	R33 I37 V82 I84	R33-A89 HydrophobicContact CB-CB 4.1Å; I37-A89 HydrophobicContact CD1-CB 4.33Å; I37-A89 HydrophobicContact CG2-CB 4.35Å; V82-A89 HydrophobicContact CG1-CB 3.88Å; I84-A89 HydrophobicContact CG1-CB 4.37Å
90	T	93.6	Very high	91.7	Very high	22 Å²	22	33.3 Å²	33.3	14%	0.135	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.5	-178.1	56.4	0	0	0	0	110.5	V82 D83 P166 S168	V82-T90 WeakPolarHBondContact CA-O 3.49Å; D83-T90 PolarHBondContact N-O 3.07Å; D83-T90 PolarHBondContact O-N 2.96Å; D83-T90 PolarHBondContact O-OG1 3.31Å; T90-P166 CarbonylContact C-O 3.51Å; T90-P166 WeakPolarHBondContact CA-O 3.34Å; T90-P166 WeakPolarHBondContact CB-O 3.31Å; T90-S168 PolarHBondContact O-OG 3.34Å; T90-S168 WeakPolarHBondContact OG1-CA 3.29Å; T90-S168 PolarHBondContact OG1-OG 2.71Å
91	V	94.5	Very high	91.6	Very high	13 Å²	13	33.3 Å²	33.3	8%	0.079	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	115.2	-175.3	-179.5	0	0	0	0	110.4	I37 L80 V94 L165 P166 A167 S168	I37-V91 HydrophobicContact CD1-CG2 4.33Å; L80-V91 HydrophobicContact CD1-CG1 3.76Å; L80-V91 HydrophobicContact CD1-CG2 4.14Å; V91-V94 HydrophobicContact CG1-CG2 3.45Å; V91-V94 VanDerWaalsContact CG1-CG2 3.45Å; V91-L165 HydrophobicContact CG2-CB 3.78Å; V91-L165 HydrophobicContact CG2-CD1 3.85Å; V91-L165 HydrophobicContact CG2-CG 4.49Å; V91-P166 PolarHBondContact N-O 3.27Å; V91-A167 CarbonylContact O-C 3.59Å; V91-A167 WeakPolarHBondContact O-CA 3.36Å; V91-S168 PolarHBondContact O-N 2.99Å
92	G	91.6	Very high	91.3	Very high	10 Å²	10	35.7 Å²	35.7	10%	0.103	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-17.4	179.2	0	0	0	0	0	114.5	G81 S168	G81-G92 PolarHBondContact O-N 3.06Å; G92-S168 WeakPolarHBondContact CA-OG 3.38Å; G92-S168 PolarHBondContact N-OG 2.92Å
93	L	93.5	Very high	91.2	Very high	18 Å²	18	36.1 Å²	36.1	9%	0.094	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	142.2	172.9	-174.8	65.4	0	0	0	111	G81 F122 W176	G81-L93 PolarHBondContact N-O 3.22Å; G81-L93 PolarHBondContact O-N 3.04Å; L93-F122 HydrophobicContact CD2-CE1 3.91Å; L93-F122 HydrophobicContact CD2-CZ 3.6Å; L93-W176 HydrophobicContact CB-CB 4.36Å; L93-W176 HydrophobicContact CB-CD2 4Å; L93-W176 HydrophobicContact CB-CE3 4.05Å; L93-W176 HydrophobicContact CB-CG 4.19Å; L93-W176 HydrophobicContact CD2-CE3 4.05Å
94	V	94.2	Very high	90.9	Very high	23 Å²	23	40 Å²	40	14%	0.139	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	126.9	168.7	-179.6	0	0	0	0	106.9	F78 L80 V91 V159 H163	F78-V94 HydrophobicContact CD2-CG1 3.85Å; F78-V94 HydrophobicContact CE2-CG1 3.87Å; L80-V94 HydrophobicContact CD1-CG2 4.19Å; V91-V94 HydrophobicContact CG1-CG2 3.45Å; V91-V94 VanDerWaalsContact CG1-CG2 3.45Å; V94-V159 HydrophobicContact CG1-CG1 3.38Å; V94-H163 WeakPolarHBondContact CG1-NE2 3.3Å
95	L	93.1	Very high	90.6	Very high	15 Å²	15	44.4 Å²	44.4	8%	0.079	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	111.3	-174.6	-173.5	73.8	0	0	0	111	F78 V79 M101 L113 T115	F78-L95 WeakPolarHBondContact CA-O 3.43Å; F78-L95 WeakPolarHBondContact CB-O 3.44Å; V79-L95 HydrophobicContact CB-CB 4.42Å; V79-L95 PolarHBondContact N-O 3.27Å; V79-L95 PolarHBondContact O-N 2.86Å; L95-M101 HydrophobicContact CD2-CE 3.71Å; L95-M101 HydrophobicContact CG-CE 3.71Å; L95-L113 HydrophobicContact CD2-CB 4.21Å; L95-L113 HydrophobicContact CD2-CD1 3.92Å; L95-T115 HydrophobicContact CD1-CG2 4.06Å
96	E	93.2	Very high	89.8	Confident	48 Å²	48	43.7 Å²	43.7	22%	0.224	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	143.1	-176.8	-34.9	93.4	129.3	0	0	112.5	F78 W98 M101 H156 V159	F78-E96 HydrophobicContact CB-CB 4.42Å; E96-W98 HydrophobicContact CB-CD2 4.42Å; E96-W98 HydrophobicContact CB-CZ2 3.79Å; E96-W98 HydrophobicContact CG-CZ2 3.99Å; E96-W98 PolarHBondContact O-N 3Å; E96-W98 VanDerWaalsContact O-N 3.16Å; E96-W98 PolarHBondContact OE2-NE1 3.27Å; E96-M101 WeakPolarHBondContact O-CE 3.42Å; E96-H156 HydrophobicContact CB-CB 4.38Å; E96-H156 HydrophobicContact CG-CB 4.28Å; E96-V159 HydrophobicContact CG-CB 4.25Å; E96-V159 HydrophobicContact CG-CG1 4.01Å; E96-V159 HydrophobicContact CG-CG2 4.11Å
97	I	94.3	Very high	89.1	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	24%	0.236	C	C	.	.			trans	-89.9	87.9	-175.6	-61.5	163.2	0	0	0	109.6	V65 S77 V79 M101 A140 C141 A144	V65-I97 HydrophobicContact CG1-CD1 4.31Å; S77-I97 VanDerWaalsContact O-CB 3.31Å; S77-I97 WeakPolarHBondContact O-CB 3.35Å; S77-I97 PolarHBondContact O-N 3.44Å; V79-I97 HydrophobicContact CG2-CD1 3.89Å; V79-I97 HydrophobicContact CG2-CG1 4.15Å; I97-M101 HydrophobicContact CB-SD 4.37Å; I97-M101 HydrophobicContact CG1-CE 4.1Å; I97-M101 HydrophobicContact CG1-SD 3.87Å; I97-M101 HydrophobicContact CG2-SD 4.21Å; I97-A140 HydrophobicContact CD1-CB 3.75Å; I97-A140 HydrophobicContact CG2-CB 4.19Å; I97-C141 HydrophobicContact CG2-CB 4.23Å; I97-C141 VanDerWaalsContact CG2-SG 3.54Å; I97-A144 HydrophobicContact CG2-CB 4.22Å; I97-A144 WeakPolarHBondContact O-CB 3.37Å
98	W	92.6	Very high	88.9	Confident	22 Å²	22	42.2 Å²	42.2	8%	0.083	25%	0.246	C	C	.	.			trans	-81.5	162.5	174.9	-56.2	114.5	0	0	0	112.5	E96 D100 M101 F150 C151 H156	E96-W98 HydrophobicContact CB-CD2 4.42Å; E96-W98 HydrophobicContact CB-CZ2 3.79Å; E96-W98 HydrophobicContact CG-CZ2 3.99Å; E96-W98 PolarHBondContact O-N 3Å; E96-W98 VanDerWaalsContact O-N 3.16Å; E96-W98 PolarHBondContact OE2-NE1 3.27Å; W98-D100 WeakPolarHBondContact CB-OD1 3.44Å; W98-D100 PolarHBondContact O-N 2.9Å; W98-D100 VanDerWaalsContact O-N 3.12Å; W98-M101 WeakPolarHBondContact O-CB 3.47Å; W98-M101 PolarHBondContact O-N 3.47Å; W98-F150 WeakPolarHBondContact CZ3-O 3.43Å; W98-C151 HydrophobicContact CD2-CB 4.33Å; W98-C151 HydrophobicContact CZ2-CB 4.17Å; W98-H156 AromaticContact CE3-ND1 3.99Å; W98-H156 HydrophobicContact CH2-CB 3.78Å; W98-H156 AromaticContact CH2-ND1 3.67Å; W98-H156 HydrophobicContact CZ2-CB 4.31Å; W98-H156 HydrophobicContact CZ3-CB 4.39Å; W98-H156 AromaticContact CZ3-ND1 3.37Å; W98-H156 WeakPolarHBondContact CZ3-ND1 3.44Å
99	Q	92	Very high	88.2	Confident	71 Å²	71	36.9 Å²	36.9	33%	0.332	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.3	-179.1	70.4	-174	-33.2	0	0	114.5	A144 R145 Y149	Q99-A144 WeakPolarHBondContact CB-O 3.39Å; Q99-R145 HydrophobicContact CB-CG 4.06Å; Q99-R145 WeakPolarHBondContact O-CG 3.33Å; Q99-Y149 WeakPolarHBondContact CB-O 3.39Å; Q99-Y149 VanDerWaalsContact CG-O 3.22Å; Q99-Y149 WeakPolarHBondContact CG-O 3.09Å; Q99-Y149 PolarHBondContact N-O 2.99Å
100	D	89.9	Confident	87.8	Confident	56 Å²	56	36.2 Å²	36.2	30%	0.299	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	3	179.9	55.5	3.6	0	0	0	113.6	W98 K116	W98-D100 WeakPolarHBondContact CB-OD1 3.44Å; W98-D100 PolarHBondContact O-N 2.9Å; W98-D100 VanDerWaalsContact O-N 3.12Å; D100-K116 VanDerWaalsContact OD2-CD 3.25Å; D100-K116 WeakPolarHBondContact OD2-CD 3.49Å; D100-K116 WeakPolarHBondContact OD2-CE 3.45Å; D100-K116 IonicContact OD2-NZ 2.68Å; D100-K116 PolarHBondContact OD2-NZ 3.3Å
101	M	92.9	Very high	87.6	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	22%	0.218	C	C	.	.			trans	-72.6	133.6	169	-172.2	-178.4	-71.7	0	0	111.1	L95 E96 I97 W98 I114 T115 R145	L95-M101 HydrophobicContact CD2-CE 3.71Å; L95-M101 HydrophobicContact CG-CE 3.71Å; E96-M101 WeakPolarHBondContact O-CE 3.42Å; I97-M101 HydrophobicContact CB-SD 4.37Å; I97-M101 HydrophobicContact CG1-CE 4.1Å; I97-M101 HydrophobicContact CG1-SD 3.87Å; I97-M101 HydrophobicContact CG2-SD 4.21Å; W98-M101 WeakPolarHBondContact O-CB 3.47Å; W98-M101 PolarHBondContact O-N 3.47Å; M101-I114 WeakPolarHBondContact CA-O 3.43Å; M101-T115 HydrophobicContact CE-CG2 3.81Å; M101-T115 HydrophobicContact CG-CG2 4.36Å; M101-R145 PolarHBondContact O-NH1 3.44Å
102	S	90.1	Very high	87.4	Confident	49 Å²	49	36 Å²	36	34%	0.343	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	158.3	171.8	58.6	0	0	0	0	110.8	I114	S102-I114 PolarHBondContact N-O 2.98Å; S102-I114 PolarHBondContact O-N 2.93Å; S102-I114 PolarHBondContact OG-O 3.45Å
103	I	91.8	Very high	87.5	Confident	10 Å²	10	35.6 Å²	35.6	5%	0.051	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	123.2	-179.6	176	170.2	0	0	0	109.7	F111 E112 L113 F134 I137 N138	I103-F111 HydrophobicContact CD1-CB 4.48Å; I103-F111 HydrophobicContact CD1-CD2 3.61Å; I103-F111 HydrophobicContact CD1-CE2 4.05Å; I103-F111 HydrophobicContact CD1-CG 4.21Å; I103-F111 HydrophobicContact CG1-CB 4.45Å; I103-F111 HydrophobicContact CG1-CD2 4.02Å; I103-E112 CarbonylContact C-O 3.55Å; I103-E112 VanDerWaalsContact CA-O 3.3Å; I103-E112 WeakPolarHBondContact CA-O 3.29Å; I103-L113 HydrophobicContact CB-CD2 3.8Å; I103-L113 HydrophobicContact CD1-CD2 3.75Å; I103-L113 HydrophobicContact CG1-CD2 3.79Å; I103-F134 HydrophobicContact CD1-CD2 3.92Å; I103-F134 HydrophobicContact CG1-CD2 3.89Å; I103-F134 HydrophobicContact CG1-CE2 4.21Å; I103-F134 HydrophobicContact CG2-CD2 4.41Å; I103-F134 HydrophobicContact CG2-CE2 4.24Å; I103-I137 HydrophobicContact CB-CG2 4.44Å; I103-I137 HydrophobicContact CD1-CB 3.96Å; I103-I137 HydrophobicContact CD1-CD1 4.2Å; I103-I137 HydrophobicContact CD1-CG2 4.12Å; I103-I137 HydrophobicContact CG2-CG2 4.45Å; I103-N138 HydrophobicContact CG2-CB 4.5Å; I103-N138 VanDerWaalsContact CG2-CG 3.46Å; I103-N138 VanDerWaalsContact CG2-ND2 3.27Å; I103-N138 WeakPolarHBondContact CG2-ND2 3.31Å; I103-N138 WeakPolarHBondContact CG2-OD1 3.48Å
104	N	87.7	Confident	87.2	Confident	81 Å²	81	36.7 Å²	36.7	43%	0.433	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	152	179.4	-74.3	-17.1	0	0	0	110.4	F111 E112 I114	N104-F111 CarbonylContact O-C 3.25Å; N104-F111 VanDerWaalsContact O-CA 3.25Å; N104-F111 WeakPolarHBondContact O-CA 3.44Å; N104-F111 WeakPolarHBondContact O-CB 3.29Å; N104-E112 HydrophobicContact CB-CB 4.39Å; N104-E112 PolarHBondContact N-O 3.19Å; N104-E112 PolarHBondContact O-N 3.01Å; N104-I114 VanDerWaalsContact ND2-CD1 3.3Å; N104-I114 WeakPolarHBondContact ND2-CD1 3.36Å
105	L	85.3	Confident	86.8	Confident	93 Å²	93	36.7 Å²	36.7	49%	0.487	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.8	173.8	-66.5	175.2	0	0	0	110.2	F111 L130 F134	L105-F111 HydrophobicContact CD2-CB 4.3Å; L105-L130 HydrophobicContact CD2-CD1 3.85Å; L105-L130 HydrophobicContact CD2-CD2 4.44Å; L105-L130 HydrophobicContact CD2-CG 4.16Å; L105-F134 HydrophobicContact CD1-CD2 4.38Å; L105-F134 HydrophobicContact CD1-CE2 4.31Å; L105-F134 HydrophobicContact CD2-CB 4.32Å; L105-F134 HydrophobicContact CD2-CD2 3.54Å; L105-F134 HydrophobicContact CD2-CE2 4.09Å; L105-F134 HydrophobicContact CD2-CG 4.05Å; L105-F134 HydrophobicContact CG-CD2 3.81Å; L105-F134 HydrophobicContact CG-CE2 3.81Å; L105-F134 HydrophobicContact CG-CG 4.49Å; L105-F134 HydrophobicContact CG-CZ 4.47Å
106	C	70.8	Confident	85.9	Confident	26 Å²	26	42 Å²	42	18%	0.176	24%	0.244	C	C	.	.			trans	-84.5	141.1	173.8	-53.9	0	0	0	0	109.4	D108 G109 G110	C106-D108 WeakPolarHBondContact CB-OD1 3.45Å; C106-D108 PolarHBondContact O-N 3.41Å; C106-D108 VanDerWaalsContact O-N 3.08Å; C106-G109 PolarHBondContact O-N 2.9Å; C106-G110 WeakPolarHBondContact CB-O 3.31Å; C106-G110 PolarHBondContact N-O 3.46Å
107	G	69.2	Low	84.9	Confident	84 Å²	84	44 Å²	44	87%	0.866	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-10.3	-174.8	0	0	0	0	0	115.3
108	D	75.7	Confident	84.1	Confident	89 Å²	89	46.3 Å²	46.3	48%	0.476	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-8.1	179.8	73.9	-36.3	0	0	0	113.8	C106 G110 K123	C106-D108 WeakPolarHBondContact CB-OD1 3.45Å; C106-D108 PolarHBondContact O-N 3.41Å; C106-D108 VanDerWaalsContact O-N 3.08Å; D108-G110 PolarHBondContact OD1-N 3.48Å; D108-K123 WeakPolarHBondContact OD2-CD 3.21Å; D108-K123 VanDerWaalsContact OD2-CE 3.22Å; D108-K123 WeakPolarHBondContact OD2-CE 3.33Å; D108-K123 IonicContact OD2-NZ 3.95Å; D108-K123 PolarHBondContact OD2-NZ 3.18Å
109	G	73.5	Confident	83.8	Confident	29 Å²	29	46.8 Å²	46.8	30%	0.299	27%	0.273	S	S	.	.	S	Bend	trans	102.7	5.6	-173	0	0	0	0	0	115	C106 L130	C106-G109 PolarHBondContact O-N 2.9Å; G109-L130 WeakPolarHBondContact O-CD2 3.23Å
110	G	85.1	Confident	83.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.258	C	S	.	.			trans	-83.5	178.8	165.6	0	0	0	0	0	114.3	C106 D108 F122	C106-G110 WeakPolarHBondContact CB-O 3.31Å; C106-G110 PolarHBondContact N-O 3.46Å; D108-G110 PolarHBondContact OD1-N 3.48Å; G110-F122 CarbonylContact C-O 3.54Å; G110-F122 WeakPolarHBondContact CA-O 3.38Å
111	F	89.4	Confident	83.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	149.5	162.9	68.6	-90.5	0	0	0	111.2	I48 I103 N104 L105 L113 F122 P124 L130 A133 I137	I48-F111 HydrophobicContact CD1-CE1 3.9Å; I48-F111 HydrophobicContact CD1-CZ 4.15Å; I103-F111 HydrophobicContact CD1-CB 4.48Å; I103-F111 HydrophobicContact CD1-CD2 3.61Å; I103-F111 HydrophobicContact CD1-CE2 4.05Å; I103-F111 HydrophobicContact CD1-CG 4.21Å; I103-F111 HydrophobicContact CG1-CB 4.45Å; I103-F111 HydrophobicContact CG1-CD2 4.02Å; N104-F111 CarbonylContact O-C 3.25Å; N104-F111 VanDerWaalsContact O-CA 3.25Å; N104-F111 WeakPolarHBondContact O-CA 3.44Å; N104-F111 WeakPolarHBondContact O-CB 3.29Å; L105-F111 HydrophobicContact CD2-CB 4.3Å; F111-L113 HydrophobicContact CD2-CD2 3.93Å; F111-L113 HydrophobicContact CD2-CG 4.19Å; F111-L113 HydrophobicContact CE2-CD1 4.34Å; F111-L113 HydrophobicContact CE2-CD2 3.8Å; F111-L113 HydrophobicContact CE2-CG 3.88Å; F111-F122 HydrophobicContact CD1-CB 3.88Å; F111-F122 HydrophobicContact CD2-CB 4.17Å; F111-F122 AromaticContact CD2-CD2 3.97Å; F111-F122 HydrophobicContact CD2-CD2 3.97Å; F111-F122 HydrophobicContact CD2-CG 4.34Å; F111-F122 HydrophobicContact CE1-CB 3.51Å; F111-F122 HydrophobicContact CE1-CG 4.23Å; F111-F122 HydrophobicContact CE2-CB 3.81Å; F111-F122 HydrophobicContact CE2-CD1 4.49Å; F111-F122 AromaticContact CE2-CD2 3.55Å; F111-F122 HydrophobicContact CE2-CD2 3.55Å; F111-F122 HydrophobicContact CE2-CE2 4.24Å; F111-F122 AromaticContact CE2-CG 3.71Å; F111-F122 HydrophobicContact CE2-CG 3.71Å; F111-F122 HydrophobicContact CG-CB 4.22Å; F111-F122 HydrophobicContact CZ-CB 3.47Å; F111-F122 VanDerWaalsContact CZ-CB 3.47Å; F111-F122 HydrophobicContact CZ-CD1 4.22Å; F111-F122 HydrophobicContact CZ-CD2 4.02Å; F111-F122 AromaticContact CZ-CG 3.66Å; F111-F122 HydrophobicContact CZ-CG 3.66Å; F111-F122 PolarHBondContact N-O 3.03Å; F111-F122 PolarHBondContact O-N 3.45Å; F111-P124 HydrophobicContact CD1-CG 3.97Å; F111-P124 HydrophobicContact CE1-CG 3.75Å; F111-L130 HydrophobicContact CB-CD1 3.91Å; F111-L130 HydrophobicContact CD1-CD1 3.7Å; F111-L130 HydrophobicContact CG-CD1 4.28Å; F111-A133 HydrophobicContact CD1-CB 4.3Å; F111-A133 HydrophobicContact CE1-CB 3.58Å; F111-A133 HydrophobicContact CZ-CB 3.84Å; F111-I137 HydrophobicContact CE2-CD1 3.78Å; F111-I137 HydrophobicContact CZ-CD1 4.03Å
112	E	90.3	Very high	83.4	Confident	31 Å²	31	42.6 Å²	42.6	15%	0.145	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.9	172.6	-85.4	177.6	165.3	0	0	109.9	I103 N104 I114 V119 N120 Q121 R317	I103-E112 CarbonylContact C-O 3.55Å; I103-E112 VanDerWaalsContact CA-O 3.3Å; I103-E112 WeakPolarHBondContact CA-O 3.29Å; N104-E112 HydrophobicContact CB-CB 4.39Å; N104-E112 PolarHBondContact N-O 3.19Å; N104-E112 PolarHBondContact O-N 3.01Å; E112-I114 HydrophobicContact CB-CG1 4.15Å; E112-V119 HydrophobicContact CB-CG1 4.2Å; E112-V119 HydrophobicContact CG-CG1 3.75Å; E112-N120 WeakPolarHBondContact CA-O 3.06Å; E112-Q121 HydrophobicContact CG-CG 3.47Å; E112-Q121 VanDerWaalsContact CG-CG 3.47Å; E112-Q121 PolarHBondContact OE1-NE2 3.48Å; E112-R317 IonicContact OE1-NH2 3.97Å; E112-R317 PolarHBondContact OE1-NH2 3.05Å
113	L	92.1	Very high	83.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.6	158.9	-59	-174.8	0	0	0	108.4	V79 L95 I103 F111 V119 N120 F122 I137	V79-L113 HydrophobicContact CB-CD1 4.41Å; V79-L113 HydrophobicContact CG1-CD1 4.29Å; V79-L113 HydrophobicContact CG2-CD1 3.92Å; L95-L113 HydrophobicContact CD2-CB 4.21Å; L95-L113 HydrophobicContact CD2-CD1 3.92Å; I103-L113 HydrophobicContact CB-CD2 3.8Å; I103-L113 HydrophobicContact CD1-CD2 3.75Å; I103-L113 HydrophobicContact CG1-CD2 3.79Å; F111-L113 HydrophobicContact CD2-CD2 3.93Å; F111-L113 HydrophobicContact CD2-CG 4.19Å; F111-L113 HydrophobicContact CE2-CD1 4.34Å; F111-L113 HydrophobicContact CE2-CD2 3.8Å; F111-L113 HydrophobicContact CE2-CG 3.88Å; L113-V119 WeakPolarHBondContact O-CA 3.24Å; L113-N120 PolarHBondContact N-O 2.97Å; L113-N120 PolarHBondContact O-N 3.27Å; L113-F122 HydrophobicContact CB-CE2 3.97Å; L113-F122 HydrophobicContact CD1-CD2 4.37Å; L113-F122 HydrophobicContact CD1-CE2 3.52Å; L113-F122 HydrophobicContact CD1-CZ 3.73Å; L113-F122 HydrophobicContact CG-CD2 4.05Å; L113-F122 HydrophobicContact CG-CE2 3.5Å; L113-F122 VanDerWaalsContact CG-CE2 3.5Å; L113-F122 HydrophobicContact CG-CZ 4.24Å; L113-I137 HydrophobicContact CD1-CD1 4.27Å; L113-I137 HydrophobicContact CD2-CD1 4.02Å; L113-I137 HydrophobicContact CD2-CG2 3.8Å
114	I	88.4	Confident	83.3	Confident	42 Å²	42	42.5 Å²	42.5	22%	0.215	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.7	-178	-55.9	-178.2	0	0	0	108.1	M101 S102 N104 E112 V119	M101-I114 WeakPolarHBondContact CA-O 3.43Å; S102-I114 PolarHBondContact N-O 2.98Å; S102-I114 PolarHBondContact O-N 2.93Å; S102-I114 PolarHBondContact OG-O 3.45Å; N104-I114 VanDerWaalsContact ND2-CD1 3.3Å; N104-I114 WeakPolarHBondContact ND2-CD1 3.36Å; E112-I114 HydrophobicContact CB-CG1 4.15Å; I114-V119 HydrophobicContact CG1-CG1 4.22Å; I114-V119 HydrophobicContact CG1-CG2 4.19Å; I114-V119 HydrophobicContact CG2-CG2 4.31Å
115	T	84.8	Confident	83.2	Confident	22 Å²	22	41.4 Å²	41.4	14%	0.135	24%	0.241	C	C	.	.			trans	-104.8	178.9	165.6	72.4	0	0	0	0	109.3	L95 M101 H117 T118	L95-T115 HydrophobicContact CD1-CG2 4.06Å; M101-T115 HydrophobicContact CE-CG2 3.81Å; M101-T115 HydrophobicContact CG-CG2 4.36Å; T115-H117 PolarHBondContact O-N 3.33Å; T115-H117 PolarHBondContact OG1-N 3.3Å; T115-H117 VanDerWaalsContact OG1-N 3.1Å; T115-T118 PolarHBondContact N-O 3.24Å; T115-T118 PolarHBondContact OG1-N 2.64Å; T115-T118 PolarHBondContact OG1-O 3.18Å; T115-T118 PolarHBondContact OG1-OG1 3.09Å
116	K	74.2	Confident	83.2	Confident	128 Å²	128	38.6 Å²	38.6	56%	0.557	23%	0.229	S	C	*	.	S	Bend	trans	-60.5	-19.1	168.9	-73	-179.2	-178.1	136	0	114	D100 Y346	D100-K116 VanDerWaalsContact OD2-CD 3.25Å; D100-K116 WeakPolarHBondContact OD2-CD 3.49Å; D100-K116 WeakPolarHBondContact OD2-CE 3.45Å; D100-K116 IonicContact OD2-NZ 2.68Å; D100-K116 PolarHBondContact OD2-NZ 3.3Å; K116-Y346 PolarHBondContact O-OH 3.27Å
117	H	72.5	Confident	83.5	Confident	90 Å²	90	42.8 Å²	42.8	42%	0.417	25%	0.254	S	S	.	.	S	Bend	trans	-121.8	-21.1	-169.1	-57.4	-75	0	0	0	114.7	T115 Y346 E349	T115-H117 PolarHBondContact O-N 3.33Å; T115-H117 PolarHBondContact OG1-N 3.3Å; T115-H117 VanDerWaalsContact OG1-N 3.1Å; H117-Y346 AromaticContact ND1-CE1 3.76Å; H117-E349 IonicContact ND1-OE2 3.52Å
118	T	78.6	Confident	83.9	Confident	49 Å²	49	44.8 Å²	44.8	30%	0.301	24%	0.24	S	C	.	.			trans	-139.1	147.3	-175.2	63.3	0	0	0	0	111.8	T115 N120	T115-T118 PolarHBondContact N-O 3.24Å; T115-T118 PolarHBondContact OG1-N 2.64Å; T115-T118 PolarHBondContact OG1-O 3.18Å; T115-T118 PolarHBondContact OG1-OG1 3.09Å; T118-N120 WeakPolarHBondContact CB-OD1 3.27Å; T118-N120 PolarHBondContact OG1-OD1 3.38Å
119	V	85	Confident	84.3	Confident	32 Å²	32	40.6 Å²	40.6	19%	0.194	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117.9	160.2	-179.4	0	0	0	0	106.6	E112 L113 I114	E112-V119 HydrophobicContact CB-CG1 4.2Å; E112-V119 HydrophobicContact CG-CG1 3.75Å; L113-V119 WeakPolarHBondContact O-CA 3.24Å; I114-V119 HydrophobicContact CG1-CG1 4.22Å; I114-V119 HydrophobicContact CG1-CG2 4.19Å; I114-V119 HydrophobicContact CG2-CG2 4.31Å
120	N	88.2	Confident	85	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.027	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.5	178.3	-70.4	95.2	0	0	0	108.9	E112 L113 T118 F122 W176	E112-N120 WeakPolarHBondContact CA-O 3.06Å; L113-N120 PolarHBondContact N-O 2.97Å; L113-N120 PolarHBondContact O-N 3.27Å; T118-N120 WeakPolarHBondContact CB-OD1 3.27Å; T118-N120 PolarHBondContact OG1-OD1 3.38Å; N120-F122 HydrophobicContact CB-CE2 3.57Å; N120-F122 HydrophobicContact CB-CZ 3.94Å; N120-F122 VanDerWaalsContact O-CD2 3.31Å; N120-F122 WeakPolarHBondContact O-CD2 3.43Å; N120-F122 VanDerWaalsContact O-CE2 3.26Å; N120-F122 WeakPolarHBondContact O-CE2 3.49Å; N120-W176 PolarHBondContact ND2-O 3.34Å
121	Q	87.6	Confident	85	Confident	31 Å²	31	46.8 Å²	46.8	15%	0.145	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	138.1	-179.9	-77.9	175.9	-10.2	0	0	111.3	E112 T179 D180	E112-Q121 HydrophobicContact CG-CG 3.47Å; E112-Q121 VanDerWaalsContact CG-CG 3.47Å; E112-Q121 PolarHBondContact OE1-NE2 3.48Å; Q121-T179 HydrophobicContact CG-CG2 4.4Å; Q121-T179 VanDerWaalsContact OE1-CA 3.26Å; Q121-D180 PolarHBondContact OE1-OD2 3.49Å
122	F	91	Very high	84.9	Confident	3 Å²	3	47.9 Å²	47.9	1%	0.013	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.5	-177.5	-58.6	-101.5	0	0	0	108.9	L50 C63 V79 L93 G110 F111 L113 N120 P124 W176	L50-F122 HydrophobicContact CD1-CD1 3.95Å; L50-F122 HydrophobicContact CD2-CB 4.32Å; C63-F122 HydrophobicContact CB-CD1 4.15Å; C63-F122 HydrophobicContact CB-CE1 4.41Å; V79-F122 HydrophobicContact CG1-CE1 4.4Å; V79-F122 HydrophobicContact CG1-CZ 4.44Å; L93-F122 HydrophobicContact CD2-CE1 3.91Å; L93-F122 HydrophobicContact CD2-CZ 3.6Å; G110-F122 CarbonylContact C-O 3.54Å; G110-F122 WeakPolarHBondContact CA-O 3.38Å; F111-F122 HydrophobicContact CD1-CB 3.88Å; F111-F122 HydrophobicContact CD2-CB 4.17Å; F111-F122 AromaticContact CD2-CD2 3.97Å; F111-F122 HydrophobicContact CD2-CD2 3.97Å; F111-F122 HydrophobicContact CD2-CG 4.34Å; F111-F122 HydrophobicContact CE1-CB 3.51Å; F111-F122 HydrophobicContact CE1-CG 4.23Å; F111-F122 HydrophobicContact CE2-CB 3.81Å; F111-F122 HydrophobicContact CE2-CD1 4.49Å; F111-F122 AromaticContact CE2-CD2 3.55Å; F111-F122 HydrophobicContact CE2-CD2 3.55Å; F111-F122 HydrophobicContact CE2-CE2 4.24Å; F111-F122 AromaticContact CE2-CG 3.71Å; F111-F122 HydrophobicContact CE2-CG 3.71Å; F111-F122 HydrophobicContact CG-CB 4.22Å; F111-F122 HydrophobicContact CZ-CB 3.47Å; F111-F122 VanDerWaalsContact CZ-CB 3.47Å; F111-F122 HydrophobicContact CZ-CD1 4.22Å; F111-F122 HydrophobicContact CZ-CD2 4.02Å; F111-F122 AromaticContact CZ-CG 3.66Å; F111-F122 HydrophobicContact CZ-CG 3.66Å; F111-F122 PolarHBondContact N-O 3.03Å; F111-F122 PolarHBondContact O-N 3.45Å; L113-F122 HydrophobicContact CB-CE2 3.97Å; L113-F122 HydrophobicContact CD1-CD2 4.37Å; L113-F122 HydrophobicContact CD1-CE2 3.52Å; L113-F122 HydrophobicContact CD1-CZ 3.73Å; L113-F122 HydrophobicContact CG-CD2 4.05Å; L113-F122 HydrophobicContact CG-CE2 3.5Å; L113-F122 VanDerWaalsContact CG-CE2 3.5Å; L113-F122 HydrophobicContact CG-CZ 4.24Å; N120-F122 HydrophobicContact CB-CE2 3.57Å; N120-F122 HydrophobicContact CB-CZ 3.94Å; N120-F122 VanDerWaalsContact O-CD2 3.31Å; N120-F122 WeakPolarHBondContact O-CD2 3.43Å; N120-F122 VanDerWaalsContact O-CE2 3.26Å; N120-F122 WeakPolarHBondContact O-CE2 3.49Å; F122-P124 WeakPolarHBondContact O-CD 3.24Å; F122-W176 HydrophobicContact CD1-CZ3 4.03Å; F122-W176 HydrophobicContact CE1-CE3 4.23Å; F122-W176 AromaticContact CE1-CZ3 3.77Å; F122-W176 HydrophobicContact CE1-CZ3 3.77Å
123	K	89.4	Confident	85	Confident	56 Å²	56	46.5 Å²	46.5	24%	0.243	24%	0.237	C	C	.	.			trans	-116.9	94.6	178.1	-56.4	-164.2	-174.8	-160.2	0	110.3	L50 Q51 D108 D180	L50-K123 WeakPolarHBondContact CA-O 3.42Å; Q51-K123 HydrophobicContact CB-CB 4.38Å; Q51-K123 WeakPolarHBondContact CG-O 3.18Å; Q51-K123 PolarHBondContact N-O 3.47Å; D108-K123 WeakPolarHBondContact OD2-CD 3.21Å; D108-K123 VanDerWaalsContact OD2-CE 3.22Å; D108-K123 WeakPolarHBondContact OD2-CE 3.33Å; D108-K123 IonicContact OD2-NZ 3.95Å; D108-K123 PolarHBondContact OD2-NZ 3.18Å; K123-D180 VanDerWaalsContact CE-OD1 3.29Å; K123-D180 WeakPolarHBondContact CE-OD1 3.47Å; K123-D180 WeakPolarHBondContact CE-OD2 3.22Å; K123-D180 IonicContact NZ-OD1 3.31Å; K123-D180 PolarHBondContact NZ-OD1 3.31Å; K123-D180 IonicContact NZ-OD2 3.6Å; K123-D180 PolarHBondContact NZ-OD2 3.06Å
124	P	90.4	Very high	84.9	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.013	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-66.8	156	-179.1	-24.6	38.4	0	0	0	112.6	I48 L50 Q51 F111 F122 S126 A129 L130	I48-P124 HydrophobicContact CD1-CB 4.45Å; I48-P124 HydrophobicContact CD1-CG 4.02Å; L50-P124 HydrophobicContact CD2-CG 4.3Å; Q51-P124 PolarHBondContact NE2-O 2.87Å; F111-P124 HydrophobicContact CD1-CG 3.97Å; F111-P124 HydrophobicContact CE1-CG 3.75Å; F122-P124 WeakPolarHBondContact O-CD 3.24Å; P124-S126 PolarHBondContact O-N 3.42Å; P124-A129 HydrophobicContact CB-CB 3.78Å; P124-L130 HydrophobicContact CB-CB 4.47Å; P124-L130 HydrophobicContact CG-CB 4.19Å; P124-L130 HydrophobicContact CG-CD1 4.34Å
125	V	86.2	Confident	85	Confident	57 Å²	57	51.7 Å²	51.7	35%	0.345	26%	0.26	S	S	.	.	S	Bend	trans	-70.6	-5.9	178.9	-62.5	0	0	0	0	114.7	T6 K49 Q51	T6-V125 HydrophobicContact CG2-CG2 4.03Å; K49-V125 HydrophobicContact CB-CG1 4.13Å; K49-V125 HydrophobicContact CB-CG2 4.03Å; K49-V125 HydrophobicContact CD-CG1 4.3Å; K49-V125 HydrophobicContact CG-CG1 3.96Å; K49-V125 PolarHBondContact O-N 2.74Å; K49-V125 VanDerWaalsContact O-N 3.09Å; Q51-V125 HydrophobicContact CG-CG1 4.27Å
126	S	84.6	Confident	85.4	Confident	35 Å²	35	51.5 Å²	51.5	25%	0.245	26%	0.26	C	S	.	.	S	Bend	trans	-159.4	156.6	177.2	71.6	0	0	0	0	112.5	T6 P124 Q128 A129 L130	T6-S126 PolarHBondContact OG1-OG 3.01Å; P124-S126 PolarHBondContact O-N 3.42Å; S126-Q128 PolarHBondContact O-N 3.19Å; S126-A129 WeakPolarHBondContact O-CB 3.49Å; S126-A129 PolarHBondContact O-N 3.5Å; S126-A129 PolarHBondContact OG-N 3.25Å; S126-A129 VanDerWaalsContact OG-N 3.14Å; S126-L130 PolarHBondContact O-N 2.85Å
127	V	78	Confident	86.3	Confident	114 Å²	114	45.4 Å²	45.4	69%	0.691	23%	0.234	S	C	*	.	H	α-helix	trans	-61.1	-29	173.8	-177.4	0	0	0	0	111.9	L130 W131	V127-L130 PolarHBondContact O-N 2.75Å; V127-W131 WeakPolarHBondContact O-CB 3.34Å; V127-W131 PolarHBondContact O-N 3.32Å
128	Q	77.9	Confident	87.2	Confident	126 Å²	126	43.5 Å²	43.5	59%	0.589	23%	0.226	S	C	*	.	H	α-helix	trans	-66.8	-41.5	173	-69.6	-180	-16.5	0	0	111.8	S126 A132	S126-Q128 PolarHBondContact O-N 3.19Å; Q128-A132 WeakPolarHBondContact O-CB 3.46Å; Q128-A132 PolarHBondContact O-N 3.11Å
129	A	84.3	Confident	87.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-69	-38.2	174.6	0	0	0	0	0	112.2	I48 P124 S126 A133	I48-A129 HydrophobicContact CB-CB 4.17Å; I48-A129 HydrophobicContact CG2-CB 3.99Å; P124-A129 HydrophobicContact CB-CB 3.78Å; S126-A129 WeakPolarHBondContact O-CB 3.49Å; S126-A129 PolarHBondContact O-N 3.5Å; S126-A129 PolarHBondContact OG-N 3.25Å; S126-A129 VanDerWaalsContact OG-N 3.14Å; A129-A133 VanDerWaalsContact O-CB 3.3Å; A129-A133 WeakPolarHBondContact O-CB 3.47Å; A129-A133 PolarHBondContact O-N 2.89Å
130	L	88.2	Confident	88.4	Confident	21 Å²	21	45 Å²	45	11%	0.11	23%	0.227	C	C	.	.	H	α-helix	trans	-57.5	-50.4	171.2	176.2	66	0	0	0	112	L105 G109 F111 P124 S126 V127 A133 F134	L105-L130 HydrophobicContact CD2-CD1 3.85Å; L105-L130 HydrophobicContact CD2-CD2 4.44Å; L105-L130 HydrophobicContact CD2-CG 4.16Å; G109-L130 WeakPolarHBondContact O-CD2 3.23Å; F111-L130 HydrophobicContact CB-CD1 3.91Å; F111-L130 HydrophobicContact CD1-CD1 3.7Å; F111-L130 HydrophobicContact CG-CD1 4.28Å; P124-L130 HydrophobicContact CB-CB 4.47Å; P124-L130 HydrophobicContact CG-CB 4.19Å; P124-L130 HydrophobicContact CG-CD1 4.34Å; S126-L130 PolarHBondContact O-N 2.85Å; V127-L130 PolarHBondContact O-N 2.75Å; L130-A133 PolarHBondContact O-N 2.88Å; L130-F134 WeakPolarHBondContact O-CB 3.33Å; L130-F134 PolarHBondContact O-N 2.81Å
131	W	85.2	Confident	88.6	Confident	138 Å²	138	44.8 Å²	44.8	52%	0.523	23%	0.225	S	C	.	.	H	α-helix	trans	-67.9	-39.2	-179	-173.5	-118.3	0	0	0	112.5	V127 F134 Q135	V127-W131 WeakPolarHBondContact O-CB 3.34Å; V127-W131 PolarHBondContact O-N 3.32Å; W131-F134 HydrophobicContact CE3-CB 4.36Å; W131-F134 AromaticContact CE3-CD1 3.95Å; W131-F134 HydrophobicContact CE3-CD1 3.95Å; W131-F134 HydrophobicContact CE3-CG 4.49Å; W131-F134 HydrophobicContact CH2-CD1 4.3Å; W131-F134 AromaticContact CZ3-CD1 3.53Å; W131-F134 HydrophobicContact CZ3-CD1 3.53Å; W131-F134 AromaticContact CZ3-CE1 4Å; W131-F134 HydrophobicContact CZ3-CE1 4Å; W131-F134 HydrophobicContact CZ3-CG 4.43Å; W131-F134 PolarHBondContact O-N 3.07Å; W131-Q135 HydrophobicContact CD2-CG 4.34Å; W131-Q135 HydrophobicContact CZ2-CG 4.19Å; W131-Q135 VanDerWaalsContact NE1-NE2 3.19Å; W131-Q135 WeakPolarHBondContact O-CG 3.26Å; W131-Q135 PolarHBondContact O-N 3Å
132	A	86.4	Confident	88.9	Confident	24 Å²	24	48.4 Å²	48.4	20%	0.198	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-43.5	173.1	0	0	0	0	0	112	A7 L46 Q128 Q135 A136	A7-A132 HydrophobicContact CB-CB 3.85Å; L46-A132 HydrophobicContact CD1-CB 4.07Å; L46-A132 HydrophobicContact CD2-CB 4.3Å; L46-A132 WeakPolarHBondContact CD2-O 3.36Å; Q128-A132 WeakPolarHBondContact O-CB 3.46Å; Q128-A132 PolarHBondContact O-N 3.11Å; A132-Q135 PolarHBondContact O-N 2.98Å; A132-A136 WeakPolarHBondContact O-CB 3.27Å; A132-A136 PolarHBondContact O-N 3.5Å
133	A	91.3	Very high	89	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-61.8	-47.4	175.1	0	0	0	0	0	111.8	L46 I48 F111 A129 L130 Q135 A136 I137	L46-A133 VanDerWaalsContact CD2-CA 3.42Å; L46-A133 HydrophobicContact CD2-CB 4.16Å; I48-A133 HydrophobicContact CD1-CB 3.63Å; F111-A133 HydrophobicContact CD1-CB 4.3Å; F111-A133 HydrophobicContact CE1-CB 3.58Å; F111-A133 HydrophobicContact CZ-CB 3.84Å; A129-A133 VanDerWaalsContact O-CB 3.3Å; A129-A133 WeakPolarHBondContact O-CB 3.47Å; A129-A133 PolarHBondContact O-N 2.89Å; L130-A133 PolarHBondContact O-N 2.88Å; A133-Q135 VanDerWaalsContact C-N 3.32Å; A133-Q135 PolarHBondContact O-N 3.46Å; A133-A136 PolarHBondContact O-N 3.14Å; A133-I137 WeakPolarHBondContact O-CB 3.47Å; A133-I137 WeakPolarHBondContact O-CG1 3.49Å; A133-I137 PolarHBondContact O-N 3.24Å
134	F	90.1	Very high	89.2	Confident	44 Å²	44	47 Å²	47	19%	0.193	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-42.8	178.2	-170.6	-99.9	0	0	0	111.9	I103 L105 L130 W131 N138	I103-F134 HydrophobicContact CD1-CD2 3.92Å; I103-F134 HydrophobicContact CG1-CD2 3.89Å; I103-F134 HydrophobicContact CG1-CE2 4.21Å; I103-F134 HydrophobicContact CG2-CD2 4.41Å; I103-F134 HydrophobicContact CG2-CE2 4.24Å; L105-F134 HydrophobicContact CD1-CD2 4.38Å; L105-F134 HydrophobicContact CD1-CE2 4.31Å; L105-F134 HydrophobicContact CD2-CB 4.32Å; L105-F134 HydrophobicContact CD2-CD2 3.54Å; L105-F134 HydrophobicContact CD2-CE2 4.09Å; L105-F134 HydrophobicContact CD2-CG 4.05Å; L105-F134 HydrophobicContact CG-CD2 3.81Å; L105-F134 HydrophobicContact CG-CE2 3.81Å; L105-F134 HydrophobicContact CG-CG 4.49Å; L105-F134 HydrophobicContact CG-CZ 4.47Å; L130-F134 WeakPolarHBondContact O-CB 3.33Å; L130-F134 PolarHBondContact O-N 2.81Å; W131-F134 HydrophobicContact CE3-CB 4.36Å; W131-F134 AromaticContact CE3-CD1 3.95Å; W131-F134 HydrophobicContact CE3-CD1 3.95Å; W131-F134 HydrophobicContact CE3-CG 4.49Å; W131-F134 HydrophobicContact CH2-CD1 4.3Å; W131-F134 AromaticContact CZ3-CD1 3.53Å; W131-F134 HydrophobicContact CZ3-CD1 3.53Å; W131-F134 AromaticContact CZ3-CE1 4Å; W131-F134 HydrophobicContact CZ3-CE1 4Å; W131-F134 HydrophobicContact CZ3-CG 4.43Å; W131-F134 PolarHBondContact O-N 3.07Å; F134-N138 VanDerWaalsContact CE1-ND2 3.3Å; F134-N138 WeakPolarHBondContact CE1-ND2 3.07Å; F134-N138 WeakPolarHBondContact CE2-ND2 3.13Å; F134-N138 WeakPolarHBondContact CZ-ND2 3.46Å; F134-N138 VanDerWaalsContact O-CB 3.24Å; F134-N138 WeakPolarHBondContact O-CB 3.45Å; F134-N138 PolarHBondContact O-N 3.06Å; F134-N138 VanDerWaalsContact O-N 3.12Å; F134-N138 PolarHBondContact O-ND2 3.14Å
135	Q	90.7	Very high	89.4	Confident	108 Å²	108	52 Å²	52	51%	0.505	26%	0.257	S	S	.	.	H	α-helix	trans	-69.5	-48.8	177	-72.4	-169.1	-26.6	0	0	113	W131 A132 A133 K139	W131-Q135 HydrophobicContact CD2-CG 4.34Å; W131-Q135 HydrophobicContact CZ2-CG 4.19Å; W131-Q135 VanDerWaalsContact NE1-NE2 3.19Å; W131-Q135 WeakPolarHBondContact O-CG 3.26Å; W131-Q135 PolarHBondContact O-N 3Å; A132-Q135 PolarHBondContact O-N 2.98Å; A133-Q135 VanDerWaalsContact C-N 3.32Å; A133-Q135 PolarHBondContact O-N 3.46Å; Q135-K139 WeakPolarHBondContact O-CB 3.48Å; Q135-K139 PolarHBondContact O-N 3.02Å
136	A	92.9	Very high	89.7	Confident	17 Å²	17	54.6 Å²	54.6	14%	0.14	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-46	-177.7	0	0	0	0	0	111.8	L46 A132 A133 K139 A140	L46-A136 HydrophobicContact CB-CB 4.09Å; L46-A136 HydrophobicContact CD2-CB 3.81Å; A132-A136 WeakPolarHBondContact O-CB 3.27Å; A132-A136 PolarHBondContact O-N 3.5Å; A133-A136 PolarHBondContact O-N 3.14Å; A136-K139 WeakPolarHBondContact O-CB 3.18Å; A136-K139 PolarHBondContact O-N 2.95Å; A136-A140 PolarHBondContact O-N 3.32Å
137	I	94.2	Very high	90	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-71.3	-40.7	-178.6	-60.4	172.3	0	0	0	110.7	V65 V79 I103 F111 L113 A133 K139 A140 C141	V65-I137 HydrophobicContact CG2-CD1 4.25Å; V65-I137 HydrophobicContact CG2-CG1 3.68Å; V79-I137 HydrophobicContact CG2-CD1 4.39Å; I103-I137 HydrophobicContact CB-CG2 4.44Å; I103-I137 HydrophobicContact CD1-CB 3.96Å; I103-I137 HydrophobicContact CD1-CD1 4.2Å; I103-I137 HydrophobicContact CD1-CG2 4.12Å; I103-I137 HydrophobicContact CG2-CG2 4.45Å; F111-I137 HydrophobicContact CE2-CD1 3.78Å; F111-I137 HydrophobicContact CZ-CD1 4.03Å; L113-I137 HydrophobicContact CD1-CD1 4.27Å; L113-I137 HydrophobicContact CD2-CD1 4.02Å; L113-I137 HydrophobicContact CD2-CG2 3.8Å; A133-I137 WeakPolarHBondContact O-CB 3.47Å; A133-I137 WeakPolarHBondContact O-CG1 3.49Å; A133-I137 PolarHBondContact O-N 3.24Å; I137-K139 VanDerWaalsContact C-N 3.3Å; I137-K139 PolarHBondContact O-N 3.19Å; I137-A140 PolarHBondContact O-N 2.83Å; I137-C141 WeakPolarHBondContact O-CB 3.25Å; I137-C141 PolarHBondContact O-N 2.8Å; I137-C141 PolarHBondContact O-SG 3.11Å
138	N	91.8	Very high	90.7	Very high	50 Å²	50	55.4 Å²	55.4	27%	0.267	27%	0.268	S	S	.	.	H	α-helix	trans	-59	-40.3	172.8	-88.8	-67	0	0	0	112.6	I103 F134 C141 Q142	I103-N138 HydrophobicContact CG2-CB 4.5Å; I103-N138 VanDerWaalsContact CG2-CG 3.46Å; I103-N138 VanDerWaalsContact CG2-ND2 3.27Å; I103-N138 WeakPolarHBondContact CG2-ND2 3.31Å; I103-N138 WeakPolarHBondContact CG2-OD1 3.48Å; F134-N138 VanDerWaalsContact CE1-ND2 3.3Å; F134-N138 WeakPolarHBondContact CE1-ND2 3.07Å; F134-N138 WeakPolarHBondContact CE2-ND2 3.13Å; F134-N138 WeakPolarHBondContact CZ-ND2 3.46Å; F134-N138 VanDerWaalsContact O-CB 3.24Å; F134-N138 WeakPolarHBondContact O-CB 3.45Å; F134-N138 PolarHBondContact O-N 3.06Å; F134-N138 VanDerWaalsContact O-N 3.12Å; F134-N138 PolarHBondContact O-ND2 3.14Å; N138-C141 PolarHBondContact O-N 3.23Å; N138-Q142 WeakPolarHBondContact O-CB 3.47Å; N138-Q142 PolarHBondContact O-N 2.83Å
139	K	93.5	Very high	91.3	Very high	109 Å²	109	49.8 Å²	49.8	47%	0.474	24%	0.242	S	C	.	.	H	α-helix	trans	-61.3	-47.8	175.1	-175.3	-160.8	169.7	-131.8	0	110.8	E75 Q135 A136 I137 Q142 V143	E75-K139 IonicContact OE2-NZ 3.54Å; Q135-K139 WeakPolarHBondContact O-CB 3.48Å; Q135-K139 PolarHBondContact O-N 3.02Å; A136-K139 WeakPolarHBondContact O-CB 3.18Å; A136-K139 PolarHBondContact O-N 2.95Å; I137-K139 VanDerWaalsContact C-N 3.3Å; I137-K139 PolarHBondContact O-N 3.19Å; K139-Q142 WeakPolarHBondContact O-CB 3.42Å; K139-Q142 PolarHBondContact O-N 3.04Å; K139-V143 WeakPolarHBondContact O-CG2 3.48Å; K139-V143 PolarHBondContact O-N 3.36Å
140	A	94.6	Very high	91.5	Very high	3 Å²	3	54 Å²	54	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-42.3	178.6	0	0	0	0	0	112.2	I97 A136 I137 Q142 V143 A144	I97-A140 HydrophobicContact CD1-CB 3.75Å; I97-A140 HydrophobicContact CG2-CB 4.19Å; A136-A140 PolarHBondContact O-N 3.32Å; I137-A140 PolarHBondContact O-N 2.83Å; A140-Q142 VanDerWaalsContact C-N 3.27Å; A140-Q142 PolarHBondContact O-N 3.18Å; A140-V143 PolarHBondContact O-N 3.07Å; A140-A144 WeakPolarHBondContact O-CB 2.79Å; A140-A144 PolarHBondContact O-N 2.97Å
141	C	93.3	Very high	91.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-31.9	172.8	-62.9	0	0	0	0	112.5	I97 I137 N138 R145	I97-C141 HydrophobicContact CG2-CB 4.23Å; I97-C141 VanDerWaalsContact CG2-SG 3.54Å; I137-C141 WeakPolarHBondContact O-CB 3.25Å; I137-C141 PolarHBondContact O-N 2.8Å; I137-C141 PolarHBondContact O-SG 3.11Å; N138-C141 PolarHBondContact O-N 3.23Å; C141-R145 WeakPolarHBondContact O-CG 3.3Å; C141-R145 VanDerWaalsContact O-CZ 3.25Å; C141-R145 PolarHBondContact O-N 3.29Å; C141-R145 VanDerWaalsContact O-N 3.07Å; C141-R145 PolarHBondContact O-NE 2.68Å
142	Q	93.2	Very high	90.7	Very high	107 Å²	107	59.3 Å²	59.3	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-68.4	-47.4	172.9	-179.3	173.7	-3.9	0	0	111.1	N138 K139 A140 A144 R145 D146	N138-Q142 WeakPolarHBondContact O-CB 3.47Å; N138-Q142 PolarHBondContact O-N 2.83Å; K139-Q142 WeakPolarHBondContact O-CB 3.42Å; K139-Q142 PolarHBondContact O-N 3.04Å; A140-Q142 VanDerWaalsContact C-N 3.27Å; A140-Q142 PolarHBondContact O-N 3.18Å; Q142-A144 PolarHBondContact O-N 3.42Å; Q142-R145 PolarHBondContact O-N 3.09Å; Q142-R145 VanDerWaalsContact O-N 3.08Å; Q142-D146 WeakPolarHBondContact CG-OD2 3.4Å; Q142-D146 WeakPolarHBondContact O-CB 3.32Å; Q142-D146 VanDerWaalsContact O-CG 3.26Å; Q142-D146 PolarHBondContact O-N 3.18Å
143	V	93.7	Very high	90.4	Very high	28 Å²	28	59.1 Å²	59.1	17%	0.17	29%	0.29	C	S	.	.	H	α-helix	trans	-56.1	-42.1	173.3	174.9	0	0	0	0	110.6	E75 K139 A140 R145 D146 K147 Y149	E75-V143 HydrophobicContact CB-CG1 4.41Å; E75-V143 WeakPolarHBondContact O-CG1 3.3Å; K139-V143 WeakPolarHBondContact O-CG2 3.48Å; K139-V143 PolarHBondContact O-N 3.36Å; A140-V143 PolarHBondContact O-N 3.07Å; V143-R145 VanDerWaalsContact C-N 3.33Å; V143-R145 PolarHBondContact O-N 3.09Å; V143-D146 PolarHBondContact O-N 2.83Å; V143-K147 HydrophobicContact CG1-CG 4.21Å; V143-K147 WeakPolarHBondContact O-CB 3.49Å; V143-K147 VanDerWaalsContact O-CG 3.32Å; V143-K147 WeakPolarHBondContact O-CG 3.15Å; V143-K147 PolarHBondContact O-N 2.7Å; V143-Y149 HydrophobicContact CG1-CE2 4.49Å
144	A	93.6	Very high	89.9	Confident	1 Å²	1	67 Å²	67	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-63.1	-34.9	177.3	0	0	0	0	0	113.8	I97 Q99 A140 Q142 A148 Y149	I97-A144 HydrophobicContact CG2-CB 4.22Å; I97-A144 WeakPolarHBondContact O-CB 3.37Å; Q99-A144 WeakPolarHBondContact CB-O 3.39Å; A140-A144 WeakPolarHBondContact O-CB 2.79Å; A140-A144 PolarHBondContact O-N 2.97Å; Q142-A144 PolarHBondContact O-N 3.42Å; A144-A148 CarbonylContact O-C 3.52Å; A144-A148 WeakPolarHBondContact O-CA 3.48Å; A144-A148 PolarHBondContact O-N 3.47Å; A144-Y149 VanDerWaalsContact CA-CD2 3.46Å; A144-Y149 HydrophobicContact CB-CD2 3.69Å; A144-Y149 HydrophobicContact CB-CE2 4.47Å; A144-Y149 HydrophobicContact CB-CG 4.41Å; A144-Y149 PolarHBondContact O-N 3.37Å
145	R	93.5	Very high	89.8	Confident	107 Å²	107	65.4 Å²	65.4	40%	0.404	32%	0.318	S	S	.	.	H	α-helix	trans	-72.3	-47.4	171.6	-75.2	-179.3	-71.6	-92.4	3.9	112.3	Q99 M101 C141 Q142 V143 K147 A148	Q99-R145 HydrophobicContact CB-CG 4.06Å; Q99-R145 WeakPolarHBondContact O-CG 3.33Å; M101-R145 PolarHBondContact O-NH1 3.44Å; C141-R145 WeakPolarHBondContact O-CG 3.3Å; C141-R145 VanDerWaalsContact O-CZ 3.25Å; C141-R145 PolarHBondContact O-N 3.29Å; C141-R145 VanDerWaalsContact O-N 3.07Å; C141-R145 PolarHBondContact O-NE 2.68Å; Q142-R145 PolarHBondContact O-N 3.09Å; Q142-R145 VanDerWaalsContact O-N 3.08Å; V143-R145 VanDerWaalsContact C-N 3.33Å; V143-R145 PolarHBondContact O-N 3.09Å; R145-K147 PolarHBondContact O-N 3.09Å; R145-A148 PolarHBondContact O-N 3.27Å
146	D	93.2	Very high	89.8	Confident	112 Å²	112	60.7 Å²	60.7	60%	0.599	30%	0.296	S	S	*	.	H	α-helix	trans	-65.4	-20.1	-179.3	-65	-10.3	0	0	0	112.5	Q142 V143	Q142-D146 WeakPolarHBondContact CG-OD2 3.4Å; Q142-D146 WeakPolarHBondContact O-CB 3.32Å; Q142-D146 VanDerWaalsContact O-CG 3.26Å; Q142-D146 PolarHBondContact O-N 3.18Å; V143-D146 PolarHBondContact O-N 2.83Å
147	K	91.4	Very high	89.6	Confident	116 Å²	116	63.4 Å²	63.4	50%	0.504	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	1.8	173.1	-58.1	-55.1	-177	-176.8	0	114.5	T74 V143 R145 Y149	T74-K147 HydrophobicContact CG2-CD 3.92Å; T74-K147 HydrophobicContact CG2-CG 4.29Å; V143-K147 HydrophobicContact CG1-CG 4.21Å; V143-K147 WeakPolarHBondContact O-CB 3.49Å; V143-K147 VanDerWaalsContact O-CG 3.32Å; V143-K147 WeakPolarHBondContact O-CG 3.15Å; V143-K147 PolarHBondContact O-N 2.7Å; R145-K147 PolarHBondContact O-N 3.09Å; K147-Y149 HydrophobicContact CB-CD1 3.85Å; K147-Y149 HydrophobicContact CB-CE1 3.42Å; K147-Y149 VanDerWaalsContact CB-CE1 3.42Å; K147-Y149 HydrophobicContact CB-CE2 4.22Å; K147-Y149 HydrophobicContact CB-CG 4.44Å; K147-Y149 HydrophobicContact CG-CE1 4.23Å; K147-Y149 PolarHBondContact O-N 3.15Å
148	A	90.9	Very high	89.3	Confident	50 Å²	50	63.7 Å²	63.7	41%	0.413	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	47.2	-179.2	0	0	0	0	0	114.6	A144 R145 F150	A144-A148 CarbonylContact O-C 3.52Å; A144-A148 WeakPolarHBondContact O-CA 3.48Å; A144-A148 PolarHBondContact O-N 3.47Å; R145-A148 PolarHBondContact O-N 3.27Å; A148-F150 WeakPolarHBondContact O-CD1 3.34Å; A148-F150 PolarHBondContact O-N 3.1Å
149	Y	91.9	Very high	89.3	Confident	9 Å²	9	61.3 Å²	61.3	4%	0.035	30%	0.297	C	S	.	.			trans	-69.7	128.9	177.7	-60.8	-29.6	0	0	0	111.9	T74 E75 E76 Q99 V143 A144 K147 T155 H156	T74-Y149 WeakPolarHBondContact CB-OH 3.43Å; T74-Y149 PolarHBondContact OG1-OH 2.78Å; E75-Y149 PolarHBondContact O-OH 3.28Å; E75-Y149 VanDerWaalsContact O-OH 3.11Å; E76-Y149 HydrophobicContact CG-CE1 4.29Å; E76-Y149 HydrophobicContact CG-CE2 4.16Å; Q99-Y149 WeakPolarHBondContact CB-O 3.39Å; Q99-Y149 VanDerWaalsContact CG-O 3.22Å; Q99-Y149 WeakPolarHBondContact CG-O 3.09Å; Q99-Y149 PolarHBondContact N-O 2.99Å; V143-Y149 HydrophobicContact CG1-CE2 4.49Å; A144-Y149 VanDerWaalsContact CA-CD2 3.46Å; A144-Y149 HydrophobicContact CB-CD2 3.69Å; A144-Y149 HydrophobicContact CB-CE2 4.47Å; A144-Y149 HydrophobicContact CB-CG 4.41Å; A144-Y149 PolarHBondContact O-N 3.37Å; K147-Y149 HydrophobicContact CB-CD1 3.85Å; K147-Y149 HydrophobicContact CB-CE1 3.42Å; K147-Y149 VanDerWaalsContact CB-CE1 3.42Å; K147-Y149 HydrophobicContact CB-CE2 4.22Å; K147-Y149 HydrophobicContact CB-CG 4.44Å; K147-Y149 HydrophobicContact CG-CE1 4.23Å; K147-Y149 PolarHBondContact O-N 3.15Å; Y149-T155 HydrophobicContact CD1-CG2 3.88Å; Y149-T155 HydrophobicContact CE1-CG2 3.95Å; Y149-H156 AromaticContact CD2-CE1 3.58Å
150	F	88.6	Confident	89.1	Confident	87 Å²	87	59.3 Å²	59.3	38%	0.382	30%	0.297	S	S	.	.			trans	-134.4	146.6	177.6	60.9	-89.5	0	0	0	112.2	W98 A148 R152 G153 Y1012	W98-F150 WeakPolarHBondContact CZ3-O 3.43Å; A148-F150 WeakPolarHBondContact O-CD1 3.34Å; A148-F150 PolarHBondContact O-N 3.1Å; F150-R152 PolarHBondContact O-N 3.09Å; F150-G153 VanDerWaalsContact CE2-CA 3.48Å; F150-G153 PolarHBondContact O-N 3.39Å; F150-Y1012 HydrophobicContact CE2-CE1 4.28Å
151	C	81.4	Confident	89	Confident	78 Å²	78	63.6 Å²	63.6	53%	0.527	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	132.9	174.6	-177.8	0	0	0	0	110.7	W98 G153	W98-C151 HydrophobicContact CD2-CB 4.33Å; W98-C151 HydrophobicContact CZ2-CB 4.17Å; C151-G153 VanDerWaalsContact C-N 3.34Å
152	R	75.3	Confident	89	Confident	194 Å²	194	63.6 Å²	63.6	73%	0.732	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	13.5	-169.1	-48.6	177.3	175.6	-179.6	-3.4	116	F150	F150-R152 PolarHBondContact O-N 3.09Å
153	G	78.5	Confident	88.8	Confident	19 Å²	19	63.9 Å²	63.9	20%	0.196	31%	0.314	C	S	.	.	S	Bend	trans	-73.8	-178.1	163.1	0	0	0	0	0	112.9	F150 C151 T155	F150-G153 VanDerWaalsContact CE2-CA 3.48Å; F150-G153 PolarHBondContact O-N 3.39Å; C151-G153 VanDerWaalsContact C-N 3.34Å; G153-T155 PolarHBondContact O-N 3.37Å; G153-T155 VanDerWaalsContact O-N 3.15Å
154	F	81.3	Confident	88.7	Confident	166 Å²	166	69.2 Å²	69.2	73%	0.728	34%	0.342	S	S	*	.	S	Bend	trans	-80	19	178.1	-61	-72.9	0	0	0	114.2
155	T	88.1	Confident	88.5	Confident	12 Å²	12	70.7 Å²	70.7	7%	0.074	35%	0.349	C	S	.	.	S	Bend	trans	-126.7	154.2	-168.9	60	0	0	0	0	110.5	L72 E76 Y149 G153 D157	L72-T155 HydrophobicContact CD1-CG2 3.81Å; E76-T155 WeakPolarHBondContact OE1-CB 3.36Å; E76-T155 WeakPolarHBondContact OE1-CG2 3.28Å; Y149-T155 HydrophobicContact CD1-CG2 3.88Å; Y149-T155 HydrophobicContact CE1-CG2 3.95Å; G153-T155 PolarHBondContact O-N 3.37Å; G153-T155 VanDerWaalsContact O-N 3.15Å; T155-D157 PolarHBondContact O-N 3.04Å
156	H	90.9	Very high	88.3	Confident	9 Å²	9	69.8 Å²	69.8	4%	0.042	36%	0.357	C	S	.	.	S	Bend	trans	64.3	13.1	-177.7	-54.6	92.7	0	0	0	114.9	E76 S77 E96 W98 Y149 W158 V159	E76-H156 PolarHBondContact OE2-N 3.25Å; S77-H156 PolarHBondContact N-NE2 2.82Å; S77-H156 PolarHBondContact O-NE2 3.07Å; S77-H156 VanDerWaalsContact O-NE2 3.16Å; E96-H156 HydrophobicContact CB-CB 4.38Å; E96-H156 HydrophobicContact CG-CB 4.28Å; W98-H156 AromaticContact CE3-ND1 3.99Å; W98-H156 HydrophobicContact CH2-CB 3.78Å; W98-H156 AromaticContact CH2-ND1 3.67Å; W98-H156 HydrophobicContact CZ2-CB 4.31Å; W98-H156 HydrophobicContact CZ3-CB 4.39Å; W98-H156 AromaticContact CZ3-ND1 3.37Å; W98-H156 WeakPolarHBondContact CZ3-ND1 3.44Å; Y149-H156 AromaticContact CD2-CE1 3.58Å; H156-W158 AromaticContact CD2-CZ2 4Å; H156-W158 PolarHBondContact O-N 3.07Å; H156-W158 VanDerWaalsContact O-N 3.17Å; H156-V159 HydrophobicContact CB-CG2 3.93Å; H156-V159 WeakPolarHBondContact O-CB 3.4Å; H156-V159 WeakPolarHBondContact O-CG2 3.29Å; H156-V159 PolarHBondContact O-N 2.99Å
157	D	87.9	Confident	88	Confident	73 Å²	73	67.7 Å²	67.7	39%	0.39	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-59.3	-29.3	177.4	72	-28.6	0	0	0	113.2	K71 T155 V159 S160	K71-D157 VanDerWaalsContact CE-OD2 3.25Å; K71-D157 WeakPolarHBondContact CE-OD2 3.44Å; K71-D157 IonicContact NZ-OD2 2.62Å; K71-D157 PolarHBondContact NZ-OD2 3.48Å; T155-D157 PolarHBondContact O-N 3.04Å; D157-V159 VanDerWaalsContact C-N 3.3Å; D157-V159 PolarHBondContact O-N 2.88Å; D157-S160 WeakPolarHBondContact O-CB 3.46Å; D157-S160 PolarHBondContact O-OG 3.36Å
158	W	89.8	Confident	88	Confident	7 Å²	7	62.4 Å²	62.4	3%	0.027	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-67.6	-20.4	174.4	55.5	-86.5	0	0	0	114.7	R39 T68 E76 F78 H156 S160 Y161 Y162	R39-W158 VanDerWaalsContact NH1-CB 3.29Å; T68-W158 HydrophobicContact CG2-CD2 3.68Å; T68-W158 HydrophobicContact CG2-CE3 4.11Å; T68-W158 HydrophobicContact CG2-CG 4.19Å; T68-W158 HydrophobicContact CG2-CH2 3.9Å; T68-W158 HydrophobicContact CG2-CZ2 3.48Å; T68-W158 VanDerWaalsContact CG2-CZ2 3.48Å; T68-W158 HydrophobicContact CG2-CZ3 4.19Å; E76-W158 HydrophobicContact CB-CZ2 3.83Å; E76-W158 PolarHBondContact OE2-NE1 3.2Å; F78-W158 AromaticContact CD1-CH2 3.58Å; F78-W158 HydrophobicContact CD1-CH2 3.58Å; F78-W158 AromaticContact CD1-CZ3 3.64Å; F78-W158 HydrophobicContact CD1-CZ3 3.64Å; F78-W158 HydrophobicContact CE1-CH2 4.05Å; F78-W158 AromaticContact CE1-CZ3 3.64Å; F78-W158 HydrophobicContact CE1-CZ3 3.64Å; H156-W158 AromaticContact CD2-CZ2 4Å; H156-W158 PolarHBondContact O-N 3.07Å; H156-W158 VanDerWaalsContact O-N 3.17Å; W158-S160 PolarHBondContact O-N 3.2Å; W158-Y161 WeakPolarHBondContact O-CB 3.29Å; W158-Y161 PolarHBondContact O-N 3.12Å; W158-Y162 HydrophobicContact CE3-CE2 4.16Å; W158-Y162 HydrophobicContact CZ3-CE2 4.07Å
159	V	90.8	Very high	87.6	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.006	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-65.1	-23	179.3	-179.3	0	0	0	0	111.6	F78 V94 E96 H156 D157 Y161 Y162 H163	F78-V159 HydrophobicContact CB-CG2 4.26Å; F78-V159 HydrophobicContact CD1-CG2 4.21Å; F78-V159 HydrophobicContact CD2-CG1 4.12Å; F78-V159 HydrophobicContact CE2-CG1 4.42Å; F78-V159 HydrophobicContact CG-CG1 4.33Å; F78-V159 HydrophobicContact CG-CG2 4.19Å; V94-V159 HydrophobicContact CG1-CG1 3.38Å; E96-V159 HydrophobicContact CG-CB 4.25Å; E96-V159 HydrophobicContact CG-CG1 4.01Å; E96-V159 HydrophobicContact CG-CG2 4.11Å; H156-V159 HydrophobicContact CB-CG2 3.93Å; H156-V159 WeakPolarHBondContact O-CB 3.4Å; H156-V159 WeakPolarHBondContact O-CG2 3.29Å; H156-V159 PolarHBondContact O-N 2.99Å; D157-V159 VanDerWaalsContact C-N 3.3Å; D157-V159 PolarHBondContact O-N 2.88Å; V159-Y161 PolarHBondContact O-N 3.21Å; V159-Y162 PolarHBondContact O-N 2.94Å; V159-H163 PolarHBondContact O-CD2 2.68Å; V159-H163 PolarHBondContact O-N 3.1Å
160	S	89.2	Confident	87	Confident	67 Å²	67	65 Å²	65	47%	0.469	35%	0.347	S	S	.	.	H	α-helix	trans	-49.3	-27.4	168.1	60.4	0	0	0	0	114.2	D157 W158 N164	D157-S160 WeakPolarHBondContact O-CB 3.46Å; D157-S160 PolarHBondContact O-OG 3.36Å; W158-S160 PolarHBondContact O-N 3.2Å; S160-N164 PolarHBondContact O-ND2 3.38Å
161	Y	92.8	Very high	86.5	Confident	92 Å²	92	64 Å²	64	36%	0.361	34%	0.343	S	S	.	.	H	α-helix	trans	-59.8	-46.5	171.7	173.9	-101.6	0	0	0	112.4	R39 W158 V159 H163 N164 L165	R39-Y161 HydrophobicContact CB-CD1 3.8Å; R39-Y161 HydrophobicContact CB-CE1 3.83Å; R39-Y161 HydrophobicContact CB-CG 4.34Å; W158-Y161 WeakPolarHBondContact O-CB 3.29Å; W158-Y161 PolarHBondContact O-N 3.12Å; V159-Y161 PolarHBondContact O-N 3.21Å; Y161-H163 PolarHBondContact O-N 2.91Å; Y161-N164 PolarHBondContact O-N 3.15Å; Y161-N164 VanDerWaalsContact O-N 3.13Å; Y161-L165 HydrophobicContact CE1-CD1 4.21Å; Y161-L165 HydrophobicContact CE1-CD2 4.21Å; Y161-L165 HydrophobicContact CE1-CG 4.4Å
162	Y	93.9	Very high	86.7	Confident	1 Å²	1	60.5 Å²	60.5	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-73.1	-28.3	-175.1	-65.7	-81.3	0	0	0	112.9	L38 R39 D42 F78 L80 W158 V159 N164 L165	L38-Y162 HydrophobicContact CD2-CE1 3.93Å; R39-Y162 PolarHBondContact N-OH 3.3Å; D42-Y162 WeakPolarHBondContact OD2-CE2 3.47Å; D42-Y162 PolarHBondContact OD2-OH 3.3Å; F78-Y162 AromaticContact CE1-CD2 3.65Å; F78-Y162 HydrophobicContact CE1-CD2 3.65Å; F78-Y162 AromaticContact CE1-CE2 3.58Å; F78-Y162 HydrophobicContact CE1-CE2 3.58Å; F78-Y162 HydrophobicContact CE1-CG 4.23Å; F78-Y162 HydrophobicContact CE2-CD2 4.18Å; F78-Y162 HydrophobicContact CE2-CG 4.06Å; F78-Y162 AromaticContact CZ-CD1 3.81Å; F78-Y162 HydrophobicContact CZ-CD1 3.81Å; F78-Y162 AromaticContact CZ-CD2 3.31Å; F78-Y162 HydrophobicContact CZ-CD2 3.31Å; F78-Y162 HydrophobicContact CZ-CE1 4.09Å; F78-Y162 AromaticContact CZ-CE2 3.62Å; F78-Y162 HydrophobicContact CZ-CE2 3.62Å; F78-Y162 AromaticContact CZ-CG 3.42Å; F78-Y162 HydrophobicContact CZ-CG 3.42Å; F78-Y162 VanDerWaalsContact CZ-CG 3.42Å; L80-Y162 HydrophobicContact CD1-CD1 4.12Å; L80-Y162 HydrophobicContact CD2-CD1 4.2Å; L80-Y162 HydrophobicContact CD2-CE1 4.3Å; W158-Y162 HydrophobicContact CE3-CE2 4.16Å; W158-Y162 HydrophobicContact CZ3-CE2 4.07Å; V159-Y162 PolarHBondContact O-N 2.94Å; Y162-N164 PolarHBondContact O-N 3.04Å; Y162-L165 HydrophobicContact CD1-CD1 3.62Å; Y162-L165 HydrophobicContact CE1-CD1 4.26Å; Y162-L165 HydrophobicContact CG-CD1 4.43Å; Y162-L165 PolarHBondContact O-N 3.3Å
163	H	88.9	Confident	87.2	Confident	113 Å²	113	53.8 Å²	53.8	52%	0.523	30%	0.297	S	S	.	.	H	α-helix	trans	-67.2	-20.6	170	-70.5	-76.3	0	0	0	113.8	V94 V159 Y161	V94-H163 WeakPolarHBondContact CG1-NE2 3.3Å; V159-H163 PolarHBondContact O-CD2 2.68Å; V159-H163 PolarHBondContact O-N 3.1Å; Y161-H163 PolarHBondContact O-N 2.91Å
164	N	90.2	Very high	87.2	Confident	140 Å²	140	56.6 Å²	56.6	75%	0.749	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	3.7	179.1	-73.1	-69	0	0	0	113.3	S160 Y161 Y162	S160-N164 PolarHBondContact O-ND2 3.38Å; Y161-N164 PolarHBondContact O-N 3.15Å; Y161-N164 VanDerWaalsContact O-N 3.13Å; Y162-N164 PolarHBondContact O-N 3.04Å
165	L	91.2	Very high	87.4	Confident	31 Å²	31	50.8 Å²	50.8	16%	0.162	28%	0.28	C	S	.	.	S	Bend	trans	-77.2	162.3	172.5	-69.8	176.6	0	0	0	111.4	I37 V91 Y161 Y162 A167	I37-L165 HydrophobicContact CB-CD1 4.18Å; I37-L165 HydrophobicContact CD1-CD1 4.44Å; V91-L165 HydrophobicContact CG2-CB 3.78Å; V91-L165 HydrophobicContact CG2-CD1 3.85Å; V91-L165 HydrophobicContact CG2-CG 4.49Å; Y161-L165 HydrophobicContact CE1-CD1 4.21Å; Y161-L165 HydrophobicContact CE1-CD2 4.21Å; Y161-L165 HydrophobicContact CE1-CG 4.4Å; Y162-L165 HydrophobicContact CD1-CD1 3.62Å; Y162-L165 HydrophobicContact CE1-CD1 4.26Å; Y162-L165 HydrophobicContact CG-CD1 4.43Å; Y162-L165 PolarHBondContact O-N 3.3Å; L165-A167 PolarHBondContact O-N 3.13Å
166	P	87.5	Confident	87.3	Confident	88 Å²	88	50.5 Å²	50.5	57%	0.571	28%	0.278	S	S	*	.			trans	-55.3	112.9	174.5	-26.4	36.1	0	0	0	111.9	T90 V91	T90-P166 CarbonylContact C-O 3.51Å; T90-P166 WeakPolarHBondContact CA-O 3.34Å; T90-P166 WeakPolarHBondContact CB-O 3.31Å; V91-P166 PolarHBondContact N-O 3.27Å
167	A	88.7	Confident	86.9	Confident	68 Å²	68	53.1 Å²	53.1	56%	0.562	29%	0.292	S	S	*	.	B	Isolated β-bridge	trans	-66.4	147.3	178	0	0	0	0	0	111.2	V91 L165 I173	V91-A167 CarbonylContact O-C 3.59Å; V91-A167 WeakPolarHBondContact O-CA 3.36Å; L165-A167 PolarHBondContact O-N 3.13Å; A167-I173 HydrophobicContact CB-CD1 4.37Å
168	S	89.6	Confident	86.1	Confident	6 Å²	6	52.7 Å²	52.7	4%	0.042	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-62.1	158.9	172.6	-67.8	0	0	0	0	111.4	D83 T90 V91 G92 I173	D83-S168 WeakPolarHBondContact OD2-CB 3.37Å; D83-S168 PolarHBondContact OD2-OG 2.92Å; T90-S168 PolarHBondContact O-OG 3.34Å; T90-S168 WeakPolarHBondContact OG1-CA 3.29Å; T90-S168 PolarHBondContact OG1-OG 2.71Å; V91-S168 PolarHBondContact O-N 2.99Å; G92-S168 WeakPolarHBondContact CA-OG 3.38Å; G92-S168 PolarHBondContact N-OG 2.92Å; S168-I173 WeakPolarHBondContact O-CD1 3.2Å
169	S	84.3	Confident	85	Confident	52 Å²	52	52.4 Å²	52.4	36%	0.364	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-63.1	152.9	178.1	69.9	0	0	0	0	111.3	H171 Q172 I173	S169-H171 VanDerWaalsContact C-N 3.28Å; S169-H171 PolarHBondContact O-N 3.26Å; S169-H171 VanDerWaalsContact O-N 3.08Å; S169-H171 PolarHBondContact OG-CE1 2.88Å; S169-H171 PolarHBondContact OG-ND1 3.27Å; S169-Q172 WeakPolarHBondContact O-CA 3.49Å; S169-Q172 VanDerWaalsContact O-CB 3.31Å; S169-Q172 WeakPolarHBondContact O-CB 3.37Å; S169-Q172 PolarHBondContact O-N 3.07Å; S169-Q172 VanDerWaalsContact OG-CD 3.23Å; S169-Q172 PolarHBondContact OG-OE1 3.02Å; S169-I173 PolarHBondContact O-N 2.86Å; S169-I173 VanDerWaalsContact O-N 3.13Å
170	T	79.4	Confident	83.3	Confident	61 Å²	61	55.8 Å²	55.8	37%	0.374	30%	0.304	S	S	.	.	H	α-helix	trans	-47.7	-43.8	-172.4	-49	0	0	0	0	114.7	Q172 I173 Q174 P324	T170-Q172 VanDerWaalsContact C-N 3.32Å; T170-Q172 PolarHBondContact O-N 3.21Å; T170-I173 PolarHBondContact O-N 3.19Å; T170-Q174 PolarHBondContact O-N 3.42Å; T170-P324 HydrophobicContact CG2-CB 3.49Å; T170-P324 VanDerWaalsContact CG2-CB 3.49Å; T170-P324 HydrophobicContact CG2-CG 3.54Å; T170-P324 VanDerWaalsContact CG2-O 3.25Å; T170-P324 WeakPolarHBondContact CG2-O 3.32Å
171	H	77.6	Confident	81.5	Confident	66 Å²	66	57.9 Å²	57.9	31%	0.306	31%	0.306	S	S	.	.	H	α-helix	trans	-69.5	-28.5	179.4	80.4	-77.7	0	0	0	113.3	K56 S169 E175	K56-H171 PolarHBondContact NZ-NE2 3.28Å; S169-H171 VanDerWaalsContact C-N 3.28Å; S169-H171 PolarHBondContact O-N 3.26Å; S169-H171 VanDerWaalsContact O-N 3.08Å; S169-H171 PolarHBondContact OG-CE1 2.88Å; S169-H171 PolarHBondContact OG-ND1 3.27Å; H171-E175 PolarHBondContact O-N 3.08Å
172	Q	85.2	Confident	79.4	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.019	29%	0.29	C	S	.	.	H	α-helix	trans	-73.8	-42	175.3	-67.7	164.6	-41.7	0	0	110.7	T85 S169 T170 Q174 E175 W176	T85-Q172 PolarHBondContact OG1-NE2 3.4Å; S169-Q172 WeakPolarHBondContact O-CA 3.49Å; S169-Q172 VanDerWaalsContact O-CB 3.31Å; S169-Q172 WeakPolarHBondContact O-CB 3.37Å; S169-Q172 PolarHBondContact O-N 3.07Å; S169-Q172 VanDerWaalsContact OG-CD 3.23Å; S169-Q172 PolarHBondContact OG-OE1 3.02Å; T170-Q172 VanDerWaalsContact C-N 3.32Å; T170-Q172 PolarHBondContact O-N 3.21Å; Q172-Q174 VanDerWaalsContact C-N 3.3Å; Q172-Q174 PolarHBondContact O-N 2.84Å; Q172-E175 PolarHBondContact O-N 3.31Å; Q172-E175 VanDerWaalsContact O-N 3.11Å; Q172-W176 PolarHBondContact O-N 3.05Å; Q172-W176 VanDerWaalsContact O-N 3.17Å
173	I	85.3	Confident	76.9	Confident	54 Å²	54	56.7 Å²	56.7	28%	0.277	31%	0.307	S	S	.	.	H	α-helix	trans	-60.2	-40.1	173.5	-62.1	177.7	0	0	0	110.7	A167 S168 S169 T170 E175 W176 L177	A167-I173 HydrophobicContact CB-CD1 4.37Å; S168-I173 WeakPolarHBondContact O-CD1 3.2Å; S169-I173 PolarHBondContact O-N 2.86Å; S169-I173 VanDerWaalsContact O-N 3.13Å; T170-I173 PolarHBondContact O-N 3.19Å; I173-E175 PolarHBondContact O-N 3.24Å; I173-W176 PolarHBondContact O-N 3.01Å; I173-L177 HydrophobicContact CG2-CD1 3.85Å; I173-L177 HydrophobicContact CG2-CG 4.39Å; I173-L177 WeakPolarHBondContact O-CG 3.44Å; I173-L177 PolarHBondContact O-N 3.24Å; I173-L177 VanDerWaalsContact O-N 3.15Å
174	Q	79.8	Confident	74.7	Confident	78 Å²	78	60.9 Å²	60.9	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-57.7	-45.2	171.7	-79.8	-176.4	-63.6	0	0	112.6	T170 Q172 W176 L177 K178 N321 P324	T170-Q174 PolarHBondContact O-N 3.42Å; Q172-Q174 VanDerWaalsContact C-N 3.3Å; Q172-Q174 PolarHBondContact O-N 2.84Å; Q174-W176 PolarHBondContact O-N 3.24Å; Q174-L177 CarbonylContact O-C 3.6Å; Q174-L177 PolarHBondContact O-N 3.05Å; Q174-K178 PolarHBondContact O-N 3.4Å; Q174-N321 PolarHBondContact NE2-O 3.42Å; Q174-P324 HydrophobicContact CG-CB 4.34Å; Q174-P324 HydrophobicContact CG-CG 3.96Å
175	E	83.6	Confident	72.1	Confident	43 Å²	43	59.5 Å²	59.5	20%	0.201	31%	0.314	C	S	.	.	H	α-helix	trans	-65.5	-22.3	178.1	-69.7	-176.7	-165	0	0	113.7	S52 R61 H171 Q172 I173	S52-E175 PolarHBondContact OG-OE2 2.76Å; R61-E175 IonicContact CZ-OE2 3.98Å; R61-E175 VanDerWaalsContact CZ-OE2 3.23Å; R61-E175 VanDerWaalsContact NH1-CB 3.26Å; R61-E175 IonicContact NH1-OE2 2.7Å; R61-E175 PolarHBondContact NH1-OE2 2.97Å; R61-E175 IonicContact NH2-OE2 3.75Å; R61-E175 PolarHBondContact NH2-OE2 3.28Å; H171-E175 PolarHBondContact O-N 3.08Å; Q172-E175 PolarHBondContact O-N 3.31Å; Q172-E175 VanDerWaalsContact O-N 3.11Å; I173-E175 PolarHBondContact O-N 3.24Å
176	W	87.7	Confident	69.7	Low	6 Å²	6	59.9 Å²	59.9	2%	0.023	32%	0.315	C	S	.	.	H	α-helix	trans	-80.6	-21.1	170.5	-72.7	110.2	0	0	0	114.2	L50 R61 Y62 C63 D83 L93 N120 F122 Q172 I173 Q174	L50-W176 HydrophobicContact CD1-CE3 4.46Å; L50-W176 HydrophobicContact CD1-CH2 3.77Å; L50-W176 HydrophobicContact CD1-CZ3 3.53Å; R61-W176 HydrophobicContact CG-CH2 3.43Å; R61-W176 VanDerWaalsContact CG-CH2 3.43Å; R61-W176 HydrophobicContact CG-CZ2 3.15Å; R61-W176 HydrophobicContact CG-CZ3 4.24Å; Y62-W176 WeakPolarHBondContact O-CH2 3.5Å; C63-W176 HydrophobicContact CB-CH2 4.5Å; D83-W176 PolarHBondContact OD2-NE1 2.89Å; L93-W176 HydrophobicContact CB-CB 4.36Å; L93-W176 HydrophobicContact CB-CD2 4Å; L93-W176 HydrophobicContact CB-CE3 4.05Å; L93-W176 HydrophobicContact CB-CG 4.19Å; L93-W176 HydrophobicContact CD2-CE3 4.05Å; N120-W176 PolarHBondContact ND2-O 3.34Å; F122-W176 HydrophobicContact CD1-CZ3 4.03Å; F122-W176 HydrophobicContact CE1-CE3 4.23Å; F122-W176 AromaticContact CE1-CZ3 3.77Å; F122-W176 HydrophobicContact CE1-CZ3 3.77Å; Q172-W176 PolarHBondContact O-N 3.05Å; Q172-W176 VanDerWaalsContact O-N 3.17Å; I173-W176 PolarHBondContact O-N 3.01Å; Q174-W176 PolarHBondContact O-N 3.24Å
177	L	82	Confident	67.2	Low	65 Å²	65	62.9 Å²	62.9	34%	0.34	32%	0.322	S	S	.	.	H	α-helix	trans	-103.3	-5.7	-177.8	-65.1	178	0	0	0	113.3	I173 Q174 R334	I173-L177 HydrophobicContact CG2-CD1 3.85Å; I173-L177 HydrophobicContact CG2-CG 4.39Å; I173-L177 WeakPolarHBondContact O-CG 3.44Å; I173-L177 PolarHBondContact O-N 3.24Å; I173-L177 VanDerWaalsContact O-N 3.15Å; Q174-L177 CarbonylContact O-C 3.6Å; Q174-L177 PolarHBondContact O-N 3.05Å; L177-R334 PolarHBondContact O-NH2 2.97Å
178	K	71.7	Confident	64.6	Low	63 Å²	63	62.1 Å²	62.1	27%	0.274	31%	0.312	S	S	.	.			trans	-70.2	147.3	178.2	-169.4	177.3	-176.3	-172.6	0	111.3	Q174 D183	Q174-K178 PolarHBondContact O-N 3.4Å; K178-D183 WeakPolarHBondContact CE-OD1 3.35Å; K178-D183 IonicContact NZ-OD1 3.18Å; K178-D183 PolarHBondContact NZ-OD1 2.95Å; K178-D183 IonicContact NZ-OD2 2.99Å; K178-D183 PolarHBondContact NZ-OD2 2.82Å
179	T	65.3	Low	62.3	Low	2 Å²	2	64.2 Å²	64.2	1%	0.012	32%	0.323	C	S	.	.			trans	-128	144.3	164.7	50.9	0	0	0	0	110.1	Q121 E181 S182	Q121-T179 HydrophobicContact CG-CG2 4.4Å; Q121-T179 VanDerWaalsContact OE1-CA 3.26Å; T179-E181 PolarHBondContact O-N 2.84Å; T179-S182 PolarHBondContact O-N 3.04Å; T179-S182 PolarHBondContact O-OG 2.98Å
180	D	55.3	Low	59.8	Low	72 Å²	72	65.6 Å²	65.6	39%	0.385	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-7.5	-167	-75.7	-37.1	0	0	0	117.6	Q121 K123	Q121-D180 PolarHBondContact OE1-OD2 3.49Å; K123-D180 VanDerWaalsContact CE-OD1 3.29Å; K123-D180 WeakPolarHBondContact CE-OD1 3.47Å; K123-D180 WeakPolarHBondContact CE-OD2 3.22Å; K123-D180 IonicContact NZ-OD1 3.31Å; K123-D180 PolarHBondContact NZ-OD1 3.31Å; K123-D180 IonicContact NZ-OD2 3.6Å; K123-D180 PolarHBondContact NZ-OD2 3.06Å
181	E	51.4	Low	57.4	Low	110 Å²	110	67.3 Å²	67.3	51%	0.514	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-0	-176.7	-68.4	-178.7	-156.4	0	0	114.8	T179 Y336	T179-E181 PolarHBondContact O-N 2.84Å; E181-Y336 PolarHBondContact OE1-OH 3.48Å; E181-Y336 VanDerWaalsContact OE2-CE1 3.22Å; E181-Y336 WeakPolarHBondContact OE2-CE1 3.23Å; E181-Y336 VanDerWaalsContact OE2-CZ 3.27Å; E181-Y336 PolarHBondContact OE2-OH 3.12Å
182	S	48.9	Very low	54.9	Low	4 Å²	4	68.7 Å²	68.7	3%	0.028	36%	0.363	C	S	.	.	S	Bend	trans	-86	-7.8	-176.2	63.1	0	0	0	0	116	T179 I186 D320	T179-S182 PolarHBondContact O-N 3.04Å; T179-S182 PolarHBondContact O-OG 2.98Å; S182-I186 WeakPolarHBondContact O-CD1 3.33Å; S182-I186 WeakPolarHBondContact O-CG1 3.22Å; S182-D320 WeakPolarHBondContact CB-OD2 3.46Å; S182-D320 PolarHBondContact OG-OD2 2.68Å
183	D	41.3	Very low	52.3	Low	65 Å²	65	73.9 Å²	73.9	35%	0.348	40%	0.397	S	S	.	.	H	α-helix	trans	-80.1	-40.8	-165.8	-80.5	-37	0	0	0	116.3	K178 F185	K178-D183 WeakPolarHBondContact CE-OD1 3.35Å; K178-D183 IonicContact NZ-OD1 3.18Å; K178-D183 PolarHBondContact NZ-OD1 2.95Å; K178-D183 IonicContact NZ-OD2 2.99Å; K178-D183 PolarHBondContact NZ-OD2 2.82Å; D183-F185 VanDerWaalsContact C-N 3.32Å; D183-F185 PolarHBondContact O-N 2.56Å
184	E	42.8	Very low	49.6	Very low	201 Å²	201	78.9 Å²	78.9	94%	0.939	42%	0.424	S	S	*	.	H	α-helix	trans	-68.4	-21.9	-165.7	-71.2	-161	144.9	0	0	115.5
185	F	35.2	Very low	47.2	Very low	110 Å²	110	79.9 Å²	79.9	48%	0.482	44%	0.439	S	S	.	.	H	α-helix	trans	-104.4	-41.9	-179.4	-158	-112.9	0	0	0	113.2	D183 Q187 S188 L189	D183-F185 VanDerWaalsContact C-N 3.32Å; D183-F185 PolarHBondContact O-N 2.56Å; F185-Q187 VanDerWaalsContact C-N 3.34Å; F185-Q187 PolarHBondContact O-N 2.81Å; F185-S188 WeakPolarHBondContact O-CB 3.48Å; F185-S188 PolarHBondContact O-N 3.48Å; F185-S188 VanDerWaalsContact O-N 3.14Å; F185-S188 PolarHBondContact O-OG 2.65Å; F185-L189 HydrophobicContact CD1-CD1 3.7Å; F185-L189 HydrophobicContact CE1-CD1 3.77Å; F185-L189 HydrophobicContact CE1-CG 4.49Å
186	I	41.7	Very low	44.5	Very low	39 Å²	39	85.9 Å²	85.9	20%	0.2	47%	0.473	C	S	.	.	H	α-helix	trans	-67.5	-35.7	-172.9	-59.7	-179.1	0	0	0	111.4	S182 S188 L189 S190 D320	S182-I186 WeakPolarHBondContact O-CD1 3.33Å; S182-I186 WeakPolarHBondContact O-CG1 3.22Å; I186-S188 PolarHBondContact O-N 2.56Å; I186-L189 WeakPolarHBondContact O-CA 3.46Å; I186-L189 WeakPolarHBondContact O-CB 2.99Å; I186-L189 PolarHBondContact O-N 2.72Å; I186-S190 PolarHBondContact O-N 2.73Å; I186-D320 HydrophobicContact CD1-CB 4.4Å
187	Q	35.4	Very low	41.8	Very low	151 Å²	151	89.6 Å²	89.6	71%	0.706	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-10.6	178.3	-154.6	159.5	73.9	0	0	113.3	F185	F185-Q187 VanDerWaalsContact C-N 3.34Å; F185-Q187 PolarHBondContact O-N 2.81Å
188	S	34.3	Very low	39.4	Very low	52 Å²	52	91.8 Å²	91.8	36%	0.364	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.5	171.8	88.8	0	0	0	0	114.4	F185 I186 K271	F185-S188 WeakPolarHBondContact O-CB 3.48Å; F185-S188 PolarHBondContact O-N 3.48Å; F185-S188 VanDerWaalsContact O-N 3.14Å; F185-S188 PolarHBondContact O-OG 2.65Å; I186-S188 PolarHBondContact O-N 2.56Å; S188-K271 PolarHBondContact O-NZ 3.11Å
189	L	40.9	Very low	37.5	Very low	50 Å²	50	94 Å²	94	26%	0.262	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-22.2	-177	-68.3	173.4	0	0	0	113.1	F185 I186 C191 F296	F185-L189 HydrophobicContact CD1-CD1 3.7Å; F185-L189 HydrophobicContact CE1-CD1 3.77Å; F185-L189 HydrophobicContact CE1-CG 4.49Å; I186-L189 WeakPolarHBondContact O-CA 3.46Å; I186-L189 WeakPolarHBondContact O-CB 2.99Å; I186-L189 PolarHBondContact O-N 2.72Å; L189-C191 PolarHBondContact O-N 2.77Å; L189-F296 HydrophobicContact CD2-CE1 3.88Å; L189-F296 HydrophobicContact CD2-CZ 4.42Å
190	S	31.1	Very low	36.1	Very low	81 Å²	81	101.1 Å²	101.1	57%	0.566	58%	0.584	S	S	*	*			trans	-72.8	55.5	177.2	61.5	0	0	0	0	113	I186 S192	I186-S190 PolarHBondContact O-N 2.73Å; S190-S192 PolarHBondContact O-N 3.21Å
191	C	28.5	Very low	35.1	Very low	97 Å²	97	105 Å²	105	66%	0.655	60%	0.6	S	S	*	*			trans	-81.8	91.5	168.6	-168.7	0	0	0	0	108.3	L189	L189-C191 PolarHBondContact O-N 2.77Å
192	S	26.1	Very low	34.6	Very low	95 Å²	95	105 Å²	105	66%	0.664	60%	0.603	S	S	*	*			trans	-50.6	145.3	177.1	-56.3	0	0	0	0	111.6	S190 L194	S190-S192 PolarHBondContact O-N 3.21Å; S192-L194 PolarHBondContact O-N 2.85Å
193	P	29.3	Very low	33.9	Very low	114 Å²	114	114.7 Å²	114.7	74%	0.74	65%	0.648	S	S	*	*			trans	-53.4	134.6	154.8	-16.9	30.4	0	0	0	108.1	S195	P193-S195 PolarHBondContact O-N 3.28Å
194	L	28.8	Very low	33.5	Very low	159 Å²	159	117.2 Å²	117.2	83%	0.832	67%	0.67	S	S	*	*			trans	-62.5	106	171.1	-74.9	163.3	0	0	0	107.9	S192 D196	S192-L194 PolarHBondContact O-N 2.85Å; L194-D196 PolarHBondContact O-N 3.46Å
195	S	29.8	Very low	33	Very low	99 Å²	99	114.2 Å²	114.2	69%	0.692	65%	0.654	S	S	*	*			trans	-80	101.8	172.3	54	0	0	0	0	108.8	P193 S197	P193-S195 PolarHBondContact O-N 3.28Å; S195-S197 PolarHBondContact O-N 3.02Å; S195-S197 PolarHBondContact O-OG 2.73Å; S195-S197 VanDerWaalsContact O-OG 3.11Å
196	D	27.7	Very low	33	Very low	169 Å²	169	117.7 Å²	117.7	90%	0.904	67%	0.671	S	S	*	*			trans	-57.4	95.8	174.4	-75.4	-49.1	0	0	0	111.1	L194	L194-D196 PolarHBondContact O-N 3.46Å
197	S	30.6	Very low	32.8	Very low	84 Å²	84	123.7 Å²	123.7	59%	0.587	70%	0.698	S	S	*	*			trans	-143.4	75.2	174.9	45.7	0	0	0	0	108.4	S195 T199	S195-S197 PolarHBondContact O-N 3.02Å; S195-S197 PolarHBondContact O-OG 2.73Å; S195-S197 VanDerWaalsContact O-OG 3.11Å; S197-T199 VanDerWaalsContact C-N 3.33Å; S197-T199 PolarHBondContact O-N 3.19Å
198	A	31.4	Very low	33.1	Very low	111 Å²	111	124 Å²	124	92%	0.917	70%	0.698	S	S	*	*			trans	-78.6	78.9	-178.5	0	0	0	0	0	111.5
199	T	32.2	Very low	33.2	Very low	110 Å²	110	124.1 Å²	124.1	68%	0.675	71%	0.707	S	S	*	*			trans	-133.5	156.9	164.9	47.8	0	0	0	0	110.5	S197	S197-T199 VanDerWaalsContact C-N 3.33Å; S197-T199 PolarHBondContact O-N 3.19Å
200	D	35.4	Very low	33.5	Very low	150 Å²	150	129.7 Å²	129.7	80%	0.802	74%	0.736	S	S	*	*			trans	73.1	33.1	166.8	-45.8	-28.3	0	0	0	118.6	D202	D200-D202 VanDerWaalsContact C-N 3.32Å; D200-D202 PolarHBondContact O-N 2.72Å
201	E	35.3	Very low	34.2	Very low	154 Å²	154	128.3 Å²	128.3	72%	0.72	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	79.1	154.3	-92.5	-142.5	161.3	0	0	111.4	R216	E201-R216 IonicContact OE1-NH2 3.31Å; E201-R216 PolarHBondContact OE1-NH2 3.01Å
202	D	39	Very low	35.3	Very low	110 Å²	110	128.3 Å²	128.3	59%	0.588	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.4	-29.2	166.5	-115	-44.6	0	0	0	117	D200 C204 K205	D200-D202 VanDerWaalsContact C-N 3.32Å; D200-D202 PolarHBondContact O-N 2.72Å; D202-C204 PolarHBondContact O-N 3.37Å; D202-K205 IonicContact OD1-NZ 3.62Å; D202-K205 PolarHBondContact OD1-NZ 3.17Å; D202-K205 IonicContact OD2-NZ 3.14Å
203	E	36	Very low	36.6	Very low	207 Å²	207	128.8 Å²	128.8	97%	0.967	72%	0.723	S	S	*	*	S	Bend	trans	-80	50.6	-179.5	-65.4	-151	135.6	0	0	115
204	C	32	Very low	37.8	Very low	118 Å²	118	131.1 Å²	131.1	80%	0.797	72%	0.721	S	S	*	*			trans	-153.6	56.2	165.8	-156.4	0	0	0	0	112.7	D202	D202-C204 PolarHBondContact O-N 3.37Å
205	K	32.4	Very low	39.1	Very low	139 Å²	139	130.3 Å²	130.3	60%	0.604	71%	0.713	S	S	*	*			trans	-125.4	45.3	-177.4	-69.2	171.5	-172.4	159	0	113.3	D202	D202-K205 IonicContact OD1-NZ 3.62Å; D202-K205 PolarHBondContact OD1-NZ 3.17Å; D202-K205 IonicContact OD2-NZ 3.14Å
206	Q	34.7	Very low	40.5	Very low	183 Å²	183	134 Å²	134	86%	0.855	71%	0.712	S	S	*	*			trans	-164	119.5	159.2	-94.5	137.4	96.8	0	0	102.8
207	E	38.6	Very low	42.4	Very low	164 Å²	164	134 Å²	134	77%	0.766	70%	0.699	S	S	*	*			cis	-151.3	174.4	45.1	-118.5	-176	138	0	0	113
208	F	40.5	Very low	44.4	Very low	159 Å²	159	135 Å²	135	70%	0.697	70%	0.697	S	S	*	*			trans	41.6	119.4	161.4	-80.1	-84.2	0	0	0	122.1
209	G	36.4	Very low	46.5	Very low	54 Å²	54	131.7 Å²	131.7	56%	0.557	67%	0.674	S	S	*	*				109.2	112.4	128.6	0	0	0	0	0	117.7	G211	G209-G211 PolarHBondContact O-N 3.36Å
210	L	47.8	Very low	48.8	Very low	166 Å²	166	132.9 Å²	132.9	87%	0.869	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-5.6	179.4	-149	71.7	0	0	0	114.7
211	G	45.1	Very low	50.9	Low	52 Å²	52	131.6 Å²	131.6	54%	0.536	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	-36.8	179	0	0	0	0	0	114.1	G209 L213 K214	G209-G211 PolarHBondContact O-N 3.36Å; G211-L213 PolarHBondContact O-N 3.15Å; G211-K214 PolarHBondContact O-N 3.43Å; G211-K214 VanDerWaalsContact O-N 3.12Å
212	N	51.2	Low	53.3	Low	97 Å²	97	129.6 Å²	129.6	52%	0.519	64%	0.644	S	S	.	*	H	α-helix	trans	-64.9	-14.6	-167.5	-61.1	-0.3	0	0	0	113.5	K214 E215 R216	N212-K214 VanDerWaalsContact C-N 3.29Å; N212-K214 PolarHBondContact O-N 2.84Å; N212-E215 PolarHBondContact O-N 3.45Å; N212-R216 VanDerWaalsContact O-CB 3.29Å; N212-R216 WeakPolarHBondContact O-CB 3.33Å; N212-R216 PolarHBondContact O-N 3.35Å
213	L	53.8	Low	55.4	Low	105 Å²	105	126.8 Å²	126.8	55%	0.55	64%	0.636	S	S	.	*	H	α-helix	trans	-64	-26.5	174.5	-80.4	169.3	0	0	0	114	G211 R217	G211-L213 PolarHBondContact O-N 3.15Å; L213-R217 WeakPolarHBondContact O-CB 3.36Å; L213-R217 VanDerWaalsContact O-CD 3.31Å; L213-R217 WeakPolarHBondContact O-CD 3.38Å; L213-R217 WeakPolarHBondContact O-CG 3.28Å; L213-R217 PolarHBondContact O-N 3.34Å
214	K	55.5	Low	57.8	Low	164 Å²	164	121 Å²	121	71%	0.713	61%	0.609	S	S	*	*	H	α-helix	trans	-76.4	-47.7	173.1	-83.6	-173	174.9	-179	0	111.3	G211 N212 R217 I218	G211-K214 PolarHBondContact O-N 3.43Å; G211-K214 VanDerWaalsContact O-N 3.12Å; N212-K214 VanDerWaalsContact C-N 3.29Å; N212-K214 PolarHBondContact O-N 2.84Å; K214-R217 WeakPolarHBondContact O-CB 3.21Å; K214-R217 PolarHBondContact O-N 2.94Å; K214-I218 VanDerWaalsContact O-CG1 3.31Å; K214-I218 WeakPolarHBondContact O-CG1 3.46Å; K214-I218 PolarHBondContact O-N 2.87Å
215	E	56.5	Low	60.6	Low	141 Å²	141	117.4 Å²	117.4	66%	0.659	58%	0.581	S	S	*	*	H	α-helix	trans	-69.9	-40.4	-177.5	-70.3	172.4	159.8	0	0	112.2	N212 R217 I218 G219	N212-E215 PolarHBondContact O-N 3.45Å; E215-R217 PolarHBondContact O-N 2.94Å; E215-I218 PolarHBondContact O-N 3.34Å; E215-G219 PolarHBondContact O-N 3.35Å
216	R	58.6	Low	63.3	Low	176 Å²	176	112.8 Å²	112.8	66%	0.664	56%	0.562	S	S	*	*	H	α-helix	trans	-62.1	-30	172.6	-167.5	170.5	176.4	-175	-5.6	112.1	E201 N212 K220	E201-R216 IonicContact OE1-NH2 3.31Å; E201-R216 PolarHBondContact OE1-NH2 3.01Å; N212-R216 VanDerWaalsContact O-CB 3.29Å; N212-R216 WeakPolarHBondContact O-CB 3.33Å; N212-R216 PolarHBondContact O-N 3.35Å; R216-K220 WeakPolarHBondContact O-CB 3.26Å; R216-K220 PolarHBondContact O-N 2.63Å; R216-K220 VanDerWaalsContact O-N 3.16Å
217	R	68.1	Low	65.8	Low	169 Å²	169	108.3 Å²	108.3	64%	0.638	55%	0.547	S	S	*	.	H	α-helix	trans	-74.1	-44.2	171.1	-75.8	174.9	-174.4	-173	2.3	112.7	L213 K214 E215 K220 Q221	L213-R217 WeakPolarHBondContact O-CB 3.36Å; L213-R217 VanDerWaalsContact O-CD 3.31Å; L213-R217 WeakPolarHBondContact O-CD 3.38Å; L213-R217 WeakPolarHBondContact O-CG 3.28Å; L213-R217 PolarHBondContact O-N 3.34Å; K214-R217 WeakPolarHBondContact O-CB 3.21Å; K214-R217 PolarHBondContact O-N 2.94Å; E215-R217 PolarHBondContact O-N 2.94Å; R217-K220 PolarHBondContact O-N 3.07Å; R217-Q221 WeakPolarHBondContact O-CB 3.29Å; R217-Q221 VanDerWaalsContact O-CG 3.31Å; R217-Q221 WeakPolarHBondContact O-CG 3.2Å; R217-Q221 PolarHBondContact O-N 3.49Å
218	I	71.7	Confident	68.3	Low	107 Å²	107	105 Å²	105	55%	0.549	53%	0.534	S	S	.	.	H	α-helix	trans	-64.1	-43.3	178.3	-68.5	162.3	0	0	0	110.6	K214 E215 Q221 R222	K214-I218 VanDerWaalsContact O-CG1 3.31Å; K214-I218 WeakPolarHBondContact O-CG1 3.46Å; K214-I218 PolarHBondContact O-N 2.87Å; E215-I218 PolarHBondContact O-N 3.34Å; I218-Q221 PolarHBondContact O-N 3.28Å; I218-R222 WeakPolarHBondContact O-CB 3.43Å; I218-R222 PolarHBondContact O-N 3.39Å
219	G	75.3	Confident	70.7	Confident	41 Å²	41	97.4 Å²	97.4	42%	0.423	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-43.6	174.4	0	0	0	0	0	112.4	E215 R222 A223	E215-G219 PolarHBondContact O-N 3.35Å; G219-R222 PolarHBondContact O-N 2.72Å; G219-A223 PolarHBondContact O-N 2.87Å
220	K	80	Confident	73.1	Confident	134 Å²	134	98.2 Å²	98.2	58%	0.583	49%	0.487	S	S	*	.	H	α-helix	trans	-63.3	-47.4	175.4	-160.1	-170.4	-175.4	-131.4	0	112.1	R216 R217 R222 A223 E224	R216-K220 WeakPolarHBondContact O-CB 3.26Å; R216-K220 PolarHBondContact O-N 2.63Å; R216-K220 VanDerWaalsContact O-N 3.16Å; R217-K220 PolarHBondContact O-N 3.07Å; K220-R222 VanDerWaalsContact C-N 3.27Å; K220-R222 PolarHBondContact O-N 2.83Å; K220-A223 PolarHBondContact O-N 2.96Å; K220-A223 VanDerWaalsContact O-N 3.16Å; K220-E224 WeakPolarHBondContact CD-OE1 3.37Å; K220-E224 WeakPolarHBondContact CE-OE1 3.44Å; K220-E224 HydrophobicContact CG-CG 4.43Å; K220-E224 IonicContact NZ-OE1 3.1Å; K220-E224 PolarHBondContact NZ-OE1 2.85Å; K220-E224 WeakPolarHBondContact O-CB 3.33Å; K220-E224 VanDerWaalsContact O-CG 3.3Å; K220-E224 WeakPolarHBondContact O-CG 3.45Å; K220-E224 PolarHBondContact O-N 3.1Å
221	Q	80.3	Confident	74.8	Confident	123 Å²	123	94.4 Å²	94.4	58%	0.575	47%	0.471	S	S	*	.	H	α-helix	trans	-60.8	-35.4	175.8	-73.9	173.8	-7.4	0	0	112.3	R217 I218 M225	R217-Q221 WeakPolarHBondContact O-CB 3.29Å; R217-Q221 VanDerWaalsContact O-CG 3.31Å; R217-Q221 WeakPolarHBondContact O-CG 3.2Å; R217-Q221 PolarHBondContact O-N 3.49Å; I218-Q221 PolarHBondContact O-N 3.28Å; Q221-M225 VanDerWaalsContact O-CB 3.28Å; Q221-M225 WeakPolarHBondContact O-CB 3.36Å; Q221-M225 PolarHBondContact O-N 3.05Å
222	R	85.2	Confident	76.9	Confident	112 Å²	112	94.9 Å²	94.9	42%	0.423	46%	0.458	S	S	.	.	H	α-helix	trans	-64.7	-47.4	173.7	-170.5	-173.2	171.6	97.5	22	111.2	I218 G219 K220 M225 E226 F265	I218-R222 WeakPolarHBondContact O-CB 3.43Å; I218-R222 PolarHBondContact O-N 3.39Å; G219-R222 PolarHBondContact O-N 2.72Å; K220-R222 VanDerWaalsContact C-N 3.27Å; K220-R222 PolarHBondContact O-N 2.83Å; R222-M225 PolarHBondContact O-N 3.45Å; R222-E226 IonicContact CZ-OE1 2.79Å; R222-E226 IonicContact NE-OE1 3.91Å; R222-E226 PolarHBondContact NE-OE1 2.9Å; R222-E226 IonicContact NH2-OE1 2.77Å; R222-E226 PolarHBondContact NH2-OE1 3.23Å; R222-E226 WeakPolarHBondContact O-CB 3.42Å; R222-E226 WeakPolarHBondContact O-CG 3.35Å; R222-E226 PolarHBondContact O-N 2.89Å; R222-F265 HydrophobicContact CG-CE1 3.84Å; R222-F265 HydrophobicContact CG-CZ 4.47Å
223	A	83.1	Confident	78.8	Confident	51 Å²	51	90.2 Å²	90.2	42%	0.421	43%	0.433	S	S	.	.	H	α-helix	trans	-64.9	-43	178.6	0	0	0	0	0	112.3	G219 K220 M225 E226 V227	G219-A223 PolarHBondContact O-N 2.87Å; K220-A223 PolarHBondContact O-N 2.96Å; K220-A223 VanDerWaalsContact O-N 3.16Å; A223-M225 VanDerWaalsContact C-N 3.32Å; A223-M225 PolarHBondContact O-N 3.43Å; A223-E226 PolarHBondContact O-N 2.7Å; A223-V227 WeakPolarHBondContact O-CG2 3.34Å; A223-V227 PolarHBondContact O-N 3.39Å
224	E	87.4	Confident	80	Confident	85 Å²	85	87.8 Å²	87.8	40%	0.397	42%	0.419	S	S	.	.	H	α-helix	trans	-57.9	-43.6	173.6	-72	165.6	170.7	0	0	110.9	K220 L228	K220-E224 WeakPolarHBondContact CD-OE1 3.37Å; K220-E224 WeakPolarHBondContact CE-OE1 3.44Å; K220-E224 HydrophobicContact CG-CG 4.43Å; K220-E224 IonicContact NZ-OE1 3.1Å; K220-E224 PolarHBondContact NZ-OE1 2.85Å; K220-E224 WeakPolarHBondContact O-CB 3.33Å; K220-E224 VanDerWaalsContact O-CG 3.3Å; K220-E224 WeakPolarHBondContact O-CG 3.45Å; K220-E224 PolarHBondContact O-N 3.1Å; E224-L228 WeakPolarHBondContact O-CG 3.43Å; E224-L228 PolarHBondContact O-N 3.26Å; E224-L228 VanDerWaalsContact O-N 3.13Å
225	M	89.9	Confident	81.3	Confident	43 Å²	43	84.9 Å²	84.9	21%	0.212	41%	0.408	C	S	.	.	H	α-helix	trans	-68.7	-38.4	175.5	-171.7	60	59.5	0	0	113.1	Q221 R222 A223 L228 I229 F258 F265	Q221-M225 VanDerWaalsContact O-CB 3.28Å; Q221-M225 WeakPolarHBondContact O-CB 3.36Å; Q221-M225 PolarHBondContact O-N 3.05Å; R222-M225 PolarHBondContact O-N 3.45Å; A223-M225 VanDerWaalsContact C-N 3.32Å; A223-M225 PolarHBondContact O-N 3.43Å; M225-L228 PolarHBondContact O-N 2.72Å; M225-I229 HydrophobicContact CG-CD1 3.89Å; M225-I229 HydrophobicContact CG-CG1 4.38Å; M225-I229 WeakPolarHBondContact O-CB 3.49Å; M225-I229 VanDerWaalsContact O-CG1 3.24Å; M225-I229 WeakPolarHBondContact O-CG1 3.25Å; M225-I229 PolarHBondContact O-N 2.9Å; M225-I229 HydrophobicContact SD-CD1 4.46Å; M225-I229 HydrophobicContact SD-CG1 4.44Å; M225-F258 HydrophobicContact SD-CD1 4.47Å; M225-F258 HydrophobicContact SD-CE1 4.31Å; M225-F265 HydrophobicContact CB-CE1 4.25Å; M225-F265 HydrophobicContact CB-CZ 3.86Å; M225-F265 HydrophobicContact CG-CE1 4.06Å; M225-F265 HydrophobicContact CG-CE2 3.7Å; M225-F265 HydrophobicContact CG-CZ 3.43Å; M225-F265 VanDerWaalsContact CG-CZ 3.43Å
226	E	90.3	Very high	82.8	Confident	42 Å²	42	78.8 Å²	78.8	20%	0.196	38%	0.38	C	S	.	.	H	α-helix	trans	-66	-36.4	177.4	-81.5	177.8	178.7	0	0	112.3	R222 A223 R230 F265 F268	R222-E226 IonicContact CZ-OE1 2.79Å; R222-E226 IonicContact NE-OE1 3.91Å; R222-E226 PolarHBondContact NE-OE1 2.9Å; R222-E226 IonicContact NH2-OE1 2.77Å; R222-E226 PolarHBondContact NH2-OE1 3.23Å; R222-E226 WeakPolarHBondContact O-CB 3.42Å; R222-E226 WeakPolarHBondContact O-CG 3.35Å; R222-E226 PolarHBondContact O-N 2.89Å; A223-E226 PolarHBondContact O-N 2.7Å; E226-R230 PolarHBondContact O-N 3.22Å; E226-F265 HydrophobicContact CG-CD1 3.7Å; E226-F265 HydrophobicContact CG-CE1 3.77Å; E226-F268 HydrophobicContact CB-CD1 4.38Å; E226-F268 HydrophobicContact CB-CD2 4.33Å; E226-F268 HydrophobicContact CB-CE1 3.83Å; E226-F268 HydrophobicContact CB-CE2 3.78Å; E226-F268 HydrophobicContact CB-CZ 3.51Å; E226-F268 HydrophobicContact CG-CD1 3.97Å; E226-F268 HydrophobicContact CG-CD2 3.86Å; E226-F268 HydrophobicContact CG-CE1 3.94Å; E226-F268 HydrophobicContact CG-CE2 3.84Å; E226-F268 HydrophobicContact CG-CG 3.94Å; E226-F268 HydrophobicContact CG-CZ 3.89Å; E226-F268 WeakPolarHBondContact O-CE1 3.34Å; E226-F268 VanDerWaalsContact O-CZ 3.29Å; E226-F268 WeakPolarHBondContact O-CZ 3.35Å
227	V	86.6	Confident	84.1	Confident	89 Å²	89	70.4 Å²	70.4	54%	0.539	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-48.6	171	172	0	0	0	0	111.1	A223 I229 R230 V231	A223-V227 WeakPolarHBondContact O-CG2 3.34Å; A223-V227 PolarHBondContact O-N 3.39Å; V227-I229 PolarHBondContact O-N 3.15Å; V227-R230 PolarHBondContact O-N 3.24Å; V227-V231 WeakPolarHBondContact O-CG2 3.26Å; V227-V231 PolarHBondContact O-N 2.84Å; V227-V231 VanDerWaalsContact O-N 3.09Å
228	L	91.5	Very high	84.4	Confident	94 Å²	94	68.8 Å²	68.8	49%	0.492	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-45.4	177.7	-73	168.3	0	0	0	111.9	E224 M225 R230 V231 K232 F258	E224-L228 WeakPolarHBondContact O-CG 3.43Å; E224-L228 PolarHBondContact O-N 3.26Å; E224-L228 VanDerWaalsContact O-N 3.13Å; M225-L228 PolarHBondContact O-N 2.72Å; L228-R230 VanDerWaalsContact C-N 3.33Å; L228-R230 PolarHBondContact O-N 3.39Å; L228-V231 PolarHBondContact O-N 2.8Å; L228-K232 PolarHBondContact O-N 2.91Å; L228-F258 HydrophobicContact CB-CE1 4.01Å; L228-F258 HydrophobicContact CB-CZ 3.88Å
229	I	91.5	Very high	84.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-56.1	-47.8	175.5	-77.8	168.8	0	0	0	110.5	M225 V227 V231 K232 L233 L254 F258 L262 F265 F268 I269	M225-I229 HydrophobicContact CG-CD1 3.89Å; M225-I229 HydrophobicContact CG-CG1 4.38Å; M225-I229 WeakPolarHBondContact O-CB 3.49Å; M225-I229 VanDerWaalsContact O-CG1 3.24Å; M225-I229 WeakPolarHBondContact O-CG1 3.25Å; M225-I229 PolarHBondContact O-N 2.9Å; M225-I229 HydrophobicContact SD-CD1 4.46Å; M225-I229 HydrophobicContact SD-CG1 4.44Å; V227-I229 PolarHBondContact O-N 3.15Å; I229-V231 PolarHBondContact O-N 2.86Å; I229-K232 PolarHBondContact O-N 3.4Å; I229-L233 WeakPolarHBondContact O-CB 3.43Å; I229-L233 PolarHBondContact O-N 2.95Å; I229-L254 HydrophobicContact CG2-CD2 4.06Å; I229-F258 HydrophobicContact CG1-CE2 4.06Å; I229-F258 HydrophobicContact CG1-CZ 4.33Å; I229-L262 HydrophobicContact CD1-CD1 4.36Å; I229-L262 HydrophobicContact CD1-CD2 4.11Å; I229-L262 HydrophobicContact CG1-CD1 4.25Å; I229-F265 HydrophobicContact CD1-CB 3.74Å; I229-F265 HydrophobicContact CD1-CD1 3.81Å; I229-F265 HydrophobicContact CD1-CD2 3.64Å; I229-F265 HydrophobicContact CD1-CE1 4.32Å; I229-F265 HydrophobicContact CD1-CE2 4.18Å; I229-F265 HydrophobicContact CD1-CG 3.44Å; I229-F265 VanDerWaalsContact CD1-CG 3.44Å; I229-F265 HydrophobicContact CD1-CZ 4.5Å; I229-F268 HydrophobicContact CB-CE1 4.23Å; I229-F268 HydrophobicContact CG2-CD1 3.88Å; I229-F268 HydrophobicContact CG2-CE1 3.79Å; I229-I269 HydrophobicContact CG2-CG1 3.76Å
230	R	85.6	Confident	84.9	Confident	71 Å²	71	69.4 Å²	69.4	27%	0.268	34%	0.344	S	S	.	.	H	α-helix	trans	-59.6	-44.8	179.5	-175.9	179.1	178	-136.9	-9.3	111.8	E226 V227 L228 Q234 Q272	E226-R230 PolarHBondContact O-N 3.22Å; V227-R230 PolarHBondContact O-N 3.24Å; L228-R230 VanDerWaalsContact C-N 3.33Å; L228-R230 PolarHBondContact O-N 3.39Å; R230-Q234 VanDerWaalsContact O-CB 3.29Å; R230-Q234 WeakPolarHBondContact O-CB 3.37Å; R230-Q234 PolarHBondContact O-N 3.08Å; R230-Q272 HydrophobicContact CB-CG 4.47Å; R230-Q272 HydrophobicContact CG-CG 4.45Å
231	V	83.7	Confident	84.8	Confident	87 Å²	87	67.8 Å²	67.8	53%	0.527	34%	0.341	S	S	.	.	H	α-helix	trans	-65.2	-49.1	-179.9	174.6	0	0	0	0	111.6	V227 L228 I229 Q234 E235	V227-V231 WeakPolarHBondContact O-CG2 3.26Å; V227-V231 PolarHBondContact O-N 2.84Å; V227-V231 VanDerWaalsContact O-N 3.09Å; L228-V231 PolarHBondContact O-N 2.8Å; I229-V231 PolarHBondContact O-N 2.86Å; V231-Q234 PolarHBondContact O-N 3Å; V231-E235 PolarHBondContact O-N 3.02Å
232	K	90	Very high	84.6	Confident	61 Å²	61	65 Å²	65	27%	0.265	33%	0.33	S	S	.	.	H	α-helix	trans	-68.7	-36.6	-178.6	-169.2	72.5	-150.2	172.5	0	112.3	L228 I229 Q234 E235 I236 L254 F258	L228-K232 PolarHBondContact O-N 2.91Å; I229-K232 PolarHBondContact O-N 3.4Å; K232-Q234 VanDerWaalsContact C-N 3.33Å; K232-E235 WeakPolarHBondContact CD-OE2 3.23Å; K232-E235 WeakPolarHBondContact CE-OE2 3.28Å; K232-E235 IonicContact NZ-OE1 2.73Å; K232-E235 PolarHBondContact NZ-OE1 3.44Å; K232-E235 IonicContact NZ-OE2 3.73Å; K232-E235 PolarHBondContact NZ-OE2 3Å; K232-E235 WeakPolarHBondContact O-CB 3.47Å; K232-E235 PolarHBondContact O-N 3.02Å; K232-I236 HydrophobicContact CG-CD1 4.18Å; K232-I236 VanDerWaalsContact O-CG1 3.31Å; K232-I236 WeakPolarHBondContact O-CG1 3.49Å; K232-I236 PolarHBondContact O-N 3.15Å; K232-L254 HydrophobicContact CB-CD1 4Å; K232-L254 HydrophobicContact CG-CD1 4.08Å; K232-F258 HydrophobicContact CB-CE2 3.64Å; K232-F258 HydrophobicContact CB-CZ 3.91Å; K232-F258 HydrophobicContact CG-CE2 4Å; K232-F258 HydrophobicContact CG-CZ 4.49Å
233	L	89.3	Confident	83.7	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.6	-40	173.8	-180	62	0	0	0	111.4	I229 I236 M237 L254 I269 Q272 I273 I276	I229-L233 WeakPolarHBondContact O-CB 3.43Å; I229-L233 PolarHBondContact O-N 2.95Å; L233-I236 PolarHBondContact O-N 2.79Å; L233-M237 HydrophobicContact CD1-CG 4.17Å; L233-M237 HydrophobicContact CD1-SD 3.83Å; L233-M237 HydrophobicContact CD2-SD 4.5Å; L233-M237 HydrophobicContact CG-CG 4.49Å; L233-M237 HydrophobicContact CG-SD 3.8Å; L233-M237 WeakPolarHBondContact O-CB 3.36Å; L233-M237 VanDerWaalsContact O-CG 3.23Å; L233-M237 WeakPolarHBondContact O-CG 3.45Å; L233-M237 PolarHBondContact O-N 3.34Å; L233-L254 HydrophobicContact CB-CD1 3.91Å; L233-L254 HydrophobicContact CD1-CD2 4.49Å; L233-I269 HydrophobicContact CD2-CG2 4.36Å; L233-Q272 HydrophobicContact CD2-CB 3.63Å; L233-I273 HydrophobicContact CD1-CG1 3.98Å; L233-I273 HydrophobicContact CD2-CG1 3.95Å; L233-I273 HydrophobicContact CG-CG1 4.41Å; L233-I276 HydrophobicContact CB-CD1 4.13Å; L233-I276 HydrophobicContact CD2-CD1 3.82Å; L233-I276 HydrophobicContact CG-CD1 3.77Å
234	Q	80.8	Confident	83.3	Confident	54 Å²	54	74 Å²	74	25%	0.252	37%	0.368	S	S	.	.	H	α-helix	trans	-64.4	-41.8	175.3	-174.1	170.9	17.1	0	0	111.8	R230 V231 K232 M237 Y238 I276	R230-Q234 VanDerWaalsContact O-CB 3.29Å; R230-Q234 WeakPolarHBondContact O-CB 3.37Å; R230-Q234 PolarHBondContact O-N 3.08Å; V231-Q234 PolarHBondContact O-N 3Å; K232-Q234 VanDerWaalsContact C-N 3.33Å; Q234-M237 PolarHBondContact O-N 3.22Å; Q234-Y238 HydrophobicContact CG-CD2 3.84Å; Q234-Y238 HydrophobicContact CG-CE2 3.71Å; Q234-Y238 VanDerWaalsContact O-CD2 3.24Å; Q234-Y238 WeakPolarHBondContact O-CD2 3.44Å; Q234-Y238 PolarHBondContact O-N 2.73Å; Q234-I276 HydrophobicContact CB-CD1 4Å; Q234-I276 HydrophobicContact CB-CG1 4.37Å; Q234-I276 HydrophobicContact CB-CG2 4.35Å; Q234-I276 HydrophobicContact CG-CG2 4.21Å
235	E	82.9	Confident	82.9	Confident	102 Å²	102	71.2 Å²	71.2	48%	0.477	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-46	173.9	-169.2	-161.5	138.7	0	0	112.4	V231 K232 Y238 T239	V231-E235 PolarHBondContact O-N 3.02Å; K232-E235 WeakPolarHBondContact CD-OE2 3.23Å; K232-E235 WeakPolarHBondContact CE-OE2 3.28Å; K232-E235 IonicContact NZ-OE1 2.73Å; K232-E235 PolarHBondContact NZ-OE1 3.44Å; K232-E235 IonicContact NZ-OE2 3.73Å; K232-E235 PolarHBondContact NZ-OE2 3Å; K232-E235 WeakPolarHBondContact O-CB 3.47Å; K232-E235 PolarHBondContact O-N 3.02Å; E235-Y238 PolarHBondContact O-N 2.94Å; E235-T239 PolarHBondContact O-N 2.9Å; E235-T239 PolarHBondContact O-OG1 2.79Å
236	I	87.8	Confident	82.5	Confident	14 Å²	14	72 Å²	72	7%	0.072	36%	0.364	C	S	.	.	H	α-helix	trans	-62.3	-49.5	176.5	-69	162.5	0	0	0	110.3	K232 L233 Y238 T239 V240 L250 L253 L254	K232-I236 HydrophobicContact CG-CD1 4.18Å; K232-I236 VanDerWaalsContact O-CG1 3.31Å; K232-I236 WeakPolarHBondContact O-CG1 3.49Å; K232-I236 PolarHBondContact O-N 3.15Å; L233-I236 PolarHBondContact O-N 2.79Å; I236-Y238 VanDerWaalsContact C-N 3.28Å; I236-Y238 PolarHBondContact O-N 3.22Å; I236-T239 PolarHBondContact O-N 2.98Å; I236-T239 PolarHBondContact O-OG1 3.08Å; I236-V240 HydrophobicContact CG2-CG2 4.17Å; I236-V240 WeakPolarHBondContact O-CG2 3.38Å; I236-V240 PolarHBondContact O-N 3.2Å; I236-L250 HydrophobicContact CG2-CD2 4.04Å; I236-L253 HydrophobicContact CD1-CB 4.18Å; I236-L253 HydrophobicContact CG2-CB 3.97Å; I236-L253 HydrophobicContact CG2-CD1 3.89Å; I236-L254 HydrophobicContact CD1-CB 4.1Å; I236-L254 HydrophobicContact CD1-CD1 3.97Å
237	M	84.3	Confident	82.2	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-64.2	-32.2	-177.6	-70.4	176	67	0	0	112.6	L233 Q234 T239 L242 L250 I273 I276 C277 M280	L233-M237 HydrophobicContact CD1-CG 4.17Å; L233-M237 HydrophobicContact CD1-SD 3.83Å; L233-M237 HydrophobicContact CD2-SD 4.5Å; L233-M237 HydrophobicContact CG-CG 4.49Å; L233-M237 HydrophobicContact CG-SD 3.8Å; L233-M237 WeakPolarHBondContact O-CB 3.36Å; L233-M237 VanDerWaalsContact O-CG 3.23Å; L233-M237 WeakPolarHBondContact O-CG 3.45Å; L233-M237 PolarHBondContact O-N 3.34Å; Q234-M237 PolarHBondContact O-N 3.22Å; M237-T239 PolarHBondContact O-N 2.8Å; M237-L242 HydrophobicContact CB-CD2 4.3Å; M237-L242 HydrophobicContact CE-CD2 4.31Å; M237-L250 HydrophobicContact CE-CD1 4.33Å; M237-L250 HydrophobicContact CG-CD1 4.06Å; M237-L250 HydrophobicContact CG-CD2 3.79Å; M237-L250 HydrophobicContact SD-CD1 4.24Å; M237-I273 HydrophobicContact CE-CB 4.42Å; M237-I273 HydrophobicContact CE-CG2 3.96Å; M237-I273 WeakPolarHBondContact CE-O 3.3Å; M237-I273 HydrophobicContact SD-CB 4.34Å; M237-I273 HydrophobicContact SD-CG1 4.04Å; M237-I273 HydrophobicContact SD-CG2 4.39Å; M237-I276 HydrophobicContact CB-CG2 3.98Å; M237-I276 HydrophobicContact CE-CB 3.96Å; M237-I276 HydrophobicContact CE-CG2 3.74Å; M237-I276 HydrophobicContact CG-CG2 4.43Å; M237-I276 HydrophobicContact SD-CB 3.87Å; M237-I276 HydrophobicContact SD-CD1 4.24Å; M237-I276 HydrophobicContact SD-CG2 3.64Å; M237-C277 HydrophobicContact CE-CB 4.35Å; M237-C277 WeakPolarHBondContact CE-SG 3.4Å; M237-M280 HydrophobicContact CB-SD 3.79Å; M237-M280 WeakPolarHBondContact O-CE 3.33Å
238	Y	74.4	Confident	82	Confident	134 Å²	134	75.1 Å²	75.1	53%	0.525	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.9	172.3	-90	-60.1	0	0	0	115.2	Q234 E235 I236 M280	Q234-Y238 HydrophobicContact CG-CD2 3.84Å; Q234-Y238 HydrophobicContact CG-CE2 3.71Å; Q234-Y238 VanDerWaalsContact O-CD2 3.24Å; Q234-Y238 WeakPolarHBondContact O-CD2 3.44Å; Q234-Y238 PolarHBondContact O-N 2.73Å; E235-Y238 PolarHBondContact O-N 2.94Å; I236-Y238 VanDerWaalsContact C-N 3.28Å; I236-Y238 PolarHBondContact O-N 3.22Å; Y238-M280 HydrophobicContact CD1-CE 3.61Å; Y238-M280 HydrophobicContact CD1-CG 4.23Å; Y238-M280 HydrophobicContact CD1-SD 4.11Å; Y238-M280 HydrophobicContact CD2-SD 4.47Å; Y238-M280 HydrophobicContact CE1-CE 3.97Å; Y238-M280 HydrophobicContact CE1-CG 3.73Å; Y238-M280 HydrophobicContact CE1-SD 4.22Å; Y238-M280 HydrophobicContact CE2-CG 4.26Å; Y238-M280 HydrophobicContact CG-CE 4.12Å; Y238-M280 HydrophobicContact CG-SD 4.21Å
239	T	79.1	Confident	81.8	Confident	115 Å²	115	74.6 Å²	74.6	71%	0.706	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-11.8	-176.2	51.6	0	0	0	0	114.3	E235 I236 M237	E235-T239 PolarHBondContact O-N 2.9Å; E235-T239 PolarHBondContact O-OG1 2.79Å; I236-T239 PolarHBondContact O-N 2.98Å; I236-T239 PolarHBondContact O-OG1 3.08Å; M237-T239 PolarHBondContact O-N 2.8Å
240	V	80.3	Confident	81.7	Confident	47 Å²	47	74.8 Å²	74.8	29%	0.285	37%	0.371	S	S	.	.	S	Bend	trans	-108.1	146.6	-178.5	-178.1	0	0	0	0	110.6	I236 L242 V245 L253	I236-V240 HydrophobicContact CG2-CG2 4.17Å; I236-V240 WeakPolarHBondContact O-CG2 3.38Å; I236-V240 PolarHBondContact O-N 3.2Å; V240-L242 PolarHBondContact O-N 3.39Å; V240-V245 HydrophobicContact CG1-CB 3.66Å; V240-V245 HydrophobicContact CG1-CG1 4.06Å; V240-V245 HydrophobicContact CG1-CG2 3.74Å; V240-L253 HydrophobicContact CG2-CD1 3.94Å
241	D	77	Confident	81.8	Confident	100 Å²	100	72.9 Å²	72.9	54%	0.535	36%	0.363	S	S	.	.			trans	-67.3	117.8	173.4	-162.3	-38.7	0	0	0	111	E243 V245	D241-E243 VanDerWaalsContact C-N 3.3Å; D241-E243 PolarHBondContact O-N 2.89Å; D241-E243 PolarHBondContact OD1-N 2.76Å; D241-V245 WeakPolarHBondContact O-CB 3.3Å; D241-V245 VanDerWaalsContact O-CG1 3.31Å; D241-V245 WeakPolarHBondContact O-CG1 3.14Å; D241-V245 PolarHBondContact O-N 2.9Å; D241-V245 VanDerWaalsContact O-N 3.15Å
242	L	75.7	Confident	82.1	Confident	64 Å²	64	74 Å²	74	34%	0.335	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-10.3	-178.1	-61.8	-174.9	0	0	0	113.8	M237 V240 V245 M280	M237-L242 HydrophobicContact CB-CD2 4.3Å; M237-L242 HydrophobicContact CE-CD2 4.31Å; V240-L242 PolarHBondContact O-N 3.39Å; L242-V245 HydrophobicContact CD2-CG1 4.08Å; L242-M280 HydrophobicContact CD1-CE 3.65Å; L242-M280 HydrophobicContact CD1-SD 4.12Å; L242-M280 HydrophobicContact CG-CE 4.44Å
243	E	66.4	Low	82.1	Confident	185 Å²	185	74.1 Å²	74.1	86%	0.864	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-25.8	173.1	-64.1	-164.5	-168.8	0	0	112.6	D241	D241-E243 VanDerWaalsContact C-N 3.3Å; D241-E243 PolarHBondContact O-N 2.89Å; D241-E243 PolarHBondContact OD1-N 2.76Å
244	E	75.2	Confident	82.3	Confident	168 Å²	168	74.1 Å²	74.1	79%	0.785	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-23.4	-179.7	-61.6	-161.3	152.7	0	0	114.5
245	V	79.3	Confident	82.9	Confident	26 Å²	26	74 Å²	74	16%	0.158	37%	0.365	C	S	.	.			trans	-82.4	133	-172.3	77.3	0	0	0	0	114.2	V240 D241 L242 Q249 L250	V240-V245 HydrophobicContact CG1-CB 3.66Å; V240-V245 HydrophobicContact CG1-CG1 4.06Å; V240-V245 HydrophobicContact CG1-CG2 3.74Å; D241-V245 WeakPolarHBondContact O-CB 3.3Å; D241-V245 VanDerWaalsContact O-CG1 3.31Å; D241-V245 WeakPolarHBondContact O-CG1 3.14Å; D241-V245 PolarHBondContact O-N 2.9Å; D241-V245 VanDerWaalsContact O-N 3.15Å; L242-V245 HydrophobicContact CD2-CG1 4.08Å; V245-Q249 HydrophobicContact CG2-CB 3.67Å; V245-L250 HydrophobicContact CG1-CD1 4.09Å; V245-L250 HydrophobicContact CG1-CD2 3.97Å; V245-L250 HydrophobicContact CG1-CG 3.93Å; V245-L250 HydrophobicContact CG2-CD2 3.93Å; V245-L250 HydrophobicContact CG2-CG 3.86Å
246	T	81	Confident	83.3	Confident	58 Å²	58	75.7 Å²	75.7	36%	0.356	37%	0.373	S	S	.	.			trans	-84.5	156.3	172.3	64.2	0	0	0	0	112.7	F248 Q249 L250	T246-F248 PolarHBondContact O-N 2.93Å; T246-F248 VanDerWaalsContact O-N 3.14Å; T246-Q249 PolarHBondContact O-N 3.21Å; T246-Q249 VanDerWaalsContact O-N 3.1Å; T246-Q249 WeakPolarHBondContact OG1-CG 3.48Å; T246-Q249 PolarHBondContact OG1-N 2.95Å; T246-Q249 VanDerWaalsContact OG1-N 3.14Å; T246-Q249 PolarHBondContact OG1-OE1 3.26Å; T246-L250 PolarHBondContact O-N 2.96Å
247	V	84.4	Confident	83.4	Confident	56 Å²	56	77 Å²	77	34%	0.339	39%	0.391	S	S	.	.	H	α-helix	trans	-57.4	-25.5	169.6	173.9	0	0	0	0	112.1	R251 E270 I273	V247-R251 WeakPolarHBondContact O-CB 3.47Å; V247-R251 PolarHBondContact O-N 3.26Å; V247-E270 HydrophobicContact CG1-CG 4Å; V247-I273 HydrophobicContact CG1-CD1 3.94Å; V247-I273 HydrophobicContact CG2-CD1 4.49Å
248	F	82.7	Confident	83.7	Confident	141 Å²	141	79.5 Å²	79.5	62%	0.618	40%	0.402	S	S	*	.	H	α-helix	trans	-69.2	-51.2	172.8	-178	-88.5	0	0	0	111.7	T246 L250 R251 E252	T246-F248 PolarHBondContact O-N 2.93Å; T246-F248 VanDerWaalsContact O-N 3.14Å; F248-L250 PolarHBondContact O-N 3.27Å; F248-R251 WeakPolarHBondContact O-CA 3.49Å; F248-R251 WeakPolarHBondContact O-CB 3.49Å; F248-R251 PolarHBondContact O-N 2.9Å; F248-R251 VanDerWaalsContact O-N 3.07Å; F248-E252 WeakPolarHBondContact CE1-OE2 3.02Å; F248-E252 PolarHBondContact O-N 2.99Å
249	Q	86.9	Confident	84.4	Confident	83 Å²	83	82.4 Å²	82.4	39%	0.388	42%	0.417	S	S	.	.	H	α-helix	trans	-63.8	-39.3	178.8	-72	155.6	-55.1	0	0	112.2	V245 T246 R251 E252 L253	V245-Q249 HydrophobicContact CG2-CB 3.67Å; T246-Q249 PolarHBondContact O-N 3.21Å; T246-Q249 VanDerWaalsContact O-N 3.1Å; T246-Q249 WeakPolarHBondContact OG1-CG 3.48Å; T246-Q249 PolarHBondContact OG1-N 2.95Å; T246-Q249 VanDerWaalsContact OG1-N 3.14Å; T246-Q249 PolarHBondContact OG1-OE1 3.26Å; Q249-R251 PolarHBondContact O-N 2.92Å; Q249-E252 PolarHBondContact O-N 2.82Å; Q249-L253 WeakPolarHBondContact O-CG 3.48Å; Q249-L253 PolarHBondContact O-N 2.83Å
250	L	88.3	Confident	84.8	Confident	5 Å²	5	80.7 Å²	80.7	3%	0.026	40%	0.401	C	S	.	.	H	α-helix	trans	-61.3	-33.4	173	-70.9	179.3	0	0	0	112.5	I236 M237 V245 T246 F248 L254 I273	I236-L250 HydrophobicContact CG2-CD2 4.04Å; M237-L250 HydrophobicContact CE-CD1 4.33Å; M237-L250 HydrophobicContact CG-CD1 4.06Å; M237-L250 HydrophobicContact CG-CD2 3.79Å; M237-L250 HydrophobicContact SD-CD1 4.24Å; V245-L250 HydrophobicContact CG1-CD1 4.09Å; V245-L250 HydrophobicContact CG1-CD2 3.97Å; V245-L250 HydrophobicContact CG1-CG 3.93Å; V245-L250 HydrophobicContact CG2-CD2 3.93Å; V245-L250 HydrophobicContact CG2-CG 3.86Å; T246-L250 PolarHBondContact O-N 2.96Å; F248-L250 PolarHBondContact O-N 3.27Å; L250-L254 VanDerWaalsContact O-CB 3.29Å; L250-L254 WeakPolarHBondContact O-CB 3.27Å; L250-L254 PolarHBondContact O-N 2.94Å; L250-I273 HydrophobicContact CB-CD1 4.04Å; L250-I273 HydrophobicContact CD1-CD1 4.03Å; L250-I273 HydrophobicContact CD1-CG1 4.13Å; L250-I273 HydrophobicContact CD1-CG2 3.99Å
251	R	88.6	Confident	85.1	Confident	31 Å²	31	82.7 Å²	82.7	12%	0.117	42%	0.415	C	S	.	.	H	α-helix	trans	-72.3	-42.1	173.2	174.9	180	-54.4	-63.1	-4.2	111.7	V247 F248 Q249 L254 E255 R266 I269 E270	V247-R251 WeakPolarHBondContact O-CB 3.47Å; V247-R251 PolarHBondContact O-N 3.26Å; F248-R251 WeakPolarHBondContact O-CA 3.49Å; F248-R251 WeakPolarHBondContact O-CB 3.49Å; F248-R251 PolarHBondContact O-N 2.9Å; F248-R251 VanDerWaalsContact O-N 3.07Å; Q249-R251 PolarHBondContact O-N 2.92Å; R251-L254 PolarHBondContact O-N 2.8Å; R251-E255 HydrophobicContact CG-CG 4.43Å; R251-E255 WeakPolarHBondContact O-CG 3.39Å; R251-E255 PolarHBondContact O-N 3.04Å; R251-R266 PolarHBondContact NH2-O 3.17Å; R251-R266 VanDerWaalsContact NH2-O 3.1Å; R251-I269 VanDerWaalsContact NH1-CD1 3.31Å; R251-E270 IonicContact CZ-OE1 2.81Å; R251-E270 IonicContact NH2-OE1 3.6Å; R251-E270 PolarHBondContact NH2-OE1 2.98Å
252	E	89.8	Confident	85.6	Confident	111 Å²	111	78 Å²	78	52%	0.519	39%	0.39	S	S	.	.	H	α-helix	trans	-63.3	-49.6	-179.9	-172.6	165.3	-143	0	0	111.7	F248 Q249 L254 E255 E256	F248-E252 WeakPolarHBondContact CE1-OE2 3.02Å; F248-E252 PolarHBondContact O-N 2.99Å; Q249-E252 PolarHBondContact O-N 2.82Å; E252-L254 PolarHBondContact O-N 2.8Å; E252-E255 PolarHBondContact O-N 3.22Å; E252-E255 VanDerWaalsContact O-N 3.16Å; E252-E256 PolarHBondContact O-N 2.9Å
253	L	90.9	Very high	86	Confident	63 Å²	63	80.6 Å²	80.6	33%	0.33	40%	0.4	S	S	.	.	H	α-helix	trans	-59.3	-34	174.6	-68.2	169.7	0	0	0	112.7	I236 V240 Q249 G257	I236-L253 HydrophobicContact CD1-CB 4.18Å; I236-L253 HydrophobicContact CG2-CB 3.97Å; I236-L253 HydrophobicContact CG2-CD1 3.89Å; V240-L253 HydrophobicContact CG2-CD1 3.94Å; Q249-L253 WeakPolarHBondContact O-CG 3.48Å; Q249-L253 PolarHBondContact O-N 2.83Å; L253-G257 PolarHBondContact O-N 2.9Å
254	L	92.8	Very high	87	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-73	-42.1	176.4	-172.1	75	0	0	0	111.8	I229 K232 L233 I236 L250 R251 E252 G257 F258 L262 I269	I229-L254 HydrophobicContact CG2-CD2 4.06Å; K232-L254 HydrophobicContact CB-CD1 4Å; K232-L254 HydrophobicContact CG-CD1 4.08Å; L233-L254 HydrophobicContact CB-CD1 3.91Å; L233-L254 HydrophobicContact CD1-CD2 4.49Å; I236-L254 HydrophobicContact CD1-CB 4.1Å; I236-L254 HydrophobicContact CD1-CD1 3.97Å; L250-L254 VanDerWaalsContact O-CB 3.29Å; L250-L254 WeakPolarHBondContact O-CB 3.27Å; L250-L254 PolarHBondContact O-N 2.94Å; R251-L254 PolarHBondContact O-N 2.8Å; E252-L254 PolarHBondContact O-N 2.8Å; L254-G257 PolarHBondContact O-N 3.21Å; L254-F258 HydrophobicContact CD1-CD2 4.05Å; L254-F258 HydrophobicContact CD1-CE2 3.8Å; L254-F258 HydrophobicContact CG-CD2 4.15Å; L254-F258 HydrophobicContact CG-CE2 4.31Å; L254-F258 WeakPolarHBondContact O-CD2 3.25Å; L254-F258 PolarHBondContact O-N 3.18Å; L254-L262 HydrophobicContact CD2-CD1 3.66Å; L254-L262 HydrophobicContact CG-CD1 3.66Å; L254-I269 HydrophobicContact CD2-CD1 3.64Å; L254-I269 HydrophobicContact CD2-CG1 3.76Å; L254-I269 HydrophobicContact CD2-CG2 4.22Å
255	E	93.1	Very high	87.6	Confident	50 Å²	50	72 Å²	72	23%	0.234	36%	0.357	C	S	.	.	H	α-helix	trans	-68.8	-33.7	176.6	-70.3	-171.8	-176.5	0	0	112	R251 E252 K259 Q260 L262	R251-E255 HydrophobicContact CG-CG 4.43Å; R251-E255 WeakPolarHBondContact O-CG 3.39Å; R251-E255 PolarHBondContact O-N 3.04Å; E252-E255 PolarHBondContact O-N 3.22Å; E252-E255 VanDerWaalsContact O-N 3.16Å; E255-K259 WeakPolarHBondContact O-CA 3.1Å; E255-K259 PolarHBondContact O-N 2.81Å; E255-Q260 PolarHBondContact O-N 3.39Å; E255-L262 HydrophobicContact CG-CB 3.82Å; E255-L262 HydrophobicContact CG-CD1 4.08Å; E255-L262 HydrophobicContact CG-CG 3.87Å; E255-L262 WeakPolarHBondContact OE1-CA 3.11Å; E255-L262 PolarHBondContact OE1-N 3.18Å
256	E	91.8	Very high	87.8	Confident	138 Å²	138	77.5 Å²	77.5	65%	0.645	38%	0.375	S	S	*	.	H	α-helix	trans	-63.5	-50.1	167.4	-176.6	180	-161.9	0	0	111.3	E252 F258 K259	E252-E256 PolarHBondContact O-N 2.9Å; E256-F258 VanDerWaalsContact C-N 3.26Å; E256-F258 PolarHBondContact O-N 3.09Å; E256-K259 WeakPolarHBondContact O-CG 3.45Å; E256-K259 PolarHBondContact O-N 2.94Å; E256-K259 VanDerWaalsContact O-N 3.07Å
257	G	89.2	Confident	87.9	Confident	43 Å²	43	82 Å²	82	44%	0.443	39%	0.392	S	S	.	.	H	α-helix	trans	-59.2	-33.6	-179.9	0	0	0	0	0	113.9	L253 L254	L253-G257 PolarHBondContact O-N 2.9Å; L254-G257 PolarHBondContact O-N 3.21Å
258	F	91.4	Very high	88	Confident	52 Å²	52	81.2 Å²	81.2	23%	0.228	38%	0.384	C	S	.	.	H	α-helix	trans	-91.4	-15.4	174.2	-81.9	-74.9	0	0	0	114.8	M225 L228 I229 K232 L254 E256 Q260 L262	M225-F258 HydrophobicContact SD-CD1 4.47Å; M225-F258 HydrophobicContact SD-CE1 4.31Å; L228-F258 HydrophobicContact CB-CE1 4.01Å; L228-F258 HydrophobicContact CB-CZ 3.88Å; I229-F258 HydrophobicContact CG1-CE2 4.06Å; I229-F258 HydrophobicContact CG1-CZ 4.33Å; K232-F258 HydrophobicContact CB-CE2 3.64Å; K232-F258 HydrophobicContact CB-CZ 3.91Å; K232-F258 HydrophobicContact CG-CE2 4Å; K232-F258 HydrophobicContact CG-CZ 4.49Å; L254-F258 HydrophobicContact CD1-CD2 4.05Å; L254-F258 HydrophobicContact CD1-CE2 3.8Å; L254-F258 HydrophobicContact CG-CD2 4.15Å; L254-F258 HydrophobicContact CG-CE2 4.31Å; L254-F258 WeakPolarHBondContact O-CD2 3.25Å; L254-F258 PolarHBondContact O-N 3.18Å; E256-F258 VanDerWaalsContact C-N 3.26Å; E256-F258 PolarHBondContact O-N 3.09Å; F258-Q260 HydrophobicContact CB-CG 3.82Å; F258-Q260 PolarHBondContact O-N 3.42Å; F258-L262 HydrophobicContact CB-CD1 4.42Å; F258-L262 HydrophobicContact CD2-CD1 3.83Å; F258-L262 HydrophobicContact CG-CD1 4.38Å
259	K	88.6	Confident	88.3	Confident	194 Å²	194	74.5 Å²	74.5	84%	0.843	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	33.3	-174.5	-54.8	-177.1	-179.3	-178.8	0	113.8	E255 E256	E255-K259 WeakPolarHBondContact O-CA 3.1Å; E255-K259 PolarHBondContact O-N 2.81Å; E256-K259 WeakPolarHBondContact O-CG 3.45Å; E256-K259 PolarHBondContact O-N 2.94Å; E256-K259 VanDerWaalsContact O-N 3.07Å
260	Q	86.8	Confident	88	Confident	79 Å²	79	71.9 Å²	71.9	37%	0.369	34%	0.342	S	S	.	.	S	Bend	trans	-151.2	147.1	176.9	52.3	166.6	-2.9	0	0	111.4	E255 F258 L262	E255-Q260 PolarHBondContact O-N 3.39Å; F258-Q260 HydrophobicContact CB-CG 3.82Å; F258-Q260 PolarHBondContact O-N 3.42Å; Q260-L262 HydrophobicContact CG-CD2 4.1Å; Q260-L262 PolarHBondContact O-N 3.34Å
261	P	87.3	Confident	87.5	Confident	89 Å²	89	76.3 Å²	76.3	58%	0.578	36%	0.361	S	S	*	.			trans	-75.1	115.9	-179.9	29.2	-34.4	0	0	0	111.8	H263	P261-H263 VanDerWaalsContact C-N 3.32Å; P261-H263 PolarHBondContact O-N 3.42Å; P261-H263 PolarHBondContact O-ND1 3.29Å
262	L	88.3	Confident	87.2	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.01	36%	0.36	C	S	.	.			trans	-90.9	18.2	-171.6	-62.9	175.2	0	0	0	113.9	I229 L254 E255 F258 Q260 K264 F265 I269	I229-L262 HydrophobicContact CD1-CD1 4.36Å; I229-L262 HydrophobicContact CD1-CD2 4.11Å; I229-L262 HydrophobicContact CG1-CD1 4.25Å; L254-L262 HydrophobicContact CD2-CD1 3.66Å; L254-L262 HydrophobicContact CG-CD1 3.66Å; E255-L262 HydrophobicContact CG-CB 3.82Å; E255-L262 HydrophobicContact CG-CD1 4.08Å; E255-L262 HydrophobicContact CG-CG 3.87Å; E255-L262 WeakPolarHBondContact OE1-CA 3.11Å; E255-L262 PolarHBondContact OE1-N 3.18Å; F258-L262 HydrophobicContact CB-CD1 4.42Å; F258-L262 HydrophobicContact CD2-CD1 3.83Å; F258-L262 HydrophobicContact CG-CD1 4.38Å; Q260-L262 HydrophobicContact CG-CD2 4.1Å; Q260-L262 PolarHBondContact O-N 3.34Å; L262-K264 PolarHBondContact O-N 2.82Å; L262-F265 HydrophobicContact CB-CD2 4.46Å; L262-F265 HydrophobicContact CD2-CD2 4.13Å; L262-F265 HydrophobicContact CD2-CE2 4.48Å; L262-F265 WeakPolarHBondContact O-CA 3.45Å; L262-F265 WeakPolarHBondContact O-CB 3.31Å; L262-F265 PolarHBondContact O-N 3.26Å; L262-I269 HydrophobicContact CB-CD1 3.82Å; L262-I269 HydrophobicContact CD1-CD1 4.25Å
263	H	84.1	Confident	86.6	Confident	118 Å²	118	71 Å²	71	55%	0.546	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-39.4	-39.8	174.9	64.8	-72.6	0	0	0	115.5	P261 F265 R266	P261-H263 VanDerWaalsContact C-N 3.32Å; P261-H263 PolarHBondContact O-N 3.42Å; P261-H263 PolarHBondContact O-ND1 3.29Å; H263-F265 PolarHBondContact O-N 2.99Å; H263-R266 WeakPolarHBondContact O-CB 3.38Å; H263-R266 PolarHBondContact O-N 3.43Å; H263-R266 VanDerWaalsContact O-N 3.11Å
264	K	86.1	Confident	85.8	Confident	148 Å²	148	72 Å²	72	64%	0.643	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-66.8	-14.6	178.9	-56.6	-174.5	-178.5	174.9	0	114.6	L262	L262-K264 PolarHBondContact O-N 2.82Å
265	F	88.4	Confident	84.6	Confident	25 Å²	25	72.9 Å²	72.9	11%	0.11	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-110.7	13.5	178.4	-56	-82.4	0	0	0	111.7	R222 M225 E226 I229 L262 H263 H267 F268 I269	R222-F265 HydrophobicContact CG-CE1 3.84Å; R222-F265 HydrophobicContact CG-CZ 4.47Å; M225-F265 HydrophobicContact CB-CE1 4.25Å; M225-F265 HydrophobicContact CB-CZ 3.86Å; M225-F265 HydrophobicContact CG-CE1 4.06Å; M225-F265 HydrophobicContact CG-CE2 3.7Å; M225-F265 HydrophobicContact CG-CZ 3.43Å; M225-F265 VanDerWaalsContact CG-CZ 3.43Å; E226-F265 HydrophobicContact CG-CD1 3.7Å; E226-F265 HydrophobicContact CG-CE1 3.77Å; I229-F265 HydrophobicContact CD1-CB 3.74Å; I229-F265 HydrophobicContact CD1-CD1 3.81Å; I229-F265 HydrophobicContact CD1-CD2 3.64Å; I229-F265 HydrophobicContact CD1-CE1 4.32Å; I229-F265 HydrophobicContact CD1-CE2 4.18Å; I229-F265 HydrophobicContact CD1-CG 3.44Å; I229-F265 VanDerWaalsContact CD1-CG 3.44Å; I229-F265 HydrophobicContact CD1-CZ 4.5Å; L262-F265 HydrophobicContact CB-CD2 4.46Å; L262-F265 HydrophobicContact CD2-CD2 4.13Å; L262-F265 HydrophobicContact CD2-CE2 4.48Å; L262-F265 WeakPolarHBondContact O-CA 3.45Å; L262-F265 WeakPolarHBondContact O-CB 3.31Å; L262-F265 PolarHBondContact O-N 3.26Å; H263-F265 PolarHBondContact O-N 2.99Å; F265-H267 PolarHBondContact O-N 3.15Å; F265-F268 HydrophobicContact CB-CB 4.42Å; F265-F268 WeakPolarHBondContact O-CA 3.42Å; F265-F268 WeakPolarHBondContact O-CB 3.48Å; F265-F268 PolarHBondContact O-N 2.9Å; F265-I269 HydrophobicContact CB-CD1 3.98Å; F265-I269 HydrophobicContact CB-CG1 4.29Å; F265-I269 WeakPolarHBondContact O-CG1 3.37Å; F265-I269 PolarHBondContact O-N 3.5Å
266	R	82.9	Confident	83.5	Confident	142 Å²	142	70.5 Å²	70.5	54%	0.536	34%	0.337	S	S	.	.	H	α-helix	trans	-44.2	-60.3	-176.2	173.3	160.6	-170.5	173.4	3.3	113.6	R251 H263 F268 I269 E270	R251-R266 PolarHBondContact NH2-O 3.17Å; R251-R266 VanDerWaalsContact NH2-O 3.1Å; H263-R266 WeakPolarHBondContact O-CB 3.38Å; H263-R266 PolarHBondContact O-N 3.43Å; H263-R266 VanDerWaalsContact O-N 3.11Å; R266-F268 VanDerWaalsContact C-N 3.34Å; R266-F268 PolarHBondContact O-N 3Å; R266-I269 PolarHBondContact O-N 2.93Å; R266-E270 VanDerWaalsContact CG-OE1 3.32Å; R266-E270 WeakPolarHBondContact CG-OE1 3.47Å; R266-E270 WeakPolarHBondContact CG-OE2 3.18Å; R266-E270 IonicContact CZ-OE1 3.83Å; R266-E270 IonicContact NE-OE1 2.73Å; R266-E270 PolarHBondContact NE-OE1 2.84Å; R266-E270 IonicContact NE-OE2 3.49Å; R266-E270 IonicContact NH2-OE1 2.72Å; R266-E270 PolarHBondContact NH2-OE1 3.44Å; R266-E270 PolarHBondContact O-N 3.04Å
267	H	82.8	Confident	82.4	Confident	152 Å²	152	66.1 Å²	66.1	70%	0.704	32%	0.321	S	S	*	.	H	α-helix	trans	-67	-31.1	-179.8	-58.6	114.6	0	0	0	113.3	F265 E270 K271	F265-H267 PolarHBondContact O-N 3.15Å; H267-E270 IonicContact CD2-OE2 2.85Å; H267-K271 WeakPolarHBondContact O-CB 3.46Å; H267-K271 PolarHBondContact O-N 2.94Å
268	F	88.3	Confident	81.2	Confident	40 Å²	40	64.7 Å²	64.7	18%	0.175	31%	0.307	C	S	.	.	H	α-helix	trans	-67.5	-46.7	175.5	179.5	-91.7	0	0	0	110.5	E226 I229 F265 R266 K271 Q272	E226-F268 HydrophobicContact CB-CD1 4.38Å; E226-F268 HydrophobicContact CB-CD2 4.33Å; E226-F268 HydrophobicContact CB-CE1 3.83Å; E226-F268 HydrophobicContact CB-CE2 3.78Å; E226-F268 HydrophobicContact CB-CZ 3.51Å; E226-F268 HydrophobicContact CG-CD1 3.97Å; E226-F268 HydrophobicContact CG-CD2 3.86Å; E226-F268 HydrophobicContact CG-CE1 3.94Å; E226-F268 HydrophobicContact CG-CE2 3.84Å; E226-F268 HydrophobicContact CG-CG 3.94Å; E226-F268 HydrophobicContact CG-CZ 3.89Å; E226-F268 WeakPolarHBondContact O-CE1 3.34Å; E226-F268 VanDerWaalsContact O-CZ 3.29Å; E226-F268 WeakPolarHBondContact O-CZ 3.35Å; I229-F268 HydrophobicContact CB-CE1 4.23Å; I229-F268 HydrophobicContact CG2-CD1 3.88Å; I229-F268 HydrophobicContact CG2-CE1 3.79Å; F265-F268 HydrophobicContact CB-CB 4.42Å; F265-F268 WeakPolarHBondContact O-CA 3.42Å; F265-F268 WeakPolarHBondContact O-CB 3.48Å; F265-F268 PolarHBondContact O-N 2.9Å; R266-F268 VanDerWaalsContact C-N 3.34Å; R266-F268 PolarHBondContact O-N 3Å; F268-K271 PolarHBondContact O-N 2.94Å; F268-Q272 HydrophobicContact CD1-CG 3.88Å; F268-Q272 HydrophobicContact CE1-CG 3.45Å; F268-Q272 VanDerWaalsContact CE1-CG 3.45Å; F268-Q272 HydrophobicContact CE2-CG 4.17Å; F268-Q272 HydrophobicContact CG-CG 4.41Å; F268-Q272 HydrophobicContact CZ-CG 3.61Å; F268-Q272 WeakPolarHBondContact O-CB 3.5Å; F268-Q272 VanDerWaalsContact O-CG 3.31Å; F268-Q272 WeakPolarHBondContact O-CG 3.39Å; F268-Q272 PolarHBondContact O-N 2.77Å
269	I	87.3	Confident	79.7	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.5	-47.3	175.3	-69.1	160.8	0	0	0	110.3	I229 L233 R251 L254 L262 F265 R266 K271 Q272 I273	I229-I269 HydrophobicContact CG2-CG1 3.76Å; L233-I269 HydrophobicContact CD2-CG2 4.36Å; R251-I269 VanDerWaalsContact NH1-CD1 3.31Å; L254-I269 HydrophobicContact CD2-CD1 3.64Å; L254-I269 HydrophobicContact CD2-CG1 3.76Å; L254-I269 HydrophobicContact CD2-CG2 4.22Å; L262-I269 HydrophobicContact CB-CD1 3.82Å; L262-I269 HydrophobicContact CD1-CD1 4.25Å; F265-I269 HydrophobicContact CB-CD1 3.98Å; F265-I269 HydrophobicContact CB-CG1 4.29Å; F265-I269 WeakPolarHBondContact O-CG1 3.37Å; F265-I269 PolarHBondContact O-N 3.5Å; R266-I269 PolarHBondContact O-N 2.93Å; I269-K271 PolarHBondContact O-N 3.31Å; I269-Q272 PolarHBondContact O-N 2.85Å; I269-Q272 VanDerWaalsContact O-N 3.17Å; I269-I273 HydrophobicContact CG2-CD1 3.95Å; I269-I273 HydrophobicContact CG2-CG1 4.42Å; I269-I273 WeakPolarHBondContact O-CG1 3.36Å; I269-I273 PolarHBondContact O-N 2.92Å
270	E	82	Confident	78.4	Confident	27 Å²	27	57.4 Å²	57.4	13%	0.126	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-41.4	177.9	-77	150.6	-170.5	0	0	112.4	V247 R251 R266 H267 L274	V247-E270 HydrophobicContact CG1-CG 4Å; R251-E270 IonicContact CZ-OE1 2.81Å; R251-E270 IonicContact NH2-OE1 3.6Å; R251-E270 PolarHBondContact NH2-OE1 2.98Å; R266-E270 VanDerWaalsContact CG-OE1 3.32Å; R266-E270 WeakPolarHBondContact CG-OE1 3.47Å; R266-E270 WeakPolarHBondContact CG-OE2 3.18Å; R266-E270 IonicContact CZ-OE1 3.83Å; R266-E270 IonicContact NE-OE1 2.73Å; R266-E270 PolarHBondContact NE-OE1 2.84Å; R266-E270 IonicContact NE-OE2 3.49Å; R266-E270 IonicContact NH2-OE1 2.72Å; R266-E270 PolarHBondContact NH2-OE1 3.44Å; R266-E270 PolarHBondContact O-N 3.04Å; H267-E270 IonicContact CD2-OE2 2.85Å; E270-L274 PolarHBondContact O-N 2.85Å
271	K	77.4	Confident	77.7	Confident	99 Å²	99	56.3 Å²	56.3	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-65.3	-42.1	171.8	-177.1	179.2	175.8	-175.3	0	112.3	S188 H267 F268 I269 L274 T275	S188-K271 PolarHBondContact O-NZ 3.11Å; H267-K271 WeakPolarHBondContact O-CB 3.46Å; H267-K271 PolarHBondContact O-N 2.94Å; F268-K271 PolarHBondContact O-N 2.94Å; I269-K271 PolarHBondContact O-N 3.31Å; K271-L274 PolarHBondContact O-N 3.28Å; K271-T275 WeakPolarHBondContact O-CB 3.39Å; K271-T275 PolarHBondContact O-N 3.17Å; K271-T275 PolarHBondContact O-OG1 3.07Å
272	Q	82.4	Confident	77.3	Confident	21 Å²	21	58.4 Å²	58.4	10%	0.098	27%	0.274	C	S	.	.	H	α-helix	trans	-68.9	-35.9	179.8	-69.3	-56.3	-29.8	0	0	111.9	R230 L233 F268 I269 L274 T275 I276	R230-Q272 HydrophobicContact CB-CG 4.47Å; R230-Q272 HydrophobicContact CG-CG 4.45Å; L233-Q272 HydrophobicContact CD2-CB 3.63Å; F268-Q272 HydrophobicContact CD1-CG 3.88Å; F268-Q272 HydrophobicContact CE1-CG 3.45Å; F268-Q272 VanDerWaalsContact CE1-CG 3.45Å; F268-Q272 HydrophobicContact CE2-CG 4.17Å; F268-Q272 HydrophobicContact CG-CG 4.41Å; F268-Q272 HydrophobicContact CZ-CG 3.61Å; F268-Q272 WeakPolarHBondContact O-CB 3.5Å; F268-Q272 VanDerWaalsContact O-CG 3.31Å; F268-Q272 WeakPolarHBondContact O-CG 3.39Å; F268-Q272 PolarHBondContact O-N 2.77Å; I269-Q272 PolarHBondContact O-N 2.85Å; I269-Q272 VanDerWaalsContact O-N 3.17Å; Q272-L274 PolarHBondContact O-N 3.18Å; Q272-T275 CarbonylContact O-C 3.44Å; Q272-T275 PolarHBondContact O-N 3.45Å; Q272-I276 HydrophobicContact CB-CD1 4.17Å; Q272-I276 VanDerWaalsContact O-CB 3.27Å; Q272-I276 WeakPolarHBondContact O-CB 3.37Å; Q272-I276 WeakPolarHBondContact O-CD1 3.46Å; Q272-I276 WeakPolarHBondContact O-CG1 3.49Å; Q272-I276 PolarHBondContact O-N 3.2Å
273	I	77.4	Confident	77.5	Confident	8 Å²	8	58.5 Å²	58.5	4%	0.041	28%	0.275	C	S	.	.	H	α-helix	trans	-56	-52.6	172.6	-71.1	167.5	0	0	0	109.8	L233 M237 V247 L250 I269 T275 I276 C277	L233-I273 HydrophobicContact CD1-CG1 3.98Å; L233-I273 HydrophobicContact CD2-CG1 3.95Å; L233-I273 HydrophobicContact CG-CG1 4.41Å; M237-I273 HydrophobicContact CE-CB 4.42Å; M237-I273 HydrophobicContact CE-CG2 3.96Å; M237-I273 WeakPolarHBondContact CE-O 3.3Å; M237-I273 HydrophobicContact SD-CB 4.34Å; M237-I273 HydrophobicContact SD-CG1 4.04Å; M237-I273 HydrophobicContact SD-CG2 4.39Å; V247-I273 HydrophobicContact CG1-CD1 3.94Å; V247-I273 HydrophobicContact CG2-CD1 4.49Å; L250-I273 HydrophobicContact CB-CD1 4.04Å; L250-I273 HydrophobicContact CD1-CD1 4.03Å; L250-I273 HydrophobicContact CD1-CG1 4.13Å; L250-I273 HydrophobicContact CD1-CG2 3.99Å; I269-I273 HydrophobicContact CG2-CD1 3.95Å; I269-I273 HydrophobicContact CG2-CG1 4.42Å; I269-I273 WeakPolarHBondContact O-CG1 3.36Å; I269-I273 PolarHBondContact O-N 2.92Å; I273-T275 VanDerWaalsContact C-N 3.29Å; I273-T275 PolarHBondContact O-N 3.25Å; I273-I276 PolarHBondContact O-N 2.95Å; I273-C277 WeakPolarHBondContact O-CB 3.42Å; I273-C277 PolarHBondContact O-N 3.42Å; I273-C277 PolarHBondContact O-SG 2.99Å
274	L	73.6	Confident	77.9	Confident	84 Å²	84	53.8 Å²	53.8	44%	0.44	26%	0.255	S	S	.	.	H	α-helix	trans	-61.3	-37.6	178.3	-66.3	172	0	0	0	112.5	E270 K271 Q272 G278 L575	E270-L274 PolarHBondContact O-N 2.85Å; K271-L274 PolarHBondContact O-N 3.28Å; Q272-L274 PolarHBondContact O-N 3.18Å; L274-G278 PolarHBondContact O-N 3.03Å; L274-G278 VanDerWaalsContact O-N 3.14Å; L274-L575 HydrophobicContact CD1-CD2 4.34Å
275	T	67.8	Low	78.4	Confident	19 Å²	19	49.8 Å²	49.8	12%	0.117	24%	0.243	C	C	.	.	H	α-helix	trans	-68.4	-41.1	177.7	-53.4	0	0	0	0	112	K271 Q272 I273 G278 Q279	K271-T275 WeakPolarHBondContact O-CB 3.39Å; K271-T275 PolarHBondContact O-N 3.17Å; K271-T275 PolarHBondContact O-OG1 3.07Å; Q272-T275 CarbonylContact O-C 3.44Å; Q272-T275 PolarHBondContact O-N 3.45Å; I273-T275 VanDerWaalsContact C-N 3.29Å; I273-T275 PolarHBondContact O-N 3.25Å; T275-G278 PolarHBondContact O-N 2.9Å; T275-Q279 WeakPolarHBondContact O-CB 3.35Å; T275-Q279 VanDerWaalsContact O-CG 3.26Å; T275-Q279 WeakPolarHBondContact O-CG 3.48Å; T275-Q279 PolarHBondContact O-N 3.46Å
276	I	69.7	Low	78.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-74.5	-44.6	-178.5	-69.5	162.4	0	0	0	110.2	L233 Q234 M237 Q272 I273 G278 Q279 M280	L233-I276 HydrophobicContact CB-CD1 4.13Å; L233-I276 HydrophobicContact CD2-CD1 3.82Å; L233-I276 HydrophobicContact CG-CD1 3.77Å; Q234-I276 HydrophobicContact CB-CD1 4Å; Q234-I276 HydrophobicContact CB-CG1 4.37Å; Q234-I276 HydrophobicContact CB-CG2 4.35Å; Q234-I276 HydrophobicContact CG-CG2 4.21Å; M237-I276 HydrophobicContact CB-CG2 3.98Å; M237-I276 HydrophobicContact CE-CB 3.96Å; M237-I276 HydrophobicContact CE-CG2 3.74Å; M237-I276 HydrophobicContact CG-CG2 4.43Å; M237-I276 HydrophobicContact SD-CB 3.87Å; M237-I276 HydrophobicContact SD-CD1 4.24Å; M237-I276 HydrophobicContact SD-CG2 3.64Å; Q272-I276 HydrophobicContact CB-CD1 4.17Å; Q272-I276 VanDerWaalsContact O-CB 3.27Å; Q272-I276 WeakPolarHBondContact O-CB 3.37Å; Q272-I276 WeakPolarHBondContact O-CD1 3.46Å; Q272-I276 WeakPolarHBondContact O-CG1 3.49Å; Q272-I276 PolarHBondContact O-N 3.2Å; I273-I276 PolarHBondContact O-N 2.95Å; I276-G278 VanDerWaalsContact C-N 3.27Å; I276-G278 PolarHBondContact O-N 2.7Å; I276-Q279 CarbonylContact O-C 3.1Å; I276-Q279 WeakPolarHBondContact O-CA 3.31Å; I276-Q279 PolarHBondContact O-N 2.84Å; I276-M280 HydrophobicContact CG2-CG 4.11Å; I276-M280 HydrophobicContact CG2-SD 3.76Å; I276-M280 WeakPolarHBondContact O-CB 3.44Å; I276-M280 VanDerWaalsContact O-CG 3.27Å; I276-M280 WeakPolarHBondContact O-CG 3.41Å; I276-M280 PolarHBondContact O-N 3.16Å
277	C	68.8	Low	79.5	Confident	46 Å²	46	43 Å²	43	31%	0.311	22%	0.217	S	C	.	.	H	α-helix	trans	-53	-46.1	170.5	-77	0	0	0	0	111.3	M237 I273 Q279 M280 D281	M237-C277 HydrophobicContact CE-CB 4.35Å; M237-C277 WeakPolarHBondContact CE-SG 3.4Å; I273-C277 WeakPolarHBondContact O-CB 3.42Å; I273-C277 PolarHBondContact O-N 3.42Å; I273-C277 PolarHBondContact O-SG 2.99Å; C277-Q279 VanDerWaalsContact C-N 3.35Å; C277-Q279 PolarHBondContact O-N 3.4Å; C277-M280 PolarHBondContact O-N 2.91Å; C277-D281 PolarHBondContact O-N 2.81Å
278	G	63.5	Low	80.1	Confident	14 Å²	14	42.3 Å²	42.3	14%	0.144	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-39.6	174.8	0	0	0	0	0	113.5	L274 T275 I276 M280 F296	L274-G278 PolarHBondContact O-N 3.03Å; L274-G278 VanDerWaalsContact O-N 3.14Å; T275-G278 PolarHBondContact O-N 2.9Å; I276-G278 VanDerWaalsContact C-N 3.27Å; I276-G278 PolarHBondContact O-N 2.7Å; G278-M280 VanDerWaalsContact C-N 3.32Å; G278-F296 VanDerWaalsContact C-CG 3.49Å; G278-F296 WeakPolarHBondContact O-CB 3.43Å; G278-F296 WeakPolarHBondContact O-CG 3.33Å
279	Q	59.7	Low	80.5	Confident	53 Å²	53	41.5 Å²	41.5	25%	0.248	22%	0.216	C	C	.	.	H	α-helix	trans	-75.1	-16.2	176.3	-73.2	171.2	-3.6	0	0	113.9	T275 I276 C277 F296	T275-Q279 WeakPolarHBondContact O-CB 3.35Å; T275-Q279 VanDerWaalsContact O-CG 3.26Å; T275-Q279 WeakPolarHBondContact O-CG 3.48Å; T275-Q279 PolarHBondContact O-N 3.46Å; I276-Q279 CarbonylContact O-C 3.1Å; I276-Q279 WeakPolarHBondContact O-CA 3.31Å; I276-Q279 PolarHBondContact O-N 2.84Å; C277-Q279 VanDerWaalsContact C-N 3.35Å; C277-Q279 PolarHBondContact O-N 3.4Å; Q279-F296 HydrophobicContact CG-CD1 4.01Å
280	M	62.2	Low	81	Confident	39 Å²	39	41.5 Å²	41.5	19%	0.192	22%	0.216	C	C	.	.	H	α-helix	trans	-93.5	-24.3	-178.5	-78.8	-175.7	57.2	0	0	114.6	M237 Y238 L242 I276 C277 G278 K282	M237-M280 HydrophobicContact CB-SD 3.79Å; M237-M280 WeakPolarHBondContact O-CE 3.33Å; Y238-M280 HydrophobicContact CD1-CE 3.61Å; Y238-M280 HydrophobicContact CD1-CG 4.23Å; Y238-M280 HydrophobicContact CD1-SD 4.11Å; Y238-M280 HydrophobicContact CD2-SD 4.47Å; Y238-M280 HydrophobicContact CE1-CE 3.97Å; Y238-M280 HydrophobicContact CE1-CG 3.73Å; Y238-M280 HydrophobicContact CE1-SD 4.22Å; Y238-M280 HydrophobicContact CE2-CG 4.26Å; Y238-M280 HydrophobicContact CG-CE 4.12Å; Y238-M280 HydrophobicContact CG-SD 4.21Å; L242-M280 HydrophobicContact CD1-CE 3.65Å; L242-M280 HydrophobicContact CD1-SD 4.12Å; L242-M280 HydrophobicContact CG-CE 4.44Å; I276-M280 HydrophobicContact CG2-CG 4.11Å; I276-M280 HydrophobicContact CG2-SD 3.76Å; I276-M280 WeakPolarHBondContact O-CB 3.44Å; I276-M280 VanDerWaalsContact O-CG 3.27Å; I276-M280 WeakPolarHBondContact O-CG 3.41Å; I276-M280 PolarHBondContact O-N 3.16Å; C277-M280 PolarHBondContact O-N 2.91Å; G278-M280 VanDerWaalsContact C-N 3.32Å; M280-K282 PolarHBondContact O-N 3.13Å
281	D	71.2	Confident	81.8	Confident	57 Å²	57	40.3 Å²	40.3	31%	0.305	21%	0.21	S	C	.	.	S	Bend	trans	-63.4	100.8	173.4	176.6	18.2	0	0	0	110.3	C277 T294 N297 R402	C277-D281 PolarHBondContact O-N 2.81Å; D281-T294 WeakPolarHBondContact OD2-CG2 3.34Å; D281-N297 PolarHBondContact O-ND2 2.92Å; D281-N297 PolarHBondContact O-OD1 2.81Å; D281-R402 IonicContact OD1-CZ 2.8Å; D281-R402 IonicContact OD1-NH1 3.76Å; D281-R402 PolarHBondContact OD1-NH1 3.29Å; D281-R402 IonicContact OD1-NH2 2.92Å; D281-R402 IonicContact OD2-CZ 2.7Å; D281-R402 IonicContact OD2-NH1 3.6Å; D281-R402 PolarHBondContact OD2-NH1 2.84Å; D281-R402 IonicContact OD2-NH2 2.89Å; D281-R402 PolarHBondContact OD2-NH2 2.98Å
282	K	80.6	Confident	82.7	Confident	133 Å²	133	35.6 Å²	35.6	58%	0.578	19%	0.19	S	C	*	.	P	Polyproline II helix	trans	-72.1	136.8	-175.3	-177.6	-173.7	175.5	-175.8	0	111.4	M280 S284	M280-K282 PolarHBondContact O-N 3.13Å; K282-S284 PolarHBondContact O-N 3.32Å; K282-S284 VanDerWaalsContact O-N 3.09Å
283	A	91.4	Very high	83.3	Confident	4 Å²	4	34.6 Å²	34.6	3%	0.033	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-53.9	118.8	175.9	0	0	0	0	0	111	V285 L291 N297 L307 L365	A283-V285 PolarHBondContact O-N 3.02Å; A283-L291 HydrophobicContact CB-CB 4.42Å; A283-L291 HydrophobicContact CB-CD2 3.99Å; A283-N297 HydrophobicContact CB-CB 4.12Å; A283-N297 PolarHBondContact N-ND2 3.47Å; A283-L307 HydrophobicContact CB-CD1 4.49Å; A283-L365 HydrophobicContact CB-CD1 4.24Å
284	S	92.8	Very high	83.9	Confident	18 Å²	18	34.5 Å²	34.5	13%	0.126	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	117.3	-171.1	-45.6	0	0	0	0	109.7	K282 I286 L291 L292 R402	K282-S284 PolarHBondContact O-N 3.32Å; K282-S284 VanDerWaalsContact O-N 3.09Å; S284-I286 PolarHBondContact O-N 2.71Å; S284-L291 WeakPolarHBondContact O-CA 3.26Å; S284-L292 PolarHBondContact N-O 3.12Å; S284-L292 PolarHBondContact O-N 3.02Å; S284-R402 WeakPolarHBondContact OG-CD 3.34Å; S284-R402 PolarHBondContact OG-NH1 3.18Å
285	V	96.1	Very high	84.6	Confident	65 Å²	65	31 Å²	31	39%	0.394	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	112	177	-178.6	0	0	0	0	108.6	A283 F287 L291 R401	A283-V285 PolarHBondContact O-N 3.02Å; V285-F287 WeakPolarHBondContact CG1-O 3.38Å; V285-L291 HydrophobicContact CB-CD2 4.4Å; V285-L291 HydrophobicContact CG2-CD2 3.64Å; V285-R401 WeakPolarHBondContact O-CD 3.22Å
286	I	97.5	Very high	85.5	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-50.1	177.6	-54.5	-54	0	0	0	110.2	S284 V290 L292 V379 Y397 V398 R401	S284-I286 PolarHBondContact O-N 2.71Å; I286-V290 PolarHBondContact N-O 3.28Å; I286-L292 HydrophobicContact CD1-CB 4.03Å; I286-L292 HydrophobicContact CD1-CD2 4.28Å; I286-L292 HydrophobicContact CG1-CB 3.58Å; I286-L292 HydrophobicContact CG1-CD2 4.39Å; I286-V379 HydrophobicContact CB-CG1 4.21Å; I286-V379 HydrophobicContact CG1-CG1 4.12Å; I286-V379 HydrophobicContact CG2-CG1 3.79Å; I286-Y397 HydrophobicContact CG2-CD1 4.35Å; I286-Y397 HydrophobicContact CG2-CE1 4.09Å; I286-Y397 WeakPolarHBondContact O-CE1 3.4Å; I286-Y397 PolarHBondContact O-OH 2.85Å; I286-V398 HydrophobicContact CD1-CG1 4.37Å; I286-V398 HydrophobicContact CG2-CG2 4.04Å; I286-R401 HydrophobicContact CD1-CB 3.71Å; I286-R401 PolarHBondContact O-NE 2.94Å
287	F	97	Very high	86.5	Confident	22 Å²	22	31.6 Å²	31.6	10%	0.096	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	167.2	171.2	-58.8	-71.6	0	0	0	109.2	V285 H289 V290 Y382 A383 N387 W389 Y397	V285-F287 WeakPolarHBondContact CG1-O 3.38Å; F287-H289 PolarHBondContact O-N 2.95Å; F287-V290 HydrophobicContact CB-CB 4.1Å; F287-V290 HydrophobicContact CB-CG2 4.08Å; F287-V290 HydrophobicContact CD2-CB 4.04Å; F287-V290 HydrophobicContact CD2-CG2 3.93Å; F287-V290 HydrophobicContact CG-CG2 4.5Å; F287-V290 PolarHBondContact N-O 3.18Å; F287-V290 VanDerWaalsContact N-O 3.15Å; F287-V290 PolarHBondContact O-N 3.5Å; F287-V290 VanDerWaalsContact O-O 3.05Å; F287-Y382 HydrophobicContact CD2-CD1 4.25Å; F287-Y382 HydrophobicContact CD2-CE1 4.08Å; F287-Y382 AromaticContact CE2-CD1 3.98Å; F287-Y382 HydrophobicContact CE2-CD1 3.98Å; F287-Y382 HydrophobicContact CE2-CE1 4.11Å; F287-A383 HydrophobicContact CE2-CB 3.93Å; F287-A383 HydrophobicContact CZ-CB 3.77Å; F287-N387 VanDerWaalsContact CZ-OD1 3.3Å; F287-N387 WeakPolarHBondContact CZ-OD1 3.47Å; F287-W389 AromaticContact CE1-CH2 3.98Å; F287-W389 HydrophobicContact CE1-CH2 3.98Å; F287-W389 HydrophobicContact CE1-CZ3 4.19Å; F287-W389 HydrophobicContact CZ-CH2 4.21Å; F287-W389 AromaticContact CZ-CZ3 3.94Å; F287-W389 HydrophobicContact CZ-CZ3 3.94Å; F287-Y397 HydrophobicContact CD1-CE1 4.01Å; F287-Y397 HydrophobicContact CE1-CD1 4.35Å; F287-Y397 AromaticContact CE1-CE1 3.48Å; F287-Y397 HydrophobicContact CE1-CE1 3.48Å; F287-Y397 VanDerWaalsContact CE1-CE1 3.48Å; F287-Y397 AromaticContact CE1-CZ 3.7Å; F287-Y397 HydrophobicContact CZ-CD1 4.34Å; F287-Y397 AromaticContact CZ-CE1 3.84Å; F287-Y397 HydrophobicContact CZ-CE1 3.84Å
288	D	95.3	Very high	87.6	Confident	138 Å²	138	29.4 Å²	29.4	74%	0.738	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.7	-177.2	-61.7	-41.6	0	0	0	113.7	R363	D288-R363 WeakPolarHBondContact O-CD 3.47Å; D288-R363 PolarHBondContact O-NE 3.24Å
289	H	97	Very high	88.8	Confident	24 Å²	24	30.7 Å²	30.7	11%	0.111	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	0.9	176.5	63.8	-68.3	0	0	0	114.4	F287 K358 T362 R363 C364 Y382	F287-H289 PolarHBondContact O-N 2.95Å; H289-K358 HydrophobicContact CB-CB 4.35Å; H289-K358 HydrophobicContact CB-CG 4.45Å; H289-T362 WeakPolarHBondContact CB-O 3.46Å; H289-R363 WeakPolarHBondContact O-CA 3.09Å; H289-C364 PolarHBondContact O-N 2.88Å; H289-Y382 AromaticContact NE2-CE1 3.76Å; H289-Y382 AromaticContact NE2-CZ 3.56Å; H289-Y382 PolarHBondContact NE2-OH 2.98Å
290	V	98.2	Very high	90	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	118.3	-175.7	-169.2	0	0	0	0	112.2	I286 F287 I354 V366 V379 Y382	I286-V290 PolarHBondContact N-O 3.28Å; F287-V290 HydrophobicContact CB-CB 4.1Å; F287-V290 HydrophobicContact CB-CG2 4.08Å; F287-V290 HydrophobicContact CD2-CB 4.04Å; F287-V290 HydrophobicContact CD2-CG2 3.93Å; F287-V290 HydrophobicContact CG-CG2 4.5Å; F287-V290 PolarHBondContact N-O 3.18Å; F287-V290 VanDerWaalsContact N-O 3.15Å; F287-V290 PolarHBondContact O-N 3.5Å; F287-V290 VanDerWaalsContact O-O 3.05Å; V290-I354 HydrophobicContact CG2-CG2 3.53Å; V290-V366 HydrophobicContact CG1-CG2 4.15Å; V290-V379 HydrophobicContact CG1-CG1 4.42Å; V290-V379 HydrophobicContact CG1-CG2 4.22Å; V290-Y382 HydrophobicContact CG2-CD1 4.39Å; V290-Y382 HydrophobicContact CG2-CE1 3.99Å
291	L	98	Very high	91.3	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	142	170.5	-68.6	146.7	0	0	0	109.9	A283 S284 V285 L307 V309 R363 C364 L365 V366	A283-L291 HydrophobicContact CB-CB 4.42Å; A283-L291 HydrophobicContact CB-CD2 3.99Å; S284-L291 WeakPolarHBondContact O-CA 3.26Å; V285-L291 HydrophobicContact CB-CD2 4.4Å; V285-L291 HydrophobicContact CG2-CD2 3.64Å; L291-L307 HydrophobicContact CD1-CB 4.28Å; L291-L307 HydrophobicContact CD1-CD1 4.06Å; L291-L307 HydrophobicContact CD2-CD1 3.96Å; L291-V309 HydrophobicContact CD1-CG2 3.42Å; L291-V309 VanDerWaalsContact CD1-CG2 3.42Å; L291-R363 HydrophobicContact CD1-CB 4.07Å; L291-C364 PolarHBondContact N-O 3.19Å; L291-L365 HydrophobicContact CB-CB 4.5Å; L291-L365 HydrophobicContact CB-CD1 3.79Å; L291-V366 PolarHBondContact O-N 3.18Å
292	L	97.4	Very high	92	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125	171.9	175	59.7	0	0	0	109.1	S284 I286 V366 S375 A376 V379 V398 R402 V405	S284-L292 PolarHBondContact N-O 3.12Å; S284-L292 PolarHBondContact O-N 3.02Å; I286-L292 HydrophobicContact CD1-CB 4.03Å; I286-L292 HydrophobicContact CD1-CD2 4.28Å; I286-L292 HydrophobicContact CG1-CB 3.58Å; I286-L292 HydrophobicContact CG1-CD2 4.39Å; L292-V366 WeakPolarHBondContact CA-O 3.45Å; L292-S375 WeakPolarHBondContact CD1-OG 3.25Å; L292-A376 HydrophobicContact CD1-CB 4.41Å; L292-A376 HydrophobicContact CD2-CB 4.01Å; L292-V379 HydrophobicContact CB-CG2 4.49Å; L292-V379 HydrophobicContact CD1-CG2 4.15Å; L292-V398 HydrophobicContact CD2-CG1 3.86Å; L292-R402 HydrophobicContact CD2-CB 4.47Å; L292-V405 HydrophobicContact CD2-CG2 3.78Å
293	G	93.7	Very high	92.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	-171.3	-174.7	0	0	0	0	0	115.9	N297 V366 H367 G371	G293-N297 WeakPolarHBondContact CA-OD1 3.18Å; G293-V366 PolarHBondContact N-O 3.39Å; G293-V366 VanDerWaalsContact N-O 3.07Å; G293-H367 WeakPolarHBondContact O-CA 3.38Å; G293-H367 WeakPolarHBondContact O-CB 3.3Å; G293-G371 WeakPolarHBondContact O-CA 3.25Å
294	T	91	Very high	92.4	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.043	16%	0.156	C	C	.	.			trans	-99	174.6	-178.3	71.7	0	0	0	0	111.7	D281 F296 N297 A298 C368	D281-T294 WeakPolarHBondContact OD2-CG2 3.34Å; T294-F296 PolarHBondContact O-N 3.31Å; T294-F296 WeakPolarHBondContact OG1-CB 3.43Å; T294-F296 PolarHBondContact OG1-N 2.85Å; T294-F296 VanDerWaalsContact OG1-N 3.09Å; T294-N297 PolarHBondContact N-OD1 3.1Å; T294-N297 PolarHBondContact O-N 3.03Å; T294-N297 PolarHBondContact OG1-N 3.1Å; T294-N297 PolarHBondContact OG1-OD1 3.49Å; T294-N297 VanDerWaalsContact OG1-OD1 3.09Å; T294-A298 PolarHBondContact O-N 3.39Å; T294-C368 CarbonylContact C-O 3.46Å
295	S	88.7	Confident	92.4	Very high	9 Å²	9	33.8 Å²	33.8	6%	0.063	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-28.9	167.9	51.7	0	0	0	0	112.7	A298 S299 F322 C368 K369	S295-A298 PolarHBondContact O-N 2.91Å; S295-S299 PolarHBondContact O-N 2.87Å; S295-F322 VanDerWaalsContact O-CE2 3.29Å; S295-F322 WeakPolarHBondContact O-CE2 3.27Å; S295-C368 PolarHBondContact N-O 3.42Å; S295-K369 PolarHBondContact N-O 2.93Å; S295-K369 PolarHBondContact OG-O 2.93Å
296	F	85.8	Confident	92.2	Very high	30 Å²	30	38 Å²	38	13%	0.132	18%	0.18	C	C	.	.	H	α-helix	trans	-68	-40	174.7	-63.9	-83.2	0	0	0	112.1	L189 G278 Q279 T294 A298 S299 N300	L189-F296 HydrophobicContact CD2-CE1 3.88Å; L189-F296 HydrophobicContact CD2-CZ 4.42Å; G278-F296 VanDerWaalsContact C-CG 3.49Å; G278-F296 WeakPolarHBondContact O-CB 3.43Å; G278-F296 WeakPolarHBondContact O-CG 3.33Å; Q279-F296 HydrophobicContact CG-CD1 4.01Å; T294-F296 PolarHBondContact O-N 3.31Å; T294-F296 WeakPolarHBondContact OG1-CB 3.43Å; T294-F296 PolarHBondContact OG1-N 2.85Å; T294-F296 VanDerWaalsContact OG1-N 3.09Å; F296-A298 VanDerWaalsContact C-N 3.34Å; F296-A298 PolarHBondContact O-N 2.96Å; F296-S299 WeakPolarHBondContact CA-OG 3.48Å; F296-S299 CarbonylContact O-C 3.6Å; F296-S299 WeakPolarHBondContact O-CA 3.42Å; F296-S299 PolarHBondContact O-N 3.44Å; F296-S299 VanDerWaalsContact O-N 3.09Å; F296-S299 PolarHBondContact O-OG 3.28Å; F296-N300 PolarHBondContact O-N 3.2Å; F296-N300 VanDerWaalsContact O-N 3.15Å
297	N	90.2	Very high	92	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-41	173.9	-57.7	114.1	0	0	0	111.8	D281 A283 G293 T294 S299 N300 E303 L365	D281-N297 PolarHBondContact O-ND2 2.92Å; D281-N297 PolarHBondContact O-OD1 2.81Å; A283-N297 HydrophobicContact CB-CB 4.12Å; A283-N297 PolarHBondContact N-ND2 3.47Å; G293-N297 WeakPolarHBondContact CA-OD1 3.18Å; T294-N297 PolarHBondContact N-OD1 3.1Å; T294-N297 PolarHBondContact O-N 3.03Å; T294-N297 PolarHBondContact OG1-N 3.1Å; T294-N297 PolarHBondContact OG1-OD1 3.49Å; T294-N297 VanDerWaalsContact OG1-OD1 3.09Å; N297-S299 PolarHBondContact O-N 2.84Å; N297-N300 PolarHBondContact O-N 3.27Å; N297-E303 PolarHBondContact ND2-OE2 2.82Å; N297-L365 HydrophobicContact CB-CD2 4.14Å
298	A	92.2	Very high	91.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-25.1	175	0	0	0	0	0	112.7	T294 S295 F296 F322 F323 L365	T294-A298 PolarHBondContact O-N 3.39Å; S295-A298 PolarHBondContact O-N 2.91Å; F296-A298 VanDerWaalsContact C-N 3.34Å; F296-A298 PolarHBondContact O-N 2.96Å; A298-F322 VanDerWaalsContact C-CD2 3.44Å; A298-F322 HydrophobicContact CB-CD2 3.89Å; A298-F322 HydrophobicContact CB-CE2 3.91Å; A298-F322 WeakPolarHBondContact O-CD2 3.32Å; A298-F323 VanDerWaalsContact O-CE2 3.29Å; A298-F323 WeakPolarHBondContact O-CE2 3.25Å; A298-L365 HydrophobicContact CB-CD2 4.14Å
299	S	88.4	Confident	91.9	Very high	40 Å²	40	35.6 Å²	35.6	28%	0.28	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-4.6	171.9	79.5	0	0	0	0	114.5	S295 F296 N297 R301 F323	S295-S299 PolarHBondContact O-N 2.87Å; F296-S299 WeakPolarHBondContact CA-OG 3.48Å; F296-S299 CarbonylContact O-C 3.6Å; F296-S299 WeakPolarHBondContact O-CA 3.42Å; F296-S299 PolarHBondContact O-N 3.44Å; F296-S299 VanDerWaalsContact O-N 3.09Å; F296-S299 PolarHBondContact O-OG 3.28Å; N297-S299 PolarHBondContact O-N 2.84Å; S299-R301 PolarHBondContact O-N 2.74Å; S299-F323 VanDerWaalsContact O-CZ 3.25Å; S299-F323 WeakPolarHBondContact O-CZ 3.31Å
300	N	86.6	Confident	91.8	Very high	58 Å²	58	36 Å²	36	31%	0.31	17%	0.172	S	C	.	.			trans	-98.1	79.3	-177.6	-168.8	-16.6	0	0	0	111.5	F296 N297 D302 E303 L304	F296-N300 PolarHBondContact O-N 3.2Å; F296-N300 VanDerWaalsContact O-N 3.15Å; N297-N300 PolarHBondContact O-N 3.27Å; N300-D302 PolarHBondContact O-N 3.26Å; N300-D302 VanDerWaalsContact O-N 3.08Å; N300-E303 HydrophobicContact CB-CB 3.97Å; N300-E303 WeakPolarHBondContact ND2-CB 3.18Å; N300-E303 PolarHBondContact O-N 3.13Å; N300-E303 PolarHBondContact OD1-N 2.93Å; N300-E303 VanDerWaalsContact OD1-N 3.07Å; N300-L304 VanDerWaalsContact O-CG 3.29Å; N300-L304 WeakPolarHBondContact O-CG 3.2Å; N300-L304 PolarHBondContact O-N 2.78Å
301	R	87.8	Confident	91.8	Very high	99 Å²	99	36.1 Å²	36.1	37%	0.374	17%	0.173	S	C	.	.	H	α-helix	trans	-49.7	-37.1	-177.7	-161.6	-175.8	64.2	-163.8	-15.6	114.1	S299 K305 F323 F328	S299-R301 PolarHBondContact O-N 2.74Å; R301-K305 HydrophobicContact CG-CD 4.25Å; R301-K305 WeakPolarHBondContact O-CB 3.48Å; R301-K305 WeakPolarHBondContact O-CG 3.46Å; R301-K305 PolarHBondContact O-N 3.3Å; R301-F323 HydrophobicContact CB-CD1 4.36Å; R301-F323 HydrophobicContact CB-CD2 4.2Å; R301-F323 HydrophobicContact CB-CE1 3.88Å; R301-F323 HydrophobicContact CB-CE2 3.68Å; R301-F323 HydrophobicContact CB-CZ 3.53Å; R301-F323 HydrophobicContact CG-CD1 4.16Å; R301-F323 HydrophobicContact CG-CD2 4.24Å; R301-F323 HydrophobicContact CG-CE1 4.16Å; R301-F323 HydrophobicContact CG-CE2 4.22Å; R301-F323 HydrophobicContact CG-CG 4.23Å; R301-F323 HydrophobicContact CG-CZ 4.2Å; R301-F328 HydrophobicContact CG-CE2 4.15Å; R301-F328 HydrophobicContact CG-CZ 4.45Å
302	D	86.2	Confident	91.7	Very high	93 Å²	93	36 Å²	36	50%	0.497	17%	0.173	S	C	.	.	H	α-helix	trans	-90.8	-27.5	-168.9	-53.7	-29.9	0	0	0	110.6	N300 R306	N300-D302 PolarHBondContact O-N 3.26Å; N300-D302 VanDerWaalsContact O-N 3.08Å; D302-R306 WeakPolarHBondContact O-CB 3.21Å; D302-R306 PolarHBondContact O-N 2.59Å
303	E	88.3	Confident	91.8	Very high	16 Å²	16	36 Å²	36	8%	0.075	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-49	159	168.8	162.6	-122.1	0	0	111.5	N297 N300 K305 R306 L307	N297-E303 PolarHBondContact ND2-OE2 2.82Å; N300-E303 HydrophobicContact CB-CB 3.97Å; N300-E303 WeakPolarHBondContact ND2-CB 3.18Å; N300-E303 PolarHBondContact O-N 3.13Å; N300-E303 PolarHBondContact OD1-N 2.93Å; N300-E303 VanDerWaalsContact OD1-N 3.07Å; E303-K305 VanDerWaalsContact C-N 3.34Å; E303-K305 PolarHBondContact O-N 3.06Å; E303-R306 PolarHBondContact O-N 2.88Å; E303-R306 IonicContact OE1-NH2 3.35Å; E303-L307 HydrophobicContact CG-CD1 3.59Å; E303-L307 HydrophobicContact CG-CG 4.25Å; E303-L307 WeakPolarHBondContact O-CB 3.45Å; E303-L307 WeakPolarHBondContact O-CG 3.08Å; E303-L307 PolarHBondContact O-N 2.94Å
304	L	92.9	Very high	91.9	Very high	4 Å²	4	36 Å²	36	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-56	-47.8	179.7	-70.3	165.9	0	0	0	111.4	N300 L307 N308 V309 I312 F323 F328 L365	N300-L304 VanDerWaalsContact O-CG 3.29Å; N300-L304 WeakPolarHBondContact O-CG 3.2Å; N300-L304 PolarHBondContact O-N 2.78Å; L304-L307 PolarHBondContact O-N 2.76Å; L304-N308 PolarHBondContact O-N 3.14Å; L304-V309 HydrophobicContact CB-CB 4.28Å; L304-V309 HydrophobicContact CD2-CB 3.92Å; L304-V309 HydrophobicContact CD2-CG1 3.82Å; L304-V309 HydrophobicContact CD2-CG2 4Å; L304-V309 WeakPolarHBondContact O-CB 3.5Å; L304-V309 PolarHBondContact O-N 2.93Å; L304-I312 HydrophobicContact CD1-CD1 3.87Å; L304-I312 HydrophobicContact CD2-CD1 4.12Å; L304-F323 HydrophobicContact CD1-CD2 3.98Å; L304-F323 HydrophobicContact CD1-CE2 4.07Å; L304-F328 HydrophobicContact CB-CE1 3.72Å; L304-F328 HydrophobicContact CB-CZ 3.71Å; L304-F328 HydrophobicContact CD1-CE1 4.38Å; L304-F328 HydrophobicContact CD1-CZ 4.15Å; L304-L365 HydrophobicContact CD2-CB 4.28Å; L304-L365 HydrophobicContact CD2-CD2 3.69Å
305	K	91.9	Very high	92.2	Very high	99 Å²	99	35.7 Å²	35.7	43%	0.43	17%	0.17	S	C	.	.	H	α-helix	trans	-63.3	-47.6	176	-74.8	170.6	-178.1	174.4	0	112	R301 E303 L307 N308 D326 F328	R301-K305 HydrophobicContact CG-CD 4.25Å; R301-K305 WeakPolarHBondContact O-CB 3.48Å; R301-K305 WeakPolarHBondContact O-CG 3.46Å; R301-K305 PolarHBondContact O-N 3.3Å; E303-K305 VanDerWaalsContact C-N 3.34Å; E303-K305 PolarHBondContact O-N 3.06Å; K305-L307 PolarHBondContact O-N 2.94Å; K305-N308 PolarHBondContact O-N 2.88Å; K305-D326 IonicContact NZ-OD2 3.12Å; K305-D326 PolarHBondContact NZ-OD2 3.3Å; K305-F328 HydrophobicContact CG-CZ 4.11Å
306	R	91.7	Very high	92.4	Very high	154 Å²	154	35.3 Å²	35.3	58%	0.581	17%	0.167	S	C	*	.	H	α-helix	trans	-61.8	-27	177.6	-172.4	-169.7	53.2	56.3	5.1	112.9	D302 E303	D302-R306 WeakPolarHBondContact O-CB 3.21Å; D302-R306 PolarHBondContact O-N 2.59Å; E303-R306 PolarHBondContact O-N 2.88Å; E303-R306 IonicContact OE1-NH2 3.35Å
307	L	92.9	Very high	92.4	Very high	15 Å²	15	35.3 Å²	35.3	8%	0.079	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1.8	176.6	-69.9	175.7	0	0	0	114	A283 L291 E303 L304 K305 V309 R363	A283-L307 HydrophobicContact CB-CD1 4.49Å; L291-L307 HydrophobicContact CD1-CB 4.28Å; L291-L307 HydrophobicContact CD1-CD1 4.06Å; L291-L307 HydrophobicContact CD2-CD1 3.96Å; E303-L307 HydrophobicContact CG-CD1 3.59Å; E303-L307 HydrophobicContact CG-CG 4.25Å; E303-L307 WeakPolarHBondContact O-CB 3.45Å; E303-L307 WeakPolarHBondContact O-CG 3.08Å; E303-L307 PolarHBondContact O-N 2.94Å; L304-L307 PolarHBondContact O-N 2.76Å; K305-L307 PolarHBondContact O-N 2.94Å; L307-V309 VanDerWaalsContact C-N 3.28Å; L307-V309 HydrophobicContact CB-CG2 3.98Å; L307-V309 PolarHBondContact O-N 3.43Å; L307-R363 VanDerWaalsContact O-CD 3.23Å; L307-R363 WeakPolarHBondContact O-CD 3.45Å; L307-R363 PolarHBondContact O-NH1 3.46Å
308	N	94.2	Very high	92.1	Very high	89 Å²	89	36.8 Å²	36.8	48%	0.476	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	41.7	-173.3	-164.2	39.7	0	0	0	113	L304 K305 R363	L304-N308 PolarHBondContact O-N 3.14Å; K305-N308 PolarHBondContact O-N 2.88Å; N308-R363 PolarHBondContact O-N 3.11Å
309	V	96.1	Very high	91.6	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.042	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	131.5	171.2	-176.7	0	0	0	0	109.3	L291 L304 L307 H311 I312 F328 R363 L365	L291-V309 HydrophobicContact CD1-CG2 3.42Å; L291-V309 VanDerWaalsContact CD1-CG2 3.42Å; L304-V309 HydrophobicContact CB-CB 4.28Å; L304-V309 HydrophobicContact CD2-CB 3.92Å; L304-V309 HydrophobicContact CD2-CG1 3.82Å; L304-V309 HydrophobicContact CD2-CG2 4Å; L304-V309 WeakPolarHBondContact O-CB 3.5Å; L304-V309 PolarHBondContact O-N 2.93Å; L307-V309 VanDerWaalsContact C-N 3.28Å; L307-V309 HydrophobicContact CB-CG2 3.98Å; L307-V309 PolarHBondContact O-N 3.43Å; V309-H311 VanDerWaalsContact CG1-O 3.26Å; V309-H311 WeakPolarHBondContact CG1-O 3.43Å; V309-I312 HydrophobicContact CG1-CG1 4.05Å; V309-F328 WeakPolarHBondContact O-CD1 3.42Å; V309-F328 VanDerWaalsContact O-CE1 3.28Å; V309-F328 WeakPolarHBondContact O-CE1 3.42Å; V309-R363 WeakPolarHBondContact CA-O 3.36Å; V309-R363 HydrophobicContact CG2-CB 4.06Å; V309-L365 HydrophobicContact CG1-CB 4.09Å
310	T	95.5	Very high	91.6	Very high	31 Å²	31	36.8 Å²	36.8	19%	0.19	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	-22.6	175.2	55	0	0	0	0	112	F328 E329 T362 R363	T310-F328 CarbonylContact O-C 3.5Å; T310-F328 WeakPolarHBondContact O-CA 3.26Å; T310-E329 PolarHBondContact O-N 2.85Å; T310-T362 HydrophobicContact CG2-CG2 3.73Å; T310-T362 WeakPolarHBondContact OG1-CB 3.47Å; T310-T362 PolarHBondContact OG1-OG1 3.44Å; T310-R363 PolarHBondContact N-O 3Å
311	H	97.5	Very high	91.8	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.014	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	137.9	179.7	-64.9	57.1	0	0	0	109.8	V309 E329 F353 A357 R363 C364 L365	V309-H311 VanDerWaalsContact CG1-O 3.26Å; V309-H311 WeakPolarHBondContact CG1-O 3.43Å; H311-E329 CarbonylContact C-O 3.32Å; H311-E329 WeakPolarHBondContact CA-O 3.24Å; H311-F353 HydrophobicContact CB-CE1 3.87Å; H311-F353 HydrophobicContact CB-CE2 4.45Å; H311-F353 HydrophobicContact CB-CZ 3.75Å; H311-F353 AromaticContact CD2-CE2 3.64Å; H311-F353 AromaticContact CD2-CZ 3.84Å; H311-A357 HydrophobicContact CB-CB 4Å; H311-A357 PolarHBondContact NE2-N 3.09Å; H311-R363 PolarHBondContact N-O 2.9Å; H311-C364 HydrophobicContact CB-CB 3.92Å; H311-C364 CarbonylContact O-C 3.6Å; H311-C364 VanDerWaalsContact O-CA 3.26Å; H311-C364 WeakPolarHBondContact O-CA 3.44Å; H311-L365 PolarHBondContact O-N 3.37Å
312	I	97.5	Very high	91.8	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	112.8	178.3	-58	178.1	0	0	0	109.2	L304 V309 F328 E329 Y330 K331 L365	L304-I312 HydrophobicContact CD1-CD1 3.87Å; L304-I312 HydrophobicContact CD2-CD1 4.12Å; V309-I312 HydrophobicContact CG1-CG1 4.05Å; I312-F328 HydrophobicContact CD1-CB 3.96Å; I312-F328 HydrophobicContact CD1-CD1 3.91Å; I312-F328 HydrophobicContact CD1-CG 3.89Å; I312-F328 HydrophobicContact CG1-CB 4.45Å; I312-F328 HydrophobicContact CG1-CD1 4.46Å; I312-E329 PolarHBondContact N-O 2.76Å; I312-Y330 HydrophobicContact CB-CD1 3.78Å; I312-Y330 HydrophobicContact CB-CE1 3.73Å; I312-Y330 HydrophobicContact CB-CG 4.35Å; I312-Y330 HydrophobicContact CD1-CE1 4Å; I312-Y330 HydrophobicContact CD1-CE2 4.27Å; I312-Y330 HydrophobicContact CG1-CE1 4.43Å; I312-Y330 HydrophobicContact CG2-CD1 3.87Å; I312-Y330 HydrophobicContact CG2-CE1 3.59Å; I312-Y330 WeakPolarHBondContact O-CA 3.33Å; I312-K331 PolarHBondContact O-N 3.01Å; I312-L365 WeakPolarHBondContact CA-O 3.45Å
313	L	98.1	Very high	92	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	99.8	178.1	177.2	57	0	0	0	109.4	V315 K331 I333 T350 F353 I354 L365 V366 H367 T378	L313-V315 HydrophobicContact CD1-CG2 4.43Å; L313-V315 HydrophobicContact CG-CG2 3.97Å; L313-K331 WeakPolarHBondContact CA-O 3.35Å; L313-K331 HydrophobicContact CD1-CB 3.86Å; L313-K331 HydrophobicContact CD1-CG 3.96Å; L313-I333 HydrophobicContact CD1-CG1 3.9Å; L313-T350 HydrophobicContact CD1-CG2 3.97Å; L313-T350 HydrophobicContact CD2-CG2 3.79Å; L313-F353 HydrophobicContact CB-CD1 4.01Å; L313-F353 HydrophobicContact CB-CE1 4.01Å; L313-F353 HydrophobicContact CD1-CD1 4.39Å; L313-I354 HydrophobicContact CD2-CD1 4.08Å; L313-I354 HydrophobicContact CD2-CG1 4.26Å; L313-L365 PolarHBondContact N-O 2.86Å; L313-V366 HydrophobicContact CB-CG1 4.34Å; L313-V366 HydrophobicContact CB-CG2 4.27Å; L313-V366 HydrophobicContact CD2-CG1 3.85Å; L313-V366 HydrophobicContact CD2-CG2 4.06Å; L313-V366 HydrophobicContact CG-CG1 4.09Å; L313-H367 PolarHBondContact O-N 2.77Å; L313-T378 HydrophobicContact CD2-CG2 3.92Å
314	N	97.1	Very high	91.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	103.8	179.1	179.9	0.6	0	0	0	110	T316 V319 N321 K331 N332 I333 H367	N314-T316 PolarHBondContact O-N 3.44Å; N314-T316 PolarHBondContact OD1-N 3.16Å; N314-T316 PolarHBondContact OD1-OG1 2.97Å; N314-V319 PolarHBondContact ND2-O 2.94Å; N314-N321 PolarHBondContact ND2-OD1 3.2Å; N314-K331 PolarHBondContact N-O 3.46Å; N314-N332 WeakPolarHBondContact O-CA 3.22Å; N314-I333 PolarHBondContact O-N 2.59Å; N314-H367 WeakPolarHBondContact CA-NE2 3.17Å; N314-H367 WeakPolarHBondContact CB-NE2 3.31Å; N314-H367 PolarHBondContact OD1-CE1 3.42Å
315	V	97.2	Very high	90.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.			trans	-97.6	62.5	178.9	-163.4	0	0	0	0	109.5	L313 I333 I335 L343 V366 H367 C368 R374	L313-V315 HydrophobicContact CD1-CG2 4.43Å; L313-V315 HydrophobicContact CG-CG2 3.97Å; V315-I333 CarbonylContact C-O 3.28Å; V315-I333 HydrophobicContact CG1-CB 4.25Å; V315-I333 HydrophobicContact CG1-CG2 4.43Å; V315-I335 HydrophobicContact CG1-CD1 4.27Å; V315-I335 HydrophobicContact CG1-CG1 4.34Å; V315-L343 HydrophobicContact CG1-CD2 3.87Å; V315-V366 HydrophobicContact CG2-CG1 4.05Å; V315-H367 PolarHBondContact N-O 2.94Å; V315-C368 WeakPolarHBondContact O-CB 3.45Å; V315-R374 HydrophobicContact CB-CB 4.38Å; V315-R374 HydrophobicContact CG1-CB 3.9Å; V315-R374 WeakPolarHBondContact O-CD 3.24Å
316	T	92.5	Very high	89.5	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.			trans	-148.3	153.4	176.4	74.8	0	0	0	0	112.4	N314 E318 V319 I333 R334 I335 C368	N314-T316 PolarHBondContact O-N 3.44Å; N314-T316 PolarHBondContact OD1-N 3.16Å; N314-T316 PolarHBondContact OD1-OG1 2.97Å; T316-E318 WeakPolarHBondContact CB-OE2 3.43Å; T316-V319 HydrophobicContact CG2-CB 4.14Å; T316-V319 HydrophobicContact CG2-CG2 3.89Å; T316-V319 WeakPolarHBondContact OG1-CA 3.37Å; T316-V319 VanDerWaalsContact OG1-CB 3.26Å; T316-V319 WeakPolarHBondContact OG1-CB 3.26Å; T316-V319 PolarHBondContact OG1-N 3.5Å; T316-V319 PolarHBondContact OG1-O 3.2Å; T316-I333 CarbonylContact C-O 3.54Å; T316-I333 PolarHBondContact N-O 2.93Å; T316-I333 VanDerWaalsContact N-O 3.17Å; T316-R334 WeakPolarHBondContact O-CA 3.33Å; T316-R334 VanDerWaalsContact O-CD 3.31Å; T316-R334 WeakPolarHBondContact O-CD 3.38Å; T316-I335 CarbonylContact C-O 3.52Å; T316-I335 WeakPolarHBondContact CA-O 3.43Å; T316-C368 VanDerWaalsContact CG2-CA 3.45Å; T316-C368 HydrophobicContact CG2-CB 3.89Å
317	R	85.3	Confident	89.1	Confident	30 Å²	30	34.6 Å²	34.6	11%	0.113	19%	0.187	C	C	.	.	S	Bend	trans	-84.7	-37.9	160.4	-167.3	171.1	-178	-161.3	7.7	111.4	E112 R334 I335 Y336	E112-R317 IonicContact OE1-NH2 3.97Å; E112-R317 PolarHBondContact OE1-NH2 3.05Å; R317-R334 HydrophobicContact CB-CB 4.47Å; R317-R334 HydrophobicContact CG-CB 4.36Å; R317-R334 PolarHBondContact O-NH1 3.18Å; R317-I335 PolarHBondContact N-O 3.26Å; R317-Y336 HydrophobicContact CB-CD1 4.48Å; R317-Y336 HydrophobicContact CB-CE1 4.26Å; R317-Y336 WeakPolarHBondContact CD-OH 3.47Å; R317-Y336 PolarHBondContact NH1-OH 3.01Å
318	E	83.3	Confident	89.1	Confident	35 Å²	35	34.6 Å²	34.6	16%	0.164	19%	0.186	C	C	.	.	S	Bend	trans	-89.9	-9.1	-166	77.9	-77.5	-170.1	0	0	116.2	T316 K369 R374	T316-E318 WeakPolarHBondContact CB-OE2 3.43Å; E318-K369 HydrophobicContact CG-CD 4.35Å; E318-K369 WeakPolarHBondContact OE1-CB 3.5Å; E318-R374 VanDerWaalsContact CD-NH1 3.34Å; E318-R374 IonicContact OE1-CZ 2.85Å; E318-R374 IonicContact OE1-NH1 3.28Å; E318-R374 PolarHBondContact OE1-NH1 3.39Å; E318-R374 VanDerWaalsContact OE1-NH1 3.12Å; E318-R374 IonicContact OE1-NH2 2.74Å; E318-R374 PolarHBondContact OE1-NH2 2.7Å; E318-R374 IonicContact OE2-CZ 3.36Å; E318-R374 IonicContact OE2-NH1 3.63Å; E318-R374 PolarHBondContact OE2-NH1 3.35Å; E318-R374 IonicContact OE2-NH2 2.7Å
319	V	82.5	Confident	89	Confident	8 Å²	8	35.6 Å²	35.6	5%	0.048	19%	0.188	C	C	.	.			trans	-109.7	127.7	176.7	-170.5	0	0	0	0	109.4	N314 T316 F322 R334 K369	N314-V319 PolarHBondContact ND2-O 2.94Å; T316-V319 HydrophobicContact CG2-CB 4.14Å; T316-V319 HydrophobicContact CG2-CG2 3.89Å; T316-V319 WeakPolarHBondContact OG1-CA 3.37Å; T316-V319 VanDerWaalsContact OG1-CB 3.26Å; T316-V319 WeakPolarHBondContact OG1-CB 3.26Å; T316-V319 PolarHBondContact OG1-N 3.5Å; T316-V319 PolarHBondContact OG1-O 3.2Å; V319-F322 HydrophobicContact CG1-CE2 3.75Å; V319-F322 HydrophobicContact CG1-CZ 3.71Å; V319-R334 PolarHBondContact O-NH1 2.82Å; V319-K369 HydrophobicContact CG2-CB 4.38Å
320	D	87.9	Confident	89	Confident	31 Å²	31	37.2 Å²	37.2	17%	0.166	19%	0.193	C	C	.	.			trans	-92	162.1	175.8	-77	-41.8	0	0	0	112.8	S182 I186 F322 R334	S182-D320 WeakPolarHBondContact CB-OD2 3.46Å; S182-D320 PolarHBondContact OG-OD2 2.68Å; I186-D320 HydrophobicContact CD1-CB 4.4Å; D320-F322 PolarHBondContact O-N 3Å; D320-R334 IonicContact OD1-CZ 2.87Å; D320-R334 IonicContact OD1-NH1 2.71Å; D320-R334 PolarHBondContact OD1-NH1 3.07Å; D320-R334 VanDerWaalsContact OD1-NH1 3.1Å; D320-R334 IonicContact OD1-NH2 2.66Å; D320-R334 PolarHBondContact OD1-NH2 3.48Å
321	N	91.8	Very high	88.9	Confident	18 Å²	18	38.7 Å²	38.7	10%	0.096	20%	0.197	C	C	.	.			trans	-74.8	120.6	-176.2	-65.3	-12.1	0	0	0	110.1	Q174 N314 P324 Y330 N332	Q174-N321 PolarHBondContact NE2-O 3.42Å; N314-N321 PolarHBondContact ND2-OD1 3.2Å; N321-P324 WeakPolarHBondContact O-CD 3.33Å; N321-Y330 HydrophobicContact CB-CD1 3.61Å; N321-Y330 HydrophobicContact CB-CD2 4.47Å; N321-Y330 HydrophobicContact CB-CE1 3.52Å; N321-Y330 HydrophobicContact CB-CE2 4.42Å; N321-Y330 HydrophobicContact CB-CG 4.08Å; N321-Y330 WeakPolarHBondContact ND2-CB 3.41Å; N321-Y330 VanDerWaalsContact ND2-CD1 3.34Å; N321-Y330 WeakPolarHBondContact ND2-CD1 3.33Å; N321-Y330 WeakPolarHBondContact OD1-CD1 3.31Å; N321-N332 PolarHBondContact ND2-ND2 3.31Å; N321-N332 VanDerWaalsContact ND2-ND2 3.2Å; N321-N332 PolarHBondContact ND2-OD1 3.45Å; N321-N332 PolarHBondContact OD1-OD1 3.1Å
322	F	88	Confident	88.8	Confident	60 Å²	60	40.2 Å²	40.2	26%	0.263	21%	0.206	S	C	.	.	S	Bend	trans	-75.7	-33.3	-172.4	-61.8	-80.5	0	0	0	114.1	S295 A298 V319 D320 P324	S295-F322 VanDerWaalsContact O-CE2 3.29Å; S295-F322 WeakPolarHBondContact O-CE2 3.27Å; A298-F322 VanDerWaalsContact C-CD2 3.44Å; A298-F322 HydrophobicContact CB-CD2 3.89Å; A298-F322 HydrophobicContact CB-CE2 3.91Å; A298-F322 WeakPolarHBondContact O-CD2 3.32Å; V319-F322 HydrophobicContact CG1-CE2 3.75Å; V319-F322 HydrophobicContact CG1-CZ 3.71Å; D320-F322 PolarHBondContact O-N 3Å; F322-P324 WeakPolarHBondContact O-CD 3.39Å
323	F	88.9	Confident	88.7	Confident	43 Å²	43	40.3 Å²	40.3	19%	0.189	21%	0.206	C	C	.	.	S	Bend	trans	-126.9	52.9	-174.8	-52	-59.6	0	0	0	113.3	A298 S299 R301 L304 D326 F328 Y330	A298-F323 VanDerWaalsContact O-CE2 3.29Å; A298-F323 WeakPolarHBondContact O-CE2 3.25Å; S299-F323 VanDerWaalsContact O-CZ 3.25Å; S299-F323 WeakPolarHBondContact O-CZ 3.31Å; R301-F323 HydrophobicContact CB-CD1 4.36Å; R301-F323 HydrophobicContact CB-CD2 4.2Å; R301-F323 HydrophobicContact CB-CE1 3.88Å; R301-F323 HydrophobicContact CB-CE2 3.68Å; R301-F323 HydrophobicContact CB-CZ 3.53Å; R301-F323 HydrophobicContact CG-CD1 4.16Å; R301-F323 HydrophobicContact CG-CD2 4.24Å; R301-F323 HydrophobicContact CG-CE1 4.16Å; R301-F323 HydrophobicContact CG-CE2 4.22Å; R301-F323 HydrophobicContact CG-CG 4.23Å; R301-F323 HydrophobicContact CG-CZ 4.2Å; L304-F323 HydrophobicContact CD1-CD2 3.98Å; L304-F323 HydrophobicContact CD1-CE2 4.07Å; F323-D326 HydrophobicContact CB-CB 4.18Å; F323-F328 HydrophobicContact CB-CD2 3.63Å; F323-F328 HydrophobicContact CB-CE2 3.91Å; F323-F328 HydrophobicContact CD2-CE2 4.21Å; F323-F328 HydrophobicContact CG-CD2 4.4Å; F323-F328 HydrophobicContact CG-CE2 4.23Å; F323-Y330 PolarHBondContact N-OH 3.27Å; F323-Y330 WeakPolarHBondContact O-CE2 3.32Å
324	P	77.7	Confident	88.5	Confident	36 Å²	36	41.9 Å²	41.9	23%	0.234	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	149.6	176	35	-39.2	0	0	0	109.7	T170 Q174 N321 F322 D326	T170-P324 HydrophobicContact CG2-CB 3.49Å; T170-P324 VanDerWaalsContact CG2-CB 3.49Å; T170-P324 HydrophobicContact CG2-CG 3.54Å; T170-P324 VanDerWaalsContact CG2-O 3.25Å; T170-P324 WeakPolarHBondContact CG2-O 3.32Å; Q174-P324 HydrophobicContact CG-CB 4.34Å; Q174-P324 HydrophobicContact CG-CG 3.96Å; N321-P324 WeakPolarHBondContact O-CD 3.33Å; F322-P324 WeakPolarHBondContact O-CD 3.39Å; P324-D326 PolarHBondContact O-N 2.85Å
325	G	67.9	Low	88.1	Confident	65 Å²	65	42.5 Å²	42.5	67%	0.67	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.7	-11.9	176.7	0	0	0	0	0	116.3
326	D	76.3	Confident	87.8	Confident	66 Å²	66	45.5 Å²	45.5	35%	0.353	23%	0.227	S	C	.	.	S	Bend	trans	-69.9	-178.7	161.4	-144.3	6.4	0	0	0	108.7	K305 F323 P324 F328	K305-D326 IonicContact NZ-OD2 3.12Å; K305-D326 PolarHBondContact NZ-OD2 3.3Å; F323-D326 HydrophobicContact CB-CB 4.18Å; P324-D326 PolarHBondContact O-N 2.85Å; D326-F328 HydrophobicContact CB-CD2 4.03Å; D326-F328 HydrophobicContact CB-CE2 4.41Å; D326-F328 PolarHBondContact O-N 2.96Å
327	K	83	Confident	87.7	Confident	189 Å²	189	48.4 Å²	48.4	82%	0.822	24%	0.242	S	C	*	.	S	Bend	trans	-71.1	30.6	-178.7	-61.9	-172.6	178	-176	0	115.5
328	F	92	Very high	87.9	Confident	15 Å²	15	49.9 Å²	49.9	7%	0.066	25%	0.252	C	S	.	.			trans	-116.6	120.8	178.8	-55.9	-70.3	0	0	0	110.4	R301 L304 K305 V309 T310 I312 F323 D326 Y330	R301-F328 HydrophobicContact CG-CE2 4.15Å; R301-F328 HydrophobicContact CG-CZ 4.45Å; L304-F328 HydrophobicContact CB-CE1 3.72Å; L304-F328 HydrophobicContact CB-CZ 3.71Å; L304-F328 HydrophobicContact CD1-CE1 4.38Å; L304-F328 HydrophobicContact CD1-CZ 4.15Å; K305-F328 HydrophobicContact CG-CZ 4.11Å; V309-F328 WeakPolarHBondContact O-CD1 3.42Å; V309-F328 VanDerWaalsContact O-CE1 3.28Å; V309-F328 WeakPolarHBondContact O-CE1 3.42Å; T310-F328 CarbonylContact O-C 3.5Å; T310-F328 WeakPolarHBondContact O-CA 3.26Å; I312-F328 HydrophobicContact CD1-CB 3.96Å; I312-F328 HydrophobicContact CD1-CD1 3.91Å; I312-F328 HydrophobicContact CD1-CG 3.89Å; I312-F328 HydrophobicContact CG1-CB 4.45Å; I312-F328 HydrophobicContact CG1-CD1 4.46Å; F323-F328 HydrophobicContact CB-CD2 3.63Å; F323-F328 HydrophobicContact CB-CE2 3.91Å; F323-F328 HydrophobicContact CD2-CE2 4.21Å; F323-F328 HydrophobicContact CG-CD2 4.4Å; F323-F328 HydrophobicContact CG-CE2 4.23Å; D326-F328 HydrophobicContact CB-CD2 4.03Å; D326-F328 HydrophobicContact CB-CE2 4.41Å; D326-F328 PolarHBondContact O-N 2.96Å; F328-Y330 HydrophobicContact CB-CD2 4.21Å; F328-Y330 HydrophobicContact CB-CE2 3.69Å; F328-Y330 WeakPolarHBondContact O-CD2 3.49Å
329	E	93.4	Very high	88.2	Confident	111 Å²	111	52.2 Å²	52.2	52%	0.519	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	136.8	167.2	-164.5	172.8	149.7	0	0	109.6	T310 H311 I312 F353	T310-E329 PolarHBondContact O-N 2.85Å; H311-E329 CarbonylContact C-O 3.32Å; H311-E329 WeakPolarHBondContact CA-O 3.24Å; I312-E329 PolarHBondContact N-O 2.76Å; E329-F353 HydrophobicContact CB-CE2 4.49Å; E329-F353 HydrophobicContact CG-CE2 4.02Å; E329-F353 HydrophobicContact CG-CZ 4.45Å
330	Y	95.1	Very high	88.5	Confident	40 Å²	40	60 Å²	60	16%	0.157	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.5	-176.7	-81.1	-96.6	0	0	0	112.2	I312 N321 F323 F328	I312-Y330 HydrophobicContact CB-CD1 3.78Å; I312-Y330 HydrophobicContact CB-CE1 3.73Å; I312-Y330 HydrophobicContact CB-CG 4.35Å; I312-Y330 HydrophobicContact CD1-CE1 4Å; I312-Y330 HydrophobicContact CD1-CE2 4.27Å; I312-Y330 HydrophobicContact CG1-CE1 4.43Å; I312-Y330 HydrophobicContact CG2-CD1 3.87Å; I312-Y330 HydrophobicContact CG2-CE1 3.59Å; I312-Y330 WeakPolarHBondContact O-CA 3.33Å; N321-Y330 HydrophobicContact CB-CD1 3.61Å; N321-Y330 HydrophobicContact CB-CD2 4.47Å; N321-Y330 HydrophobicContact CB-CE1 3.52Å; N321-Y330 HydrophobicContact CB-CE2 4.42Å; N321-Y330 HydrophobicContact CB-CG 4.08Å; N321-Y330 WeakPolarHBondContact ND2-CB 3.41Å; N321-Y330 VanDerWaalsContact ND2-CD1 3.34Å; N321-Y330 WeakPolarHBondContact ND2-CD1 3.33Å; N321-Y330 WeakPolarHBondContact OD1-CD1 3.31Å; F323-Y330 PolarHBondContact N-OH 3.27Å; F323-Y330 WeakPolarHBondContact O-CE2 3.32Å; F328-Y330 HydrophobicContact CB-CD2 4.21Å; F328-Y330 HydrophobicContact CB-CE2 3.69Å; F328-Y330 WeakPolarHBondContact O-CD2 3.49Å
331	K	94.9	Very high	88.6	Confident	62 Å²	62	59.5 Å²	59.5	27%	0.27	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.4	167.7	-168.3	65.7	172	178.6	0	109.8	I312 L313 N314 E349 F353	I312-K331 PolarHBondContact O-N 3.01Å; L313-K331 WeakPolarHBondContact CA-O 3.35Å; L313-K331 HydrophobicContact CD1-CB 3.86Å; L313-K331 HydrophobicContact CD1-CG 3.96Å; N314-K331 PolarHBondContact N-O 3.46Å; K331-E349 VanDerWaalsContact CE-OE1 3.23Å; K331-E349 WeakPolarHBondContact CE-OE1 3.43Å; K331-E349 IonicContact NZ-OE1 2.64Å; K331-E349 PolarHBondContact NZ-OE1 3.3Å; K331-E349 IonicContact NZ-OE2 2.6Å; K331-F353 HydrophobicContact CB-CD1 3.58Å; K331-F353 HydrophobicContact CB-CD2 3.94Å; K331-F353 HydrophobicContact CB-CE1 3.52Å; K331-F353 HydrophobicContact CB-CE2 3.89Å; K331-F353 HydrophobicContact CB-CG 3.79Å; K331-F353 HydrophobicContact CB-CZ 3.67Å; K331-F353 HydrophobicContact CG-CD1 4.3Å; K331-F353 HydrophobicContact CG-CD2 4.45Å; K331-F353 HydrophobicContact CG-CG 4.17Å
332	N	94.5	Very high	88.7	Confident	36 Å²	36	62 Å²	62	19%	0.193	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.6	-178.1	-65.3	-27.8	0	0	0	110.6	N314 N321 R334	N314-N332 WeakPolarHBondContact O-CA 3.22Å; N321-N332 PolarHBondContact ND2-ND2 3.31Å; N321-N332 VanDerWaalsContact ND2-ND2 3.2Å; N321-N332 PolarHBondContact ND2-OD1 3.45Å; N321-N332 PolarHBondContact OD1-OD1 3.1Å; N332-R334 HydrophobicContact CB-CG 4.37Å
333	I	95.3	Very high	89.1	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	30%	0.302	C	S	.	.			trans	-116.4	93.4	170	-50.4	-62	0	0	0	107	L313 N314 V315 T316 I335 L343 Y346 T350	L313-I333 HydrophobicContact CD1-CG1 3.9Å; N314-I333 PolarHBondContact O-N 2.59Å; V315-I333 CarbonylContact C-O 3.28Å; V315-I333 HydrophobicContact CG1-CB 4.25Å; V315-I333 HydrophobicContact CG1-CG2 4.43Å; T316-I333 CarbonylContact C-O 3.54Å; T316-I333 PolarHBondContact N-O 2.93Å; T316-I333 VanDerWaalsContact N-O 3.17Å; I333-I335 HydrophobicContact CG2-CG1 4.38Å; I333-I335 HydrophobicContact CG2-CG2 4.41Å; I333-I335 PolarHBondContact O-N 3.25Å; I333-L343 HydrophobicContact CG2-CD2 4.29Å; I333-Y346 HydrophobicContact CD1-CD1 3.83Å; I333-Y346 HydrophobicContact CD1-CG 4.21Å; I333-Y346 HydrophobicContact CG2-CD1 3.95Å; I333-Y346 HydrophobicContact CG2-CD2 3.77Å; I333-Y346 HydrophobicContact CG2-CE1 4.3Å; I333-Y346 HydrophobicContact CG2-CE2 4.13Å; I333-Y346 HydrophobicContact CG2-CG 3.67Å; I333-T350 HydrophobicContact CD1-CG2 3.98Å; I333-T350 HydrophobicContact CG1-CG2 3.91Å
334	R	93.1	Very high	89.4	Confident	34 Å²	34	59.4 Å²	59.4	13%	0.128	31%	0.305	C	S	.	.			trans	-78.8	71.6	-165.1	-67.6	-66.5	-153.7	179.9	10.9	113.2	L177 T316 R317 V319 D320 N332	L177-R334 PolarHBondContact O-NH2 2.97Å; T316-R334 WeakPolarHBondContact O-CA 3.33Å; T316-R334 VanDerWaalsContact O-CD 3.31Å; T316-R334 WeakPolarHBondContact O-CD 3.38Å; R317-R334 HydrophobicContact CB-CB 4.47Å; R317-R334 HydrophobicContact CG-CB 4.36Å; R317-R334 PolarHBondContact O-NH1 3.18Å; V319-R334 PolarHBondContact O-NH1 2.82Å; D320-R334 IonicContact OD1-CZ 2.87Å; D320-R334 IonicContact OD1-NH1 2.71Å; D320-R334 PolarHBondContact OD1-NH1 3.07Å; D320-R334 VanDerWaalsContact OD1-NH1 3.1Å; D320-R334 IonicContact OD1-NH2 2.66Å; D320-R334 PolarHBondContact OD1-NH2 3.48Å; N332-R334 HydrophobicContact CB-CG 4.37Å
335	I	90	Very high	90.3	Very high	12 Å²	12	61.3 Å²	61.3	6%	0.062	32%	0.317	C	S	.	.			trans	-127.5	159.5	-178.5	64	161.5	0	0	0	114.6	V315 T316 R317 I333 L343 Y346 R374 F411	V315-I335 HydrophobicContact CG1-CD1 4.27Å; V315-I335 HydrophobicContact CG1-CG1 4.34Å; T316-I335 CarbonylContact C-O 3.52Å; T316-I335 WeakPolarHBondContact CA-O 3.43Å; R317-I335 PolarHBondContact N-O 3.26Å; I333-I335 HydrophobicContact CG2-CG1 4.38Å; I333-I335 HydrophobicContact CG2-CG2 4.41Å; I333-I335 PolarHBondContact O-N 3.25Å; I335-L343 HydrophobicContact CD1-CD1 4.27Å; I335-L343 HydrophobicContact CD1-CD2 3.42Å; I335-L343 VanDerWaalsContact CD1-CD2 3.42Å; I335-L343 HydrophobicContact CD1-CG 3.47Å; I335-L343 VanDerWaalsContact CD1-CG 3.47Å; I335-Y346 HydrophobicContact CG2-CE2 4.27Å; I335-R374 HydrophobicContact CD1-CG 4.05Å; I335-R374 HydrophobicContact CG1-CG 4.39Å; I335-R374 PolarHBondContact O-NH1 2.99Å; I335-F411 HydrophobicContact CD1-CE1 4.21Å; I335-F411 HydrophobicContact CD1-CZ 4.01Å
336	Y	91.3	Very high	91.6	Very high	64 Å²	64	59.5 Å²	59.5	25%	0.251	29%	0.29	S	S	.	.			trans	-90.9	172.9	172.2	-56.6	-75.1	0	0	0	112.8	E181 R317 D338 R374	E181-Y336 PolarHBondContact OE1-OH 3.48Å; E181-Y336 VanDerWaalsContact OE2-CE1 3.22Å; E181-Y336 WeakPolarHBondContact OE2-CE1 3.23Å; E181-Y336 VanDerWaalsContact OE2-CZ 3.27Å; E181-Y336 PolarHBondContact OE2-OH 3.12Å; R317-Y336 HydrophobicContact CB-CD1 4.48Å; R317-Y336 HydrophobicContact CB-CE1 4.26Å; R317-Y336 WeakPolarHBondContact CD-OH 3.47Å; R317-Y336 PolarHBondContact NH1-OH 3.01Å; Y336-D338 WeakPolarHBondContact CB-OD2 3.45Å; Y336-D338 PolarHBondContact O-N 3.13Å; Y336-R374 WeakPolarHBondContact O-CD 3.46Å
337	D	90.5	Very high	92.6	Very high	60 Å²	60	56.4 Å²	56.4	32%	0.321	27%	0.274	S	S	.	.	S	Bend	trans	-96.7	36.9	-179.1	-133.1	-44.7	0	0	0	113.4	S373 R374 N408	D337-S373 WeakPolarHBondContact OD1-CB 3.29Å; D337-S373 PolarHBondContact OD1-OG 3.41Å; D337-R374 HydrophobicContact CB-CG 4.32Å; D337-R374 VanDerWaalsContact CG-NE 3.31Å; D337-R374 WeakPolarHBondContact OD2-CG 3.45Å; D337-R374 IonicContact OD2-CZ 2.66Å; D337-R374 PolarHBondContact OD2-N 3.42Å; D337-R374 IonicContact OD2-NE 2.65Å; D337-R374 PolarHBondContact OD2-NE 3.45Å; D337-R374 IonicContact OD2-NH2 2.76Å; D337-N408 PolarHBondContact O-ND2 3.45Å
338	D	88	Confident	93.1	Very high	61 Å²	61	52.1 Å²	52.1	33%	0.326	26%	0.257	S	S	.	.	S	Bend	trans	-105.8	174	-179.8	63.8	52.8	0	0	0	113.2	Y336 Q340 S341 N408	Y336-D338 WeakPolarHBondContact CB-OD2 3.45Å; Y336-D338 PolarHBondContact O-N 3.13Å; D338-Q340 VanDerWaalsContact C-N 3.32Å; D338-Q340 WeakPolarHBondContact OD1-CA 3.44Å; D338-Q340 PolarHBondContact OD1-N 2.93Å; D338-S341 WeakPolarHBondContact OD1-CB 3.37Å; D338-S341 PolarHBondContact OD1-N 3.27Å; D338-S341 PolarHBondContact OD1-OG 3.4Å; D338-S341 PolarHBondContact OD2-OG 2.8Å; D338-N408 PolarHBondContact O-ND2 2.97Å
339	E	89.5	Confident	93.2	Very high	85 Å²	85	53.4 Å²	53.4	40%	0.397	26%	0.263	S	S	.	.	S	Bend	trans	-81	-4.4	179.6	-68.2	-163.3	-153.7	0	0	115.1	P409 R413	E339-P409 HydrophobicContact CG-CB 4.42Å; E339-P409 WeakPolarHBondContact OE1-CB 3.33Å; E339-P409 WeakPolarHBondContact OE1-CG 3.38Å; E339-R413 IonicContact OE2-CZ 3.56Å; E339-R413 IonicContact OE2-NH1 3.47Å; E339-R413 IonicContact OE2-NH2 2.82Å; E339-R413 PolarHBondContact OE2-NH2 2.91Å
340	Q	89.7	Confident	93.4	Very high	171 Å²	171	48.1 Å²	48.1	80%	0.799	24%	0.238	S	C	*	.	S	Bend	trans	-96.9	-27.8	-179.4	-53.4	-59.1	-48.9	0	0	111.5	D338	D338-Q340 VanDerWaalsContact C-N 3.32Å; D338-Q340 WeakPolarHBondContact OD1-CA 3.44Å; D338-Q340 PolarHBondContact OD1-N 2.93Å
341	S	89.8	Confident	93.6	Very high	21 Å²	21	47 Å²	47	15%	0.147	23%	0.234	C	C	.	.	S	Bend	trans	-65.6	135	173.1	-64.1	0	0	0	0	111	D338 F411	D338-S341 WeakPolarHBondContact OD1-CB 3.37Å; D338-S341 PolarHBondContact OD1-N 3.27Å; D338-S341 PolarHBondContact OD1-OG 3.4Å; D338-S341 PolarHBondContact OD2-OG 2.8Å; S341-F411 WeakPolarHBondContact O-CE1 3.25Å
342	T	93.9	Very high	93.7	Very high	70 Å²	70	48.5 Å²	48.5	43%	0.429	24%	0.238	S	C	.	.			trans	-110.4	121	-178.4	57.8	0	0	0	0	111.7	Y346 E414	T342-Y346 WeakPolarHBondContact O-CD2 3.31Å; T342-Y346 VanDerWaalsContact O-CE2 3.31Å; T342-Y346 WeakPolarHBondContact O-CE2 3.45Å; T342-E414 WeakPolarHBondContact CA-OE1 3.41Å; T342-E414 WeakPolarHBondContact CB-OE1 3.3Å
343	L	96.3	Very high	93.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.231	C	C	.	.			trans	-89.6	-26.3	170	-90.9	175.8	0	0	0	113.1	V315 I333 I335 P345 Y346 W347 F411 E414	V315-L343 HydrophobicContact CG1-CD2 3.87Å; I333-L343 HydrophobicContact CG2-CD2 4.29Å; I335-L343 HydrophobicContact CD1-CD1 4.27Å; I335-L343 HydrophobicContact CD1-CD2 3.42Å; I335-L343 VanDerWaalsContact CD1-CD2 3.42Å; I335-L343 HydrophobicContact CD1-CG 3.47Å; I335-L343 VanDerWaalsContact CD1-CG 3.47Å; L343-P345 VanDerWaalsContact C-N 3.33Å; L343-P345 VanDerWaalsContact O-N 3.15Å; L343-Y346 PolarHBondContact O-N 2.95Å; L343-W347 HydrophobicContact CB-CH2 4.29Å; L343-W347 HydrophobicContact CB-CZ2 3.48Å; L343-W347 VanDerWaalsContact CB-CZ2 3.48Å; L343-W347 HydrophobicContact CD1-CZ2 4.15Å; L343-W347 HydrophobicContact CG-CZ2 4.43Å; L343-F411 HydrophobicContact CB-CD1 3.98Å; L343-F411 HydrophobicContact CB-CE1 4.16Å; L343-F411 HydrophobicContact CD1-CD1 3.73Å; L343-F411 HydrophobicContact CD1-CD2 4.15Å; L343-F411 HydrophobicContact CD1-CE1 3.87Å; L343-F411 HydrophobicContact CD1-CE2 4.29Å; L343-F411 HydrophobicContact CD1-CG 3.9Å; L343-F411 HydrophobicContact CD1-CZ 4.17Å; L343-F411 HydrophobicContact CG-CD1 3.91Å; L343-F411 HydrophobicContact CG-CE1 3.76Å; L343-F411 HydrophobicContact CG-CZ 4.31Å; L343-E414 WeakPolarHBondContact CA-OE2 3.34Å; L343-E414 WeakPolarHBondContact CB-OE2 3.35Å; L343-E414 PolarHBondContact N-OE1 2.87Å; L343-E414 PolarHBondContact N-OE2 3.26Å
344	L	96	Very high	94	Very high	48 Å²	48	47 Å²	47	25%	0.251	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-49.4	-41	-173.6	-178.9	62.6	0	0	0	114.9	Y346 W347 E414 T417 Y418 I421	L344-Y346 PolarHBondContact O-N 3.23Å; L344-W347 HydrophobicContact CB-CE3 4.48Å; L344-W347 HydrophobicContact CB-CZ3 4.25Å; L344-W347 HydrophobicContact CD1-CE3 3.79Å; L344-W347 HydrophobicContact CD1-CZ3 3.74Å; L344-E414 HydrophobicContact CB-CB 4.15Å; L344-E414 HydrophobicContact CB-CG 4.08Å; L344-E414 WeakPolarHBondContact CB-OE1 3.42Å; L344-E414 PolarHBondContact N-OE1 3.13Å; L344-E414 VanDerWaalsContact N-OE1 3.13Å; L344-E414 PolarHBondContact N-OE2 2.77Å; L344-T417 HydrophobicContact CD2-CG2 3.9Å; L344-Y418 HydrophobicContact CD1-CD2 3.88Å; L344-Y418 HydrophobicContact CD1-CG 4.29Å; L344-I421 HydrophobicContact CD1-CD1 4.08Å; L344-I421 HydrophobicContact CD2-CD1 4.46Å
345	P	94.9	Very high	94.1	Very high	77 Å²	77	46.7 Å²	46.7	50%	0.5	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-66.5	-22.3	179.5	-21.3	34.7	0	0	0	114.3	L343	L343-P345 VanDerWaalsContact C-N 3.33Å; L343-P345 VanDerWaalsContact O-N 3.15Å
346	Y	95.9	Very high	94.4	Very high	26 Å²	26	49.9 Å²	49.9	10%	0.102	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-92.7	-18.3	-170.8	-60.6	-75.9	0	0	0	113.9	K116 H117 I333 I335 T342 L343 L344 E348 E349 T350	K116-Y346 PolarHBondContact O-OH 3.27Å; H117-Y346 AromaticContact ND1-CE1 3.76Å; I333-Y346 HydrophobicContact CD1-CD1 3.83Å; I333-Y346 HydrophobicContact CD1-CG 4.21Å; I333-Y346 HydrophobicContact CG2-CD1 3.95Å; I333-Y346 HydrophobicContact CG2-CD2 3.77Å; I333-Y346 HydrophobicContact CG2-CE1 4.3Å; I333-Y346 HydrophobicContact CG2-CE2 4.13Å; I333-Y346 HydrophobicContact CG2-CG 3.67Å; I335-Y346 HydrophobicContact CG2-CE2 4.27Å; T342-Y346 WeakPolarHBondContact O-CD2 3.31Å; T342-Y346 VanDerWaalsContact O-CE2 3.31Å; T342-Y346 WeakPolarHBondContact O-CE2 3.45Å; L343-Y346 PolarHBondContact O-N 2.95Å; L344-Y346 PolarHBondContact O-N 3.23Å; Y346-E348 PolarHBondContact O-N 2.74Å; Y346-E348 VanDerWaalsContact O-N 3.15Å; Y346-E349 WeakPolarHBondContact O-CA 3.27Å; Y346-E349 WeakPolarHBondContact O-CB 3.49Å; Y346-E349 PolarHBondContact O-N 2.85Å; Y346-T350 PolarHBondContact O-N 3.31Å; Y346-T350 PolarHBondContact O-OG1 3.25Å
347	W	97.2	Very high	94.6	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-64.1	-25.1	-170.2	-69.3	-31.2	0	0	0	114.7	L343 L344 E349 T350 H351 T378 A381 E414 L415 Y418	L343-W347 HydrophobicContact CB-CH2 4.29Å; L343-W347 HydrophobicContact CB-CZ2 3.48Å; L343-W347 VanDerWaalsContact CB-CZ2 3.48Å; L343-W347 HydrophobicContact CD1-CZ2 4.15Å; L343-W347 HydrophobicContact CG-CZ2 4.43Å; L344-W347 HydrophobicContact CB-CE3 4.48Å; L344-W347 HydrophobicContact CB-CZ3 4.25Å; L344-W347 HydrophobicContact CD1-CE3 3.79Å; L344-W347 HydrophobicContact CD1-CZ3 3.74Å; W347-E349 VanDerWaalsContact C-N 3.32Å; W347-T350 WeakPolarHBondContact CA-OG1 3.42Å; W347-T350 PolarHBondContact O-OG1 3.33Å; W347-H351 WeakPolarHBondContact O-CB 3.38Å; W347-H351 PolarHBondContact O-N 2.91Å; W347-T378 PolarHBondContact NE1-OG1 3.38Å; W347-A381 HydrophobicContact CB-CB 4.22Å; W347-A381 HydrophobicContact CD2-CB 3.44Å; W347-A381 VanDerWaalsContact CD2-CB 3.44Å; W347-A381 HydrophobicContact CE3-CB 3.94Å; W347-A381 HydrophobicContact CG-CB 3.56Å; W347-A381 HydrophobicContact CZ2-CB 4.29Å; W347-E414 HydrophobicContact CH2-CB 3.62Å; W347-E414 HydrophobicContact CZ3-CB 3.98Å; W347-L415 HydrophobicContact CH2-CB 4.42Å; W347-L415 HydrophobicContact CH2-CD2 3.62Å; W347-L415 HydrophobicContact CH2-CG 3.69Å; W347-L415 HydrophobicContact CZ2-CD2 3.87Å; W347-L415 HydrophobicContact CZ2-CG 4.14Å; W347-L415 HydrophobicContact CZ3-CD2 4.08Å; W347-L415 HydrophobicContact CZ3-CG 4.42Å; W347-Y418 HydrophobicContact CB-CE1 4.47Å; W347-Y418 HydrophobicContact CB-CE2 4.12Å; W347-Y418 AromaticContact CE3-CD1 3.92Å; W347-Y418 HydrophobicContact CE3-CD1 3.92Å; W347-Y418 AromaticContact CE3-CD2 3.86Å; W347-Y418 HydrophobicContact CE3-CD2 3.86Å; W347-Y418 HydrophobicContact CE3-CE1 4.41Å; W347-Y418 HydrophobicContact CE3-CE2 4.35Å; W347-Y418 AromaticContact CE3-CG 3.6Å; W347-Y418 HydrophobicContact CE3-CG 3.6Å; W347-Y418 HydrophobicContact CZ3-CD1 4.42Å; W347-Y418 HydrophobicContact CZ3-CG 4.01Å
348	E	94.6	Very high	94.9	Very high	100 Å²	100	48 Å²	48	47%	0.467	24%	0.236	S	C	.	.	H	α-helix	trans	-73.8	-22.3	171.8	-168.3	55.5	-141.8	0	0	113.5	Y346 R352 K385	Y346-E348 PolarHBondContact O-N 2.74Å; Y346-E348 VanDerWaalsContact O-N 3.15Å; E348-R352 WeakPolarHBondContact O-CG 3.3Å; E348-R352 PolarHBondContact O-NE 2.84Å; E348-K385 IonicContact OE1-NZ 3.38Å; E348-K385 PolarHBondContact OE1-NZ 3.45Å; E348-K385 IonicContact OE2-NZ 2.68Å; E348-K385 PolarHBondContact OE2-NZ 3.45Å
349	E	93.9	Very high	95.3	Very high	41 Å²	41	52.2 Å²	52.2	19%	0.192	26%	0.257	C	S	.	.	H	α-helix	trans	-89	-44.7	176	-179	167.9	-129.9	0	0	111.6	H117 K331 Y346 W347 H351 R352 F353	H117-E349 IonicContact ND1-OE2 3.52Å; K331-E349 VanDerWaalsContact CE-OE1 3.23Å; K331-E349 WeakPolarHBondContact CE-OE1 3.43Å; K331-E349 IonicContact NZ-OE1 2.64Å; K331-E349 PolarHBondContact NZ-OE1 3.3Å; K331-E349 IonicContact NZ-OE2 2.6Å; Y346-E349 WeakPolarHBondContact O-CA 3.27Å; Y346-E349 WeakPolarHBondContact O-CB 3.49Å; Y346-E349 PolarHBondContact O-N 2.85Å; W347-E349 VanDerWaalsContact C-N 3.32Å; E349-H351 VanDerWaalsContact C-N 3.28Å; E349-H351 PolarHBondContact O-N 2.66Å; E349-R352 PolarHBondContact O-N 3.43Å; E349-F353 PolarHBondContact O-N 3.03Å; E349-F353 VanDerWaalsContact O-N 3.1Å
350	T	97.7	Very high	95.5	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-64.4	-34.2	175.5	61.1	0	0	0	0	112	L313 I333 Y346 W347 F353 I354 T378	L313-T350 HydrophobicContact CD1-CG2 3.97Å; L313-T350 HydrophobicContact CD2-CG2 3.79Å; I333-T350 HydrophobicContact CD1-CG2 3.98Å; I333-T350 HydrophobicContact CG1-CG2 3.91Å; Y346-T350 PolarHBondContact O-N 3.31Å; Y346-T350 PolarHBondContact O-OG1 3.25Å; W347-T350 WeakPolarHBondContact CA-OG1 3.42Å; W347-T350 PolarHBondContact O-OG1 3.33Å; T350-F353 PolarHBondContact O-N 3.12Å; T350-I354 WeakPolarHBondContact O-CD1 3.4Å; T350-I354 VanDerWaalsContact O-CG1 3.24Å; T350-I354 WeakPolarHBondContact O-CG1 3.3Å; T350-I354 PolarHBondContact O-N 3.28Å; T350-T378 HydrophobicContact CG2-CG2 3.88Å; T350-T378 WeakPolarHBondContact OG1-CG2 3.38Å
351	H	97.9	Very high	95.7	Very high	15 Å²	15	49 Å²	49	7%	0.069	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-41.6	175.4	175.6	-95	0	0	0	112.6	W347 E349 N355 Y382 K385 E386	W347-H351 WeakPolarHBondContact O-CB 3.38Å; W347-H351 PolarHBondContact O-N 2.91Å; E349-H351 VanDerWaalsContact C-N 3.28Å; E349-H351 PolarHBondContact O-N 2.66Å; H351-N355 PolarHBondContact CE1-ND2 3.35Å; H351-N355 PolarHBondContact NE2-ND2 3.44Å; H351-N355 WeakPolarHBondContact O-CB 3.32Å; H351-N355 PolarHBondContact O-N 3.08Å; H351-N355 VanDerWaalsContact O-N 3.07Å; H351-Y382 HydrophobicContact CB-CD2 4.41Å; H351-Y382 AromaticContact CD2-CD2 3.47Å; H351-Y382 VanDerWaalsContact CD2-CD2 3.47Å; H351-Y382 WeakPolarHBondContact CD2-CD2 3.36Å; H351-Y382 AromaticContact CD2-CE2 3.53Å; H351-Y382 AromaticContact NE2-CE2 3.98Å; H351-K385 HydrophobicContact CB-CD 4.3Å; H351-K385 WeakPolarHBondContact ND1-CE 3.43Å; H351-K385 PolarHBondContact ND1-NZ 3.05Å; H351-E386 IonicContact CD2-OE2 3.12Å; H351-E386 IonicContact CE1-OE2 3.28Å; H351-E386 PolarHBondContact CE1-OE2 3.36Å; H351-E386 IonicContact NE2-OE2 2.71Å; H351-E386 PolarHBondContact NE2-OE2 3.09Å
352	R	97.1	Very high	96	Very high	94 Å²	94	48.8 Å²	48.8	36%	0.355	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-48.2	174.6	-72.2	-179.2	-67	121.4	-1.4	111.5	E348 E349 I354 N355 E356	E348-R352 WeakPolarHBondContact O-CG 3.3Å; E348-R352 PolarHBondContact O-NE 2.84Å; E349-R352 PolarHBondContact O-N 3.43Å; R352-I354 VanDerWaalsContact C-N 3.31Å; R352-I354 PolarHBondContact O-N 3.35Å; R352-N355 CarbonylContact O-C 3.56Å; R352-N355 WeakPolarHBondContact O-CA 3.45Å; R352-N355 PolarHBondContact O-N 3.33Å; R352-E356 WeakPolarHBondContact O-CG 3.38Å; R352-E356 PolarHBondContact O-N 2.87Å
353	F	97.6	Very high	96.1	Very high	7 Å²	7	48.9 Å²	48.9	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-61	-35.2	179.3	-172.1	-109	0	0	0	114.1	H311 L313 E329 K331 E349 T350 E356	H311-F353 HydrophobicContact CB-CE1 3.87Å; H311-F353 HydrophobicContact CB-CE2 4.45Å; H311-F353 HydrophobicContact CB-CZ 3.75Å; H311-F353 AromaticContact CD2-CE2 3.64Å; H311-F353 AromaticContact CD2-CZ 3.84Å; L313-F353 HydrophobicContact CB-CD1 4.01Å; L313-F353 HydrophobicContact CB-CE1 4.01Å; L313-F353 HydrophobicContact CD1-CD1 4.39Å; E329-F353 HydrophobicContact CB-CE2 4.49Å; E329-F353 HydrophobicContact CG-CE2 4.02Å; E329-F353 HydrophobicContact CG-CZ 4.45Å; K331-F353 HydrophobicContact CB-CD1 3.58Å; K331-F353 HydrophobicContact CB-CD2 3.94Å; K331-F353 HydrophobicContact CB-CE1 3.52Å; K331-F353 HydrophobicContact CB-CE2 3.89Å; K331-F353 HydrophobicContact CB-CG 3.79Å; K331-F353 HydrophobicContact CB-CZ 3.67Å; K331-F353 HydrophobicContact CG-CD1 4.3Å; K331-F353 HydrophobicContact CG-CD2 4.45Å; K331-F353 HydrophobicContact CG-CG 4.17Å; E349-F353 PolarHBondContact O-N 3.03Å; E349-F353 VanDerWaalsContact O-N 3.1Å; T350-F353 PolarHBondContact O-N 3.12Å; F353-E356 WeakPolarHBondContact CA-OE2 3.35Å
354	I	98.2	Very high	96.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-72.5	-34.1	173.5	-65.4	163.8	0	0	0	111.2	V290 L313 T350 R352 K358 V366 Y382	V290-I354 HydrophobicContact CG2-CG2 3.53Å; L313-I354 HydrophobicContact CD2-CD1 4.08Å; L313-I354 HydrophobicContact CD2-CG1 4.26Å; T350-I354 WeakPolarHBondContact O-CD1 3.4Å; T350-I354 VanDerWaalsContact O-CG1 3.24Å; T350-I354 WeakPolarHBondContact O-CG1 3.3Å; T350-I354 PolarHBondContact O-N 3.28Å; R352-I354 VanDerWaalsContact C-N 3.31Å; R352-I354 PolarHBondContact O-N 3.35Å; I354-K358 PolarHBondContact O-N 3.26Å; I354-V366 HydrophobicContact CD1-CG2 3.88Å; I354-V366 HydrophobicContact CG1-CG2 4.19Å; I354-Y382 HydrophobicContact CB-CD2 3.84Å; I354-Y382 HydrophobicContact CB-CE2 3.71Å; I354-Y382 HydrophobicContact CD1-CD2 3.77Å; I354-Y382 HydrophobicContact CD1-CG 3.96Å; I354-Y382 HydrophobicContact CG1-CD2 4.42Å; I354-Y382 HydrophobicContact CG2-CD1 4.33Å; I354-Y382 HydrophobicContact CG2-CD2 3.74Å; I354-Y382 HydrophobicContact CG2-CE1 4.01Å; I354-Y382 HydrophobicContact CG2-CE2 3.38Å; I354-Y382 HydrophobicContact CG2-CG 4.22Å
355	N	96.7	Very high	96.3	Very high	27 Å²	27	46.7 Å²	46.7	14%	0.144	24%	0.239	C	C	.	.	H	α-helix	trans	-77.9	-23.9	177.5	-83.1	-0.5	0	0	0	113.9	H351 R352 K358 I359 Y382 E386	H351-N355 PolarHBondContact CE1-ND2 3.35Å; H351-N355 PolarHBondContact NE2-ND2 3.44Å; H351-N355 WeakPolarHBondContact O-CB 3.32Å; H351-N355 PolarHBondContact O-N 3.08Å; H351-N355 VanDerWaalsContact O-N 3.07Å; R352-N355 CarbonylContact O-C 3.56Å; R352-N355 WeakPolarHBondContact O-CA 3.45Å; R352-N355 PolarHBondContact O-N 3.33Å; N355-K358 WeakPolarHBondContact O-CB 3.43Å; N355-K358 PolarHBondContact O-N 3.42Å; N355-I359 WeakPolarHBondContact O-CB 3.37Å; N355-I359 WeakPolarHBondContact O-CD1 3.23Å; N355-I359 VanDerWaalsContact O-CG1 3.23Å; N355-I359 WeakPolarHBondContact O-CG1 3.22Å; N355-I359 PolarHBondContact O-N 3.42Å; N355-Y382 WeakPolarHBondContact OD1-CE2 3.5Å; N355-Y382 PolarHBondContact OD1-OH 2.94Å; N355-E386 PolarHBondContact ND2-OE2 2.66Å
356	E	96	Very high	96.5	Very high	79 Å²	79	43 Å²	43	37%	0.369	22%	0.215	S	C	.	.	H	α-helix	trans	-60.8	-49.7	169.6	-76.2	147.1	-163.3	0	0	110	R352 F353 K358 I359 M360	R352-E356 WeakPolarHBondContact O-CG 3.38Å; R352-E356 PolarHBondContact O-N 2.87Å; F353-E356 WeakPolarHBondContact CA-OE2 3.35Å; E356-K358 VanDerWaalsContact C-N 3.32Å; E356-K358 PolarHBondContact O-N 3.49Å; E356-I359 PolarHBondContact O-N 3.07Å; E356-M360 WeakPolarHBondContact O-CG 3.44Å; E356-M360 PolarHBondContact O-N 3.39Å; E356-M360 VanDerWaalsContact O-N 3.12Å
357	A	95.6	Very high	96.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-56.9	-42.4	172.3	0	0	0	0	0	113.3	H311 M360 G361 T362 C364	H311-A357 HydrophobicContact CB-CB 4Å; H311-A357 PolarHBondContact NE2-N 3.09Å; A357-M360 PolarHBondContact O-N 2.99Å; A357-G361 PolarHBondContact O-N 3.36Å; A357-T362 CarbonylContact O-C 3.51Å; A357-T362 PolarHBondContact O-N 2.93Å; A357-T362 VanDerWaalsContact O-O 3.12Å; A357-T362 PolarHBondContact O-OG1 2.91Å; A357-C364 HydrophobicContact CB-CB 3.83Å
358	K	96.7	Very high	96.4	Very high	85 Å²	85	41.8 Å²	41.8	37%	0.37	21%	0.21	S	C	.	.	H	α-helix	trans	-60.7	-48.1	178.1	-170.8	-177.1	178.7	170.3	0	112.1	H289 I354 N355 E356 M360 G361 E386	H289-K358 HydrophobicContact CB-CB 4.35Å; H289-K358 HydrophobicContact CB-CG 4.45Å; I354-K358 PolarHBondContact O-N 3.26Å; N355-K358 WeakPolarHBondContact O-CB 3.43Å; N355-K358 PolarHBondContact O-N 3.42Å; E356-K358 VanDerWaalsContact C-N 3.32Å; E356-K358 PolarHBondContact O-N 3.49Å; K358-M360 VanDerWaalsContact C-N 3.26Å; K358-M360 PolarHBondContact O-N 2.93Å; K358-G361 PolarHBondContact O-N 2.88Å; K358-G361 VanDerWaalsContact O-N 3.08Å; K358-E386 IonicContact NZ-OE1 3.59Å; K358-E386 PolarHBondContact NZ-OE1 3.41Å
359	I	95.6	Very high	96	Very high	148 Å²	148	40.4 Å²	40.4	76%	0.759	20%	0.202	S	C	*	.	H	α-helix	trans	-64	-35.1	179.8	-70.6	163	0	0	0	110.7	N355 E356 G361	N355-I359 WeakPolarHBondContact O-CB 3.37Å; N355-I359 WeakPolarHBondContact O-CD1 3.23Å; N355-I359 VanDerWaalsContact O-CG1 3.23Å; N355-I359 WeakPolarHBondContact O-CG1 3.22Å; N355-I359 PolarHBondContact O-N 3.42Å; E356-I359 PolarHBondContact O-N 3.07Å; I359-G361 PolarHBondContact O-N 3.33Å
360	M	93.8	Very high	95.5	Very high	127 Å²	127	43.7 Å²	43.7	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-4.8	175.3	-68.1	-179.5	62.9	0	0	114.5	E356 A357 K358 T362	E356-M360 WeakPolarHBondContact O-CG 3.44Å; E356-M360 PolarHBondContact O-N 3.39Å; E356-M360 VanDerWaalsContact O-N 3.12Å; A357-M360 PolarHBondContact O-N 2.99Å; K358-M360 VanDerWaalsContact C-N 3.26Å; K358-M360 PolarHBondContact O-N 2.93Å; M360-T362 VanDerWaalsContact C-N 3.29Å; M360-T362 HydrophobicContact CB-CG2 4.22Å; M360-T362 PolarHBondContact O-N 2.9Å
361	G	94.2	Very high	95.2	Very high	61 Å²	61	43.7 Å²	43.7	63%	0.629	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	69	27.6	-175	0	0	0	0	0	113.5	A357 K358 I359	A357-G361 PolarHBondContact O-N 3.36Å; K358-G361 PolarHBondContact O-N 2.88Å; K358-G361 VanDerWaalsContact O-N 3.08Å; I359-G361 PolarHBondContact O-N 3.33Å
362	T	95.6	Very high	94.7	Very high	17 Å²	17	45.8 Å²	45.8	10%	0.104	23%	0.23	C	C	.	.			trans	-122.6	175.2	-173.9	58.1	0	0	0	0	111.3	H289 T310 A357 M360	H289-T362 WeakPolarHBondContact CB-O 3.46Å; T310-T362 HydrophobicContact CG2-CG2 3.73Å; T310-T362 WeakPolarHBondContact OG1-CB 3.47Å; T310-T362 PolarHBondContact OG1-OG1 3.44Å; A357-T362 CarbonylContact O-C 3.51Å; A357-T362 PolarHBondContact O-N 2.93Å; A357-T362 VanDerWaalsContact O-O 3.12Å; A357-T362 PolarHBondContact O-OG1 2.91Å; M360-T362 VanDerWaalsContact C-N 3.29Å; M360-T362 HydrophobicContact CB-CG2 4.22Å; M360-T362 PolarHBondContact O-N 2.9Å
363	R	97.5	Very high	94.4	Very high	72 Å²	72	41.6 Å²	41.6	27%	0.272	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.1	179.8	-57.3	-158.2	170.2	108.7	-2.4	113.3	D288 H289 L291 L307 N308 V309 T310 H311	D288-R363 WeakPolarHBondContact O-CD 3.47Å; D288-R363 PolarHBondContact O-NE 3.24Å; H289-R363 WeakPolarHBondContact O-CA 3.09Å; L291-R363 HydrophobicContact CD1-CB 4.07Å; L307-R363 VanDerWaalsContact O-CD 3.23Å; L307-R363 WeakPolarHBondContact O-CD 3.45Å; L307-R363 PolarHBondContact O-NH1 3.46Å; N308-R363 PolarHBondContact O-N 3.11Å; V309-R363 WeakPolarHBondContact CA-O 3.36Å; V309-R363 HydrophobicContact CG2-CB 4.06Å; T310-R363 PolarHBondContact N-O 3Å; H311-R363 PolarHBondContact N-O 2.9Å
364	C	98.1	Very high	94.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.5	166	-173.7	0	0	0	0	110.2	H289 L291 H311 A357	H289-C364 PolarHBondContact O-N 2.88Å; L291-C364 PolarHBondContact N-O 3.19Å; H311-C364 HydrophobicContact CB-CB 3.92Å; H311-C364 CarbonylContact O-C 3.6Å; H311-C364 VanDerWaalsContact O-CA 3.26Å; H311-C364 WeakPolarHBondContact O-CA 3.44Å; A357-C364 HydrophobicContact CB-CB 3.83Å
365	L	98	Very high	94.4	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	116.9	166	173.7	63.9	0	0	0	109.6	A283 L291 N297 A298 L304 V309 H311 I312 L313 H367	A283-L365 HydrophobicContact CB-CD1 4.24Å; L291-L365 HydrophobicContact CB-CB 4.5Å; L291-L365 HydrophobicContact CB-CD1 3.79Å; N297-L365 HydrophobicContact CB-CD2 4.14Å; A298-L365 HydrophobicContact CB-CD2 4.14Å; L304-L365 HydrophobicContact CD2-CB 4.28Å; L304-L365 HydrophobicContact CD2-CD2 3.69Å; V309-L365 HydrophobicContact CG1-CB 4.09Å; H311-L365 PolarHBondContact O-N 3.37Å; I312-L365 WeakPolarHBondContact CA-O 3.45Å; L313-L365 PolarHBondContact N-O 2.86Å; L365-H367 HydrophobicContact CD2-CB 4.5Å; L365-H367 HydrophobicContact CG-CB 4.31Å
366	V	98.4	Very high	94.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.7	169	-168.2	0	0	0	0	108.6	V290 L291 L292 G293 L313 V315 I354 T378 V379	V290-V366 HydrophobicContact CG1-CG2 4.15Å; L291-V366 PolarHBondContact O-N 3.18Å; L292-V366 WeakPolarHBondContact CA-O 3.45Å; G293-V366 PolarHBondContact N-O 3.39Å; G293-V366 VanDerWaalsContact N-O 3.07Å; L313-V366 HydrophobicContact CB-CG1 4.34Å; L313-V366 HydrophobicContact CB-CG2 4.27Å; L313-V366 HydrophobicContact CD2-CG1 3.85Å; L313-V366 HydrophobicContact CD2-CG2 4.06Å; L313-V366 HydrophobicContact CG-CG1 4.09Å; V315-V366 HydrophobicContact CG2-CG1 4.05Å; I354-V366 HydrophobicContact CD1-CG2 3.88Å; I354-V366 HydrophobicContact CG1-CG2 4.19Å; V366-T378 HydrophobicContact CG1-CG2 4.29Å; V366-V379 HydrophobicContact CB-CG2 3.69Å; V366-V379 HydrophobicContact CG1-CG2 3.89Å; V366-V379 HydrophobicContact CG2-CG2 3.84Å
367	H	97.1	Very high	94.5	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	156.5	-178.1	80.2	96.2	0	0	0	113	G293 L313 N314 V315 L365	G293-H367 WeakPolarHBondContact O-CA 3.38Å; G293-H367 WeakPolarHBondContact O-CB 3.3Å; L313-H367 PolarHBondContact O-N 2.77Å; N314-H367 WeakPolarHBondContact CA-NE2 3.17Å; N314-H367 WeakPolarHBondContact CB-NE2 3.31Å; N314-H367 PolarHBondContact OD1-CE1 3.42Å; V315-H367 PolarHBondContact N-O 2.94Å; L365-H367 HydrophobicContact CD2-CB 4.5Å; L365-H367 HydrophobicContact CG-CB 4.31Å
368	C	94.6	Very high	94.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.			trans	-129	-160.2	160.2	74.3	0	0	0	0	107.9	T294 S295 V315 T316 G371 R374 S375	T294-C368 CarbonylContact C-O 3.46Å; S295-C368 PolarHBondContact N-O 3.42Å; V315-C368 WeakPolarHBondContact O-CB 3.45Å; T316-C368 VanDerWaalsContact CG2-CA 3.45Å; T316-C368 HydrophobicContact CG2-CB 3.89Å; C368-G371 PolarHBondContact SG-N 3.1Å; C368-R374 HydrophobicContact CB-CB 3.76Å; C368-S375 PolarHBondContact N-OG 3.15Å; C368-S375 PolarHBondContact SG-OG 2.68Å
369	K	86.8	Confident	94.7	Very high	71 Å²	71	32.6 Å²	32.6	31%	0.309	17%	0.173	S	C	.	.	S	Bend	trans	-58.8	-55.3	175.9	-170.7	168.7	-178.5	172.5	0	112.3	S295 E318 V319	S295-K369 PolarHBondContact N-O 2.93Å; S295-K369 PolarHBondContact OG-O 2.93Å; E318-K369 HydrophobicContact CG-CD 4.35Å; E318-K369 WeakPolarHBondContact OE1-CB 3.5Å; V319-K369 HydrophobicContact CG2-CB 4.38Å
370	M	82.9	Confident	94.9	Very high	111 Å²	111	25.5 Å²	25.5	55%	0.547	14%	0.137	S	C	.	.	S	Bend	trans	-107.8	-6.9	-173.1	-57.9	-56.6	-66.3	0	0	115.3	I372 R402	M370-I372 VanDerWaalsContact C-N 3.26Å; M370-I372 HydrophobicContact CB-CB 4.43Å; M370-I372 HydrophobicContact CB-CD1 3.97Å; M370-I372 HydrophobicContact CB-CG1 4.18Å; M370-I372 PolarHBondContact O-N 3.28Å; M370-R402 PolarHBondContact O-NH2 2.99Å
371	G	90.5	Very high	95.1	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	66.3	21.8	-177	0	0	0	0	0	115.3	G293 C368 R402	G293-G371 WeakPolarHBondContact O-CA 3.25Å; C368-G371 PolarHBondContact SG-N 3.1Å; G371-R402 PolarHBondContact O-NE 3.18Å
372	I	87.1	Confident	95.3	Very high	59 Å²	59	16.7 Å²	16.7	30%	0.303	8%	0.078	S	C	.	.	S	Bend	trans	-103.8	-50.7	-172.3	-73.7	171.5	0	0	0	112.6	M370 A376 C404 Q406	M370-I372 VanDerWaalsContact C-N 3.26Å; M370-I372 HydrophobicContact CB-CB 4.43Å; M370-I372 HydrophobicContact CB-CD1 3.97Å; M370-I372 HydrophobicContact CB-CG1 4.18Å; M370-I372 PolarHBondContact O-N 3.28Å; I372-A376 VanDerWaalsContact O-CB 3.28Å; I372-A376 WeakPolarHBondContact O-CB 3.33Å; I372-C404 HydrophobicContact CG1-CB 4.32Å; I372-C404 WeakPolarHBondContact CG2-O 3.47Å; I372-Q406 HydrophobicContact CG2-CB 4.04Å; I372-Q406 CarbonylContact O-C 3.59Å; I372-Q406 PolarHBondContact O-N 2.88Å
373	S	92.5	Very high	95.4	Very high	6 Å²	6	15.9 Å²	15.9	4%	0.042	7%	0.073	C	C	.	.	S	Bend	trans	-115.5	-80.2	-168.2	169.4	0	0	0	0	112.4	D337 S375 A376 S377 Q406 N408 F411	D337-S373 WeakPolarHBondContact OD1-CB 3.29Å; D337-S373 PolarHBondContact OD1-OG 3.41Å; S373-S375 PolarHBondContact O-N 2.87Å; S373-A376 PolarHBondContact O-N 2.9Å; S373-A376 VanDerWaalsContact O-N 3.15Å; S373-S377 WeakPolarHBondContact O-CB 3.49Å; S373-S377 PolarHBondContact O-N 3.16Å; S373-S377 PolarHBondContact O-OG 2.82Å; S373-Q406 WeakPolarHBondContact CB-O 3.44Å; S373-N408 PolarHBondContact OG-N 2.81Å; S373-F411 WeakPolarHBondContact OG-CD2 3.4Å
374	R	97.3	Very high	95.4	Very high	9 Å²	9	12.6 Å²	12.6	3%	0.034	6%	0.061	C	C	.	.	H	α-helix	trans	-45.7	-58.5	-177.4	-83.4	173.4	-73.7	176.3	2.7	115	V315 E318 I335 Y336 D337 C368 S377 T378 F411	V315-R374 HydrophobicContact CB-CB 4.38Å; V315-R374 HydrophobicContact CG1-CB 3.9Å; V315-R374 WeakPolarHBondContact O-CD 3.24Å; E318-R374 VanDerWaalsContact CD-NH1 3.34Å; E318-R374 IonicContact OE1-CZ 2.85Å; E318-R374 IonicContact OE1-NH1 3.28Å; E318-R374 PolarHBondContact OE1-NH1 3.39Å; E318-R374 VanDerWaalsContact OE1-NH1 3.12Å; E318-R374 IonicContact OE1-NH2 2.74Å; E318-R374 PolarHBondContact OE1-NH2 2.7Å; E318-R374 IonicContact OE2-CZ 3.36Å; E318-R374 IonicContact OE2-NH1 3.63Å; E318-R374 PolarHBondContact OE2-NH1 3.35Å; E318-R374 IonicContact OE2-NH2 2.7Å; I335-R374 HydrophobicContact CD1-CG 4.05Å; I335-R374 HydrophobicContact CG1-CG 4.39Å; I335-R374 PolarHBondContact O-NH1 2.99Å; Y336-R374 WeakPolarHBondContact O-CD 3.46Å; D337-R374 HydrophobicContact CB-CG 4.32Å; D337-R374 VanDerWaalsContact CG-NE 3.31Å; D337-R374 WeakPolarHBondContact OD2-CG 3.45Å; D337-R374 IonicContact OD2-CZ 2.66Å; D337-R374 PolarHBondContact OD2-N 3.42Å; D337-R374 IonicContact OD2-NE 2.65Å; D337-R374 PolarHBondContact OD2-NE 3.45Å; D337-R374 IonicContact OD2-NH2 2.76Å; C368-R374 HydrophobicContact CB-CB 3.76Å; R374-S377 PolarHBondContact O-N 2.95Å; R374-T378 PolarHBondContact O-N 2.85Å; R374-T378 PolarHBondContact O-OG1 3.24Å; R374-F411 HydrophobicContact CB-CE2 4.44Å; R374-F411 HydrophobicContact CG-CE2 3.56Å; R374-F411 HydrophobicContact CG-CZ 3.8Å
375	S	97.6	Very high	95.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-68.4	-36.1	-178.5	50.9	0	0	0	0	113.1	L292 C368 S373 T378 V379	L292-S375 WeakPolarHBondContact CD1-OG 3.25Å; C368-S375 PolarHBondContact N-OG 3.15Å; C368-S375 PolarHBondContact SG-OG 2.68Å; S373-S375 PolarHBondContact O-N 2.87Å; S375-T378 PolarHBondContact O-N 3.01Å; S375-V379 WeakPolarHBondContact O-CG2 3.07Å; S375-V379 PolarHBondContact O-N 3.03Å
376	A	96.4	Very high	95.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.8	-41.1	177.4	0	0	0	0	0	111.5	L292 I372 S373 T378 V379 I380 V405	L292-A376 HydrophobicContact CD1-CB 4.41Å; L292-A376 HydrophobicContact CD2-CB 4.01Å; I372-A376 VanDerWaalsContact O-CB 3.28Å; I372-A376 WeakPolarHBondContact O-CB 3.33Å; S373-A376 PolarHBondContact O-N 2.9Å; S373-A376 VanDerWaalsContact O-N 3.15Å; A376-T378 VanDerWaalsContact C-N 3.32Å; A376-T378 PolarHBondContact O-N 2.84Å; A376-V379 PolarHBondContact O-N 2.76Å; A376-V379 VanDerWaalsContact O-N 3.17Å; A376-I380 WeakPolarHBondContact O-CB 3.22Å; A376-I380 WeakPolarHBondContact O-CD1 3.46Å; A376-I380 WeakPolarHBondContact O-CG1 3.25Å; A376-I380 PolarHBondContact O-N 3.46Å; A376-V405 HydrophobicContact CB-CB 4.24Å; A376-V405 HydrophobicContact CB-CG1 3.63Å; A376-V405 HydrophobicContact CB-CG2 3.75Å
377	S	98.3	Very high	95.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-56.4	-46.5	174.1	-53.2	0	0	0	0	111.2	S373 R374 V379 I380 A381 P407 F411	S373-S377 WeakPolarHBondContact O-CB 3.49Å; S373-S377 PolarHBondContact O-N 3.16Å; S373-S377 PolarHBondContact O-OG 2.82Å; R374-S377 PolarHBondContact O-N 2.95Å; S377-V379 PolarHBondContact O-N 2.87Å; S377-I380 PolarHBondContact O-N 2.6Å; S377-A381 WeakPolarHBondContact O-CB 3.36Å; S377-A381 PolarHBondContact O-N 2.85Å; S377-P407 WeakPolarHBondContact OG-CB 3.18Å; S377-F411 WeakPolarHBondContact OG-CB 3.34Å
378	T	98.6	Very high	95	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-37.3	176.2	-63	0	0	0	0	113.3	L313 W347 T350 V366 R374 S375 A376 Y382	L313-T378 HydrophobicContact CD2-CG2 3.92Å; W347-T378 PolarHBondContact NE1-OG1 3.38Å; T350-T378 HydrophobicContact CG2-CG2 3.88Å; T350-T378 WeakPolarHBondContact OG1-CG2 3.38Å; V366-T378 HydrophobicContact CG1-CG2 4.29Å; R374-T378 PolarHBondContact O-N 2.85Å; R374-T378 PolarHBondContact O-OG1 3.24Å; S375-T378 PolarHBondContact O-N 3.01Å; A376-T378 VanDerWaalsContact C-N 3.32Å; A376-T378 PolarHBondContact O-N 2.84Å; T378-Y382 WeakPolarHBondContact O-CB 3.34Å; T378-Y382 PolarHBondContact O-N 3.27Å
379	V	98.5	Very high	95.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-71.8	-34	174.5	173.4	0	0	0	0	112.3	I286 V290 L292 V366 S375 A376 S377 Y382 A383 V398	I286-V379 HydrophobicContact CB-CG1 4.21Å; I286-V379 HydrophobicContact CG1-CG1 4.12Å; I286-V379 HydrophobicContact CG2-CG1 3.79Å; V290-V379 HydrophobicContact CG1-CG1 4.42Å; V290-V379 HydrophobicContact CG1-CG2 4.22Å; L292-V379 HydrophobicContact CB-CG2 4.49Å; L292-V379 HydrophobicContact CD1-CG2 4.15Å; V366-V379 HydrophobicContact CB-CG2 3.69Å; V366-V379 HydrophobicContact CG1-CG2 3.89Å; V366-V379 HydrophobicContact CG2-CG2 3.84Å; S375-V379 WeakPolarHBondContact O-CG2 3.07Å; S375-V379 PolarHBondContact O-N 3.03Å; A376-V379 PolarHBondContact O-N 2.76Å; A376-V379 VanDerWaalsContact O-N 3.17Å; S377-V379 PolarHBondContact O-N 2.87Å; V379-Y382 WeakPolarHBondContact O-CB 3.13Å; V379-Y382 PolarHBondContact O-N 2.86Å; V379-A383 WeakPolarHBondContact O-CB 3.4Å; V379-A383 PolarHBondContact O-N 2.73Å; V379-V398 HydrophobicContact CG1-CG2 4.11Å
380	I	98.6	Very high	95.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66.5	-47.2	173.8	-67.9	159	0	0	0	109.9	A376 S377 Y382 A383 M384 L391 A394 L395 V398 V405 P407 L415	A376-I380 WeakPolarHBondContact O-CB 3.22Å; A376-I380 WeakPolarHBondContact O-CD1 3.46Å; A376-I380 WeakPolarHBondContact O-CG1 3.25Å; A376-I380 PolarHBondContact O-N 3.46Å; S377-I380 PolarHBondContact O-N 2.6Å; I380-Y382 VanDerWaalsContact C-N 3.31Å; I380-Y382 PolarHBondContact O-N 3.24Å; I380-A383 PolarHBondContact O-N 2.93Å; I380-M384 HydrophobicContact CG2-CG 4.48Å; I380-M384 HydrophobicContact CG2-SD 3.92Å; I380-M384 VanDerWaalsContact O-CG 3.26Å; I380-M384 WeakPolarHBondContact O-CG 3.47Å; I380-M384 PolarHBondContact O-N 2.94Å; I380-L391 HydrophobicContact CG2-CD1 3.55Å; I380-A394 HydrophobicContact CG2-CB 3.96Å; I380-L395 HydrophobicContact CD1-CD1 3.6Å; I380-V398 HydrophobicContact CG1-CB 4.13Å; I380-V398 HydrophobicContact CG1-CG1 4.31Å; I380-V398 HydrophobicContact CG1-CG2 3.96Å; I380-V405 HydrophobicContact CD1-CG1 4.19Å; I380-P407 HydrophobicContact CD1-CG 3.84Å; I380-L415 HydrophobicContact CB-CD1 4.46Å; I380-L415 HydrophobicContact CB-CD2 4.42Å; I380-L415 HydrophobicContact CG2-CD1 4.14Å; I380-L415 HydrophobicContact CG2-CD2 4.08Å
381	A	98.5	Very high	96.4	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-59.3	-41.3	174.1	0	0	0	0	0	112.1	W347 S377 M384 K385 L415 Y418	W347-A381 HydrophobicContact CB-CB 4.22Å; W347-A381 HydrophobicContact CD2-CB 3.44Å; W347-A381 VanDerWaalsContact CD2-CB 3.44Å; W347-A381 HydrophobicContact CE3-CB 3.94Å; W347-A381 HydrophobicContact CG-CB 3.56Å; W347-A381 HydrophobicContact CZ2-CB 4.29Å; S377-A381 WeakPolarHBondContact O-CB 3.36Å; S377-A381 PolarHBondContact O-N 2.85Å; A381-M384 PolarHBondContact O-N 3.48Å; A381-K385 PolarHBondContact O-N 2.95Å; A381-K385 VanDerWaalsContact O-N 3.11Å; A381-L415 HydrophobicContact CB-CD2 3.87Å; A381-Y418 HydrophobicContact CB-CD1 4.03Å; A381-Y418 HydrophobicContact CB-CE1 3.85Å
382	Y	98.5	Very high	96.7	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-57.6	-50.9	172.5	177.6	-93.9	0	0	0	111.8	F287 H289 V290 H351 I354 N355 T378 V379 I380 M384 K385 E386	F287-Y382 HydrophobicContact CD2-CD1 4.25Å; F287-Y382 HydrophobicContact CD2-CE1 4.08Å; F287-Y382 AromaticContact CE2-CD1 3.98Å; F287-Y382 HydrophobicContact CE2-CD1 3.98Å; F287-Y382 HydrophobicContact CE2-CE1 4.11Å; H289-Y382 AromaticContact NE2-CE1 3.76Å; H289-Y382 AromaticContact NE2-CZ 3.56Å; H289-Y382 PolarHBondContact NE2-OH 2.98Å; V290-Y382 HydrophobicContact CG2-CD1 4.39Å; V290-Y382 HydrophobicContact CG2-CE1 3.99Å; H351-Y382 HydrophobicContact CB-CD2 4.41Å; H351-Y382 AromaticContact CD2-CD2 3.47Å; H351-Y382 VanDerWaalsContact CD2-CD2 3.47Å; H351-Y382 WeakPolarHBondContact CD2-CD2 3.36Å; H351-Y382 AromaticContact CD2-CE2 3.53Å; H351-Y382 AromaticContact NE2-CE2 3.98Å; I354-Y382 HydrophobicContact CB-CD2 3.84Å; I354-Y382 HydrophobicContact CB-CE2 3.71Å; I354-Y382 HydrophobicContact CD1-CD2 3.77Å; I354-Y382 HydrophobicContact CD1-CG 3.96Å; I354-Y382 HydrophobicContact CG1-CD2 4.42Å; I354-Y382 HydrophobicContact CG2-CD1 4.33Å; I354-Y382 HydrophobicContact CG2-CD2 3.74Å; I354-Y382 HydrophobicContact CG2-CE1 4.01Å; I354-Y382 HydrophobicContact CG2-CE2 3.38Å; I354-Y382 HydrophobicContact CG2-CG 4.22Å; N355-Y382 WeakPolarHBondContact OD1-CE2 3.5Å; N355-Y382 PolarHBondContact OD1-OH 2.94Å; T378-Y382 WeakPolarHBondContact O-CB 3.34Å; T378-Y382 PolarHBondContact O-N 3.27Å; V379-Y382 WeakPolarHBondContact O-CB 3.13Å; V379-Y382 PolarHBondContact O-N 2.86Å; I380-Y382 VanDerWaalsContact C-N 3.31Å; I380-Y382 PolarHBondContact O-N 3.24Å; Y382-M384 PolarHBondContact O-N 2.66Å; Y382-K385 PolarHBondContact O-N 3.3Å; Y382-E386 HydrophobicContact CD1-CB 4.47Å; Y382-E386 HydrophobicContact CE1-CB 3.97Å; Y382-E386 HydrophobicContact CE1-CG 4.11Å; Y382-E386 HydrophobicContact CE2-CB 4.3Å; Y382-E386 HydrophobicContact CE2-CG 4.48Å; Y382-E386 VanDerWaalsContact O-CB 3.27Å; Y382-E386 WeakPolarHBondContact O-CB 3.19Å; Y382-E386 PolarHBondContact O-N 3.44Å; Y382-E386 WeakPolarHBondContact OH-CG 3.45Å
383	A	98.2	Very high	97.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.3	-40.3	179.4	0	0	0	0	0	112.7	F287 V379 I380 K385 N387 W389 A394	F287-A383 HydrophobicContact CE2-CB 3.93Å; F287-A383 HydrophobicContact CZ-CB 3.77Å; V379-A383 WeakPolarHBondContact O-CB 3.4Å; V379-A383 PolarHBondContact O-N 2.73Å; I380-A383 PolarHBondContact O-N 2.93Å; A383-K385 PolarHBondContact O-N 3.44Å; A383-N387 VanDerWaalsContact O-CB 3.32Å; A383-N387 WeakPolarHBondContact O-CB 3.27Å; A383-N387 PolarHBondContact O-N 3.32Å; A383-N387 PolarHBondContact O-OD1 2.91Å; A383-W389 HydrophobicContact CB-CE3 3.98Å; A383-W389 HydrophobicContact CB-CZ3 4.13Å; A383-A394 HydrophobicContact CB-CB 4.13Å
384	M	98.3	Very high	97.5	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-58.7	-47.2	175.4	-69.8	164.9	61.2	0	0	111.7	I380 A381 Y382 N388 W389 L391 A394 L415 Y418 Q419 L422	I380-M384 HydrophobicContact CG2-CG 4.48Å; I380-M384 HydrophobicContact CG2-SD 3.92Å; I380-M384 VanDerWaalsContact O-CG 3.26Å; I380-M384 WeakPolarHBondContact O-CG 3.47Å; I380-M384 PolarHBondContact O-N 2.94Å; A381-M384 PolarHBondContact O-N 3.48Å; Y382-M384 PolarHBondContact O-N 2.66Å; M384-N388 CarbonylContact O-C 3.51Å; M384-N388 VanDerWaalsContact O-CA 3.22Å; M384-N388 WeakPolarHBondContact O-CA 3.47Å; M384-N388 PolarHBondContact O-N 3.13Å; M384-N388 VanDerWaalsContact O-N 3.16Å; M384-W389 WeakPolarHBondContact CA-O 3.41Å; M384-W389 WeakPolarHBondContact CB-O 3.47Å; M384-W389 PolarHBondContact O-N 2.93Å; M384-W389 VanDerWaalsContact O-N 3.16Å; M384-L391 HydrophobicContact CE-CB 4.18Å; M384-L391 HydrophobicContact SD-CB 4.16Å; M384-L391 HydrophobicContact SD-CD1 3.83Å; M384-A394 HydrophobicContact CG-CB 3.57Å; M384-L415 HydrophobicContact SD-CD2 4.09Å; M384-Y418 HydrophobicContact CE-CD1 4.22Å; M384-Q419 HydrophobicContact CE-CB 3.61Å; M384-Q419 HydrophobicContact CE-CG 4.34Å; M384-L422 HydrophobicContact CB-CD1 3.81Å; M384-L422 HydrophobicContact CE-CD1 4.42Å
385	K	97.1	Very high	97.4	Very high	45 Å²	45	33 Å²	33	20%	0.196	16%	0.162	C	C	.	.	H	α-helix	trans	-74.5	-44.3	-179.3	-178.4	175.6	170.3	-163.3	0	113.2	E348 H351 A381 Y382 A383 Y418 L422	E348-K385 IonicContact OE1-NZ 3.38Å; E348-K385 PolarHBondContact OE1-NZ 3.45Å; E348-K385 IonicContact OE2-NZ 2.68Å; E348-K385 PolarHBondContact OE2-NZ 3.45Å; H351-K385 HydrophobicContact CB-CD 4.3Å; H351-K385 WeakPolarHBondContact ND1-CE 3.43Å; H351-K385 PolarHBondContact ND1-NZ 3.05Å; A381-K385 PolarHBondContact O-N 2.95Å; A381-K385 VanDerWaalsContact O-N 3.11Å; Y382-K385 PolarHBondContact O-N 3.3Å; A383-K385 PolarHBondContact O-N 3.44Å; K385-Y418 HydrophobicContact CB-CE1 4.42Å; K385-Y418 WeakPolarHBondContact CD-OH 3.4Å; K385-L422 HydrophobicContact CB-CD1 4.17Å; K385-L422 HydrophobicContact CB-CD2 3.99Å; K385-L422 HydrophobicContact CD-CD2 4.39Å; K385-L422 HydrophobicContact CG-CD2 3.96Å
386	E	96.2	Very high	97.4	Very high	54 Å²	54	36.1 Å²	36.1	25%	0.252	18%	0.184	S	C	.	.	H	α-helix	trans	-75.1	-37.4	-174.1	-170	71.3	-173.1	0	0	112.4	H351 N355 K358 Y382	H351-E386 IonicContact CD2-OE2 3.12Å; H351-E386 IonicContact CE1-OE2 3.28Å; H351-E386 PolarHBondContact CE1-OE2 3.36Å; H351-E386 IonicContact NE2-OE2 2.71Å; H351-E386 PolarHBondContact NE2-OE2 3.09Å; N355-E386 PolarHBondContact ND2-OE2 2.66Å; K358-E386 IonicContact NZ-OE1 3.59Å; K358-E386 PolarHBondContact NZ-OE1 3.41Å; Y382-E386 HydrophobicContact CD1-CB 4.47Å; Y382-E386 HydrophobicContact CE1-CB 3.97Å; Y382-E386 HydrophobicContact CE1-CG 4.11Å; Y382-E386 HydrophobicContact CE2-CB 4.3Å; Y382-E386 HydrophobicContact CE2-CG 4.48Å; Y382-E386 VanDerWaalsContact O-CB 3.27Å; Y382-E386 WeakPolarHBondContact O-CB 3.19Å; Y382-E386 PolarHBondContact O-N 3.44Å; Y382-E386 WeakPolarHBondContact OH-CG 3.45Å
387	N	95.2	Very high	97.5	Very high	61 Å²	61	39 Å²	39	33%	0.326	20%	0.196	S	C	.	.	H	α-helix	trans	-101.9	0.1	-177.1	-57.6	96.5	0	0	0	113.8	F287 A383 W389	F287-N387 VanDerWaalsContact CZ-OD1 3.3Å; F287-N387 WeakPolarHBondContact CZ-OD1 3.47Å; A383-N387 VanDerWaalsContact O-CB 3.32Å; A383-N387 WeakPolarHBondContact O-CB 3.27Å; A383-N387 PolarHBondContact O-N 3.32Å; A383-N387 PolarHBondContact O-OD1 2.91Å; N387-W389 VanDerWaalsContact C-N 3.28Å; N387-W389 HydrophobicContact CB-CD2 3.56Å; N387-W389 VanDerWaalsContact CB-CE2 3.45Å; N387-W389 HydrophobicContact CB-CE3 4.1Å; N387-W389 HydrophobicContact CB-CG 3.81Å; N387-W389 HydrophobicContact CB-CH2 4.38Å; N387-W389 HydrophobicContact CB-CZ2 3.9Å; N387-W389 HydrophobicContact CB-CZ3 4.48Å; N387-W389 PolarHBondContact O-N 3.02Å
388	N	94.5	Very high	97.3	Very high	139 Å²	139	39 Å²	39	74%	0.743	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	43.1	-171.3	-61.7	-82.5	0	0	0	112.6	M384	M384-N388 CarbonylContact O-C 3.51Å; M384-N388 VanDerWaalsContact O-CA 3.22Å; M384-N388 WeakPolarHBondContact O-CA 3.47Å; M384-N388 PolarHBondContact O-N 3.13Å; M384-N388 VanDerWaalsContact O-N 3.16Å
389	W	97.2	Very high	96.8	Very high	68 Å²	68	43.1 Å²	43.1	26%	0.258	21%	0.213	S	C	.	.			trans	-92.9	146.6	179.1	-69.7	-12	0	0	0	112.1	F287 A383 M384 N387 T393 A394 Y397	F287-W389 AromaticContact CE1-CH2 3.98Å; F287-W389 HydrophobicContact CE1-CH2 3.98Å; F287-W389 HydrophobicContact CE1-CZ3 4.19Å; F287-W389 HydrophobicContact CZ-CH2 4.21Å; F287-W389 AromaticContact CZ-CZ3 3.94Å; F287-W389 HydrophobicContact CZ-CZ3 3.94Å; A383-W389 HydrophobicContact CB-CE3 3.98Å; A383-W389 HydrophobicContact CB-CZ3 4.13Å; M384-W389 WeakPolarHBondContact CA-O 3.41Å; M384-W389 WeakPolarHBondContact CB-O 3.47Å; M384-W389 PolarHBondContact O-N 2.93Å; M384-W389 VanDerWaalsContact O-N 3.16Å; N387-W389 VanDerWaalsContact C-N 3.28Å; N387-W389 HydrophobicContact CB-CD2 3.56Å; N387-W389 VanDerWaalsContact CB-CE2 3.45Å; N387-W389 HydrophobicContact CB-CE3 4.1Å; N387-W389 HydrophobicContact CB-CG 3.81Å; N387-W389 HydrophobicContact CB-CH2 4.38Å; N387-W389 HydrophobicContact CB-CZ2 3.9Å; N387-W389 HydrophobicContact CB-CZ3 4.48Å; N387-W389 PolarHBondContact O-N 3.02Å; W389-T393 HydrophobicContact CB-CG2 4.4Å; W389-T393 HydrophobicContact CD2-CG2 4.02Å; W389-T393 HydrophobicContact CE3-CG2 4.44Å; W389-T393 HydrophobicContact CG-CG2 4.01Å; W389-A394 HydrophobicContact CB-CB 4.28Å; W389-A394 HydrophobicContact CE3-CB 4.26Å; W389-Y397 AromaticContact CH2-CD1 3.98Å; W389-Y397 HydrophobicContact CH2-CD1 3.98Å; W389-Y397 AromaticContact CH2-CD2 3.45Å; W389-Y397 HydrophobicContact CH2-CD2 3.45Å; W389-Y397 VanDerWaalsContact CH2-CD2 3.45Å; W389-Y397 HydrophobicContact CH2-CE1 4.05Å; W389-Y397 AromaticContact CH2-CE2 3.53Å; W389-Y397 HydrophobicContact CH2-CE2 3.53Å; W389-Y397 AromaticContact CH2-CG 3.68Å; W389-Y397 HydrophobicContact CH2-CG 3.68Å; W389-Y397 AromaticContact CH2-CZ 3.82Å; W389-Y397 HydrophobicContact CZ2-CD2 4.38Å; W389-Y397 HydrophobicContact CZ2-CE2 4.43Å; W389-Y397 AromaticContact CZ3-CD1 3.66Å; W389-Y397 HydrophobicContact CZ3-CD1 3.66Å; W389-Y397 AromaticContact CZ3-CD2 3.78Å; W389-Y397 HydrophobicContact CZ3-CD2 3.78Å; W389-Y397 HydrophobicContact CZ3-CE1 4.1Å; W389-Y397 HydrophobicContact CZ3-CE2 4.2Å; W389-Y397 AromaticContact CZ3-CG 3.48Å; W389-Y397 HydrophobicContact CZ3-CG 3.48Å; W389-Y397 VanDerWaalsContact CZ3-CG 3.48Å
390	D	96.9	Very high	96.4	Very high	61 Å²	61	47 Å²	47	33%	0.326	25%	0.245	S	C	.	.			trans	-70.1	160.7	166.2	85.3	-53.2	0	0	0	110.7	K392 T393 A394	D390-K392 PolarHBondContact O-N 2.81Å; D390-K392 WeakPolarHBondContact OD2-CB 3.39Å; D390-K392 PolarHBondContact OD2-N 3.12Å; D390-T393 PolarHBondContact O-N 2.83Å; D390-T393 WeakPolarHBondContact OD1-CB 3.25Å; D390-T393 PolarHBondContact OD1-N 3.2Å; D390-T393 PolarHBondContact OD1-OG1 3.39Å; D390-A394 PolarHBondContact O-N 3.35Å
391	L	98.1	Very high	96	Very high	4 Å²	4	52 Å²	52	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-57.6	-34.5	-179.3	176.2	55.1	0	0	0	112	I380 M384 L395 M412 L415 Q419	I380-L391 HydrophobicContact CG2-CD1 3.55Å; M384-L391 HydrophobicContact CE-CB 4.18Å; M384-L391 HydrophobicContact SD-CB 4.16Å; M384-L391 HydrophobicContact SD-CD1 3.83Å; L391-L395 HydrophobicContact CD1-CB 4.47Å; L391-L395 WeakPolarHBondContact O-CB 3.47Å; L391-L395 PolarHBondContact O-N 3.42Å; L391-M412 HydrophobicContact CD2-CE 4.06Å; L391-L415 HydrophobicContact CD1-CB 3.79Å; L391-L415 HydrophobicContact CD1-CD1 4.01Å; L391-L415 HydrophobicContact CD1-CD2 4.48Å; L391-L415 HydrophobicContact CD1-CG 4.32Å; L391-L415 HydrophobicContact CD2-CB 3.8Å; L391-L415 HydrophobicContact CG-CB 4.45Å; L391-Q419 VanDerWaalsContact CB-OE1 3.23Å
392	K	97.5	Very high	95.4	Very high	158 Å²	158	52.3 Å²	52.3	69%	0.687	27%	0.265	S	S	*	.	H	α-helix	trans	-67.1	-45.4	-179.9	-166.3	-175.6	175.2	-175.1	0	111.6	D390 S396	D390-K392 PolarHBondContact O-N 2.81Å; D390-K392 WeakPolarHBondContact OD2-CB 3.39Å; D390-K392 PolarHBondContact OD2-N 3.12Å; K392-S396 VanDerWaalsContact O-CB 3.25Å; K392-S396 WeakPolarHBondContact O-CB 3.17Å; K392-S396 PolarHBondContact O-N 3.21Å; K392-S396 PolarHBondContact O-OG 2.64Å
393	T	97.8	Very high	94.5	Very high	66 Å²	66	57.7 Å²	57.7	41%	0.405	30%	0.3	S	S	.	.	H	α-helix	trans	-66.5	-46.7	177.5	-58.4	0	0	0	0	110.9	W389 D390 S396 Y397	W389-T393 HydrophobicContact CB-CG2 4.4Å; W389-T393 HydrophobicContact CD2-CG2 4.02Å; W389-T393 HydrophobicContact CE3-CG2 4.44Å; W389-T393 HydrophobicContact CG-CG2 4.01Å; D390-T393 PolarHBondContact O-N 2.83Å; D390-T393 WeakPolarHBondContact OD1-CB 3.25Å; D390-T393 PolarHBondContact OD1-N 3.2Å; D390-T393 PolarHBondContact OD1-OG1 3.39Å; T393-S396 PolarHBondContact O-N 3.25Å; T393-Y397 WeakPolarHBondContact O-CB 3.36Å; T393-Y397 PolarHBondContact O-N 3.45Å
394	A	98.3	Very high	93.7	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.8	-48.7	179.5	0	0	0	0	0	112.6	I380 A383 M384 W389 D390 S396 Y397 V398	I380-A394 HydrophobicContact CG2-CB 3.96Å; A383-A394 HydrophobicContact CB-CB 4.13Å; M384-A394 HydrophobicContact CG-CB 3.57Å; W389-A394 HydrophobicContact CB-CB 4.28Å; W389-A394 HydrophobicContact CE3-CB 4.26Å; D390-A394 PolarHBondContact O-N 3.35Å; A394-S396 VanDerWaalsContact C-N 3.31Å; A394-S396 PolarHBondContact O-N 3.03Å; A394-Y397 PolarHBondContact O-N 2.91Å; A394-V398 WeakPolarHBondContact O-CG2 3.49Å; A394-V398 PolarHBondContact O-N 2.82Å; A394-V398 VanDerWaalsContact O-N 3.07Å
395	L	96.2	Very high	93.2	Very high	31 Å²	31	60.6 Å²	60.6	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-60	-40.5	175.6	177.2	62.2	0	0	0	111.8	I380 L391 K399 V405 M412	I380-L395 HydrophobicContact CD1-CD1 3.6Å; L391-L395 HydrophobicContact CD1-CB 4.47Å; L391-L395 WeakPolarHBondContact O-CB 3.47Å; L391-L395 PolarHBondContact O-N 3.42Å; L395-K399 HydrophobicContact CD1-CD 4.12Å; L395-K399 HydrophobicContact CD1-CG 4.23Å; L395-K399 HydrophobicContact CG-CD 4.25Å; L395-K399 VanDerWaalsContact O-CB 3.3Å; L395-K399 WeakPolarHBondContact O-CB 3.5Å; L395-K399 WeakPolarHBondContact O-CG 3.46Å; L395-K399 PolarHBondContact O-N 3.04Å; L395-V405 HydrophobicContact CD1-CG1 4.32Å; L395-M412 HydrophobicContact CD2-CE 4.3Å
396	S	96.5	Very high	92.7	Very high	66 Å²	66	65.1 Å²	65.1	46%	0.462	34%	0.342	S	S	.	.	H	α-helix	trans	-68.4	-42.1	178.8	-57.2	0	0	0	0	112.2	K392 T393 A394 V398 K399 A400	K392-S396 VanDerWaalsContact O-CB 3.25Å; K392-S396 WeakPolarHBondContact O-CB 3.17Å; K392-S396 PolarHBondContact O-N 3.21Å; K392-S396 PolarHBondContact O-OG 2.64Å; T393-S396 PolarHBondContact O-N 3.25Å; A394-S396 VanDerWaalsContact C-N 3.31Å; A394-S396 PolarHBondContact O-N 3.03Å; S396-V398 PolarHBondContact O-N 3.49Å; S396-K399 PolarHBondContact O-N 3.43Å; S396-A400 VanDerWaalsContact O-CB 3.32Å; S396-A400 WeakPolarHBondContact O-CB 3.13Å; S396-A400 PolarHBondContact O-N 2.81Å
397	Y	97.8	Very high	92.5	Very high	62 Å²	62	63 Å²	63	24%	0.243	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-39.7	178.6	-178.5	-85.8	0	0	0	112.5	I286 F287 W389 T393 A394 R401	I286-Y397 HydrophobicContact CG2-CD1 4.35Å; I286-Y397 HydrophobicContact CG2-CE1 4.09Å; I286-Y397 WeakPolarHBondContact O-CE1 3.4Å; I286-Y397 PolarHBondContact O-OH 2.85Å; F287-Y397 HydrophobicContact CD1-CE1 4.01Å; F287-Y397 HydrophobicContact CE1-CD1 4.35Å; F287-Y397 AromaticContact CE1-CE1 3.48Å; F287-Y397 HydrophobicContact CE1-CE1 3.48Å; F287-Y397 VanDerWaalsContact CE1-CE1 3.48Å; F287-Y397 AromaticContact CE1-CZ 3.7Å; F287-Y397 HydrophobicContact CZ-CD1 4.34Å; F287-Y397 AromaticContact CZ-CE1 3.84Å; F287-Y397 HydrophobicContact CZ-CE1 3.84Å; W389-Y397 AromaticContact CH2-CD1 3.98Å; W389-Y397 HydrophobicContact CH2-CD1 3.98Å; W389-Y397 AromaticContact CH2-CD2 3.45Å; W389-Y397 HydrophobicContact CH2-CD2 3.45Å; W389-Y397 VanDerWaalsContact CH2-CD2 3.45Å; W389-Y397 HydrophobicContact CH2-CE1 4.05Å; W389-Y397 AromaticContact CH2-CE2 3.53Å; W389-Y397 HydrophobicContact CH2-CE2 3.53Å; W389-Y397 AromaticContact CH2-CG 3.68Å; W389-Y397 HydrophobicContact CH2-CG 3.68Å; W389-Y397 AromaticContact CH2-CZ 3.82Å; W389-Y397 HydrophobicContact CZ2-CD2 4.38Å; W389-Y397 HydrophobicContact CZ2-CE2 4.43Å; W389-Y397 AromaticContact CZ3-CD1 3.66Å; W389-Y397 HydrophobicContact CZ3-CD1 3.66Å; W389-Y397 AromaticContact CZ3-CD2 3.78Å; W389-Y397 HydrophobicContact CZ3-CD2 3.78Å; W389-Y397 HydrophobicContact CZ3-CE1 4.1Å; W389-Y397 HydrophobicContact CZ3-CE2 4.2Å; W389-Y397 AromaticContact CZ3-CG 3.48Å; W389-Y397 HydrophobicContact CZ3-CG 3.48Å; W389-Y397 VanDerWaalsContact CZ3-CG 3.48Å; T393-Y397 WeakPolarHBondContact O-CB 3.36Å; T393-Y397 PolarHBondContact O-N 3.45Å; A394-Y397 PolarHBondContact O-N 2.91Å; Y397-R401 VanDerWaalsContact CE2-NH1 3.29Å; Y397-R401 PolarHBondContact O-NH1 3.18Å; Y397-R401 PolarHBondContact OH-NH2 3.07Å
398	V	95.3	Very high	92.3	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-72.5	-46.1	176.6	176.1	0	0	0	0	110.7	I286 L292 V379 I380 A394 S396 A400 R401 R402 V405	I286-V398 HydrophobicContact CD1-CG1 4.37Å; I286-V398 HydrophobicContact CG2-CG2 4.04Å; L292-V398 HydrophobicContact CD2-CG1 3.86Å; V379-V398 HydrophobicContact CG1-CG2 4.11Å; I380-V398 HydrophobicContact CG1-CB 4.13Å; I380-V398 HydrophobicContact CG1-CG1 4.31Å; I380-V398 HydrophobicContact CG1-CG2 3.96Å; A394-V398 WeakPolarHBondContact O-CG2 3.49Å; A394-V398 PolarHBondContact O-N 2.82Å; A394-V398 VanDerWaalsContact O-N 3.07Å; S396-V398 PolarHBondContact O-N 3.49Å; V398-A400 VanDerWaalsContact C-N 3.3Å; V398-A400 PolarHBondContact O-N 2.98Å; V398-R401 PolarHBondContact O-N 2.88Å; V398-R402 PolarHBondContact O-N 3.16Å; V398-V405 HydrophobicContact CG1-CG1 4.13Å; V398-V405 HydrophobicContact CG1-CG2 4.05Å
399	K	88.5	Confident	92.3	Very high	86 Å²	86	58 Å²	58	37%	0.374	31%	0.31	S	S	.	.	H	α-helix	trans	-58.5	-37.9	174.9	-83.4	-175.7	161.9	-175.3	0	113.3	L395 S396 R401 R402 P403 V405	L395-K399 HydrophobicContact CD1-CD 4.12Å; L395-K399 HydrophobicContact CD1-CG 4.23Å; L395-K399 HydrophobicContact CG-CD 4.25Å; L395-K399 VanDerWaalsContact O-CB 3.3Å; L395-K399 WeakPolarHBondContact O-CB 3.5Å; L395-K399 WeakPolarHBondContact O-CG 3.46Å; L395-K399 PolarHBondContact O-N 3.04Å; S396-K399 PolarHBondContact O-N 3.43Å; K399-R401 PolarHBondContact O-N 3.09Å; K399-R401 VanDerWaalsContact O-N 3.13Å; K399-R402 CarbonylContact O-C 3.54Å; K399-R402 VanDerWaalsContact O-C 3.28Å; K399-R402 PolarHBondContact O-N 2.95Å; K399-P403 WeakPolarHBondContact O-CA 3.44Å; K399-V405 WeakPolarHBondContact CE-O 3.36Å; K399-V405 HydrophobicContact CG-CB 4.1Å; K399-V405 HydrophobicContact CG-CG1 4.13Å
400	A	88.5	Confident	92.2	Very high	81 Å²	81	55 Å²	55	67%	0.669	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.8	176.2	0	0	0	0	0	114.1	S396 V398	S396-A400 VanDerWaalsContact O-CB 3.32Å; S396-A400 WeakPolarHBondContact O-CB 3.13Å; S396-A400 PolarHBondContact O-N 2.81Å; V398-A400 VanDerWaalsContact C-N 3.3Å; V398-A400 PolarHBondContact O-N 2.98Å
401	R	90.5	Very high	92.2	Very high	105 Å²	105	52 Å²	52	40%	0.396	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-23.1	178.5	-67.5	172	168.5	57.9	10	113.6	V285 I286 Y397 V398 K399	V285-R401 WeakPolarHBondContact O-CD 3.22Å; I286-R401 HydrophobicContact CD1-CB 3.71Å; I286-R401 PolarHBondContact O-NE 2.94Å; Y397-R401 VanDerWaalsContact CE2-NH1 3.29Å; Y397-R401 PolarHBondContact O-NH1 3.18Å; Y397-R401 PolarHBondContact OH-NH2 3.07Å; V398-R401 PolarHBondContact O-N 2.88Å; K399-R401 PolarHBondContact O-N 3.09Å; K399-R401 VanDerWaalsContact O-N 3.13Å
402	R	86.9	Confident	92.2	Very high	7 Å²	7	54.1 Å²	54.1	3%	0.026	30%	0.295	C	S	.	.			trans	-141.5	89.9	173.2	-169.7	172.6	176.1	74.3	5.3	109.2	D281 S284 L292 M370 G371 V398 K399 C404 V405	D281-R402 IonicContact OD1-CZ 2.8Å; D281-R402 IonicContact OD1-NH1 3.76Å; D281-R402 PolarHBondContact OD1-NH1 3.29Å; D281-R402 IonicContact OD1-NH2 2.92Å; D281-R402 IonicContact OD2-CZ 2.7Å; D281-R402 IonicContact OD2-NH1 3.6Å; D281-R402 PolarHBondContact OD2-NH1 2.84Å; D281-R402 IonicContact OD2-NH2 2.89Å; D281-R402 PolarHBondContact OD2-NH2 2.98Å; S284-R402 WeakPolarHBondContact OG-CD 3.34Å; S284-R402 PolarHBondContact OG-NH1 3.18Å; L292-R402 HydrophobicContact CD2-CB 4.47Å; M370-R402 PolarHBondContact O-NH2 2.99Å; G371-R402 PolarHBondContact O-NE 3.18Å; V398-R402 PolarHBondContact O-N 3.16Å; K399-R402 CarbonylContact O-C 3.54Å; K399-R402 VanDerWaalsContact O-C 3.28Å; K399-R402 PolarHBondContact O-N 2.95Å; R402-C404 PolarHBondContact O-N 2.93Å; R402-C404 VanDerWaalsContact O-N 3.15Å; R402-V405 HydrophobicContact CB-CG2 3.86Å; R402-V405 HydrophobicContact CG-CG2 3.96Å; R402-V405 WeakPolarHBondContact O-CB 3.19Å; R402-V405 VanDerWaalsContact O-CG2 3.3Å; R402-V405 WeakPolarHBondContact O-CG2 3.48Å; R402-V405 PolarHBondContact O-N 2.92Å; R402-V405 VanDerWaalsContact O-N 3.1Å
403	P	79.3	Confident	92.2	Very high	115 Å²	115	53.3 Å²	53.3	75%	0.747	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.5	-170	-29.7	37.3	0	0	0	115.4	K399 V405	K399-P403 WeakPolarHBondContact O-CA 3.44Å; P403-V405 PolarHBondContact O-N 3.4Å
404	C	81	Confident	92.2	Very high	62 Å²	62	51.2 Å²	51.2	42%	0.419	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-0.8	178.7	65.2	0	0	0	0	114.8	I372 R402 Q406	I372-C404 HydrophobicContact CG1-CB 4.32Å; I372-C404 WeakPolarHBondContact CG2-O 3.47Å; R402-C404 PolarHBondContact O-N 2.93Å; R402-C404 VanDerWaalsContact O-N 3.15Å; C404-Q406 PolarHBondContact O-N 2.85Å
405	V	87.2	Confident	92.2	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	27%	0.273	C	S	.	.			trans	-63.2	117.6	-178.7	160.2	0	0	0	0	111.6	L292 A376 I380 L395 V398 K399 R402 P403	L292-V405 HydrophobicContact CD2-CG2 3.78Å; A376-V405 HydrophobicContact CB-CB 4.24Å; A376-V405 HydrophobicContact CB-CG1 3.63Å; A376-V405 HydrophobicContact CB-CG2 3.75Å; I380-V405 HydrophobicContact CD1-CG1 4.19Å; L395-V405 HydrophobicContact CD1-CG1 4.32Å; V398-V405 HydrophobicContact CG1-CG1 4.13Å; V398-V405 HydrophobicContact CG1-CG2 4.05Å; K399-V405 WeakPolarHBondContact CE-O 3.36Å; K399-V405 HydrophobicContact CG-CB 4.1Å; K399-V405 HydrophobicContact CG-CG1 4.13Å; R402-V405 HydrophobicContact CB-CG2 3.86Å; R402-V405 HydrophobicContact CG-CG2 3.96Å; R402-V405 WeakPolarHBondContact O-CB 3.19Å; R402-V405 VanDerWaalsContact O-CG2 3.3Å; R402-V405 WeakPolarHBondContact O-CG2 3.48Å; R402-V405 PolarHBondContact O-N 2.92Å; R402-V405 VanDerWaalsContact O-N 3.1Å; P403-V405 PolarHBondContact O-N 3.4Å
406	Q	86.6	Confident	92.2	Very high	140 Å²	140	55.3 Å²	55.3	65%	0.654	29%	0.291	S	S	*	.			trans	-149	86.9	179.8	-174.7	169	-62	0	0	109.8	I372 S373 C404	I372-Q406 HydrophobicContact CG2-CB 4.04Å; I372-Q406 CarbonylContact O-C 3.59Å; I372-Q406 PolarHBondContact O-N 2.88Å; S373-Q406 WeakPolarHBondContact CB-O 3.44Å; C404-Q406 PolarHBondContact O-N 2.85Å
407	P	93.6	Very high	92.3	Very high	11 Å²	11	55.7 Å²	55.7	7%	0.071	29%	0.29	C	S	.	.			trans	-51.1	139.5	166.3	-29.1	38.6	0	0	0	112	S377 I380 F411 M412 L415	S377-P407 WeakPolarHBondContact OG-CB 3.18Å; I380-P407 HydrophobicContact CD1-CG 3.84Å; P407-F411 HydrophobicContact CB-CB 4.43Å; P407-M412 HydrophobicContact CB-CG 3.97Å; P407-M412 HydrophobicContact CB-SD 3.83Å; P407-M412 HydrophobicContact CG-SD 4.15Å; P407-L415 HydrophobicContact CG-CD1 4.46Å
408	N	91.1	Very high	92.3	Very high	20 Å²	20	53.3 Å²	53.3	11%	0.107	28%	0.281	C	S	.	.			trans	-66.4	163.5	174.9	82.5	28.2	0	0	0	111.7	D337 D338 S373 G410 F411 M412	D337-N408 PolarHBondContact O-ND2 3.45Å; D338-N408 PolarHBondContact O-ND2 2.97Å; S373-N408 PolarHBondContact OG-N 2.81Å; N408-G410 PolarHBondContact O-N 3.1Å; N408-G410 VanDerWaalsContact OD1-CA 3.3Å; N408-G410 WeakPolarHBondContact OD1-CA 3.33Å; N408-G410 PolarHBondContact OD1-N 2.91Å; N408-F411 HydrophobicContact CB-CD2 4.43Å; N408-F411 WeakPolarHBondContact ND2-CD2 3.31Å; N408-F411 WeakPolarHBondContact ND2-CE2 3.46Å; N408-F411 PolarHBondContact O-N 3.48Å; N408-F411 PolarHBondContact OD1-N 3.36Å; N408-M412 PolarHBondContact O-N 3.43Å
409	P	92.6	Very high	92.4	Very high	74 Å²	74	55.1 Å²	55.1	48%	0.481	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-24.4	-175.9	-22.2	34.2	0	0	0	114.3	E339 R413	E339-P409 HydrophobicContact CG-CB 4.42Å; E339-P409 WeakPolarHBondContact OE1-CB 3.33Å; E339-P409 WeakPolarHBondContact OE1-CG 3.38Å; P409-R413 WeakPolarHBondContact O-CG 3.12Å; P409-R413 PolarHBondContact O-N 3.44Å; P409-R413 PolarHBondContact O-NE 3.45Å
410	G	95.7	Very high	92.7	Very high	4 Å²	4	52.8 Å²	52.8	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-61.5	170	0	0	0	0	0	111.4	N408 M412 R413 E414	N408-G410 PolarHBondContact O-N 3.1Å; N408-G410 VanDerWaalsContact OD1-CA 3.3Å; N408-G410 WeakPolarHBondContact OD1-CA 3.33Å; N408-G410 PolarHBondContact OD1-N 2.91Å; G410-M412 VanDerWaalsContact C-N 3.26Å; G410-M412 PolarHBondContact O-N 3.49Å; G410-R413 WeakPolarHBondContact O-CB 3.48Å; G410-R413 PolarHBondContact O-N 3.44Å; G410-E414 PolarHBondContact O-N 3.48Å; G410-E414 VanDerWaalsContact O-N 3.1Å
411	F	97.4	Very high	93	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-30.7	-179.8	-54.3	-39.3	0	0	0	112.8	I335 S341 L343 S373 R374 S377 P407 N408 E414 L415	I335-F411 HydrophobicContact CD1-CE1 4.21Å; I335-F411 HydrophobicContact CD1-CZ 4.01Å; S341-F411 WeakPolarHBondContact O-CE1 3.25Å; L343-F411 HydrophobicContact CB-CD1 3.98Å; L343-F411 HydrophobicContact CB-CE1 4.16Å; L343-F411 HydrophobicContact CD1-CD1 3.73Å; L343-F411 HydrophobicContact CD1-CD2 4.15Å; L343-F411 HydrophobicContact CD1-CE1 3.87Å; L343-F411 HydrophobicContact CD1-CE2 4.29Å; L343-F411 HydrophobicContact CD1-CG 3.9Å; L343-F411 HydrophobicContact CD1-CZ 4.17Å; L343-F411 HydrophobicContact CG-CD1 3.91Å; L343-F411 HydrophobicContact CG-CE1 3.76Å; L343-F411 HydrophobicContact CG-CZ 4.31Å; S373-F411 WeakPolarHBondContact OG-CD2 3.4Å; R374-F411 HydrophobicContact CB-CE2 4.44Å; R374-F411 HydrophobicContact CG-CE2 3.56Å; R374-F411 HydrophobicContact CG-CZ 3.8Å; S377-F411 WeakPolarHBondContact OG-CB 3.34Å; P407-F411 HydrophobicContact CB-CB 4.43Å; N408-F411 HydrophobicContact CB-CD2 4.43Å; N408-F411 WeakPolarHBondContact ND2-CD2 3.31Å; N408-F411 WeakPolarHBondContact ND2-CE2 3.46Å; N408-F411 PolarHBondContact O-N 3.48Å; N408-F411 PolarHBondContact OD1-N 3.36Å; F411-E414 PolarHBondContact O-N 3.33Å; F411-L415 WeakPolarHBondContact O-CB 3.24Å; F411-L415 VanDerWaalsContact O-CG 3.27Å; F411-L415 WeakPolarHBondContact O-CG 3.37Å; F411-L415 PolarHBondContact O-N 3.34Å
412	M	97.4	Very high	93.2	Very high	48 Å²	48	49.5 Å²	49.5	24%	0.236	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-41.4	171.7	-77.6	-57.9	-55.7	0	0	112.8	L391 L395 P407 N408 G410 L415 H416	L391-M412 HydrophobicContact CD2-CE 4.06Å; L395-M412 HydrophobicContact CD2-CE 4.3Å; P407-M412 HydrophobicContact CB-CG 3.97Å; P407-M412 HydrophobicContact CB-SD 3.83Å; P407-M412 HydrophobicContact CG-SD 4.15Å; N408-M412 PolarHBondContact O-N 3.43Å; G410-M412 VanDerWaalsContact C-N 3.26Å; G410-M412 PolarHBondContact O-N 3.49Å; M412-L415 PolarHBondContact O-N 3.39Å; M412-L415 HydrophobicContact SD-CD1 4.31Å; M412-H416 PolarHBondContact O-CD2 3.39Å; M412-H416 PolarHBondContact O-N 3.42Å; M412-H416 VanDerWaalsContact O-N 3.1Å
413	R	97.5	Very high	93.4	Very high	141 Å²	141	54 Å²	54	53%	0.532	29%	0.289	S	S	.	.	H	α-helix	trans	-64.8	-41.2	173.9	-70	177.2	-64.5	-150.2	-5.8	111.5	E339 P409 G410 H416 T417	E339-R413 IonicContact OE2-CZ 3.56Å; E339-R413 IonicContact OE2-NH1 3.47Å; E339-R413 IonicContact OE2-NH2 2.82Å; E339-R413 PolarHBondContact OE2-NH2 2.91Å; P409-R413 WeakPolarHBondContact O-CG 3.12Å; P409-R413 PolarHBondContact O-N 3.44Å; P409-R413 PolarHBondContact O-NE 3.45Å; G410-R413 WeakPolarHBondContact O-CB 3.48Å; G410-R413 PolarHBondContact O-N 3.44Å; R413-H416 PolarHBondContact O-N 3.34Å; R413-T417 PolarHBondContact O-N 2.88Å; R413-T417 PolarHBondContact O-OG1 3.02Å
414	E	97.9	Very high	93.9	Very high	22 Å²	22	51.3 Å²	51.3	10%	0.103	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-40.3	176.3	-70.9	-167.5	128.4	0	0	112.4	T342 L343 L344 W347 G410 F411 H416 T417 Y418	T342-E414 WeakPolarHBondContact CA-OE1 3.41Å; T342-E414 WeakPolarHBondContact CB-OE1 3.3Å; L343-E414 WeakPolarHBondContact CA-OE2 3.34Å; L343-E414 WeakPolarHBondContact CB-OE2 3.35Å; L343-E414 PolarHBondContact N-OE1 2.87Å; L343-E414 PolarHBondContact N-OE2 3.26Å; L344-E414 HydrophobicContact CB-CB 4.15Å; L344-E414 HydrophobicContact CB-CG 4.08Å; L344-E414 WeakPolarHBondContact CB-OE1 3.42Å; L344-E414 PolarHBondContact N-OE1 3.13Å; L344-E414 VanDerWaalsContact N-OE1 3.13Å; L344-E414 PolarHBondContact N-OE2 2.77Å; W347-E414 HydrophobicContact CH2-CB 3.62Å; W347-E414 HydrophobicContact CZ3-CB 3.98Å; G410-E414 PolarHBondContact O-N 3.48Å; G410-E414 VanDerWaalsContact O-N 3.1Å; F411-E414 PolarHBondContact O-N 3.33Å; E414-H416 PolarHBondContact O-N 3.18Å; E414-T417 CarbonylContact O-C 3.46Å; E414-T417 WeakPolarHBondContact O-CA 3.33Å; E414-T417 VanDerWaalsContact O-CB 3.31Å; E414-T417 WeakPolarHBondContact O-CB 3.42Å; E414-T417 PolarHBondContact O-N 3.48Å; E414-T417 VanDerWaalsContact O-N 3.09Å; E414-Y418 WeakPolarHBondContact O-CB 3.45Å; E414-Y418 PolarHBondContact O-N 3.41Å
415	L	98.2	Very high	94.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-40.9	175.8	-76.7	169.3	0	0	0	111.7	W347 I380 A381 M384 L391 P407 F411 M412 T417 Y418 Q419	W347-L415 HydrophobicContact CH2-CB 4.42Å; W347-L415 HydrophobicContact CH2-CD2 3.62Å; W347-L415 HydrophobicContact CH2-CG 3.69Å; W347-L415 HydrophobicContact CZ2-CD2 3.87Å; W347-L415 HydrophobicContact CZ2-CG 4.14Å; W347-L415 HydrophobicContact CZ3-CD2 4.08Å; W347-L415 HydrophobicContact CZ3-CG 4.42Å; I380-L415 HydrophobicContact CB-CD1 4.46Å; I380-L415 HydrophobicContact CB-CD2 4.42Å; I380-L415 HydrophobicContact CG2-CD1 4.14Å; I380-L415 HydrophobicContact CG2-CD2 4.08Å; A381-L415 HydrophobicContact CB-CD2 3.87Å; M384-L415 HydrophobicContact SD-CD2 4.09Å; L391-L415 HydrophobicContact CD1-CB 3.79Å; L391-L415 HydrophobicContact CD1-CD1 4.01Å; L391-L415 HydrophobicContact CD1-CD2 4.48Å; L391-L415 HydrophobicContact CD1-CG 4.32Å; L391-L415 HydrophobicContact CD2-CB 3.8Å; L391-L415 HydrophobicContact CG-CB 4.45Å; P407-L415 HydrophobicContact CG-CD1 4.46Å; F411-L415 WeakPolarHBondContact O-CB 3.24Å; F411-L415 VanDerWaalsContact O-CG 3.27Å; F411-L415 WeakPolarHBondContact O-CG 3.37Å; F411-L415 PolarHBondContact O-N 3.34Å; M412-L415 PolarHBondContact O-N 3.39Å; M412-L415 HydrophobicContact SD-CD1 4.31Å; L415-T417 VanDerWaalsContact C-N 3.33Å; L415-Y418 PolarHBondContact O-N 3.3Å; L415-Q419 PolarHBondContact O-N 3.41Å
416	H	97.6	Very high	93.9	Very high	116 Å²	116	53 Å²	53	54%	0.537	29%	0.289	S	S	.	.	H	α-helix	trans	-61.3	-41.1	169.9	-80.9	-68.2	0	0	0	112.2	M412 R413 E414 Y418 Q419 G420	M412-H416 PolarHBondContact O-CD2 3.39Å; M412-H416 PolarHBondContact O-N 3.42Å; M412-H416 VanDerWaalsContact O-N 3.1Å; R413-H416 PolarHBondContact O-N 3.34Å; E414-H416 PolarHBondContact O-N 3.18Å; H416-Y418 VanDerWaalsContact C-N 3.34Å; H416-Y418 PolarHBondContact O-N 2.87Å; H416-Q419 PolarHBondContact O-N 3.37Å; H416-G420 PolarHBondContact O-N 2.95Å
417	T	97.3	Very high	93.4	Very high	74 Å²	74	48.9 Å²	48.9	45%	0.454	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-41.7	175.1	-52.3	0	0	0	0	111.4	L344 R413 E414 L415 G420 I421	L344-T417 HydrophobicContact CD2-CG2 3.9Å; R413-T417 PolarHBondContact O-N 2.88Å; R413-T417 PolarHBondContact O-OG1 3.02Å; E414-T417 CarbonylContact O-C 3.46Å; E414-T417 WeakPolarHBondContact O-CA 3.33Å; E414-T417 VanDerWaalsContact O-CB 3.31Å; E414-T417 WeakPolarHBondContact O-CB 3.42Å; E414-T417 PolarHBondContact O-N 3.48Å; E414-T417 VanDerWaalsContact O-N 3.09Å; L415-T417 VanDerWaalsContact C-N 3.33Å; T417-G420 PolarHBondContact O-N 3.07Å; T417-I421 HydrophobicContact CG2-CD1 4.18Å; T417-I421 WeakPolarHBondContact O-CG1 3.49Å; T417-I421 PolarHBondContact O-N 3.12Å
418	Y	97.7	Very high	92.3	Very high	12 Å²	12	55.8 Å²	55.8	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-69.6	-35.1	179.2	-170.1	-118.2	0	0	0	112.9	L344 W347 A381 M384 K385 E414 L415 H416 G420 I421 L422	L344-Y418 HydrophobicContact CD1-CD2 3.88Å; L344-Y418 HydrophobicContact CD1-CG 4.29Å; W347-Y418 HydrophobicContact CB-CE1 4.47Å; W347-Y418 HydrophobicContact CB-CE2 4.12Å; W347-Y418 AromaticContact CE3-CD1 3.92Å; W347-Y418 HydrophobicContact CE3-CD1 3.92Å; W347-Y418 AromaticContact CE3-CD2 3.86Å; W347-Y418 HydrophobicContact CE3-CD2 3.86Å; W347-Y418 HydrophobicContact CE3-CE1 4.41Å; W347-Y418 HydrophobicContact CE3-CE2 4.35Å; W347-Y418 AromaticContact CE3-CG 3.6Å; W347-Y418 HydrophobicContact CE3-CG 3.6Å; W347-Y418 HydrophobicContact CZ3-CD1 4.42Å; W347-Y418 HydrophobicContact CZ3-CG 4.01Å; A381-Y418 HydrophobicContact CB-CD1 4.03Å; A381-Y418 HydrophobicContact CB-CE1 3.85Å; M384-Y418 HydrophobicContact CE-CD1 4.22Å; K385-Y418 HydrophobicContact CB-CE1 4.42Å; K385-Y418 WeakPolarHBondContact CD-OH 3.4Å; E414-Y418 WeakPolarHBondContact O-CB 3.45Å; E414-Y418 PolarHBondContact O-N 3.41Å; L415-Y418 PolarHBondContact O-N 3.3Å; H416-Y418 VanDerWaalsContact C-N 3.34Å; H416-Y418 PolarHBondContact O-N 2.87Å; Y418-G420 VanDerWaalsContact C-N 3.32Å; Y418-G420 PolarHBondContact O-N 3.16Å; Y418-I421 PolarHBondContact O-N 2.7Å; Y418-L422 HydrophobicContact CD1-CD1 3.87Å; Y418-L422 HydrophobicContact CD1-CG 4.28Å; Y418-L422 HydrophobicContact CE1-CD1 3.7Å; Y418-L422 HydrophobicContact CE1-CD2 4.38Å; Y418-L422 HydrophobicContact CE1-CG 4.13Å; Y418-L422 WeakPolarHBondContact O-CG 3.46Å; Y418-L422 PolarHBondContact O-N 3Å
419	Q	97	Very high	90.9	Very high	39 Å²	39	62.7 Å²	62.7	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-56.4	-48.4	168.9	-174.8	174.5	-30.5	0	0	110.6	M384 L391 L415 H416 I421 L422 E423	M384-Q419 HydrophobicContact CE-CB 3.61Å; M384-Q419 HydrophobicContact CE-CG 4.34Å; L391-Q419 VanDerWaalsContact CB-OE1 3.23Å; L415-Q419 PolarHBondContact O-N 3.41Å; H416-Q419 PolarHBondContact O-N 3.37Å; Q419-I421 VanDerWaalsContact C-N 3.31Å; Q419-I421 PolarHBondContact O-N 2.75Å; Q419-L422 PolarHBondContact O-N 3.16Å; Q419-E423 HydrophobicContact CG-CG 4.4Å; Q419-E423 WeakPolarHBondContact CG-OE1 3.18Å; Q419-E423 PolarHBondContact NE2-OE1 2.91Å; Q419-E423 WeakPolarHBondContact O-CB 3.21Å; Q419-E423 WeakPolarHBondContact O-CG 3.41Å; Q419-E423 PolarHBondContact O-N 2.89Å
420	G	95.2	Very high	89.5	Confident	37 Å²	37	64.4 Å²	64.4	38%	0.381	32%	0.322	S	S	.	.	H	α-helix	trans	-60.6	-36.6	175.9	0	0	0	0	0	113.5	H416 T417 Y418 A424	H416-G420 PolarHBondContact O-N 2.95Å; T417-G420 PolarHBondContact O-N 3.07Å; Y418-G420 VanDerWaalsContact C-N 3.32Å; Y418-G420 PolarHBondContact O-N 3.16Å; G420-A424 VanDerWaalsContact O-CB 3.25Å; G420-A424 WeakPolarHBondContact O-CB 3.45Å; G420-A424 PolarHBondContact O-N 2.67Å
421	I	95	Very high	87.7	Confident	83 Å²	83	69.3 Å²	69.3	43%	0.426	35%	0.353	S	S	.	.	H	α-helix	trans	-66.5	-44	174.2	-69.2	163	0	0	0	111.2	L344 T417 Y418 Q419 A424 S425	L344-I421 HydrophobicContact CD1-CD1 4.08Å; L344-I421 HydrophobicContact CD2-CD1 4.46Å; T417-I421 HydrophobicContact CG2-CD1 4.18Å; T417-I421 WeakPolarHBondContact O-CG1 3.49Å; T417-I421 PolarHBondContact O-N 3.12Å; Y418-I421 PolarHBondContact O-N 2.7Å; Q419-I421 VanDerWaalsContact C-N 3.31Å; Q419-I421 PolarHBondContact O-N 2.75Å; I421-A424 PolarHBondContact O-N 2.9Å; I421-S425 VanDerWaalsContact O-CB 3.22Å; I421-S425 WeakPolarHBondContact O-CB 3.32Å; I421-S425 PolarHBondContact O-N 2.95Å; I421-S425 PolarHBondContact O-OG 3.09Å
422	L	94.3	Very high	86.1	Confident	33 Å²	33	75.9 Å²	75.9	17%	0.173	39%	0.387	C	S	.	.	H	α-helix	trans	-64.9	-44.9	177.5	-69.5	175.3	0	0	0	111.5	M384 K385 Y418 Q419 S425 S426	M384-L422 HydrophobicContact CB-CD1 3.81Å; M384-L422 HydrophobicContact CE-CD1 4.42Å; K385-L422 HydrophobicContact CB-CD1 4.17Å; K385-L422 HydrophobicContact CB-CD2 3.99Å; K385-L422 HydrophobicContact CD-CD2 4.39Å; K385-L422 HydrophobicContact CG-CD2 3.96Å; Y418-L422 HydrophobicContact CD1-CD1 3.87Å; Y418-L422 HydrophobicContact CD1-CG 4.28Å; Y418-L422 HydrophobicContact CE1-CD1 3.7Å; Y418-L422 HydrophobicContact CE1-CD2 4.38Å; Y418-L422 HydrophobicContact CE1-CG 4.13Å; Y418-L422 WeakPolarHBondContact O-CG 3.46Å; Y418-L422 PolarHBondContact O-N 3Å; Q419-L422 PolarHBondContact O-N 3.16Å; L422-S425 WeakPolarHBondContact CA-OG 3.33Å; L422-S425 PolarHBondContact O-N 3.17Å; L422-S425 PolarHBondContact O-OG 2.91Å; L422-S426 PolarHBondContact O-N 3.45Å; L422-S426 PolarHBondContact O-OG 2.75Å; L422-S426 VanDerWaalsContact O-OG 3.07Å
423	E	91.9	Very high	84.4	Confident	101 Å²	101	79.7 Å²	79.7	47%	0.472	40%	0.403	S	S	.	.	H	α-helix	trans	-59.9	-47.1	174.3	-73	175.5	-169	0	0	111.6	Q419 S425 S426 N427	Q419-E423 HydrophobicContact CG-CG 4.4Å; Q419-E423 WeakPolarHBondContact CG-OE1 3.18Å; Q419-E423 PolarHBondContact NE2-OE1 2.91Å; Q419-E423 WeakPolarHBondContact O-CB 3.21Å; Q419-E423 WeakPolarHBondContact O-CG 3.41Å; Q419-E423 PolarHBondContact O-N 2.89Å; E423-S425 VanDerWaalsContact C-N 3.32Å; E423-S425 PolarHBondContact O-N 2.87Å; E423-S426 PolarHBondContact O-OG 3Å; E423-S426 VanDerWaalsContact O-OG 3.04Å; E423-N427 WeakPolarHBondContact O-CB 3.34Å; E423-N427 VanDerWaalsContact O-CG 3.26Å; E423-N427 PolarHBondContact O-N 3.16Å; E423-N427 VanDerWaalsContact O-N 3.16Å; E423-N427 PolarHBondContact O-ND2 3.41Å
424	A	90.1	Very high	82.4	Confident	59 Å²	59	77.1 Å²	77.1	49%	0.488	40%	0.396	S	S	.	.	H	α-helix	trans	-61.8	-39.1	173.6	0	0	0	0	0	112.3	G420 I421	G420-A424 VanDerWaalsContact O-CB 3.25Å; G420-A424 WeakPolarHBondContact O-CB 3.45Å; G420-A424 PolarHBondContact O-N 2.67Å; I421-A424 PolarHBondContact O-N 2.9Å
425	S	86.1	Confident	80	Confident	37 Å²	37	83.5 Å²	83.5	26%	0.259	43%	0.431	S	S	.	.	H	α-helix	trans	-69.2	-38	-176.7	80.2	0	0	0	0	113.4	I421 L422 E423 R428	I421-S425 VanDerWaalsContact O-CB 3.22Å; I421-S425 WeakPolarHBondContact O-CB 3.32Å; I421-S425 PolarHBondContact O-N 2.95Å; I421-S425 PolarHBondContact O-OG 3.09Å; L422-S425 WeakPolarHBondContact CA-OG 3.33Å; L422-S425 PolarHBondContact O-N 3.17Å; L422-S425 PolarHBondContact O-OG 2.91Å; E423-S425 VanDerWaalsContact C-N 3.32Å; E423-S425 PolarHBondContact O-N 2.87Å; S425-R428 WeakPolarHBondContact O-CB 3.37Å; S425-R428 PolarHBondContact O-NE 3.32Å; S425-R428 VanDerWaalsContact O-NE 3.09Å
426	S	81.4	Confident	77.6	Confident	62 Å²	62	89.9 Å²	89.9	43%	0.434	47%	0.465	S	S	.	.	H	α-helix	trans	-75.8	-32.1	178.5	57.1	0	0	0	0	112	L422 E423 R428 Y429	L422-S426 PolarHBondContact O-N 3.45Å; L422-S426 PolarHBondContact O-OG 2.75Å; L422-S426 VanDerWaalsContact O-OG 3.07Å; E423-S426 PolarHBondContact O-OG 3Å; E423-S426 VanDerWaalsContact O-OG 3.04Å; S426-R428 PolarHBondContact O-N 3.29Å; S426-R428 VanDerWaalsContact O-N 3.17Å; S426-Y429 PolarHBondContact O-N 3.17Å
427	N	76.1	Confident	74.9	Confident	54 Å²	54	92.2 Å²	92.2	29%	0.289	48%	0.477	S	S	.	.	H	α-helix	trans	-58.9	-24.4	173.1	-81.3	-43.5	0	0	0	113.5	E423 Y429 K430 F433	E423-N427 WeakPolarHBondContact O-CB 3.34Å; E423-N427 VanDerWaalsContact O-CG 3.26Å; E423-N427 PolarHBondContact O-N 3.16Å; E423-N427 VanDerWaalsContact O-N 3.16Å; E423-N427 PolarHBondContact O-ND2 3.41Å; N427-Y429 PolarHBondContact O-N 2.58Å; N427-Y429 VanDerWaalsContact O-N 3.13Å; N427-K430 WeakPolarHBondContact O-CB 3.06Å; N427-K430 PolarHBondContact O-N 3.06Å; N427-K430 WeakPolarHBondContact OD1-CD 3.48Å; N427-K430 WeakPolarHBondContact OD1-CE 3.38Å; N427-K430 PolarHBondContact OD1-NZ 2.98Å; N427-F433 HydrophobicContact CB-CE2 4.29Å; N427-F433 WeakPolarHBondContact O-CD2 3.42Å; N427-F433 WeakPolarHBondContact O-CE2 3.5Å
428	R	70.9	Confident	72.6	Confident	155 Å²	155	94.5 Å²	94.5	59%	0.585	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.3	-177.7	-65	-175.5	-66.4	-175.1	-0.3	114.9	S425 S426	S425-R428 WeakPolarHBondContact O-CB 3.37Å; S425-R428 PolarHBondContact O-NE 3.32Å; S425-R428 VanDerWaalsContact O-NE 3.09Å; S426-R428 PolarHBondContact O-N 3.29Å; S426-R428 VanDerWaalsContact O-N 3.17Å
429	Y	61.1	Low	69.9	Low	165 Å²	165	102.2 Å²	102.2	65%	0.647	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-0.1	176.2	-59.1	-75.7	0	0	0	113.7	S426 N427	S426-Y429 PolarHBondContact O-N 3.17Å; N427-Y429 PolarHBondContact O-N 2.58Å; N427-Y429 VanDerWaalsContact O-N 3.13Å
430	K	64	Low	67.1	Low	111 Å²	111	105.4 Å²	105.4	48%	0.483	55%	0.551	S	S	.	*	S	Bend	trans	-74.8	138.9	175.4	-68.5	-179.6	175.3	171.4	0	109.9	N427 I432 F433	N427-K430 WeakPolarHBondContact O-CB 3.06Å; N427-K430 PolarHBondContact O-N 3.06Å; N427-K430 WeakPolarHBondContact OD1-CD 3.48Å; N427-K430 WeakPolarHBondContact OD1-CE 3.38Å; N427-K430 PolarHBondContact OD1-NZ 2.98Å; K430-I432 PolarHBondContact O-N 3.07Å; K430-F433 HydrophobicContact CB-CD2 4.36Å; K430-F433 PolarHBondContact O-N 3.44Å
431	P	56.6	Low	64.5	Low	107 Å²	107	110.1 Å²	110.1	70%	0.695	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-62.4	-13.1	-174.5	23.3	-34	0	0	0	114.7	F433 H434	P431-F433 PolarHBondContact O-N 3.23Å; P431-H434 CarbonylContact O-C 3.53Å; P431-H434 PolarHBondContact O-N 2.67Å; P431-H434 VanDerWaalsContact O-N 3.08Å; P431-H434 VanDerWaalsContact O-O 3.1Å
432	I	64.7	Low	61.9	Low	138 Å²	138	114.9 Å²	114.9	71%	0.708	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-58.9	-28.2	168.8	-70.8	173.7	0	0	0	112.2	K430	K430-I432 PolarHBondContact O-N 3.07Å
433	F	61.4	Low	59	Low	128 Å²	128	119.5 Å²	119.5	56%	0.561	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-99	7	176.7	-56.1	-76.1	0	0	0	113.2	N427 K430 P431	N427-F433 HydrophobicContact CB-CE2 4.29Å; N427-F433 WeakPolarHBondContact O-CD2 3.42Å; N427-F433 WeakPolarHBondContact O-CE2 3.5Å; K430-F433 HydrophobicContact CB-CD2 4.36Å; K430-F433 PolarHBondContact O-N 3.44Å; P431-F433 PolarHBondContact O-N 3.23Å
434	H	55.9	Low	56.5	Low	87 Å²	87	121.9 Å²	121.9	40%	0.403	64%	0.641	S	S	.	*			trans	-120.6	90.8	173.1	-71.1	3.1	0	0	0	108.6	P431 N436	P431-H434 CarbonylContact O-C 3.53Å; P431-H434 PolarHBondContact O-N 2.67Å; P431-H434 VanDerWaalsContact O-N 3.08Å; P431-H434 VanDerWaalsContact O-O 3.1Å; H434-N436 PolarHBondContact O-N 3.09Å
435	N	47.3	Very low	53.7	Low	155 Å²	155	124 Å²	124	83%	0.829	65%	0.651	S	S	*	*			trans	-68.6	65.3	170.7	-77	-16.3	0	0	0	110.8	E437	N435-E437 PolarHBondContact O-N 3.17Å; N435-E437 VanDerWaalsContact O-N 3.09Å
436	N	47	Very low	51.3	Low	135 Å²	135	127.6 Å²	127.6	72%	0.722	67%	0.674	S	S	*	*			trans	-64.8	108	164.3	-77.6	-6.3	0	0	0	107.2	H434 V438	H434-N436 PolarHBondContact O-N 3.09Å; N436-V438 VanDerWaalsContact C-N 3.33Å; N436-V438 PolarHBondContact O-N 2.87Å
437	E	42.9	Very low	49	Very low	165 Å²	165	133 Å²	133	77%	0.771	69%	0.692	S	S	*	*			trans	-62.1	91.3	178.4	-67	-170.1	154.8	0	0	110.8	N435 K439	N435-E437 PolarHBondContact O-N 3.17Å; N435-E437 VanDerWaalsContact O-N 3.09Å; E437-K439 PolarHBondContact O-N 3.25Å
438	V	47.2	Very low	46.7	Very low	122 Å²	122	141 Å²	141	74%	0.739	72%	0.72	S	S	*	*			trans	-65.1	99.3	167.1	179.7	0	0	0	0	107.2	N436 S440	N436-V438 VanDerWaalsContact C-N 3.33Å; N436-V438 PolarHBondContact O-N 2.87Å; V438-S440 PolarHBondContact O-N 3.29Å; V438-S440 PolarHBondContact O-OG 2.91Å
439	K	41	Very low	44.9	Very low	174 Å²	174	140.7 Å²	140.7	76%	0.757	74%	0.736	S	S	*	*			trans	-68.9	78.8	177.1	-71.1	-178.5	179.4	174.9	0	110.3	E437 T441	E437-K439 PolarHBondContact O-N 3.25Å; K439-T441 PolarHBondContact O-N 2.83Å
440	S	39.4	Very low	43.3	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	74%	0.74	S	S	*	*			trans	-64.3	94.2	178	-58.5	0	0	0	0	111.3	V438 K442	V438-S440 PolarHBondContact O-N 3.29Å; V438-S440 PolarHBondContact O-OG 2.91Å; S440-K442 PolarHBondContact O-N 3.19Å
441	T	40.1	Very low	41.8	Very low	135 Å²	135	139 Å²	139	83%	0.828	76%	0.756	S	S	*	*			trans	-70.7	89.1	173.5	48	0	0	0	0	111	K439	K439-T441 PolarHBondContact O-N 2.83Å
442	K	40.9	Very low	40.5	Very low	183 Å²	183	140.4 Å²	140.4	80%	0.796	76%	0.758	S	S	*	*			trans	26.8	97.9	156.6	-66.8	-176.7	177.8	-179.9	0	117.5	S440	S440-K442 PolarHBondContact O-N 3.19Å
443	T	33.3	Very low	39	Very low	131 Å²	131	141.5 Å²	141.5	80%	0.804	77%	0.765	S	S	*	*				24.8	111.3	128.7	53.2	0	0	0	0	118.8
444	V	39.2	Very low	37.5	Very low	151 Å²	151	143.5 Å²	143.5	92%	0.915	78%	0.776	S	S	*	*			trans	-131.9	145.7	137.2	-177.7	0	0	0	0	107.7
445	S	31.4	Very low	36.4	Very low	102 Å²	102	148.6 Å²	148.6	71%	0.713	80%	0.8	S	S	*	*			trans	-151.1	163.7	-178.8	55.8	0	0	0	0	108.4
446	P	36	Very low	35.6	Very low	113 Å²	113	147.6 Å²	147.6	73%	0.734	80%	0.795	S	S	*	*			cis	-104.9	-146.7	3.6	34.7	-15.6	0	0	0	110.1
447	E	32.8	Very low	34.9	Very low	176 Å²	176	152.2 Å²	152.2	82%	0.822	80%	0.804	S	S	*	*			cis	-164.3	177.3	29.2	-154.1	157.1	-132.5	0	0	112.1
448	Y	27.7	Very low	34.3	Very low	222 Å²	222	149.2 Å²	149.2	87%	0.871	80%	0.8	S	S	*	*			trans	-85.3	136.5	-175	-70.6	-102.4	0	0	0	113.1
449	T	32.9	Very low	33.5	Very low	148 Å²	148	148.9 Å²	148.9	91%	0.908	80%	0.8	S	S	*	*			trans	-163.6	148.5	132.6	3.1	0	0	0	0	112.2
450	S	27.5	Very low	33.4	Very low	106 Å²	106	146.3 Å²	146.3	74%	0.741	80%	0.801	S	S	*	*			trans	-88.3	146.7	170.6	51.9	0	0	0	0	111.7
451	V	33.8	Very low	33.1	Very low	135 Å²	135	148.6 Å²	148.6	82%	0.818	81%	0.805	S	S	*	*			trans	-175.1	149.8	130.9	144.4	0	0	0	0	108.2
452	D	28.5	Very low	32.5	Very low	137 Å²	137	148.6 Å²	148.6	73%	0.733	81%	0.805	S	S	*	*			trans	-62.5	149.4	-177	-50.4	-97.9	0	0	0	114.4
453	N	33.3	Very low	32	Very low	160 Å²	160	148.1 Å²	148.1	86%	0.856	81%	0.81	S	S	*	*				-164.2	163.4	113.5	-107.4	-70.5	0	0	0	113.4
454	Q	28.4	Very low	31.8	Very low	170 Å²	170	147.7 Å²	147.7	79%	0.794	80%	0.802	S	S	*	*			trans	-95.9	148.6	-168.3	-56.1	165	-3.6	0	0	112.4
455	Q	34.5	Very low	31.5	Very low	194 Å²	194	148.5 Å²	148.5	91%	0.907	80%	0.801	S	S	*	*				-171.9	143.5	129.1	-101.9	157.1	36.5	0	0	114.5
456	N	29.3	Very low	31.5	Very low	134 Å²	134	152 Å²	152	72%	0.717	80%	0.803	S	S	*	*			trans	-60.1	159.3	-167.6	-52.6	-33.7	0	0	0	117.2
457	Y	32.7	Very low	31.4	Very low	232 Å²	232	152.6 Å²	152.6	91%	0.91	81%	0.81	S	S	*	*				-160.6	165.8	102.1	-108.7	-77.2	0	0	0	112
458	C	29.6	Very low	31.2	Very low	102 Å²	102	150.2 Å²	150.2	69%	0.689	81%	0.807	S	S	*	*			trans	-109.3	158.7	-146.1	-55.8	0	0	0	0	117.3
459	P	31	Very low	31.5	Very low	115 Å²	115	143.2 Å²	143.2	75%	0.747	80%	0.802	S	S	*	*			trans	-90.7	169	164.7	38.4	-35.4	0	0	0	113.1
460	P	38.5	Very low	31.4	Very low	121 Å²	121	142.1 Å²	142.1	79%	0.786	79%	0.791	S	S	*	*			trans	-89.6	114.4	-176.7	-4.5	24.4	0	0	0	114.9
461	N	33.3	Very low	31.6	Very low	154 Å²	154	144.5 Å²	144.5	82%	0.824	79%	0.791	S	S	*	*			trans	51.9	102.9	140.1	-59.5	-10.2	0	0	0	121.3
462	V	29.1	Very low	31.4	Very low	135 Å²	135	145.6 Å²	145.6	82%	0.818	79%	0.787	S	S	*	*			trans	-118	132.9	136.3	176.1	0	0	0	0	107.5	I464	V462-I464 HydrophobicContact CG1-CG1 4.27Å
463	L	29.1	Very low	31.6	Very low	172 Å²	172	144.9 Å²	144.9	90%	0.901	78%	0.783	S	S	*	*			trans	-85.6	118.9	176.6	-91.2	164.6	0	0	0	111
464	I	29	Very low	31.4	Very low	123 Å²	123	143.2 Å²	143.2	63%	0.631	77%	0.774	S	S	*	*			trans	-138.7	119.9	166.9	-60.8	178.6	0	0	0	108.5	V462 K466	V462-I464 HydrophobicContact CG1-CG1 4.27Å; I464-K466 HydrophobicContact CG2-CG 4.03Å
465	N	33.4	Very low	31.5	Very low	167 Å²	167	142.1 Å²	142.1	89%	0.893	77%	0.774	S	S	*	*			trans	-85.3	121.4	157.7	-82.1	-12.4	0	0	0	108.4
466	K	30.5	Very low	31.2	Very low	177 Å²	177	140.5 Å²	140.5	77%	0.77	77%	0.77	S	S	*	*			trans	-114	136.8	172	-104.3	-176.7	176.5	-177.7	0	109.5	I464	I464-K466 HydrophobicContact CG2-CG 4.03Å
467	S	34.6	Very low	31.1	Very low	124 Å²	124	138.7 Å²	138.7	87%	0.867	77%	0.768	S	S	*	*			trans	-115	153.9	148.1	49.4	0	0	0	0	108.1
468	T	29.6	Very low	30.7	Very low	127 Å²	127	133 Å²	133	78%	0.779	76%	0.762	S	S	*	*			trans	-127.3	148.1	-167	47.2	0	0	0	0	111.2
469	G	32.7	Very low	30.7	Very low	74 Å²	74	133.5 Å²	133.5	76%	0.763	77%	0.767	S	S	*	*			trans	-163.5	107	179.5	0	0	0	0	0	110.3
470	N	30.2	Very low	30.5	Very low	126 Å²	126	134.2 Å²	134.2	67%	0.674	77%	0.77	S	S	*	*			trans	-55.2	171.2	-168.2	-58.2	6.3	0	0	0	118
471	E	31.8	Very low	30.1	Very low	156 Å²	156	137.5 Å²	137.5	73%	0.729	78%	0.776	S	S	*	*			trans	64.8	147.6	142.8	-75.7	147.1	-129.8	0	0	118.2
472	Q	29.6	Very low	29.8	Very low	158 Å²	158	139.1 Å²	139.1	74%	0.738	78%	0.776	S	S	*	*			cis	-161.5	-176.5	-25.7	-140.7	169.3	-9.7	0	0	106.5
473	D	32.6	Very low	29.9	Very low	121 Å²	121	139.9 Å²	139.9	65%	0.647	78%	0.781	S	S	*	*			trans	58.9	106	159.5	-68.7	-3.9	0	0	0	122.4
474	N	30	Very low	29.7	Very low	125 Å²	125	138 Å²	138	67%	0.668	77%	0.771	S	S	*	*				66.7	132.8	117.8	-57.1	-43.4	0	0	0	123.1
475	N	30.5	Very low	29.7	Very low	148 Å²	148	139.6 Å²	139.6	79%	0.791	78%	0.778	S	S	*	*			trans	76	104.4	143.6	-65.9	-23.5	0	0	0	122
476	L	27.9	Very low	29.4	Very low	159 Å²	159	137.4 Å²	137.4	83%	0.832	77%	0.771	S	S	*	*				83.7	146.6	116.7	-154.3	72.1	0	0	0	120.6
477	S	27.4	Very low	29.3	Very low	96 Å²	96	133.2 Å²	133.2	67%	0.671	76%	0.764	S	S	*	*			trans	70.1	108.5	156.4	45.5	0	0	0	0	121.3
478	S	24.9	Very low	29	Very low	113 Å²	113	134.1 Å²	134.1	79%	0.79	76%	0.755	S	S	*	*				37.7	105.6	124.3	-52.7	0	0	0	0	121.3
479	S	29.9	Very low	29	Very low	113 Å²	113	135.4 Å²	135.4	79%	0.79	75%	0.749	S	S	*	*				-167.2	129.6	117.3	-80.4	0	0	0	0	108.7
480	T	26.7	Very low	28.6	Very low	130 Å²	130	138.6 Å²	138.6	80%	0.798	75%	0.748	S	S	*	*				63.3	91.5	62.1	-52.2	0	0	0	0	113.2
481	M	30.3	Very low	28.5	Very low	189 Å²	189	139.1 Å²	139.1	93%	0.931	75%	0.746	S	S	*	*			trans	-152.4	137.4	132.2	-122	179.5	-179.4	0	0	111.5
482	K	26.3	Very low	28.3	Very low	189 Å²	189	139.4 Å²	139.4	82%	0.822	75%	0.748	S	S	*	*			trans	-92.4	144.1	168.8	-64.2	175.8	178.5	178.2	0	108.3
483	V	31	Very low	28.3	Very low	151 Å²	151	138.9 Å²	138.9	92%	0.915	75%	0.75	S	S	*	*			trans	-119.3	142.4	145.4	-178	0	0	0	0	106.5
484	N	25.2	Very low	28.3	Very low	131 Å²	131	139.1 Å²	139.1	70%	0.701	76%	0.758	S	S	*	*			trans	-144.1	166.7	-169.3	-157.9	36.5	0	0	0	108
485	M	29.5	Very low	28.1	Very low	158 Å²	158	142.8 Å²	142.8	78%	0.778	76%	0.764	S	S	*	*			trans	75.3	147.1	173.4	-52.9	-169.9	172.9	0	0	116.3
486	T	26.4	Very low	27.9	Very low	121 Å²	121	142.8 Å²	142.8	74%	0.742	76%	0.764	S	S	*	*			cis	-163.2	169.8	-13	20.7	0	0	0	0	110.4
487	S	29.2	Very low	28	Very low	88 Å²	88	141.1 Å²	141.1	62%	0.615	77%	0.766	S	S	*	*			trans	81.7	123.2	152.5	-73.8	0	0	0	0	119.9
488	E	28.5	Very low	27.9	Very low	143 Å²	143	142.6 Å²	142.6	67%	0.668	77%	0.771	S	S	*	*				61	145.7	125.2	-59.8	179.1	102.5	0	0	119.5
489	K	27.8	Very low	28	Very low	155 Å²	155	142.8 Å²	142.8	67%	0.674	77%	0.767	S	S	*	*			cis	-166.3	147.6	-2.2	-122.6	167.8	178.6	151.6	0	107.1
490	L	26	Very low	27.9	Very low	140 Å²	140	146 Å²	146	73%	0.733	77%	0.772	S	S	*	*			trans	64.4	164	159	-57	165.1	0	0	0	113.6
491	E	27.2	Very low	27.9	Very low	137 Å²	137	147.3 Å²	147.3	64%	0.64	77%	0.774	S	S	*	*			cis	-154.7	155.8	-7.8	-127.3	169.3	164.8	0	0	112.4
492	Q	27.8	Very low	27.8	Very low	163 Å²	163	143.4 Å²	143.4	76%	0.762	77%	0.765	S	S	*	*			trans	47.6	143.6	147.2	-71.6	168.3	51.2	0	0	124.1
493	N	30.3	Very low	27.8	Very low	146 Å²	146	138.8 Å²	138.8	78%	0.781	76%	0.757	S	S	*	*			trans	-62.5	165	165.7	-77.3	-37.3	0	0	0	112.5
494	P	32.4	Very low	27.6	Very low	126 Å²	126	138.9 Å²	138.9	82%	0.818	75%	0.752	S	S	*	*				-140	164.3	102.5	38.1	-26.8	0	0	0	115.7
495	Y	26	Very low	27.7	Very low	202 Å²	202	139.7 Å²	139.7	79%	0.792	75%	0.754	S	S	*	*			trans	-89	167.6	169.3	-106.7	-98.6	0	0	0	111.6
496	N	25.4	Very low	27.6	Very low	148 Å²	148	135.7 Å²	135.7	79%	0.791	75%	0.746	S	S	*	*			trans	68.4	123.1	162.8	-58.5	-19.3	0	0	0	118.7
497	S	29.3	Very low	27.7	Very low	125 Å²	125	137.7 Å²	137.7	87%	0.874	75%	0.753	S	S	*	*			trans	-141.8	160.2	143.3	75.3	0	0	0	0	109.9
498	T	26.1	Very low	27.7	Very low	126 Å²	126	137 Å²	137	77%	0.773	76%	0.76	S	S	*	*			trans	-123.9	135.4	-161.5	-61.8	0	0	0	0	111.6
499	V	26.4	Very low	27.6	Very low	118 Å²	118	136.3 Å²	136.3	72%	0.715	77%	0.769	S	S	*	*			trans	32.2	114.5	159.2	-177.6	0	0	0	0	118
500	M	28.5	Very low	28.1	Very low	181 Å²	181	135.4 Å²	135.4	89%	0.892	77%	0.771	S	S	*	*			trans	-139.4	126	142.8	-96.4	-63.9	-177.3	0	0	110
501	N	26.4	Very low	28.3	Very low	157 Å²	157	134.4 Å²	134.4	84%	0.84	77%	0.772	S	S	*	*			trans	-105.9	105.8	177.4	-101.2	-17.1	0	0	0	110.1
502	S	28.3	Very low	28.7	Very low	107 Å²	107	132.4 Å²	132.4	75%	0.748	77%	0.77	S	S	*	*			trans	177.6	151	157.1	41.8	0	0	0	0	111.1
503	S	26.4	Very low	28.9	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	77%	0.773	S	S	*	*			cis	-171.5	174	-29.4	47.1	0	0	0	0	107.9
504	L	26	Very low	28.8	Very low	153 Å²	153	130.8 Å²	130.8	80%	0.801	77%	0.771	S	S	*	*			trans	75.5	141.3	169.2	-44.7	172.1	0	0	0	115.1
505	I	27.3	Very low	28.5	Very low	147 Å²	147	131.9 Å²	131.9	75%	0.754	77%	0.769	S	S	*	*			cis	-159.2	158.7	-12.8	-126.7	171.9	0	0	0	110.5
506	A	27.8	Very low	28.7	Very low	74 Å²	74	126.7 Å²	126.7	61%	0.612	76%	0.762	S	S	*	*			trans	62.5	154.4	163.7	0	0	0	0	0	119.3
507	D	27.8	Very low	29	Very low	164 Å²	164	125 Å²	125	88%	0.877	76%	0.762	S	S	*	*			cis	-168.4	154.4	-27.3	-91.8	-33.5	0	0	0	104.9
508	G	30.1	Very low	28.9	Very low	74 Å²	74	123.5 Å²	123.5	76%	0.763	75%	0.752	S	S	*	*			cis	175.7	-176.1	1.1	0	0	0	0	0	106.4
509	C	26.6	Very low	29	Very low	128 Å²	128	125.1 Å²	125.1	87%	0.865	76%	0.755	S	S	*	*			cis	-158.9	166.7	-11	-168.1	0	0	0	0	108.1
510	L	37.6	Very low	29.1	Very low	135 Å²	135	125 Å²	125	71%	0.707	76%	0.759	S	S	*	*			trans	-85.3	-172.8	171.8	-64.4	89.7	0	0	0	111.2	T512	L510-T512 HydrophobicContact CB-CG2 3.92Å; L510-T512 HydrophobicContact CD2-CG2 4.04Å; L510-T512 HydrophobicContact CG-CG2 4.49Å
511	P	30.8	Very low	29	Very low	119 Å²	119	122.9 Å²	122.9	77%	0.773	75%	0.751	S	S	*	*				-135.9	139	83	33.3	-18.1	0	0	0	113.1
512	T	34.7	Very low	29	Very low	95 Å²	95	124.7 Å²	124.7	58%	0.583	75%	0.752	S	S	*	*				70	116	51.2	62.5	0	0	0	0	117.8	L510	L510-T512 HydrophobicContact CB-CG2 3.92Å; L510-T512 HydrophobicContact CD2-CG2 4.04Å; L510-T512 HydrophobicContact CG-CG2 4.49Å
513	T	31.7	Very low	29.1	Very low	136 Å²	136	124.6 Å²	124.6	83%	0.834	75%	0.751	S	S	*	*			trans	-152.5	114.5	138.8	19.3	0	0	0	0	106.1
514	L	28.5	Very low	29	Very low	139 Å²	139	125.2 Å²	125.2	73%	0.728	76%	0.756	S	S	*	*				72.2	130.2	61.8	-63.1	174.6	0	0	0	111.9
515	L	27.6	Very low	29	Very low	149 Å²	149	124.8 Å²	124.8	78%	0.78	75%	0.753	S	S	*	*			cis	-143.1	158.9	20	-94	114	0	0	0	116.1
516	S	30.2	Very low	28.9	Very low	94 Å²	94	126.4 Å²	126.4	66%	0.657	76%	0.755	S	S	*	*			trans	-3.7	156.2	152.4	60.7	0	0	0	0	121.7
517	S	31.4	Very low	28.8	Very low	111 Å²	111	127.8 Å²	127.8	78%	0.776	76%	0.76	S	S	*	*				-178	-176.3	57.5	52	0	0	0	0	112.9
518	S	27.6	Very low	28.9	Very low	95 Å²	95	126.1 Å²	126.1	66%	0.664	76%	0.761	S	S	*	*			cis	-169	133	-49.1	-80.4	0	0	0	0	111.1
519	L	27.2	Very low	28.7	Very low	160 Å²	160	129.3 Å²	129.3	84%	0.838	77%	0.766	S	S	*	*			trans	41	114.7	146.4	-71.9	154.3	0	0	0	121.8
520	S	29.1	Very low	28.9	Very low	116 Å²	116	128.8 Å²	128.8	81%	0.811	76%	0.764	S	S	*	*			trans	173.7	169.3	135.3	39.6	0	0	0	0	111.2
521	N	25.8	Very low	28.3	Very low	136 Å²	136	128.5 Å²	128.5	73%	0.727	77%	0.768	S	S	*	*				-172.6	169.2	-56.1	-118.9	-6.8	0	0	0	108.1
522	F	26.2	Very low	28.2	Very low	195 Å²	195	128.8 Å²	128.8	86%	0.855	77%	0.767	S	S	*	*			trans	71.1	134.6	164.9	-78.3	-72	0	0	0	121.5
523	S	30.2	Very low	27.8	Very low	104 Å²	104	130.6 Å²	130.6	73%	0.727	77%	0.772	S	S	*	*			trans	-92.7	165.1	163.8	53.3	0	0	0	0	111.3
524	S	25.6	Very low	27.7	Very low	105 Å²	105	129.5 Å²	129.5	73%	0.734	77%	0.765	S	S	*	*			trans	-174.2	151.8	143.9	42.6	0	0	0	0	114.2
525	L	24.9	Very low	27.7	Very low	144 Å²	144	129 Å²	129	75%	0.754	77%	0.768	S	S	*	*			trans	49.6	108.4	147.4	-60.9	165.8	0	0	0	119
526	K	24.8	Very low	28.1	Very low	182 Å²	182	127.1 Å²	127.1	79%	0.791	77%	0.765	S	S	*	*				85.1	114.6	70	-84.6	-164.6	-173.1	177.2	0	115.3
527	S	25.8	Very low	28.1	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	77%	0.771	S	S	*	*			trans	45.1	124.4	139.4	63.2	0	0	0	0	121.3
528	S	30.7	Very low	28.1	Very low	130 Å²	130	129 Å²	129	91%	0.909	77%	0.766	S	S	*	*				-153.4	115.6	127	-82.5	0	0	0	0	111.5
529	T	26.4	Very low	28.2	Very low	141 Å²	141	128.9 Å²	128.9	87%	0.865	76%	0.764	S	S	*	*			trans	-80.9	141.3	164.7	45.4	0	0	0	0	110.1
530	S	29.4	Very low	28.3	Very low	116 Å²	116	129.2 Å²	129.2	81%	0.811	77%	0.766	S	S	*	*			trans	-150.6	110.1	148.3	-161.4	0	0	0	0	112.2
531	T	24.9	Very low	28.5	Very low	130 Å²	130	128.6 Å²	128.6	80%	0.798	76%	0.762	S	S	*	*			trans	-72.7	140.6	160.4	-50.5	0	0	0	0	109.3
532	V	28.9	Very low	28.7	Very low	124 Å²	124	127.2 Å²	127.2	75%	0.752	76%	0.763	S	S	*	*			trans	174.3	142.3	157.1	137.9	0	0	0	0	108.5
533	I	26.8	Very low	29.3	Very low	133 Å²	133	123.2 Å²	123.2	68%	0.682	76%	0.757	S	S	*	*			cis	-166.2	159.3	-30.1	-136.5	164	0	0	0	107.9
534	T	28.9	Very low	29.3	Very low	114 Å²	114	125 Å²	125	70%	0.699	76%	0.757	S	S	*	*			trans	59.2	129.7	174.9	48.6	0	0	0	0	117.3
535	T	28.5	Very low	29.6	Very low	128 Å²	128	126.3 Å²	126.3	79%	0.785	76%	0.76	S	S	*	*			cis	79.2	159.4	32.1	85.9	0	0	0	0	114
536	P	36.5	Very low	29.8	Very low	109 Å²	109	122.5 Å²	122.5	71%	0.708	76%	0.755	S	S	*	*				-134.2	-169.4	-100.2	35.2	-12.8	0	0	0	113.8
537	L	30.4	Very low	30.1	Very low	150 Å²	150	122 Å²	122	79%	0.785	76%	0.756	S	S	*	*			trans	172.9	136.7	139.7	-107.1	58.1	0	0	0	107.2
538	S	30.8	Very low	30.1	Very low	96 Å²	96	125.2 Å²	125.2	67%	0.671	76%	0.759	S	S	*	*				64.6	141.2	78.1	111.1	0	0	0	0	113.4
539	S	30.4	Very low	30.1	Very low	91 Å²	91	124.3 Å²	124.3	64%	0.636	75%	0.753	S	S	*	*			cis	-176.7	160.1	6.4	44.7	0	0	0	0	111.5
540	L	30.3	Very low	30.2	Very low	167 Å²	167	122.4 Å²	122.4	87%	0.874	75%	0.746	S	S	*	*			trans	65.3	161	157.2	-93.2	65.6	0	0	0	116.3
541	S	31.8	Very low	30.2	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	75%	0.745	S	S	*	*			cis	-155	152.7	-6.3	39.3	0	0	0	0	111.8
542	S	30.9	Very low	30.3	Very low	108 Å²	108	121 Å²	121	76%	0.755	74%	0.741	S	S	*	*			trans	-81.9	-154	164.5	-38.3	0	0	0	0	110.2
543	P	38	Very low	30.5	Very low	111 Å²	111	119.8 Å²	119.8	72%	0.721	74%	0.738	S	S	*	*			cis	-137.6	-151.7	-15	23.5	4.6	0	0	0	112.9
544	I	31.6	Very low	30.7	Very low	142 Å²	142	122.7 Å²	122.7	73%	0.728	75%	0.746	S	S	*	*			trans	116.6	105.7	142.3	-69.2	165.6	0	0	0	119.3
545	V	30.8	Very low	30.6	Very low	132 Å²	132	122 Å²	122	80%	0.8	74%	0.744	S	S	*	*			trans	55.8	140.9	134	-177.1	0	0	0	0	120
546	G	28.3	Very low	30.7	Very low	63 Å²	63	121.8 Å²	121.8	65%	0.649	74%	0.739	S	S	*	*			cis	150.2	-167.7	-1.8	0	0	0	0	0	112.4
547	Q	31.9	Very low	30.5	Very low	173 Å²	173	122 Å²	122	81%	0.808	73%	0.734	S	S	*	*			trans	70.3	154.8	176.2	-64.9	-177.4	9.6	0	0	117
548	Q	26.2	Very low	30.5	Very low	168 Å²	168	122.1 Å²	122.1	79%	0.785	73%	0.73	S	S	*	*			cis	-167.8	172.1	-36.3	-123.6	-179.3	18.3	0	0	110.4
549	S	31.5	Very low	30.5	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	73%	0.732	S	S	*	*			trans	74.6	159.2	161.5	87.6	0	0	0	0	118.4
550	S	26.9	Very low	30.4	Very low	102 Å²	102	126 Å²	126	71%	0.713	73%	0.733	S	S	*	*			cis	-170.3	170	-32.9	59.3	0	0	0	0	111.8
551	S	31.1	Very low	30.3	Very low	115 Å²	115	124.1 Å²	124.1	80%	0.804	72%	0.723	S	S	*	*			trans	75.5	159.1	163	87.7	0	0	0	0	118.2
552	S	26.9	Very low	30.2	Very low	100 Å²	100	123.9 Å²	123.9	70%	0.699	71%	0.713	S	S	*	*			cis	-169.3	170.6	-35.6	61.6	0	0	0	0	111.9
553	S	31.7	Very low	30.1	Very low	100 Å²	100	124 Å²	124	70%	0.699	70%	0.704	S	S	*	*			trans	81.3	120.4	164.9	86.6	0	0	0	0	116.7
554	K	30.6	Very low	29.8	Very low	194 Å²	194	125.3 Å²	125.3	84%	0.843	70%	0.7	S	S	*	*				86.2	139	82.2	-74.8	-177.3	-178.4	178.5	0	112.2
555	C	28.5	Very low	29.6	Very low	98 Å²	98	123 Å²	123	66%	0.662	69%	0.686	S	S	*	*			cis	-170.9	149.4	-10	-113	0	0	0	0	109.9
556	N	29.7	Very low	29.6	Very low	125 Å²	125	122.9 Å²	122.9	67%	0.668	68%	0.681	S	S	*	*			trans	65.2	151.3	144.4	-64.9	45.9	0	0	0	119
557	D	31.8	Very low	29.6	Very low	113 Å²	113	123.7 Å²	123.7	60%	0.604	68%	0.676	S	S	*	*			cis	-159.2	154.4	-2.7	-115.2	-27	0	0	0	114.4
558	H	31.8	Very low	29.5	Very low	152 Å²	152	122.8 Å²	122.8	70%	0.704	68%	0.677	S	S	*	*			trans	55.2	111.3	149.1	-73	55.5	0	0	0	120.8
559	F	30	Very low	29.7	Very low	165 Å²	165	120.1 Å²	120.1	72%	0.724	68%	0.675	S	S	*	*				74.8	115.7	80.6	-85.4	-121.7	0	0	0	114.1
560	T	28.7	Very low	29.5	Very low	105 Å²	105	121.8 Å²	121.8	64%	0.644	68%	0.676	S	S	*	*				62.4	150.1	62.3	71.6	0	0	0	0	114
561	N	27.5	Very low	29.7	Very low	127 Å²	127	122.2 Å²	122.2	68%	0.679	68%	0.677	S	S	*	*			cis	-161.6	154.9	-9.1	-109.7	-2	0	0	0	107.3	S851	N561-S851 VanDerWaalsContact O-O 3.12Å
562	I	29.2	Very low	29.6	Very low	97 Å²	97	122.7 Å²	122.7	50%	0.497	68%	0.675	S	S	.	*			trans	-146.3	138.1	165.3	-74.1	96	0	0	0	112.1	M849	I562-M849 HydrophobicContact CG2-SD 3.73Å
563	I	29.5	Very low	30	Very low	110 Å²	110	124.1 Å²	124.1	56%	0.564	67%	0.674	S	S	*	*			trans	-87.4	-122.4	-157.1	-55.1	171.1	0	0	0	115.6	L848 M849 T850	I563-L848 CarbonylContact O-C 3.53Å; I563-M849 CarbonylContact C-O 3.38Å; I563-M849 CarbonylContact O-C 3.45Å; I563-M849 WeakPolarHBondContact O-CA 3.25Å; I563-M849 PolarHBondContact O-N 2.97Å; I563-T850 VanDerWaalsContact N-N 3.14Å; I563-T850 PolarHBondContact N-O 3.02Å
564	H	31.7	Very low	30.1	Very low	140 Å²	140	123.8 Å²	123.8	65%	0.648	67%	0.665	S	S	*	*			trans	-119.5	159.8	-154.8	-79	-156.2	0	0	0	116.2	L848 M849	H564-L848 CarbonylContact C-O 3.44Å; H564-L848 WeakPolarHBondContact CA-O 3.27Å; H564-M849 CarbonylContact C-O 3.3Å; H564-M849 VanDerWaalsContact C-O 3.3Å; H564-M849 PolarHBondContact N-O 3.14Å; H564-M849 VanDerWaalsContact N-O 3.1Å
565	Q	28.1	Very low	30.4	Very low	94 Å²	94	117.1 Å²	117.1	44%	0.439	64%	0.638	S	S	.	*			trans	-134.5	152.7	136.6	-86.2	-165.6	-94.6	0	0	113	L847 L848	Q565-L847 HydrophobicContact CB-CB 3.74Å; Q565-L847 HydrophobicContact CB-CD1 4.36Å; Q565-L847 HydrophobicContact CB-CD2 4.1Å; Q565-L847 HydrophobicContact CB-CG 4.27Å; Q565-L847 PolarHBondContact N-O 3.28Å; Q565-L847 VanDerWaalsContact O-O 3.06Å; Q565-L848 HydrophobicContact CB-CB 3.82Å; Q565-L848 HydrophobicContact CG-CB 3.72Å; Q565-L848 PolarHBondContact N-O 2.75Å; Q565-L848 VanDerWaalsContact OE1-CD2 3.29Å
566	D	30.2	Very low	30.6	Very low	128 Å²	128	119.1 Å²	119.1	68%	0.684	64%	0.638	S	S	*	*			trans	-81.2	168.1	-171.6	-46.1	-85.8	0	0	0	114.7
567	C	29.1	Very low	31	Very low	80 Å²	80	117.7 Å²	117.7	54%	0.541	63%	0.633	S	S	.	*			trans	-141.5	109.9	166	-81.7	0	0	0	0	110.5	N846	C567-N846 WeakPolarHBondContact SG-CB 3.49Å
568	D	28	Very low	31.2	Very low	155 Å²	155	119.6 Å²	119.6	83%	0.829	64%	0.639	S	S	*	*			trans	-69.5	132.1	174.5	-69.1	-63.4	0	0	0	112.1
569	C	30.6	Very low	31.4	Very low	112 Å²	112	117.2 Å²	117.2	76%	0.757	63%	0.631	S	S	*	*			trans	-129.3	71.4	171.2	55.1	0	0	0	0	112	C571	C569-C571 VanDerWaalsContact C-N 3.32Å; C569-C571 PolarHBondContact O-N 3.32Å
570	N	27.5	Very low	31.6	Very low	146 Å²	146	117.1 Å²	117.1	78%	0.781	63%	0.63	S	S	*	*			trans	-67.6	83	172.5	-87.7	-43.1	0	0	0	112.1
571	C	30.6	Very low	31.7	Very low	110 Å²	110	115.6 Å²	115.6	74%	0.743	63%	0.629	S	S	*	*			trans	-101.9	75	168	-74.7	0	0	0	0	110.5	C569 L573	C569-C571 VanDerWaalsContact C-N 3.32Å; C569-C571 PolarHBondContact O-N 3.32Å; C571-L573 PolarHBondContact O-N 3.02Å
572	T	30.3	Very low	31.7	Very low	125 Å²	125	119.5 Å²	119.5	77%	0.767	64%	0.64	S	S	*	*			trans	-71.9	95.3	175.3	50.8	0	0	0	0	111	N574	T572-N574 PolarHBondContact O-N 3.4Å
573	L	33.9	Very low	31.6	Very low	130 Å²	130	123.3 Å²	123.3	68%	0.681	65%	0.653	S	S	*	*			trans	-65.9	120.8	166.7	-97.9	92.1	0	0	0	109.8	C571 L575	C571-L573 PolarHBondContact O-N 3.02Å; L573-L575 PolarHBondContact O-N 3.08Å
574	N	34.5	Very low	31.6	Very low	93 Å²	93	125.8 Å²	125.8	50%	0.497	66%	0.662	S	S	.	*			trans	-86.6	81.9	170.8	-167.9	7.1	0	0	0	110.7	T572 E576 T577	T572-N574 PolarHBondContact O-N 3.4Å; N574-E576 PolarHBondContact O-N 2.89Å; N574-E576 VanDerWaalsContact O-N 3.07Å; N574-E576 WeakPolarHBondContact OD1-CB 3.24Å; N574-T577 PolarHBondContact ND2-OG1 3.5Å; N574-T577 PolarHBondContact O-N 3.31Å
575	L	36.6	Very low	31.3	Very low	54 Å²	54	124.1 Å²	124.1	28%	0.283	67%	0.666	S	S	.	*	H	α-helix	trans	-52.1	-28.8	-179.5	-78.1	160.2	0	0	0	113.9	L274 L573 T577 E578 L579	L274-L575 HydrophobicContact CD1-CD2 4.34Å; L573-L575 PolarHBondContact O-N 3.08Å; L575-T577 PolarHBondContact O-N 3.02Å; L575-E578 PolarHBondContact O-N 3.38Å; L575-L579 HydrophobicContact CB-CD1 4.39Å; L575-L579 HydrophobicContact CD2-CD1 4.47Å; L575-L579 PolarHBondContact O-N 3.47Å
576	E	32.7	Very low	31.4	Very low	140 Å²	140	124.1 Å²	124.1	65%	0.654	68%	0.682	S	S	*	*	H	α-helix	trans	-63.5	-24.9	178	-162.9	168.1	-119.8	0	0	112.8	N574	N574-E576 PolarHBondContact O-N 2.89Å; N574-E576 VanDerWaalsContact O-N 3.07Å; N574-E576 WeakPolarHBondContact OD1-CB 3.24Å
577	T	39.2	Very low	31.2	Very low	95 Å²	95	125.4 Å²	125.4	58%	0.583	69%	0.687	S	S	*	*	H	α-helix	trans	-87.7	-29.3	176.9	-46.1	0	0	0	0	112.8	N574 L575	N574-T577 PolarHBondContact ND2-OG1 3.5Å; N574-T577 PolarHBondContact O-N 3.31Å; L575-T577 PolarHBondContact O-N 3.02Å
578	E	35.8	Very low	31.3	Very low	154 Å²	154	127.1 Å²	127.1	72%	0.72	70%	0.697	S	S	*	*	H	α-helix	trans	-80.2	-33.2	-178.1	-70.9	-91.8	122.5	0	0	112.7	L575	L575-E578 PolarHBondContact O-N 3.38Å
579	L	36.5	Very low	31.2	Very low	102 Å²	102	126.6 Å²	126.6	53%	0.534	69%	0.694	S	S	.	*	S	Bend	trans	-89.2	-20.8	-167.4	-73.2	168.1	0	0	0	115.9	L575	L575-L579 HydrophobicContact CB-CD1 4.39Å; L575-L579 HydrophobicContact CD2-CD1 4.47Å; L575-L579 PolarHBondContact O-N 3.47Å
580	F	32.4	Very low	31.1	Very low	163 Å²	163	126.6 Å²	126.6	72%	0.715	69%	0.69	S	S	*	*	S	Bend	trans	-116.9	6.8	-169	-71	-74.6	0	0	0	115.6	F582	F580-F582 PolarHBondContact O-N 2.91Å; F580-F582 VanDerWaalsContact O-N 3.11Å
581	A	31	Very low	31	Very low	73 Å²	73	125.2 Å²	125.2	60%	0.603	69%	0.687	S	S	*	*			trans	-87.5	64.2	-171.8	0	0	0	0	0	114.9
582	F	28.7	Very low	31	Very low	209 Å²	209	126.7 Å²	126.7	92%	0.917	69%	0.693	S	S	*	*			trans	-172	108.7	148.1	-112.2	-68.5	0	0	0	114	F580	F580-F582 PolarHBondContact O-N 2.91Å; F580-F582 VanDerWaalsContact O-N 3.11Å
583	K	26.4	Very low	30.7	Very low	176 Å²	176	129.4 Å²	129.4	77%	0.765	69%	0.694	S	S	*	*			trans	-154.6	109.7	163.9	-157.4	175.9	-175	173.5	0	112.7
584	H	28.9	Very low	30.4	Very low	163 Å²	163	132.9 Å²	132.9	76%	0.755	70%	0.704	S	S	*	*			trans	63.7	155.6	173.9	-53.5	-46.5	0	0	0	116.7
585	S	26.3	Very low	30	Very low	105 Å²	105	133.8 Å²	133.8	73%	0.734	71%	0.714	S	S	*	*			cis	-166.2	167.1	-28.2	54.4	0	0	0	0	110.4
586	A	30.4	Very low	29.7	Very low	94 Å²	94	137.2 Å²	137.2	78%	0.777	74%	0.737	S	S	*	*			trans	63.2	110.5	158.2	0	0	0	0	0	121
587	I	26.4	Very low	29.4	Very low	154 Å²	154	137.3 Å²	137.3	79%	0.79	74%	0.742	S	S	*	*			trans	-63.4	138.2	152	-72.1	159.1	0	0	0	108.5
588	P	30.8	Very low	29.1	Very low	117 Å²	117	140 Å²	140	76%	0.76	75%	0.753	S	S	*	*				-150.6	126.1	84.5	36.1	-14.2	0	0	0	119.2
589	D	26.3	Very low	28.7	Very low	144 Å²	144	139.6 Å²	139.6	77%	0.77	76%	0.755	S	S	*	*				58.5	141.6	118.5	-96.9	-24.1	0	0	0	126
590	V	28.6	Very low	28.4	Very low	111 Å²	111	144.9 Å²	144.9	67%	0.673	77%	0.77	S	S	*	*			trans	76.1	94.3	144.8	176.9	0	0	0	0	120.5
591	T	25.9	Very low	28.2	Very low	117 Å²	117	143.7 Å²	143.7	72%	0.718	77%	0.77	S	S	*	*			trans	49.3	131.9	138.1	69.3	0	0	0	0	120.9
592	T	28.8	Very low	28.2	Very low	141 Å²	141	147.2 Å²	147.2	87%	0.865	78%	0.778	S	S	*	*				-167.2	175.1	76.5	27.3	0	0	0	0	112.8
593	K	24.6	Very low	28.3	Very low	182 Å²	182	143.2 Å²	143.2	79%	0.791	77%	0.766	S	S	*	*			trans	-99.9	151.2	-175.1	-55.8	171.7	-178.4	174.8	0	112.5
594	F	28.3	Very low	28.5	Very low	203 Å²	203	140.4 Å²	140.4	89%	0.89	76%	0.76	S	S	*	*			trans	169.8	107.6	137.8	-87.1	-60.8	0	0	0	107
595	T	25.5	Very low	28.5	Very low	113 Å²	113	139 Å²	139	69%	0.693	76%	0.758	S	S	*	*				74.9	134.4	62.7	-45.6	0	0	0	0	114.6
596	T	29.8	Very low	28.9	Very low	125 Å²	125	141.2 Å²	141.2	77%	0.767	76%	0.761	S	S	*	*			trans	98.1	111.1	-178.7	66.5	0	0	0	0	114.5
597	N	27.7	Very low	29.1	Very low	142 Å²	142	143 Å²	143	76%	0.759	76%	0.758	S	S	*	*				78.1	107.9	64.4	-75.8	4.5	0	0	0	114
598	N	31.4	Very low	29.4	Very low	153 Å²	153	141.7 Å²	141.7	82%	0.818	75%	0.753	S	S	*	*				-173.7	153.5	105.3	-90.4	-32	0	0	0	113
599	N	28.2	Very low	29.5	Very low	144 Å²	144	143.8 Å²	143.8	77%	0.77	76%	0.757	S	S	*	*			trans	-87.4	163.2	169.6	-56.7	-61.5	0	0	0	110.7
600	Y	30.1	Very low	29.9	Very low	213 Å²	213	142 Å²	142	84%	0.835	76%	0.756	S	S	*	*			trans	175.6	114.5	136.5	-84.4	-64.3	0	0	0	106.2
601	L	28.4	Very low	30.2	Very low	138 Å²	138	145 Å²	145	72%	0.723	76%	0.76	S	S	*	*				92.7	146.1	65.5	-100.7	158.4	0	0	0	114.2
602	L	30	Very low	30.6	Very low	148 Å²	148	145.4 Å²	145.4	78%	0.775	76%	0.757	S	S	*	*			trans	72.4	149.9	173.4	-86.6	79.8	0	0	0	117.9
603	N	31	Very low	30.9	Very low	124 Å²	124	144.6 Å²	144.6	66%	0.663	75%	0.748	S	S	*	*			cis	-160.6	155.4	-21.6	-146.8	3.5	0	0	0	114.6
604	N	30.7	Very low	31.4	Very low	117 Å²	117	142.9 Å²	142.9	63%	0.626	74%	0.743	S	S	*	*			trans	10.5	136.2	150.5	-72.2	-8.4	0	0	0	124.9
605	N	29.1	Very low	31.7	Very low	134 Å²	134	138.5 Å²	138.5	72%	0.717	73%	0.725	S	S	*	*				61	126.3	126.9	-55.7	-12.8	0	0	0	123.2
606	N	34.9	Very low	32.1	Very low	151 Å²	151	140.8 Å²	140.8	81%	0.807	73%	0.725	S	S	*	*			trans	177	153	140.4	-93.8	-41.3	0	0	0	109.6
607	N	34.7	Very low	32.2	Very low	131 Å²	131	141.9 Å²	141.9	70%	0.701	72%	0.721	S	S	*	*			cis	-158.6	-177.3	-30	-144.8	-46.9	0	0	0	109.3
608	N	31.6	Very low	32.5	Very low	128 Å²	128	141.6 Å²	141.6	68%	0.684	72%	0.72	S	S	*	*			trans	-85.2	179.1	-163.8	-64.9	-75.1	0	0	0	117.5
609	N	33.4	Very low	32.5	Very low	160 Å²	160	139.2 Å²	139.2	86%	0.856	72%	0.716	S	S	*	*			trans	95.4	136.6	163.6	-47.8	-50.8	0	0	0	114.6
610	S	35.6	Very low	33	Very low	108 Å²	108	137.6 Å²	137.6	76%	0.755	71%	0.713	S	S	*	*			cis	-162.1	-177.2	18.2	69.4	0	0	0	0	110.4
611	K	33.9	Very low	33	Very low	173 Å²	173	132.6 Å²	132.6	75%	0.752	71%	0.709	S	S	*	*			cis	-171.3	153.6	1.1	-137.3	-173	160.1	-161.9	0	109.8
612	L	33.8	Very low	32.9	Very low	125 Å²	125	130.2 Å²	130.2	65%	0.654	70%	0.704	S	S	*	*			trans	61.8	150.8	165.8	-77.3	62	0	0	0	117
613	D	35.4	Very low	32.9	Very low	124 Å²	124	129.9 Å²	129.9	66%	0.663	70%	0.702	S	S	*	*			cis	-156.2	151.8	-12	-108.1	-14.8	0	0	0	113.4
614	E	34.7	Very low	32.9	Very low	147 Å²	147	130.6 Å²	130.6	69%	0.687	70%	0.701	S	S	*	*			trans	33.4	146.4	139	-55.4	-133.2	114.9	0	0	122.8
615	Q	35.2	Very low	32.9	Very low	110 Å²	110	131.8 Å²	131.8	51%	0.514	70%	0.703	S	S	.	*			cis	-166.4	162.3	4.2	-127.5	-178.2	36.4	0	0	112.9
616	K	33.7	Very low	33	Very low	162 Å²	162	131.7 Å²	131.7	70%	0.704	70%	0.698	S	S	*	*			trans	70.1	143.2	157.5	-65.2	167.5	173.3	130.3	0	117.7
617	Q	33.3	Very low	32.6	Very low	147 Å²	147	133.4 Å²	133.4	69%	0.687	69%	0.693	S	S	*	*			cis	-156.3	142.8	-1.4	-125.2	170.2	3.1	0	0	113.3
618	N	32.7	Very low	32.4	Very low	137 Å²	137	132.5 Å²	132.5	73%	0.733	69%	0.685	S	S	*	*			trans	58.1	146	150.6	-58.7	-9.6	0	0	0	121.7
619	S	32.5	Very low	32.3	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	69%	0.686	S	S	*	*			cis	165.6	179.6	-34.9	60.3	0	0	0	0	108.1
620	P	37.6	Very low	32.2	Very low	110 Å²	110	131.4 Å²	131.4	71%	0.714	67%	0.674	S	S	*	*				-136.6	-160.4	-110.7	37.2	-12.8	0	0	0	115.1
621	S	29.7	Very low	32	Very low	108 Å²	108	131.9 Å²	131.9	76%	0.755	67%	0.669	S	S	*	*			trans	74.9	156.6	157.3	83.2	0	0	0	0	117.2
622	S	27.3	Very low	31.7	Very low	87 Å²	87	130.8 Å²	130.8	61%	0.608	67%	0.666	S	S	*	*			cis	-174	173.8	-22.1	51.3	0	0	0	0	110.1
623	L	29.8	Very low	31.5	Very low	141 Å²	141	131.5 Å²	131.5	74%	0.738	67%	0.67	S	S	*	*			trans	68.1	165.6	167	-49.5	165.3	0	0	0	114.5
624	Q	31.8	Very low	31.2	Very low	139 Å²	139	132.4 Å²	132.4	65%	0.65	67%	0.674	S	S	*	*			cis	-160	149.4	-28.9	-113.1	174.3	-24.3	0	0	110
625	Q	30.2	Very low	30.9	Very low	143 Å²	143	131.8 Å²	131.8	67%	0.668	67%	0.673	S	S	*	*			trans	60.5	149.5	142	-73.2	174.2	-26.9	0	0	123.9
626	Q	31.4	Very low	30.5	Very low	131 Å²	131	133.4 Å²	133.4	61%	0.612	69%	0.685	S	S	*	*			trans	76.8	123.7	152.6	-75.6	172.5	-119.4	0	0	117.6
627	R	26	Very low	30.3	Very low	187 Å²	187	128.7 Å²	128.7	71%	0.706	68%	0.683	S	S	*	*				69.8	138.9	75.8	-77.3	-162.6	-59.1	-161.7	-5.2	111.1
628	Q	30.8	Very low	30.1	Very low	113 Å²	113	127.5 Å²	127.5	53%	0.528	69%	0.691	S	S	.	*			cis	-162.7	171.5	26.1	-132.4	159.2	-64.7	0	0	111.5
629	E	30.3	Very low	29.9	Very low	148 Å²	148	126.2 Å²	126.2	69%	0.692	69%	0.692	S	S	*	*			trans	38.2	150	135.5	-80.1	150.3	-143.5	0	0	121.7
630	D	30.8	Very low	30	Very low	116 Å²	116	126.9 Å²	126.9	62%	0.62	69%	0.694	S	S	*	*			cis	-166.7	-179.2	8.6	-143.1	-17.4	0	0	0	113.8
631	N	31.9	Very low	29.6	Very low	119 Å²	119	129.1 Å²	129.1	64%	0.636	70%	0.699	S	S	*	*			trans	70.6	147	151.7	-68.2	-42.4	0	0	0	119.9
632	Q	27.7	Very low	29.5	Very low	149 Å²	149	129.4 Å²	129.4	70%	0.696	69%	0.692	S	S	*	*			cis	155	175.4	-23.1	-101.9	-165.3	88.2	0	0	106.7
633	L	28.8	Very low	29.6	Very low	141 Å²	141	131.5 Å²	131.5	74%	0.738	70%	0.697	S	S	*	*			trans	74.4	153.7	164	-51.1	-168.7	0	0	0	116.2
634	L	28.4	Very low	29.6	Very low	142 Å²	142	130.6 Å²	130.6	74%	0.743	70%	0.697	S	S	*	*			cis	-165.9	160.7	-24	-88.9	179.8	0	0	0	104.5
635	M	29.6	Very low	29.5	Very low	135 Å²	135	129.2 Å²	129.2	67%	0.665	70%	0.697	S	S	*	*			cis	-159.4	158.8	-1.2	-102.3	-96	-86.4	0	0	111.5
636	N	25.7	Very low	29.4	Very low	143 Å²	143	131 Å²	131	77%	0.765	70%	0.703	S	S	*	*			trans	16.5	139.1	148.8	-57.5	-4.3	0	0	0	123.7
637	G	29.4	Very low	29.2	Very low	64 Å²	64	129.4 Å²	129.4	66%	0.66	71%	0.706	S	S	*	*			trans	166.5	110.3	150.7	0	0	0	0	0	110.6
638	S	28.9	Very low	29.3	Very low	122 Å²	122	128 Å²	128	85%	0.853	71%	0.712	S	S	*	*				54	124.6	75.7	71.8	0	0	0	0	113.6
639	S	28.7	Very low	29.1	Very low	109 Å²	109	126.7 Å²	126.7	76%	0.762	72%	0.715	S	S	*	*			cis	-158.7	161.9	9.5	44.8	0	0	0	0	111.6
640	P	35.8	Very low	29	Very low	118 Å²	118	126.4 Å²	126.4	77%	0.766	73%	0.726	S	S	*	*			trans	-85.7	168.5	179.2	37.2	-37.3	0	0	0	113.1
641	L	28.5	Very low	28.9	Very low	157 Å²	157	125.4 Å²	125.4	82%	0.822	73%	0.728	S	S	*	*			trans	168.7	142.3	159	-90.4	155.3	0	0	0	106.1
642	D	28.5	Very low	28.7	Very low	114 Å²	114	127 Å²	127	61%	0.61	73%	0.732	S	S	*	*			cis	-167.6	148.4	-13.6	-147.3	15.8	0	0	0	110.7
643	N	29.3	Very low	28.7	Very low	131 Å²	131	128.8 Å²	128.8	70%	0.701	74%	0.742	S	S	*	*			trans	56.1	164.1	153.3	-69.5	-38.1	0	0	0	118.7
644	V	29	Very low	28.7	Very low	122 Å²	122	129.9 Å²	129.9	74%	0.739	75%	0.749	S	S	*	*			cis	-159.1	142.6	-9.1	117.7	0	0	0	0	105
645	V	29.5	Very low	28.6	Very low	109 Å²	109	132.8 Å²	132.8	66%	0.661	75%	0.75	S	S	*	*			cis	-162.4	-179.9	-4.6	72.8	0	0	0	0	111.5
646	K	28.8	Very low	28.4	Very low	181 Å²	181	132 Å²	132	79%	0.787	76%	0.755	S	S	*	*			trans	-30.2	154.6	162.9	-57.3	157.2	-164.8	171.6	0	115.5
647	S	26.8	Very low	28.5	Very low	98 Å²	98	130.8 Å²	130.8	69%	0.685	75%	0.753	S	S	*	*			cis	-174.3	151.2	0.5	41.2	0	0	0	0	108.9
648	L	27.3	Very low	28.3	Very low	158 Å²	158	133.5 Å²	133.5	83%	0.827	75%	0.751	S	S	*	*				-177.7	150.2	89.8	-95.1	159.9	0	0	0	112.3
649	S	28.3	Very low	28.2	Very low	84 Å²	84	137.5 Å²	137.5	59%	0.587	75%	0.748	S	S	*	*			trans	11.1	119	160.1	55.4	0	0	0	0	121.3	S651	S649-S651 PolarHBondContact O-N 2.94Å
650	P	27.9	Very low	27.9	Very low	142 Å²	142	141.1 Å²	141.1	92%	0.922	75%	0.746	S	S	*	*			trans	-80.9	94.5	167	33	-32.6	0	0	0	111.8
651	S	28.1	Very low	27.6	Very low	95 Å²	95	144.1 Å²	144.1	66%	0.664	75%	0.747	S	S	*	*			trans	-147.4	52.2	177.5	65.8	0	0	0	0	113.9	S649	S649-S651 PolarHBondContact O-N 2.94Å
652	Q	27.8	Very low	27.5	Very low	154 Å²	154	143.4 Å²	143.4	72%	0.72	74%	0.744	S	S	*	*			trans	-162.3	92.8	162	-118.6	168.4	89.5	0	0	110.9
653	M	27.3	Very low	27.6	Very low	185 Å²	185	145.8 Å²	145.8	91%	0.911	76%	0.757	S	S	*	*			trans	-104.4	149.2	158	-77.4	-178.8	163.5	0	0	108
654	N	29.2	Very low	27.6	Very low	164 Å²	164	144.5 Å²	144.5	88%	0.877	75%	0.754	S	S	*	*	S	Bend	trans	70.9	65.5	-169.2	-57	-13.1	0	0	0	115.9
655	R	25.9	Very low	27.6	Very low	203 Å²	203	145.7 Å²	145.7	77%	0.766	76%	0.756	S	S	*	*			trans	-139.5	144.4	148.3	-80.7	-164.5	167.9	-165.6	-4.9	110.7
656	P	26.8	Very low	27.8	Very low	118 Å²	118	148.4 Å²	148.4	77%	0.766	77%	0.767	S	S	*	*			trans	-72.7	146.8	173.1	31.1	-34.4	0	0	0	110.9	L658	P656-L658 PolarHBondContact O-N 2.97Å
657	V	26.4	Very low	27.7	Very low	119 Å²	119	146.8 Å²	146.8	72%	0.721	77%	0.767	S	S	*	*			trans	-83	109.9	171.4	179.4	0	0	0	0	108.3
658	L	25.7	Very low	27.9	Very low	120 Å²	120	151.7 Å²	151.7	63%	0.628	78%	0.776	S	S	*	*			trans	-95.8	125.2	171.5	-149.2	85.1	0	0	0	109.3	P656 Y660	P656-L658 PolarHBondContact O-N 2.97Å; L658-Y660 HydrophobicContact CD2-CD2 4.4Å; L658-Y660 HydrophobicContact CD2-CE1 4.09Å; L658-Y660 HydrophobicContact CD2-CE2 3.69Å
659	W	26.4	Very low	28.2	Very low	207 Å²	207	149.1 Å²	149.1	78%	0.784	78%	0.778	S	S	*	*			trans	-91.8	120.6	174.1	-68.9	87.4	0	0	0	109.8
660	Y	23.8	Very low	28.1	Very low	184 Å²	184	155 Å²	155	72%	0.722	79%	0.793	S	S	*	*			trans	-105.2	121.1	168	-70.7	-79.7	0	0	0	108.9	L658	L658-Y660 HydrophobicContact CD2-CD2 4.4Å; L658-Y660 HydrophobicContact CD2-CE1 4.09Å; L658-Y660 HydrophobicContact CD2-CE2 3.69Å
661	F	28.3	Very low	28.1	Very low	181 Å²	181	153.8 Å²	153.8	79%	0.794	79%	0.788	S	S	*	*			trans	-93.9	112	164	-76.7	-87.8	0	0	0	108.3
662	N	25.9	Very low	28.4	Very low	142 Å²	142	155.3 Å²	155.3	76%	0.759	80%	0.799	S	S	*	*			trans	-94.8	92.6	174.5	-77.6	-9.1	0	0	0	109.5
663	D	32.4	Very low	28.4	Very low	164 Å²	164	151.5 Å²	151.5	88%	0.877	80%	0.801	S	S	*	*			trans	-90.6	129.6	157.3	-82.2	-46.7	0	0	0	109.2
664	T	29	Very low	28.5	Very low	105 Å²	105	148.9 Å²	148.9	64%	0.644	80%	0.795	S	S	*	*			trans	-105.1	142.3	-174	54.2	0	0	0	0	112.1
665	N	29	Very low	28.5	Very low	146 Å²	146	147.4 Å²	147.4	78%	0.781	79%	0.791	S	S	*	*			trans	74.2	130.3	177.6	-33.1	-52.5	0	0	0	112.4
666	D	32	Very low	28.4	Very low	166 Å²	166	144.5 Å²	144.5	89%	0.888	79%	0.791	S	S	*	*			cis	-138.2	160.7	24.8	-93	-44	0	0	0	114.6
667	D	28.6	Very low	28.5	Very low	147 Å²	147	144.1 Å²	144.1	79%	0.786	79%	0.791	S	S	*	*			trans	-76.1	124.4	177	-81.7	-58.7	0	0	0	114.2
668	K	31.1	Very low	28.5	Very low	202 Å²	202	144.3 Å²	144.3	88%	0.878	79%	0.793	S	S	*	*				159.5	103.8	126	-84.9	152.6	-168	158.7	0	114.2
669	A	31.9	Very low	28.6	Very low	104 Å²	104	146.3 Å²	146.3	86%	0.86	80%	0.802	S	S	*	*			trans	-178.5	144.4	132.7	0	0	0	0	0	110
670	K	26.4	Very low	28.6	Very low	206 Å²	206	142.3 Å²	142.3	90%	0.896	80%	0.8	S	S	*	*			trans	-125	120.1	173.9	-68.4	179.9	178.1	-180	0	110
671	S	29.2	Very low	28.8	Very low	118 Å²	118	137.1 Å²	137.1	83%	0.825	80%	0.796	S	S	*	*			trans	169.5	163.7	146.2	54	0	0	0	0	112.5
672	S	33	Very low	28.7	Very low	127 Å²	127	136.4 Å²	136.4	89%	0.888	79%	0.792	S	S	*	*			trans	65.5	144.5	-170.5	79.2	0	0	0	0	114.2
673	G	28.2	Very low	28.8	Very low	74 Å²	74	136.3 Å²	136.3	76%	0.763	79%	0.792	S	S	*	*			trans	-124.1	130.6	-168.8	0	0	0	0	0	111.7
674	V	28.5	Very low	28.8	Very low	130 Å²	130	132.2 Å²	132.2	79%	0.788	78%	0.776	S	S	*	*			trans	-98.1	127.3	173.1	178.6	0	0	0	0	108.7
675	V	30	Very low	28.8	Very low	132 Å²	132	135.9 Å²	135.9	80%	0.8	79%	0.786	S	S	*	*			trans	-90.1	108.3	175.3	179.4	0	0	0	0	108.9	S677	V675-S677 PolarHBondContact O-N 3.13Å
676	N	24.6	Very low	28.9	Very low	143 Å²	143	134 Å²	134	77%	0.765	78%	0.782	S	S	*	*			trans	-73.4	93.7	176.6	-71.9	-11.8	0	0	0	110.9	T678	N676-T678 PolarHBondContact O-N 3.08Å
677	S	27.5	Very low	28.8	Very low	109 Å²	109	134 Å²	134	76%	0.762	78%	0.782	S	S	*	*			trans	-71.2	121.1	170.4	43	0	0	0	0	110.9	V675	V675-S677 PolarHBondContact O-N 3.13Å
678	T	26.9	Very low	28.7	Very low	124 Å²	124	138 Å²	138	76%	0.761	79%	0.786	S	S	*	*			trans	-88.9	118.3	179.2	-60.5	0	0	0	0	110.1	N676 V680	N676-T678 PolarHBondContact O-N 3.08Å; T678-V680 HydrophobicContact CG2-CG2 4.22Å; T678-V680 PolarHBondContact O-N 2.99Å
679	I	28.6	Very low	28.5	Very low	162 Å²	162	137.3 Å²	137.3	83%	0.831	79%	0.785	S	S	*	*			trans	-77.5	115.5	175.3	-58.7	176	0	0	0	109.1
680	V	25.5	Very low	28.5	Very low	122 Å²	122	144.8 Å²	144.8	74%	0.739	79%	0.792	S	S	*	*			trans	-109.5	97.1	172.8	-178.2	0	0	0	0	108.6	T678	T678-V680 HydrophobicContact CG2-CG2 4.22Å; T678-V680 PolarHBondContact O-N 2.99Å
681	A	29	Very low	28.6	Very low	76 Å²	76	142 Å²	142	63%	0.628	78%	0.781	S	S	*	*			trans	-73.3	124.9	169.6	0	0	0	0	0	109.5
682	K	26.4	Very low	28.4	Very low	166 Å²	166	142.1 Å²	142.1	72%	0.722	78%	0.779	S	S	*	*			trans	-108.1	134.5	174	-155.1	-160.5	170.4	-152.6	0	109	S684	K682-S684 PolarHBondContact O-N 2.93Å
683	D	28.2	Very low	28.2	Very low	140 Å²	140	142 Å²	142	75%	0.749	77%	0.769	S	S	*	*	S	Bend	trans	60	7.7	168.7	-49.9	-35.9	0	0	0	117.7
684	S	31.1	Very low	28.3	Very low	78 Å²	78	145 Å²	145	55%	0.545	77%	0.772	S	S	.	*			trans	-89.9	111.7	173.7	56	0	0	0	0	113.1	K682 C686	K682-S684 PolarHBondContact O-N 2.93Å; S684-C686 VanDerWaalsContact C-N 3.3Å; S684-C686 PolarHBondContact O-N 2.93Å
685	H	29.7	Very low	28.2	Very low	182 Å²	182	148.7 Å²	148.7	84%	0.843	78%	0.778	S	S	*	*			trans	-85.5	11.4	-165.5	-135.7	-74.5	0	0	0	115.5
686	C	31.1	Very low	28.1	Very low	106 Å²	106	150.3 Å²	150.3	72%	0.716	78%	0.777	S	S	*	*			trans	-101	-1.8	-154.3	-50.9	0	0	0	0	116.5	S684	S684-C686 VanDerWaalsContact C-N 3.3Å; S684-C686 PolarHBondContact O-N 2.93Å
687	L	29.2	Very low	28.2	Very low	166 Å²	166	150.1 Å²	150.1	87%	0.869	78%	0.776	S	S	*	*			trans	-119	77.9	-173.5	-72.8	174.1	0	0	0	113.2
688	R	26.7	Very low	28.3	Very low	232 Å²	232	151 Å²	151	88%	0.875	78%	0.776	S	S	*	*			trans	-142	152.4	162.5	-64.5	-172.6	-177.1	-108	-3.5	109.5
689	Q	27.9	Very low	28.6	Very low	186 Å²	186	152.1 Å²	152.1	87%	0.869	78%	0.778	S	S	*	*			trans	68.6	73.7	-179.8	-58	-177.8	-25.4	0	0	117.1
690	W	30.8	Very low	28.6	Very low	261 Å²	261	148.2 Å²	148.2	99%	0.989	78%	0.777	S	S	*	*			trans	-133.6	147	140.7	-90.6	83.3	0	0	0	109.1
691	H	28	Very low	28.9	Very low	147 Å²	147	147.6 Å²	147.6	68%	0.681	78%	0.779	S	S	*	*			trans	-95.4	144.6	-162.9	-144.2	-100.2	0	0	0	112.6	D693	H691-D693 VanDerWaalsContact C-N 3.28Å; H691-D693 IonicContact CE1-OD2 2.68Å; H691-D693 PolarHBondContact CE1-OD2 3.13Å; H691-D693 IonicContact CG-OD2 3.38Å; H691-D693 IonicContact ND1-OD2 3.46Å; H691-D693 PolarHBondContact ND1-OD2 2.77Å; H691-D693 PolarHBondContact O-N 3.11Å; H691-D693 VanDerWaalsContact O-N 3.07Å
692	P	26.2	Very low	29.1	Very low	121 Å²	121	151.6 Å²	151.6	79%	0.786	79%	0.79	S	S	*	*	S	Bend	trans	-85.1	56.3	-179.9	36.8	-37.3	0	0	0	113
693	D	27.9	Very low	29.3	Very low	124 Å²	124	155 Å²	155	66%	0.663	80%	0.798	S	S	*	*			trans	-132.2	61	-179.6	-77.2	-61.3	0	0	0	112.6	H691	H691-D693 VanDerWaalsContact C-N 3.28Å; H691-D693 IonicContact CE1-OD2 2.68Å; H691-D693 PolarHBondContact CE1-OD2 3.13Å; H691-D693 IonicContact CG-OD2 3.38Å; H691-D693 IonicContact ND1-OD2 3.46Å; H691-D693 PolarHBondContact ND1-OD2 2.77Å; H691-D693 PolarHBondContact O-N 3.11Å; H691-D693 VanDerWaalsContact O-N 3.07Å
694	V	29.9	Very low	29.6	Very low	138 Å²	138	157.4 Å²	157.4	84%	0.836	80%	0.804	S	S	*	*			trans	-134.1	75.4	167.4	-170	0	0	0	0	109.7
695	F	26.8	Very low	29.5	Very low	207 Å²	207	158.9 Å²	158.9	91%	0.908	81%	0.813	S	S	*	*			trans	-130.7	161.9	167.8	-108.4	-87.8	0	0	0	109.9
696	E	28.1	Very low	29.4	Very low	167 Å²	167	157.8 Å²	157.8	78%	0.78	81%	0.812	S	S	*	*			trans	77.8	140.9	173.5	-49.7	-158.8	146	0	0	119.5
697	N	26.2	Very low	29.3	Very low	138 Å²	138	159.2 Å²	159.2	74%	0.738	81%	0.812	S	S	*	*			trans	67.4	121	173.5	-51.5	-61	0	0	0	115.3
698	V	30.8	Very low	29.2	Very low	127 Å²	127	157.8 Å²	157.8	77%	0.77	81%	0.805	S	S	*	*	S	Bend		-135.4	125.2	53.3	171.8	0	0	0	0	114.1
699	N	33	Very low	29.2	Very low	148 Å²	148	153 Å²	153	79%	0.791	80%	0.797	S	S	*	*			trans	50.8	130.4	150.4	-57.3	-0.4	0	0	0	122.5
700	G	27.1	Very low	29.3	Very low	80 Å²	80	148.9 Å²	148.9	83%	0.825	79%	0.785	S	S	*	*			trans	-138.5	144.8	153.6	0	0	0	0	0	111.8
701	S	33.8	Very low	29.1	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	77%	0.773	S	S	*	*			trans	-157.9	136.5	170.9	49.3	0	0	0	0	105.6
702	D	33	Very low	29.1	Very low	160 Å²	160	144.6 Å²	144.6	86%	0.856	78%	0.778	S	S	*	*			cis	-113	171.3	41.4	-65.4	-49.9	0	0	0	117.4
703	R	30.6	Very low	29.1	Very low	236 Å²	236	145.8 Å²	145.8	89%	0.891	78%	0.776	S	S	*	*			trans	-144.6	149.9	164.1	-77.5	-178.3	170.1	-177.6	-1.9	109.2
704	H	33.1	Very low	29.1	Very low	191 Å²	191	146.2 Å²	146.2	88%	0.884	78%	0.775	S	S	*	*			trans	-153.9	165	140.1	-113.7	-79.2	0	0	0	111.5
705	C	28.7	Very low	29	Very low	109 Å²	109	148.5 Å²	148.5	74%	0.736	77%	0.773	S	S	*	*			trans	-88.8	-176.1	-164	-49.4	0	0	0	0	112.5
706	I	29.3	Very low	29	Very low	159 Å²	159	142.2 Å²	142.2	82%	0.815	76%	0.76	S	S	*	*			cis	-152.1	156.6	44.7	-71.5	176.6	0	0	0	112.6
707	L	28.8	Very low	29.2	Very low	136 Å²	136	141.6 Å²	141.6	71%	0.712	76%	0.76	S	S	*	*			trans	-26.5	150.2	175.3	-85.6	64.6	0	0	0	121.3
708	N	26.8	Very low	29.3	Very low	137 Å²	137	140 Å²	140	73%	0.733	76%	0.759	S	S	*	*				35.3	145.1	126.1	-48	-6.9	0	0	0	119.9
709	N	27.2	Very low	29.5	Very low	131 Å²	131	138.9 Å²	138.9	70%	0.701	76%	0.755	S	S	*	*			cis	-160.9	158	27	-147.5	5.2	0	0	0	114.3
710	T	28.3	Very low	29.3	Very low	100 Å²	100	137.1 Å²	137.1	61%	0.613	76%	0.755	S	S	*	*			trans	42.5	116.1	153.8	50.1	0	0	0	0	122.4
711	N	27.3	Very low	29.7	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	75%	0.749	S	S	*	*				76.5	126.1	127.5	-74.4	-44	0	0	0	123.3
712	K	27.4	Very low	29.5	Very low	177 Å²	177	137.9 Å²	137.9	77%	0.77	75%	0.745	S	S	*	*			trans	81	128.8	137.4	-79.5	-178.9	178.3	178.3	0	120.5
713	L	27.3	Very low	29.3	Very low	145 Å²	145	137.3 Å²	137.3	76%	0.759	74%	0.741	S	S	*	*			trans	71.2	146.4	150.3	-62.7	165.4	0	0	0	116.9
714	Q	28	Very low	29.1	Very low	134 Å²	134	136.8 Å²	136.8	63%	0.626	74%	0.739	S	S	*	*			cis	-169.3	142.9	-28.7	-148	-170.9	49	0	0	107.9
715	K	27.2	Very low	29.1	Very low	185 Å²	185	136.2 Å²	136.2	80%	0.804	74%	0.74	S	S	*	*			trans	61.9	159.8	165.9	-69.5	164.9	178.9	167.7	0	115.4
716	A	28.1	Very low	29	Very low	76 Å²	76	135.2 Å²	135.2	63%	0.628	74%	0.74	S	S	*	*			cis	-171	-169.9	-23.3	0	0	0	0	0	106.8
717	I	32.1	Very low	29	Very low	154 Å²	154	132 Å²	132	79%	0.79	74%	0.737	S	S	*	*			trans	68.1	91.7	159.5	-58.4	153.6	0	0	0	113.6
718	S	27.6	Very low	29.2	Very low	103 Å²	103	132.3 Å²	132.3	72%	0.72	75%	0.745	S	S	*	*				78.6	169.7	70.7	88.4	0	0	0	0	113.4
719	P	35.8	Very low	29.3	Very low	104 Å²	104	131.2 Å²	131.2	68%	0.675	75%	0.748	S	S	*	*				-137.5	147.4	-105.1	35.6	-15	0	0	0	118.9
720	S	28.7	Very low	29.8	Very low	112 Å²	112	130.3 Å²	130.3	78%	0.783	75%	0.749	S	S	*	*			trans	61.4	-177.1	156.5	78.7	0	0	0	0	115.9
721	P	35.3	Very low	29.7	Very low	109 Å²	109	130.6 Å²	130.6	71%	0.708	75%	0.754	S	S	*	*			cis	-124.6	-166.5	-26.2	32.5	-13.5	0	0	0	112.2
722	S	28.9	Very low	30	Very low	97 Å²	97	128.7 Å²	128.7	68%	0.678	76%	0.758	S	S	*	*			trans	123.3	147	139.1	-53	0	0	0	0	119.5
723	L	29.7	Very low	30	Very low	148 Å²	148	126.4 Å²	126.4	78%	0.775	75%	0.753	S	S	*	*			trans	63.1	114.8	157.8	-63.7	160.1	0	0	0	117.6
724	R	26.7	Very low	30.1	Very low	225 Å²	225	125.6 Å²	125.6	85%	0.849	75%	0.754	S	S	*	*				64.1	114.5	72.1	-71.2	-165.4	-171.8	-172.4	3	114.9
725	I	32.3	Very low	30.1	Very low	178 Å²	178	123.8 Å²	123.8	91%	0.913	76%	0.756	S	S	*	*				-174.7	166	117.1	-93.1	157.1	0	0	0	108.1
726	A	26.8	Very low	30.2	Very low	89 Å²	89	121.1 Å²	121.1	74%	0.736	76%	0.755	S	S	*	*			trans	-122.1	169.7	-162.6	0	0	0	0	0	114.8
727	A	28.2	Very low	30.5	Very low	90 Å²	90	123.5 Å²	123.5	74%	0.744	77%	0.767	S	S	*	*			trans	67.2	119.6	160.6	0	0	0	0	0	119.3
728	T	32.6	Very low	30.4	Very low	143 Å²	143	123.1 Å²	123.1	88%	0.877	77%	0.767	S	S	*	*				-172.6	152.9	102.5	22.7	0	0	0	0	112.3
729	S	30.2	Very low	30.7	Very low	114 Å²	114	122.9 Å²	122.9	80%	0.797	76%	0.763	S	S	*	*			trans	-103.7	-175	170.1	-41.3	0	0	0	0	108.8
730	P	36.9	Very low	30.6	Very low	112 Å²	112	125.1 Å²	125.1	73%	0.727	76%	0.764	S	S	*	*			cis	-140.2	-176.6	-1.9	43.2	-24.5	0	0	0	116.3
731	C	26.6	Very low	30.9	Very low	107 Å²	107	127 Å²	127	72%	0.723	76%	0.76	S	S	*	*			trans	31.4	119.8	146.2	-66.5	0	0	0	0	123.7	I733	C731-I733 HydrophobicContact CB-CD1 3.89Å; C731-I733 HydrophobicContact CB-CG1 4.15Å
732	A	33	Very low	30.7	Very low	101 Å²	101	129.3 Å²	129.3	84%	0.835	76%	0.761	S	S	*	*				-147.3	123	122.7	0	0	0	0	0	107.2
733	I	27.7	Very low	30.5	Very low	128 Å²	128	131.2 Å²	131.2	66%	0.656	76%	0.763	S	S	*	*			cis	87.9	122.9	33.6	-58.7	-178.6	0	0	0	113.5	C731	C731-I733 HydrophobicContact CB-CD1 3.89Å; C731-I733 HydrophobicContact CB-CG1 4.15Å
734	T	29.3	Very low	30.5	Very low	128 Å²	128	133.2 Å²	133.2	79%	0.785	77%	0.768	S	S	*	*			trans	68.3	150.7	165	46.1	0	0	0	0	121
735	S	28.3	Very low	30.4	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	77%	0.766	S	S	*	*			cis	179.9	-176.5	-34.7	49.6	0	0	0	0	111.1
736	V	30.1	Very low	30.2	Very low	128 Å²	128	130.2 Å²	130.2	78%	0.776	76%	0.764	S	S	*	*			trans	78.6	101.2	160.7	-163.8	0	0	0	0	118.5
737	S	32.9	Very low	30.1	Very low	126 Å²	126	133.1 Å²	133.1	88%	0.881	77%	0.767	S	S	*	*				-159.1	144.8	102.2	11.8	0	0	0	0	111.4
738	N	29.8	Very low	30.1	Very low	147 Å²	147	140.5 Å²	140.5	79%	0.786	78%	0.777	S	S	*	*			trans	-139.5	163.1	-179.5	-164.2	8.9	0	0	0	106.3
739	P	35.6	Very low	29.7	Very low	97 Å²	97	137.2 Å²	137.2	63%	0.63	77%	0.765	S	S	*	*				-157.3	149.3	95	37.8	-17.9	0	0	0	118.4
740	Q	33.9	Very low	29.6	Very low	152 Å²	152	138.9 Å²	138.9	71%	0.71	77%	0.765	S	S	*	*			trans	70.2	150.1	137.3	-67.8	166.9	-11.8	0	0	119.4
741	Q	33.2	Very low	29.3	Very low	150 Å²	150	140 Å²	140	70%	0.701	77%	0.77	S	S	*	*			cis	-151.1	145	1	-132.5	151.7	15.1	0	0	113.9
742	H	31.1	Very low	29.5	Very low	158 Å²	158	141 Å²	141	73%	0.731	77%	0.772	S	S	*	*			trans	7.1	132.8	160	-66.3	-106.6	0	0	0	120.8
743	I	26	Very low	29.2	Very low	137 Å²	137	141.5 Å²	141.5	70%	0.703	77%	0.77	S	S	*	*			cis	78	117.1	39.9	-57.3	169.9	0	0	0	115.1
744	H	28.9	Very low	29.5	Very low	191 Å²	191	140.9 Å²	140.9	88%	0.884	78%	0.777	S	S	*	*			trans	-139.8	142.3	139.6	-128.2	-84.7	0	0	0	109.6
745	Q	24.6	Very low	29.5	Very low	172 Å²	172	141 Å²	141	80%	0.804	77%	0.77	S	S	*	*			trans	-105.2	157.8	177.1	-69.5	178.6	-30.2	0	0	111.1
746	L	28.3	Very low	29.8	Very low	167 Å²	167	141.7 Å²	141.7	87%	0.874	77%	0.772	S	S	*	*			trans	-160.9	134.8	143.6	-108.3	168.2	0	0	0	110.4
747	N	24.4	Very low	30	Very low	151 Å²	151	144.7 Å²	144.7	81%	0.807	77%	0.77	S	S	*	*			trans	-99.8	155.4	166.9	-75.6	-22.4	0	0	0	109.2
748	Y	28.1	Very low	29.9	Very low	244 Å²	244	144.7 Å²	144.7	96%	0.957	76%	0.76	S	S	*	*			trans	-164	173.7	130.7	-116.1	-80.1	0	0	0	109.9
749	A	25.8	Very low	29.9	Very low	75 Å²	75	147.4 Å²	147.4	62%	0.62	76%	0.761	S	S	*	*			trans	-122.8	-178.6	-156.5	0	0	0	0	0	115.7
750	D	26.4	Very low	29.3	Very low	149 Å²	149	147.6 Å²	147.6	80%	0.797	77%	0.77	S	S	*	*			trans	73.2	121.9	160.8	-56.1	-34.9	0	0	0	120.7
751	T	31.9	Very low	29.1	Very low	135 Å²	135	145.9 Å²	145.9	83%	0.828	77%	0.77	S	S	*	*				-173.5	127.3	112	20.5	0	0	0	0	114.3
752	V	30.6	Very low	28.9	Very low	128 Å²	128	147.4 Å²	147.4	78%	0.776	78%	0.778	S	S	*	*			trans	58.4	107.3	147.6	-173.5	0	0	0	0	118.1
753	S	27	Very low	28.6	Very low	112 Å²	112	148.3 Å²	148.3	78%	0.783	79%	0.787	S	S	*	*				69.4	134.5	76.5	170.5	0	0	0	0	114.1
754	S	32.7	Very low	28.7	Very low	115 Å²	115	151 Å²	151	80%	0.804	79%	0.794	S	S	*	*			cis	-142	177.4	31.7	59.3	0	0	0	0	115.9
755	M	30.8	Very low	28.7	Very low	129 Å²	129	150.6 Å²	150.6	64%	0.635	79%	0.794	S	S	*	*			trans	-142.5	169.4	-174.6	-146.3	175.3	153.5	0	0	109.8	W757	M755-W757 HydrophobicContact CE-CD2 3.7Å; M755-W757 HydrophobicContact CE-CE3 4.39Å; M755-W757 HydrophobicContact CE-CG 3.82Å; M755-W757 HydrophobicContact CE-CZ2 4.12Å; M755-W757 HydrophobicContact SD-CD2 4.44Å; M755-W757 HydrophobicContact SD-CG 4.38Å; M755-W757 HydrophobicContact SD-CZ2 4.35Å; M755-W757 PolarHBondContact SD-NE1 3.15Å
756	P	34.6	Very low	28.7	Very low	113 Å²	113	151.3 Å²	151.3	73%	0.734	80%	0.8	S	S	*	*				-135.6	154.9	79.4	15.8	8.9	0	0	0	114.2
757	W	32.5	Very low	28.8	Very low	190 Å²	190	148.8 Å²	148.8	72%	0.72	79%	0.793	S	S	*	*				57.9	138.3	75.2	-54.8	102.3	0	0	0	113.4	M755	M755-W757 HydrophobicContact CE-CD2 3.7Å; M755-W757 HydrophobicContact CE-CE3 4.39Å; M755-W757 HydrophobicContact CE-CG 3.82Å; M755-W757 HydrophobicContact CE-CZ2 4.12Å; M755-W757 HydrophobicContact SD-CD2 4.44Å; M755-W757 HydrophobicContact SD-CG 4.38Å; M755-W757 HydrophobicContact SD-CZ2 4.35Å; M755-W757 PolarHBondContact SD-NE1 3.15Å
758	D	32.2	Very low	28.9	Very low	126 Å²	126	146.9 Å²	146.9	67%	0.674	79%	0.792	S	S	*	*			cis	-155.2	-170.5	24.6	-152.2	-9.1	0	0	0	114.6
759	Y	29.2	Very low	29	Very low	204 Å²	204	142.1 Å²	142.1	80%	0.8	79%	0.788	S	S	*	*			trans	85.3	91.5	174.2	-82.5	-85.9	0	0	0	118.8
760	A	23.9	Very low	28.9	Very low	101 Å²	101	147.2 Å²	147.2	84%	0.835	80%	0.797	S	S	*	*			trans	-135	114.8	156.7	0	0	0	0	0	110.5
761	T	28.6	Very low	28.9	Very low	116 Å²	116	149 Å²	149	71%	0.712	80%	0.8	S	S	*	*			trans	-142.8	148.7	175.9	-27.1	0	0	0	0	110.9
762	E	29.4	Very low	28.7	Very low	182 Å²	182	147.6 Å²	147.6	85%	0.85	80%	0.802	S	S	*	*			trans	64.9	68.4	166.1	-51.8	-136.2	127.3	0	0	118.8
763	L	25.4	Very low	28.5	Very low	177 Å²	177	151.4 Å²	151.4	93%	0.927	81%	0.808	S	S	*	*			trans	-102.1	88.9	140.4	-95	175.3	0	0	0	110
764	K	26.7	Very low	28.4	Very low	194 Å²	194	152.8 Å²	152.8	84%	0.843	81%	0.806	S	S	*	*			trans	-167.5	154.5	162.4	-109.5	153.6	-172	174.1	0	111.9
765	M	29.4	Very low	28	Very low	183 Å²	183	153.5 Å²	153.5	90%	0.901	81%	0.81	S	S	*	*			trans	69.9	94	178.1	-52.9	-158.4	-177.5	0	0	117.1
766	M	25.1	Very low	27.7	Very low	186 Å²	186	153.8 Å²	153.8	92%	0.916	81%	0.812	S	S	*	*			trans	-74.2	148.5	141	-60.2	-179.8	85.9	0	0	108.5
767	P	29.5	Very low	27.2	Very low	114 Å²	114	155.4 Å²	155.4	74%	0.74	81%	0.813	S	S	*	*				-135.8	159	115.4	37.8	-29.6	0	0	0	113.5
768	S	27	Very low	26.8	Very low	112 Å²	112	151.6 Å²	151.6	78%	0.783	81%	0.813	S	S	*	*			trans	-83.6	126.2	176.8	56.3	0	0	0	0	112.9
769	T	30.2	Very low	26.5	Very low	143 Å²	143	156.1 Å²	156.1	88%	0.877	82%	0.822	S	S	*	*			trans	-151.3	162.9	158.9	4	0	0	0	0	111.9
770	K	24.8	Very low	26.3	Very low	183 Å²	183	154.5 Å²	154.5	80%	0.796	82%	0.822	S	S	*	*			trans	-99.4	154.3	-169.1	-56.2	176.2	179	178.4	0	112.8
771	H	25.9	Very low	26.7	Very low	185 Å²	185	154.7 Å²	154.7	86%	0.856	81%	0.814	S	S	*	*			trans	55.1	99.4	160.7	-56.7	-65.6	0	0	0	118.3
772	A	28.3	Very low	26.5	Very low	106 Å²	106	156 Å²	156	88%	0.876	82%	0.815	S	S	*	*			trans	-136.6	131.3	148.6	0	0	0	0	0	109.7
773	K	25.5	Very low	26.2	Very low	208 Å²	208	153.4 Å²	153.4	90%	0.904	82%	0.816	S	S	*	*			trans	-76.8	136	-176.1	-82.6	174.3	167	179.4	0	112.2
774	L	23.9	Very low	26.3	Very low	142 Å²	142	151.2 Å²	151.2	74%	0.743	80%	0.804	S	S	*	*			trans	28.5	110.1	131.8	-153.2	81.6	0	0	0	118	I776	L774-I776 HydrophobicContact CD1-CD1 4.14Å; L774-I776 HydrophobicContact CD1-CG1 4.15Å; L774-I776 HydrophobicContact CD2-CD1 4.17Å; L774-I776 HydrophobicContact CG-CD1 4.26Å; L774-I776 HydrophobicContact CG-CG1 4.17Å
775	C	25.4	Very low	26.1	Very low	130 Å²	130	147.5 Å²	147.5	88%	0.878	80%	0.8	S	S	*	*			trans	-128.3	108.7	151.8	-113.5	0	0	0	0	108
776	I	24	Very low	26	Very low	135 Å²	135	145.3 Å²	145.3	69%	0.692	79%	0.791	S	S	*	*			trans	-92.5	120.9	172.9	-65.2	167.5	0	0	0	107.2	L774	L774-I776 HydrophobicContact CD1-CD1 4.14Å; L774-I776 HydrophobicContact CD1-CG1 4.15Å; L774-I776 HydrophobicContact CD2-CD1 4.17Å; L774-I776 HydrophobicContact CG-CD1 4.26Å; L774-I776 HydrophobicContact CG-CG1 4.17Å
777	I	24.6	Very low	26	Very low	146 Å²	146	143.9 Å²	143.9	75%	0.749	79%	0.786	S	S	*	*			trans	-101.3	114.6	165.2	-59.6	177.4	0	0	0	106.4
778	P	24.3	Very low	25.9	Very low	110 Å²	110	143.8 Å²	143.8	71%	0.714	78%	0.783	S	S	*	*			trans	-71.7	141	171.7	31	-33	0	0	0	109.4
779	Y	25.3	Very low	25.6	Very low	221 Å²	221	144.5 Å²	144.5	87%	0.867	79%	0.786	S	S	*	*			trans	-131	120.5	166.1	-133.1	-83.6	0	0	0	108.8
780	E	25.4	Very low	25.4	Very low	170 Å²	170	145.8 Å²	145.8	79%	0.794	78%	0.782	S	S	*	*			trans	-122.4	176	-179.9	-127	-161.6	-143.9	0	0	108.8
781	P	31.3	Very low	25.4	Very low	105 Å²	105	144.3 Å²	144.3	68%	0.682	78%	0.783	S	S	*	*				-109.4	159.9	-114.5	38	-27.7	0	0	0	113.7
782	I	25.8	Very low	25.3	Very low	143 Å²	143	141.7 Å²	141.7	73%	0.733	78%	0.779	S	S	*	*			trans	-133.5	112.8	167.8	-52.5	-178.4	0	0	0	109.7	I784	I782-I784 HydrophobicContact CG2-CD1 4.25Å; I782-I784 HydrophobicContact CG2-CG1 3.68Å
783	C	23.3	Very low	25.1	Very low	129 Å²	129	144.5 Å²	144.5	87%	0.872	78%	0.779	S	S	*	*			trans	-76.8	125.4	160.6	-66	0	0	0	0	109
784	I	25.7	Very low	25	Very low	131 Å²	131	142.7 Å²	142.7	67%	0.672	77%	0.773	S	S	*	*			trans	-118.4	118.5	170.1	-55.2	-177.4	0	0	0	108.3	I782	I782-I784 HydrophobicContact CG2-CD1 4.25Å; I782-I784 HydrophobicContact CG2-CG1 3.68Å
785	P	24	Very low	25.1	Very low	115 Å²	115	140.1 Å²	140.1	75%	0.747	77%	0.772	S	S	*	*			trans	-77.2	125.7	170.8	31.3	-31.5	0	0	0	109.6
786	L	27.3	Very low	25	Very low	137 Å²	137	138.6 Å²	138.6	72%	0.717	76%	0.763	S	S	*	*			trans	-114.2	85.2	177.4	-115	165.4	0	0	0	110.6	T788	L786-T788 HydrophobicContact CD2-CG2 3.6Å
787	I	23.6	Very low	25	Very low	157 Å²	157	139.9 Å²	139.9	81%	0.805	77%	0.77	S	S	*	*			trans	-85.1	106.6	165	-61.5	173.9	0	0	0	107.3
788	T	27.3	Very low	25	Very low	112 Å²	112	138.8 Å²	138.8	69%	0.687	76%	0.764	S	S	*	*			trans	-128.2	65.2	175.6	32.8	0	0	0	0	112	L786 Q790	L786-T788 HydrophobicContact CD2-CG2 3.6Å; T788-Q790 PolarHBondContact O-N 2.68Å
789	C	22.6	Very low	24.9	Very low	126 Å²	126	140.9 Å²	140.9	85%	0.851	77%	0.774	S	S	*	*			trans	-77.5	97.4	158.1	-82.3	0	0	0	0	109.5
790	Q	25.7	Very low	24.7	Very low	170 Å²	170	134.3 Å²	134.3	79%	0.794	76%	0.761	S	S	*	*			trans	-147.9	97.9	167.7	-141.8	156	-0.6	0	0	114.8	T788	T788-Q790 PolarHBondContact O-N 2.68Å
791	L	23.3	Very low	24.7	Very low	153 Å²	153	131.6 Å²	131.6	80%	0.801	76%	0.76	S	S	*	*			trans	42.6	101.6	136.9	-65.7	164.8	0	0	0	119.3
792	V	24.1	Very low	24.4	Very low	130 Å²	130	134.6 Å²	134.6	79%	0.788	77%	0.77	S	S	*	*				18	116.5	126.5	-175.7	0	0	0	0	116.9
793	L	24.4	Very low	24.3	Very low	165 Å²	165	135 Å²	135	86%	0.864	77%	0.773	S	S	*	*			trans	-138.7	149.8	139.9	-105.5	173.7	0	0	0	110.7
794	H	24	Very low	24.6	Very low	170 Å²	170	135.9 Å²	135.9	79%	0.787	77%	0.768	S	S	*	*			trans	-46.3	161	-171.4	-81.6	-125.6	0	0	0	117
795	A	25.2	Very low	24.6	Very low	87 Å²	87	135.4 Å²	135.4	72%	0.719	77%	0.767	S	S	*	*			cis	-144.5	145.5	25	0	0	0	0	0	115.8
796	S	23.3	Very low	24.9	Very low	98 Å²	98	137.8 Å²	137.8	69%	0.685	77%	0.766	S	S	*	*			trans	-85.9	136.8	163.6	-49.4	0	0	0	0	111.2
797	I	24.9	Very low	25	Very low	163 Å²	163	135.4 Å²	135.4	84%	0.836	76%	0.761	S	S	*	*			trans	-132.6	82.5	154.4	-56	178.4	0	0	0	105.1
798	I	23.7	Very low	25.4	Very low	122 Å²	122	135.5 Å²	135.5	63%	0.626	76%	0.761	S	S	*	*				56.2	95.1	80.5	-54.9	-179.3	0	0	0	111	S800	I798-S800 PolarHBondContact O-N 2.77Å
799	V	22.1	Very low	25.5	Very low	154 Å²	154	135 Å²	135	93%	0.933	76%	0.758	S	S	*	*			trans	-78.5	99.9	164	175.3	0	0	0	0	108.2
800	S	22.9	Very low	25.9	Very low	83 Å²	83	139.3 Å²	139.3	58%	0.58	76%	0.756	S	S	*	*			trans	-164	106.2	161.9	60.3	0	0	0	0	114.3	I798	I798-S800 PolarHBondContact O-N 2.77Å
801	S	23.4	Very low	26.2	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	76%	0.756	S	S	*	*			trans	75.3	150.5	132.3	-52	0	0	0	0	122.4
802	L	25.7	Very low	26.5	Very low	168 Å²	168	141 Å²	141	88%	0.88	75%	0.754	S	S	*	*			trans	84.7	112.9	157.6	-68	156.2	0	0	0	119.8
803	N	24.5	Very low	26.8	Very low	151 Å²	151	142.1 Å²	142.1	81%	0.807	75%	0.751	S	S	*	*			trans	-66.9	159.8	156.9	-61.3	-55.4	0	0	0	111.1
804	I	28	Very low	27.1	Very low	148 Å²	148	140.4 Å²	140.4	76%	0.759	75%	0.747	S	S	*	*				175.2	127.9	113.6	-91.1	157.7	0	0	0	110.8
805	D	26.9	Very low	27.3	Very low	122 Å²	122	138.4 Å²	138.4	65%	0.652	74%	0.742	S	S	*	*			trans	62.2	156.8	158.7	-77	-7.4	0	0	0	120.3
806	K	30.7	Very low	27.7	Very low	164 Å²	164	141.2 Å²	141.2	71%	0.713	74%	0.744	S	S	*	*			cis	-149.2	139.6	6.9	-130.4	160.9	-167.3	95.3	0	112.4
807	S	28.3	Very low	28	Very low	88 Å²	88	145 Å²	145	62%	0.615	75%	0.751	S	S	*	*			trans	20.1	126.1	148.9	61.6	0	0	0	0	122.4
808	I	32.3	Very low	28.1	Very low	159 Å²	159	141.8 Å²	141.8	82%	0.815	75%	0.748	S	S	*	*				-174.8	88.2	123.6	-90	147.9	0	0	0	106.6
809	T	30.5	Very low	28.5	Very low	102 Å²	102	144.1 Å²	144.1	63%	0.626	76%	0.76	S	S	*	*				52.9	108.5	86.4	72.9	0	0	0	0	116.5
810	R	29.9	Very low	28.9	Very low	215 Å²	215	142.1 Å²	142.1	81%	0.811	75%	0.749	S	S	*	*				166.9	125.5	106.8	-89.6	165.9	-176.5	-165.7	2.1	114
811	K	31.3	Very low	29.4	Very low	179 Å²	179	145.2 Å²	145.2	78%	0.778	76%	0.759	S	S	*	*			trans	59.1	142.2	139.4	-59.7	176.5	-179.2	-179.1	0	118.1
812	K	30.9	Very low	29.7	Very low	179 Å²	179	146.5 Å²	146.5	78%	0.778	76%	0.756	S	S	*	*			cis	-161.7	135.8	-3.5	-107.9	179.7	173.6	-162.9	0	104.3
813	H	29.6	Very low	30	Very low	155 Å²	155	144 Å²	144	72%	0.718	74%	0.741	S	S	*	*				50.5	114	77.9	-142.5	-19.5	0	0	0	114.8	D815	H813-D815 IonicContact CE1-OD2 2.68Å; H813-D815 PolarHBondContact CE1-OD2 3.3Å; H813-D815 VanDerWaalsContact CE1-OD2 3.28Å; H813-D815 IonicContact ND1-OD2 2.76Å; H813-D815 PolarHBondContact ND1-OD2 2.77Å
814	V	32.1	Very low	30.2	Very low	129 Å²	129	146.2 Å²	146.2	78%	0.782	74%	0.737	S	S	*	*				-179.3	134.5	119.7	151.1	0	0	0	0	109.3
815	D	27.3	Very low	30.2	Very low	127 Å²	127	144.5 Å²	144.5	68%	0.679	73%	0.734	S	S	*	*			trans	-107.7	141.4	-174.9	-38.3	-105.8	0	0	0	109.1	H813	H813-D815 IonicContact CE1-OD2 2.68Å; H813-D815 PolarHBondContact CE1-OD2 3.3Å; H813-D815 VanDerWaalsContact CE1-OD2 3.28Å; H813-D815 IonicContact ND1-OD2 2.76Å; H813-D815 PolarHBondContact ND1-OD2 2.77Å
816	I	33.3	Very low	30.3	Very low	147 Å²	147	146.6 Å²	146.6	75%	0.754	74%	0.737	S	S	*	*			trans	-143.9	109.3	159.4	-60	-172.9	0	0	0	109.7
817	E	30.1	Very low	30.3	Very low	177 Å²	177	147.9 Å²	147.9	83%	0.827	74%	0.739	S	S	*	*				21.9	118.6	129.5	-60.3	171.3	163.8	0	0	117.6
818	A	27.2	Very low	30.3	Very low	95 Å²	95	148 Å²	148	79%	0.785	74%	0.74	S	S	*	*				79.9	127.4	68.7	0	0	0	0	0	115
819	I	32	Very low	30.1	Very low	172 Å²	172	145.9 Å²	145.9	88%	0.882	73%	0.73	S	S	*	*			trans	-164.7	153.5	156.6	-101.1	152.4	0	0	0	107.2
820	T	29.8	Very low	29.9	Very low	112 Å²	112	150 Å²	150	69%	0.687	73%	0.734	S	S	*	*			trans	-112.8	-164.2	-164.8	50.4	0	0	0	0	113.1
821	D	32.9	Very low	29.6	Very low	148 Å²	148	149 Å²	149	79%	0.791	74%	0.736	S	S	*	*			trans	82.8	147.8	158.7	-47.5	-11.9	0	0	0	117.7
822	D	29.8	Very low	29.3	Very low	139 Å²	139	144.7 Å²	144.7	74%	0.743	73%	0.728	S	S	*	*			cis	-165.6	173.2	-34.1	-163.8	4.8	0	0	0	108.3
823	E	32.6	Very low	28.9	Very low	117 Å²	117	142.3 Å²	142.3	55%	0.547	73%	0.729	S	S	.	*			trans	68.8	155.7	159.6	-58.4	-139.4	124.3	0	0	118.5
824	R	29.7	Very low	28.7	Very low	197 Å²	197	141.6 Å²	141.6	74%	0.743	73%	0.73	S	S	*	*			cis	-150.7	149.6	-7.2	-129.2	173.8	-162.7	155.8	21.2	113.9
825	T	26.6	Very low	28.2	Very low	111 Å²	111	141.3 Å²	141.3	68%	0.681	73%	0.728	S	S	*	*			trans	-31.2	147.6	163.8	59.2	0	0	0	0	119.9
826	K	29.9	Very low	28	Very low	167 Å²	167	142.8 Å²	142.8	73%	0.726	74%	0.736	S	S	*	*			trans	164.6	149.5	130.9	-89.7	158.4	-179.3	173.3	0	110
827	Y	30.8	Very low	27.5	Very low	191 Å²	191	145.6 Å²	145.6	75%	0.749	74%	0.738	S	S	*	*			cis	-148.1	167	0.9	-113.1	-52.7	0	0	0	110.9
828	S	26.9	Very low	27.1	Very low	90 Å²	90	145.7 Å²	145.7	63%	0.629	74%	0.741	S	S	*	*			trans	-24.5	163.1	158.7	58.7	0	0	0	0	119.5
829	D	28.3	Very low	26.9	Very low	115 Å²	115	145.2 Å²	145.2	62%	0.615	73%	0.732	S	S	*	*			cis	-162.9	163.2	17.9	-138.3	-14.8	0	0	0	115.5
830	R	26.5	Very low	26.6	Very low	189 Å²	189	142.7 Å²	142.7	71%	0.713	73%	0.729	S	S	*	*			trans	33.5	126.6	146.6	-75.5	155.2	-146.6	-149.2	-0.9	123.9
831	K	24.5	Very low	26.3	Very low	193 Å²	193	145.6 Å²	145.6	84%	0.839	73%	0.732	S	S	*	*			trans	70.3	155.9	133.7	-62.6	176.1	-179.2	-173.9	0	117
832	S	24.1	Very low	26	Very low	89 Å²	89	146.8 Å²	146.8	62%	0.622	74%	0.738	S	S	*	*			cis	-139.2	147	3.7	49.4	0	0	0	0	112.5	N834	S832-N834 PolarHBondContact O-N 2.74Å
833	T	22.8	Very low	25.9	Very low	129 Å²	129	145.7 Å²	145.7	79%	0.791	74%	0.741	S	S	*	*			trans	-62.4	127.3	160.8	38.4	0	0	0	0	110.9
834	N	24.6	Very low	25.5	Very low	139 Å²	139	148.3 Å²	148.3	74%	0.743	75%	0.753	S	S	*	*			trans	-127.5	86.8	165	-86.2	-27.3	0	0	0	108.9	S832 L836	S832-N834 PolarHBondContact O-N 2.74Å; N834-L836 PolarHBondContact O-N 2.87Å
835	V	23.3	Very low	25.5	Very low	123 Å²	123	143.8 Å²	143.8	75%	0.745	75%	0.752	S	S	*	*			trans	-78.2	96.3	169.4	178.3	0	0	0	0	107.7	Y837	V835-Y837 HydrophobicContact CG1-CD2 3.99Å; V835-Y837 PolarHBondContact O-N 2.62Å; V835-Y837 VanDerWaalsContact O-N 3.07Å
836	L	22.5	Very low	25.6	Very low	159 Å²	159	144.4 Å²	144.4	83%	0.832	75%	0.751	S	S	*	*			trans	-79.8	85.8	173.4	-88.1	168.7	0	0	0	110.4	N834 M838	N834-L836 PolarHBondContact O-N 2.87Å; L836-M838 PolarHBondContact O-N 3.41Å
837	Y	22.7	Very low	25.6	Very low	205 Å²	205	139.5 Å²	139.5	80%	0.804	73%	0.732	S	S	*	*			trans	-74.3	86.4	173.2	-133.3	-80.7	0	0	0	110.1	V835 S839	V835-Y837 HydrophobicContact CG1-CD2 3.99Å; V835-Y837 PolarHBondContact O-N 2.62Å; V835-Y837 VanDerWaalsContact O-N 3.07Å; Y837-S839 VanDerWaalsContact C-N 3.3Å; Y837-S839 PolarHBondContact O-N 3.08Å
838	M	22.5	Very low	25.6	Very low	180 Å²	180	135 Å²	135	89%	0.887	72%	0.721	S	S	*	*			trans	-80.1	78.6	170.9	-81.9	-169.4	63.9	0	0	111.1	L836	L836-M838 PolarHBondContact O-N 3.41Å
839	S	23.2	Very low	25.6	Very low	85 Å²	85	135.7 Å²	135.7	59%	0.594	72%	0.715	S	S	*	*			trans	-76.9	119.3	164.4	-179.5	0	0	0	0	109.7	Y837	Y837-S839 VanDerWaalsContact C-N 3.3Å; Y837-S839 PolarHBondContact O-N 3.08Å
840	S	25.1	Very low	25.5	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	71%	0.709	S	S	*	*			trans	-97.2	108.4	164.2	-167.3	0	0	0	0	108.6
841	K	22.9	Very low	25.6	Very low	174 Å²	174	128.1 Å²	128.1	76%	0.757	70%	0.697	S	S	*	*			trans	-86.6	109.6	-179.7	-81.6	-170.6	170.8	-168.2	0	111.8
842	L	26	Very low	25.7	Very low	172 Å²	172	124.7 Å²	124.7	90%	0.901	69%	0.692	S	S	*	*			trans	-155.1	119	150.4	-90.1	168.9	0	0	0	104
843	S	28.4	Very low	25.8	Very low	116 Å²	116	125.6 Å²	125.6	81%	0.811	70%	0.699	S	S	*	*			cis	-124.6	164.3	26.5	47.6	0	0	0	0	114.2
844	E	25.3	Very low	26.1	Very low	172 Å²	172	128.9 Å²	128.9	80%	0.804	71%	0.705	S	S	*	*			trans	-98.2	128.4	169.5	-63.8	-175.7	137.9	0	0	110.5
845	S	29.4	Very low	26.3	Very low	103 Å²	103	126 Å²	126	72%	0.72	71%	0.708	S	S	*	*			trans	-169.5	111.2	152.8	-81.1	0	0	0	0	110.2
846	N	28.6	Very low	26.6	Very low	123 Å²	123	129.4 Å²	129.4	66%	0.658	71%	0.713	S	S	*	*			trans	61.7	147.7	133.5	-62.3	-9.2	0	0	0	120.1	C567	C567-N846 WeakPolarHBondContact SG-CB 3.49Å
847	L	29.4	Very low	27	Very low	64 Å²	64	129.7 Å²	129.7	34%	0.335	71%	0.707	S	S	.	*			cis	-162.9	134.3	-1	-124.1	173.7	0	0	0	110.8	Q565	Q565-L847 HydrophobicContact CB-CB 3.74Å; Q565-L847 HydrophobicContact CB-CD1 4.36Å; Q565-L847 HydrophobicContact CB-CD2 4.1Å; Q565-L847 HydrophobicContact CB-CG 4.27Å; Q565-L847 PolarHBondContact N-O 3.28Å; Q565-L847 VanDerWaalsContact O-O 3.06Å
848	L	29.7	Very low	27.4	Very low	98 Å²	98	126.5 Å²	126.5	51%	0.513	70%	0.7	S	S	.	*			trans	38.2	150.6	162.5	-94.6	80.2	0	0	0	120.2	I563 H564 Q565	I563-L848 CarbonylContact O-C 3.53Å; H564-L848 CarbonylContact C-O 3.44Å; H564-L848 WeakPolarHBondContact CA-O 3.27Å; Q565-L848 HydrophobicContact CB-CB 3.82Å; Q565-L848 HydrophobicContact CG-CB 3.72Å; Q565-L848 PolarHBondContact N-O 2.75Å; Q565-L848 VanDerWaalsContact OE1-CD2 3.29Å
849	M	27	Very low	27.9	Very low	103 Å²	103	126.4 Å²	126.4	51%	0.507	69%	0.694	S	S	.	*				75.3	144.8	56.5	-68.6	-90.4	-72.9	0	0	117	I562 I563 H564	I562-M849 HydrophobicContact CG2-SD 3.73Å; I563-M849 CarbonylContact C-O 3.38Å; I563-M849 CarbonylContact O-C 3.45Å; I563-M849 WeakPolarHBondContact O-CA 3.25Å; I563-M849 PolarHBondContact O-N 2.97Å; H564-M849 CarbonylContact C-O 3.3Å; H564-M849 VanDerWaalsContact C-O 3.3Å; H564-M849 PolarHBondContact N-O 3.14Å; H564-M849 VanDerWaalsContact N-O 3.1Å
850	T	27.8	Very low	28.2	Very low	78 Å²	78	129.3 Å²	129.3	48%	0.479	70%	0.701	S	S	.	*			trans	159.6	87.5	174.4	82.5	0	0	0	0	114.9	I563	I563-T850 VanDerWaalsContact N-N 3.14Å; I563-T850 PolarHBondContact N-O 3.02Å
851	S	27.1	Very low	28.3	Very low	67 Å²	67	130.2 Å²	130.2	47%	0.469	70%	0.697	S	S	.	*			trans	72.2	136	151.6	80.7	0	0	0	0	120.1	N561	N561-S851 VanDerWaalsContact O-O 3.12Å
852	V	26.3	Very low	28.6	Very low	121 Å²	121	127.3 Å²	127.3	73%	0.733	69%	0.693	S	S	*	*			cis	-163.9	146.8	-2.9	115.9	0	0	0	0	113.2
853	S	28	Very low	28.5	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	68%	0.682	S	S	*	*			trans	-167.7	115.2	138.1	34.3	0	0	0	0	114.3
854	Q	28.1	Very low	28.5	Very low	197 Å²	197	128 Å²	128	92%	0.921	68%	0.682	S	S	*	*			trans	45.1	101.7	147.2	-51.2	-171.6	15.7	0	0	120.2
855	G	29.7	Very low	28.5	Very low	78 Å²	78	127.1 Å²	127.1	80%	0.804	68%	0.678	S	S	*	*			trans	-152.8	13.6	178.7	0	0	0	0	0	119.7
856	K	29.6	Very low	28.3	Very low	195 Å²	195	127.9 Å²	127.9	85%	0.848	68%	0.683	S	S	*	*			trans	39.1	118.9	170.2	-72.3	178.1	177.8	170.9	0	120
857	K	30.6	Very low	28.3	Very low	165 Å²	165	125.7 Å²	125.7	72%	0.717	68%	0.682	S	S	*	*			trans	66.1	152.9	151	-64.9	164.1	152.1	-92.2	0	116.2
858	E	31.2	Very low	28.1	Very low	139 Å²	139	131.6 Å²	131.6	65%	0.65	71%	0.706	S	S	*	*			cis	-144.4	124.3	-13.7	-114.6	143.3	-174.9	0	0	106
859	K	31.8	Very low	28.1	Very low	178 Å²	178	131.4 Å²	131.4	77%	0.774	71%	0.709	S	S	*	*				75.1	123	82.8	-135.5	-165.6	-177	-172.9	0	113.9
860	I	30.9	Very low	28.1	Very low	145 Å²	145	133 Å²	133	74%	0.744	73%	0.726	S	S	*	*			trans	77.7	146.5	160.9	-63.5	153.8	0	0	0	117.4
861	L	27.5	Very low	28.1	Very low	138 Å²	138	134.7 Å²	134.7	72%	0.723	74%	0.737	S	S	*	*			cis	-171.3	149.4	-40.9	-158.7	73.9	0	0	0	108.8
862	T	27.3	Very low	28.2	Very low	112 Å²	112	139.8 Å²	139.8	69%	0.687	76%	0.758	S	S	*	*			trans	57.7	133.3	153.2	36.3	0	0	0	0	121.8
863	S	25.7	Very low	28.1	Very low	95 Å²	95	142.7 Å²	142.7	66%	0.664	76%	0.761	S	S	*	*			trans	51.5	119.9	145.9	62.3	0	0	0	0	120.2
864	Y	27.1	Very low	28	Very low	209 Å²	209	149.3 Å²	149.3	82%	0.82	77%	0.769	S	S	*	*				-157.6	-175.1	94	-124.5	-95	0	0	0	111.6
865	E	26.1	Very low	27.9	Very low	153 Å²	153	150.4 Å²	150.4	72%	0.715	77%	0.765	S	S	*	*			trans	-75.9	162.3	-171.2	-55.8	164.2	102.4	0	0	115.1
866	S	26	Very low	27.7	Very low	118 Å²	118	156 Å²	156	83%	0.825	77%	0.767	S	S	*	*			trans	81.6	163	144.4	84.7	0	0	0	0	120.9
867	A	26.7	Very low	27.7	Very low	77 Å²	77	153 Å²	153	64%	0.636	76%	0.76	S	S	*	*			trans	75.6	98.8	156.7	0	0	0	0	0	121.5
868	F	26.4	Very low	27.4	Very low	189 Å²	189	152.8 Å²	152.8	83%	0.829	76%	0.762	S	S	*	*				53.5	104.6	126.1	-74.6	-79.7	0	0	0	121.6
869	T	29.8	Very low	27.1	Very low	94 Å²	94	154.2 Å²	154.2	58%	0.577	77%	0.766	S	S	*	*				37.2	133.6	122.5	61.8	0	0	0	0	121.1	T871	T869-T871 PolarHBondContact O-N 3.35Å
870	P	27.5	Very low	26.7	Very low	135 Å²	135	152.4 Å²	152.4	88%	0.877	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-62.1	124.5	153.7	29.5	-32.7	0	0	0	109.4
871	T	27.9	Very low	26.4	Very low	114 Å²	114	150.5 Å²	150.5	70%	0.699	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-87.9	127	-174	37.3	0	0	0	0	112.5	T869	T869-T871 PolarHBondContact O-N 3.35Å
872	L	27.9	Very low	26.3	Very low	175 Å²	175	150.2 Å²	150.2	92%	0.916	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-93.1	118.5	144.4	-99.8	170.1	0	0	0	108.4
873	K	25.2	Very low	26.3	Very low	182 Å²	182	151.4 Å²	151.4	79%	0.791	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-66.5	133.6	-177.5	-63	166.1	180	167.9	0	110.5
874	W	26.2	Very low	26.4	Very low	247 Å²	247	150.7 Å²	150.7	94%	0.936	76%	0.758	S	S	*	*				-142.7	157.7	121.5	-101.8	92.3	0	0	0	109.5
875	R	25.3	Very low	26.4	Very low	220 Å²	220	147.5 Å²	147.5	83%	0.83	76%	0.756	S	S	*	*			trans	-78.8	141	-157.3	-79.4	175.5	163.6	146.9	-8.4	114.6
876	K	25.1	Very low	26.5	Very low	195 Å²	195	145.5 Å²	145.5	85%	0.848	75%	0.754	S	S	*	*			trans	-67.5	132.5	142.5	-87.1	-177.2	175	176.8	0	109.3
877	N	29.3	Very low	26.6	Very low	132 Å²	132	144.9 Å²	144.9	71%	0.706	75%	0.745	S	S	*	*			trans	-159.3	125	134.5	-88	-16.1	0	0	0	103.9
878	Q	24.9	Very low	26.7	Very low	161 Å²	161	146.4 Å²	146.4	75%	0.752	75%	0.747	S	S	*	*				61.4	148.3	61.4	-77.6	-163.9	-24.2	0	0	114.3
879	F	25.3	Very low	26.6	Very low	170 Å²	170	142.9 Å²	142.9	75%	0.746	74%	0.741	S	S	*	*			trans	72.4	107	-163.1	-58.4	-86.3	0	0	0	112.3
880	I	23.1	Very low	26.5	Very low	140 Å²	140	143.3 Å²	143.3	72%	0.718	74%	0.743	S	S	*	*				79.5	141	55.2	-63.6	165.5	0	0	0	110.6
881	C	24	Very low	26.5	Very low	105 Å²	105	142 Å²	142	71%	0.709	73%	0.733	S	S	*	*			trans	71.1	139	-176	-70.9	0	0	0	0	114.9
882	N	25.6	Very low	26.4	Very low	131 Å²	131	142.9 Å²	142.9	70%	0.701	73%	0.734	S	S	*	*			cis	-160.7	177.5	-19.5	-130.1	-12.3	0	0	0	111.3
883	N	26.4	Very low	26.4	Very low	137 Å²	137	141.3 Å²	141.3	73%	0.733	73%	0.725	S	S	*	*			trans	-6.5	139.7	132.2	-80	-2	0	0	0	115.2
884	S	28.2	Very low	26.4	Very low	80 Å²	80	139.7 Å²	139.7	56%	0.559	72%	0.724	S	S	*	*			cis	175.8	-176.1	17.5	42	0	0	0	0	109.6
885	N	28.6	Very low	26.5	Very low	143 Å²	143	133.8 Å²	133.8	77%	0.765	72%	0.715	S	S	*	*			trans	71.1	150.8	153.5	-62.4	-17.9	0	0	0	115.9
886	T	28.1	Very low	26.5	Very low	110 Å²	110	129.7 Å²	129.7	68%	0.675	72%	0.715	S	S	*	*			cis	-129.3	145.7	-3.1	14.1	0	0	0	0	106.8
887	T	27.2	Very low	26.8	Very low	106 Å²	106	123.6 Å²	123.6	65%	0.65	71%	0.708	S	S	*	*				36.6	147.5	92.9	82.9	0	0	0	0	113.9
888	T	27.8	Very low	26.7	Very low	109 Å²	109	124.5 Å²	124.5	67%	0.669	71%	0.712	S	S	*	*			cis	-165	127	44.4	-22.3	0	0	0	0	104.3
889	T	26.2	Very low	26.9	Very low	115 Å²	115	124 Å²	124	71%	0.706	72%	0.715	S	S	*	*				78.6	135.7	98.1	-68.5	0	0	0	0	113.8
890	T	26.4	Very low	27.1	Very low	102 Å²	102	121.3 Å²	121.3	63%	0.626	71%	0.712	S	S	*	*			cis	-169.7	-172.6	-20.2	39.9	0	0	0	0	105.5
891	T	27.2	Very low	27.2	Very low	108 Å²	108	118.9 Å²	118.9	66%	0.663	71%	0.708	S	S	*	*			trans	56.6	141.3	138.5	53.3	0	0	0	0	120.5
892	N	26.7	Very low	27.4	Very low	133 Å²	133	121 Å²	121	71%	0.711	71%	0.712	S	S	*	*			cis	-168.8	-148.5	-8.6	-106.4	-4.8	0	0	0	104.1
893	I	27.4	Very low	27.6	Very low	141 Å²	141	118.6 Å²	118.6	72%	0.723	71%	0.71	S	S	*	*			trans	75.7	94.7	155.2	-59.4	143.3	0	0	0	111.5
894	L	26.2	Very low	27.6	Very low	148 Å²	148	117.9 Å²	117.9	78%	0.775	71%	0.711	S	S	*	*				69.5	141.8	89.1	-63	157.2	0	0	0	111.4
895	T	28.5	Very low	27.5	Very low	123 Å²	123	122.3 Å²	122.3	76%	0.755	72%	0.72	S	S	*	*			cis	-153.4	170.5	20.6	-21.5	0	0	0	0	112.3
896	T	24.8	Very low	27.4	Very low	135 Å²	135	122.2 Å²	122.2	83%	0.828	72%	0.719	S	S	*	*			trans	-58.2	151.6	170	49.7	0	0	0	0	115.7
897	G	30.4	Very low	27.4	Very low	67 Å²	67	121 Å²	121	69%	0.691	72%	0.715	S	S	*	*			trans	171.4	97.1	163.4	0	0	0	0	0	108.5
898	N	26.8	Very low	27.4	Very low	150 Å²	150	125.2 Å²	125.2	80%	0.802	72%	0.72	S	S	*	*				44.5	98	78.4	-74	14.8	0	0	0	113.1
899	D	30.8	Very low	27.8	Very low	150 Å²	150	124.1 Å²	124.1	80%	0.802	72%	0.715	S	S	*	*				174.4	158.4	110.4	-85.7	-14.2	0	0	0	109.6
900	V	28	Very low	28.1	Very low	115 Å²	115	125.9 Å²	125.9	70%	0.697	72%	0.715	S	S	*	*			cis	172.9	134	-35.6	137.9	0	0	0	0	104.4
901	S	26.2	Very low	28.2	Very low	89 Å²	89	127.7 Å²	127.7	62%	0.622	72%	0.717	S	S	*	*			trans	75.3	153	161.2	79.6	0	0	0	0	121.8
902	N	28	Very low	28.4	Very low	150 Å²	150	127.4 Å²	127.4	80%	0.802	72%	0.718	S	S	*	*			trans	76.2	133	151.4	-60.6	-26.2	0	0	0	119.6
903	A	29.4	Very low	28.5	Very low	80 Å²	80	127 Å²	127	66%	0.661	72%	0.715	S	S	*	*			cis	-157.7	144.7	-9.1	0	0	0	0	0	113.7
904	T	27.5	Very low	28.6	Very low	122 Å²	122	126.8 Å²	126.8	75%	0.748	72%	0.715	S	S	*	*			trans	44.1	104.9	135.2	-45.1	0	0	0	0	118.5
905	F	24.7	Very low	28.7	Very low	172 Å²	172	127.2 Å²	127.2	75%	0.754	72%	0.715	S	S	*	*				59.8	133.2	89.7	-106.9	-98.3	0	0	0	115.9
906	L	27.7	Very low	28.7	Very low	142 Å²	142	126.8 Å²	126.8	74%	0.743	71%	0.712	S	S	*	*				-168.7	105.3	122.7	-106	171.6	0	0	0	112.3	Y908	L906-Y908 HydrophobicContact CD2-CD2 3.58Å; L906-Y908 HydrophobicContact CD2-CE2 3.49Å; L906-Y908 VanDerWaalsContact CD2-CE2 3.49Å; L906-Y908 HydrophobicContact CD2-CG 4.27Å
907	S	26.6	Very low	28.8	Very low	83 Å²	83	128.6 Å²	128.6	58%	0.58	71%	0.711	S	S	*	*			trans	-101	141.1	163.6	53.8	0	0	0	0	109.5
908	Y	29.1	Very low	28.5	Very low	195 Å²	195	129.3 Å²	129.3	77%	0.765	71%	0.706	S	S	*	*			trans	-156.7	159.7	176.1	-99.3	-20.9	0	0	0	112.2	L906	L906-Y908 HydrophobicContact CD2-CD2 3.58Å; L906-Y908 HydrophobicContact CD2-CE2 3.49Å; L906-Y908 VanDerWaalsContact CD2-CE2 3.49Å; L906-Y908 HydrophobicContact CD2-CG 4.27Å
909	P	35.4	Very low	28.5	Very low	87 Å²	87	128.2 Å²	128.2	57%	0.565	70%	0.704	S	S	*	*				-153.2	-170	-75	40.7	-19.3	0	0	0	117.9
910	H	33.1	Very low	28.5	Very low	151 Å²	151	126.3 Å²	126.3	70%	0.699	70%	0.698	S	S	*	*			trans	65.4	154.4	143.2	-67	-46.6	0	0	0	120.3
911	Q	28.5	Very low	28.4	Very low	141 Å²	141	128.8 Å²	128.8	66%	0.659	70%	0.7	S	S	*	*			cis	-168.5	177.9	-28	-174.5	159.1	-17.4	0	0	108.4
912	C	30.4	Very low	28.6	Very low	102 Å²	102	131.2 Å²	131.2	69%	0.689	70%	0.701	S	S	*	*			trans	85.2	133.1	165.8	-59.6	0	0	0	0	115.9
913	D	29.7	Very low	28.6	Very low	123 Å²	123	131.1 Å²	131.1	66%	0.658	70%	0.696	S	S	*	*			cis	-165.2	-179.6	-15.7	-112.7	-42.8	0	0	0	107.8
914	L	29	Very low	28.3	Very low	137 Å²	137	137.2 Å²	137.2	72%	0.717	70%	0.703	S	S	*	*			cis	-147.4	-152.1	14.9	-158.5	52.4	0	0	0	110.8
915	M	27.6	Very low	28.2	Very low	158 Å²	158	139 Å²	139	78%	0.778	71%	0.705	S	S	*	*			trans	-68.7	170.9	173.5	-55	169.7	-168	0	0	113.1
916	T	29	Very low	28.2	Very low	113 Å²	113	135.5 Å²	135.5	69%	0.693	70%	0.702	S	S	*	*			cis	-154.6	155.4	19.4	-20.9	0	0	0	0	113.8
917	Q	26.7	Very low	28.4	Very low	174 Å²	174	133.8 Å²	133.8	81%	0.813	70%	0.699	S	S	*	*			trans	-6.9	156	140.2	-64.6	168.9	28.1	0	0	119.3
918	S	24.7	Very low	28.3	Very low	82 Å²	82	136.1 Å²	136.1	57%	0.573	71%	0.705	S	S	*	*			cis	179.4	171.7	-11.1	59.4	0	0	0	0	111.6
919	T	27.4	Very low	28.1	Very low	126 Å²	126	133 Å²	133	77%	0.773	70%	0.702	S	S	*	*			trans	63	147.9	155.7	62.6	0	0	0	0	118.6
920	T	30.4	Very low	27.7	Very low	110 Å²	110	134 Å²	134	68%	0.675	71%	0.71	S	S	*	*			cis	-147.9	157.9	25.5	22.5	0	0	0	0	112.7
921	K	25.7	Very low	27.4	Very low	167 Å²	167	133.3 Å²	133.3	73%	0.726	71%	0.71	S	S	*	*			trans	14.8	147.6	134.2	-45.1	159.2	156.8	-169.8	0	118.9
922	H	30.4	Very low	27.3	Very low	140 Å²	140	132.7 Å²	132.7	65%	0.648	71%	0.711	S	S	*	*			cis	-161.3	140.9	45.8	-104.8	-82	0	0	0	114.4
923	Q	27.6	Very low	27.3	Very low	149 Å²	149	137.3 Å²	137.3	70%	0.696	72%	0.72	S	S	*	*			trans	38.9	117.8	132.7	-68.8	-176	-66.4	0	0	124.1
924	Y	24.1	Very low	27.4	Very low	207 Å²	207	136.5 Å²	136.5	81%	0.812	72%	0.723	S	S	*	*				60.4	138.6	116.4	-87.6	-64.6	0	0	0	124.9
925	M	24.6	Very low	27.3	Very low	159 Å²	159	136.4 Å²	136.4	78%	0.783	72%	0.722	S	S	*	*			trans	86	127.6	138.5	-76.9	-171.1	85.9	0	0	123.3
926	S	24.3	Very low	27.5	Very low	99 Å²	99	135 Å²	135	69%	0.692	72%	0.718	S	S	*	*			trans	84.7	159.7	136	-74.2	0	0	0	0	120.8
927	P	32.6	Very low	27.8	Very low	106 Å²	106	135.2 Å²	135.2	69%	0.688	72%	0.715	S	S	*	*			trans	-116.1	-170.1	-161.8	44	-32.4	0	0	0	113.7
928	N	24	Very low	28	Very low	132 Å²	132	133.6 Å²	133.6	71%	0.706	71%	0.712	S	S	*	*			trans	81.3	135.7	158.7	-85.7	46.6	0	0	0	120
929	D	25.8	Very low	28.5	Very low	129 Å²	129	134.1 Å²	134.1	69%	0.69	72%	0.716	S	S	*	*			trans	71.3	128.8	142.4	-61.2	-36.3	0	0	0	122.5
930	C	26.1	Very low	28.7	Very low	110 Å²	110	134.9 Å²	134.9	74%	0.743	72%	0.715	S	S	*	*			trans	75.2	150.7	144.5	-67.9	0	0	0	0	119.1
931	I	27.6	Very low	28.9	Very low	135 Å²	135	136.7 Å²	136.7	69%	0.692	72%	0.72	S	S	*	*			cis	-155.6	150.5	-4	-125	164.4	0	0	0	113.8
932	N	25	Very low	29	Very low	128 Å²	128	136 Å²	136	68%	0.684	72%	0.724	S	S	*	*			trans	15.3	128.9	155.9	-48.5	-18.6	0	0	0	122.9
933	K	30.3	Very low	29	Very low	200 Å²	200	139 Å²	139	87%	0.87	74%	0.735	S	S	*	*				175.7	145.1	121.1	-92.3	152.6	-175.1	177	0	108.6
934	S	32.9	Very low	29.1	Very low	105 Å²	105	141.5 Å²	141.5	73%	0.734	75%	0.746	S	S	*	*			cis	-141.5	137.8	1.4	43.9	0	0	0	0	108
935	I	27.3	Very low	29.5	Very low	136 Å²	136	138.8 Å²	138.8	70%	0.697	75%	0.745	S	S	*	*				75.2	131.5	60.5	-66.5	174.3	0	0	0	112.7
936	N	31.9	Very low	29.6	Very low	129 Å²	129	135.1 Å²	135.1	69%	0.69	73%	0.734	S	S	*	*			trans	71.7	136.6	-177.5	-76.3	43.7	0	0	0	116.1
937	D	34.1	Very low	29.9	Very low	116 Å²	116	138.9 Å²	138.9	62%	0.62	74%	0.739	S	S	*	*			cis	-146.2	151.5	1.4	-99.6	-46.9	0	0	0	113.4
938	N	31.8	Very low	29.7	Very low	141 Å²	141	140.4 Å²	140.4	75%	0.754	74%	0.74	S	S	*	*			trans	15	144.2	141.1	-58.4	-49.6	0	0	0	120.4
939	S	33.8	Very low	30.1	Very low	93 Å²	93	139.9 Å²	139.9	65%	0.65	74%	0.743	S	S	*	*			cis	-170.6	164.4	6.2	46.9	0	0	0	0	111.2
940	N	32.1	Very low	30.4	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	75%	0.752	S	S	*	*			trans	32.9	130.9	149.4	-50.2	-6.6	0	0	0	118.9
941	D	34.3	Very low	30.6	Very low	148 Å²	148	140.9 Å²	140.9	79%	0.791	75%	0.748	S	S	*	*				-157.2	177.2	56.9	-126.4	-41.9	0	0	0	115.4
942	L	29.2	Very low	30.7	Very low	152 Å²	152	141.2 Å²	141.2	80%	0.796	75%	0.751	S	S	*	*			trans	-93	133.9	-163.2	-65.5	152.9	0	0	0	115.6
943	K	30.6	Very low	31.1	Very low	202 Å²	202	143.3 Å²	143.3	88%	0.878	76%	0.76	S	S	*	*				166.8	94	123	-90.1	161.3	-175.8	173.3	0	113.5
944	E	28.9	Very low	31	Very low	202 Å²	202	142.7 Å²	142.7	94%	0.944	76%	0.758	S	S	*	*			trans	-160	147.3	147.1	-122	168.2	-156.5	0	0	110.6
945	I	32.5	Very low	30.8	Very low	151 Å²	151	146.2 Å²	146.2	77%	0.774	77%	0.765	S	S	*	*			trans	-139.2	97.4	-172.2	-64.9	178.9	0	0	0	105.1
946	S	26.4	Very low	30.9	Very low	81 Å²	81	143.9 Å²	143.9	57%	0.566	77%	0.765	S	S	*	*				54.9	140.7	93	72.7	0	0	0	0	114.2
947	F	30.2	Very low	30.8	Very low	178 Å²	178	145.2 Å²	145.2	78%	0.781	77%	0.772	S	S	*	*			cis	-129	148	21.5	-76.5	-110.9	0	0	0	110
948	I	29.2	Very low	30.6	Very low	139 Å²	139	145.5 Å²	145.5	71%	0.713	78%	0.778	S	S	*	*				65.3	124.6	62.7	-62.5	-179.5	0	0	0	112.7
949	P	33.2	Very low	30.5	Very low	120 Å²	120	145 Å²	145	78%	0.779	77%	0.771	S	S	*	*			trans	-99.3	165.5	-155.1	39.4	-38.2	0	0	0	115.4
950	L	31.2	Very low	30.3	Very low	167 Å²	167	152.3 Å²	152.3	87%	0.874	78%	0.784	S	S	*	*			trans	-119	125.7	165.3	-85.7	82.5	0	0	0	112
951	S	29.9	Very low	30.2	Very low	94 Å²	94	155.1 Å²	155.1	66%	0.657	78%	0.784	S	S	*	*			trans	-81.9	161.8	155	54.9	0	0	0	0	110.4
952	N	30.9	Very low	30.2	Very low	141 Å²	141	157.7 Å²	157.7	75%	0.754	79%	0.788	S	S	*	*			trans	71.9	112.6	178.7	-45.5	-68.1	0	0	0	116.5
953	I	31.6	Very low	30.3	Very low	172 Å²	172	156 Å²	156	88%	0.882	79%	0.789	S	S	*	*				-170.2	146.6	107.3	-93.9	155.3	0	0	0	109.3
954	K	28.9	Very low	30.2	Very low	187 Å²	187	151.6 Å²	151.6	81%	0.813	78%	0.784	S	S	*	*			trans	-98.5	146.3	-178.9	-66.3	175.2	177.4	174.6	0	111.6
955	M	29.3	Very low	30.2	Very low	180 Å²	180	152.2 Å²	152.2	89%	0.887	78%	0.779	S	S	*	*				165.5	123.1	122.1	-88.6	176.2	-66.5	0	0	108.1
956	A	29.1	Very low	30.2	Very low	86 Å²	86	150.6 Å²	150.6	71%	0.711	78%	0.779	S	S	*	*			cis	97	120	44.5	0	0	0	0	0	112.8
957	L	30	Very low	30.2	Very low	157 Å²	157	153.7 Å²	153.7	82%	0.822	79%	0.789	S	S	*	*			trans	171.6	135.1	132.4	-93.1	164.3	0	0	0	112.8
958	T	29.9	Very low	30.1	Very low	122 Å²	122	153.8 Å²	153.8	75%	0.748	80%	0.796	S	S	*	*			trans	54.2	151.6	148.3	53.2	0	0	0	0	122.6
959	E	28.8	Very low	30	Very low	130 Å²	130	155.9 Å²	155.9	61%	0.607	80%	0.801	S	S	*	*			cis	-171.9	132.4	-33.1	-149.3	-160.9	170.7	0	0	108.5	R961	E959-R961 IonicContact OE1-CZ 3.39Å; E959-R961 IonicContact OE1-NE 3.23Å; E959-R961 PolarHBondContact OE1-NE 3.09Å; E959-R961 IonicContact OE1-NH2 2.72Å; E959-R961 PolarHBondContact OE1-NH2 2.8Å
960	R	30.5	Very low	29.6	Very low	248 Å²	248	157.3 Å²	157.3	94%	0.936	80%	0.799	S	S	*	*			trans	-177	167.8	141.9	-101.1	157.7	-165.4	-159.9	3.4	111.5
961	R	30.2	Very low	29.4	Very low	201 Å²	201	156.4 Å²	156.4	76%	0.758	79%	0.794	S	S	*	*			trans	-130.5	151	-150.6	-56.7	176.5	-173.7	160.1	4.3	114.6	E959	E959-R961 IonicContact OE1-CZ 3.39Å; E959-R961 IonicContact OE1-NE 3.23Å; E959-R961 PolarHBondContact OE1-NE 3.09Å; E959-R961 IonicContact OE1-NH2 2.72Å; E959-R961 PolarHBondContact OE1-NH2 2.8Å
962	K	34.3	Very low	29.2	Very low	201 Å²	201	158.7 Å²	158.7	87%	0.874	80%	0.799	S	S	*	*			trans	133.1	136.1	142.8	-75.9	172.8	-178.7	-175.5	0	111.1
963	S	31.6	Very low	29.2	Very low	116 Å²	116	158 Å²	158	81%	0.811	80%	0.8	S	S	*	*			cis	-162.7	144.8	-12.7	41.3	0	0	0	0	110.1
964	S	27.7	Very low	29	Very low	111 Å²	111	156.1 Å²	156.1	78%	0.776	79%	0.792	S	S	*	*			trans	-109	171.4	-178.6	62.1	0	0	0	0	113
965	Y	29	Very low	29.1	Very low	215 Å²	215	154.9 Å²	154.9	84%	0.843	79%	0.789	S	S	*	*			trans	-52.1	151.9	149	-86	-85.6	0	0	0	110.4
966	P	31.9	Very low	29	Very low	117 Å²	117	152.9 Å²	152.9	76%	0.76	78%	0.782	S	S	*	*				-150.9	171.5	85.5	40.9	-23.1	0	0	0	116.5
967	D	28	Very low	29.1	Very low	146 Å²	146	155.8 Å²	155.8	78%	0.781	79%	0.79	S	S	*	*			trans	-66.3	151.1	159.4	-61.3	-71.5	0	0	0	112.3
968	L	27.4	Very low	29	Very low	179 Å²	179	154 Å²	154	94%	0.937	79%	0.786	S	S	*	*			trans	-167.5	162.6	136.5	-110.1	161.9	0	0	0	113.7
969	F	26.6	Very low	29.1	Very low	184 Å²	184	154.4 Å²	154.4	81%	0.807	79%	0.788	S	S	*	*			trans	-104	167.6	-165.5	-122.9	-95.2	0	0	0	112.7
970	M	25.5	Very low	29	Very low	150 Å²	150	155 Å²	155	74%	0.739	80%	0.796	S	S	*	*			trans	70.1	136.3	165.1	-63.3	-59.5	-101.5	0	0	116.4
971	L	26.8	Very low	28.9	Very low	148 Å²	148	152.5 Å²	152.5	78%	0.775	79%	0.794	S	S	*	*			cis	-155.9	170.1	32	-123.6	152.9	0	0	0	112.9
972	N	26.4	Very low	28.7	Very low	142 Å²	142	147.3 Å²	147.3	76%	0.759	79%	0.794	S	S	*	*			trans	-65.1	152.7	-175.8	-72.9	-33.6	0	0	0	116.2
973	T	29.2	Very low	28.3	Very low	125 Å²	125	145.2 Å²	145.2	77%	0.767	79%	0.791	S	S	*	*				-167.1	132.2	109.1	21.9	0	0	0	0	113.3
974	N	28.3	Very low	27.8	Very low	134 Å²	134	144.5 Å²	144.5	72%	0.717	78%	0.782	S	S	*	*			trans	38	143.6	137.4	-57.4	-11.6	0	0	0	120.8
975	Q	30.9	Very low	27.8	Very low	161 Å²	161	145.7 Å²	145.7	75%	0.752	78%	0.784	S	S	*	*			cis	-160.3	147.6	25	-143.8	162	25	0	0	113.7
976	N	27.6	Very low	27.5	Very low	137 Å²	137	140.3 Å²	140.3	73%	0.733	77%	0.77	S	S	*	*			trans	7.8	119	156.4	-51.9	-8	0	0	0	120.7
977	V	31.4	Very low	27.1	Very low	148 Å²	148	140.4 Å²	140.4	90%	0.897	77%	0.77	S	S	*	*				-138.2	133	119.5	179.8	0	0	0	0	108.6
978	T	27.4	Very low	27	Very low	119 Å²	119	141.9 Å²	141.9	73%	0.73	77%	0.772	S	S	*	*			trans	-103.8	132.5	-179.3	50.3	0	0	0	0	112.2
979	T	31.2	Very low	27	Very low	130 Å²	130	144.3 Å²	144.3	80%	0.798	77%	0.769	S	S	*	*			trans	-161	114.4	140.2	23.9	0	0	0	0	111.7
980	N	26.7	Very low	27	Very low	144 Å²	144	141 Å²	141	77%	0.77	77%	0.769	S	S	*	*			trans	6.6	115.5	144.9	-49.1	-17.1	0	0	0	117.8
981	H	29.8	Very low	27.3	Very low	194 Å²	194	143 Å²	143	90%	0.898	78%	0.776	S	S	*	*				-165	111.5	115.7	-103.4	71.7	0	0	0	108.3
982	A	24.6	Very low	27.2	Very low	92 Å²	92	141.3 Å²	141.3	76%	0.76	78%	0.776	S	S	*	*			trans	-95.7	118	179.7	0	0	0	0	0	110.3
983	I	25.7	Very low	27.5	Very low	158 Å²	158	141 Å²	141	81%	0.81	78%	0.78	S	S	*	*			trans	-105	102.7	159.6	-63	-179.6	0	0	0	106.8	V985	I983-V985 HydrophobicContact CG2-CG2 4.45Å
984	V	22.8	Very low	27.4	Very low	101 Å²	101	145.9 Å²	145.9	61%	0.612	78%	0.784	S	S	*	*			trans	-92	118.1	167.5	-170.6	0	0	0	0	106.8	L986	V984-L986 HydrophobicContact CB-CD2 4.39Å; V984-L986 HydrophobicContact CB-CG 4.35Å; V984-L986 HydrophobicContact CG1-CD2 3.57Å; V984-L986 HydrophobicContact CG1-CG 3.84Å; V984-L986 PolarHBondContact O-N 2.94Å
985	V	25.8	Very low	27.5	Very low	136 Å²	136	144.7 Å²	144.7	82%	0.824	79%	0.786	S	S	*	*			trans	-87	100.2	160.5	-179.4	0	0	0	0	106.2	I983	I983-V985 HydrophobicContact CG2-CG2 4.45Å
986	L	24.1	Very low	27.5	Very low	102 Å²	102	142 Å²	142	53%	0.534	79%	0.785	S	S	.	*			trans	-73.4	148.4	-173.7	-69.9	162.4	0	0	0	111.4	V984 E988	V984-L986 HydrophobicContact CB-CD2 4.39Å; V984-L986 HydrophobicContact CB-CG 4.35Å; V984-L986 HydrophobicContact CG1-CD2 3.57Å; V984-L986 HydrophobicContact CG1-CG 3.84Å; V984-L986 PolarHBondContact O-N 2.94Å; L986-E988 VanDerWaalsContact C-N 3.33Å; L986-E988 HydrophobicContact CB-CG 4Å; L986-E988 PolarHBondContact O-N 2.91Å; L986-E988 VanDerWaalsContact O-N 3.17Å
987	P	22.4	Very low	27.5	Very low	118 Å²	118	146.7 Å²	146.7	77%	0.766	79%	0.793	S	S	*	*			trans	-69.3	98	142.5	31.1	-27.7	0	0	0	106.8	R989	P987-R989 PolarHBondContact O-N 3.44Å
988	E	27.3	Very low	27.4	Very low	178 Å²	178	146.5 Å²	146.5	83%	0.832	79%	0.792	S	S	*	*			trans	-65.5	100.2	-176.4	-74.1	-149.3	140.8	0	0	111.6	L986	L986-E988 VanDerWaalsContact C-N 3.33Å; L986-E988 HydrophobicContact CB-CG 4Å; L986-E988 PolarHBondContact O-N 2.91Å; L986-E988 VanDerWaalsContact O-N 3.17Å
989	R	27.1	Very low	27.3	Very low	230 Å²	230	146.5 Å²	146.5	87%	0.868	80%	0.797	S	S	*	*			trans	-68.2	139.7	165.9	-87	-179.5	164.5	173	-4.2	110	P987	P987-R989 PolarHBondContact O-N 3.44Å
990	S	25.8	Very low	27.2	Very low	115 Å²	115	144.9 Å²	144.9	80%	0.804	80%	0.797	S	S	*	*			trans	-60.9	141.5	169.2	46.8	0	0	0	0	112.3
991	H	31.2	Very low	27.1	Very low	190 Å²	190	149.3 Å²	149.3	88%	0.88	80%	0.803	S	S	*	*			trans	-107	141	159.7	-92.5	-89.4	0	0	0	110.4
992	S	26.1	Very low	27	Very low	113 Å²	113	147.3 Å²	147.3	79%	0.79	80%	0.798	S	S	*	*			trans	-94	130.4	-165.2	-177.7	0	0	0	0	113.8
993	T	31.5	Very low	27.1	Very low	136 Å²	136	153.2 Å²	153.2	83%	0.834	80%	0.801	S	S	*	*			trans	-152.3	143.2	137.9	52.5	0	0	0	0	109.4
994	R	28.3	Very low	27.2	Very low	227 Å²	227	151.4 Å²	151.4	86%	0.857	80%	0.799	S	S	*	*			cis	-171.6	129.7	-16.8	162.5	177.9	165.6	-175.8	-4.4	107.9
995	S	29.5	Very low	27.4	Very low	109 Å²	109	153.4 Å²	153.4	76%	0.762	81%	0.806	S	S	*	*			trans	68.9	151.3	173.7	-140.2	0	0	0	0	114.9
996	S	31.4	Very low	27.6	Very low	105 Å²	105	154.2 Å²	154.2	73%	0.734	81%	0.806	S	S	*	*			cis	-142.6	165	7.7	-49.9	0	0	0	0	112.8
997	R	26.4	Very low	27.8	Very low	236 Å²	236	153.8 Å²	153.8	89%	0.891	81%	0.812	S	S	*	*			trans	-43.3	153.6	164.6	-56.9	166	176.4	169	-4	112.2
998	T	30	Very low	28.1	Very low	144 Å²	144	160.2 Å²	160.2	88%	0.883	82%	0.821	S	S	*	*			cis	-148	175.1	48.3	41.4	0	0	0	0	115.2
999	S	25.2	Very low	28	Very low	118 Å²	118	157.5 Å²	157.5	83%	0.825	81%	0.811	S	S	*	*			trans	-93.4	141.7	-169.5	168.4	0	0	0	0	114.8
1000	A	30	Very low	28	Very low	97 Å²	97	155.6 Å²	155.6	80%	0.802	81%	0.814	S	S	*	*			trans	-148.1	151.7	152.3	0	0	0	0	0	110.4
1001	R	23.9	Very low	28.2	Very low	236 Å²	236	155.9 Å²	155.9	89%	0.891	81%	0.807	S	S	*	*			trans	-82.2	150.3	176.9	-65.3	168.5	168.5	156.2	-7.4	110.8
1002	L	27.4	Very low	28	Very low	153 Å²	153	155.6 Å²	155.6	80%	0.801	80%	0.799	S	S	*	*				177.6	137.6	122	-96.1	161.9	0	0	0	113.7
1003	R	27.9	Very low	28.2	Very low	215 Å²	215	157.2 Å²	157.2	81%	0.811	80%	0.799	S	S	*	*			trans	43.8	141.3	157.4	-71.4	-178.3	-179.5	152.9	1.6	122.6
1004	P	27.5	Very low	28.1	Very low	120 Å²	120	155.3 Å²	155.3	78%	0.779	79%	0.791	S	S	*	*			trans	-90	117.4	156.3	34.6	-25.9	0	0	0	110.7
1005	D	27.2	Very low	28.3	Very low	143 Å²	143	150.4 Å²	150.4	77%	0.765	79%	0.79	S	S	*	*			trans	-163.4	138.6	161.8	-97.5	-45.5	0	0	0	108.3
1006	N	29.8	Very low	28.3	Very low	154 Å²	154	152.3 Å²	152.3	82%	0.824	79%	0.791	S	S	*	*			trans	-179.4	110.7	140.9	-96.8	-18.8	0	0	0	110
1007	S	27.1	Very low	28.2	Very low	93 Å²	93	153.9 Å²	153.9	65%	0.65	79%	0.791	S	S	*	*			trans	-68	154	168.7	45.5	0	0	0	0	111.4
1008	W	29.1	Very low	28.2	Very low	252 Å²	252	149.9 Å²	149.9	96%	0.955	79%	0.787	S	S	*	*			trans	-102.2	108.2	165.3	-78.7	81.7	0	0	0	109.4
1009	I	26.9	Very low	28.1	Very low	121 Å²	121	148.4 Å²	148.4	62%	0.621	78%	0.778	S	S	*	*			trans	-85.1	128.7	-175.9	-58.8	163.1	0	0	0	108.2	N1011	I1009-N1011 WeakPolarHBondContact CG2-OD1 3.48Å; I1009-N1011 PolarHBondContact O-N 2.79Å
1010	M	26.9	Very low	28.2	Very low	190 Å²	190	149 Å²	149	94%	0.936	78%	0.776	S	S	*	*			trans	-81.3	97.1	159.7	-79.7	-160	170.2	0	0	108.7	Y1012	M1010-Y1012 PolarHBondContact O-N 2.98Å
1011	N	29.7	Very low	28.1	Very low	122 Å²	122	151.1 Å²	151.1	65%	0.652	78%	0.78	S	S	*	*			trans	-67.9	127.5	169.3	-81.6	-0.3	0	0	0	109.6	I1009 D1013	I1009-N1011 WeakPolarHBondContact CG2-OD1 3.48Å; I1009-N1011 PolarHBondContact O-N 2.79Å; N1011-D1013 PolarHBondContact O-N 2.92Å
1012	Y	26	Very low	28.3	Very low	183 Å²	183	145 Å²	145	72%	0.718	77%	0.773	S	S	*	*			trans	-70.2	111.4	142.2	-90.2	-103.1	0	0	0	106.9	F150 M1010	F150-Y1012 HydrophobicContact CE2-CE1 4.28Å; M1010-Y1012 PolarHBondContact O-N 2.98Å
1013	D	31.4	Very low	28.5	Very low	148 Å²	148	145.1 Å²	145.1	79%	0.791	77%	0.774	S	S	*	*			trans	-155.1	127.7	153	-110	-33.5	0	0	0	109.8	N1011	N1011-D1013 PolarHBondContact O-N 2.92Å
1014	S	28.8	Very low	28.8	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	77%	0.773	S	S	*	*			trans	-98.4	121.4	175.4	56.4	0	0	0	0	109.8
1015	C	31.7	Very low	29	Very low	124 Å²	124	139 Å²	139	84%	0.838	77%	0.767	S	S	*	*			trans	-172.4	147.5	133.3	-106.6	0	0	0	0	112.4
1016	I	29.7	Very low	29.3	Very low	149 Å²	149	139.4 Å²	139.4	76%	0.764	77%	0.769	S	S	*	*			trans	-85.9	121.4	166.2	-67	159	0	0	0	107.2
1017	D	29.1	Very low	29.2	Very low	138 Å²	138	136.6 Å²	136.6	74%	0.738	76%	0.762	S	S	*	*			trans	-129.2	82.2	166.2	-134.2	-27.1	0	0	0	110.4	T1019	D1017-T1019 VanDerWaalsContact C-N 3.32Å; D1017-T1019 PolarHBondContact O-N 2.93Å
1018	N	27.8	Very low	29.4	Very low	152 Å²	152	139.1 Å²	139.1	81%	0.813	77%	0.766	S	S	*	*			trans	-75.8	79.1	177.4	-89.5	-35.8	0	0	0	110.5
1019	T	27	Very low	29.3	Very low	113 Å²	113	131.8 Å²	131.8	69%	0.693	75%	0.753	S	S	*	*			trans	-112.6	104.7	169.6	41.7	0	0	0	0	112.9	D1017	D1017-T1019 VanDerWaalsContact C-N 3.32Å; D1017-T1019 PolarHBondContact O-N 2.93Å
1020	V	27.1	Very low	29.5	Very low	130 Å²	130	131.5 Å²	131.5	79%	0.788	76%	0.757	S	S	*	*			trans	-39	126.9	175.2	177.4	0	0	0	0	113.9
1021	T	29.1	Very low	29.7	Very low	142 Å²	142	128.6 Å²	128.6	87%	0.871	75%	0.75	S	S	*	*			trans	-120.3	76.5	163.4	40	0	0	0	0	111.1
1022	S	28.4	Very low	29.8	Very low	107 Å²	107	127 Å²	127	75%	0.748	75%	0.749	S	S	*	*			trans	-72.7	132.2	167.6	55.2	0	0	0	0	110.5
1023	N	30.9	Very low	30.1	Very low	156 Å²	156	124.9 Å²	124.9	83%	0.834	75%	0.75	S	S	*	*			trans	-141	142.4	179	-140.2	-16.3	0	0	0	111.8
1024	S	33.6	Very low	30	Very low	112 Å²	112	123.8 Å²	123.8	78%	0.783	75%	0.749	S	S	*	*			trans	63.7	139.4	-168.1	80.1	0	0	0	0	115.3
1025	S	32.9	Very low	30.2	Very low	94 Å²	94	125.6 Å²	125.6	66%	0.657	76%	0.756	S	S	*	*			cis	-157.9	160.3	-10.5	46.4	0	0	0	0	111.5
1026	N	32	Very low	29.9	Very low	152 Å²	152	125.5 Å²	125.5	81%	0.813	75%	0.752	S	S	*	*			trans	69.1	140.3	172.1	-55.4	-25.3	0	0	0	116.5
1027	S	28.8	Very low	30	Very low	94 Å²	94	125.5 Å²	125.5	66%	0.657	76%	0.759	S	S	*	*			cis	-170.5	158.3	-11	49.2	0	0	0	0	111.3
1028	I	29.8	Very low	29.9	Very low	147 Å²	147	124.2 Å²	124.2	75%	0.754	76%	0.757	S	S	*	*			trans	74.9	96.2	156	-65.8	155.5	0	0	0	117.5
1029	S	27.8	Very low	30.1	Very low	97 Å²	97	125.2 Å²	125.2	68%	0.678	76%	0.762	S	S	*	*				72.7	145.6	126.6	83.8	0	0	0	0	120.4
1030	T	30.2	Very low	30.1	Very low	115 Å²	115	126 Å²	126	71%	0.706	76%	0.758	S	S	*	*			cis	-162.6	152.7	-2.7	0.6	0	0	0	0	110.7
1031	T	32	Very low	30.1	Very low	129 Å²	129	129.2 Å²	129.2	79%	0.791	76%	0.757	S	S	*	*			trans	58.3	141.2	154.1	50.7	0	0	0	0	120.1
1032	S	31.8	Very low	30	Very low	90 Å²	90	128.2 Å²	128.2	63%	0.629	75%	0.751	S	S	*	*			cis	-173.7	152.2	-6.4	49.6	0	0	0	0	112.7
1033	N	32.2	Very low	29.9	Very low	138 Å²	138	130.7 Å²	130.7	74%	0.738	75%	0.754	S	S	*	*			trans	70.5	108.2	147.4	-63.2	2.4	0	0	0	119
1034	T	30.4	Very low	29.8	Very low	125 Å²	125	129.3 Å²	129.3	77%	0.767	75%	0.751	S	S	*	*				96.2	146.1	93.6	57.2	0	0	0	0	113.1
1035	T	31.4	Very low	29.5	Very low	133 Å²	133	131.6 Å²	131.6	82%	0.816	76%	0.755	S	S	*	*			cis	-145.8	160.5	9.9	-20.3	0	0	0	0	111.7
1036	T	26.6	Very low	29.4	Very low	122 Å²	122	133.2 Å²	133.2	75%	0.748	77%	0.766	S	S	*	*			trans	-88.7	148.8	177.3	8.4	0	0	0	0	114.1
1037	T	31.3	Very low	29.1	Very low	150 Å²	150	131.4 Å²	131.4	92%	0.92	76%	0.764	S	S	*	*			trans	-147.3	124.5	145.1	13.6	0	0	0	0	110.7
1038	T	26.7	Very low	29.1	Very low	111 Å²	111	130.8 Å²	130.8	68%	0.681	76%	0.76	S	S	*	*			trans	-92.4	152.5	175.3	47.1	0	0	0	0	111.4
1039	N	31.7	Very low	29	Very low	173 Å²	173	131.2 Å²	131.2	93%	0.925	76%	0.763	S	S	*	*			trans	-153.4	162.9	143.6	-103.2	-30.1	0	0	0	111.5
1040	H	28.1	Very low	29	Very low	130 Å²	130	135.6 Å²	135.6	60%	0.602	77%	0.77	S	S	*	*			trans	-125.2	154.5	-144.5	-118.7	-84.4	0	0	0	114.2
1041	Y	27.5	Very low	28.8	Very low	196 Å²	196	135.8 Å²	135.8	77%	0.769	77%	0.771	S	S	*	*			trans	65.6	161.1	162.6	-55.7	-55.2	0	0	0	116.6
1042	T	26.8	Very low	28.7	Very low	122 Å²	122	135.7 Å²	135.7	75%	0.748	78%	0.776	S	S	*	*			cis	-142	151.9	10.7	-32.6	0	0	0	0	111.1
1043	I	25.7	Very low	28.7	Very low	159 Å²	159	137.2 Å²	137.2	82%	0.815	79%	0.786	S	S	*	*			trans	-101.5	135.6	168.4	-63.1	171.1	0	0	0	108.5
1044	T	27.9	Very low	28.8	Very low	127 Å²	127	135.9 Å²	135.9	78%	0.779	79%	0.788	S	S	*	*			trans	-111	110.8	176	49.6	0	0	0	0	111.3
1045	N	27.6	Very low	29	Very low	160 Å²	160	138.3 Å²	138.3	86%	0.856	79%	0.79	S	S	*	*			trans	-72.1	146.5	161.3	-78.4	-19.5	0	0	0	110.1
1046	S	30.6	Very low	29	Very low	127 Å²	127	140.3 Å²	140.3	89%	0.888	80%	0.795	S	S	*	*			trans	-141.9	91.4	164.4	50.8	0	0	0	0	111
1047	C	26.5	Very low	29.3	Very low	114 Å²	114	139.8 Å²	139.8	77%	0.77	80%	0.796	S	S	*	*			trans	-118.3	125.3	164.9	-173.8	0	0	0	0	108.4
1048	S	27.7	Very low	29.5	Very low	82 Å²	82	138.4 Å²	138.4	57%	0.573	79%	0.792	S	S	*	*			trans	61.5	138.2	178.6	70	0	0	0	0	118
1049	L	28.3	Very low	29.7	Very low	155 Å²	155	143 Å²	143	81%	0.812	80%	0.803	S	S	*	*				-179	166.1	104.6	-97.8	169.5	0	0	0	113.4
1050	F	26.8	Very low	29.9	Very low	189 Å²	189	138.3 Å²	138.3	83%	0.829	79%	0.789	S	S	*	*			trans	-85.1	146.8	174.6	-103.9	-120.4	0	0	0	112.1
1051	T	27.6	Very low	30.2	Very low	120 Å²	120	139 Å²	139	74%	0.736	80%	0.797	S	S	*	*			trans	42.8	121.6	148	59.5	0	0	0	0	121.3
1052	S	30.3	Very low	30.4	Very low	127 Å²	127	139.7 Å²	139.7	89%	0.888	80%	0.798	S	S	*	*				173.7	172.6	103.8	47.3	0	0	0	0	112.5
1053	S	31.5	Very low	30.8	Very low	122 Å²	122	138.6 Å²	138.6	85%	0.853	79%	0.791	S	S	*	*			trans	-113.6	153.3	-156.4	-44.1	0	0	0	0	115.2
1054	S	34.1	Very low	31.4	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	79%	0.785	S	S	*	*			trans	-171.3	131.1	132.2	61.1	0	0	0	0	115.3
1055	H	33.5	Very low	31.7	Very low	176 Å²	176	138.8 Å²	138.8	82%	0.815	78%	0.784	S	S	*	*			trans	5.5	136.6	154.1	-61.6	-91.1	0	0	0	122.1
1056	L	32.6	Very low	32.3	Very low	175 Å²	175	136.6 Å²	136.6	92%	0.916	78%	0.781	S	S	*	*				-162.2	178.4	89.1	-121.2	99	0	0	0	111.9
1057	S	31.4	Very low	32.8	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	78%	0.779	S	S	*	*			trans	-139.4	155.4	-164.3	64.4	0	0	0	0	116.2
1058	S	35.3	Very low	33	Very low	121 Å²	121	136.2 Å²	136.2	85%	0.846	78%	0.777	S	S	*	*			trans	-162.5	159.6	148.9	57.8	0	0	0	0	113.6
1059	K	32.1	Very low	33.3	Very low	208 Å²	208	138.7 Å²	138.7	90%	0.904	79%	0.788	S	S	*	*			trans	-87.4	178.7	-167.9	-59	164.3	174	169.8	0	111.8
1060	A	35.8	Very low	33.4	Very low	75 Å²	75	137.6 Å²	137.6	62%	0.62	79%	0.787	S	S	*	*			cis	-174.1	161.2	30.4	0	0	0	0	0	116.1
1061	N	33.7	Very low	33.9	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	79%	0.785	S	S	*	*			trans	64	155.6	143.3	-65.6	-17.3	0	0	0	120.4
1062	R	33.1	Very low	34.4	Very low	210 Å²	210	134.9 Å²	134.9	79%	0.792	79%	0.788	S	S	*	*			cis	-175.9	173.5	-8.1	-107.1	-174.7	178.1	-151.8	-1.6	108.2
1063	T	34.1	Very low	34.5	Very low	99 Å²	99	137.8 Å²	137.8	61%	0.607	79%	0.788	S	S	*	*			cis	-168	168.5	-39.1	27.3	0	0	0	0	109
1064	H	38.2	Very low	34.6	Very low	150 Å²	150	140.4 Å²	140.4	69%	0.694	79%	0.79	S	S	*	*			trans	120.2	107	154.3	-69.4	-73.5	0	0	0	121.9
1065	D	35.2	Very low	34.5	Very low	141 Å²	141	139.6 Å²	139.6	75%	0.754	79%	0.785	S	S	*	*				87.3	158.8	121	-54.8	-4.3	0	0	0	125
1066	S	38.8	Very low	34.5	Very low	114 Å²	114	138.3 Å²	138.3	80%	0.797	78%	0.784	S	S	*	*			trans	-144.1	-176.5	-163.8	-48.1	0	0	0	0	111.7
1067	P	41.9	Very low	34.4	Very low	129 Å²	129	138.6 Å²	138.6	84%	0.838	78%	0.78	S	S	*	*				-160.2	-176.6	95.7	41.9	-20.2	0	0	0	119.9
1068	S	31.9	Very low	34.4	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	78%	0.782	S	S	*	*			trans	-68.7	171	-170.7	56.5	0	0	0	0	123.7
1069	V	32.2	Very low	34.2	Very low	133 Å²	133	139.2 Å²	139.2	81%	0.806	78%	0.779	S	S	*	*			trans	-175.9	111.7	130.5	143	0	0	0	0	109.4
1070	V	31.5	Very low	34.2	Very low	132 Å²	132	137.4 Å²	137.4	80%	0.8	78%	0.777	S	S	*	*				85.2	137.3	80.3	174.6	0	0	0	0	116.6
1071	V	37.6	Very low	33.9	Very low	128 Å²	128	138.6 Å²	138.6	78%	0.776	78%	0.781	S	S	*	*			trans	-147.5	156.5	-169.4	177.6	0	0	0	0	111.5
1072	P	37.6	Very low	33.8	Very low	124 Å²	124	136.4 Å²	136.4	81%	0.805	78%	0.777	S	S	*	*			trans	-126	163.2	158.8	37.6	-24.6	0	0	0	115.9
1073	Q	33	Very low	33.7	Very low	188 Å²	188	135.1 Å²	135.1	88%	0.879	78%	0.777	S	S	*	*			trans	-111.9	173.1	176.6	-61.2	-176.6	-77.1	0	0	112.9
1074	I	33.5	Very low	33.5	Very low	177 Å²	177	135.3 Å²	135.3	91%	0.908	78%	0.783	S	S	*	*			trans	-167.6	161.4	137.1	-99.7	152.4	0	0	0	110.2
1075	S	31.4	Very low	33.2	Very low	92 Å²	92	134.8 Å²	134.8	64%	0.643	79%	0.79	S	S	*	*			trans	-118	168.8	-175.5	54.7	0	0	0	0	113.7
1076	D	34	Very low	33	Very low	149 Å²	149	136.3 Å²	136.3	80%	0.797	79%	0.792	S	S	*	*				169.3	-171	124.3	-85.4	7.2	0	0	0	113.8
1077	Q	30.8	Very low	32.6	Very low	181 Å²	181	136.3 Å²	136.3	85%	0.846	79%	0.792	S	S	*	*			trans	-115.8	162.4	-153.5	-52.3	175.1	0.2	0	0	114.8
1078	S	31.5	Very low	32	Very low	115 Å²	115	134.6 Å²	134.6	80%	0.804	78%	0.783	S	S	*	*				142.7	143.1	121.2	67.9	0	0	0	0	119.3
1079	V	30	Very low	31.7	Very low	130 Å²	130	137.4 Å²	137.4	79%	0.788	79%	0.789	S	S	*	*			trans	-23.8	147.1	164.1	-161.3	0	0	0	0	120
1080	I	32.5	Very low	31.6	Very low	170 Å²	170	136.4 Å²	136.4	87%	0.872	79%	0.788	S	S	*	*				172.6	167.3	128.6	-88	163.4	0	0	0	111.4
1081	S	29.3	Very low	31.6	Very low	100 Å²	100	134.4 Å²	134.4	70%	0.699	78%	0.78	S	S	*	*			trans	-138	171.7	-154.2	63.8	0	0	0	0	117.1
1082	S	31	Very low	31.4	Very low	98 Å²	98	134.7 Å²	134.7	69%	0.685	78%	0.777	S	S	*	*			trans	108.3	141.2	137.3	83.3	0	0	0	0	122.7
1083	K	31	Very low	31.3	Very low	184 Å²	184	134.6 Å²	134.6	80%	0.8	77%	0.769	S	S	*	*			trans	77.6	104.3	141.3	-78.9	171.5	179.4	-179.5	0	123.9
1084	S	30.6	Very low	31.5	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	76%	0.759	S	S	*	*				49.2	142.7	117.5	66.4	0	0	0	0	123.9
1085	V	32.5	Very low	31.5	Very low	138 Å²	138	130.5 Å²	130.5	84%	0.836	75%	0.75	S	S	*	*				-173.3	164.4	115.6	143.5	0	0	0	0	112.3
1086	H	30.2	Very low	31.7	Very low	174 Å²	174	132.4 Å²	132.4	81%	0.806	75%	0.753	S	S	*	*			trans	-84.5	-178.4	-170.4	-74.2	-105.3	0	0	0	116.7
1087	S	31.2	Very low	31.7	Very low	113 Å²	113	132 Å²	132	79%	0.79	75%	0.749	S	S	*	*			trans	101.8	149	142.5	78.6	0	0	0	0	118.3
1088	S	28.5	Very low	32	Very low	94 Å²	94	131.2 Å²	131.2	66%	0.657	74%	0.742	S	S	*	*			cis	-172.5	138.2	-23.8	50.3	0	0	0	0	113.6
1089	L	26	Very low	32	Very low	163 Å²	163	132.6 Å²	132.6	85%	0.853	74%	0.741	S	S	*	*			trans	48.7	156.2	142.9	-79.4	114.4	0	0	0	124.5
1090	S	30.5	Very low	32.2	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	74%	0.742	S	S	*	*			trans	85.2	148.9	153.6	79.7	0	0	0	0	119.1
1091	S	29.9	Very low	32.1	Very low	89 Å²	89	130.1 Å²	130.1	62%	0.622	73%	0.73	S	S	*	*			cis	-175.7	161.6	-28.4	54.4	0	0	0	0	110.2
1092	N	34.6	Very low	32.1	Very low	134 Å²	134	130.2 Å²	130.2	72%	0.717	73%	0.731	S	S	*	*			trans	71.7	147.4	160.6	-57.5	-7.1	0	0	0	116.6
1093	N	36	Very low	32	Very low	122 Å²	122	130.4 Å²	130.4	65%	0.652	73%	0.728	S	S	*	*			cis	-158.9	152.6	-8.2	-111.2	1.9	0	0	0	111
1094	N	36.3	Very low	32.1	Very low	124 Å²	124	132 Å²	132	66%	0.663	73%	0.729	S	S	*	*			trans	60.9	149.6	147.2	-66.3	36	0	0	0	120.3
1095	E	33.5	Very low	32.1	Very low	155 Å²	155	134.4 Å²	134.4	72%	0.724	73%	0.729	S	S	*	*			cis	-172.6	136.2	-31.5	-128.1	-179.3	165.4	0	0	108
1096	N	36	Very low	31.8	Very low	132 Å²	132	136 Å²	136	71%	0.706	73%	0.727	S	S	*	*				166.8	119.4	129.6	-96.2	-71.3	0	0	0	113.4
1097	M	34.7	Very low	31.8	Very low	142 Å²	142	132.6 Å²	132.6	70%	0.7	72%	0.723	S	S	*	*			trans	43	135.9	140.8	-54.2	-160.5	-166.6	0	0	121.8
1098	K	35.4	Very low	31.6	Very low	163 Å²	163	135.8 Å²	135.8	71%	0.709	73%	0.725	S	S	*	*			cis	-161.5	124.9	-2.8	-118.9	164.8	-173.3	163.3	0	111.9
1099	N	31.2	Very low	31.8	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	73%	0.732	S	S	*	*			trans	25.4	128	140	-54.2	4.7	0	0	0	121.7
1100	I	35.4	Very low	31.9	Very low	158 Å²	158	138.9 Å²	138.9	81%	0.81	73%	0.734	S	S	*	*				174.5	88.4	115.3	-86.3	154.9	0	0	0	105.9
1101	S	30.5	Very low	31.9	Very low	90 Å²	90	139.7 Å²	139.7	63%	0.629	74%	0.738	S	S	*	*				49.8	116.8	105.1	64.1	0	0	0	0	114.3
1102	S	29.3	Very low	32.1	Very low	102 Å²	102	142.6 Å²	142.6	71%	0.713	75%	0.746	S	S	*	*				62.1	147.7	58.7	89.8	0	0	0	0	112.7
1103	T	29.2	Very low	31.7	Very low	103 Å²	103	144 Å²	144	63%	0.632	75%	0.752	S	S	*	*			cis	-157	-164.4	22.3	-27.6	0	0	0	0	110.1
1104	W	31.5	Very low	31.6	Very low	217 Å²	217	142.7 Å²	142.7	82%	0.822	76%	0.759	S	S	*	*			trans	84.4	135.8	163.3	-50.1	95.3	0	0	0	118.2
1105	H	31.8	Very low	31.5	Very low	154 Å²	154	146.6 Å²	146.6	71%	0.713	77%	0.773	S	S	*	*			cis	-161.2	161.8	-28.4	-142.2	-89.7	0	0	0	111.1
1106	Q	26.3	Very low	31.5	Very low	171 Å²	171	146.7 Å²	146.7	80%	0.799	82%	0.815	S	S	*	*			trans	-89.2	142.2	166.1	-70	169.3	-96.1	0	0	111.9
1107	S	30.1	Very low	31.3	Very low	103 Å²	103	147.4 Å²	147.4	72%	0.72	82%	0.82	S	S	*	*			trans	-171.3	134.2	151.3	-124.4	0	0	0	0	105.5
1108	E	27.1	Very low	31.1	Very low	179 Å²	179	147.7 Å²	147.7	84%	0.836	83%	0.827	S	S	*	*			cis	66.2	89.8	16.8	-127.9	175.9	-127.1	0	0	113.3
1109	V	32.8	Very low	30.9	Very low	130 Å²	130	146.8 Å²	146.8	79%	0.788	83%	0.833	S	S	*	*			trans	-146.7	95.8	161.5	-176	0	0	0	0	108.8
1110	E	27.4	Very low	30.9	Very low	193 Å²	193	147 Å²	147	90%	0.902	84%	0.837	S	S	*	*			trans	-101.7	118.2	143.5	-75.5	-170.7	138.5	0	0	106.6
1111	C	31.3	Very low	30.6	Very low	128 Å²	128	146.3 Å²	146.3	87%	0.865	84%	0.839	S	S	*	*			trans	-170.9	148.8	143	-120	0	0	0	0	113.5
1112	L	32.8	Very low	30.6	Very low	150 Å²	150	150.1 Å²	150.1	79%	0.785	85%	0.853	S	S	*	*			trans	-77.7	147.3	-176.9	-68.8	142.8	0	0	0	113.3
1113	L	27.4	Very low	30.7	Very low	164 Å²	164	153.5 Å²	153.5	86%	0.859	86%	0.863	S	S	*	*			trans	26.2	117.7	134.5	-57.5	170.1	0	0	0	119.4
1114	A	33.9	Very low	30.8	Very low	95 Å²	95	157.4 Å²	157.4	79%	0.785	88%	0.88	S	S	*	*			trans	-160.7	123.4	136.4	0	0	0	0	0	112.1
1115	E	33	Very low	30.7	Very low	206 Å²	206	152.4 Å²	152.4	96%	0.963	89%	0.885	S	S	*	*			trans	41.1	113.2	147.7	-57.4	-178	161.1	0	0	120.3
1116	G	34.9	Very low	30.6	Very low	156 Å²	156	152.3 Å²	152.3	100%	1.608	90%	0.901	S	S	*	*			trans	-179	0	173.1	0	0	0	0	0	112.5

Retrieved 1,116 of 1,116 residues in 1051.5 ms (Link to these results)

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