A0A3Q0KMN4_SCHMA Loading...

Putative rho/rac guanine nucleotide exchange factor

AlphaFold DB , UniProt , Accession A0A3Q0KMN4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,338 aa.

						>A0A3Q0KMN4_SCHMA|A0A3Q0KMN4
MLSLLMISKSLNYKSRILNNIIDIIFKRRYYYYYDDDDNDYDETTTTNSTIPKNDINYDSLQEINQKINMKLQQKSINRSSLLLSSFHNTYYPNKNNQLSHYMDRSSSSSSLSSSKRINPTLNWYLLNLKLKQRIYYLNDHDHDHDPTVQQKNKKKFFLINSYSDEFINEKSNDKSKTLSYNRQLLENVTQLPPMATSSSSASSPLSPQQQQQQEKKKKKQQRQRQQQHRQQQHQQQHSKTWNGKKPKRNLILEEWKRKSDTVQNFTNIENVSFSTKVLTIRFWNGDELKLDPLPSEKLGDVIRSHLSDLTIPIQCIDLMSKEYIPWETPTLQLSSKTLLIKKIHKNKVTPPGIHPTRKMERRSAPPFDTTSGALKNWFDFYKKSNSMNSYSLSDQLINDCLCELNPNVLVNLLGGRQKLFDENSPTPTPLSAISSLDEIFRHRSNSYSRVEEIQHQNLPNNQPFDSQDLASLFFIEESWEQIVKSSSKMTKQQQKRQSAIWEFIYTEANYIKYLRTIIDYYLAPFLEIRESLFENLDTGWIFGNIEEIFKANIKLWLQYLTEPLREIRRNGDAFTPVIFKSAITHIPDLFSVYKQYYVNLSRCRSYTQEAVRQSTNFCTFLEWADQQGHDHREPLWDQLTKPTTRLTQYRLLMESIRKNCCNSTEEQEVSEMFNSISEFIEEINQQMMTETKTWESLELLASKLICCDFLDNNVDDYTQLISDYSRFKFSILSPIKLPSPVILFNDYHSISQSIPSCTKSLAFLRNRRLSGSPLFTSNNSISDARTILNHNTTSCNRSDSGIGDCNQTLSTSSSTTSRDYTSPTGFKQRSRIYSLTNPATESFSFPVMLSRISEGGKIQKSISLDTEFSDSISYDWSDIHYRRTIQRTVLYGGNLRFKEPPNRSIETVCHILTDLFLITKQHKKDGNDYWKLIKNPIRLDKLIIQRGRETGVFGCAILDDFHNIANLYIFSAGPKCDEWITQIESAKENYRKLMEPEVLIVQPLMKYQRDDLSTIIMSPDSMCSSDNISELHNQPYGHFVDTTPTSGNSINSGKNINIEGNKRNVFFESQSPLFESINCNHTNHNNQTDSMCIIDKRIRSNNSPTIMTNHQRSSSRSCNYTSIERDSTKMIHSTSVRNLSISNTSDRHLLHLSSNLTEASKSTTSHSPLRRDVAKKFFLSSNQNGQKYFSMNYQNEPRFPRDLSDQRLKSGSSNLDLDKVSHTIPIRQSSRFTSSAVINNNDDCNINQQDHCQSSNSTLSSSSSSSSLTSLKTEMKVPVNYPSIVICKVQSDSDEIINSNDNNRYLLSTGLQRSSVHHSLLNIERSDSSEDQITIKL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.3	Very low	27	Very low	154 Å²	154	94 Å²	94	76%	0.759	51%	0.505	S	S	*	.				0	-61.7	0	-82.4	-61.3	-170.1	0	0	112.9	S3 L4 L5 Y125	M1-S3 PolarHBondContact O-N 3.48Å; M1-S3 VanDerWaalsContact O-N 3.15Å; M1-L4 WeakPolarHBondContact O-CB 3.26Å; M1-L4 PolarHBondContact O-N 3.2Å; M1-L4 HydrophobicContact SD-CD1 4.37Å; M1-L5 PolarHBondContact O-N 3.31Å; M1-Y125 WeakPolarHBondContact CB-OH 3.37Å
2	L	24.3	Very low	27.2	Very low	58 Å²	58	97.8 Å²	97.8	30%	0.304	52%	0.524	S	S	.	.	H	α-helix	trans	-57.9	-32.7	-177.5	-127.9	76.7	0	0	0	113.8	L4 L5 M6 W124	L2-L4 PolarHBondContact O-N 3.49Å; L2-L5 WeakPolarHBondContact O-CB 3.39Å; L2-L5 PolarHBondContact O-N 2.98Å; L2-M6 PolarHBondContact O-N 3.19Å; L2-W124 HydrophobicContact CD1-CH2 4.1Å; L2-W124 HydrophobicContact CD1-CZ3 4.11Å; L2-W124 HydrophobicContact CD2-CH2 4.02Å
3	S	26.3	Very low	27.3	Very low	41 Å²	41	105.5 Å²	105.5	29%	0.287	54%	0.544	S	S	.	.	H	α-helix	trans	-61.2	-34	171.9	39.9	0	0	0	0	114.4	M1 L5 I7 R613	M1-S3 PolarHBondContact O-N 3.48Å; M1-S3 VanDerWaalsContact O-N 3.15Å; S3-L5 PolarHBondContact O-N 3.21Å; S3-I7 WeakPolarHBondContact O-CB 3.39Å; S3-I7 WeakPolarHBondContact O-CG1 3.32Å; S3-I7 PolarHBondContact O-N 3.02Å; S3-R613 PolarHBondContact OG-NH1 3.47Å
4	L	25.4	Very low	27.5	Very low	118 Å²	118	102.8 Å²	102.8	62%	0.618	53%	0.526	S	S	*	.	H	α-helix	trans	-68.3	-24.3	172	-82	151.6	0	0	0	112.3	M1 L2 S8	M1-L4 WeakPolarHBondContact O-CB 3.26Å; M1-L4 PolarHBondContact O-N 3.2Å; M1-L4 HydrophobicContact SD-CD1 4.37Å; L2-L4 PolarHBondContact O-N 3.49Å; L4-S8 WeakPolarHBondContact O-CB 3.48Å; L4-S8 PolarHBondContact O-N 2.83Å; L4-S8 VanDerWaalsContact O-N 3.12Å
5	L	26.4	Very low	27.8	Very low	103 Å²	103	99.7 Å²	99.7	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-88.2	-16	-178.4	-148.6	83.9	0	0	0	114	M1 L2 S3 S8	M1-L5 PolarHBondContact O-N 3.31Å; L2-L5 WeakPolarHBondContact O-CB 3.39Å; L2-L5 PolarHBondContact O-N 2.98Å; S3-L5 PolarHBondContact O-N 3.21Å; L5-S8 PolarHBondContact O-OG 2.73Å; L5-S8 VanDerWaalsContact O-OG 3.13Å
6	M	27.3	Very low	27.9	Very low	122 Å²	122	106.8 Å²	106.8	60%	0.601	54%	0.536	S	S	*	.	H	α-helix	trans	-87	-42.5	168.8	-62.8	-61.9	-71.1	0	0	110	L2 S8 K9	L2-M6 PolarHBondContact O-N 3.19Å; M6-S8 PolarHBondContact O-N 3.34Å; M6-K9 PolarHBondContact O-N 3.06Å; M6-K9 VanDerWaalsContact O-N 3.15Å
7	I	29.1	Very low	28.3	Very low	94 Å²	94	106.2 Å²	106.2	48%	0.482	53%	0.533	S	S	.	.	H	α-helix	trans	-62.8	-28	174.9	-71	171.2	0	0	0	112.1	S3 K9 S10 L11	S3-I7 WeakPolarHBondContact O-CB 3.39Å; S3-I7 WeakPolarHBondContact O-CG1 3.32Å; S3-I7 PolarHBondContact O-N 3.02Å; I7-K9 PolarHBondContact O-N 3.38Å; I7-S10 PolarHBondContact O-OG 2.84Å; I7-L11 HydrophobicContact CG2-CD1 3.48Å; I7-L11 VanDerWaalsContact CG2-CD1 3.48Å; I7-L11 HydrophobicContact CG2-CG 4.27Å; I7-L11 PolarHBondContact O-N 3Å
8	S	26.1	Very low	28.4	Very low	55 Å²	55	105.4 Å²	105.4	39%	0.385	53%	0.53	S	S	.	.	H	α-helix	trans	-68.2	-16.6	175.6	66.3	0	0	0	0	114.7	L4 L5 M6	L4-S8 WeakPolarHBondContact O-CB 3.48Å; L4-S8 PolarHBondContact O-N 2.83Å; L4-S8 VanDerWaalsContact O-N 3.12Å; L5-S8 PolarHBondContact O-OG 2.73Å; L5-S8 VanDerWaalsContact O-OG 3.13Å; M6-S8 PolarHBondContact O-N 3.34Å
9	K	27.5	Very low	28.7	Very low	128 Å²	128	104.6 Å²	104.6	56%	0.557	53%	0.528	S	S	*	.	H	α-helix	trans	-79.4	-27.5	178.3	-75	-164.2	173.8	-171.5	0	114.1	M6 I7 Y136	M6-K9 PolarHBondContact O-N 3.06Å; M6-K9 VanDerWaalsContact O-N 3.15Å; I7-K9 PolarHBondContact O-N 3.38Å; K9-Y136 PolarHBondContact NZ-OH 3.47Å
10	S	28.8	Very low	29	Very low	101 Å²	101	104.6 Å²	104.6	71%	0.706	53%	0.529	S	S	*	.	H	α-helix	trans	-94.7	-13	176.3	60.1	0	0	0	0	114.1	I7	I7-S10 PolarHBondContact O-OG 2.84Å
11	L	28.1	Very low	29.2	Very low	60 Å²	60	103.5 Å²	103.5	31%	0.314	52%	0.524	S	S	.	.			trans	-96.9	12.2	-175.8	-71.3	179	0	0	0	115.6	I7 Y13 K14 S15	I7-L11 HydrophobicContact CG2-CD1 3.48Å; I7-L11 VanDerWaalsContact CG2-CD1 3.48Å; I7-L11 HydrophobicContact CG2-CG 4.27Å; I7-L11 PolarHBondContact O-N 3Å; L11-Y13 PolarHBondContact O-N 3.09Å; L11-K14 HydrophobicContact CD2-CB 4.02Å; L11-K14 HydrophobicContact CD2-CD 4.28Å; L11-K14 PolarHBondContact O-N 2.84Å; L11-S15 PolarHBondContact O-N 3.27Å; L11-S15 VanDerWaalsContact O-N 3.13Å
12	N	28.7	Very low	29.6	Very low	139 Å²	139	99.9 Å²	99.9	74%	0.743	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-12.9	-177.4	-108.4	-11	0	0	0	114.9
13	Y	29.3	Very low	30.1	Very low	199 Å²	199	100.9 Å²	100.9	78%	0.78	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-13.9	170	-119.1	-99.9	0	0	0	115	L11	L11-Y13 PolarHBondContact O-N 3.09Å
14	K	29.6	Very low	30.7	Very low	67 Å²	67	103.5 Å²	103.5	29%	0.291	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-6	-177.5	-75.3	-173.9	172.8	-172.1	0	114.8	L11 R16 I17 L18 D926	L11-K14 HydrophobicContact CD2-CB 4.02Å; L11-K14 HydrophobicContact CD2-CD 4.28Å; L11-K14 PolarHBondContact O-N 2.84Å; K14-R16 PolarHBondContact O-N 3.28Å; K14-R16 VanDerWaalsContact O-N 3.14Å; K14-I17 PolarHBondContact O-N 2.81Å; K14-L18 PolarHBondContact O-N 3.37Å; K14-L18 VanDerWaalsContact O-N 3.15Å; K14-D926 VanDerWaalsContact CE-CB 3.49Å; K14-D926 WeakPolarHBondContact CE-OD2 3.07Å; K14-D926 IonicContact NZ-OD2 2.65Å; K14-D926 PolarHBondContact NZ-OD2 3.43Å
15	S	31.3	Very low	31.1	Very low	57 Å²	57	102.4 Å²	102.4	40%	0.399	52%	0.516	S	S	.	.	H	α-helix	trans	-47.8	-40	177.2	-178.4	0	0	0	0	114	L11 I17 L18 N19	L11-S15 PolarHBondContact O-N 3.27Å; L11-S15 VanDerWaalsContact O-N 3.13Å; S15-I17 PolarHBondContact O-N 3.13Å; S15-L18 PolarHBondContact O-N 3.3Å; S15-N19 WeakPolarHBondContact O-CB 3.1Å; S15-N19 VanDerWaalsContact O-CG 3.25Å; S15-N19 PolarHBondContact O-N 3.42Å; S15-N19 PolarHBondContact O-ND2 3.19Å
16	R	30.3	Very low	31.5	Very low	213 Å²	213	103.9 Å²	103.9	80%	0.804	52%	0.518	S	S	*	.	H	α-helix	trans	-62.5	-39.9	176.3	-95.6	-178.1	169.6	163.9	-2.9	114	K14 N20	K14-R16 PolarHBondContact O-N 3.28Å; K14-R16 VanDerWaalsContact O-N 3.14Å; R16-N20 VanDerWaalsContact O-CG 3.29Å; R16-N20 PolarHBondContact O-N 2.85Å; R16-N20 PolarHBondContact O-OD1 2.75Å
17	I	34.3	Very low	31.8	Very low	96 Å²	96	104.4 Å²	104.4	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-72.9	-41.9	179.7	-61.4	175.9	0	0	0	109.8	K14 S15 N20 I21	K14-I17 PolarHBondContact O-N 2.81Å; S15-I17 PolarHBondContact O-N 3.13Å; I17-N20 PolarHBondContact O-N 3.17Å; I17-I21 HydrophobicContact CG2-CD1 3.91Å; I17-I21 WeakPolarHBondContact O-CG1 3.33Å; I17-I21 PolarHBondContact O-N 3.18Å
18	L	30	Very low	31.9	Very low	93 Å²	93	109.6 Å²	109.6	49%	0.487	53%	0.531	S	S	.	.	H	α-helix	trans	-65.8	-40.1	177.6	-163.1	71.8	0	0	0	111.8	K14 S15 I21 I22	K14-L18 PolarHBondContact O-N 3.37Å; K14-L18 VanDerWaalsContact O-N 3.15Å; S15-L18 PolarHBondContact O-N 3.3Å; L18-I21 PolarHBondContact O-N 2.91Å; L18-I22 HydrophobicContact CD2-CD1 4.39Å; L18-I22 HydrophobicContact CG-CD1 4.02Å; L18-I22 WeakPolarHBondContact O-CB 3.23Å; L18-I22 VanDerWaalsContact O-CG1 3.28Å; L18-I22 WeakPolarHBondContact O-CG1 3.44Å; L18-I22 PolarHBondContact O-N 2.89Å
19	N	33.6	Very low	32	Very low	90 Å²	90	116.8 Å²	116.8	48%	0.481	55%	0.549	S	S	.	.	H	α-helix	trans	-62.9	-44.2	173.6	-74.1	-16.4	0	0	0	111.6	S15 I21 I22 D23	S15-N19 WeakPolarHBondContact O-CB 3.1Å; S15-N19 VanDerWaalsContact O-CG 3.25Å; S15-N19 PolarHBondContact O-N 3.42Å; S15-N19 PolarHBondContact O-ND2 3.19Å; N19-I21 VanDerWaalsContact C-N 3.31Å; N19-I21 PolarHBondContact O-N 3.01Å; N19-I22 PolarHBondContact O-N 2.91Å; N19-D23 VanDerWaalsContact O-CB 3.26Å; N19-D23 WeakPolarHBondContact O-CB 3.26Å; N19-D23 PolarHBondContact O-N 3.29Å
20	N	35.1	Very low	32.1	Very low	103 Å²	103	120.6 Å²	120.6	55%	0.551	56%	0.562	S	S	*	*	H	α-helix	trans	-60.7	-39	174.8	-74.2	1.2	0	0	0	112.3	R16 I17 D23 I24	R16-N20 VanDerWaalsContact O-CG 3.29Å; R16-N20 PolarHBondContact O-N 2.85Å; R16-N20 PolarHBondContact O-OD1 2.75Å; I17-N20 PolarHBondContact O-N 3.17Å; N20-D23 PolarHBondContact O-N 3.03Å; N20-I24 WeakPolarHBondContact O-CB 3.38Å; N20-I24 WeakPolarHBondContact O-CD1 3.16Å; N20-I24 WeakPolarHBondContact O-CG1 3.43Å; N20-I24 PolarHBondContact O-N 3.08Å
21	I	34.3	Very low	32	Very low	82 Å²	82	125.5 Å²	125.5	42%	0.421	57%	0.566	S	S	.	*	H	α-helix	trans	-68.2	-42.5	176.6	-70.5	168.6	0	0	0	111.2	I17 L18 N19 D23 I24 I25	I17-I21 HydrophobicContact CG2-CD1 3.91Å; I17-I21 WeakPolarHBondContact O-CG1 3.33Å; I17-I21 PolarHBondContact O-N 3.18Å; L18-I21 PolarHBondContact O-N 2.91Å; N19-I21 VanDerWaalsContact C-N 3.31Å; N19-I21 PolarHBondContact O-N 3.01Å; I21-D23 VanDerWaalsContact C-N 3.34Å; I21-I24 PolarHBondContact O-N 3.1Å; I21-I25 HydrophobicContact CG2-CD1 3.74Å; I21-I25 WeakPolarHBondContact O-CB 3.47Å; I21-I25 VanDerWaalsContact O-CG1 3.24Å; I21-I25 WeakPolarHBondContact O-CG1 3.45Å; I21-I25 PolarHBondContact O-N 3.26Å
22	I	36.4	Very low	31.9	Very low	78 Å²	78	133.3 Å²	133.3	40%	0.4	59%	0.593	S	S	.	*	H	α-helix	trans	-63.9	-40.9	175.6	-70.8	167.3	0	0	0	110.7	L18 N19 I25 F26	L18-I22 HydrophobicContact CD2-CD1 4.39Å; L18-I22 HydrophobicContact CG-CD1 4.02Å; L18-I22 WeakPolarHBondContact O-CB 3.23Å; L18-I22 VanDerWaalsContact O-CG1 3.28Å; L18-I22 WeakPolarHBondContact O-CG1 3.44Å; L18-I22 PolarHBondContact O-N 2.89Å; N19-I22 PolarHBondContact O-N 2.91Å; I22-I25 PolarHBondContact O-N 3.27Å; I22-F26 HydrophobicContact CG2-CD2 4.02Å; I22-F26 HydrophobicContact CG2-CE2 4.42Å; I22-F26 PolarHBondContact O-N 3Å
23	D	33.9	Very low	31.7	Very low	79 Å²	79	135.9 Å²	135.9	42%	0.422	59%	0.594	S	S	.	*	H	α-helix	trans	-67.8	-38.6	178.7	-155	52.9	0	0	0	111.7	N19 N20 I21 K27	N19-D23 VanDerWaalsContact O-CB 3.26Å; N19-D23 WeakPolarHBondContact O-CB 3.26Å; N19-D23 PolarHBondContact O-N 3.29Å; N20-D23 PolarHBondContact O-N 3.03Å; I21-D23 VanDerWaalsContact C-N 3.34Å; D23-K27 VanDerWaalsContact O-CB 3.24Å; D23-K27 WeakPolarHBondContact O-CB 3.3Å; D23-K27 VanDerWaalsContact O-CG 3.29Å; D23-K27 WeakPolarHBondContact O-CG 3.24Å; D23-K27 PolarHBondContact O-N 3.39Å; D23-K27 IonicContact OD1-NZ 2.95Å; D23-K27 WeakPolarHBondContact OD2-CE 3.45Å; D23-K27 IonicContact OD2-NZ 2.67Å; D23-K27 PolarHBondContact OD2-NZ 3.45Å
24	I	39.6	Very low	31.5	Very low	96 Å²	96	136.6 Å²	136.6	49%	0.492	60%	0.597	S	S	.	*	H	α-helix	trans	-63.4	-42.7	170.4	-72.8	164.9	0	0	0	111.3	N20 I21 R28	N20-I24 WeakPolarHBondContact O-CB 3.38Å; N20-I24 WeakPolarHBondContact O-CD1 3.16Å; N20-I24 WeakPolarHBondContact O-CG1 3.43Å; N20-I24 PolarHBondContact O-N 3.08Å; I21-I24 PolarHBondContact O-N 3.1Å; I24-R28 WeakPolarHBondContact O-CB 3.41Å; I24-R28 PolarHBondContact O-N 3.5Å
25	I	34.6	Very low	31.3	Very low	95 Å²	95	140.3 Å²	140.3	49%	0.487	62%	0.62	S	S	.	*	H	α-helix	trans	-69.6	-38	-179.9	-72.1	168.8	0	0	0	111.6	I21 I22 R29	I21-I25 HydrophobicContact CG2-CD1 3.74Å; I21-I25 WeakPolarHBondContact O-CB 3.47Å; I21-I25 VanDerWaalsContact O-CG1 3.24Å; I21-I25 WeakPolarHBondContact O-CG1 3.45Å; I21-I25 PolarHBondContact O-N 3.26Å; I22-I25 PolarHBondContact O-N 3.27Å; I25-R29 PolarHBondContact O-N 3.03Å
26	F	33	Very low	31.1	Very low	135 Å²	135	145.5 Å²	145.5	59%	0.592	64%	0.643	S	S	*	*	H	α-helix	trans	-73.7	-42.2	175.4	-95.3	-91.4	0	0	0	112.5	I22 R28 R29	I22-F26 HydrophobicContact CG2-CD2 4.02Å; I22-F26 HydrophobicContact CG2-CE2 4.42Å; I22-F26 PolarHBondContact O-N 3Å; F26-R28 VanDerWaalsContact C-N 3.33Å; F26-R28 PolarHBondContact O-N 3.41Å; F26-R29 PolarHBondContact O-N 3.41Å
27	K	34.1	Very low	31.1	Very low	133 Å²	133	143.8 Å²	143.8	58%	0.578	65%	0.65	S	S	*	*	H	α-helix	trans	-62.6	-37.8	175.3	-75.6	169.5	175	165.3	0	112.3	D23 R29	D23-K27 VanDerWaalsContact O-CB 3.24Å; D23-K27 WeakPolarHBondContact O-CB 3.3Å; D23-K27 VanDerWaalsContact O-CG 3.29Å; D23-K27 WeakPolarHBondContact O-CG 3.24Å; D23-K27 PolarHBondContact O-N 3.39Å; D23-K27 IonicContact OD1-NZ 2.95Å; D23-K27 WeakPolarHBondContact OD2-CE 3.45Å; D23-K27 IonicContact OD2-NZ 2.67Å; D23-K27 PolarHBondContact OD2-NZ 3.45Å; K27-R29 PolarHBondContact O-N 3.07Å
28	R	31.5	Very low	31	Very low	202 Å²	202	146 Å²	146	76%	0.762	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-8.4	172.4	-87.6	-176.4	155.8	166.3	-5.7	115.2	I24 F26	I24-R28 WeakPolarHBondContact O-CB 3.41Å; I24-R28 PolarHBondContact O-N 3.5Å; F26-R28 VanDerWaalsContact C-N 3.33Å; F26-R28 PolarHBondContact O-N 3.41Å
29	R	27.4	Very low	31.1	Very low	206 Å²	206	147.2 Å²	147.2	78%	0.777	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-1.4	-178.6	-152.9	166.8	-174.7	133.1	-0.3	114.3	I25 F26 K27	I25-R29 PolarHBondContact O-N 3.03Å; F26-R29 PolarHBondContact O-N 3.41Å; K27-R29 PolarHBondContact O-N 3.07Å
30	Y	29.7	Very low	30.8	Very low	208 Å²	208	149.1 Å²	149.1	82%	0.816	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	-6.2	174.9	-97	-83	0	0	0	114.7
31	Y	27.7	Very low	30.5	Very low	204 Å²	204	153.6 Å²	153.6	80%	0.8	69%	0.69	S	S	*	*	S	Bend	trans	-110.4	83.4	169.1	-87.4	-87.9	0	0	0	109.7
32	Y	25.4	Very low	30.2	Very low	224 Å²	224	155.8 Å²	155.8	88%	0.878	70%	0.703	S	S	*	*			trans	177.3	68.9	158.6	-95.8	-58.8	0	0	0	109
33	Y	24.1	Very low	29.6	Very low	193 Å²	193	160.8 Å²	160.8	76%	0.757	73%	0.725	S	S	*	*	S	Bend	trans	-162.5	59	169.6	-113.7	-66.8	0	0	0	111.2	K359	Y33-K359 PolarHBondContact OH-NZ 3.34Å
34	Y	25.9	Very low	29.3	Very low	215 Å²	215	162.4 Å²	162.4	84%	0.843	74%	0.738	S	S	*	*	S	Bend	trans	-160.1	162.5	153.6	-106.9	-74	0	0	0	107.5
35	D	25.8	Very low	28.7	Very low	145 Å²	145	163.2 Å²	163.2	78%	0.775	75%	0.747	S	S	*	*			trans	66.1	84.3	166.9	-42.6	-29.8	0	0	0	117.2
36	D	27.2	Very low	28.3	Very low	166 Å²	166	164.6 Å²	164.6	89%	0.888	76%	0.76	S	S	*	*			trans	-129.2	102.7	144.7	-92.5	-38.7	0	0	0	105.8
37	D	30.6	Very low	28.1	Very low	176 Å²	176	163.6 Å²	163.6	94%	0.941	77%	0.765	S	S	*	*			trans	-172.3	141.5	149.6	-99.6	-26.4	0	0	0	108.8
38	D	31.5	Very low	27.7	Very low	144 Å²	144	164.1 Å²	164.1	77%	0.77	78%	0.775	S	S	*	*			trans	-125.8	134.3	-150.4	-122.9	-21.9	0	0	0	113.4
39	N	30.9	Very low	27.5	Very low	117 Å²	117	160 Å²	160	63%	0.626	78%	0.777	S	S	*	*			trans	66.7	116.8	150.7	-55.4	-51.7	0	0	0	123.5
40	D	27.1	Very low	27.6	Very low	131 Å²	131	157 Å²	157	70%	0.701	78%	0.781	S	S	*	*				85.7	149.6	121.8	-62.1	-17.3	0	0	0	124.8
41	Y	30.8	Very low	27.3	Very low	196 Å²	196	154.1 Å²	154.1	77%	0.769	78%	0.778	S	S	*	*			trans	83.5	82.1	166.6	-68.6	-70.1	0	0	0	121.1
42	D	26.2	Very low	27.3	Very low	129 Å²	129	149.8 Å²	149.8	69%	0.69	78%	0.775	S	S	*	*				60.5	134.1	114.3	-60.9	-13.5	0	0	0	123.4
43	E	24.3	Very low	27.2	Very low	182 Å²	182	147.9 Å²	147.9	85%	0.85	77%	0.772	S	S	*	*			trans	44.6	126.4	143.7	-56	-165.7	148.8	0	0	119.7
44	T	28.3	Very low	27.4	Very low	114 Å²	114	145.6 Å²	145.6	70%	0.699	77%	0.772	S	S	*	*			cis	-163	152	42	49.3	0	0	0	0	114.7
45	T	27.6	Very low	27.6	Very low	113 Å²	113	141.8 Å²	141.8	69%	0.693	77%	0.767	S	S	*	*			trans	53.7	123.8	142.8	58.2	0	0	0	0	124
46	T	26.4	Very low	27.6	Very low	124 Å²	124	142.8 Å²	142.8	76%	0.761	77%	0.77	S	S	*	*			trans	66.5	140.9	139.9	55.9	0	0	0	0	120.1
47	T	27.5	Very low	27.6	Very low	114 Å²	114	139.9 Å²	139.9	70%	0.699	76%	0.755	S	S	*	*			cis	-155.6	163.1	8.5	-3.4	0	0	0	0	113
48	N	26.1	Very low	27.5	Very low	144 Å²	144	140.6 Å²	140.6	77%	0.77	75%	0.746	S	S	*	*			trans	65.1	93.6	152.7	-61.2	-12.1	0	0	0	121.3
49	S	27.2	Very low	27.4	Very low	115 Å²	115	138.6 Å²	138.6	80%	0.804	74%	0.735	S	S	*	*				-172.4	116	108	30.6	0	0	0	0	114.5
50	T	28.6	Very low	27.5	Very low	142 Å²	142	136.4 Å²	136.4	87%	0.871	73%	0.729	S	S	*	*			trans	34	100.1	151.5	49.2	0	0	0	0	122
51	I	23.7	Very low	27.7	Very low	148 Å²	148	135.5 Å²	135.5	76%	0.759	72%	0.723	S	S	*	*			trans	-54.8	163	146.9	-73.4	161.5	0	0	0	111.2
52	P	28.1	Very low	27.8	Very low	114 Å²	114	132.4 Å²	132.4	74%	0.74	72%	0.716	S	S	*	*			cis	-118	170	14.2	8.7	17.9	0	0	0	115.4
53	K	23.3	Very low	28.1	Very low	183 Å²	183	130.9 Å²	130.9	80%	0.796	71%	0.705	S	S	*	*			cis	65.8	96.9	18.7	-79.4	-167.4	175.4	-177.9	0	118
54	N	28.6	Very low	28.8	Very low	145 Å²	145	126.4 Å²	126.4	78%	0.775	69%	0.685	S	S	*	*			trans	-148.8	140.7	141.3	-111.7	33.6	0	0	0	111.5
55	D	29.3	Very low	29.1	Very low	136 Å²	136	125.2 Å²	125.2	73%	0.727	68%	0.675	S	S	*	*			trans	52.8	93.2	149.5	-48.1	-35.1	0	0	0	121	N57	D55-N57 PolarHBondContact O-N 2.96Å
56	I	26.3	Very low	29.6	Very low	165 Å²	165	125.4 Å²	125.4	85%	0.846	67%	0.668	S	S	*	*			trans	-75.9	110.3	154.6	-61.9	166.1	0	0	0	108.1
57	N	28	Very low	30.2	Very low	105 Å²	105	124.7 Å²	124.7	56%	0.561	65%	0.654	S	S	*	*			trans	-91.7	138.5	167.5	-169.7	18.9	0	0	0	111.5	D55 D59	D55-N57 PolarHBondContact O-N 2.96Å; N57-D59 VanDerWaalsContact C-N 3.34Å; N57-D59 PolarHBondContact ND2-OD2 3.29Å; N57-D59 PolarHBondContact O-N 2.82Å; N57-D59 PolarHBondContact OD1-OD2 3.46Å
58	Y	28.5	Very low	30.8	Very low	192 Å²	192	123.4 Å²	123.4	75%	0.753	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-15.2	-170.5	-118.7	-100.1	0	0	0	114.4	S60	Y58-S60 PolarHBondContact O-N 3.41Å
59	D	29	Very low	31.1	Very low	102 Å²	102	120.7 Å²	120.7	55%	0.545	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.7	-29.3	-174.8	-63.8	-48.6	0	0	0	114.1	N57 L61 Q62 E63	N57-D59 VanDerWaalsContact C-N 3.34Å; N57-D59 PolarHBondContact ND2-OD2 3.29Å; N57-D59 PolarHBondContact O-N 2.82Å; N57-D59 PolarHBondContact OD1-OD2 3.46Å; D59-L61 PolarHBondContact O-N 2.75Å; D59-L61 VanDerWaalsContact O-N 3.11Å; D59-Q62 PolarHBondContact O-N 3.27Å; D59-E63 PolarHBondContact O-N 2.88Å; D59-E63 VanDerWaalsContact O-N 3.14Å
60	S	32.1	Very low	31.6	Very low	70 Å²	70	120.3 Å²	120.3	49%	0.49	62%	0.615	S	S	.	*	H	α-helix	trans	-60.9	-25.9	-176.4	-55.3	0	0	0	0	113.5	Y58 E63 I64	Y58-S60 PolarHBondContact O-N 3.41Å; S60-E63 PolarHBondContact O-N 3.37Å; S60-I64 VanDerWaalsContact O-CG1 3.31Å; S60-I64 WeakPolarHBondContact O-CG1 3.42Å; S60-I64 PolarHBondContact O-N 3.35Å
61	L	31.9	Very low	31.8	Very low	112 Å²	112	120.8 Å²	120.8	59%	0.586	61%	0.605	S	S	*	*	H	α-helix	trans	-78.2	-25.6	176.1	-79.7	168.2	0	0	0	113.5	D59 N65	D59-L61 PolarHBondContact O-N 2.75Å; D59-L61 VanDerWaalsContact O-N 3.11Å; L61-N65 PolarHBondContact O-N 2.84Å; L61-N65 PolarHBondContact O-ND2 3.18Å
62	Q	32.3	Very low	32.2	Very low	132 Å²	132	119 Å²	119	62%	0.617	60%	0.596	S	S	*	*	H	α-helix	trans	-71.1	-43.8	165.2	-77.8	-152.1	20.8	0	0	110.6	D59 I64 N65 Q66	D59-Q62 PolarHBondContact O-N 3.27Å; Q62-I64 VanDerWaalsContact C-N 3.33Å; Q62-I64 PolarHBondContact O-N 3.47Å; Q62-N65 CarbonylContact O-C 3.59Å; Q62-N65 PolarHBondContact O-N 3.17Å; Q62-N65 VanDerWaalsContact O-N 3.13Å; Q62-Q66 WeakPolarHBondContact O-CG 3.28Å; Q62-Q66 PolarHBondContact O-N 3.41Å
63	E	33.9	Very low	32.3	Very low	97 Å²	97	119.4 Å²	119.4	45%	0.453	59%	0.588	S	S	.	*	H	α-helix	trans	-63.7	-38	-176.5	-136.3	-141.7	163.9	0	0	112.3	D59 S60 Q66 K67	D59-E63 PolarHBondContact O-N 2.88Å; D59-E63 VanDerWaalsContact O-N 3.14Å; S60-E63 PolarHBondContact O-N 3.37Å; E63-Q66 PolarHBondContact O-N 3.34Å; E63-K67 VanDerWaalsContact CD-CE 3.43Å; E63-K67 WeakPolarHBondContact O-CB 3.42Å; E63-K67 VanDerWaalsContact O-CG 3.26Å; E63-K67 WeakPolarHBondContact O-CG 3.49Å; E63-K67 PolarHBondContact O-N 3.38Å; E63-K67 WeakPolarHBondContact OE1-CE 3.24Å; E63-K67 IonicContact OE1-NZ 2.67Å; E63-K67 PolarHBondContact OE1-NZ 3.02Å; E63-K67 IonicContact OE2-NZ 2.65Å; E63-K67 PolarHBondContact OE2-NZ 2.97Å
64	I	37.9	Very low	32.8	Very low	87 Å²	87	116 Å²	116	45%	0.446	58%	0.575	S	S	.	*	H	α-helix	trans	-66.2	-42.5	173	-70.6	167.4	0	0	0	111.2	S60 Q62 Q66 K67 I68	S60-I64 VanDerWaalsContact O-CG1 3.31Å; S60-I64 WeakPolarHBondContact O-CG1 3.42Å; S60-I64 PolarHBondContact O-N 3.35Å; Q62-I64 VanDerWaalsContact C-N 3.33Å; Q62-I64 PolarHBondContact O-N 3.47Å; I64-Q66 PolarHBondContact O-N 3.28Å; I64-K67 PolarHBondContact O-N 3.31Å; I64-I68 HydrophobicContact CG2-CD1 3.85Å; I64-I68 WeakPolarHBondContact O-CB 3.27Å; I64-I68 VanDerWaalsContact O-CG1 3.31Å; I64-I68 WeakPolarHBondContact O-CG1 3.49Å; I64-I68 PolarHBondContact O-N 3.01Å
65	N	34.8	Very low	32.8	Very low	89 Å²	89	117.7 Å²	117.7	48%	0.476	58%	0.575	S	S	.	*	H	α-helix	trans	-66.3	-35.2	175.7	-86.4	-72.1	0	0	0	112.7	L61 Q62 N69	L61-N65 PolarHBondContact O-N 2.84Å; L61-N65 PolarHBondContact O-ND2 3.18Å; Q62-N65 CarbonylContact O-C 3.59Å; Q62-N65 PolarHBondContact O-N 3.17Å; Q62-N65 VanDerWaalsContact O-N 3.13Å; N65-N69 WeakPolarHBondContact O-CB 3.5Å; N65-N69 PolarHBondContact O-N 3.42Å; N65-N69 PolarHBondContact O-ND2 3.01Å
66	Q	37.4	Very low	32.7	Very low	118 Å²	118	115.4 Å²	115.4	55%	0.551	57%	0.57	S	S	*	*	H	α-helix	trans	-67.3	-44.7	171.3	-72.4	-173.4	6.4	0	0	111.2	Q62 E63 I64 I68 N69 M70	Q62-Q66 WeakPolarHBondContact O-CG 3.28Å; Q62-Q66 PolarHBondContact O-N 3.41Å; E63-Q66 PolarHBondContact O-N 3.34Å; I64-Q66 PolarHBondContact O-N 3.28Å; Q66-I68 VanDerWaalsContact C-N 3.3Å; Q66-I68 PolarHBondContact O-N 3.05Å; Q66-N69 PolarHBondContact O-N 3.25Å; Q66-M70 VanDerWaalsContact O-CB 3.24Å; Q66-M70 WeakPolarHBondContact O-CB 3.23Å; Q66-M70 WeakPolarHBondContact O-CG 3.34Å; Q66-M70 PolarHBondContact O-N 3.19Å
67	K	39	Very low	32.8	Very low	109 Å²	109	113.2 Å²	113.2	47%	0.474	56%	0.559	S	S	.	*	H	α-helix	trans	-63.6	-32.1	176.9	-74.6	167.1	-178.5	171.6	0	112.9	E63 I64 K71	E63-K67 VanDerWaalsContact CD-CE 3.43Å; E63-K67 WeakPolarHBondContact O-CB 3.42Å; E63-K67 VanDerWaalsContact O-CG 3.26Å; E63-K67 WeakPolarHBondContact O-CG 3.49Å; E63-K67 PolarHBondContact O-N 3.38Å; E63-K67 WeakPolarHBondContact OE1-CE 3.24Å; E63-K67 IonicContact OE1-NZ 2.67Å; E63-K67 PolarHBondContact OE1-NZ 3.02Å; E63-K67 IonicContact OE2-NZ 2.65Å; E63-K67 PolarHBondContact OE2-NZ 2.97Å; I64-K67 PolarHBondContact O-N 3.31Å; K67-K71 WeakPolarHBondContact O-CB 3.41Å; K67-K71 WeakPolarHBondContact O-CG 3.43Å; K67-K71 PolarHBondContact O-N 2.79Å; K67-K71 VanDerWaalsContact O-N 3.15Å
68	I	40.3	Very low	32.7	Very low	87 Å²	87	114.2 Å²	114.2	45%	0.446	56%	0.564	S	S	.	*	H	α-helix	trans	-72.8	-47.3	172.8	-70.6	168.9	0	0	0	111.3	I64 Q66 M70 K71 L72	I64-I68 HydrophobicContact CG2-CD1 3.85Å; I64-I68 WeakPolarHBondContact O-CB 3.27Å; I64-I68 VanDerWaalsContact O-CG1 3.31Å; I64-I68 WeakPolarHBondContact O-CG1 3.49Å; I64-I68 PolarHBondContact O-N 3.01Å; Q66-I68 VanDerWaalsContact C-N 3.3Å; Q66-I68 PolarHBondContact O-N 3.05Å; I68-M70 PolarHBondContact O-N 3.38Å; I68-K71 PolarHBondContact O-N 3.37Å; I68-L72 HydrophobicContact CG2-CD1 4.04Å; I68-L72 WeakPolarHBondContact O-CG 3.44Å; I68-L72 PolarHBondContact O-N 3.39Å
69	N	33.5	Very low	32.5	Very low	86 Å²	86	116.6 Å²	116.6	46%	0.46	57%	0.572	S	S	.	*	H	α-helix	trans	-64	-39.5	176.9	-81	-70.3	0	0	0	112.3	N65 Q66 K71 L72 Q73	N65-N69 WeakPolarHBondContact O-CB 3.5Å; N65-N69 PolarHBondContact O-N 3.42Å; N65-N69 PolarHBondContact O-ND2 3.01Å; Q66-N69 PolarHBondContact O-N 3.25Å; N69-K71 PolarHBondContact O-N 2.86Å; N69-L72 PolarHBondContact O-N 2.76Å; N69-Q73 WeakPolarHBondContact O-CB 3.49Å; N69-Q73 WeakPolarHBondContact O-CG 3.48Å; N69-Q73 PolarHBondContact O-N 3.09Å
70	M	36.6	Very low	32.3	Very low	108 Å²	108	117 Å²	117	53%	0.532	58%	0.583	S	S	.	*	H	α-helix	trans	-57.8	-47	171.6	-75.8	-85	-84.1	0	0	111.4	Q66 I68 L72 Q73 Q74	Q66-M70 VanDerWaalsContact O-CB 3.24Å; Q66-M70 WeakPolarHBondContact O-CB 3.23Å; Q66-M70 WeakPolarHBondContact O-CG 3.34Å; Q66-M70 PolarHBondContact O-N 3.19Å; I68-M70 PolarHBondContact O-N 3.38Å; M70-L72 VanDerWaalsContact C-N 3.29Å; M70-L72 PolarHBondContact O-N 3.32Å; M70-Q73 PolarHBondContact O-N 3.06Å; M70-Q74 VanDerWaalsContact O-CB 3.27Å; M70-Q74 WeakPolarHBondContact O-CB 3.27Å; M70-Q74 VanDerWaalsContact O-CG 3.26Å; M70-Q74 WeakPolarHBondContact O-CG 3.41Å; M70-Q74 PolarHBondContact O-N 3.12Å
71	K	33.4	Very low	31.9	Very low	152 Å²	152	118.1 Å²	118.1	66%	0.661	59%	0.591	S	S	*	*	H	α-helix	trans	-68.8	-23	177.2	-79.9	-178.9	175.1	177	0	114.1	K67 I68 N69	K67-K71 WeakPolarHBondContact O-CB 3.41Å; K67-K71 WeakPolarHBondContact O-CG 3.43Å; K67-K71 PolarHBondContact O-N 2.79Å; K67-K71 VanDerWaalsContact O-N 3.15Å; I68-K71 PolarHBondContact O-N 3.37Å; N69-K71 PolarHBondContact O-N 2.86Å
72	L	32.7	Very low	31.6	Very low	110 Å²	110	120.5 Å²	120.5	58%	0.576	60%	0.603	S	S	*	*	H	α-helix	trans	-80.8	-41.7	172.5	-72.4	168.4	0	0	0	111.9	I68 N69 M70 K75 S76	I68-L72 HydrophobicContact CG2-CD1 4.04Å; I68-L72 WeakPolarHBondContact O-CG 3.44Å; I68-L72 PolarHBondContact O-N 3.39Å; N69-L72 PolarHBondContact O-N 2.76Å; M70-L72 VanDerWaalsContact C-N 3.29Å; M70-L72 PolarHBondContact O-N 3.32Å; L72-K75 PolarHBondContact O-N 3.02Å; L72-S76 PolarHBondContact O-N 3.01Å; L72-S76 PolarHBondContact O-OG 3.19Å
73	Q	30.4	Very low	31.1	Very low	123 Å²	123	122.6 Å²	122.6	58%	0.575	62%	0.618	S	S	*	*	H	α-helix	trans	-70.6	-37.9	176.8	-70.7	-177.6	-9.3	0	0	112.7	N69 M70 K75 S76 I77	N69-Q73 WeakPolarHBondContact O-CB 3.49Å; N69-Q73 WeakPolarHBondContact O-CG 3.48Å; N69-Q73 PolarHBondContact O-N 3.09Å; M70-Q73 PolarHBondContact O-N 3.06Å; Q73-K75 PolarHBondContact O-N 3.11Å; Q73-S76 WeakPolarHBondContact CA-OG 3.38Å; Q73-S76 PolarHBondContact O-N 2.78Å; Q73-S76 VanDerWaalsContact O-N 3.11Å; Q73-S76 PolarHBondContact O-OG 2.73Å; Q73-I77 PolarHBondContact O-N 3.43Å
74	Q	32.1	Very low	30.6	Very low	112 Å²	112	126.2 Å²	126.2	52%	0.523	64%	0.639	S	S	.	*	H	α-helix	trans	-65	-19.9	172.7	-74	177.8	-14	0	0	113.3	M70 N78	M70-Q74 VanDerWaalsContact O-CB 3.27Å; M70-Q74 WeakPolarHBondContact O-CB 3.27Å; M70-Q74 VanDerWaalsContact O-CG 3.26Å; M70-Q74 WeakPolarHBondContact O-CG 3.41Å; M70-Q74 PolarHBondContact O-N 3.12Å; Q74-N78 PolarHBondContact O-ND2 3.02Å; Q74-N78 VanDerWaalsContact O-ND2 3.1Å
75	K	29.9	Very low	29.9	Very low	179 Å²	179	126.7 Å²	126.7	78%	0.778	65%	0.65	S	S	*	*	H	α-helix	trans	-89.7	-13.5	172.8	-86.4	-174.7	173.1	179.8	0	114.6	L72 Q73	L72-K75 PolarHBondContact O-N 3.02Å; Q73-K75 PolarHBondContact O-N 3.11Å
76	S	27.2	Very low	29.3	Very low	89 Å²	89	128.1 Å²	128.1	62%	0.622	67%	0.667	S	S	*	*	H	α-helix	trans	-96.1	-14.2	176.9	52.9	0	0	0	0	114.8	L72 Q73	L72-S76 PolarHBondContact O-N 3.01Å; L72-S76 PolarHBondContact O-OG 3.19Å; Q73-S76 WeakPolarHBondContact CA-OG 3.38Å; Q73-S76 PolarHBondContact O-N 2.78Å; Q73-S76 VanDerWaalsContact O-N 3.11Å; Q73-S76 PolarHBondContact O-OG 2.73Å
77	I	27.8	Very low	28.6	Very low	119 Å²	119	132.3 Å²	132.3	61%	0.61	68%	0.684	S	S	*	*	H	α-helix	trans	-99	-28.8	-178.5	-67.7	173.9	0	0	0	112.6	Q73 R79	Q73-I77 PolarHBondContact O-N 3.43Å; I77-R79 VanDerWaalsContact C-N 3.31Å; I77-R79 PolarHBondContact O-N 3.2Å
78	N	26.2	Very low	28	Very low	126 Å²	126	136.1 Å²	136.1	67%	0.674	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	47.8	-176.4	-74.9	-50.3	0	0	0	114.8	Q74	Q74-N78 PolarHBondContact O-ND2 3.02Å; Q74-N78 VanDerWaalsContact O-ND2 3.1Å
79	R	25.3	Very low	27.2	Very low	241 Å²	241	138.8 Å²	138.8	91%	0.909	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139	9.7	175.9	-104.2	-176.6	179.8	178.1	-0.3	116.7	I77	I77-R79 VanDerWaalsContact C-N 3.31Å; I77-R79 PolarHBondContact O-N 3.2Å
80	S	24.1	Very low	26.7	Very low	112 Å²	112	140.4 Å²	140.4	78%	0.783	73%	0.731	S	S	*	*	S	Bend	trans	-122.7	17.1	-179.4	51.1	0	0	0	0	114.7
81	S	23.8	Very low	26.1	Very low	93 Å²	93	145.7 Å²	145.7	65%	0.65	75%	0.747	S	S	*	*	S	Bend	trans	-163.5	66.9	178.7	58.2	0	0	0	0	113.8
82	L	24.3	Very low	25.6	Very low	161 Å²	161	148.5 Å²	148.5	84%	0.843	76%	0.755	S	S	*	*			trans	-174.6	57.9	164.8	-108.9	162.9	0	0	0	113.8
83	L	23.6	Very low	25.5	Very low	177 Å²	177	148.2 Å²	148.2	93%	0.927	76%	0.759	S	S	*	*	S	Bend	trans	-147.3	39.7	170.1	-92.5	-172	0	0	0	113.4
84	L	22.3	Very low	25.2	Very low	173 Å²	173	149.2 Å²	149.2	91%	0.906	77%	0.769	S	S	*	*	S	Bend	trans	-144.3	25.6	176.2	-148	80.2	0	0	0	115.3
85	S	22.5	Very low	24.8	Very low	97 Å²	97	152.3 Å²	152.3	68%	0.678	78%	0.78	S	S	*	*	S	Bend	trans	-164.5	76.1	176.2	58.3	0	0	0	0	113.7
86	S	23.5	Very low	24.6	Very low	118 Å²	118	150.3 Å²	150.3	83%	0.825	78%	0.778	S	S	*	*			trans	-179.6	78.3	157.5	-83.3	0	0	0	0	111.3
87	F	22.3	Very low	24.6	Very low	207 Å²	207	151.8 Å²	151.8	91%	0.908	78%	0.779	S	S	*	*			trans	-151.3	76.2	161.1	-107.3	-71.5	0	0	0	109.6
88	H	25.3	Very low	24.5	Very low	189 Å²	189	154 Å²	154	88%	0.875	79%	0.787	S	S	*	*			trans	-147.2	138.9	158.5	-130.8	-91.2	0	0	0	109.1
89	N	23.7	Very low	24.3	Very low	142 Å²	142	154.7 Å²	154.7	76%	0.759	79%	0.79	S	S	*	*			trans	-87.5	156	-165.1	-70.3	-27.5	0	0	0	113.7
90	T	22.8	Very low	24	Very low	121 Å²	121	147.2 Å²	147.2	74%	0.742	77%	0.774	S	S	*	*			trans	179.3	150.6	142	22.8	0	0	0	0	107.6
91	Y	24.3	Very low	24	Very low	218 Å²	218	149.6 Å²	149.6	86%	0.855	77%	0.773	S	S	*	*			cis	-147	161.8	0.4	-124.3	-62.1	0	0	0	110.1
92	Y	23.7	Very low	23.9	Very low	212 Å²	212	154.1 Å²	154.1	83%	0.831	78%	0.777	S	S	*	*			trans	-107.2	152.7	170.5	-120.3	-74.4	0	0	0	111.7
93	P	29.5	Very low	23.8	Very low	103 Å²	103	153.8 Å²	153.8	67%	0.669	77%	0.773	S	S	*	*			trans	-142.1	166	133	39.8	-25.7	0	0	0	112.1
94	N	24.9	Very low	23.6	Very low	145 Å²	145	151 Å²	151	78%	0.775	76%	0.759	S	S	*	*			cis	-152.7	-170.3	-2.8	-139.7	-34.7	0	0	0	112.8
95	K	24.2	Very low	23.5	Very low	176 Å²	176	152.7 Å²	152.7	77%	0.765	75%	0.753	S	S	*	*			trans	-69	165.3	175.7	-65	165.9	177.3	179.8	0	115
96	N	24.3	Very low	23.4	Very low	137 Å²	137	153 Å²	153	73%	0.733	76%	0.756	S	S	*	*				-166.5	165.3	55.5	-120.4	-11.3	0	0	0	115.6
97	N	28.8	Very low	23.2	Very low	121 Å²	121	152.7 Å²	152.7	65%	0.647	75%	0.753	S	S	*	*			trans	69.4	121.3	162.1	-68.5	4.9	0	0	0	118.9
98	Q	24.6	Very low	23.2	Very low	165 Å²	165	147.7 Å²	147.7	77%	0.771	74%	0.744	S	S	*	*				75.4	138.5	77.5	-70.7	-173.4	15.8	0	0	113.7
99	L	21.9	Very low	23	Very low	140 Å²	140	143.7 Å²	143.7	73%	0.733	74%	0.738	S	S	*	*			cis	-155.7	149.9	0.4	-153	75.8	0	0	0	112.1
100	S	19.8	Very low	22.8	Very low	84 Å²	84	142 Å²	142	59%	0.587	74%	0.737	S	S	*	*			trans	39.9	141.1	146	66.9	0	0	0	0	126.2
101	H	23.3	Very low	22.7	Very low	163 Å²	163	141.2 Å²	141.2	76%	0.755	74%	0.736	S	S	*	*				106.9	135.7	126.3	-89.2	-44.1	0	0	0	124.6
102	Y	22.7	Very low	22.7	Very low	187 Å²	187	139.4 Å²	139.4	73%	0.733	74%	0.74	S	S	*	*			trans	68.9	100.6	148.7	-85.4	-81.2	0	0	0	124.2
103	M	21.2	Very low	22.5	Very low	155 Å²	155	134.3 Å²	134.3	76%	0.764	74%	0.736	S	S	*	*				63.8	137.2	124.5	-68.8	-63	-162.4	0	0	125.7
104	D	20.2	Very low	22.2	Very low	117 Å²	117	134.7 Å²	134.7	63%	0.626	74%	0.741	S	S	*	*			trans	83.1	131.7	140.1	-104.8	25.9	0	0	0	125
105	R	20.9	Very low	22.1	Very low	209 Å²	209	132.8 Å²	132.8	79%	0.789	74%	0.739	S	S	*	*			trans	75.7	98	146.5	-71	171.8	-165.2	-122.2	-3.8	122.4
106	S	19.4	Very low	22.2	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	75%	0.745	S	S	*	*				78.2	125.9	120.6	64.4	0	0	0	0	122.8
107	S	20	Very low	22.1	Very low	111 Å²	111	140 Å²	140	78%	0.776	76%	0.757	S	S	*	*			trans	86.1	155.8	142.5	80.1	0	0	0	0	121.1
108	S	21.2	Very low	22	Very low	102 Å²	102	141.8 Å²	141.8	71%	0.713	77%	0.765	S	S	*	*			trans	73.6	90.4	170.9	67.7	0	0	0	0	120.5
109	S	21	Very low	22.2	Very low	106 Å²	106	139.2 Å²	139.2	74%	0.741	76%	0.756	S	S	*	*				51.5	127.3	122.7	60.8	0	0	0	0	123.8
110	S	20.7	Very low	22.5	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	75%	0.752	S	S	*	*				102.7	125.3	127.9	75.9	0	0	0	0	121.5
111	S	20.2	Very low	22.9	Very low	105 Å²	105	137.6 Å²	137.6	73%	0.734	75%	0.751	S	S	*	*			trans	42.4	118.2	146.2	57.7	0	0	0	0	121.3
112	L	23.9	Very low	23.2	Very low	179 Å²	179	135.4 Å²	135.4	94%	0.937	74%	0.744	S	S	*	*				-143.5	140.2	115.1	-143	76.6	0	0	0	111.2
113	S	20.2	Very low	23.6	Very low	106 Å²	106	132.3 Å²	132.3	74%	0.741	74%	0.74	S	S	*	*			trans	-115.4	144.8	176.8	61.6	0	0	0	0	110.8
114	S	22.7	Very low	24.1	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	73%	0.728	S	S	*	*				170.7	162.7	128.3	54.6	0	0	0	0	114.7
115	S	23.1	Very low	24.5	Very low	106 Å²	106	130.2 Å²	130.2	74%	0.741	72%	0.716	S	S	*	*			trans	64.7	77.9	145	-63.5	0	0	0	0	120.8
116	K	25.3	Very low	25	Very low	206 Å²	206	124.6 Å²	124.6	90%	0.896	70%	0.701	S	S	*	*				-159.6	75.8	129.7	-108.4	158	-171.6	171.6	0	112.3	I118	K116-I118 PolarHBondContact O-N 3.09Å
117	R	24.1	Very low	25.5	Very low	257 Å²	257	124.8 Å²	124.8	97%	0.97	69%	0.693	S	S	*	*			trans	-72.2	114.6	168.8	-78.2	-175.5	174.4	177.2	-1.4	109.8
118	I	26.8	Very low	26	Very low	160 Å²	160	121.3 Å²	121.3	82%	0.821	67%	0.666	S	S	*	*			trans	-93.9	134.2	167.4	-62.6	178	0	0	0	108.1	K116 P120	K116-I118 PolarHBondContact O-N 3.09Å; I118-P120 WeakPolarHBondContact O-CD 3.46Å
119	N	26.9	Very low	26.4	Very low	110 Å²	110	120.6 Å²	120.6	59%	0.588	65%	0.654	S	S	*	*			trans	-88.8	114.5	-161.8	-159.5	-7.7	0	0	0	112.3	T121 L122	N119-T121 VanDerWaalsContact C-N 3.3Å; N119-T121 PolarHBondContact O-N 3.04Å; N119-T121 PolarHBondContact OD1-OG1 3.02Å; N119-L122 PolarHBondContact O-N 3.02Å
120	P	28.4	Very low	26.7	Very low	100 Å²	100	122.9 Å²	122.9	65%	0.649	65%	0.65	S	S	*	*	H	α-helix	trans	-65.3	-28.1	-168.5	24.2	-34.6	0	0	0	114.3	I118 L122 N123	I118-P120 WeakPolarHBondContact O-CD 3.46Å; P120-L122 PolarHBondContact O-N 3.17Å; P120-L122 VanDerWaalsContact O-N 3.08Å; P120-N123 PolarHBondContact O-N 3.08Å; P120-N123 VanDerWaalsContact O-N 3.15Å
121	T	28.9	Very low	27.1	Very low	90 Å²	90	122.6 Å²	122.6	55%	0.552	64%	0.64	S	S	*	*	H	α-helix	trans	-57.4	-27.3	-178.5	-24.8	0	0	0	0	113.4	N119	N119-T121 VanDerWaalsContact C-N 3.3Å; N119-T121 PolarHBondContact O-N 3.04Å; N119-T121 PolarHBondContact OD1-OG1 3.02Å
122	L	29.9	Very low	27.4	Very low	118 Å²	118	121.5 Å²	121.5	62%	0.618	62%	0.622	S	S	*	*	H	α-helix	trans	-79.7	-31.5	-176.2	-137.5	159.2	0	0	0	111.9	N119 P120 Y125 L126	N119-L122 PolarHBondContact O-N 3.02Å; P120-L122 PolarHBondContact O-N 3.17Å; P120-L122 VanDerWaalsContact O-N 3.08Å; L122-Y125 PolarHBondContact O-N 3.37Å; L122-L126 HydrophobicContact CD2-CD1 3.91Å; L122-L126 HydrophobicContact CD2-CG 4.41Å; L122-L126 PolarHBondContact O-N 3.1Å; L122-L126 VanDerWaalsContact O-N 3.16Å
123	N	30.8	Very low	27.6	Very low	121 Å²	121	118.7 Å²	118.7	65%	0.647	60%	0.604	S	S	*	*	H	α-helix	trans	-74.7	-40.1	-178.4	-148.7	7	0	0	0	111.4	P120 Y125 L126 L127	P120-N123 PolarHBondContact O-N 3.08Å; P120-N123 VanDerWaalsContact O-N 3.15Å; N123-Y125 VanDerWaalsContact C-N 3.28Å; N123-Y125 PolarHBondContact O-N 2.79Å; N123-L126 PolarHBondContact O-N 3.12Å; N123-L127 PolarHBondContact O-N 3.19Å
124	W	31.7	Very low	27.9	Very low	136 Å²	136	123.1 Å²	123.1	52%	0.515	60%	0.604	S	S	.	*	H	α-helix	trans	-59.6	-37.4	172.7	-176.5	89.4	0	0	0	112.6	L2 N128	L2-W124 HydrophobicContact CD1-CH2 4.1Å; L2-W124 HydrophobicContact CD1-CZ3 4.11Å; L2-W124 HydrophobicContact CD2-CH2 4.02Å; W124-N128 WeakPolarHBondContact O-CB 3.49Å; W124-N128 PolarHBondContact O-N 3.44Å; W124-N128 PolarHBondContact O-ND2 3.15Å
125	Y	28.7	Very low	28.1	Very low	92 Å²	92	124.2 Å²	124.2	36%	0.361	60%	0.6	S	S	.	*	H	α-helix	trans	-66.6	-44.2	175.2	-111.8	-86.3	0	0	0	112.8	M1 L122 N123 L129	M1-Y125 WeakPolarHBondContact CB-OH 3.37Å; L122-Y125 PolarHBondContact O-N 3.37Å; N123-Y125 VanDerWaalsContact C-N 3.28Å; N123-Y125 PolarHBondContact O-N 2.79Å; Y125-L129 WeakPolarHBondContact O-CB 3.37Å; Y125-L129 PolarHBondContact O-N 3.17Å
126	L	30.6	Very low	28.1	Very low	92 Å²	92	127 Å²	127	48%	0.482	60%	0.596	S	S	.	*	H	α-helix	trans	-67.7	-36.3	177.8	-78.4	165.1	0	0	0	112.5	L122 N123 K130	L122-L126 HydrophobicContact CD2-CD1 3.91Å; L122-L126 HydrophobicContact CD2-CG 4.41Å; L122-L126 PolarHBondContact O-N 3.1Å; L122-L126 VanDerWaalsContact O-N 3.16Å; N123-L126 PolarHBondContact O-N 3.12Å; L126-K130 PolarHBondContact O-N 2.89Å
127	L	30.9	Very low	28.1	Very low	107 Å²	107	127.3 Å²	127.3	56%	0.56	59%	0.593	S	S	*	*	H	α-helix	trans	-68.3	-45	175.6	-163.9	69	0	0	0	111.5	N123 L129 K130 L131	N123-L127 PolarHBondContact O-N 3.19Å; L127-L129 VanDerWaalsContact C-N 3.34Å; L127-L129 PolarHBondContact O-N 3.11Å; L127-K130 PolarHBondContact O-N 3.28Å; L127-L131 HydrophobicContact CG-CD1 4.34Å; L127-L131 WeakPolarHBondContact O-CG 3.49Å; L127-L131 PolarHBondContact O-N 3.26Å
128	N	29.8	Very low	28.1	Very low	38 Å²	38	121.8 Å²	121.8	20%	0.203	58%	0.582	C	S	.	*	H	α-helix	trans	-63.1	-37	174.7	-91.8	-88	0	0	0	113	W124 K132	W124-N128 WeakPolarHBondContact O-CB 3.49Å; W124-N128 PolarHBondContact O-N 3.44Å; W124-N128 PolarHBondContact O-ND2 3.15Å; N128-K132 WeakPolarHBondContact O-CB 3.19Å; N128-K132 WeakPolarHBondContact O-CG 3.32Å; N128-K132 PolarHBondContact O-N 2.94Å
129	L	30.6	Very low	27.9	Very low	88 Å²	88	121 Å²	121	46%	0.461	58%	0.579	S	S	.	*	H	α-helix	trans	-64.3	-46.8	173.7	-90.1	161.1	0	0	0	111.5	Y125 L127 L131 K132 Q133	Y125-L129 WeakPolarHBondContact O-CB 3.37Å; Y125-L129 PolarHBondContact O-N 3.17Å; L127-L129 VanDerWaalsContact C-N 3.34Å; L127-L129 PolarHBondContact O-N 3.11Å; L129-L131 VanDerWaalsContact C-N 3.35Å; L129-L131 PolarHBondContact O-N 3.35Å; L129-K132 PolarHBondContact O-N 3.49Å; L129-Q133 WeakPolarHBondContact O-CB 3.43Å; L129-Q133 VanDerWaalsContact O-CG 3.3Å; L129-Q133 WeakPolarHBondContact O-CG 3.39Å; L129-Q133 PolarHBondContact O-N 3.04Å
130	K	26.9	Very low	27.8	Very low	154 Å²	154	123 Å²	123	67%	0.67	59%	0.59	S	S	*	*	H	α-helix	trans	-63.6	-37.2	177.2	-76.8	-175.2	174.5	-176.8	0	112.9	L126 L127 R134	L126-K130 PolarHBondContact O-N 2.89Å; L127-K130 PolarHBondContact O-N 3.28Å; K130-R134 WeakPolarHBondContact O-CB 3.46Å; K130-R134 PolarHBondContact O-N 3.06Å
131	L	28.7	Very low	27.8	Very low	99 Å²	99	126.9 Å²	126.9	52%	0.518	60%	0.599	S	S	.	*	H	α-helix	trans	-70	-44.5	175.1	-73.3	167.3	0	0	0	112.1	L127 L129 R134 I135	L127-L131 HydrophobicContact CG-CD1 4.34Å; L127-L131 WeakPolarHBondContact O-CG 3.49Å; L127-L131 PolarHBondContact O-N 3.26Å; L129-L131 VanDerWaalsContact C-N 3.35Å; L129-L131 PolarHBondContact O-N 3.35Å; L131-R134 PolarHBondContact O-N 3.06Å; L131-I135 PolarHBondContact O-N 3.05Å
132	K	27.2	Very low	27.6	Very low	82 Å²	82	129.4 Å²	129.4	36%	0.357	61%	0.609	S	S	.	*	H	α-helix	trans	-70.4	-30.9	178.4	-72.9	-169.5	175.4	-169.8	0	113.8	N128 L129 R134 I135 Y136	N128-K132 WeakPolarHBondContact O-CB 3.19Å; N128-K132 WeakPolarHBondContact O-CG 3.32Å; N128-K132 PolarHBondContact O-N 2.94Å; L129-K132 PolarHBondContact O-N 3.49Å; K132-R134 VanDerWaalsContact C-N 3.35Å; K132-I135 PolarHBondContact O-N 3.2Å; K132-Y136 PolarHBondContact O-N 3.34Å
133	Q	28	Very low	27.5	Very low	121 Å²	121	131.6 Å²	131.6	57%	0.565	62%	0.616	S	S	*	*	H	α-helix	trans	-69.2	-33.6	171.8	-75.1	175	-34.4	0	0	111.9	L129 I135 Y136 Y137	L129-Q133 WeakPolarHBondContact O-CB 3.43Å; L129-Q133 VanDerWaalsContact O-CG 3.3Å; L129-Q133 WeakPolarHBondContact O-CG 3.39Å; L129-Q133 PolarHBondContact O-N 3.04Å; Q133-I135 PolarHBondContact O-N 3.08Å; Q133-Y136 PolarHBondContact O-N 3.1Å; Q133-Y137 PolarHBondContact O-N 2.94Å
134	R	24.9	Very low	27.3	Very low	198 Å²	198	131.6 Å²	131.6	75%	0.747	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-5.8	177.8	-155.8	168.2	-166.8	151.3	5	114.5	K130 L131 K132	K130-R134 WeakPolarHBondContact O-CB 3.46Å; K130-R134 PolarHBondContact O-N 3.06Å; L131-R134 PolarHBondContact O-N 3.06Å; K132-R134 VanDerWaalsContact C-N 3.35Å
135	I	27.6	Very low	27.2	Very low	134 Å²	134	133.8 Å²	133.8	69%	0.687	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	4.5	172.6	-63.7	167.7	0	0	0	110.6	L131 K132 Q133	L131-I135 PolarHBondContact O-N 3.05Å; K132-I135 PolarHBondContact O-N 3.2Å; Q133-I135 PolarHBondContact O-N 3.08Å
136	Y	24.1	Very low	26.9	Very low	164 Å²	164	135.8 Å²	135.8	64%	0.643	65%	0.648	S	S	*	*	S	Bend	trans	-126.6	15.2	177.7	-106.7	-93.6	0	0	0	113.9	K9 K132 Q133	K9-Y136 PolarHBondContact NZ-OH 3.47Å; K132-Y136 PolarHBondContact O-N 3.34Å; Q133-Y136 PolarHBondContact O-N 3.1Å
137	Y	24.1	Very low	26.9	Very low	213 Å²	213	136.6 Å²	136.6	84%	0.835	66%	0.659	S	S	*	*	S	Bend	trans	-146.4	68.4	171.1	-92.6	-78.4	0	0	0	108.4	Q133	Q133-Y137 PolarHBondContact O-N 2.94Å
138	L	23.7	Very low	26.6	Very low	140 Å²	140	137 Å²	137	73%	0.733	67%	0.666	S	S	*	*			trans	-167.6	74.5	171.8	-107.1	167.9	0	0	0	108
139	N	23	Very low	26.4	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	69%	0.693	S	S	*	*			trans	174.1	68.7	157	-92.7	-1.9	0	0	0	108.2
140	D	24.3	Very low	26.2	Very low	150 Å²	150	145.3 Å²	145.3	80%	0.802	71%	0.71	S	S	*	*	S	Bend	trans	-150.2	111.5	164.6	-103.8	-35.5	0	0	0	107.1
141	H	29.8	Very low	26	Very low	182 Å²	182	146.3 Å²	146.3	84%	0.843	72%	0.717	S	S	*	*			trans	65.3	116	171.4	-67.2	-67.5	0	0	0	121.6
142	D	23.8	Very low	25.7	Very low	144 Å²	144	150.3 Å²	150.3	77%	0.77	73%	0.73	S	S	*	*			trans	-76.8	140.3	153.5	-56.9	-76.6	0	0	0	112.6
143	H	29.3	Very low	25.5	Very low	164 Å²	164	153.4 Å²	153.4	76%	0.759	75%	0.751	S	S	*	*				164.4	129	115.9	-95.6	-73.6	0	0	0	112.4
144	D	25.1	Very low	25.3	Very low	121 Å²	121	157.8 Å²	157.8	65%	0.647	77%	0.768	S	S	*	*			trans	32.4	137.1	143.2	-49.2	-42.2	0	0	0	120.9
145	H	30.4	Very low	25.1	Very low	182 Å²	182	158.5 Å²	158.5	84%	0.843	78%	0.776	S	S	*	*			cis	-157.1	164.8	30.3	-112.6	-48.8	0	0	0	113.2
146	D	22.5	Very low	24.8	Very low	134 Å²	134	161.2 Å²	161.2	72%	0.717	78%	0.783	S	S	*	*			trans	-77.9	166.1	167.4	-143.3	-17.8	0	0	0	110.6	T148	D146-T148 PolarHBondContact OD1-N 3.5Å
147	P	30.7	Very low	24.7	Very low	109 Å²	109	163 Å²	163	71%	0.708	79%	0.794	S	S	*	*				-149.9	132.6	68.4	36.9	-15.1	0	0	0	118.2
148	T	23.3	Very low	24.5	Very low	114 Å²	114	162.8 Å²	162.8	70%	0.699	80%	0.798	S	S	*	*			trans	64.7	125.1	138	62.4	0	0	0	0	121.8	D146	D146-T148 PolarHBondContact OD1-N 3.5Å
149	V	26.1	Very low	24.5	Very low	127 Å²	127	163.5 Å²	163.5	77%	0.77	80%	0.802	S	S	*	*				-173	138.3	114.5	140.3	0	0	0	0	112.6
150	Q	26.5	Very low	24.4	Very low	174 Å²	174	161.9 Å²	161.9	81%	0.813	79%	0.792	S	S	*	*			trans	55.6	92.9	162.8	-73.5	172.7	20.7	0	0	122.1
151	Q	22	Very low	24.4	Very low	175 Å²	175	162.5 Å²	162.5	82%	0.818	80%	0.795	S	S	*	*				14.8	113.9	124.8	-57.2	179.4	-1.8	0	0	119.9
152	K	22.7	Very low	24	Very low	183 Å²	183	158 Å²	158	80%	0.796	78%	0.784	S	S	*	*				176.1	152.5	106.7	-94.5	161.4	-174.4	172.7	0	112.9
153	N	23.2	Very low	24	Very low	148 Å²	148	162 Å²	162	79%	0.791	79%	0.79	S	S	*	*			trans	57.3	77.4	161.5	-62	-5.3	0	0	0	119.5
154	K	24.4	Very low	23.7	Very low	213 Å²	213	158.5 Å²	158.5	93%	0.926	79%	0.785	S	S	*	*			trans	-168.7	109.6	130.6	-104.9	153.1	-172.8	172.2	0	112.8
155	K	20	Very low	23.5	Very low	212 Å²	212	160.1 Å²	160.1	92%	0.922	79%	0.793	S	S	*	*			trans	-130.4	100.4	164.2	-88.2	-167.1	174.1	-172.8	0	109.6
156	K	22.1	Very low	23.1	Very low	192 Å²	192	159.8 Å²	159.8	84%	0.835	79%	0.792	S	S	*	*			trans	179.8	154.3	153.6	-103.7	175.4	-179.8	-174.7	0	107.6
157	F	21.4	Very low	23	Very low	201 Å²	201	162.9 Å²	162.9	88%	0.882	80%	0.799	S	S	*	*			trans	67.4	73.3	-174.2	-59.9	-79.4	0	0	0	117
158	F	20.9	Very low	22.6	Very low	208 Å²	208	165.5 Å²	165.5	91%	0.912	81%	0.806	S	S	*	*			trans	-165.3	102.9	145	-115.1	-73.3	0	0	0	108.9
159	L	22.3	Very low	22.6	Very low	156 Å²	156	167.3 Å²	167.3	82%	0.817	81%	0.811	S	S	*	*			trans	164.8	57.1	161.1	-97.8	161.3	0	0	0	113
160	I	22.7	Very low	22.5	Very low	110 Å²	110	168.6 Å²	168.6	56%	0.564	81%	0.809	S	S	*	*	S	Bend	trans	-140.5	144.6	154.1	-61.5	-174	0	0	0	106.1	T645	I160-T645 HydrophobicContact CD1-CG2 4.14Å
161	N	22.6	Very low	22.3	Very low	163 Å²	163	169 Å²	169	87%	0.872	81%	0.808	S	S	*	*			trans	66.6	78.1	-173.7	-62.6	-5.3	0	0	0	115.4
162	S	21.7	Very low	22.4	Very low	87 Å²	87	166 Å²	166	61%	0.608	81%	0.806	S	S	*	*			trans	-150.5	49.1	165.5	65.8	0	0	0	0	112.3
163	Y	23.2	Very low	22.5	Very low	228 Å²	228	165 Å²	165	89%	0.894	81%	0.81	S	S	*	*			trans	-154.2	67.3	172.3	-87.5	-64.9	0	0	0	110.9
164	S	23	Very low	22.5	Very low	92 Å²	92	165 Å²	165	64%	0.643	81%	0.81	S	S	*	*			trans	-165.9	54	168.5	-78.2	0	0	0	0	111.2
165	D	21.3	Very low	22.5	Very low	155 Å²	155	164.4 Å²	164.4	83%	0.829	81%	0.807	S	S	*	*			trans	-128.2	63	173.9	-88.7	-56.7	0	0	0	110.7
166	E	21.8	Very low	22.6	Very low	174 Å²	174	159.8 Å²	159.8	81%	0.813	80%	0.801	S	S	*	*			trans	-125.7	154.8	156.8	-70.9	-167.3	139	0	0	108.4
167	F	21.9	Very low	22.8	Very low	200 Å²	200	160.2 Å²	160.2	88%	0.877	80%	0.803	S	S	*	*			trans	74.7	45.4	-174.9	-67.1	-87	0	0	0	118.6
168	I	22.7	Very low	23.1	Very low	163 Å²	163	156 Å²	156	84%	0.836	79%	0.794	S	S	*	*			trans	-132.7	95.7	139.7	-53.7	-179.1	0	0	0	110.9
169	N	23.4	Very low	23.1	Very low	153 Å²	153	155.1 Å²	155.1	82%	0.818	80%	0.798	S	S	*	*			trans	-167.4	100.3	138.8	-118.4	-35.6	0	0	0	113.1
170	E	22.2	Very low	23.2	Very low	153 Å²	153	151.5 Å²	151.5	72%	0.715	79%	0.786	S	S	*	*	S	Bend	trans	-156.8	149.9	139	-134.7	-167.8	-136.4	0	0	111.4
171	K	24	Very low	23.3	Very low	184 Å²	184	157.2 Å²	157.2	80%	0.8	80%	0.802	S	S	*	*			trans	65.1	68.3	169.5	-57.3	-174.7	173.9	87.7	0	117.2
172	S	22.8	Very low	23.5	Very low	112 Å²	112	155.1 Å²	155.1	78%	0.783	79%	0.791	S	S	*	*			trans	-121.6	109.4	138.5	63.2	0	0	0	0	110.7
173	N	24.8	Very low	23.6	Very low	162 Å²	162	162.7 Å²	162.7	87%	0.866	81%	0.806	S	S	*	*			trans	-152.1	166.8	162.4	-137	-17.5	0	0	0	110.1
174	D	24.3	Very low	23.7	Very low	148 Å²	148	160.5 Å²	160.5	79%	0.791	80%	0.804	S	S	*	*			trans	59.1	82.5	-177	-76.1	-26.2	0	0	0	117.3
175	K	24.2	Very low	23.7	Very low	200 Å²	200	164.7 Å²	164.7	87%	0.87	82%	0.818	S	S	*	*			trans	-154.1	61.5	148	-123.5	166.1	-167.8	169.1	0	114.7
176	S	22.5	Very low	23.8	Very low	115 Å²	115	163.9 Å²	163.9	80%	0.804	81%	0.813	S	S	*	*			trans	-147	49.2	177.2	53.2	0	0	0	0	114.4
177	K	26.1	Very low	23.8	Very low	200 Å²	200	162.7 Å²	162.7	87%	0.87	81%	0.807	S	S	*	*			trans	-122.8	119.2	166.7	-83.9	-176.2	177.2	172.9	0	113.8
178	T	26.6	Very low	24	Very low	112 Å²	112	160.5 Å²	160.5	69%	0.687	81%	0.805	S	S	*	*			trans	67.1	80.1	143.7	-41	0	0	0	0	118.5	S180	T178-S180 PolarHBondContact O-N 2.79Å; T178-S180 VanDerWaalsContact O-N 3.13Å
179	L	22.2	Very low	24.2	Very low	190 Å²	190	158.8 Å²	158.8	100%	0.995	80%	0.802	S	S	*	*			trans	-68.7	84.5	138.4	-94.9	164.5	0	0	0	109
180	S	24.4	Very low	24.1	Very low	81 Å²	81	157.4 Å²	157.4	57%	0.566	80%	0.799	S	S	*	*			trans	-171.2	103.8	161.4	-172.2	0	0	0	0	111.2	T178	T178-S180 PolarHBondContact O-N 2.79Å; T178-S180 VanDerWaalsContact O-N 3.13Å
181	Y	24.4	Very low	24.4	Very low	229 Å²	229	158.6 Å²	158.6	90%	0.898	81%	0.805	S	S	*	*			trans	-147.7	117.6	150.2	-158.9	-95.1	0	0	0	108
182	N	26.4	Very low	24.4	Very low	119 Å²	119	157.7 Å²	157.7	64%	0.636	81%	0.808	S	S	*	*			trans	-69.8	146.9	179.6	-66.4	-52	0	0	0	109.2
183	R	23.5	Very low	25.1	Very low	246 Å²	246	157.6 Å²	157.6	93%	0.928	80%	0.804	S	S	*	*				58.2	48.2	53.2	-152.7	-168.2	-149	-138.6	3.6	113.5
184	Q	24.9	Very low	25.5	Very low	182 Å²	182	155.4 Å²	155.4	85%	0.85	80%	0.799	S	S	*	*			trans	-149.8	89.6	161.2	-153.7	168.7	11.2	0	0	112.9
185	L	23.4	Very low	25.4	Very low	181 Å²	181	157.1 Å²	157.1	95%	0.948	80%	0.804	S	S	*	*			trans	-166	102.3	150.5	-114.8	168.8	0	0	0	107
186	L	22.8	Very low	25.5	Very low	137 Å²	137	152.5 Å²	152.5	72%	0.717	80%	0.804	S	S	*	*			trans	-150.7	137.1	-174.9	-171.3	71.6	0	0	0	109.1
187	E	23.4	Very low	25.5	Very low	149 Å²	149	153 Å²	153	70%	0.696	80%	0.802	S	S	*	*			trans	48.8	112.5	158.6	-72.6	152	-159.6	0	0	120.1
188	N	24.3	Very low	25.4	Very low	155 Å²	155	148.1 Å²	148.1	83%	0.829	79%	0.793	S	S	*	*				164.6	150.7	115.9	-83.3	-58.8	0	0	0	108
189	V	27.1	Very low	25.3	Very low	126 Å²	126	147.6 Å²	147.6	76%	0.764	79%	0.794	S	S	*	*			cis	-137.6	153.3	23.8	171.2	0	0	0	0	110.9
190	T	22.5	Very low	25.4	Very low	125 Å²	125	143.8 Å²	143.8	77%	0.767	78%	0.783	S	S	*	*			trans	-94	135	168.6	43.2	0	0	0	0	113.5
191	Q	27.8	Very low	25.5	Very low	178 Å²	178	145 Å²	145	83%	0.832	79%	0.792	S	S	*	*			trans	-163.6	110.7	153.4	-116	165.5	62.8	0	0	115.5
192	L	23.9	Very low	25.8	Very low	165 Å²	165	138.6 Å²	138.6	86%	0.864	79%	0.786	S	S	*	*			trans	44.4	143.8	142.3	-63.4	167.4	0	0	0	125
193	P	37.2	Very low	25.8	Very low	110 Å²	110	138 Å²	138	71%	0.714	79%	0.791	S	S	*	*			trans	-103.9	-175.2	169.9	45.5	-37.8	0	0	0	112.5
194	P	33.5	Very low	26.2	Very low	115 Å²	115	132 Å²	132	75%	0.747	79%	0.787	S	S	*	*				-157.8	171.9	82.9	41.6	-20.3	0	0	0	119.2
195	M	22.2	Very low	26.9	Very low	184 Å²	184	128.6 Å²	128.6	91%	0.906	78%	0.781	S	S	*	*			trans	20.8	132.8	151	-61.7	179.3	68.9	0	0	124.5
196	A	26.6	Very low	27.2	Very low	104 Å²	104	127.6 Å²	127.6	86%	0.86	78%	0.775	S	S	*	*			trans	-163	174.3	138.4	0	0	0	0	0	111.2
197	T	23.3	Very low	27.8	Very low	126 Å²	126	125.7 Å²	125.7	77%	0.773	77%	0.774	S	S	*	*			trans	-121.4	162.9	-164.6	56.2	0	0	0	0	117.1
198	S	23.7	Very low	28.5	Very low	97 Å²	97	123.9 Å²	123.9	68%	0.678	78%	0.775	S	S	*	*			trans	70.4	117.5	141.9	55.7	0	0	0	0	123.1
199	S	23.9	Very low	29.4	Very low	100 Å²	100	124.1 Å²	124.1	70%	0.699	77%	0.771	S	S	*	*				73	132.6	128.5	63.6	0	0	0	0	124.2
200	S	25.3	Very low	30.3	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	77%	0.768	S	S	*	*			trans	64.9	148.7	145.4	45.7	0	0	0	0	120.1
201	S	25.8	Very low	31.4	Very low	108 Å²	108	126.6 Å²	126.6	76%	0.755	77%	0.765	S	S	*	*			cis	-169.4	162.1	-12.5	47.2	0	0	0	0	111.3
202	A	29.5	Very low	32.5	Very low	94 Å²	94	123.7 Å²	123.7	78%	0.777	75%	0.752	S	S	*	*			trans	66.5	159.9	157	0	0	0	0	0	118.8
203	S	28	Very low	34.1	Very low	106 Å²	106	122.1 Å²	122.1	74%	0.741	74%	0.74	S	S	*	*			cis	-171.5	127.6	-37.4	54.7	0	0	0	0	110.9
204	S	31.9	Very low	35.1	Very low	121 Å²	121	122.3 Å²	122.3	85%	0.846	73%	0.732	S	S	*	*			trans	-176.1	159.1	152.7	-90	0	0	0	0	112
205	P	38.2	Very low	36.6	Very low	110 Å²	110	121.5 Å²	121.5	71%	0.714	72%	0.718	S	S	*	*			trans	-131.1	172.5	-140.2	42.8	-29	0	0	0	118.8
206	L	29.4	Very low	39	Very low	159 Å²	159	119.2 Å²	119.2	83%	0.832	70%	0.703	S	S	*	*			trans	77.6	125.8	151.6	-79.4	155.6	0	0	0	120.9
207	S	36.2	Very low	41.1	Very low	98 Å²	98	121.6 Å²	121.6	69%	0.685	69%	0.694	S	S	*	*			trans	-151.9	137.4	158.7	-72.2	0	0	0	0	110.1	Q209	S207-Q209 VanDerWaalsContact C-N 3.3Å; S207-Q209 PolarHBondContact O-N 3Å
208	P	38.1	Very low	43.5	Very low	111 Å²	111	122.3 Å²	122.3	72%	0.721	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-1.2	-160.4	-21.6	35.3	0	0	0	117.8
209	Q	43.1	Very low	46	Very low	160 Å²	160	122.7 Å²	122.7	75%	0.748	68%	0.676	S	S	*	*	H	α-helix	trans	-81.3	-24	-169.7	-70.3	-175.1	-14.2	0	0	114.9	S207 Q213	S207-Q209 VanDerWaalsContact C-N 3.3Å; S207-Q209 PolarHBondContact O-N 3Å; Q209-Q213 PolarHBondContact O-N 3.11Å
210	Q	46.4	Very low	48.3	Very low	150 Å²	150	124.9 Å²	124.9	70%	0.701	67%	0.673	S	S	*	*	H	α-helix	trans	-73.2	-30.6	179.8	-70.9	-170.8	-4.6	0	0	113.1	Q213 Q214	Q210-Q213 PolarHBondContact O-N 3.25Å; Q210-Q214 PolarHBondContact O-N 2.89Å
211	Q	45.9	Very low	50.6	Low	152 Å²	152	125.4 Å²	125.4	71%	0.71	66%	0.663	S	S	*	*	H	α-helix	trans	-63.6	-41.1	174.9	-84.2	-175.8	-14.5	0	0	111.9	Q213 Q214 E215	Q211-Q213 VanDerWaalsContact C-N 3.32Å; Q211-Q213 PolarHBondContact O-N 3.47Å; Q211-Q214 PolarHBondContact O-N 3.18Å; Q211-E215 WeakPolarHBondContact O-CB 3.37Å; Q211-E215 PolarHBondContact O-N 3.31Å
212	Q	51.6	Low	53.1	Low	117 Å²	117	125.8 Å²	125.8	55%	0.547	65%	0.653	S	S	.	*	H	α-helix	trans	-64.7	-33.3	174.4	-78.5	-157.8	15.7	0	0	113.3	K216	Q212-K216 VanDerWaalsContact O-CB 3.31Å; Q212-K216 WeakPolarHBondContact O-CB 3.39Å; Q212-K216 VanDerWaalsContact O-CG 3.27Å; Q212-K216 WeakPolarHBondContact O-CG 3.28Å; Q212-K216 PolarHBondContact O-N 2.94Å
213	Q	55.5	Low	55.3	Low	133 Å²	133	130.3 Å²	130.3	62%	0.621	65%	0.65	S	S	*	*	H	α-helix	trans	-74	-37.2	174.9	-70.2	-161.6	8.7	0	0	112.5	Q209 Q210 Q211 K216 K217	Q209-Q213 PolarHBondContact O-N 3.11Å; Q210-Q213 PolarHBondContact O-N 3.25Å; Q211-Q213 VanDerWaalsContact C-N 3.32Å; Q211-Q213 PolarHBondContact O-N 3.47Å; Q213-K216 PolarHBondContact O-N 3.43Å; Q213-K217 WeakPolarHBondContact O-CB 3.29Å; Q213-K217 WeakPolarHBondContact O-CG 3.38Å; Q213-K217 PolarHBondContact O-N 2.65Å
214	Q	58.3	Low	57.4	Low	114 Å²	114	130.3 Å²	130.3	53%	0.533	64%	0.638	S	S	.	*	H	α-helix	trans	-67.9	-38.8	172.1	-72.1	-166.3	7	0	0	112	Q210 Q211 K217 K218	Q210-Q214 PolarHBondContact O-N 2.89Å; Q211-Q214 PolarHBondContact O-N 3.18Å; Q214-K217 PolarHBondContact O-N 3.34Å; Q214-K218 WeakPolarHBondContact O-CB 3.4Å; Q214-K218 WeakPolarHBondContact O-CG 3.39Å; Q214-K218 PolarHBondContact O-N 2.93Å
215	E	66.9	Low	59.4	Low	97 Å²	97	133.2 Å²	133.2	45%	0.453	63%	0.63	S	S	.	*	H	α-helix	trans	-59.8	-47.8	169.6	-92.4	-126.1	102	0	0	111.7	Q211 K217 K218 K219	Q211-E215 WeakPolarHBondContact O-CB 3.37Å; Q211-E215 PolarHBondContact O-N 3.31Å; E215-K217 VanDerWaalsContact C-N 3.34Å; E215-K217 PolarHBondContact O-N 3.45Å; E215-K218 PolarHBondContact O-N 2.95Å; E215-K219 VanDerWaalsContact O-CB 3.27Å; E215-K219 WeakPolarHBondContact O-CB 3.38Å; E215-K219 WeakPolarHBondContact O-CG 3.09Å; E215-K219 PolarHBondContact O-N 2.9Å; E215-K219 VanDerWaalsContact OE1-CE 3.24Å; E215-K219 WeakPolarHBondContact OE1-CE 3.45Å; E215-K219 IonicContact OE1-NZ 2.68Å; E215-K219 PolarHBondContact OE1-NZ 2.89Å; E215-K219 IonicContact OE2-NZ 2.65Å; E215-K219 PolarHBondContact OE2-NZ 3.27Å
216	K	70.7	Confident	61.2	Low	137 Å²	137	132.6 Å²	132.6	60%	0.596	62%	0.618	S	S	*	*	H	α-helix	trans	-64.7	-36.7	178	-77.4	167.1	177.7	164.1	0	111.7	Q212 Q213 K220	Q212-K216 VanDerWaalsContact O-CB 3.31Å; Q212-K216 WeakPolarHBondContact O-CB 3.39Å; Q212-K216 VanDerWaalsContact O-CG 3.27Å; Q212-K216 WeakPolarHBondContact O-CG 3.28Å; Q212-K216 PolarHBondContact O-N 2.94Å; Q213-K216 PolarHBondContact O-N 3.43Å; K216-K220 VanDerWaalsContact O-CB 3.26Å; K216-K220 WeakPolarHBondContact O-CB 3.4Å; K216-K220 PolarHBondContact O-N 3.18Å
217	K	71.2	Confident	63.2	Low	154 Å²	154	131 Å²	131	67%	0.67	61%	0.606	S	S	*	*	H	α-helix	trans	-65.3	-50.7	170.3	-78.4	-176.4	176.2	-179.4	0	111.7	Q213 Q214 E215 K219 K220 Q221	Q213-K217 WeakPolarHBondContact O-CB 3.29Å; Q213-K217 WeakPolarHBondContact O-CG 3.38Å; Q213-K217 PolarHBondContact O-N 2.65Å; Q214-K217 PolarHBondContact O-N 3.34Å; E215-K217 VanDerWaalsContact C-N 3.34Å; E215-K217 PolarHBondContact O-N 3.45Å; K217-K219 PolarHBondContact O-N 3.01Å; K217-K220 PolarHBondContact O-N 3.45Å; K217-Q221 WeakPolarHBondContact O-CB 3.47Å; K217-Q221 PolarHBondContact O-N 3.34Å
218	K	73.7	Confident	64.6	Low	141 Å²	141	131.9 Å²	131.9	61%	0.613	60%	0.6	S	S	*	*	H	α-helix	trans	-58.2	-47.9	176.9	-78	-178.2	176.7	-179.3	0	111.8	Q214 E215 K220 Q221 Q222	Q214-K218 WeakPolarHBondContact O-CB 3.4Å; Q214-K218 WeakPolarHBondContact O-CG 3.39Å; Q214-K218 PolarHBondContact O-N 2.93Å; E215-K218 PolarHBondContact O-N 2.95Å; K218-K220 PolarHBondContact O-N 3.09Å; K218-Q221 PolarHBondContact O-N 3.14Å; K218-Q222 WeakPolarHBondContact O-CB 3.25Å; K218-Q222 PolarHBondContact O-N 3.05Å
219	K	75.9	Confident	66.2	Low	105 Å²	105	131.5 Å²	131.5	46%	0.457	59%	0.588	S	S	.	*	H	α-helix	trans	-63.9	-34.4	176	-76.1	165.6	171.2	157	0	112.4	E215 K217 R223	E215-K219 VanDerWaalsContact O-CB 3.27Å; E215-K219 WeakPolarHBondContact O-CB 3.38Å; E215-K219 WeakPolarHBondContact O-CG 3.09Å; E215-K219 PolarHBondContact O-N 2.9Å; E215-K219 VanDerWaalsContact OE1-CE 3.24Å; E215-K219 WeakPolarHBondContact OE1-CE 3.45Å; E215-K219 IonicContact OE1-NZ 2.68Å; E215-K219 PolarHBondContact OE1-NZ 2.89Å; E215-K219 IonicContact OE2-NZ 2.65Å; E215-K219 PolarHBondContact OE2-NZ 3.27Å; K217-K219 PolarHBondContact O-N 3.01Å; K219-R223 WeakPolarHBondContact O-CB 3.26Å; K219-R223 WeakPolarHBondContact O-CG 3.41Å; K219-R223 PolarHBondContact O-N 2.92Å
220	K	73.6	Confident	67.2	Low	146 Å²	146	131.4 Å²	131.4	64%	0.635	58%	0.581	S	S	*	*	H	α-helix	trans	-69.2	-43.1	172.4	-171.2	174.3	-178	179.5	0	112.1	K216 K217 K218 R223 Q224	K216-K220 VanDerWaalsContact O-CB 3.26Å; K216-K220 WeakPolarHBondContact O-CB 3.4Å; K216-K220 PolarHBondContact O-N 3.18Å; K217-K220 PolarHBondContact O-N 3.45Å; K218-K220 PolarHBondContact O-N 3.09Å; K220-R223 PolarHBondContact O-N 3.47Å; K220-Q224 PolarHBondContact O-N 2.98Å
221	Q	73.2	Confident	67.8	Low	120 Å²	120	130.1 Å²	130.1	56%	0.561	58%	0.575	S	S	*	*	H	α-helix	trans	-70.1	-35.5	178.9	-149.9	170.8	19.7	0	0	111.8	K217 K218 Q224 R225	K217-Q221 WeakPolarHBondContact O-CB 3.47Å; K217-Q221 PolarHBondContact O-N 3.34Å; K218-Q221 PolarHBondContact O-N 3.14Å; Q221-Q224 PolarHBondContact O-N 3.26Å; Q221-R225 WeakPolarHBondContact O-CG 3.27Å; Q221-R225 PolarHBondContact O-N 3.01Å
222	Q	78.3	Confident	68.3	Low	117 Å²	117	127.6 Å²	127.6	55%	0.547	56%	0.563	S	S	.	*	H	α-helix	trans	-69.8	-37.9	172.3	-168.8	177.6	19.8	0	0	111.6	K218 R225 Q226	K218-Q222 WeakPolarHBondContact O-CB 3.25Å; K218-Q222 PolarHBondContact O-N 3.05Å; Q222-R225 PolarHBondContact O-N 3.13Å; Q222-Q226 WeakPolarHBondContact O-CB 3.48Å; Q222-Q226 WeakPolarHBondContact O-CG 3.25Å; Q222-Q226 PolarHBondContact O-N 3.4Å
223	R	75.2	Confident	68.3	Low	188 Å²	188	126.1 Å²	126.1	71%	0.709	56%	0.556	S	S	*	*	H	α-helix	trans	-61.9	-46.2	168.5	-83.3	-176	173.1	-162.5	-1.9	111.6	K219 K220 Q226 Q227	K219-R223 WeakPolarHBondContact O-CB 3.26Å; K219-R223 WeakPolarHBondContact O-CG 3.41Å; K219-R223 PolarHBondContact O-N 2.92Å; K220-R223 PolarHBondContact O-N 3.47Å; R223-Q226 CarbonylContact O-C 3.55Å; R223-Q226 PolarHBondContact O-N 3.43Å; R223-Q227 WeakPolarHBondContact O-CB 3.48Å; R223-Q227 PolarHBondContact O-N 2.7Å
224	Q	72.4	Confident	68.1	Low	107 Å²	107	125.7 Å²	125.7	50%	0.5	55%	0.554	S	S	.	*	H	α-helix	trans	-60.3	-45.3	175	-81.7	-179	-67.4	0	0	112.1	K220 Q221 Q226 Q227 Q228	K220-Q224 PolarHBondContact O-N 2.98Å; Q221-Q224 PolarHBondContact O-N 3.26Å; Q224-Q226 PolarHBondContact O-N 3.12Å; Q224-Q227 WeakPolarHBondContact O-CB 3.41Å; Q224-Q227 PolarHBondContact O-N 2.82Å; Q224-Q228 PolarHBondContact O-N 2.76Å
225	R	74.4	Confident	67.4	Low	181 Å²	181	127 Å²	127	68%	0.683	56%	0.56	S	S	*	*	H	α-helix	trans	-60.8	-41.1	173.7	-76.9	-176.1	172.1	-171.2	-3.1	112.3	Q221 Q222 Q227 H229	Q221-R225 WeakPolarHBondContact O-CG 3.27Å; Q221-R225 PolarHBondContact O-N 3.01Å; Q222-R225 PolarHBondContact O-N 3.13Å; R225-Q227 VanDerWaalsContact C-N 3.26Å; R225-Q227 PolarHBondContact O-N 2.77Å; R225-H229 WeakPolarHBondContact O-CB 3.33Å; R225-H229 PolarHBondContact O-N 3.39Å
226	Q	74.6	Confident	66.1	Low	98 Å²	98	128.2 Å²	128.2	46%	0.458	57%	0.566	S	S	.	*	H	α-helix	trans	-68.2	-21.4	172.8	-78	-173	-3	0	0	114.1	Q222 R223 Q224 R230	Q222-Q226 WeakPolarHBondContact O-CB 3.48Å; Q222-Q226 WeakPolarHBondContact O-CG 3.25Å; Q222-Q226 PolarHBondContact O-N 3.4Å; R223-Q226 CarbonylContact O-C 3.55Å; R223-Q226 PolarHBondContact O-N 3.43Å; Q224-Q226 PolarHBondContact O-N 3.12Å; Q226-R230 VanDerWaalsContact O-CB 3.31Å; Q226-R230 WeakPolarHBondContact O-CB 3.4Å; Q226-R230 WeakPolarHBondContact O-CG 3.37Å; Q226-R230 PolarHBondContact O-N 3.27Å; Q226-R230 VanDerWaalsContact O-N 3.13Å; Q226-R230 PolarHBondContact O-NE 3.15Å
227	Q	71.3	Confident	64.6	Low	125 Å²	125	126.6 Å²	126.6	58%	0.584	56%	0.56	S	S	*	*	H	α-helix	trans	-84.4	-44.1	177.4	-142.4	168.6	1.2	0	0	110.5	R223 Q224 R225 R230 Q231	R223-Q227 WeakPolarHBondContact O-CB 3.48Å; R223-Q227 PolarHBondContact O-N 2.7Å; Q224-Q227 WeakPolarHBondContact O-CB 3.41Å; Q224-Q227 PolarHBondContact O-N 2.82Å; R225-Q227 VanDerWaalsContact C-N 3.26Å; R225-Q227 PolarHBondContact O-N 2.77Å; Q227-R230 PolarHBondContact O-N 3Å; Q227-Q231 WeakPolarHBondContact O-CG 3.37Å; Q227-Q231 PolarHBondContact O-N 3.19Å
228	Q	67.1	Low	62.9	Low	117 Å²	117	126.4 Å²	126.4	55%	0.547	56%	0.561	S	S	.	*	H	α-helix	trans	-60.7	-45.1	169.5	-72.5	176.1	-48.8	0	0	111.2	Q224 R230 Q231 Q232	Q224-Q228 PolarHBondContact O-N 2.76Å; Q228-R230 VanDerWaalsContact C-N 3.32Å; Q228-R230 PolarHBondContact O-N 3.01Å; Q228-Q231 PolarHBondContact O-N 3.29Å; Q228-Q231 VanDerWaalsContact O-N 3.15Å; Q228-Q232 WeakPolarHBondContact O-CB 3.42Å; Q228-Q232 WeakPolarHBondContact O-CG 3.5Å; Q228-Q232 PolarHBondContact O-N 3.19Å
229	H	71.5	Confident	60.9	Low	102 Å²	102	123.9 Å²	123.9	47%	0.472	56%	0.561	S	S	.	*	H	α-helix	trans	-69.2	-29.2	177.7	-156.8	60.3	0	0	0	112.3	R225 Q233	R225-H229 WeakPolarHBondContact O-CB 3.33Å; R225-H229 PolarHBondContact O-N 3.39Å; H229-Q233 PolarHBondContact CD2-NE2 2.95Å; H229-Q233 VanDerWaalsContact CD2-NE2 3.31Å; H229-Q233 PolarHBondContact NE2-NE2 3.45Å; H229-Q233 VanDerWaalsContact O-CB 3.26Å; H229-Q233 WeakPolarHBondContact O-CB 3.28Å; H229-Q233 WeakPolarHBondContact O-CG 3.43Å; H229-Q233 PolarHBondContact O-N 3.43Å
230	R	63.8	Low	58.7	Low	158 Å²	158	127.4 Å²	127.4	60%	0.596	58%	0.577	S	S	*	*	H	α-helix	trans	-71.2	-35.4	167.9	-91.3	-176.4	-92.3	-155.4	-10.4	113.4	Q226 Q227 Q228 Q233 H234	Q226-R230 VanDerWaalsContact O-CB 3.31Å; Q226-R230 WeakPolarHBondContact O-CB 3.4Å; Q226-R230 WeakPolarHBondContact O-CG 3.37Å; Q226-R230 PolarHBondContact O-N 3.27Å; Q226-R230 VanDerWaalsContact O-N 3.13Å; Q226-R230 PolarHBondContact O-NE 3.15Å; Q227-R230 PolarHBondContact O-N 3Å; Q228-R230 VanDerWaalsContact C-N 3.32Å; Q228-R230 PolarHBondContact O-N 3.01Å; R230-Q233 PolarHBondContact O-N 2.96Å; R230-H234 WeakPolarHBondContact O-CB 3.2Å; R230-H234 PolarHBondContact O-N 2.92Å
231	Q	58.8	Low	56.5	Low	123 Å²	123	125.3 Å²	125.3	58%	0.575	58%	0.576	S	S	*	*	H	α-helix	trans	-67.3	-43.2	173.4	-75.7	173.4	-25.8	0	0	111.3	Q227 Q228 H234 Q235	Q227-Q231 WeakPolarHBondContact O-CG 3.37Å; Q227-Q231 PolarHBondContact O-N 3.19Å; Q228-Q231 PolarHBondContact O-N 3.29Å; Q228-Q231 VanDerWaalsContact O-N 3.15Å; Q231-H234 PolarHBondContact O-N 3.39Å; Q231-Q235 WeakPolarHBondContact O-CG 3.22Å; Q231-Q235 PolarHBondContact O-N 3.08Å
232	Q	56.4	Low	54.4	Low	99 Å²	99	130.8 Å²	130.8	46%	0.463	59%	0.592	S	S	.	*	H	α-helix	trans	-62.8	-43.2	171.4	-73	175.7	-23.3	0	0	111.6	Q228 H234 Q235 Q236	Q228-Q232 WeakPolarHBondContact O-CB 3.42Å; Q228-Q232 WeakPolarHBondContact O-CG 3.5Å; Q228-Q232 PolarHBondContact O-N 3.19Å; Q232-H234 PolarHBondContact O-N 3.42Å; Q232-Q235 PolarHBondContact O-N 3.12Å; Q232-Q236 WeakPolarHBondContact O-CB 3.4Å; Q232-Q236 WeakPolarHBondContact O-CG 3.49Å; Q232-Q236 PolarHBondContact O-N 3.41Å
233	Q	52.5	Low	51.9	Low	87 Å²	87	133.4 Å²	133.4	41%	0.407	61%	0.61	S	S	.	*	H	α-helix	trans	-64.8	-35.9	174.7	-77.6	178.2	4.9	0	0	112.5	H229 R230 Q236 Q237	H229-Q233 PolarHBondContact CD2-NE2 2.95Å; H229-Q233 VanDerWaalsContact CD2-NE2 3.31Å; H229-Q233 PolarHBondContact NE2-NE2 3.45Å; H229-Q233 VanDerWaalsContact O-CB 3.26Å; H229-Q233 WeakPolarHBondContact O-CB 3.28Å; H229-Q233 WeakPolarHBondContact O-CG 3.43Å; H229-Q233 PolarHBondContact O-N 3.43Å; R230-Q233 PolarHBondContact O-N 2.96Å; Q233-Q236 PolarHBondContact O-N 3.2Å; Q233-Q237 VanDerWaalsContact O-CB 3.23Å; Q233-Q237 WeakPolarHBondContact O-CB 3.45Å; Q233-Q237 WeakPolarHBondContact O-CG 3.41Å; Q233-Q237 PolarHBondContact O-N 2.87Å
234	H	49.5	Very low	49.8	Very low	123 Å²	123	127.6 Å²	127.6	57%	0.569	61%	0.608	S	S	*	*	H	α-helix	trans	-68.2	-39.4	171.5	-96.8	-0.3	0	0	0	112.6	R230 Q231 Q232 Q236 Q237 H238	R230-H234 WeakPolarHBondContact O-CB 3.2Å; R230-H234 PolarHBondContact O-N 2.92Å; Q231-H234 PolarHBondContact O-N 3.39Å; Q232-H234 PolarHBondContact O-N 3.42Å; H234-Q236 VanDerWaalsContact C-N 3.32Å; H234-Q236 PolarHBondContact O-N 3.32Å; H234-Q237 PolarHBondContact ND1-OE1 3.15Å; H234-Q237 PolarHBondContact O-N 2.79Å; H234-H238 WeakPolarHBondContact O-CB 3.5Å; H234-H238 PolarHBondContact O-CD2 2.94Å; H234-H238 PolarHBondContact O-N 3.15Å
235	Q	43.3	Very low	47.6	Very low	141 Å²	141	132.4 Å²	132.4	66%	0.659	63%	0.627	S	S	*	*	H	α-helix	trans	-66.4	-33.4	173.8	-73.3	173.4	-23.3	0	0	112.2	Q231 Q232 S239	Q231-Q235 WeakPolarHBondContact O-CG 3.22Å; Q231-Q235 PolarHBondContact O-N 3.08Å; Q232-Q235 PolarHBondContact O-N 3.12Å; Q235-S239 PolarHBondContact O-N 2.95Å; Q235-S239 PolarHBondContact O-OG 2.85Å
236	Q	41.3	Very low	45.3	Very low	124 Å²	124	134.1 Å²	134.1	58%	0.579	64%	0.64	S	S	*	*	H	α-helix	trans	-80.8	-28.4	175.6	-70.3	-177	6	0	0	113.5	Q232 Q233 H234 S239 K240	Q232-Q236 WeakPolarHBondContact O-CB 3.4Å; Q232-Q236 WeakPolarHBondContact O-CG 3.49Å; Q232-Q236 PolarHBondContact O-N 3.41Å; Q233-Q236 PolarHBondContact O-N 3.2Å; H234-Q236 VanDerWaalsContact C-N 3.32Å; H234-Q236 PolarHBondContact O-N 3.32Å; Q236-S239 WeakPolarHBondContact CA-OG 3.28Å; Q236-S239 PolarHBondContact O-N 2.97Å; Q236-S239 PolarHBondContact O-OG 3.02Å; Q236-K240 PolarHBondContact O-N 3.26Å
237	Q	37.9	Very low	43.1	Very low	103 Å²	103	134.8 Å²	134.8	48%	0.481	65%	0.653	S	S	.	*	H	α-helix	trans	-71.5	-42	169.9	-77.5	169.2	-16.4	0	0	111.1	Q233 H234 S239 K240 T241	Q233-Q237 VanDerWaalsContact O-CB 3.23Å; Q233-Q237 WeakPolarHBondContact O-CB 3.45Å; Q233-Q237 WeakPolarHBondContact O-CG 3.41Å; Q233-Q237 PolarHBondContact O-N 2.87Å; H234-Q237 PolarHBondContact ND1-OE1 3.15Å; H234-Q237 PolarHBondContact O-N 2.79Å; Q237-S239 PolarHBondContact O-N 2.87Å; Q237-K240 PolarHBondContact O-N 2.98Å; Q237-T241 PolarHBondContact O-N 3.42Å; Q237-T241 PolarHBondContact O-OG1 3.38Å
238	H	36.2	Very low	41.1	Very low	150 Å²	150	138.6 Å²	138.6	69%	0.694	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-17.5	173.1	-93.9	-78.2	0	0	0	114.1	H234	H234-H238 WeakPolarHBondContact O-CB 3.5Å; H234-H238 PolarHBondContact O-CD2 2.94Å; H234-H238 PolarHBondContact O-N 3.15Å
239	S	31.5	Very low	39.5	Very low	87 Å²	87	143 Å²	143	61%	0.608	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	1.5	175.4	48.7	0	0	0	0	114.6	Q235 Q236 Q237	Q235-S239 PolarHBondContact O-N 2.95Å; Q235-S239 PolarHBondContact O-OG 2.85Å; Q236-S239 WeakPolarHBondContact CA-OG 3.28Å; Q236-S239 PolarHBondContact O-N 2.97Å; Q236-S239 PolarHBondContact O-OG 3.02Å; Q237-S239 PolarHBondContact O-N 2.87Å
240	K	29.5	Very low	37.8	Very low	180 Å²	180	144.5 Å²	144.5	78%	0.783	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	12.7	175	-70.1	-171.4	175.3	-179.8	0	115.2	Q236 Q237	Q236-K240 PolarHBondContact O-N 3.26Å; Q237-K240 PolarHBondContact O-N 2.98Å
241	T	28	Very low	36.5	Very low	102 Å²	102	142.7 Å²	142.7	63%	0.626	69%	0.692	S	S	*	*	S	Bend	trans	-123.1	25.4	179.6	54.7	0	0	0	0	115	Q237	Q237-T241 PolarHBondContact O-N 3.42Å; Q237-T241 PolarHBondContact O-OG1 3.38Å
242	W	28.3	Very low	35.6	Very low	234 Å²	234	141.7 Å²	141.7	89%	0.886	69%	0.69	S	S	*	*			trans	-120.9	22.8	173.6	-100.1	70.9	0	0	0	114.9
243	N	26.9	Very low	34.6	Very low	173 Å²	173	143.2 Å²	143.2	93%	0.925	70%	0.7	S	S	*	*	S	Bend	trans	-102.3	90.6	165.5	-94.4	-17.9	0	0	0	110.4
244	G	29.8	Very low	33.9	Very low	65 Å²	65	143.1 Å²	143.1	67%	0.67	70%	0.7	S	S	*	*	S	Bend	trans	154.9	135.6	173.5	0	0	0	0	0	113.5
245	K	27.8	Very low	33.3	Very low	209 Å²	209	142.2 Å²	142.2	91%	0.909	70%	0.696	S	S	*	*			trans	59.1	73.4	170.5	-59.8	-178.4	179.5	178.7	0	116.3	P247	K245-P247 WeakPolarHBondContact O-CD 3.31Å
246	K	24.7	Very low	33	Very low	216 Å²	216	144.9 Å²	144.9	94%	0.939	70%	0.7	S	S	*	*			trans	-60.9	131.4	157.9	-65.1	175.3	179.4	174.5	0	110.7
247	P	29.1	Very low	32.7	Very low	113 Å²	113	145.4 Å²	145.4	73%	0.734	70%	0.7	S	S	*	*			trans	-118.1	111.6	167.1	26.5	-8.1	0	0	0	113	K245 R249	K245-P247 WeakPolarHBondContact O-CD 3.31Å; P247-R249 PolarHBondContact O-N 3.2Å
248	K	29.8	Very low	32.7	Very low	204 Å²	204	147.9 Å²	147.9	89%	0.887	71%	0.705	S	S	*	*	S	Bend	trans	24.8	67.2	148.7	-58.7	-175.2	178.1	-175.8	0	118.2
249	R	33.6	Very low	32.8	Very low	209 Å²	209	148.4 Å²	148.4	79%	0.789	71%	0.705	S	S	*	*	S	Bend	trans	-137.9	-21.5	161.3	-138.4	169.2	-173.1	141.1	3.9	116.3	P247	P247-R249 PolarHBondContact O-N 3.2Å
250	N	35.2	Very low	32.9	Very low	134 Å²	134	148.3 Å²	148.3	72%	0.717	71%	0.705	S	S	*	*	S	Bend	trans	-92.4	-11.3	179.7	-68.1	11.3	0	0	0	114.7	E254	N250-E254 PolarHBondContact O-N 3.13Å
251	L	37	Very low	33	Very low	121 Å²	121	145.3 Å²	145.3	63%	0.634	70%	0.697	S	S	*	*	H	α-helix	trans	-65.4	-39.6	174.3	-93.3	84.5	0	0	0	111.8	L253 E254 E255	L251-L253 PolarHBondContact O-N 2.6Å; L251-E254 PolarHBondContact O-N 2.86Å; L251-E254 VanDerWaalsContact O-N 3.14Å; L251-E255 WeakPolarHBondContact O-CB 3.47Å; L251-E255 WeakPolarHBondContact O-CG 3.34Å; L251-E255 PolarHBondContact O-N 3.23Å
252	I	38.4	Very low	33.2	Very low	102 Å²	102	145.7 Å²	145.7	52%	0.523	70%	0.7	S	S	.	*	H	α-helix	trans	-65.9	-38.4	-173.6	-59.8	174.5	0	0	0	111.6	W256	I252-W256 WeakPolarHBondContact O-CB 3.45Å; I252-W256 PolarHBondContact O-N 2.89Å
253	L	36.6	Very low	33.3	Very low	130 Å²	130	140.2 Å²	140.2	68%	0.681	69%	0.692	S	S	*	*	H	α-helix	trans	-72.8	-31	174.5	-84.5	88.5	0	0	0	113	L251 K257	L251-L253 PolarHBondContact O-N 2.6Å; L253-K257 PolarHBondContact O-N 3.25Å
254	E	36.9	Very low	33.4	Very low	86 Å²	86	140 Å²	140	40%	0.402	69%	0.685	S	S	.	*	H	α-helix	trans	-71.3	-39.2	174.1	-84	-72.5	119.3	0	0	112.1	N250 L251 K257 R258	N250-E254 PolarHBondContact O-N 3.13Å; L251-E254 PolarHBondContact O-N 2.86Å; L251-E254 VanDerWaalsContact O-N 3.14Å; E254-K257 PolarHBondContact O-N 2.92Å; E254-R258 WeakPolarHBondContact O-CG 3.48Å; E254-R258 PolarHBondContact O-N 3.19Å; E254-R258 IonicContact OE2-CZ 2.69Å; E254-R258 IonicContact OE2-NE 3.16Å; E254-R258 IonicContact OE2-NH2 3.34Å; E254-R258 PolarHBondContact OE2-NH2 3.29Å
255	E	37.9	Very low	33.3	Very low	103 Å²	103	144.1 Å²	144.1	48%	0.481	69%	0.692	S	S	.	*	H	α-helix	trans	-67.6	-37.4	173.4	-72.9	178.1	137.3	0	0	111.8	L251 R258 K259	L251-E255 WeakPolarHBondContact O-CB 3.47Å; L251-E255 WeakPolarHBondContact O-CG 3.34Å; L251-E255 PolarHBondContact O-N 3.23Å; E255-R258 PolarHBondContact O-N 2.72Å; E255-K259 VanDerWaalsContact O-CB 3.31Å; E255-K259 WeakPolarHBondContact O-CB 3.35Å; E255-K259 WeakPolarHBondContact O-CG 3.46Å; E255-K259 PolarHBondContact O-N 3.04Å
256	W	36.3	Very low	33.3	Very low	197 Å²	197	144.1 Å²	144.1	75%	0.746	69%	0.692	S	S	*	*	H	α-helix	trans	-65.7	-36.9	173.2	-87.6	58.2	0	0	0	112.6	I252 S260	I252-W256 WeakPolarHBondContact O-CB 3.45Å; I252-W256 PolarHBondContact O-N 2.89Å; W256-S260 PolarHBondContact O-N 3.31Å; W256-S260 VanDerWaalsContact O-N 3.15Å
257	K	35.7	Very low	33.3	Very low	135 Å²	135	139.3 Å²	139.3	59%	0.587	68%	0.681	S	S	*	*	H	α-helix	trans	-64.7	-54.7	170	-82.7	-169.6	167.5	-165.9	0	111.9	L253 E254 K259 S260 D261	L253-K257 PolarHBondContact O-N 3.25Å; E254-K257 PolarHBondContact O-N 2.92Å; K257-K259 VanDerWaalsContact C-N 3.27Å; K257-K259 PolarHBondContact O-N 2.86Å; K257-S260 WeakPolarHBondContact O-CA 3.46Å; K257-S260 WeakPolarHBondContact O-CB 3.28Å; K257-S260 PolarHBondContact O-N 2.95Å; K257-D261 PolarHBondContact O-N 3.03Å
258	R	37.5	Very low	33.2	Very low	156 Å²	156	141.1 Å²	141.1	59%	0.589	69%	0.685	S	S	*	*	H	α-helix	trans	-58.6	-37.6	-178	-69.6	176.2	-150.8	170	8.2	112.8	E254 E255 D261 T262	E254-R258 WeakPolarHBondContact O-CG 3.48Å; E254-R258 PolarHBondContact O-N 3.19Å; E254-R258 IonicContact OE2-CZ 2.69Å; E254-R258 IonicContact OE2-NE 3.16Å; E254-R258 IonicContact OE2-NH2 3.34Å; E254-R258 PolarHBondContact OE2-NH2 3.29Å; E255-R258 PolarHBondContact O-N 2.72Å; R258-D261 PolarHBondContact O-N 3.07Å; R258-T262 PolarHBondContact O-N 3.11Å; R258-T262 VanDerWaalsContact O-N 3.1Å; R258-T262 PolarHBondContact O-OG1 3.18Å
259	K	37.4	Very low	33.3	Very low	161 Å²	161	139.8 Å²	139.8	70%	0.7	69%	0.685	S	S	*	*	H	α-helix	trans	-69.7	-26.8	173.2	-75	-174.3	174.1	-174.6	0	113.9	E255 K257	E255-K259 VanDerWaalsContact O-CB 3.31Å; E255-K259 WeakPolarHBondContact O-CB 3.35Å; E255-K259 WeakPolarHBondContact O-CG 3.46Å; E255-K259 PolarHBondContact O-N 3.04Å; K257-K259 VanDerWaalsContact C-N 3.27Å; K257-K259 PolarHBondContact O-N 2.86Å
260	S	35.2	Very low	32.8	Very low	85 Å²	85	137.6 Å²	137.6	59%	0.594	68%	0.684	S	S	*	*	H	α-helix	trans	-70	-35.8	168.4	-166	0	0	0	0	111.5	W256 K257	W256-S260 PolarHBondContact O-N 3.31Å; W256-S260 VanDerWaalsContact O-N 3.15Å; K257-S260 WeakPolarHBondContact O-CA 3.46Å; K257-S260 WeakPolarHBondContact O-CB 3.28Å; K257-S260 PolarHBondContact O-N 2.95Å
261	D	29.9	Very low	32.4	Very low	116 Å²	116	138.4 Å²	138.4	62%	0.62	69%	0.688	S	S	*	*	H	α-helix	trans	-83.6	-9.9	-176.7	-56.6	-33.8	0	0	0	113.2	K257 R258 V263	K257-D261 PolarHBondContact O-N 3.03Å; R258-D261 PolarHBondContact O-N 3.07Å; D261-V263 VanDerWaalsContact C-N 3.28Å; D261-V263 PolarHBondContact O-N 3.19Å
262	T	32.7	Very low	32.1	Very low	111 Å²	111	138.9 Å²	138.9	68%	0.681	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	6.4	-179.7	-17.9	0	0	0	0	114.6	R258	R258-T262 PolarHBondContact O-N 3.11Å; R258-T262 VanDerWaalsContact O-N 3.1Å; R258-T262 PolarHBondContact O-OG1 3.18Å
263	V	32	Very low	31.6	Very low	118 Å²	118	139.2 Å²	139.2	72%	0.715	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-3	-169.2	-172.6	0	0	0	0	113.3	D261	D261-V263 VanDerWaalsContact C-N 3.28Å; D261-V263 PolarHBondContact O-N 3.19Å
264	Q	28.6	Very low	31.3	Very low	170 Å²	170	141.7 Å²	141.7	79%	0.794	71%	0.713	S	S	*	*	S	Bend	trans	-88.3	-8.6	-175.5	-68.7	-135.9	-65.3	0	0	116.4
265	N	26.8	Very low	31.4	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	73%	0.73	S	S	*	*			trans	-108.8	58.2	-175.1	-79.3	-7.1	0	0	0	113.9
266	F	27.5	Very low	32	Very low	210 Å²	210	142.4 Å²	142.4	92%	0.921	74%	0.735	S	S	*	*			trans	-142.8	84.9	153.6	-93.9	-73	0	0	0	109.3
267	T	25.8	Very low	33.3	Very low	115 Å²	115	138.9 Å²	138.9	71%	0.706	73%	0.725	S	S	*	*			trans	-82.7	153.3	165.8	43.8	0	0	0	0	110.3
268	N	26.2	Very low	35.2	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	71%	0.708	S	S	*	*			trans	69.1	90.5	172.7	-51.3	-8.4	0	0	0	116.3
269	I	31.6	Very low	37.4	Very low	175 Å²	175	127 Å²	127	90%	0.897	68%	0.68	S	S	*	*				-152.7	151	114.2	-96.3	152.9	0	0	0	107.3
270	E	24.4	Very low	39.5	Very low	164 Å²	164	120.2 Å²	120.2	77%	0.766	65%	0.653	S	S	*	*			trans	-93.2	160.6	-163.7	-55.5	173.3	117	0	0	114
271	N	25.8	Very low	41.9	Very low	150 Å²	150	116.1 Å²	116.1	80%	0.802	62%	0.624	S	S	*	*			trans	54	78.6	148.8	-60.5	-31.7	0	0	0	119.9
272	V	31	Very low	44.4	Very low	132 Å²	132	115.9 Å²	115.9	80%	0.8	61%	0.614	S	S	*	*			trans	-136.8	132.3	139.5	-175.3	0	0	0	0	109.9	F274	V272-F274 HydrophobicContact CG1-CD2 4.09Å; V272-F274 HydrophobicContact CG1-CE2 4.24Å
273	S	28.2	Very low	46.9	Very low	108 Å²	108	111.2 Å²	111.2	76%	0.755	59%	0.585	S	S	*	*			trans	-103.2	112.6	-177.1	47.7	0	0	0	0	113
274	F	30.2	Very low	48.9	Very low	183 Å²	183	109.4 Å²	109.4	80%	0.803	57%	0.565	S	S	*	*			trans	-140.6	110.7	161.1	-81.7	-74.9	0	0	0	111.1	V272 T276	V272-F274 HydrophobicContact CG1-CD2 4.09Å; V272-F274 HydrophobicContact CG1-CE2 4.24Å; F274-T276 PolarHBondContact O-N 3.28Å
275	S	38.6	Very low	51.2	Low	110 Å²	110	105.8 Å²	105.8	77%	0.769	55%	0.551	S	S	*	*			trans	-96.5	80.6	174.2	-170.4	0	0	0	0	109.8	K277	S275-K277 PolarHBondContact O-N 3.45Å
276	T	49.7	Very low	53.4	Low	93 Å²	93	101.6 Å²	101.6	57%	0.571	54%	0.544	S	S	*	.			trans	-70.9	107	177.5	49.8	0	0	0	0	110.1	F274 V278	F274-T276 PolarHBondContact O-N 3.28Å; T276-V278 PolarHBondContact O-N 3.37Å
277	K	64.6	Low	55.9	Low	124 Å²	124	96.2 Å²	96.2	54%	0.539	52%	0.524	S	S	.	.			trans	-80.8	45.7	-176.5	-78.6	-171.8	176.5	-178.3	0	113.1	S275 L279 L294	S275-K277 PolarHBondContact O-N 3.45Å; K277-L279 PolarHBondContact O-N 3.25Å; K277-L294 HydrophobicContact CB-CD1 4.2Å; K277-L294 WeakPolarHBondContact O-CD1 3.49Å
278	V	75.8	Confident	58.5	Low	40 Å²	40	94.4 Å²	94.4	24%	0.242	51%	0.508	C	S	.	.			trans	-57.6	135.5	-178.8	-167.1	0	0	0	0	111.1	T276 K290 D292 S336	T276-V278 PolarHBondContact O-N 3.37Å; V278-K290 HydrophobicContact CG1-CB 4.16Å; V278-K290 HydrophobicContact CG1-CG 4.34Å; V278-D292 HydrophobicContact CG1-CB 4.45Å; V278-D292 HydrophobicContact CG2-CB 4.12Å; V278-S336 VanDerWaalsContact O-CA 3.25Å; V278-S336 WeakPolarHBondContact O-CA 3.44Å; V278-S336 PolarHBondContact O-N 3.25Å; V278-S336 VanDerWaalsContact O-N 3.09Å
279	L	82.6	Confident	61.2	Low	0 Å²	0	88.5 Å²	88.5	0%	0	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.6	162.6	160.9	60.6	0	0	0	108.6	K277 I281 K290 L291 L294 T331 L334 L339	K277-L279 PolarHBondContact O-N 3.25Å; L279-I281 HydrophobicContact CD1-CG1 4.15Å; L279-I281 HydrophobicContact CD2-CD1 4.25Å; L279-I281 HydrophobicContact CG-CD1 4.15Å; L279-I281 HydrophobicContact CG-CG1 4.19Å; L279-K290 WeakPolarHBondContact O-CA 3.44Å; L279-L291 HydrophobicContact CB-CB 4.36Å; L279-L291 HydrophobicContact CD2-CD1 3.94Å; L279-L291 HydrophobicContact CG-CD1 4.29Å; L279-L291 PolarHBondContact N-O 3.29Å; L279-L291 VanDerWaalsContact N-O 3.12Å; L279-L291 PolarHBondContact O-N 3.42Å; L279-L294 HydrophobicContact CB-CD2 3.52Å; L279-L294 HydrophobicContact CD2-CD2 3.89Å; L279-L294 HydrophobicContact CG-CD2 4.37Å; L279-T331 HydrophobicContact CD2-CG2 3.88Å; L279-L334 HydrophobicContact CD1-CB 4.25Å; L279-L334 HydrophobicContact CD2-CB 4.05Å; L279-L339 HydrophobicContact CD1-CD1 3.74Å; L279-L339 HydrophobicContact CD1-CG 3.79Å
280	T	83.2	Confident	63.6	Low	19 Å²	19	86 Å²	86	12%	0.117	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.2	177.6	-58.8	0	0	0	0	110.1	E288 L289 K290 K337 T338 L339	T280-E288 HydrophobicContact CG2-CG 3.54Å; T280-L289 CarbonylContact C-O 3.53Å; T280-L289 WeakPolarHBondContact CA-O 3.45Å; T280-K290 HydrophobicContact CG2-CG 4.15Å; T280-K337 PolarHBondContact N-O 2.83Å; T280-T338 HydrophobicContact CG2-CG2 4.03Å; T280-T338 CarbonylContact O-C 3.55Å; T280-T338 WeakPolarHBondContact O-CA 3.4Å; T280-L339 PolarHBondContact O-N 3.14Å
281	I	85.3	Confident	66.2	Low	0 Å²	0	79.3 Å²	79.3	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122	-179.4	-63.9	147.1	0	0	0	108.5	L279 F283 E288 L289 L291 L299 I303 L339 I341	L279-I281 HydrophobicContact CD1-CG1 4.15Å; L279-I281 HydrophobicContact CD2-CD1 4.25Å; L279-I281 HydrophobicContact CG-CD1 4.15Å; L279-I281 HydrophobicContact CG-CG1 4.19Å; I281-F283 HydrophobicContact CG2-CD2 4.32Å; I281-F283 HydrophobicContact CG2-CE2 3.84Å; I281-F283 HydrophobicContact CG2-CZ 4.09Å; I281-E288 CarbonylContact O-C 3.55Å; I281-E288 WeakPolarHBondContact O-CA 3.5Å; I281-L289 HydrophobicContact CB-CB 4.37Å; I281-L289 HydrophobicContact CD1-CD2 4.19Å; I281-L289 PolarHBondContact N-O 2.93Å; I281-L289 PolarHBondContact O-N 3.48Å; I281-L291 HydrophobicContact CD1-CD1 3.62Å; I281-L291 HydrophobicContact CD1-CG 4.41Å; I281-L299 HydrophobicContact CD1-CD1 4.3Å; I281-I303 HydrophobicContact CD1-CD1 3.74Å; I281-I303 HydrophobicContact CD1-CG1 4.11Å; I281-I303 HydrophobicContact CG1-CD1 4.31Å; I281-I303 HydrophobicContact CG2-CD1 4.04Å; I281-L339 HydrophobicContact CG1-CB 4.24Å; I281-L339 HydrophobicContact CG1-CD1 4.26Å; I281-I341 HydrophobicContact CG2-CD1 3.86Å; I281-I341 HydrophobicContact CG2-CG1 4.15Å
282	R	82.2	Confident	68.7	Low	110 Å²	110	76.6 Å²	76.6	42%	0.415	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131	174	-72.5	-179.7	171.9	140.3	9.5	111.1	D287 E288 L339 L340 I341	R282-D287 CarbonylContact C-O 3.52Å; R282-D287 WeakPolarHBondContact CA-O 3.19Å; R282-E288 HydrophobicContact CG-CB 4.36Å; R282-E288 HydrophobicContact CG-CG 4.09Å; R282-E288 IonicContact CZ-OE2 2.7Å; R282-E288 IonicContact NE-OE2 3.09Å; R282-E288 PolarHBondContact NE-OE2 2.92Å; R282-E288 IonicContact NH2-OE1 3.88Å; R282-E288 IonicContact NH2-OE2 3.31Å; R282-E288 PolarHBondContact NH2-OE2 3.15Å; R282-L339 PolarHBondContact N-O 3.44Å; R282-L340 HydrophobicContact CB-CD1 4.04Å; R282-I341 PolarHBondContact O-N 2.71Å
283	F	84.1	Confident	70.6	Confident	13 Å²	13	75.8 Å²	75.8	6%	0.057	41%	0.411	C	S	.	.			trans	-94	165.8	177	-66.8	-98.1	0	0	0	111.7	I281 N285 G286 D287 L289 I303 H306 L307 I341	I281-F283 HydrophobicContact CG2-CD2 4.32Å; I281-F283 HydrophobicContact CG2-CE2 3.84Å; I281-F283 HydrophobicContact CG2-CZ 4.09Å; F283-N285 WeakPolarHBondContact CB-OD1 3.31Å; F283-N285 PolarHBondContact O-N 2.92Å; F283-G286 PolarHBondContact O-N 2.82Å; F283-D287 HydrophobicContact CB-CB 4.31Å; F283-D287 HydrophobicContact CD2-CB 4.21Å; F283-D287 PolarHBondContact N-O 3.17Å; F283-L289 HydrophobicContact CE2-CB 3.86Å; F283-L289 HydrophobicContact CE2-CD2 4.46Å; F283-I303 HydrophobicContact CE1-CG2 3.74Å; F283-I303 HydrophobicContact CZ-CG2 3.85Å; F283-H306 HydrophobicContact CE1-CB 4.41Å; F283-H306 HydrophobicContact CZ-CB 3.91Å; F283-L307 HydrophobicContact CD1-CD2 4.22Å; F283-L307 HydrophobicContact CE1-CD2 3.89Å; F283-L307 HydrophobicContact CE1-CG 4.48Å; F283-I341 CarbonylContact C-O 3.58Å; F283-I341 HydrophobicContact CD1-CB 4.49Å; F283-I341 HydrophobicContact CD1-CD1 4.27Å; F283-I341 HydrophobicContact CE1-CD1 3.94Å; F283-I341 HydrophobicContact CZ-CD1 4.41Å
284	W	75.3	Confident	72.7	Confident	81 Å²	81	72.1 Å²	72.1	31%	0.307	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.3	-175.4	65.3	78	0	0	0	114.3	L307 I312 I314 I341 K343	W284-L307 HydrophobicContact CH2-CD2 3.56Å; W284-L307 HydrophobicContact CZ3-CD2 3.63Å; W284-I312 HydrophobicContact CZ2-CD1 3.97Å; W284-I314 HydrophobicContact CE3-CG2 3.75Å; W284-I314 HydrophobicContact CH2-CG2 4.29Å; W284-I314 HydrophobicContact CZ3-CD1 4.3Å; W284-I314 HydrophobicContact CZ3-CG2 3.59Å; W284-I341 HydrophobicContact CE3-CG2 3.88Å; W284-I341 HydrophobicContact CZ3-CG2 3.96Å; W284-I341 PolarHBondContact N-O 2.81Å; W284-K343 HydrophobicContact CB-CG 4Å; W284-K343 HydrophobicContact CD2-CG 4.02Å; W284-K343 HydrophobicContact CG-CD 4.31Å; W284-K343 HydrophobicContact CG-CG 3.67Å
285	N	77	Confident	74.8	Confident	94 Å²	94	65 Å²	65	50%	0.503	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-18.4	-179.6	59.5	-10.8	0	0	0	112.4	F283 D287	F283-N285 WeakPolarHBondContact CB-OD1 3.31Å; F283-N285 PolarHBondContact O-N 2.92Å; N285-D287 VanDerWaalsContact ND2-CG 3.3Å; N285-D287 PolarHBondContact ND2-OD2 2.92Å; N285-D287 PolarHBondContact OD1-N 3.11Å; N285-D287 VanDerWaalsContact OD1-N 3.15Å; N285-D287 PolarHBondContact OD1-OD2 3.31Å
286	G	73	Confident	76.5	Confident	62 Å²	62	64.5 Å²	64.5	64%	0.639	35%	0.351	S	S	*	.	S	Bend	trans	120.7	-11.9	-178	0	0	0	0	0	114.3	F283	F283-G286 PolarHBondContact O-N 2.82Å
287	D	78.7	Confident	78	Confident	96 Å²	96	65.2 Å²	65.2	51%	0.513	35%	0.348	S	S	.	.			trans	-68.6	146	-175.9	-57.5	-15.5	0	0	0	111.7	R282 F283 N285	R282-D287 CarbonylContact C-O 3.52Å; R282-D287 WeakPolarHBondContact CA-O 3.19Å; F283-D287 HydrophobicContact CB-CB 4.31Å; F283-D287 HydrophobicContact CD2-CB 4.21Å; F283-D287 PolarHBondContact N-O 3.17Å; N285-D287 VanDerWaalsContact ND2-CG 3.3Å; N285-D287 PolarHBondContact ND2-OD2 2.92Å; N285-D287 PolarHBondContact OD1-N 3.11Å; N285-D287 VanDerWaalsContact OD1-N 3.15Å; N285-D287 PolarHBondContact OD1-OD2 3.31Å
288	E	80.8	Confident	79	Confident	77 Å²	77	64 Å²	64	36%	0.36	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	103	-179.5	-174.4	171.8	123	0	0	110.4	T280 I281 R282 K290	T280-E288 HydrophobicContact CG2-CG 3.54Å; I281-E288 CarbonylContact O-C 3.55Å; I281-E288 WeakPolarHBondContact O-CA 3.5Å; R282-E288 HydrophobicContact CG-CB 4.36Å; R282-E288 HydrophobicContact CG-CG 4.09Å; R282-E288 IonicContact CZ-OE2 2.7Å; R282-E288 IonicContact NE-OE2 3.09Å; R282-E288 PolarHBondContact NE-OE2 2.92Å; R282-E288 IonicContact NH2-OE1 3.88Å; R282-E288 IonicContact NH2-OE2 3.31Å; R282-E288 PolarHBondContact NH2-OE2 3.15Å; E288-K290 WeakPolarHBondContact OE1-CE 3.49Å; E288-K290 IonicContact OE1-NZ 3.66Å; E288-K290 PolarHBondContact OE1-NZ 3.49Å
289	L	83.1	Confident	79.3	Confident	28 Å²	28	62 Å²	62	15%	0.147	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	129.6	174.6	176.4	65	0	0	0	109.6	T280 I281 F283 L291	T280-L289 CarbonylContact C-O 3.53Å; T280-L289 WeakPolarHBondContact CA-O 3.45Å; I281-L289 HydrophobicContact CB-CB 4.37Å; I281-L289 HydrophobicContact CD1-CD2 4.19Å; I281-L289 PolarHBondContact N-O 2.93Å; I281-L289 PolarHBondContact O-N 3.48Å; F283-L289 HydrophobicContact CE2-CB 3.86Å; F283-L289 HydrophobicContact CE2-CD2 4.46Å; L289-L291 HydrophobicContact CD1-CD2 4.32Å; L289-L291 HydrophobicContact CD2-CD2 4.25Å; L289-L291 HydrophobicContact CD2-CG 4.44Å; L289-L291 HydrophobicContact CG-CD2 4.21Å; L289-L291 HydrophobicContact CG-CG 4.28Å
290	K	82.8	Confident	79.2	Confident	123 Å²	123	62.1 Å²	62.1	54%	0.535	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.9	173.5	-74.3	175.7	178	150.8	0	109.7	V278 L279 T280 E288	V278-K290 HydrophobicContact CG1-CB 4.16Å; V278-K290 HydrophobicContact CG1-CG 4.34Å; L279-K290 WeakPolarHBondContact O-CA 3.44Å; T280-K290 HydrophobicContact CG2-CG 4.15Å; E288-K290 WeakPolarHBondContact OE1-CE 3.49Å; E288-K290 IonicContact OE1-NZ 3.66Å; E288-K290 PolarHBondContact OE1-NZ 3.49Å
291	L	77.6	Confident	79	Confident	23 Å²	23	64.9 Å²	64.9	12%	0.12	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	105.7	-179.1	-62.8	170.4	0	0	0	108.7	L279 I281 L289 V302 T331	L279-L291 HydrophobicContact CB-CB 4.36Å; L279-L291 HydrophobicContact CD2-CD1 3.94Å; L279-L291 HydrophobicContact CG-CD1 4.29Å; L279-L291 PolarHBondContact N-O 3.29Å; L279-L291 VanDerWaalsContact N-O 3.12Å; L279-L291 PolarHBondContact O-N 3.42Å; I281-L291 HydrophobicContact CD1-CD1 3.62Å; I281-L291 HydrophobicContact CD1-CG 4.41Å; L289-L291 HydrophobicContact CD1-CD2 4.32Å; L289-L291 HydrophobicContact CD2-CD2 4.25Å; L289-L291 HydrophobicContact CD2-CG 4.44Å; L289-L291 HydrophobicContact CG-CD2 4.21Å; L289-L291 HydrophobicContact CG-CG 4.28Å; L291-V302 HydrophobicContact CD1-CG1 3.65Å; L291-V302 HydrophobicContact CD2-CG1 3.91Å; L291-V302 HydrophobicContact CG-CG1 4.46Å; L291-T331 HydrophobicContact CD1-CG2 4.48Å
292	D	78.1	Confident	78.8	Confident	92 Å²	92	65.7 Å²	65.7	49%	0.492	35%	0.351	S	S	.	.	S	Bend	trans	-150.1	119.8	168.2	-159.3	11	0	0	0	108.2	V278	V278-D292 HydrophobicContact CG1-CB 4.45Å; V278-D292 HydrophobicContact CG2-CB 4.12Å
293	P	70.8	Confident	78.7	Confident	116 Å²	116	60.5 Å²	60.5	75%	0.753	33%	0.332	S	S	*	.	S	Bend	cis	-63.8	153.5	-4.5	30.1	-36.2	0	0	0	112.5	P295	P293-P295 WeakPolarHBondContact O-CD 3.38Å
294	L	72.4	Confident	78.3	Confident	30 Å²	30	64 Å²	64	16%	0.157	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-64.5	124.7	171.6	-82.7	163.6	0	0	0	111	K277 L279 L332	K277-L294 HydrophobicContact CB-CD1 4.2Å; K277-L294 WeakPolarHBondContact O-CD1 3.49Å; L279-L294 HydrophobicContact CB-CD2 3.52Å; L279-L294 HydrophobicContact CD2-CD2 3.89Å; L279-L294 HydrophobicContact CG-CD2 4.37Å; L294-L332 HydrophobicContact CB-CD2 3.96Å
295	P	75	Confident	78.1	Confident	35 Å²	35	64.6 Å²	64.6	23%	0.227	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-64.1	156.3	167.6	25.9	-31.9	0	0	0	111	P293 E297 V302 T331	P293-P295 WeakPolarHBondContact O-CD 3.38Å; P295-E297 VanDerWaalsContact C-N 3.31Å; P295-V302 HydrophobicContact CB-CG2 4.07Å; P295-V302 HydrophobicContact CG-CB 4.38Å; P295-V302 HydrophobicContact CG-CG1 3.84Å; P295-V302 HydrophobicContact CG-CG2 3.55Å; P295-T331 PolarHBondContact O-OG1 3.26Å
296	S	75	Confident	77.8	Confident	98 Å²	98	64.9 Å²	64.9	69%	0.685	36%	0.359	S	S	*	.	S	Bend	trans	-84.1	-4.7	176.3	49.9	0	0	0	0	114
297	E	81.2	Confident	77.8	Confident	108 Å²	108	62.4 Å²	62.4	51%	0.505	33%	0.331	S	S	.	.	S	Bend	trans	-76.3	-174.6	-175.2	-63.2	178.3	174.8	0	0	113	P295 V302 P330 T331	P295-E297 VanDerWaalsContact C-N 3.31Å; E297-V302 HydrophobicContact CB-CG2 3.7Å; E297-P330 WeakPolarHBondContact O-CA 3.43Å; E297-T331 PolarHBondContact O-N 3.18Å; E297-T331 PolarHBondContact O-OG1 3.21Å
298	K	84.2	Confident	76.8	Confident	98 Å²	98	63.9 Å²	63.9	43%	0.426	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-90.3	151.9	176.1	-55.7	170.5	-172	163.5	0	110.4	G300 D301 V302	K298-G300 PolarHBondContact O-N 3.06Å; K298-G300 VanDerWaalsContact O-N 3.17Å; K298-D301 WeakPolarHBondContact CB-OD2 3.18Å; K298-D301 PolarHBondContact O-N 3.32Å; K298-V302 WeakPolarHBondContact O-CG2 3.42Å; K298-V302 PolarHBondContact O-N 3.44Å
299	L	82.5	Confident	76	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-52.1	-40.4	-179.8	-173.9	68.1	0	0	0	113.4	I281 I303 C316 I325 W327 T329 T331 L334 L339	I281-L299 HydrophobicContact CD1-CD1 4.3Å; L299-I303 HydrophobicContact CD1-CD1 3.58Å; L299-I303 HydrophobicContact CG-CD1 3.86Å; L299-I303 VanDerWaalsContact O-CB 3.31Å; L299-I303 WeakPolarHBondContact O-CB 3.46Å; L299-I303 WeakPolarHBondContact O-CD1 3.49Å; L299-I303 WeakPolarHBondContact O-CG1 3.31Å; L299-I303 PolarHBondContact O-N 3.42Å; L299-C316 HydrophobicContact CD2-CB 4.29Å; L299-I325 HydrophobicContact CD2-CG2 3.7Å; L299-W327 HydrophobicContact CD2-CE3 4.32Å; L299-W327 HydrophobicContact CG-CE3 4.44Å; L299-T329 WeakPolarHBondContact CB-O 3.46Å; L299-T329 PolarHBondContact N-O 2.88Å; L299-T331 HydrophobicContact CD1-CG2 4.13Å; L299-L334 HydrophobicContact CB-CD1 4.16Å; L299-L334 HydrophobicContact CD1-CD1 3.88Å; L299-L334 HydrophobicContact CD2-CD1 3.9Å; L299-L334 HydrophobicContact CG-CD1 4.21Å; L299-L339 HydrophobicContact CD1-CD1 3.84Å; L299-L339 HydrophobicContact CD2-CD1 4.06Å
300	G	80.5	Confident	75.2	Confident	2 Å²	2	63.6 Å²	63.6	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-65.9	-43.3	177.3	0	0	0	0	0	113.7	K298 I303 R304 W327 F381	K298-G300 PolarHBondContact O-N 3.06Å; K298-G300 VanDerWaalsContact O-N 3.17Å; G300-I303 PolarHBondContact O-N 3.18Å; G300-R304 PolarHBondContact O-N 3.16Å; G300-W327 PolarHBondContact N-O 3.45Å; G300-F381 VanDerWaalsContact O-CE2 3.32Å; G300-F381 WeakPolarHBondContact O-CE2 3.31Å
301	D	79.8	Confident	74.4	Confident	77 Å²	77	59.9 Å²	59.9	41%	0.412	34%	0.338	S	S	.	.	H	α-helix	trans	-66.6	-46.4	-175.1	-60.6	-46.4	0	0	0	110.9	K298 I303 R304	K298-D301 WeakPolarHBondContact CB-OD2 3.18Å; K298-D301 PolarHBondContact O-N 3.32Å; D301-I303 PolarHBondContact O-N 3.37Å; D301-R304 VanDerWaalsContact O-CB 3.32Å; D301-R304 WeakPolarHBondContact O-CB 3.42Å; D301-R304 PolarHBondContact O-N 3.24Å
302	V	81	Confident	74.4	Confident	17 Å²	17	59.6 Å²	59.6	10%	0.103	34%	0.336	C	S	.	.	H	α-helix	trans	-61.7	-31.1	177.7	178.6	0	0	0	0	112.7	L291 P295 E297 K298 S305 T331	L291-V302 HydrophobicContact CD1-CG1 3.65Å; L291-V302 HydrophobicContact CD2-CG1 3.91Å; L291-V302 HydrophobicContact CG-CG1 4.46Å; P295-V302 HydrophobicContact CB-CG2 4.07Å; P295-V302 HydrophobicContact CG-CB 4.38Å; P295-V302 HydrophobicContact CG-CG1 3.84Å; P295-V302 HydrophobicContact CG-CG2 3.55Å; E297-V302 HydrophobicContact CB-CG2 3.7Å; K298-V302 WeakPolarHBondContact O-CG2 3.42Å; K298-V302 PolarHBondContact O-N 3.44Å; V302-S305 PolarHBondContact O-OG 3.04Å; V302-T331 HydrophobicContact CG2-CG2 4.17Å
303	I	79.7	Confident	74.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-91.6	-18.1	-175.5	-69.2	179	0	0	0	112	I281 F283 L299 G300 D301 S305 H306 L307 I341	I281-I303 HydrophobicContact CD1-CD1 3.74Å; I281-I303 HydrophobicContact CD1-CG1 4.11Å; I281-I303 HydrophobicContact CG1-CD1 4.31Å; I281-I303 HydrophobicContact CG2-CD1 4.04Å; F283-I303 HydrophobicContact CE1-CG2 3.74Å; F283-I303 HydrophobicContact CZ-CG2 3.85Å; L299-I303 HydrophobicContact CD1-CD1 3.58Å; L299-I303 HydrophobicContact CG-CD1 3.86Å; L299-I303 VanDerWaalsContact O-CB 3.31Å; L299-I303 WeakPolarHBondContact O-CB 3.46Å; L299-I303 WeakPolarHBondContact O-CD1 3.49Å; L299-I303 WeakPolarHBondContact O-CG1 3.31Å; L299-I303 PolarHBondContact O-N 3.42Å; G300-I303 PolarHBondContact O-N 3.18Å; D301-I303 PolarHBondContact O-N 3.37Å; I303-S305 VanDerWaalsContact C-N 3.27Å; I303-S305 PolarHBondContact O-N 3.23Å; I303-H306 WeakPolarHBondContact O-CA 3.5Å; I303-H306 PolarHBondContact O-N 3.41Å; I303-L307 HydrophobicContact CG2-CD1 3.8Å; I303-L307 HydrophobicContact CG2-CD2 4.38Å; I303-L307 HydrophobicContact CG2-CG 3.83Å; I303-L307 PolarHBondContact O-N 3.4Å; I303-I341 HydrophobicContact CD1-CD1 3.74Å; I303-I341 HydrophobicContact CG2-CD1 3.92Å
304	R	74.9	Confident	75	Confident	86 Å²	86	50 Å²	50	33%	0.325	28%	0.278	S	S	.	.	H	α-helix	trans	-56.5	-36.8	-177.5	-170.6	176.6	176.2	-167.4	-2.9	113.4	G300 D301 H306 L307 F381 S385	G300-R304 PolarHBondContact O-N 3.16Å; D301-R304 VanDerWaalsContact O-CB 3.32Å; D301-R304 WeakPolarHBondContact O-CB 3.42Å; D301-R304 PolarHBondContact O-N 3.24Å; R304-H306 PolarHBondContact O-N 2.65Å; R304-L307 PolarHBondContact O-N 2.81Å; R304-F381 HydrophobicContact CB-CZ 4.49Å; R304-S385 PolarHBondContact NH2-O 2.92Å
305	S	72.2	Confident	75.6	Confident	94 Å²	94	49.8 Å²	49.8	66%	0.657	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.8	174.8	52	0	0	0	0	114.1	V302 I303	V302-S305 PolarHBondContact O-OG 3.04Å; I303-S305 VanDerWaalsContact C-N 3.27Å; I303-S305 PolarHBondContact O-N 3.23Å
306	H	71.3	Confident	76	Confident	100 Å²	100	48.1 Å²	48.1	46%	0.463	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-2.8	179.9	-63.6	-79	0	0	0	113.1	F283 I303 R304	F283-H306 HydrophobicContact CE1-CB 4.41Å; F283-H306 HydrophobicContact CZ-CB 3.91Å; I303-H306 WeakPolarHBondContact O-CA 3.5Å; I303-H306 PolarHBondContact O-N 3.41Å; R304-H306 PolarHBondContact O-N 2.65Å
307	L	71.7	Confident	76.5	Confident	11 Å²	11	45.3 Å²	45.3	6%	0.058	24%	0.243	C	C	.	.			trans	-101	81.8	175.5	-67.1	174.8	0	0	0	110	F283 W284 I303 R304 D309 L310 I314 F381	F283-L307 HydrophobicContact CD1-CD2 4.22Å; F283-L307 HydrophobicContact CE1-CD2 3.89Å; F283-L307 HydrophobicContact CE1-CG 4.48Å; W284-L307 HydrophobicContact CH2-CD2 3.56Å; W284-L307 HydrophobicContact CZ3-CD2 3.63Å; I303-L307 HydrophobicContact CG2-CD1 3.8Å; I303-L307 HydrophobicContact CG2-CD2 4.38Å; I303-L307 HydrophobicContact CG2-CG 3.83Å; I303-L307 PolarHBondContact O-N 3.4Å; R304-L307 PolarHBondContact O-N 2.81Å; L307-D309 PolarHBondContact O-N 3.25Å; L307-L310 HydrophobicContact CB-CD2 3.91Å; L307-L310 HydrophobicContact CD1-CD2 4.01Å; L307-I314 HydrophobicContact CD1-CD1 3.73Å; L307-I314 HydrophobicContact CD2-CD1 3.81Å; L307-I314 HydrophobicContact CG-CD1 4.47Å; L307-F381 HydrophobicContact CD1-CE1 3.74Å; L307-F381 HydrophobicContact CD1-CZ 3.94Å
308	S	59.2	Low	76.6	Confident	127 Å²	127	40.5 Å²	40.5	89%	0.888	22%	0.22	S	C	*	.	S	Bend	trans	-65.8	-15.9	179.3	53.2	0	0	0	0	114.8
309	D	62.9	Low	76.5	Confident	65 Å²	65	38.8 Å²	38.8	35%	0.348	22%	0.216	S	C	.	.			trans	-136.9	107.2	175.8	175.1	10.7	0	0	0	110	L307 T311 I312	L307-D309 PolarHBondContact O-N 3.25Å; D309-T311 VanDerWaalsContact OD1-CB 3.29Å; D309-T311 WeakPolarHBondContact OD1-CB 3.45Å; D309-T311 WeakPolarHBondContact OD1-CG2 3.29Å; D309-T311 PolarHBondContact OD1-N 3.11Å; D309-T311 PolarHBondContact OD1-OG1 3.46Å; D309-T311 PolarHBondContact OD2-OG1 3Å; D309-I312 HydrophobicContact CB-CD1 4.06Å; D309-I312 WeakPolarHBondContact OD2-CD1 3.37Å; D309-I312 WeakPolarHBondContact OD2-CG1 3.21Å
310	L	66.3	Low	76.2	Confident	34 Å²	34	46.4 Å²	46.4	18%	0.178	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-2.2	179.4	-70.1	170	0	0	0	113.5	L307 I312 W378 F381	L307-L310 HydrophobicContact CB-CD2 3.91Å; L307-L310 HydrophobicContact CD1-CD2 4.01Å; L310-I312 PolarHBondContact O-N 2.7Å; L310-W378 WeakPolarHBondContact O-CZ2 3.35Å; L310-F381 HydrophobicContact CD2-CE1 3.84Å; L310-F381 HydrophobicContact CD2-CZ 4.34Å
311	T	66.8	Low	76.1	Confident	45 Å²	45	48.9 Å²	48.9	28%	0.276	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.9	175.8	70.7	0	0	0	0	112.9	D309 E528 S532	D309-T311 VanDerWaalsContact OD1-CB 3.29Å; D309-T311 WeakPolarHBondContact OD1-CB 3.45Å; D309-T311 WeakPolarHBondContact OD1-CG2 3.29Å; D309-T311 PolarHBondContact OD1-N 3.11Å; D309-T311 PolarHBondContact OD1-OG1 3.46Å; D309-T311 PolarHBondContact OD2-OG1 3Å; T311-E528 VanDerWaalsContact CB-O 3.27Å; T311-E528 WeakPolarHBondContact CB-O 3.25Å; T311-E528 WeakPolarHBondContact CG2-O 3.44Å; T311-S532 WeakPolarHBondContact O-CB 3.31Å; T311-S532 PolarHBondContact O-OG 2.9Å
312	I	76.1	Confident	75.9	Confident	17 Å²	17	53.2 Å²	53.2	9%	0.087	29%	0.285	C	S	.	.	S	Bend	trans	-85.7	119.8	-174.9	-61.6	162.3	0	0	0	110.1	W284 D309 L310 I314 K343 W378	W284-I312 HydrophobicContact CZ2-CD1 3.97Å; D309-I312 HydrophobicContact CB-CD1 4.06Å; D309-I312 WeakPolarHBondContact OD2-CD1 3.37Å; D309-I312 WeakPolarHBondContact OD2-CG1 3.21Å; L310-I312 PolarHBondContact O-N 2.7Å; I312-I314 HydrophobicContact CG2-CG2 4.04Å; I312-I314 PolarHBondContact O-N 3.38Å; I312-K343 VanDerWaalsContact CD1-NZ 3.28Å; I312-K343 HydrophobicContact CG2-CB 4.43Å; I312-K343 HydrophobicContact CG2-CD 3.52Å; I312-K343 HydrophobicContact CG2-CG 3.67Å; I312-W378 VanDerWaalsContact C-CZ2 3.46Å; I312-W378 VanDerWaalsContact O-CZ2 3.3Å; I312-W378 WeakPolarHBondContact O-CZ2 3.34Å; I312-W378 PolarHBondContact O-NE1 2.91Å
313	P	78.5	Confident	75.7	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.019	31%	0.309	C	S	.	.			trans	-68.4	125.1	176.6	33.5	-41.1	0	0	0	110.6	K343 I344 L375 W378 S532 L533	P313-K343 CarbonylContact O-C 3.6Å; P313-K343 VanDerWaalsContact O-CA 3.3Å; P313-K343 WeakPolarHBondContact O-CA 3.43Å; P313-I344 HydrophobicContact CB-CB 4.07Å; P313-I344 HydrophobicContact CB-CD1 4.4Å; P313-I344 HydrophobicContact CG-CB 4.35Å; P313-I344 WeakPolarHBondContact CG-O 3.22Å; P313-I344 PolarHBondContact O-N 3.02Å; P313-L375 HydrophobicContact CB-CD1 4.38Å; P313-W378 VanDerWaalsContact CA-CE2 3.49Å; P313-W378 VanDerWaalsContact CA-CZ2 3.46Å; P313-W378 HydrophobicContact CB-CD2 4.18Å; P313-W378 HydrophobicContact CB-CE3 3.78Å; P313-W378 HydrophobicContact CB-CH2 3.78Å; P313-W378 HydrophobicContact CB-CZ2 4.22Å; P313-W378 HydrophobicContact CB-CZ3 3.54Å; P313-S532 VanDerWaalsContact CD-OG 3.3Å; P313-S532 WeakPolarHBondContact CD-OG 3.48Å; P313-L533 HydrophobicContact CB-CD1 4.11Å; P313-L533 HydrophobicContact CB-CD2 4.27Å; P313-L533 HydrophobicContact CB-CG 4.22Å; P313-L533 HydrophobicContact CG-CD1 4.22Å; P313-L533 HydrophobicContact CG-CD2 3.67Å; P313-L533 HydrophobicContact CG-CG 3.77Å
314	I	83	Confident	75.8	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	149.9	-175.4	52.4	167.8	0	0	0	112.4	W284 L307 I312 W327 I341 K342 W378	W284-I314 HydrophobicContact CE3-CG2 3.75Å; W284-I314 HydrophobicContact CH2-CG2 4.29Å; W284-I314 HydrophobicContact CZ3-CD1 4.3Å; W284-I314 HydrophobicContact CZ3-CG2 3.59Å; L307-I314 HydrophobicContact CD1-CD1 3.73Å; L307-I314 HydrophobicContact CD2-CD1 3.81Å; L307-I314 HydrophobicContact CG-CD1 4.47Å; I312-I314 HydrophobicContact CG2-CG2 4.04Å; I312-I314 PolarHBondContact O-N 3.38Å; I314-W327 HydrophobicContact CB-CZ2 4.41Å; I314-W327 HydrophobicContact CD1-CH2 3.91Å; I314-W327 HydrophobicContact CD1-CZ2 3.95Å; I314-W327 HydrophobicContact CG1-CH2 4.27Å; I314-W327 HydrophobicContact CG1-CZ2 3.85Å; I314-I341 HydrophobicContact CB-CG2 3.83Å; I314-I341 HydrophobicContact CD1-CG2 3.86Å; I314-I341 HydrophobicContact CG1-CG2 4.39Å; I314-I341 HydrophobicContact CG2-CG2 4.1Å; I314-K342 WeakPolarHBondContact CA-O 3.33Å; I314-W378 VanDerWaalsContact CG1-CD1 3.47Å; I314-W378 HydrophobicContact CG1-CG 4.44Å; I314-W378 WeakPolarHBondContact O-CB 3.41Å
315	Q	85.1	Confident	76	Confident	27 Å²	27	57.6 Å²	57.6	13%	0.126	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.7	174.4	62.9	-176	24.9	0	0	110.1	I317 Y324 I341 K342 I344 A374	Q315-I317 HydrophobicContact CG-CD1 4.34Å; Q315-Y324 HydrophobicContact CB-CD2 4.27Å; Q315-Y324 HydrophobicContact CB-CE2 4.05Å; Q315-I341 WeakPolarHBondContact O-CA 3.48Å; Q315-K342 HydrophobicContact CG-CB 4.42Å; Q315-K342 PolarHBondContact N-O 3.22Å; Q315-K342 PolarHBondContact O-N 3.46Å; Q315-I344 HydrophobicContact CB-CD1 4.13Å; Q315-I344 HydrophobicContact CB-CG1 3.95Å; Q315-I344 HydrophobicContact CG-CG1 4Å; Q315-A374 HydrophobicContact CB-CB 3.8Å
316	C	84.7	Confident	76.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	131.7	170	-174	0	0	0	0	110.6	L299 Y324 I325 W327 I341	L299-C316 HydrophobicContact CD2-CB 4.29Å; C316-Y324 VanDerWaalsContact O-CD2 3.3Å; C316-Y324 WeakPolarHBondContact O-CD2 3.47Å; C316-I325 HydrophobicContact CB-CB 4.38Å; C316-I325 PolarHBondContact O-N 3.41Å; C316-W327 HydrophobicContact CB-CE3 4.39Å; C316-W327 HydrophobicContact CB-CH2 3.7Å; C316-W327 HydrophobicContact CB-CZ2 4.23Å; C316-W327 HydrophobicContact CB-CZ3 3.79Å; C316-I341 HydrophobicContact CB-CG1 4.46Å
317	I	84.4	Confident	77.1	Confident	39 Å²	39	51 Å²	51	20%	0.2	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.7	175.9	-68.6	169.4	0	0	0	109.5	Q315 L319 E323 L339 L340	Q315-I317 HydrophobicContact CG-CD1 4.34Å; I317-L319 PolarHBondContact O-N 3Å; I317-E323 WeakPolarHBondContact CA-O 3.5Å; I317-L339 WeakPolarHBondContact O-CA 3.26Å; I317-L340 PolarHBondContact N-O 2.84Å; I317-L340 PolarHBondContact O-N 3.06Å
318	D	84.7	Confident	77.5	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.032	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	121	165.6	-174.5	-34.8	0	0	0	109.6	M320 S321 K322 E323 I325 K337 L339	D318-M320 PolarHBondContact O-N 2.87Å; D318-M320 WeakPolarHBondContact OD1-CA 3.48Å; D318-M320 WeakPolarHBondContact OD1-CB 3.06Å; D318-M320 PolarHBondContact OD1-N 3.08Å; D318-S321 WeakPolarHBondContact CB-OG 3.41Å; D318-S321 PolarHBondContact OD1-N 3.08Å; D318-S321 VanDerWaalsContact OD1-N 3.16Å; D318-K322 WeakPolarHBondContact O-CA 3.24Å; D318-K322 PolarHBondContact O-N 3.32Å; D318-E323 PolarHBondContact N-O 2.94Å; D318-I325 HydrophobicContact CB-CD1 3.84Å; D318-K337 WeakPolarHBondContact OD2-CD 3.43Å; D318-K337 WeakPolarHBondContact OD2-CE 3.24Å; D318-K337 IonicContact OD2-NZ 3.96Å; D318-K337 PolarHBondContact OD2-NZ 3.41Å; D318-L339 HydrophobicContact CB-CD2 4.44Å
319	L	80.9	Confident	78.6	Confident	62 Å²	62	50.4 Å²	50.4	33%	0.325	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-24.5	-178.7	-81.5	159.1	0	0	0	113.6	I317 T338 L340	I317-L319 PolarHBondContact O-N 3Å; L319-T338 WeakPolarHBondContact CB-O 3.17Å; L319-T338 HydrophobicContact CD1-CG2 3.53Å; L319-T338 PolarHBondContact N-O 2.89Å; L319-L340 HydrophobicContact CD1-CB 4.09Å; L319-L340 HydrophobicContact CD2-CB 3.93Å; L319-L340 HydrophobicContact CD2-CD2 4.11Å; L319-L340 HydrophobicContact CG-CB 3.82Å
320	M	76.9	Confident	79.6	Confident	161 Å²	161	49.6 Å²	49.6	79%	0.793	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-54.2	-178.1	-62.7	-60.5	-69.1	0	0	111.6	D318	D318-M320 PolarHBondContact O-N 2.87Å; D318-M320 WeakPolarHBondContact OD1-CA 3.48Å; D318-M320 WeakPolarHBondContact OD1-CB 3.06Å; D318-M320 PolarHBondContact OD1-N 3.08Å
321	S	77.8	Confident	80.3	Confident	53 Å²	53	48 Å²	48	37%	0.371	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-21.4	179.3	78.4	0	0	0	0	113.6	D318 E323	D318-S321 WeakPolarHBondContact CB-OG 3.41Å; D318-S321 PolarHBondContact OD1-N 3.08Å; D318-S321 VanDerWaalsContact OD1-N 3.16Å; S321-E323 WeakPolarHBondContact CB-OE2 3.46Å; S321-E323 PolarHBondContact O-N 2.75Å; S321-E323 WeakPolarHBondContact OG-CB 3.49Å; S321-E323 WeakPolarHBondContact OG-CG 3.32Å; S321-E323 PolarHBondContact OG-N 3.2Å; S321-E323 PolarHBondContact OG-OE2 3.05Å
322	K	75.1	Confident	80.8	Confident	168 Å²	168	50.4 Å²	50.4	73%	0.73	26%	0.255	S	S	*	.			trans	62.2	16.5	-171.6	-57.3	175.3	-176	168.6	0	114	D318	D318-K322 WeakPolarHBondContact O-CA 3.24Å; D318-K322 PolarHBondContact O-N 3.32Å
323	E	78.6	Confident	81	Confident	129 Å²	129	56.1 Å²	56.1	60%	0.603	28%	0.282	S	S	*	.			trans	-83.7	153.7	176.1	-63	174	133.6	0	0	111.5	I317 D318 S321	I317-E323 WeakPolarHBondContact CA-O 3.5Å; D318-E323 PolarHBondContact N-O 2.94Å; S321-E323 WeakPolarHBondContact CB-OE2 3.46Å; S321-E323 PolarHBondContact O-N 2.75Å; S321-E323 WeakPolarHBondContact OG-CB 3.49Å; S321-E323 WeakPolarHBondContact OG-CG 3.32Å; S321-E323 PolarHBondContact OG-N 3.2Å; S321-E323 PolarHBondContact OG-OE2 3.05Å
324	Y	80.3	Confident	81	Confident	54 Å²	54	56.2 Å²	56.2	21%	0.212	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	133.9	173.8	173.1	-99.7	0	0	0	110.7	Q315 C316 P326 A374 N377	Q315-Y324 HydrophobicContact CB-CD2 4.27Å; Q315-Y324 HydrophobicContact CB-CE2 4.05Å; C316-Y324 VanDerWaalsContact O-CD2 3.3Å; C316-Y324 WeakPolarHBondContact O-CD2 3.47Å; Y324-P326 HydrophobicContact CE1-CB 4.45Å; Y324-P326 HydrophobicContact CE1-CG 4.15Å; Y324-A374 HydrophobicContact CD2-CB 3.59Å; Y324-A374 HydrophobicContact CE2-CB 3.43Å; Y324-A374 VanDerWaalsContact CE2-CB 3.43Å; Y324-A374 HydrophobicContact CG-CB 4.3Å; Y324-N377 HydrophobicContact CE1-CB 4.39Å; Y324-N377 WeakPolarHBondContact OH-CB 3.43Å; Y324-N377 PolarHBondContact OH-OD1 3.04Å
325	I	80.3	Confident	80.7	Confident	12 Å²	12	57.5 Å²	57.5	6%	0.062	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.3	176	-72.7	161.7	0	0	0	109.9	L299 C316 D318 L334 L339	L299-I325 HydrophobicContact CD2-CG2 3.7Å; C316-I325 HydrophobicContact CB-CB 4.38Å; C316-I325 PolarHBondContact O-N 3.41Å; D318-I325 HydrophobicContact CB-CD1 3.84Å; I325-L334 HydrophobicContact CD1-CD2 3.85Å; I325-L334 HydrophobicContact CG1-CD2 4.49Å; I325-L334 HydrophobicContact CG2-CD1 4.28Å; I325-L334 HydrophobicContact CG2-CD2 4.33Å; I325-L339 HydrophobicContact CD1-CD2 3.44Å; I325-L339 VanDerWaalsContact CD1-CD2 3.44Å
326	P	81.7	Confident	80.4	Confident	51 Å²	51	60.9 Å²	60.9	33%	0.331	32%	0.318	S	S	.	.			trans	-63.1	145.3	171.1	-21.6	33.4	0	0	0	113.1	Y324 E328 T329 N377	Y324-P326 HydrophobicContact CE1-CB 4.45Å; Y324-P326 HydrophobicContact CE1-CG 4.15Å; P326-E328 PolarHBondContact O-N 2.72Å; P326-E328 VanDerWaalsContact O-N 3.09Å; P326-T329 PolarHBondContact O-N 3.25Å; P326-T329 PolarHBondContact O-OG1 3.21Å; P326-N377 VanDerWaalsContact CA-OD1 3.27Å; P326-N377 WeakPolarHBondContact CA-OD1 3.44Å
327	W	83.2	Confident	80.2	Confident	6 Å²	6	64.2 Å²	64.2	2%	0.023	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.5	176.4	-57.8	113.4	0	0	0	113.9	L299 G300 I314 C316 I341 N377 F381	L299-W327 HydrophobicContact CD2-CE3 4.32Å; L299-W327 HydrophobicContact CG-CE3 4.44Å; G300-W327 PolarHBondContact N-O 3.45Å; I314-W327 HydrophobicContact CB-CZ2 4.41Å; I314-W327 HydrophobicContact CD1-CH2 3.91Å; I314-W327 HydrophobicContact CD1-CZ2 3.95Å; I314-W327 HydrophobicContact CG1-CH2 4.27Å; I314-W327 HydrophobicContact CG1-CZ2 3.85Å; C316-W327 HydrophobicContact CB-CE3 4.39Å; C316-W327 HydrophobicContact CB-CH2 3.7Å; C316-W327 HydrophobicContact CB-CZ2 4.23Å; C316-W327 HydrophobicContact CB-CZ3 3.79Å; W327-I341 HydrophobicContact CH2-CD1 3.79Å; W327-I341 HydrophobicContact CH2-CG1 3.96Å; W327-I341 HydrophobicContact CH2-CG2 4.1Å; W327-I341 HydrophobicContact CZ3-CD1 3.75Å; W327-I341 HydrophobicContact CZ3-CG1 4.25Å; W327-N377 VanDerWaalsContact CD1-OD1 3.28Å; W327-N377 PolarHBondContact N-OD1 2.96Å; W327-F381 HydrophobicContact CB-CB 4.11Å; W327-F381 HydrophobicContact CB-CD2 4.2Å; W327-F381 HydrophobicContact CB-CG 4.26Å; W327-F381 HydrophobicContact CG-CB 3.92Å; W327-F381 HydrophobicContact CG-CD2 4.42Å; W327-F381 HydrophobicContact CG-CG 4.06Å
328	E	79.9	Confident	80.2	Confident	96 Å²	96	64.4 Å²	64.4	45%	0.449	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-6.4	179.7	-52.3	-160.4	132.8	0	0	114.3	P326 K384	P326-E328 PolarHBondContact O-N 2.72Å; P326-E328 VanDerWaalsContact O-N 3.09Å; E328-K384 IonicContact OE1-NZ 2.68Å; E328-K384 PolarHBondContact OE1-NZ 2.87Å
329	T	82.9	Confident	80.3	Confident	28 Å²	28	64.1 Å²	64.1	17%	0.172	33%	0.334	C	S	.	.	S	Bend	trans	-66.3	127.8	179.2	-62.1	0	0	0	0	110.8	L299 P326 Q333 L334	L299-T329 WeakPolarHBondContact CB-O 3.46Å; L299-T329 PolarHBondContact N-O 2.88Å; P326-T329 PolarHBondContact O-N 3.25Å; P326-T329 PolarHBondContact O-OG1 3.21Å; T329-Q333 HydrophobicContact CG2-CB 4.22Å; T329-L334 HydrophobicContact CG2-CD1 3.89Å; T329-L334 HydrophobicContact CG2-CD2 3.98Å; T329-L334 HydrophobicContact CG2-CG 3.86Å
330	P	84.2	Confident	80.4	Confident	48 Å²	48	63.7 Å²	63.7	31%	0.312	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-61.7	135.5	175.5	-23.1	33.8	0	0	0	112	E297 L332 Q333	E297-P330 WeakPolarHBondContact O-CA 3.43Å; P330-L332 PolarHBondContact O-N 3.47Å; P330-L332 VanDerWaalsContact O-N 3.15Å; P330-Q333 HydrophobicContact CB-CG 4.5Å; P330-Q333 WeakPolarHBondContact O-CB 3.42Å; P330-Q333 PolarHBondContact O-N 3.13Å
331	T	80.4	Confident	80.7	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-59.7	-29.3	-177.9	31.7	0	0	0	0	113.2	L279 L291 P295 E297 L299 V302 Q333 L334	L279-T331 HydrophobicContact CD2-CG2 3.88Å; L291-T331 HydrophobicContact CD1-CG2 4.48Å; P295-T331 PolarHBondContact O-OG1 3.26Å; E297-T331 PolarHBondContact O-N 3.18Å; E297-T331 PolarHBondContact O-OG1 3.21Å; L299-T331 HydrophobicContact CD1-CG2 4.13Å; V302-T331 HydrophobicContact CG2-CG2 4.17Å; T331-Q333 PolarHBondContact O-N 3.36Å; T331-L334 WeakPolarHBondContact O-CA 3.47Å; T331-L334 WeakPolarHBondContact O-CB 3.49Å; T331-L334 PolarHBondContact O-N 3.25Å
332	L	78.8	Confident	80.9	Confident	97 Å²	97	57.8 Å²	57.8	51%	0.508	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-58.4	-31	173.1	-64.5	172.1	0	0	0	113.8	L294 P330 L334	L294-L332 HydrophobicContact CB-CD2 3.96Å; P330-L332 PolarHBondContact O-N 3.47Å; P330-L332 VanDerWaalsContact O-N 3.15Å; L332-L334 PolarHBondContact O-N 3.03Å
333	Q	79.7	Confident	81.2	Confident	137 Å²	137	53.3 Å²	53.3	64%	0.64	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-77.8	-10	175.7	-63.9	-175.3	-15	0	0	113	T329 P330 T331	T329-Q333 HydrophobicContact CG2-CB 4.22Å; P330-Q333 HydrophobicContact CB-CG 4.5Å; P330-Q333 WeakPolarHBondContact O-CB 3.42Å; P330-Q333 PolarHBondContact O-N 3.13Å; T331-Q333 PolarHBondContact O-N 3.36Å
334	L	79	Confident	81.2	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-107.2	10.2	-176.6	-58.1	170.2	0	0	0	111.8	L279 L299 I325 T329 T331 L332 K337 L339	L279-L334 HydrophobicContact CD1-CB 4.25Å; L279-L334 HydrophobicContact CD2-CB 4.05Å; L299-L334 HydrophobicContact CB-CD1 4.16Å; L299-L334 HydrophobicContact CD1-CD1 3.88Å; L299-L334 HydrophobicContact CD2-CD1 3.9Å; L299-L334 HydrophobicContact CG-CD1 4.21Å; I325-L334 HydrophobicContact CD1-CD2 3.85Å; I325-L334 HydrophobicContact CG1-CD2 4.49Å; I325-L334 HydrophobicContact CG2-CD1 4.28Å; I325-L334 HydrophobicContact CG2-CD2 4.33Å; T329-L334 HydrophobicContact CG2-CD1 3.89Å; T329-L334 HydrophobicContact CG2-CD2 3.98Å; T329-L334 HydrophobicContact CG2-CG 3.86Å; T331-L334 WeakPolarHBondContact O-CA 3.47Å; T331-L334 WeakPolarHBondContact O-CB 3.49Å; T331-L334 PolarHBondContact O-N 3.25Å; L332-L334 PolarHBondContact O-N 3.03Å; L334-K337 HydrophobicContact CD2-CD 3.93Å; L334-K337 VanDerWaalsContact O-CB 3.31Å; L334-K337 WeakPolarHBondContact O-CB 3.44Å; L334-K337 PolarHBondContact O-N 3.21Å; L334-K337 VanDerWaalsContact O-N 3.11Å; L334-L339 HydrophobicContact CD1-CD1 4.06Å
335	S	76.8	Confident	80.6	Confident	30 Å²	30	50.9 Å²	50.9	21%	0.21	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	138.1	176.3	66.7	0	0	0	0	112.4	K337	S335-K337 PolarHBondContact O-N 3.44Å
336	S	77	Confident	79.7	Confident	98 Å²	98	54 Å²	54	69%	0.685	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	10.6	-176.5	63.9	0	0	0	0	116.4	V278	V278-S336 VanDerWaalsContact O-CA 3.25Å; V278-S336 WeakPolarHBondContact O-CA 3.44Å; V278-S336 PolarHBondContact O-N 3.25Å; V278-S336 VanDerWaalsContact O-N 3.09Å
337	K	81.7	Confident	78.4	Confident	70 Å²	70	54.9 Å²	54.9	30%	0.304	28%	0.281	S	S	.	.			trans	-87	154.3	170.2	-63.4	-168.3	168	-150.4	0	112	T280 D318 L334 S335 L339	T280-K337 PolarHBondContact N-O 2.83Å; D318-K337 WeakPolarHBondContact OD2-CD 3.43Å; D318-K337 WeakPolarHBondContact OD2-CE 3.24Å; D318-K337 IonicContact OD2-NZ 3.96Å; D318-K337 PolarHBondContact OD2-NZ 3.41Å; L334-K337 HydrophobicContact CD2-CD 3.93Å; L334-K337 VanDerWaalsContact O-CB 3.31Å; L334-K337 WeakPolarHBondContact O-CB 3.44Å; L334-K337 PolarHBondContact O-N 3.21Å; L334-K337 VanDerWaalsContact O-N 3.11Å; S335-K337 PolarHBondContact O-N 3.44Å; K337-L339 HydrophobicContact CB-CD2 4.05Å
338	T	83.5	Confident	76.4	Confident	43 Å²	43	63.5 Å²	63.5	26%	0.264	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.3	163.9	-43.6	0	0	0	0	108.6	T280 L319	T280-T338 HydrophobicContact CG2-CG2 4.03Å; T280-T338 CarbonylContact O-C 3.55Å; T280-T338 WeakPolarHBondContact O-CA 3.4Å; L319-T338 WeakPolarHBondContact CB-O 3.17Å; L319-T338 HydrophobicContact CD1-CG2 3.53Å; L319-T338 PolarHBondContact N-O 2.89Å
339	L	86.7	Confident	74.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	148.9	-177.1	-54.2	-174.5	0	0	0	110.7	L279 T280 I281 R282 L299 I317 D318 I325 L334 K337	L279-L339 HydrophobicContact CD1-CD1 3.74Å; L279-L339 HydrophobicContact CD1-CG 3.79Å; T280-L339 PolarHBondContact O-N 3.14Å; I281-L339 HydrophobicContact CG1-CB 4.24Å; I281-L339 HydrophobicContact CG1-CD1 4.26Å; R282-L339 PolarHBondContact N-O 3.44Å; L299-L339 HydrophobicContact CD1-CD1 3.84Å; L299-L339 HydrophobicContact CD2-CD1 4.06Å; I317-L339 WeakPolarHBondContact O-CA 3.26Å; D318-L339 HydrophobicContact CB-CD2 4.44Å; I325-L339 HydrophobicContact CD1-CD2 3.44Å; I325-L339 VanDerWaalsContact CD1-CD2 3.44Å; L334-L339 HydrophobicContact CD1-CD1 4.06Å; K337-L339 HydrophobicContact CB-CD2 4.05Å
340	L	83.2	Confident	71.7	Confident	53 Å²	53	68.2 Å²	68.2	28%	0.277	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	115.9	172.7	177.9	67.4	0	0	0	109.6	R282 I317 L319	R282-L340 HydrophobicContact CB-CD1 4.04Å; I317-L340 PolarHBondContact N-O 2.84Å; I317-L340 PolarHBondContact O-N 3.06Å; L319-L340 HydrophobicContact CD1-CB 4.09Å; L319-L340 HydrophobicContact CD2-CB 3.93Å; L319-L340 HydrophobicContact CD2-CD2 4.11Å; L319-L340 HydrophobicContact CG-CB 3.82Å
341	I	83.7	Confident	68.9	Low	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	118	168.1	-61.9	-176.4	0	0	0	108.2	I281 R282 F283 W284 I303 I314 Q315 C316 W327	I281-I341 HydrophobicContact CG2-CD1 3.86Å; I281-I341 HydrophobicContact CG2-CG1 4.15Å; R282-I341 PolarHBondContact O-N 2.71Å; F283-I341 CarbonylContact C-O 3.58Å; F283-I341 HydrophobicContact CD1-CB 4.49Å; F283-I341 HydrophobicContact CD1-CD1 4.27Å; F283-I341 HydrophobicContact CE1-CD1 3.94Å; F283-I341 HydrophobicContact CZ-CD1 4.41Å; W284-I341 HydrophobicContact CE3-CG2 3.88Å; W284-I341 HydrophobicContact CZ3-CG2 3.96Å; W284-I341 PolarHBondContact N-O 2.81Å; I303-I341 HydrophobicContact CD1-CD1 3.74Å; I303-I341 HydrophobicContact CG2-CD1 3.92Å; I314-I341 HydrophobicContact CB-CG2 3.83Å; I314-I341 HydrophobicContact CD1-CG2 3.86Å; I314-I341 HydrophobicContact CG1-CG2 4.39Å; I314-I341 HydrophobicContact CG2-CG2 4.1Å; Q315-I341 WeakPolarHBondContact O-CA 3.48Å; C316-I341 HydrophobicContact CB-CG1 4.46Å; W327-I341 HydrophobicContact CH2-CD1 3.79Å; W327-I341 HydrophobicContact CH2-CG1 3.96Å; W327-I341 HydrophobicContact CH2-CG2 4.1Å; W327-I341 HydrophobicContact CZ3-CD1 3.75Å; W327-I341 HydrophobicContact CZ3-CG1 4.25Å
342	K	82	Confident	66.4	Low	90 Å²	90	76.5 Å²	76.5	39%	0.391	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.9	-177	-170.7	-173.9	173.7	-177	0	110.7	I314 Q315 I344	I314-K342 WeakPolarHBondContact CA-O 3.33Å; Q315-K342 HydrophobicContact CG-CB 4.42Å; Q315-K342 PolarHBondContact N-O 3.22Å; Q315-K342 PolarHBondContact O-N 3.46Å; K342-I344 PolarHBondContact O-N 3.44Å
343	K	81.1	Confident	64	Low	73 Å²	73	73.8 Å²	73.8	32%	0.317	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	129.9	167.8	-60.2	-159.8	178.5	-152	0	110.8	W284 I312 P313 H345	W284-K343 HydrophobicContact CB-CG 4Å; W284-K343 HydrophobicContact CD2-CG 4.02Å; W284-K343 HydrophobicContact CG-CD 4.31Å; W284-K343 HydrophobicContact CG-CG 3.67Å; I312-K343 VanDerWaalsContact CD1-NZ 3.28Å; I312-K343 HydrophobicContact CG2-CB 4.43Å; I312-K343 HydrophobicContact CG2-CD 3.52Å; I312-K343 HydrophobicContact CG2-CG 3.67Å; P313-K343 CarbonylContact O-C 3.6Å; P313-K343 VanDerWaalsContact O-CA 3.3Å; P313-K343 WeakPolarHBondContact O-CA 3.43Å; K343-H345 PolarHBondContact O-N 3.32Å
344	I	78.7	Confident	61.8	Low	12 Å²	12	75 Å²	75	6%	0.062	41%	0.412	C	S	.	.			trans	-77.2	109	167.6	-53.5	171.3	0	0	0	106.4	P313 Q315 K342 A374 L375	P313-I344 HydrophobicContact CB-CB 4.07Å; P313-I344 HydrophobicContact CB-CD1 4.4Å; P313-I344 HydrophobicContact CG-CB 4.35Å; P313-I344 WeakPolarHBondContact CG-O 3.22Å; P313-I344 PolarHBondContact O-N 3.02Å; Q315-I344 HydrophobicContact CB-CD1 4.13Å; Q315-I344 HydrophobicContact CB-CG1 3.95Å; Q315-I344 HydrophobicContact CG-CG1 4Å; K342-I344 PolarHBondContact O-N 3.44Å; I344-A374 HydrophobicContact CD1-CB 4.43Å; I344-L375 HydrophobicContact CB-CD1 4.46Å; I344-L375 HydrophobicContact CD1-CB 4.37Å; I344-L375 HydrophobicContact CD1-CD1 3.86Å; I344-L375 HydrophobicContact CG2-CD1 4.01Å
345	H	67.9	Low	59.4	Low	120 Å²	120	82.9 Å²	82.9	56%	0.556	45%	0.449	S	S	*	.			trans	-72.2	150.6	-176.1	-59	-61.6	0	0	0	112	K343 N347	K343-H345 PolarHBondContact O-N 3.32Å; H345-N347 PolarHBondContact O-N 3.42Å
346	K	60.6	Low	57.3	Low	77 Å²	77	87.5 Å²	87.5	34%	0.335	48%	0.478	S	S	.	.			trans	-45.8	127.1	159.9	-68.4	173.9	179.1	165.2	0	108.8	K348 E531 S532 E535	K346-K348 PolarHBondContact O-N 2.73Å; K346-K348 VanDerWaalsContact O-N 3.14Å; K346-E531 VanDerWaalsContact CE-O 3.29Å; K346-E531 WeakPolarHBondContact CE-O 3.34Å; K346-E531 PolarHBondContact NZ-O 3.1Å; K346-S532 VanDerWaalsContact CE-C 3.46Å; K346-S532 WeakPolarHBondContact CE-O 3.38Å; K346-S532 WeakPolarHBondContact CG-O 3.49Å; K346-E535 IonicContact NZ-OE2 3.63Å; K346-E535 PolarHBondContact NZ-OE2 3.09Å
347	N	54.8	Low	55	Low	70 Å²	70	88.8 Å²	88.8	37%	0.374	48%	0.482	S	S	.	.			trans	-57.1	123.3	174.3	-77.5	-32	0	0	0	108.5	H345 V349 N617	H345-N347 PolarHBondContact O-N 3.42Å; N347-V349 PolarHBondContact O-N 3.33Å; N347-N617 PolarHBondContact ND2-OD1 3.11Å
348	K	40.6	Very low	52.8	Low	188 Å²	188	97.2 Å²	97.2	82%	0.817	51%	0.512	S	S	*	.			trans	-63.7	107.3	169.4	-74.8	-170.4	175.6	-174.1	0	107.6	K346 T350	K346-K348 PolarHBondContact O-N 2.73Å; K346-K348 VanDerWaalsContact O-N 3.14Å; K348-T350 PolarHBondContact O-N 3.33Å; K348-T350 PolarHBondContact O-OG1 3.02Å
349	V	36.5	Very low	50.3	Low	109 Å²	109	103.3 Å²	103.3	66%	0.661	54%	0.535	S	S	*	.			trans	-58	96.8	163.1	179.1	0	0	0	0	105.7	N347 P351	N347-V349 PolarHBondContact O-N 3.33Å; V349-P351 WeakPolarHBondContact O-CD 3.21Å
350	T	29.2	Very low	47.6	Very low	114 Å²	114	112.5 Å²	112.5	70%	0.699	58%	0.58	S	S	*	*			trans	-72.7	117.4	-176.8	-58.3	0	0	0	0	105.9	K348	K348-T350 PolarHBondContact O-N 3.33Å; K348-T350 PolarHBondContact O-OG1 3.02Å
351	P	25.5	Very low	45	Very low	91 Å²	91	116.1 Å²	116.1	59%	0.591	60%	0.596	S	S	*	*			trans	-58.3	137.4	177.1	25.3	-33.4	0	0	0	108.1	V349 G353	V349-P351 WeakPolarHBondContact O-CD 3.21Å; P351-G353 PolarHBondContact O-N 3.27Å
352	P	27.8	Very low	42.6	Very low	130 Å²	130	127.6 Å²	127.6	84%	0.844	64%	0.639	S	S	*	*	S	Bend	trans	-76.7	63.5	-172.7	32	-36.8	0	0	0	111.7
353	G	28.5	Very low	40	Very low	41 Å²	41	133.8 Å²	133.8	42%	0.423	66%	0.66	S	S	.	*			trans	175.1	97.2	-178.1	0	0	0	0	0	113.2	P351	P351-G353 PolarHBondContact O-N 3.27Å
354	I	32.1	Very low	37.6	Very low	161 Å²	161	135.8 Å²	135.8	83%	0.826	68%	0.683	S	S	*	*			trans	-170.2	132	143.3	-95.9	149.9	0	0	0	106.7	P356	I354-P356 WeakPolarHBondContact O-CD 3.47Å
355	H	30.2	Very low	35.2	Very low	171 Å²	171	139.3 Å²	139.3	79%	0.792	71%	0.713	S	S	*	*			trans	-76.7	127	179.1	-82.7	-107.7	0	0	0	111.4	T357	H355-T357 PolarHBondContact O-N 3.1Å
356	P	31.6	Very low	33.3	Very low	127 Å²	127	138.4 Å²	138.4	83%	0.825	72%	0.719	S	S	*	*			trans	-78.4	85.9	166	31.9	-32.6	0	0	0	109.9	I354	I354-P356 WeakPolarHBondContact O-CD 3.47Å
357	T	29	Very low	32.3	Very low	124 Å²	124	140.7 Å²	140.7	76%	0.761	74%	0.741	S	S	*	*			trans	-71	137	172.4	47.4	0	0	0	0	111.6	H355	H355-T357 PolarHBondContact O-N 3.1Å
358	R	34.8	Very low	31.4	Very low	247 Å²	247	145.4 Å²	145.4	93%	0.932	76%	0.759	S	S	*	*			trans	63.6	103.4	-177.3	-75.4	-176	163.7	158	-4.3	115.8
359	K	32.1	Very low	31.9	Very low	171 Å²	171	142.9 Å²	142.9	74%	0.743	75%	0.754	S	S	*	*			trans	-64	149.2	150.5	-58.9	172.9	-178	172.6	0	109.1	Y33	Y33-K359 PolarHBondContact OH-NZ 3.34Å
360	M	30.2	Very low	33	Very low	193 Å²	193	141.8 Å²	141.8	95%	0.951	75%	0.748	S	S	*	*			trans	-137.7	142.7	136.2	-161.8	171.9	-177.4	0	0	109.1
361	E	28.1	Very low	35	Very low	130 Å²	130	139.9 Å²	139.9	61%	0.607	74%	0.736	S	S	*	*			trans	-69.5	131.4	-160.2	-179.6	171.7	-166.4	0	0	115.1	R363	E361-R363 HydrophobicContact CG-CG 4.44Å; E361-R363 IonicContact OE1-CZ 3.43Å; E361-R363 IonicContact OE1-NE 2.65Å; E361-R363 PolarHBondContact OE1-NE 2.89Å; E361-R363 IonicContact OE1-NH2 3.56Å; E361-R363 PolarHBondContact OE1-NH2 3.45Å
362	R	32.8	Very low	37.5	Very low	241 Å²	241	136.9 Å²	136.9	91%	0.909	72%	0.717	S	S	*	*			trans	-139.8	128	139.2	-74.7	-160.6	174.5	-177.4	-1.9	110.3
363	R	28.1	Very low	39.8	Very low	220 Å²	220	132.7 Å²	132.7	83%	0.83	70%	0.698	S	S	*	*			trans	-79.2	126	175.6	-58.4	177.1	-169.7	-176.8	2.2	109.4	E361	E361-R363 HydrophobicContact CG-CG 4.44Å; E361-R363 IonicContact OE1-CZ 3.43Å; E361-R363 IonicContact OE1-NE 2.65Å; E361-R363 PolarHBondContact OE1-NE 2.89Å; E361-R363 IonicContact OE1-NH2 3.56Å; E361-R363 PolarHBondContact OE1-NH2 3.45Å
364	S	30.4	Very low	42.3	Very low	115 Å²	115	130.8 Å²	130.8	80%	0.804	68%	0.678	S	S	*	*			trans	-152.5	161.7	165.5	48.7	0	0	0	0	109.3
365	A	27.6	Very low	44.7	Very low	85 Å²	85	123.1 Å²	123.1	70%	0.702	64%	0.639	S	S	*	*			trans	-59.5	155.3	-166.8	0	0	0	0	0	113.9
366	P	29.2	Very low	47.3	Very low	102 Å²	102	116.9 Å²	116.9	66%	0.662	61%	0.609	S	S	*	*			trans	-58.9	139.6	170.1	27.2	-35.4	0	0	0	110.2	F368	P366-F368 PolarHBondContact O-N 3.1Å; P366-F368 VanDerWaalsContact O-N 3.13Å
367	P	38.3	Very low	49.8	Very low	125 Å²	125	112.1 Å²	112.1	81%	0.812	58%	0.577	S	S	*	*			trans	-68.3	113.2	173.8	28.6	-32.6	0	0	0	109.1
368	F	36.2	Very low	52.5	Low	168 Å²	168	106.2 Å²	106.2	74%	0.737	54%	0.541	S	S	*	.			trans	-63.2	152.2	159.2	-78.4	-98.7	0	0	0	109.3	P366 T370	P366-F368 PolarHBondContact O-N 3.1Å; P366-F368 VanDerWaalsContact O-N 3.13Å; F368-T370 PolarHBondContact O-N 3.25Å; F368-T370 PolarHBondContact O-OG1 2.94Å
369	D	50.8	Low	54.9	Low	135 Å²	135	94.5 Å²	94.5	72%	0.722	50%	0.496	S	S	*	.	S	Bend	trans	-69.9	52.7	-174.7	-63.8	-67.4	0	0	0	114.6	T371 S372 G373	D369-T371 VanDerWaalsContact C-N 3.3Å; D369-T371 PolarHBondContact O-N 3.46Å; D369-S372 PolarHBondContact O-N 3.24Å; D369-G373 PolarHBondContact O-N 2.87Å
370	T	60	Low	57.3	Low	86 Å²	86	88.6 Å²	88.6	53%	0.528	47%	0.473	S	S	.	.	H	α-helix	trans	-59.2	-35.6	-178.1	46.2	0	0	0	0	113	F368 G373 A374	F368-T370 PolarHBondContact O-N 3.25Å; F368-T370 PolarHBondContact O-OG1 2.94Å; T370-G373 PolarHBondContact O-N 2.86Å; T370-A374 VanDerWaalsContact O-CB 3.25Å; T370-A374 WeakPolarHBondContact O-CB 3.42Å; T370-A374 PolarHBondContact O-N 3.36Å
371	T	70.9	Confident	59.8	Low	74 Å²	74	80.1 Å²	80.1	45%	0.454	43%	0.431	S	S	.	.	H	α-helix	trans	-65	-39.6	177.2	49.6	0	0	0	0	112.5	D369 L375	D369-T371 VanDerWaalsContact C-N 3.3Å; D369-T371 PolarHBondContact O-N 3.46Å; T371-L375 WeakPolarHBondContact O-CB 3.43Å; T371-L375 PolarHBondContact O-N 3.33Å
372	S	77.9	Confident	62.2	Low	29 Å²	29	74.1 Å²	74.1	20%	0.203	40%	0.403	C	S	.	.	H	α-helix	trans	-68.2	-44.4	178	-167.6	0	0	0	0	110.8	D369 L375 K376 T620	D369-S372 PolarHBondContact O-N 3.24Å; S372-L375 PolarHBondContact O-N 3.19Å; S372-K376 WeakPolarHBondContact O-CG 3.26Å; S372-K376 PolarHBondContact O-N 2.79Å; S372-K376 VanDerWaalsContact O-N 3.15Å; S372-T620 WeakPolarHBondContact O-CG2 3.49Å; S372-T620 VanDerWaalsContact OG-CG2 3.32Å; S372-T620 WeakPolarHBondContact OG-CG2 3.39Å; S372-T620 PolarHBondContact OG-OG1 2.8Å
373	G	77.3	Confident	64.3	Low	42 Å²	42	65.3 Å²	65.3	43%	0.433	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-44.5	175.4	0	0	0	0	0	113.4	D369 T370 K376 N377	D369-G373 PolarHBondContact O-N 2.87Å; T370-G373 PolarHBondContact O-N 2.86Å; G373-K376 PolarHBondContact O-N 2.79Å; G373-N377 PolarHBondContact O-N 3.48Å; G373-N377 VanDerWaalsContact O-N 3.11Å
374	A	80.3	Confident	66.7	Low	0 Å²	0	60.3 Å²	60.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.8	-42.2	177.8	0	0	0	0	0	112.5	Q315 Y324 I344 T370 N377 W378	Q315-A374 HydrophobicContact CB-CB 3.8Å; Y324-A374 HydrophobicContact CD2-CB 3.59Å; Y324-A374 HydrophobicContact CE2-CB 3.43Å; Y324-A374 VanDerWaalsContact CE2-CB 3.43Å; Y324-A374 HydrophobicContact CG-CB 4.3Å; I344-A374 HydrophobicContact CD1-CB 4.43Å; T370-A374 VanDerWaalsContact O-CB 3.25Å; T370-A374 WeakPolarHBondContact O-CB 3.42Å; T370-A374 PolarHBondContact O-N 3.36Å; A374-N377 PolarHBondContact O-N 3.03Å; A374-W378 WeakPolarHBondContact O-CB 3.33Å; A374-W378 PolarHBondContact O-N 3.05Å
375	L	83.5	Confident	68.6	Low	1 Å²	1	55.3 Å²	55.3	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-45	178.2	-163	84.2	0	0	0	111.5	P313 I344 T371 S372 W378 F379 L533 N617 T620	P313-L375 HydrophobicContact CB-CD1 4.38Å; I344-L375 HydrophobicContact CB-CD1 4.46Å; I344-L375 HydrophobicContact CD1-CB 4.37Å; I344-L375 HydrophobicContact CD1-CD1 3.86Å; I344-L375 HydrophobicContact CG2-CD1 4.01Å; T371-L375 WeakPolarHBondContact O-CB 3.43Å; T371-L375 PolarHBondContact O-N 3.33Å; S372-L375 PolarHBondContact O-N 3.19Å; L375-W378 PolarHBondContact O-N 3.35Å; L375-F379 HydrophobicContact CB-CE2 4.5Å; L375-F379 HydrophobicContact CD1-CZ 4.34Å; L375-F379 HydrophobicContact CD2-CE2 3.56Å; L375-F379 HydrophobicContact CD2-CZ 3.67Å; L375-F379 HydrophobicContact CG-CD2 4.33Å; L375-F379 HydrophobicContact CG-CE2 3.58Å; L375-F379 HydrophobicContact CG-CZ 3.7Å; L375-F379 VanDerWaalsContact O-CD2 3.22Å; L375-F379 WeakPolarHBondContact O-CD2 3.48Å; L375-F379 WeakPolarHBondContact O-CG 3.42Å; L375-F379 PolarHBondContact O-N 3.33Å; L375-L533 HydrophobicContact CD1-CD1 3.9Å; L375-N617 HydrophobicContact CD2-CB 4.16Å; L375-T620 HydrophobicContact CB-CG2 4.03Å; L375-T620 HydrophobicContact CD2-CG2 3.64Å; L375-T620 HydrophobicContact CG-CG2 4.37Å
376	K	84.6	Confident	70.4	Confident	39 Å²	39	53.1 Å²	53.1	17%	0.17	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-47	177.5	-64.9	-163.5	-174.7	-174.1	0	112.3	S372 G373 W378 F379 D380 T620 E623 W624	S372-K376 WeakPolarHBondContact O-CG 3.26Å; S372-K376 PolarHBondContact O-N 2.79Å; S372-K376 VanDerWaalsContact O-N 3.15Å; G373-K376 PolarHBondContact O-N 2.79Å; K376-W378 VanDerWaalsContact C-N 3.27Å; K376-W378 PolarHBondContact O-N 3.2Å; K376-F379 PolarHBondContact O-N 2.91Å; K376-F379 VanDerWaalsContact O-N 3.12Å; K376-D380 PolarHBondContact O-N 2.95Å; K376-T620 HydrophobicContact CD-CG2 4.27Å; K376-T620 HydrophobicContact CG-CG2 3.56Å; K376-E623 PolarHBondContact NZ-O 2.77Å; K376-E623 IonicContact NZ-OE2 2.66Å; K376-E623 PolarHBondContact NZ-OE2 3.34Å; K376-W624 HydrophobicContact CD-CB 4.38Å; K376-W624 HydrophobicContact CG-CB 4.17Å
377	N	84.2	Confident	71.8	Confident	27 Å²	27	52.2 Å²	52.2	14%	0.144	29%	0.293	C	S	.	.	H	α-helix	trans	-67.1	-29.9	-179.9	-170.5	-111.7	0	0	0	112.4	Y324 P326 W327 G373 A374 D380 F381	Y324-N377 HydrophobicContact CE1-CB 4.39Å; Y324-N377 WeakPolarHBondContact OH-CB 3.43Å; Y324-N377 PolarHBondContact OH-OD1 3.04Å; P326-N377 VanDerWaalsContact CA-OD1 3.27Å; P326-N377 WeakPolarHBondContact CA-OD1 3.44Å; W327-N377 VanDerWaalsContact CD1-OD1 3.28Å; W327-N377 PolarHBondContact N-OD1 2.96Å; G373-N377 PolarHBondContact O-N 3.48Å; G373-N377 VanDerWaalsContact O-N 3.11Å; A374-N377 PolarHBondContact O-N 3.03Å; N377-D380 PolarHBondContact O-N 3.32Å; N377-F381 PolarHBondContact O-N 3.27Å
378	W	84.4	Confident	72.1	Confident	1 Å²	1	51.5 Å²	51.5	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-68.1	-43	168.4	173.4	72.1	0	0	0	112.7	L310 I312 P313 I314 A374 L375 K376 D380 F381 Y382 I529	L310-W378 WeakPolarHBondContact O-CZ2 3.35Å; I312-W378 VanDerWaalsContact C-CZ2 3.46Å; I312-W378 VanDerWaalsContact O-CZ2 3.3Å; I312-W378 WeakPolarHBondContact O-CZ2 3.34Å; I312-W378 PolarHBondContact O-NE1 2.91Å; P313-W378 VanDerWaalsContact CA-CE2 3.49Å; P313-W378 VanDerWaalsContact CA-CZ2 3.46Å; P313-W378 HydrophobicContact CB-CD2 4.18Å; P313-W378 HydrophobicContact CB-CE3 3.78Å; P313-W378 HydrophobicContact CB-CH2 3.78Å; P313-W378 HydrophobicContact CB-CZ2 4.22Å; P313-W378 HydrophobicContact CB-CZ3 3.54Å; I314-W378 VanDerWaalsContact CG1-CD1 3.47Å; I314-W378 HydrophobicContact CG1-CG 4.44Å; I314-W378 WeakPolarHBondContact O-CB 3.41Å; A374-W378 WeakPolarHBondContact O-CB 3.33Å; A374-W378 PolarHBondContact O-N 3.05Å; L375-W378 PolarHBondContact O-N 3.35Å; K376-W378 VanDerWaalsContact C-N 3.27Å; K376-W378 PolarHBondContact O-N 3.2Å; W378-D380 VanDerWaalsContact C-N 3.26Å; W378-D380 PolarHBondContact O-N 2.94Å; W378-F381 PolarHBondContact O-N 3.35Å; W378-F381 VanDerWaalsContact O-N 3.14Å; W378-Y382 VanDerWaalsContact O-CB 3.32Å; W378-Y382 WeakPolarHBondContact O-CB 3.43Å; W378-Y382 PolarHBondContact O-N 3.13Å; W378-I529 HydrophobicContact CH2-CB 4.38Å; W378-I529 HydrophobicContact CH2-CD1 3.57Å; W378-I529 HydrophobicContact CH2-CG1 3.76Å; W378-I529 HydrophobicContact CH2-CG2 3.69Å; W378-I529 HydrophobicContact CZ3-CD1 3.76Å; W378-I529 HydrophobicContact CZ3-CG1 4.34Å; W378-I529 HydrophobicContact CZ3-CG2 3.87Å
379	F	85.3	Confident	72.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.5	-36.8	172.9	-62.3	-52	0	0	0	112	L375 K376 Y382 K383 I529 L533 F621 W624	L375-F379 HydrophobicContact CB-CE2 4.5Å; L375-F379 HydrophobicContact CD1-CZ 4.34Å; L375-F379 HydrophobicContact CD2-CE2 3.56Å; L375-F379 HydrophobicContact CD2-CZ 3.67Å; L375-F379 HydrophobicContact CG-CD2 4.33Å; L375-F379 HydrophobicContact CG-CE2 3.58Å; L375-F379 HydrophobicContact CG-CZ 3.7Å; L375-F379 VanDerWaalsContact O-CD2 3.22Å; L375-F379 WeakPolarHBondContact O-CD2 3.48Å; L375-F379 WeakPolarHBondContact O-CG 3.42Å; L375-F379 PolarHBondContact O-N 3.33Å; K376-F379 PolarHBondContact O-N 2.91Å; K376-F379 VanDerWaalsContact O-N 3.12Å; F379-Y382 PolarHBondContact O-N 3.47Å; F379-K383 WeakPolarHBondContact O-CB 3.27Å; F379-K383 PolarHBondContact O-N 3.32Å; F379-I529 HydrophobicContact CD1-CD1 3.74Å; F379-I529 HydrophobicContact CE1-CD1 3.74Å; F379-I529 HydrophobicContact CE1-CG2 4.45Å; F379-L533 HydrophobicContact CZ-CD1 4.44Å; F379-F621 HydrophobicContact CD1-CD2 4.43Å; F379-F621 AromaticContact CE1-CD2 3.83Å; F379-F621 HydrophobicContact CE1-CD2 3.83Å; F379-F621 HydrophobicContact CE2-CB 3.9Å; F379-F621 HydrophobicContact CE2-CD2 4.01Å; F379-F621 HydrophobicContact CE2-CG 4.48Å; F379-F621 HydrophobicContact CZ-CB 3.76Å; F379-F621 AromaticContact CZ-CD2 3.62Å; F379-F621 HydrophobicContact CZ-CD2 3.62Å; F379-F621 HydrophobicContact CZ-CG 4.16Å; F379-W624 HydrophobicContact CB-CD2 3.46Å; F379-W624 VanDerWaalsContact CB-CD2 3.46Å; F379-W624 HydrophobicContact CB-CE3 3.99Å; F379-W624 HydrophobicContact CB-CG 3.84Å; F379-W624 HydrophobicContact CB-CH2 4.19Å; F379-W624 HydrophobicContact CB-CZ2 3.67Å; F379-W624 HydrophobicContact CB-CZ3 4.33Å; F379-W624 HydrophobicContact CD2-CB 3.91Å; F379-W624 AromaticContact CD2-CD2 3.92Å; F379-W624 HydrophobicContact CD2-CD2 3.92Å; F379-W624 HydrophobicContact CD2-CE3 4.24Å; F379-W624 AromaticContact CD2-CG 3.76Å; F379-W624 HydrophobicContact CD2-CG 3.76Å; F379-W624 HydrophobicContact CE2-CB 4.5Å; F379-W624 AromaticContact CG-CD2 3.95Å; F379-W624 HydrophobicContact CG-CD2 3.95Å; F379-W624 HydrophobicContact CG-CE3 4.17Å; F379-W624 HydrophobicContact CG-CG 4.21Å; F379-W624 WeakPolarHBondContact O-CZ2 3.36Å
380	D	83.1	Confident	73.2	Confident	48 Å²	48	49 Å²	49	26%	0.257	28%	0.28	S	S	.	.	H	α-helix	trans	-65.2	-39.9	174	-67.4	-42.5	0	0	0	112.6	K376 N377 W378 K384 W624 Q628	K376-D380 PolarHBondContact O-N 2.95Å; N377-D380 PolarHBondContact O-N 3.32Å; W378-D380 VanDerWaalsContact C-N 3.26Å; W378-D380 PolarHBondContact O-N 2.94Å; D380-K384 VanDerWaalsContact O-CG 3.24Å; D380-K384 WeakPolarHBondContact O-CG 3.5Å; D380-K384 PolarHBondContact O-N 2.68Å; D380-K384 VanDerWaalsContact O-N 3.14Å; D380-W624 PolarHBondContact OD1-NE1 3.42Å; D380-Q628 PolarHBondContact OD1-NE2 2.82Å
381	F	81.9	Confident	73.6	Confident	15 Å²	15	48.2 Å²	48.2	7%	0.066	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-46.5	173.7	168.7	-107.4	0	0	0	111.8	G300 R304 L307 L310 W327 N377 W378 K384 S385	G300-F381 VanDerWaalsContact O-CE2 3.32Å; G300-F381 WeakPolarHBondContact O-CE2 3.31Å; R304-F381 HydrophobicContact CB-CZ 4.49Å; L307-F381 HydrophobicContact CD1-CE1 3.74Å; L307-F381 HydrophobicContact CD1-CZ 3.94Å; L310-F381 HydrophobicContact CD2-CE1 3.84Å; L310-F381 HydrophobicContact CD2-CZ 4.34Å; W327-F381 HydrophobicContact CB-CB 4.11Å; W327-F381 HydrophobicContact CB-CD2 4.2Å; W327-F381 HydrophobicContact CB-CG 4.26Å; W327-F381 HydrophobicContact CG-CB 3.92Å; W327-F381 HydrophobicContact CG-CD2 4.42Å; W327-F381 HydrophobicContact CG-CG 4.06Å; N377-F381 PolarHBondContact O-N 3.27Å; W378-F381 PolarHBondContact O-N 3.35Å; W378-F381 VanDerWaalsContact O-N 3.14Å; F381-K384 PolarHBondContact O-N 2.83Å; F381-S385 PolarHBondContact O-N 2.78Å; F381-S385 PolarHBondContact O-OG 3.37Å
382	Y	79.7	Confident	74.1	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-56.2	-49.1	174.5	162.1	-89.5	0	0	0	111.6	W378 F379 K384 S385 N386 P525 E528 I529	W378-Y382 VanDerWaalsContact O-CB 3.32Å; W378-Y382 WeakPolarHBondContact O-CB 3.43Å; W378-Y382 PolarHBondContact O-N 3.13Å; F379-Y382 PolarHBondContact O-N 3.47Å; Y382-K384 VanDerWaalsContact C-N 3.33Å; Y382-K384 PolarHBondContact O-N 3.35Å; Y382-S385 VanDerWaalsContact CA-OG 3.3Å; Y382-S385 WeakPolarHBondContact CA-OG 3.14Å; Y382-S385 PolarHBondContact O-N 3.09Å; Y382-S385 VanDerWaalsContact O-N 3.11Å; Y382-S385 PolarHBondContact O-OG 3.48Å; Y382-N386 PolarHBondContact O-N 3.3Å; Y382-N386 PolarHBondContact OH-ND2 3.3Å; Y382-P525 HydrophobicContact CE1-CB 4.02Å; Y382-P525 HydrophobicContact CE1-CG 4.39Å; Y382-E528 HydrophobicContact CE2-CB 4.36Å; Y382-E528 VanDerWaalsContact OH-CB 3.27Å; Y382-E528 WeakPolarHBondContact OH-CB 3.3Å; Y382-E528 PolarHBondContact OH-OE1 3.3Å; Y382-E528 PolarHBondContact OH-OE2 3.19Å; Y382-I529 HydrophobicContact CD1-CD1 4.16Å; Y382-I529 HydrophobicContact CD2-CD1 4.44Å; Y382-I529 HydrophobicContact CE1-CD1 4.04Å; Y382-I529 HydrophobicContact CE2-CD1 4.29Å; Y382-I529 HydrophobicContact CE2-CG1 4.3Å; Y382-I529 HydrophobicContact CG-CD1 4.37Å
383	K	77.2	Confident	74.5	Confident	56 Å²	56	46.3 Å²	46.3	24%	0.243	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-42.3	176.8	177.8	175	171.7	177.2	0	111.7	F379 S385 S387 W624 Q628	F379-K383 WeakPolarHBondContact O-CB 3.27Å; F379-K383 PolarHBondContact O-N 3.32Å; K383-S385 VanDerWaalsContact C-N 3.31Å; K383-S385 PolarHBondContact O-N 2.81Å; K383-S387 WeakPolarHBondContact O-CB 3.42Å; K383-S387 PolarHBondContact O-N 3.45Å; K383-W624 HydrophobicContact CB-CH2 4.34Å; K383-W624 HydrophobicContact CB-CZ2 3.98Å; K383-W624 HydrophobicContact CD-CH2 4.38Å; K383-W624 HydrophobicContact CD-CZ2 4.08Å; K383-Q628 HydrophobicContact CD-CG 4.4Å; K383-Q628 VanDerWaalsContact CD-OE1 3.27Å
384	K	77.1	Confident	75	Confident	115 Å²	115	44.3 Å²	44.3	50%	0.5	23%	0.234	S	C	.	.	H	α-helix	trans	-67.9	-29.6	177.4	-70.2	173.4	-167.1	-165.4	0	112.9	E328 D380 F381 Y382	E328-K384 IonicContact OE1-NZ 2.68Å; E328-K384 PolarHBondContact OE1-NZ 2.87Å; D380-K384 VanDerWaalsContact O-CG 3.24Å; D380-K384 WeakPolarHBondContact O-CG 3.5Å; D380-K384 PolarHBondContact O-N 2.68Å; D380-K384 VanDerWaalsContact O-N 3.14Å; F381-K384 PolarHBondContact O-N 2.83Å; Y382-K384 VanDerWaalsContact C-N 3.33Å; Y382-K384 PolarHBondContact O-N 3.35Å
385	S	70	Confident	75.3	Confident	9 Å²	9	44.4 Å²	44.4	6%	0.063	24%	0.235	C	C	.	.	H	α-helix	trans	-82.7	-30.8	178.5	43.1	0	0	0	0	113.8	R304 F381 Y382 K383	R304-S385 PolarHBondContact NH2-O 2.92Å; F381-S385 PolarHBondContact O-N 2.78Å; F381-S385 PolarHBondContact O-OG 3.37Å; Y382-S385 VanDerWaalsContact CA-OG 3.3Å; Y382-S385 WeakPolarHBondContact CA-OG 3.14Å; Y382-S385 PolarHBondContact O-N 3.09Å; Y382-S385 VanDerWaalsContact O-N 3.11Å; Y382-S385 PolarHBondContact O-OG 3.48Å; K383-S385 VanDerWaalsContact C-N 3.31Å; K383-S385 PolarHBondContact O-N 2.81Å
386	N	65.8	Low	75.5	Confident	39 Å²	39	48.9 Å²	48.9	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-81.6	-23.2	171.2	-76.3	18.7	0	0	0	113.1	Y382 M388 S390 E528	Y382-N386 PolarHBondContact O-N 3.3Å; Y382-N386 PolarHBondContact OH-ND2 3.3Å; N386-M388 PolarHBondContact O-N 3Å; N386-S390 PolarHBondContact O-OG 3.01Å; N386-E528 VanDerWaalsContact ND2-CD 3.32Å; N386-E528 PolarHBondContact ND2-OE1 2.91Å; N386-E528 VanDerWaalsContact ND2-OE1 3.11Å; N386-E528 PolarHBondContact ND2-OE2 2.92Å
387	S	59.3	Low	75.6	Confident	83 Å²	83	47.4 Å²	47.4	58%	0.58	25%	0.25	S	C	*	.	S	Bend	trans	-68.2	11.1	178.8	-174.3	0	0	0	0	115.4	K383	K383-S387 WeakPolarHBondContact O-CB 3.42Å; K383-S387 PolarHBondContact O-N 3.45Å
388	M	45.2	Very low	75.8	Confident	111 Å²	111	46.2 Å²	46.2	55%	0.547	24%	0.243	S	C	.	.	S	Bend	trans	-125.2	103.4	-175.7	-65.8	-76	133.4	0	0	109.8	N386 S390	N386-M388 PolarHBondContact O-N 3Å; M388-S390 PolarHBondContact O-N 3.26Å
389	N	48.3	Very low	75.9	Confident	175 Å²	175	46.8 Å²	46.8	94%	0.936	25%	0.247	S	C	*	.	S	Bend	trans	67	26.9	167.2	-52.4	-4.6	0	0	0	117.2
390	S	60.9	Low	75.8	Confident	76 Å²	76	50.2 Å²	50.2	53%	0.531	27%	0.265	S	S	.	.	S	Bend	trans	-121.4	146.4	165.9	66.4	0	0	0	0	111.5	N386 M388 S392	N386-S390 PolarHBondContact O-OG 3.01Å; M388-S390 PolarHBondContact O-N 3.26Å; S390-S392 PolarHBondContact O-N 3.26Å
391	Y	68	Low	76	Confident	69 Å²	69	47.9 Å²	47.9	27%	0.271	25%	0.253	S	S	.	.			trans	-67.1	126.5	175.6	-78.7	-74	0	0	0	110.6	D395 Q396 P464 F465 D466	Y391-D395 HydrophobicContact CD1-CB 3.92Å; Y391-Q396 PolarHBondContact O-NE2 3.17Å; Y391-P464 HydrophobicContact CD2-CG 4.01Å; Y391-P464 HydrophobicContact CE2-CB 3.98Å; Y391-P464 HydrophobicContact CE2-CG 3.31Å; Y391-P464 PolarHBondContact OH-O 3.24Å; Y391-F465 WeakPolarHBondContact CE1-O 3.22Å; Y391-F465 PolarHBondContact OH-O 2.81Å; Y391-D466 WeakPolarHBondContact OH-CA 3.44Å; Y391-D466 PolarHBondContact OH-N 2.6Å
392	S	83	Confident	76.1	Confident	32 Å²	32	47.2 Å²	47.2	22%	0.224	25%	0.249	C	C	.	.			trans	-61.7	155.9	173.3	70.2	0	0	0	0	110.9	S390 S394 D395 Q396 R516 D520	S390-S392 PolarHBondContact O-N 3.26Å; S392-S394 PolarHBondContact O-N 2.68Å; S392-S394 PolarHBondContact OG-OG 3.01Å; S392-D395 PolarHBondContact O-N 2.83Å; S392-D395 PolarHBondContact OG-N 2.63Å; S392-D395 PolarHBondContact OG-OD2 2.85Å; S392-Q396 WeakPolarHBondContact O-CG 3.4Å; S392-Q396 PolarHBondContact O-N 2.91Å; S392-R516 PolarHBondContact OG-NH2 3.08Å; S392-D520 WeakPolarHBondContact CB-OD1 3.32Å; S392-D520 PolarHBondContact OG-OD2 3.1Å
393	L	84.8	Confident	76.1	Confident	30 Å²	30	51.8 Å²	51.8	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-57.7	-38.8	179.1	179.1	58.2	0	0	0	110.9	D395 Q396 L397 I519 L523 A524 L527	L393-D395 PolarHBondContact O-N 3.48Å; L393-Q396 WeakPolarHBondContact O-CB 3.44Å; L393-Q396 PolarHBondContact O-N 3.05Å; L393-L397 HydrophobicContact CD1-CD1 4.42Å; L393-L397 HydrophobicContact CD1-CG 4.37Å; L393-L397 HydrophobicContact CG-CD1 4.13Å; L393-L397 VanDerWaalsContact O-CG 3.26Å; L393-L397 WeakPolarHBondContact O-CG 3.19Å; L393-L397 PolarHBondContact O-N 2.92Å; L393-I519 HydrophobicContact CB-CG2 3.94Å; L393-I519 HydrophobicContact CD2-CG2 3.89Å; L393-I519 HydrophobicContact CG-CG2 3.78Å; L393-L523 HydrophobicContact CD2-CD2 4.42Å; L393-L523 HydrophobicContact CD2-CG 4.27Å; L393-A524 HydrophobicContact CB-CB 3.78Å; L393-A524 HydrophobicContact CD2-CB 3.88Å; L393-L527 HydrophobicContact CD2-CD1 3.8Å
394	S	87.4	Confident	76.2	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-42.5	172.9	61.4	0	0	0	0	113.9	S392 Q396 L397 I398 R516 D520	S392-S394 PolarHBondContact O-N 2.68Å; S392-S394 PolarHBondContact OG-OG 3.01Å; S394-Q396 VanDerWaalsContact C-N 3.31Å; S394-Q396 PolarHBondContact O-N 3.49Å; S394-L397 PolarHBondContact O-N 2.78Å; S394-I398 WeakPolarHBondContact O-CD1 3.41Å; S394-I398 WeakPolarHBondContact O-CG1 3.28Å; S394-I398 PolarHBondContact O-N 3Å; S394-R516 WeakPolarHBondContact OG-CD 3.32Å; S394-R516 WeakPolarHBondContact OG-CG 3.22Å; S394-R516 VanDerWaalsContact OG-CZ 3.25Å; S394-R516 PolarHBondContact OG-NE 2.63Å; S394-R516 PolarHBondContact OG-NH2 2.84Å; S394-D520 VanDerWaalsContact CB-OD1 3.26Å; S394-D520 WeakPolarHBondContact CB-OD1 3.34Å; S394-D520 PolarHBondContact N-OD1 3.3Å; S394-D520 VanDerWaalsContact N-OD1 3.1Å; S394-D520 PolarHBondContact OG-OD1 3.44Å; S394-D520 PolarHBondContact OG-OD2 2.95Å
395	D	88.3	Confident	76.2	Confident	2 Å²	2	49 Å²	49	1%	0.011	27%	0.271	C	S	.	.	H	α-helix	trans	-66.7	-32.3	176.8	-74.9	-30	0	0	0	111.9	Y391 S392 L393 I398 N399 S467 L470 R516	Y391-D395 HydrophobicContact CD1-CB 3.92Å; S392-D395 PolarHBondContact O-N 2.83Å; S392-D395 PolarHBondContact OG-N 2.63Å; S392-D395 PolarHBondContact OG-OD2 2.85Å; L393-D395 PolarHBondContact O-N 3.48Å; D395-I398 PolarHBondContact O-N 3.33Å; D395-N399 WeakPolarHBondContact O-CB 3.23Å; D395-N399 PolarHBondContact O-N 3.37Å; D395-N399 PolarHBondContact O-ND2 3.34Å; D395-S467 WeakPolarHBondContact OD2-CB 3.48Å; D395-S467 PolarHBondContact OD2-OG 2.87Å; D395-L470 HydrophobicContact CB-CD1 3.64Å; D395-L470 WeakPolarHBondContact OD1-CD1 3.44Å; D395-R516 IonicContact OD1-CZ 2.71Å; D395-R516 IonicContact OD1-NH1 3.42Å; D395-R516 PolarHBondContact OD1-NH1 2.87Å; D395-R516 IonicContact OD1-NH2 2.68Å; D395-R516 PolarHBondContact OD1-NH2 2.69Å; D395-R516 IonicContact OD2-CZ 2.6Å; D395-R516 IonicContact OD2-NH1 3.17Å; D395-R516 IonicContact OD2-NH2 3.12Å; D395-R516 PolarHBondContact OD2-NH2 3.42Å
396	Q	86.5	Confident	76.3	Confident	95 Å²	95	51.3 Å²	51.3	44%	0.444	28%	0.283	S	S	.	.	H	α-helix	trans	-64.7	-49.4	172.3	-63.4	172.5	41	0	0	110.5	Y391 S392 L393 S394 I398 N399 D400	Y391-Q396 PolarHBondContact O-NE2 3.17Å; S392-Q396 WeakPolarHBondContact O-CG 3.4Å; S392-Q396 PolarHBondContact O-N 2.91Å; L393-Q396 WeakPolarHBondContact O-CB 3.44Å; L393-Q396 PolarHBondContact O-N 3.05Å; S394-Q396 VanDerWaalsContact C-N 3.31Å; S394-Q396 PolarHBondContact O-N 3.49Å; Q396-I398 VanDerWaalsContact C-N 3.27Å; Q396-I398 PolarHBondContact O-N 3.36Å; Q396-N399 WeakPolarHBondContact O-CB 3.36Å; Q396-N399 PolarHBondContact O-N 2.95Å; Q396-N399 VanDerWaalsContact O-N 3.11Å; Q396-D400 PolarHBondContact O-N 3.47Å
397	L	86.8	Confident	76.5	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-29.2	177.8	-60.8	167	0	0	0	112.9	L393 S394 C401 I519 E547 F550	L393-L397 HydrophobicContact CD1-CD1 4.42Å; L393-L397 HydrophobicContact CD1-CG 4.37Å; L393-L397 HydrophobicContact CG-CD1 4.13Å; L393-L397 VanDerWaalsContact O-CG 3.26Å; L393-L397 WeakPolarHBondContact O-CG 3.19Å; L393-L397 PolarHBondContact O-N 2.92Å; S394-L397 PolarHBondContact O-N 2.78Å; L397-C401 PolarHBondContact O-N 3.38Å; L397-C401 PolarHBondContact O-SG 2.91Å; L397-I519 HydrophobicContact CD1-CD1 4.03Å; L397-I519 HydrophobicContact CD1-CG2 4.2Å; L397-E547 HydrophobicContact CD1-CB 4.29Å; L397-E547 HydrophobicContact CD1-CG 4.16Å; L397-F550 HydrophobicContact CB-CD1 4.07Å; L397-F550 HydrophobicContact CB-CE1 4.11Å; L397-F550 HydrophobicContact CD1-CD1 3.98Å; L397-F550 HydrophobicContact CD1-CE1 4.37Å
398	I	89.2	Confident	76.7	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-72.4	-44.1	171.4	-66.1	157.8	0	0	0	111	S394 D395 Q396 D400 C401 L402 L470 F474 F550 I554	S394-I398 WeakPolarHBondContact O-CD1 3.41Å; S394-I398 WeakPolarHBondContact O-CG1 3.28Å; S394-I398 PolarHBondContact O-N 3Å; D395-I398 PolarHBondContact O-N 3.33Å; Q396-I398 VanDerWaalsContact C-N 3.27Å; Q396-I398 PolarHBondContact O-N 3.36Å; I398-D400 VanDerWaalsContact C-N 3.32Å; I398-D400 PolarHBondContact O-N 3.23Å; I398-C401 PolarHBondContact O-N 2.92Å; I398-L402 HydrophobicContact CG2-CD1 3.97Å; I398-L402 HydrophobicContact CG2-CG 4.49Å; I398-L402 WeakPolarHBondContact O-CG 3.43Å; I398-L402 PolarHBondContact O-N 3.11Å; I398-L470 HydrophobicContact CG2-CD2 3.75Å; I398-F474 HydrophobicContact CD1-CE2 3.84Å; I398-F474 HydrophobicContact CD1-CZ 4.28Å; I398-F474 HydrophobicContact CG1-CE2 4.28Å; I398-F474 HydrophobicContact CG1-CZ 4.31Å; I398-F474 HydrophobicContact CG2-CE2 4.11Å; I398-F474 HydrophobicContact CG2-CZ 4.26Å; I398-F550 HydrophobicContact CD1-CZ 4.16Å; I398-F550 HydrophobicContact CG1-CE1 4.23Å; I398-F550 HydrophobicContact CG1-CZ 4.19Å; I398-I554 HydrophobicContact CB-CD1 4.49Å; I398-I554 HydrophobicContact CG1-CD1 3.51Å; I398-I554 HydrophobicContact CG1-CG1 4.3Å
399	N	85.7	Confident	77.8	Confident	14 Å²	14	51 Å²	51	8%	0.075	28%	0.281	C	S	.	.	H	α-helix	trans	-59.3	-42	174.7	-86.9	-79.8	0	0	0	111.6	D395 Q396 C401 L402 C403 P464 F465	D395-N399 WeakPolarHBondContact O-CB 3.23Å; D395-N399 PolarHBondContact O-N 3.37Å; D395-N399 PolarHBondContact O-ND2 3.34Å; Q396-N399 WeakPolarHBondContact O-CB 3.36Å; Q396-N399 PolarHBondContact O-N 2.95Å; Q396-N399 VanDerWaalsContact O-N 3.11Å; N399-C401 PolarHBondContact O-N 3.23Å; N399-L402 PolarHBondContact O-N 3.08Å; N399-C403 PolarHBondContact O-N 3.05Å; N399-C403 PolarHBondContact O-SG 2.99Å; N399-P464 WeakPolarHBondContact OD1-CA 3.32Å; N399-P464 WeakPolarHBondContact OD1-CB 3.31Å; N399-F465 WeakPolarHBondContact OD1-CD2 3.45Å; N399-F465 PolarHBondContact OD1-N 2.94Å
400	D	84.3	Confident	78.7	Confident	71 Å²	71	44 Å²	44	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-54.8	-51.8	172.5	-68.7	-11	0	0	0	111	Q396 I398 L402 C403 E404 K551	Q396-D400 PolarHBondContact O-N 3.47Å; I398-D400 VanDerWaalsContact C-N 3.32Å; I398-D400 PolarHBondContact O-N 3.23Å; D400-L402 VanDerWaalsContact C-N 3.27Å; D400-L402 PolarHBondContact O-N 3.27Å; D400-C403 PolarHBondContact O-N 3.33Å; D400-C403 VanDerWaalsContact O-N 3.11Å; D400-E404 PolarHBondContact O-N 3.2Å; D400-E404 VanDerWaalsContact O-N 3.08Å; D400-K551 WeakPolarHBondContact OD2-CE 3.45Å; D400-K551 IonicContact OD2-NZ 2.71Å; D400-K551 PolarHBondContact OD2-NZ 3Å
401	C	85.4	Confident	78.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-31.6	-178.9	-67.2	0	0	0	0	112.9	L397 I398 N399 L405 I554 L558	L397-C401 PolarHBondContact O-N 3.38Å; L397-C401 PolarHBondContact O-SG 2.91Å; I398-C401 PolarHBondContact O-N 2.92Å; N399-C401 PolarHBondContact O-N 3.23Å; C401-L405 WeakPolarHBondContact O-CG 3.49Å; C401-I554 HydrophobicContact CB-CG2 3.57Å; C401-L558 HydrophobicContact CB-CD1 4.43Å
402	L	84.3	Confident	78.9	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-70.3	-40.9	173.2	-73.7	163.7	0	0	0	111.4	I398 N399 D400 E404 L405 L410 L413 F465 L470 L473 L558	I398-L402 HydrophobicContact CG2-CD1 3.97Å; I398-L402 HydrophobicContact CG2-CG 4.49Å; I398-L402 WeakPolarHBondContact O-CG 3.43Å; I398-L402 PolarHBondContact O-N 3.11Å; N399-L402 PolarHBondContact O-N 3.08Å; D400-L402 VanDerWaalsContact C-N 3.27Å; D400-L402 PolarHBondContact O-N 3.27Å; L402-E404 PolarHBondContact O-N 3.14Å; L402-L405 HydrophobicContact CD2-CD1 3.96Å; L402-L405 WeakPolarHBondContact O-CB 3.41Å; L402-L405 PolarHBondContact O-N 3.47Å; L402-L405 VanDerWaalsContact O-N 3.1Å; L402-L410 HydrophobicContact CB-CD1 4.2Å; L402-L410 WeakPolarHBondContact O-CD1 3.45Å; L402-L413 HydrophobicContact CD2-CD1 4.3Å; L402-F465 HydrophobicContact CB-CD2 4.49Å; L402-F465 HydrophobicContact CB-CE2 4.14Å; L402-F465 HydrophobicContact CD1-CD2 3.62Å; L402-F465 HydrophobicContact CD1-CE2 4.02Å; L402-L470 HydrophobicContact CD1-CD2 3.63Å; L402-L473 HydrophobicContact CD1-CD1 4.07Å; L402-L473 HydrophobicContact CD2-CD1 4.28Å; L402-L558 HydrophobicContact CD2-CD1 3.75Å; L402-L558 HydrophobicContact CD2-CD2 4.19Å; L402-L558 HydrophobicContact CG-CD1 3.99Å
403	C	80.6	Confident	78.1	Confident	100 Å²	100	44.6 Å²	44.6	68%	0.676	25%	0.246	S	C	*	.	H	α-helix	trans	-65.7	-25	176.7	-65.9	0	0	0	0	113.2	N399 D400 L405	N399-C403 PolarHBondContact O-N 3.05Å; N399-C403 PolarHBondContact O-SG 2.99Å; D400-C403 PolarHBondContact O-N 3.33Å; D400-C403 VanDerWaalsContact O-N 3.11Å; C403-L405 VanDerWaalsContact C-N 3.32Å
404	E	79.5	Confident	77.1	Confident	104 Å²	104	45.1 Å²	45.1	49%	0.486	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-7.1	173.4	-69.9	-178.1	-134	0	0	114.1	D400 L402 K555	D400-E404 PolarHBondContact O-N 3.2Å; D400-E404 VanDerWaalsContact O-N 3.08Å; L402-E404 PolarHBondContact O-N 3.14Å; E404-K555 IonicContact OE1-NZ 3.95Å; E404-K555 WeakPolarHBondContact OE2-CE 3.26Å; E404-K555 IonicContact OE2-NZ 2.77Å; E404-K555 PolarHBondContact OE2-NZ 2.82Å
405	L	77.5	Confident	75.2	Confident	9 Å²	9	48.5 Å²	48.5	5%	0.047	28%	0.284	C	S	.	.	S	Bend	trans	-77.6	155.7	-178.9	-63.7	-179.6	0	0	0	113.3	C401 L402 C403 L413 L558 Q559	C401-L405 WeakPolarHBondContact O-CG 3.49Å; L402-L405 HydrophobicContact CD2-CD1 3.96Å; L402-L405 WeakPolarHBondContact O-CB 3.41Å; L402-L405 PolarHBondContact O-N 3.47Å; L402-L405 VanDerWaalsContact O-N 3.1Å; C403-L405 VanDerWaalsContact C-N 3.32Å; L405-L413 HydrophobicContact CD1-CD1 3.39Å; L405-L558 HydrophobicContact CD1-CB 4.23Å; L405-L558 HydrophobicContact CD1-CD1 4.36Å; L405-Q559 HydrophobicContact CD2-CG 3.51Å
406	N	72.2	Confident	73	Confident	58 Å²	58	51.5 Å²	51.5	31%	0.31	32%	0.315	S	S	.	.			trans	-62.5	131.4	166.3	-173.9	-66.9	0	0	0	110	N408 V409 L410	N406-N408 PolarHBondContact O-N 3.13Å; N406-N408 VanDerWaalsContact O-N 3.09Å; N406-N408 WeakPolarHBondContact OD1-CB 3.44Å; N406-N408 PolarHBondContact OD1-N 3.26Å; N406-V409 HydrophobicContact CB-CG2 4.27Å; N406-V409 WeakPolarHBondContact O-CB 3.49Å; N406-V409 PolarHBondContact O-N 3.41Å; N406-L410 PolarHBondContact O-N 2.82Å
407	P	68.3	Low	70.6	Confident	60 Å²	60	53.8 Å²	53.8	39%	0.39	32%	0.32	S	S	.	.	H	α-helix	trans	-53.5	-32.7	-177.9	-30.5	35.8	0	0	0	114.6	L410 V411 P1279	P407-L410 PolarHBondContact O-N 3.37Å; P407-V411 WeakPolarHBondContact O-CB 3.46Å; P407-V411 VanDerWaalsContact O-CG2 3.32Å; P407-V411 WeakPolarHBondContact O-CG2 3.49Å; P407-V411 PolarHBondContact O-N 3.16Å; P407-P1279 VanDerWaalsContact CD-CB 3.44Å; P407-P1279 HydrophobicContact CG-CB 3.7Å; P407-P1279 HydrophobicContact CG-CG 4.45Å
408	N	64.7	Low	68.2	Low	121 Å²	121	62.5 Å²	62.5	65%	0.647	36%	0.36	S	S	*	.	H	α-helix	trans	-67.2	-38.6	178.8	-62	-19.8	0	0	0	111.5	N406 N412	N406-N408 PolarHBondContact O-N 3.13Å; N406-N408 VanDerWaalsContact O-N 3.09Å; N406-N408 WeakPolarHBondContact OD1-CB 3.44Å; N406-N408 PolarHBondContact OD1-N 3.26Å; N408-N412 PolarHBondContact O-N 3Å
409	V	67.7	Low	65.2	Low	45 Å²	45	71.4 Å²	71.4	27%	0.273	40%	0.399	S	S	.	.	H	α-helix	trans	-67.3	-46.6	172.5	-179.2	0	0	0	0	109.1	N406 V411 N412 L413	N406-V409 HydrophobicContact CB-CG2 4.27Å; N406-V409 WeakPolarHBondContact O-CB 3.49Å; N406-V409 PolarHBondContact O-N 3.41Å; V409-V411 VanDerWaalsContact C-N 3.34Å; V409-V411 PolarHBondContact O-N 2.68Å; V409-N412 PolarHBondContact O-N 2.94Å; V409-L413 HydrophobicContact CG1-CD1 3.94Å; V409-L413 HydrophobicContact CG1-CG 4.07Å; V409-L413 WeakPolarHBondContact O-CB 3.41Å; V409-L413 VanDerWaalsContact O-CG 3.24Å; V409-L413 WeakPolarHBondContact O-CG 3.1Å; V409-L413 PolarHBondContact O-N 2.77Å
410	L	67.1	Low	62.3	Low	29 Å²	29	78.7 Å²	78.7	15%	0.152	44%	0.437	C	S	.	.	H	α-helix	trans	-59.7	-40.2	179.9	-169.5	122.8	0	0	0	112.9	L402 N406 P407 L413 L414 F465	L402-L410 HydrophobicContact CB-CD1 4.2Å; L402-L410 WeakPolarHBondContact O-CD1 3.45Å; N406-L410 PolarHBondContact O-N 2.82Å; P407-L410 PolarHBondContact O-N 3.37Å; L410-L413 PolarHBondContact O-N 3.28Å; L410-L414 HydrophobicContact CD1-CD1 4.42Å; L410-L414 HydrophobicContact CD2-CD1 3.67Å; L410-L414 HydrophobicContact CG-CD1 3.68Å; L410-L414 WeakPolarHBondContact O-CB 3.43Å; L410-L414 WeakPolarHBondContact O-CD1 3.43Å; L410-L414 VanDerWaalsContact O-CG 3.23Å; L410-L414 WeakPolarHBondContact O-CG 3.32Å; L410-L414 PolarHBondContact O-N 2.82Å; L410-F465 HydrophobicContact CD2-CZ 4.5Å
411	V	66.5	Low	59.5	Low	98 Å²	98	84.8 Å²	84.8	59%	0.594	46%	0.461	S	S	*	.	H	α-helix	trans	-64.5	-45.4	174.4	168.4	0	0	0	0	111.4	P407 V409 L413 L414 G415	P407-V411 WeakPolarHBondContact O-CB 3.46Å; P407-V411 VanDerWaalsContact O-CG2 3.32Å; P407-V411 WeakPolarHBondContact O-CG2 3.49Å; P407-V411 PolarHBondContact O-N 3.16Å; V409-V411 VanDerWaalsContact C-N 3.34Å; V409-V411 PolarHBondContact O-N 2.68Å; V411-L413 VanDerWaalsContact C-N 3.3Å; V411-L413 PolarHBondContact O-N 3.48Å; V411-L414 PolarHBondContact O-N 3.26Å; V411-G415 PolarHBondContact O-N 2.87Å; V411-G415 VanDerWaalsContact O-N 3.13Å
412	N	67	Low	56.6	Low	87 Å²	87	91.1 Å²	91.1	47%	0.465	49%	0.494	S	S	.	.	H	α-helix	trans	-60.9	-39.8	174.3	-75.3	-0	0	0	0	112.3	N408 V409 L414 E563	N408-N412 PolarHBondContact O-N 3Å; V409-N412 PolarHBondContact O-N 2.94Å; N412-L414 PolarHBondContact O-N 2.97Å; N412-E563 VanDerWaalsContact CB-OE2 3.26Å; N412-E563 WeakPolarHBondContact CB-OE2 3.47Å; N412-E563 PolarHBondContact ND2-OE2 2.8Å
413	L	66	Low	53.8	Low	3 Å²	3	99 Å²	99	2%	0.016	53%	0.531	C	S	.	.	H	α-helix	trans	-65.7	-21.4	178.9	-69.9	174.6	0	0	0	113.2	L402 L405 V409 L410 V411 L558 T562 E563 R566	L402-L413 HydrophobicContact CD2-CD1 4.3Å; L405-L413 HydrophobicContact CD1-CD1 3.39Å; V409-L413 HydrophobicContact CG1-CD1 3.94Å; V409-L413 HydrophobicContact CG1-CG 4.07Å; V409-L413 WeakPolarHBondContact O-CB 3.41Å; V409-L413 VanDerWaalsContact O-CG 3.24Å; V409-L413 WeakPolarHBondContact O-CG 3.1Å; V409-L413 PolarHBondContact O-N 2.77Å; L410-L413 PolarHBondContact O-N 3.28Å; V411-L413 VanDerWaalsContact C-N 3.3Å; V411-L413 PolarHBondContact O-N 3.48Å; L413-L558 HydrophobicContact CD1-CD2 4.42Å; L413-T562 HydrophobicContact CD2-CG2 3.66Å; L413-E563 HydrophobicContact CD2-CG 4.5Å; L413-R566 PolarHBondContact O-NH2 2.9Å
414	L	63.1	Low	51.3	Low	42 Å²	42	101.1 Å²	101.1	22%	0.22	54%	0.536	C	S	.	.	H	α-helix	trans	-124.6	9.3	-167.1	-63.2	172.6	0	0	0	114.9	L410 V411 N412 G416 R417 F465	L410-L414 HydrophobicContact CD1-CD1 4.42Å; L410-L414 HydrophobicContact CD2-CD1 3.67Å; L410-L414 HydrophobicContact CG-CD1 3.68Å; L410-L414 WeakPolarHBondContact O-CB 3.43Å; L410-L414 WeakPolarHBondContact O-CD1 3.43Å; L410-L414 VanDerWaalsContact O-CG 3.23Å; L410-L414 WeakPolarHBondContact O-CG 3.32Å; L410-L414 PolarHBondContact O-N 2.82Å; V411-L414 PolarHBondContact O-N 3.26Å; N412-L414 PolarHBondContact O-N 2.97Å; L414-G416 PolarHBondContact O-N 3.29Å; L414-R417 PolarHBondContact O-N 3.3Å; L414-F465 HydrophobicContact CD1-CD1 4.29Å; L414-F465 HydrophobicContact CD1-CE1 3.37Å; L414-F465 HydrophobicContact CD1-CE2 4.35Å; L414-F465 HydrophobicContact CD1-CZ 3.41Å; L414-F465 VanDerWaalsContact CD1-CZ 3.41Å; L414-F465 HydrophobicContact CD2-CD1 4.24Å; L414-F465 HydrophobicContact CD2-CE1 4.11Å; L414-F465 HydrophobicContact CG-CE1 4.39Å
415	G	49.3	Very low	48.7	Very low	71 Å²	71	100.5 Å²	100.5	73%	0.732	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	12.4	-174.9	0	0	0	0	0	117.9	V411	V411-G415 PolarHBondContact O-N 2.87Å; V411-G415 VanDerWaalsContact O-N 3.13Å
416	G	41.8	Very low	46.6	Very low	64 Å²	64	105.9 Å²	105.9	66%	0.66	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-17.8	171.9	0	0	0	0	0	114.8	L414 Q418 K419	L414-G416 PolarHBondContact O-N 3.29Å; G416-Q418 PolarHBondContact O-N 2.69Å; G416-K419 PolarHBondContact O-N 3.34Å
417	R	36.4	Very low	44.4	Very low	143 Å²	143	109.8 Å²	109.8	54%	0.54	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.4	11.2	-167.2	-118.4	-177.1	-160.8	-158.8	5.9	117.1	L414 D469	L414-R417 PolarHBondContact O-N 3.3Å; R417-D469 IonicContact CZ-OD2 3.58Å; R417-D469 IonicContact NE-OD2 3.02Å; R417-D469 IonicContact NH2-OD2 3.84Å; R417-D469 PolarHBondContact NH2-OD2 2.72Å
418	Q	34.8	Very low	42.6	Very low	191 Å²	191	112.5 Å²	112.5	89%	0.893	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	3.6	172.9	-76.5	-170.2	-13.8	0	0	114.4	G416	G416-Q418 PolarHBondContact O-N 2.69Å
419	K	27.2	Very low	40.8	Very low	189 Å²	189	113 Å²	113	82%	0.822	63%	0.629	S	S	*	*	S	Bend	trans	-135.2	82.5	174.7	-70.4	-171.2	177	-174.8	0	112	G416	G416-K419 PolarHBondContact O-N 3.34Å
420	L	23.8	Very low	39	Very low	167 Å²	167	116.5 Å²	116.5	87%	0.874	65%	0.654	S	S	*	*			trans	179.2	79.8	152	-99.8	160.2	0	0	0	110
421	F	26	Very low	37	Very low	200 Å²	200	123.6 Å²	123.6	88%	0.877	69%	0.691	S	S	*	*	S	Bend	trans	-131.2	153.3	154.7	-86.7	-77.7	0	0	0	107	E423	F421-E423 PolarHBondContact O-N 3.05Å
422	D	25.5	Very low	35	Very low	133 Å²	133	124.6 Å²	124.6	71%	0.711	70%	0.702	S	S	*	*			trans	-56.4	124.6	-161.5	-77.4	-88.2	0	0	0	116.1	N424	D422-N424 PolarHBondContact OD1-ND2 2.81Å
423	E	25.5	Very low	33.1	Very low	164 Å²	164	125.5 Å²	125.5	77%	0.766	72%	0.721	S	S	*	*			trans	-116.7	70.4	157.7	-91.2	-69.3	-178.4	0	0	108.7	F421	F421-E423 PolarHBondContact O-N 3.05Å
424	N	26.8	Very low	31.3	Very low	146 Å²	146	133.7 Å²	133.7	78%	0.781	76%	0.763	S	S	*	*			trans	-101.8	52.8	177.6	-92.1	-56.7	0	0	0	111.3	D422	D422-N424 PolarHBondContact OD1-ND2 2.81Å
425	S	25.8	Very low	29.4	Very low	90 Å²	90	136.7 Å²	136.7	63%	0.629	79%	0.788	S	S	*	*	S	Bend	trans	-143.4	141.3	162.9	83.9	0	0	0	0	111.6
426	P	32.4	Very low	28.4	Very low	122 Å²	122	137.2 Å²	137.2	79%	0.792	78%	0.78	S	S	*	*			trans	-104.1	118.6	-168.6	35.9	-31.4	0	0	0	114.7
427	T	27.6	Very low	27.7	Very low	140 Å²	140	141.3 Å²	141.3	86%	0.859	79%	0.786	S	S	*	*			trans	-169.9	132.8	135.1	8.5	0	0	0	0	112.2
428	P	29.6	Very low	27.2	Very low	118 Å²	118	141.4 Å²	141.4	77%	0.766	80%	0.797	S	S	*	*			trans	-103.7	137.9	179	36.3	-30.8	0	0	0	113.4
429	T	26.9	Very low	27	Very low	130 Å²	130	140.1 Å²	140.1	80%	0.798	79%	0.791	S	S	*	*			trans	-150.9	120.7	159.9	-50.8	0	0	0	0	110.6
430	P	30.1	Very low	27.3	Very low	120 Å²	120	137.8 Å²	137.8	78%	0.779	79%	0.787	S	S	*	*			trans	-98.5	135.3	178	35.3	-30.2	0	0	0	112.1
431	L	26	Very low	27.5	Very low	178 Å²	178	139 Å²	139	93%	0.932	79%	0.785	S	S	*	*			trans	-141.2	143.6	163.3	-80.9	-178.6	0	0	0	111.9
432	S	23.1	Very low	27.4	Very low	118 Å²	118	140.3 Å²	140.3	83%	0.825	78%	0.784	S	S	*	*			trans	-112.6	120.6	178.9	54.5	0	0	0	0	110.8
433	A	27.2	Very low	27.5	Very low	106 Å²	106	142.4 Å²	142.4	88%	0.876	79%	0.79	S	S	*	*			trans	-154.4	127.6	161.2	0	0	0	0	0	110.9
434	I	27.9	Very low	27.6	Very low	175 Å²	175	146.6 Å²	146.6	90%	0.897	80%	0.798	S	S	*	*			trans	-79.4	142.7	-175.4	-67.1	151.1	0	0	0	111.4
435	S	24.2	Very low	27.5	Very low	105 Å²	105	145 Å²	145	73%	0.734	80%	0.799	S	S	*	*			trans	-164.3	159.4	131	-150.5	0	0	0	0	114.5
436	S	27.5	Very low	27.5	Very low	82 Å²	82	147.8 Å²	147.8	57%	0.573	81%	0.807	S	S	*	*			trans	42.6	99.6	159.1	55	0	0	0	0	119.6
437	L	26.8	Very low	27.3	Very low	151 Å²	151	147.3 Å²	147.3	79%	0.791	81%	0.806	S	S	*	*	S	Bend	trans	-95.8	12.3	166.7	-163.1	64.4	0	0	0	113.1
438	D	27.1	Very low	27.2	Very low	144 Å²	144	152 Å²	152	77%	0.77	81%	0.81	S	S	*	*	S	Bend	trans	-98.6	-12.6	-173.4	-74.1	-70.8	0	0	0	115	I440	D438-I440 PolarHBondContact O-N 3.25Å
439	E	30.6	Very low	27	Very low	164 Å²	164	151.2 Å²	151.2	77%	0.766	81%	0.807	S	S	*	*	G	3₁₀ helix	trans	-84.6	-11.6	-171.7	-151.7	162.7	-147.2	0	0	113.8	F441	E439-F441 VanDerWaalsContact C-N 3.35Å; E439-F441 PolarHBondContact O-N 2.7Å
440	I	32	Very low	27	Very low	140 Å²	140	156.2 Å²	156.2	72%	0.718	81%	0.811	S	S	*	*	G	3₁₀ helix	trans	-76.9	-19.9	-178.3	-65	176	0	0	0	112.3	D438	D438-I440 PolarHBondContact O-N 3.25Å
441	F	28	Very low	26.8	Very low	192 Å²	192	155.9 Å²	155.9	84%	0.842	81%	0.807	S	S	*	*	G	3₁₀ helix	trans	-91.9	4.9	-171	-100	-76.7	0	0	0	116.5	E439	E439-F441 VanDerWaalsContact C-N 3.35Å; E439-F441 PolarHBondContact O-N 2.7Å
442	R	24.9	Very low	26.8	Very low	228 Å²	228	156.7 Å²	156.7	86%	0.86	81%	0.806	S	S	*	*	S	Bend	trans	-122.4	-2.3	-175.9	-81.4	-168.7	170.4	-166.4	-2	118.2
443	H	28.2	Very low	27	Very low	178 Å²	178	158.5 Å²	158.5	82%	0.824	80%	0.801	S	S	*	*	S	Bend	trans	-119.6	58.4	179.2	-83.5	-69	0	0	0	114.8
444	R	27.9	Very low	27	Very low	251 Å²	251	160.5 Å²	160.5	95%	0.947	80%	0.796	S	S	*	*			trans	-151.1	72.6	157.4	-129.4	177.1	-163.6	-153	2.7	114.8
445	S	23.1	Very low	27	Very low	113 Å²	113	160.8 Å²	160.8	79%	0.79	79%	0.794	S	S	*	*			trans	-131.1	153.2	159.3	-68.5	0	0	0	0	109
446	N	25.5	Very low	27.1	Very low	149 Å²	149	164.5 Å²	164.5	80%	0.797	80%	0.799	S	S	*	*			trans	65.2	66.7	-179.8	-61.2	-6.6	0	0	0	117
447	S	28.9	Very low	27.1	Very low	112 Å²	112	168.8 Å²	168.8	78%	0.783	81%	0.81	S	S	*	*			trans	-138.2	62.8	151.3	-67.3	0	0	0	0	110.4	S449	S447-S449 VanDerWaalsContact C-N 3.33Å; S447-S449 PolarHBondContact O-N 3.3Å
448	Y	26.3	Very low	27.2	Very low	237 Å²	237	169.4 Å²	169.4	93%	0.929	81%	0.814	S	S	*	*			trans	-77.6	77.1	-179.1	-103.8	-85.2	0	0	0	112
449	S	25.5	Very low	27.4	Very low	103 Å²	103	168.6 Å²	168.6	72%	0.72	81%	0.809	S	S	*	*	S	Bend	trans	-170.3	147.7	152.2	45.4	0	0	0	0	110.7	S447	S447-S449 VanDerWaalsContact C-N 3.33Å; S447-S449 PolarHBondContact O-N 3.3Å
450	R	26.2	Very low	27.6	Very low	234 Å²	234	164.6 Å²	164.6	88%	0.883	80%	0.797	S	S	*	*			trans	61.4	61.1	167.3	-157.7	-178.8	-169.9	136.8	6.7	116.5
451	V	26.9	Very low	27.7	Very low	114 Å²	114	164.3 Å²	164.3	69%	0.691	80%	0.797	S	S	*	*			trans	-131	50.1	160.7	-162.2	0	0	0	0	111.4
452	E	25.9	Very low	28.7	Very low	194 Å²	194	161 Å²	161	91%	0.907	79%	0.788	S	S	*	*	S	Bend	trans	-113.6	67.7	165.6	-71.2	-169.2	142.4	0	0	109.5
453	E	25.7	Very low	30	Very low	156 Å²	156	156.5 Å²	156.5	73%	0.729	78%	0.777	S	S	*	*	S	Bend	trans	-166.3	-31.8	169.9	-116.8	164.8	175.4	0	0	112.4	Q455	E453-Q455 PolarHBondContact O-N 3.16Å
454	I	26.9	Very low	31.5	Very low	148 Å²	148	149.4 Å²	149.4	76%	0.759	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	48.4	-172.1	-38	-177.4	0	0	0	113.1
455	Q	28.6	Very low	33.3	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	1.2	161.6	-72.8	-164.1	-11.2	0	0	113.9	E453	E453-Q455 PolarHBondContact O-N 3.16Å
456	H	27.1	Very low	35.4	Very low	183 Å²	183	137.3 Å²	137.3	85%	0.847	69%	0.691	S	S	*	*	S	Bend	trans	-102.2	14.8	179.2	-71.6	-49.5	0	0	0	115
457	Q	26.1	Very low	37.6	Very low	172 Å²	172	132.1 Å²	132.1	80%	0.804	67%	0.666	S	S	*	*	S	Bend	trans	-122.5	77.5	171.6	-66.3	-175.6	4	0	0	110.3
458	N	30	Very low	39.6	Very low	164 Å²	164	133.5 Å²	133.5	88%	0.877	66%	0.661	S	S	*	*			trans	179.2	32.7	156.2	-94.3	-35.4	0	0	0	113.5
459	L	30.1	Very low	41.8	Very low	126 Å²	126	125 Å²	125	66%	0.66	63%	0.631	S	S	*	*	S	Bend	trans	-66.8	138.3	148.7	-109.2	71.2	0	0	0	106.9	N461	L459-N461 PolarHBondContact O-N 2.7Å
460	P	34.9	Very low	44.3	Very low	80 Å²	80	120.1 Å²	120.1	52%	0.519	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-58.3	131.9	165	27	-32.7	0	0	0	107.9
461	N	35.5	Very low	46.7	Very low	134 Å²	134	111.3 Å²	111.3	72%	0.717	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-51.4	147.8	176.3	-89.9	-37.7	0	0	0	110.5	L459 Q463	L459-N461 PolarHBondContact O-N 2.7Å; N461-Q463 HydrophobicContact CB-CG 4.47Å; N461-Q463 PolarHBondContact O-N 3.17Å
462	N	48.6	Very low	49.1	Very low	122 Å²	122	109.1 Å²	109.1	65%	0.652	56%	0.564	S	S	*	*	S	Bend	trans	-68.3	34.6	175.4	-75.5	-16.3	0	0	0	113.7	Y1282	N462-Y1282 PolarHBondContact ND2-OH 3.13Å
463	Q	52.6	Low	51.6	Low	134 Å²	134	100.3 Å²	100.3	63%	0.626	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-73.7	128.4	160.5	-70.7	178.6	-49.4	0	0	108	N461	N461-Q463 HydrophobicContact CB-CG 4.47Å; N461-Q463 PolarHBondContact O-N 3.17Å
464	P	59.2	Low	54.3	Low	29 Å²	29	93.4 Å²	93.4	19%	0.188	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-58.7	153.3	170.6	26.9	-35.4	0	0	0	111	Y391 N399	Y391-P464 HydrophobicContact CD2-CG 4.01Å; Y391-P464 HydrophobicContact CE2-CB 3.98Å; Y391-P464 HydrophobicContact CE2-CG 3.31Å; Y391-P464 PolarHBondContact OH-O 3.24Å; N399-P464 WeakPolarHBondContact OD1-CA 3.32Å; N399-P464 WeakPolarHBondContact OD1-CB 3.31Å
465	F	65.1	Low	56.8	Low	23 Å²	23	92.1 Å²	92.1	10%	0.101	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-70.4	133	177.6	-58	-71.1	0	0	0	110.3	Y391 N399 L402 L410 L414 D469 L470	Y391-F465 WeakPolarHBondContact CE1-O 3.22Å; Y391-F465 PolarHBondContact OH-O 2.81Å; N399-F465 WeakPolarHBondContact OD1-CD2 3.45Å; N399-F465 PolarHBondContact OD1-N 2.94Å; L402-F465 HydrophobicContact CB-CD2 4.49Å; L402-F465 HydrophobicContact CB-CE2 4.14Å; L402-F465 HydrophobicContact CD1-CD2 3.62Å; L402-F465 HydrophobicContact CD1-CE2 4.02Å; L410-F465 HydrophobicContact CD2-CZ 4.5Å; L414-F465 HydrophobicContact CD1-CD1 4.29Å; L414-F465 HydrophobicContact CD1-CE1 3.37Å; L414-F465 HydrophobicContact CD1-CE2 4.35Å; L414-F465 HydrophobicContact CD1-CZ 3.41Å; L414-F465 VanDerWaalsContact CD1-CZ 3.41Å; L414-F465 HydrophobicContact CD2-CD1 4.24Å; L414-F465 HydrophobicContact CD2-CE1 4.11Å; L414-F465 HydrophobicContact CG-CE1 4.39Å; F465-D469 HydrophobicContact CB-CB 4.42Å; F465-L470 HydrophobicContact CB-CD2 3.76Å; F465-L470 HydrophobicContact CB-CG 4.05Å; F465-L470 WeakPolarHBondContact O-CD1 3.23Å
466	D	68.6	Low	59.3	Low	87 Å²	87	84.2 Å²	84.2	47%	0.465	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-58.6	147.3	-177.2	-173.2	18	0	0	0	111.4	Y391 Q468 D469 L470	Y391-D466 WeakPolarHBondContact OH-CA 3.44Å; Y391-D466 PolarHBondContact OH-N 2.6Å; D466-Q468 PolarHBondContact O-N 3.2Å; D466-D469 HydrophobicContact CB-CB 4.49Å; D466-D469 WeakPolarHBondContact O-CA 3.23Å; D466-D469 WeakPolarHBondContact O-CB 3.2Å; D466-D469 PolarHBondContact O-N 2.96Å; D466-L470 WeakPolarHBondContact O-CG 3.19Å; D466-L470 PolarHBondContact O-N 2.89Å
467	S	70.6	Confident	62	Low	41 Å²	41	77 Å²	77	29%	0.287	41%	0.41	S	S	.	.	H	α-helix	trans	-58.3	-25.7	-178.5	-68.3	0	0	0	0	112.3	D395 A471	D395-S467 WeakPolarHBondContact OD2-CB 3.48Å; D395-S467 PolarHBondContact OD2-OG 2.87Å; S467-A471 VanDerWaalsContact O-CB 3.31Å; S467-A471 WeakPolarHBondContact O-CB 3.46Å; S467-A471 PolarHBondContact O-N 2.93Å
468	Q	71	Confident	64.5	Low	141 Å²	141	76.6 Å²	76.6	66%	0.659	41%	0.408	S	S	*	.	H	α-helix	trans	-75	-40.2	172.2	-171.1	62.5	24	0	0	113.1	D466 L470 A471 S472	D466-Q468 PolarHBondContact O-N 3.2Å; Q468-L470 VanDerWaalsContact C-N 3.32Å; Q468-A471 PolarHBondContact O-N 3.2Å; Q468-S472 PolarHBondContact O-N 3.45Å
469	D	72.6	Confident	66.8	Low	59 Å²	59	70.1 Å²	70.1	32%	0.316	38%	0.375	S	S	.	.	H	α-helix	trans	-59	-47	171	-79.7	-21.1	0	0	0	109.2	R417 F465 D466 S472 L473	R417-D469 IonicContact CZ-OD2 3.58Å; R417-D469 IonicContact NE-OD2 3.02Å; R417-D469 IonicContact NH2-OD2 3.84Å; R417-D469 PolarHBondContact NH2-OD2 2.72Å; F465-D469 HydrophobicContact CB-CB 4.42Å; D466-D469 HydrophobicContact CB-CB 4.49Å; D466-D469 WeakPolarHBondContact O-CA 3.23Å; D466-D469 WeakPolarHBondContact O-CB 3.2Å; D466-D469 PolarHBondContact O-N 2.96Å; D469-S472 WeakPolarHBondContact O-CB 3.31Å; D469-S472 PolarHBondContact O-N 2.77Å; D469-S472 PolarHBondContact O-OG 3.13Å; D469-L473 PolarHBondContact O-N 3.24Å
470	L	78.8	Confident	69.4	Low	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-63.7	-42	178.3	-65.3	179.9	0	0	0	112.9	D395 I398 L402 F465 D466 Q468 S472 L473 F474	D395-L470 HydrophobicContact CB-CD1 3.64Å; D395-L470 WeakPolarHBondContact OD1-CD1 3.44Å; I398-L470 HydrophobicContact CG2-CD2 3.75Å; L402-L470 HydrophobicContact CD1-CD2 3.63Å; F465-L470 HydrophobicContact CB-CD2 3.76Å; F465-L470 HydrophobicContact CB-CG 4.05Å; F465-L470 WeakPolarHBondContact O-CD1 3.23Å; D466-L470 WeakPolarHBondContact O-CG 3.19Å; D466-L470 PolarHBondContact O-N 2.89Å; Q468-L470 VanDerWaalsContact C-N 3.32Å; L470-S472 PolarHBondContact O-N 2.85Å; L470-L473 HydrophobicContact CD2-CD1 4.11Å; L470-L473 WeakPolarHBondContact O-CB 3.48Å; L470-L473 PolarHBondContact O-N 2.95Å; L470-L473 VanDerWaalsContact O-N 3.15Å; L470-F474 VanDerWaalsContact O-CD2 3.31Å; L470-F474 WeakPolarHBondContact O-CD2 3.46Å
471	A	75.8	Confident	71.6	Confident	49 Å²	49	65.9 Å²	65.9	41%	0.405	35%	0.345	S	S	.	.	H	α-helix	trans	-59.2	-34.4	174.9	0	0	0	0	0	112.2	S467 Q468 L473 F474 F475	S467-A471 VanDerWaalsContact O-CB 3.31Å; S467-A471 WeakPolarHBondContact O-CB 3.46Å; S467-A471 PolarHBondContact O-N 2.93Å; Q468-A471 PolarHBondContact O-N 3.2Å; A471-L473 VanDerWaalsContact C-N 3.34Å; A471-L473 PolarHBondContact O-N 3.44Å; A471-F474 PolarHBondContact O-N 2.79Å; A471-F475 PolarHBondContact O-N 3.47Å
472	S	77	Confident	73.7	Confident	68 Å²	68	65.5 Å²	65.5	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-66.6	-31.9	177.1	85.8	0	0	0	0	113.4	Q468 D469 L470 F474 F475	Q468-S472 PolarHBondContact O-N 3.45Å; D469-S472 WeakPolarHBondContact O-CB 3.31Å; D469-S472 PolarHBondContact O-N 2.77Å; D469-S472 PolarHBondContact O-OG 3.13Å; L470-S472 PolarHBondContact O-N 2.85Å; S472-F474 PolarHBondContact O-N 2.93Å; S472-F475 WeakPolarHBondContact O-CB 3.39Å; S472-F475 PolarHBondContact O-N 3.37Å; S472-F475 VanDerWaalsContact O-N 3.14Å
473	L	78.7	Confident	75.1	Confident	9 Å²	9	60.3 Å²	60.3	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-65.7	-22.9	178.7	-64.5	176	0	0	0	113.2	L402 D469 L470 A471 W557	L402-L473 HydrophobicContact CD1-CD1 4.07Å; L402-L473 HydrophobicContact CD2-CD1 4.28Å; D469-L473 PolarHBondContact O-N 3.24Å; L470-L473 HydrophobicContact CD2-CD1 4.11Å; L470-L473 WeakPolarHBondContact O-CB 3.48Å; L470-L473 PolarHBondContact O-N 2.95Å; L470-L473 VanDerWaalsContact O-N 3.15Å; A471-L473 VanDerWaalsContact C-N 3.34Å; A471-L473 PolarHBondContact O-N 3.44Å; L473-W557 PolarHBondContact O-NE1 3.09Å
474	F	81.7	Confident	76.4	Confident	10 Å²	10	54 Å²	54	4%	0.044	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	18.6	176.8	-53.5	-80.7	0	0	0	112.6	I398 L470 A471 S472 I512 K513 I554 W557	I398-F474 HydrophobicContact CD1-CE2 3.84Å; I398-F474 HydrophobicContact CD1-CZ 4.28Å; I398-F474 HydrophobicContact CG1-CE2 4.28Å; I398-F474 HydrophobicContact CG1-CZ 4.31Å; I398-F474 HydrophobicContact CG2-CE2 4.11Å; I398-F474 HydrophobicContact CG2-CZ 4.26Å; L470-F474 VanDerWaalsContact O-CD2 3.31Å; L470-F474 WeakPolarHBondContact O-CD2 3.46Å; A471-F474 PolarHBondContact O-N 2.79Å; S472-F474 PolarHBondContact O-N 2.93Å; F474-I512 HydrophobicContact CD1-CD1 4.4Å; F474-I512 HydrophobicContact CD1-CG2 4.02Å; F474-I512 HydrophobicContact CE1-CD1 4.14Å; F474-I512 HydrophobicContact CE1-CG2 3.82Å; F474-I512 HydrophobicContact CZ-CG2 4.39Å; F474-K513 WeakPolarHBondContact O-CE 3.48Å; F474-K513 PolarHBondContact O-NZ 2.89Å; F474-I554 HydrophobicContact CZ-CG1 4.44Å; F474-W557 AromaticContact CD1-CD1 3.54Å; F474-W557 HydrophobicContact CD1-CD2 4.39Å; F474-W557 HydrophobicContact CD1-CG 4.1Å; F474-W557 AromaticContact CD1-NE1 3.5Å; F474-W557 HydrophobicContact CE1-CB 4.47Å; F474-W557 AromaticContact CE1-CD1 3.3Å; F474-W557 AromaticContact CE1-CG 3.9Å; F474-W557 HydrophobicContact CE1-CG 3.9Å; F474-W557 AromaticContact CE1-NE1 3.75Å
475	F	80.7	Confident	77.1	Confident	122 Å²	122	59.5 Å²	59.5	54%	0.535	30%	0.303	S	S	.	.			trans	-74.1	126.7	169.9	-177.9	-95.2	0	0	0	110.7	A471 S472 E477 R569	A471-F475 PolarHBondContact O-N 3.47Å; S472-F475 WeakPolarHBondContact O-CB 3.39Å; S472-F475 PolarHBondContact O-N 3.37Å; S472-F475 VanDerWaalsContact O-N 3.14Å; F475-E477 HydrophobicContact CE1-CG 4.33Å; F475-R569 PolarHBondContact O-NH2 3.2Å
476	I	81	Confident	77.3	Confident	16 Å²	16	60.8 Å²	60.8	8%	0.082	31%	0.314	C	S	.	.			trans	-133.2	139.3	169.4	-48.6	-179.6	0	0	0	107.6	W502 I505 Y506 A509 W557	I476-W502 HydrophobicContact CG2-CH2 3.37Å; I476-W502 HydrophobicContact CG2-CZ2 3.39Å; I476-W502 HydrophobicContact CG2-CZ3 4.29Å; I476-I505 HydrophobicContact CD1-CG2 4.2Å; I476-I505 WeakPolarHBondContact CD1-O 3.28Å; I476-Y506 HydrophobicContact CB-CD2 4.44Å; I476-Y506 HydrophobicContact CG2-CD2 4.06Å; I476-A509 HydrophobicContact CD1-CB 3.42Å; I476-A509 VanDerWaalsContact CD1-CB 3.42Å; I476-A509 HydrophobicContact CG1-CB 3.99Å; I476-W557 HydrophobicContact CD1-CH2 3.47Å; I476-W557 VanDerWaalsContact CD1-CH2 3.47Å; I476-W557 HydrophobicContact CD1-CZ2 4.36Å; I476-W557 HydrophobicContact CD1-CZ3 3.96Å; I476-W557 HydrophobicContact CG1-CH2 3.82Å; I476-W557 HydrophobicContact CG1-CZ2 4.31Å
477	E	83.2	Confident	77	Confident	31 Å²	31	57.9 Å²	57.9	15%	0.145	30%	0.301	C	S	.	.			trans	-57.8	164.4	169.1	-61.9	82.5	173.2	0	0	112.1	F475 Q482 I483 W502 R569	F475-E477 HydrophobicContact CE1-CG 4.33Å; E477-Q482 HydrophobicContact CB-CB 4.49Å; E477-I483 HydrophobicContact CG-CD1 4.29Å; E477-I483 HydrophobicContact CG-CG1 4.16Å; E477-W502 HydrophobicContact CB-CH2 4.17Å; E477-W502 HydrophobicContact CB-CZ2 3.97Å; E477-W502 WeakPolarHBondContact O-CZ2 2.96Å; E477-R569 VanDerWaalsContact CD-NH2 3.31Å; E477-R569 IonicContact OE1-CZ 2.6Å; E477-R569 IonicContact OE1-NE 3.5Å; E477-R569 PolarHBondContact OE1-NE 2.75Å; E477-R569 IonicContact OE1-NH2 3.51Å; E477-R569 PolarHBondContact OE1-NH2 2.77Å; E477-R569 VanDerWaalsContact OE1-NH2 3.17Å; E477-R569 IonicContact OE2-CZ 3Å; E477-R569 IonicContact OE2-NE 3.47Å; E477-R569 PolarHBondContact OE2-NE 3.34Å; E477-R569 IonicContact OE2-NH2 3.51Å; E477-R569 PolarHBondContact OE2-NH2 2.73Å
478	E	78.1	Confident	76.6	Confident	164 Å²	164	61 Å²	61	77%	0.766	32%	0.323	S	S	*	.	S	Bend	trans	-78.5	-29.1	178.7	-64.8	-171.9	157.2	0	0	113.1
479	S	79.4	Confident	76.8	Confident	28 Å²	28	63.1 Å²	63.1	20%	0.196	33%	0.33	C	S	.	.			trans	-144.2	140.5	-176.1	179.5	0	0	0	0	111.4	E481 Q482	S479-E481 PolarHBondContact O-N 3.19Å; S479-E481 VanDerWaalsContact O-N 3.11Å; S479-E481 WeakPolarHBondContact OG-CB 3.39Å; S479-E481 WeakPolarHBondContact OG-CG 3.29Å; S479-E481 PolarHBondContact OG-N 2.91Å; S479-E481 PolarHBondContact OG-OE2 2.89Å; S479-Q482 WeakPolarHBondContact O-CB 3.27Å; S479-Q482 PolarHBondContact O-N 2.97Å
480	W	83.7	Confident	77.1	Confident	8 Å²	8	61.5 Å²	61.5	3%	0.03	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-56.6	-25	172.7	63	-96.1	0	0	0	112.8	Q482 I483 V484 M490 Q495 Q498 S499 W502	W480-Q482 PolarHBondContact O-N 3.39Å; W480-I483 PolarHBondContact O-N 3.29Å; W480-V484 HydrophobicContact CE3-CB 3.81Å; W480-V484 HydrophobicContact CE3-CG1 4.44Å; W480-V484 HydrophobicContact CE3-CG2 3.81Å; W480-V484 HydrophobicContact CZ3-CB 4.08Å; W480-V484 HydrophobicContact CZ3-CG1 4.31Å; W480-V484 HydrophobicContact CZ3-CG2 4.49Å; W480-V484 WeakPolarHBondContact O-CG2 3.16Å; W480-V484 PolarHBondContact O-N 2.9Å; W480-M490 HydrophobicContact CZ3-SD 4.1Å; W480-Q495 HydrophobicContact CH2-CB 4.37Å; W480-Q495 HydrophobicContact CH2-CG 4.03Å; W480-Q495 HydrophobicContact CZ2-CB 4.16Å; W480-Q495 HydrophobicContact CZ2-CG 4.29Å; W480-Q498 HydrophobicContact CD2-CB 3.46Å; W480-Q498 VanDerWaalsContact CD2-CB 3.46Å; W480-Q498 HydrophobicContact CD2-CG 4.16Å; W480-Q498 HydrophobicContact CE3-CB 3.7Å; W480-Q498 HydrophobicContact CE3-CG 3.86Å; W480-Q498 HydrophobicContact CG-CB 3.91Å; W480-Q498 HydrophobicContact CH2-CB 4.24Å; W480-Q498 HydrophobicContact CH2-CG 4.28Å; W480-Q498 HydrophobicContact CZ2-CB 3.99Å; W480-Q498 HydrophobicContact CZ3-CB 4.08Å; W480-Q498 HydrophobicContact CZ3-CG 3.92Å; W480-S499 PolarHBondContact NE1-OG 3.34Å; W480-W502 HydrophobicContact CB-CB 4Å; W480-W502 HydrophobicContact CB-CD2 3.68Å; W480-W502 HydrophobicContact CB-CE3 3.85Å; W480-W502 HydrophobicContact CB-CG 3.76Å; W480-W502 HydrophobicContact CG-CB 4.3Å; W480-W502 HydrophobicContact CG-CG 4.33Å
481	E	82.3	Confident	77.3	Confident	109 Å²	109	65.2 Å²	65.2	51%	0.509	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-61.9	-21.3	177.6	-62.8	173	147.8	0	0	113.1	S479 I483	S479-E481 PolarHBondContact O-N 3.19Å; S479-E481 VanDerWaalsContact O-N 3.11Å; S479-E481 WeakPolarHBondContact OG-CB 3.39Å; S479-E481 WeakPolarHBondContact OG-CG 3.29Å; S479-E481 PolarHBondContact OG-N 2.91Å; S479-E481 PolarHBondContact OG-OE2 2.89Å; E481-I483 VanDerWaalsContact C-N 3.33Å
482	Q	79.1	Confident	77.7	Confident	126 Å²	126	71 Å²	71	59%	0.589	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-76.1	-20.8	176	-61.2	-179.3	0.2	0	0	112.6	E477 S479 W480	E477-Q482 HydrophobicContact CB-CB 4.49Å; S479-Q482 WeakPolarHBondContact O-CB 3.27Å; S479-Q482 PolarHBondContact O-N 2.97Å; W480-Q482 PolarHBondContact O-N 3.39Å
483	I	77.8	Confident	77.9	Confident	13 Å²	13	72.3 Å²	72.3	7%	0.067	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-47	-178.8	-48.1	179.9	0	0	0	111	E477 W480 E481 K485 W502 L565 I568 R569 G572	E477-I483 HydrophobicContact CG-CD1 4.29Å; E477-I483 HydrophobicContact CG-CG1 4.16Å; W480-I483 PolarHBondContact O-N 3.29Å; E481-I483 VanDerWaalsContact C-N 3.33Å; I483-K485 PolarHBondContact O-N 2.89Å; I483-W502 HydrophobicContact CD1-CH2 3.53Å; I483-W502 HydrophobicContact CD1-CZ3 3.68Å; I483-L565 HydrophobicContact CD1-CD1 4.01Å; I483-I568 HydrophobicContact CG2-CG2 4Å; I483-R569 HydrophobicContact CD1-CG 4.07Å; I483-R569 HydrophobicContact CG2-CB 4.4Å; I483-R569 HydrophobicContact CG2-CG 3.96Å; I483-G572 WeakPolarHBondContact O-CA 3.26Å
484	V	79.4	Confident	78.1	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	37%	0.371	C	S	.	.			trans	-78.3	96.7	-174.6	-175.6	0	0	0	0	109.8	W480 S486 S487 M490 G572 D573 A574 F575	W480-V484 HydrophobicContact CE3-CB 3.81Å; W480-V484 HydrophobicContact CE3-CG1 4.44Å; W480-V484 HydrophobicContact CE3-CG2 3.81Å; W480-V484 HydrophobicContact CZ3-CB 4.08Å; W480-V484 HydrophobicContact CZ3-CG1 4.31Å; W480-V484 HydrophobicContact CZ3-CG2 4.49Å; W480-V484 WeakPolarHBondContact O-CG2 3.16Å; W480-V484 PolarHBondContact O-N 2.9Å; V484-S486 PolarHBondContact O-N 3Å; V484-S487 VanDerWaalsContact O-CB 3.28Å; V484-S487 WeakPolarHBondContact O-CB 3.11Å; V484-S487 PolarHBondContact O-N 3.33Å; V484-S487 PolarHBondContact O-OG 3.47Å; V484-M490 HydrophobicContact CG1-SD 3.82Å; V484-G572 WeakPolarHBondContact CA-O 3.31Å; V484-D573 WeakPolarHBondContact CG2-O 3.05Å; V484-A574 HydrophobicContact CG1-CB 4.18Å; V484-F575 HydrophobicContact CG2-CD2 4.16Å; V484-F575 HydrophobicContact CG2-CE2 4.26Å
485	K	73.6	Confident	78.3	Confident	146 Å²	146	77.8 Å²	77.8	64%	0.635	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.2	-179.6	-62.2	167.7	-167.8	161	0	112.3	I483 R570 N571 G572	I483-K485 PolarHBondContact O-N 2.89Å; K485-R570 PolarHBondContact NZ-O 2.8Å; K485-N571 PolarHBondContact NZ-O 3.29Å; K485-G572 PolarHBondContact N-O 3.31Å
486	S	69	Low	78.6	Confident	50 Å²	50	78.1 Å²	78.1	35%	0.35	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-5.2	178.4	-52.8	0	0	0	0	115.4	V484 S488 K489 M490	V484-S486 PolarHBondContact O-N 3Å; S486-S488 PolarHBondContact O-N 3.24Å; S486-K489 PolarHBondContact O-N 3.36Å; S486-M490 WeakPolarHBondContact O-CG 3.35Å
487	S	62.6	Low	78.9	Confident	26 Å²	26	78.2 Å²	78.2	18%	0.182	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-44.8	-41.2	-171.2	55.8	0	0	0	0	115.5	V484 K489 Q495	V484-S487 VanDerWaalsContact O-CB 3.28Å; V484-S487 WeakPolarHBondContact O-CB 3.11Å; V484-S487 PolarHBondContact O-N 3.33Å; V484-S487 PolarHBondContact O-OG 3.47Å; S487-K489 VanDerWaalsContact C-N 3.32Å; S487-K489 PolarHBondContact O-N 3.05Å; S487-Q495 PolarHBondContact O-NE2 3.11Å
488	S	63.5	Low	79.1	Confident	106 Å²	106	76.8 Å²	76.8	74%	0.741	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-70.7	-16.8	179.5	58.3	0	0	0	0	115.6	S486	S486-S488 PolarHBondContact O-N 3.24Å
489	K	75	Confident	79.7	Confident	186 Å²	186	71.8 Å²	71.8	81%	0.809	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-105	-7	-178.5	-63.6	-177.3	-179.4	177.8	0	113.8	S486 S487	S486-K489 PolarHBondContact O-N 3.36Å; S487-K489 VanDerWaalsContact C-N 3.32Å; S487-K489 PolarHBondContact O-N 3.05Å
490	M	78	Confident	80.2	Confident	25 Å²	25	70.6 Å²	70.6	12%	0.123	35%	0.352	C	S	.	.	S	Bend	trans	-80.9	146.8	-171.7	-67.4	172.1	77.5	0	0	112.5	W480 V484 S486 Q494 Q495 Q498 A574	W480-M490 HydrophobicContact CZ3-SD 4.1Å; V484-M490 HydrophobicContact CG1-SD 3.82Å; S486-M490 WeakPolarHBondContact O-CG 3.35Å; M490-Q494 HydrophobicContact CB-CB 4.1Å; M490-Q494 HydrophobicContact CE-CB 3.89Å; M490-Q495 HydrophobicContact CB-CG 3.95Å; M490-Q498 HydrophobicContact CE-CG 3.37Å; M490-Q498 HydrophobicContact SD-CG 4.3Å; M490-A574 HydrophobicContact CE-CB 3.58Å; M490-A574 HydrophobicContact SD-CB 4.3Å
491	T	83.2	Confident	80.4	Confident	77 Å²	77	70.2 Å²	70.2	47%	0.472	35%	0.351	S	S	.	.			trans	-68.9	157.3	176.4	75.6	0	0	0	0	111.3	Q493 Q494 Q495	T491-Q493 PolarHBondContact O-N 3.28Å; T491-Q494 WeakPolarHBondContact O-CB 3.47Å; T491-Q494 PolarHBondContact O-N 3.31Å; T491-Q494 WeakPolarHBondContact OG1-CG 3.32Å; T491-Q494 PolarHBondContact OG1-N 3.09Å; T491-Q495 WeakPolarHBondContact O-CG 3.24Å; T491-Q495 PolarHBondContact O-N 3.09Å
492	K	84.4	Confident	80.7	Confident	172 Å²	172	65.7 Å²	65.7	75%	0.748	33%	0.329	S	S	*	.	H	α-helix	trans	-58	-24	177.9	-69.1	-178	178.7	176.3	0	114	K496	K492-K496 WeakPolarHBondContact O-CG 3.32Å; K492-K496 PolarHBondContact O-N 2.97Å
493	Q	82	Confident	81.4	Confident	94 Å²	94	64.3 Å²	64.3	44%	0.439	32%	0.323	S	S	.	.	H	α-helix	trans	-79.6	-44.4	173.9	-175.9	168.3	-9.5	0	0	111.1	T491 Q495 K496 R497 C661	T491-Q493 PolarHBondContact O-N 3.28Å; Q493-Q495 VanDerWaalsContact C-N 3.34Å; Q493-Q495 PolarHBondContact O-N 3.43Å; Q493-K496 PolarHBondContact O-N 2.89Å; Q493-R497 PolarHBondContact O-N 3.36Å; Q493-C661 PolarHBondContact NE2-O 2.9Å
494	Q	82.3	Confident	82	Confident	72 Å²	72	63.7 Å²	63.7	34%	0.336	32%	0.32	S	S	.	.	H	α-helix	trans	-59.7	-42.9	173.1	-71	169.9	-24.3	0	0	111.8	M490 T491 K496 R497 Q498	M490-Q494 HydrophobicContact CB-CB 4.1Å; M490-Q494 HydrophobicContact CE-CB 3.89Å; T491-Q494 WeakPolarHBondContact O-CB 3.47Å; T491-Q494 PolarHBondContact O-N 3.31Å; T491-Q494 WeakPolarHBondContact OG1-CG 3.32Å; T491-Q494 PolarHBondContact OG1-N 3.09Å; Q494-K496 PolarHBondContact O-N 3.09Å; Q494-R497 WeakPolarHBondContact O-CA 3.42Å; Q494-R497 VanDerWaalsContact O-CB 3.31Å; Q494-R497 WeakPolarHBondContact O-CB 3.18Å; Q494-R497 PolarHBondContact O-N 2.62Å; Q494-R497 VanDerWaalsContact O-N 3.1Å; Q494-Q498 WeakPolarHBondContact O-CG 3.31Å; Q494-Q498 PolarHBondContact O-N 2.99Å
495	Q	86.5	Confident	82.5	Confident	63 Å²	63	63.7 Å²	63.7	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-59.7	-42.6	175	-69.7	-179	-28.7	0	0	112	W480 S487 M490 T491 Q493 Q498 S499	W480-Q495 HydrophobicContact CH2-CB 4.37Å; W480-Q495 HydrophobicContact CH2-CG 4.03Å; W480-Q495 HydrophobicContact CZ2-CB 4.16Å; W480-Q495 HydrophobicContact CZ2-CG 4.29Å; S487-Q495 PolarHBondContact O-NE2 3.11Å; M490-Q495 HydrophobicContact CB-CG 3.95Å; T491-Q495 WeakPolarHBondContact O-CG 3.24Å; T491-Q495 PolarHBondContact O-N 3.09Å; Q493-Q495 VanDerWaalsContact C-N 3.34Å; Q493-Q495 PolarHBondContact O-N 3.43Å; Q495-Q498 PolarHBondContact O-N 3.11Å; Q495-S499 PolarHBondContact O-N 2.82Å; Q495-S499 PolarHBondContact O-OG 3.22Å
496	K	86.5	Confident	83.3	Confident	128 Å²	128	61 Å²	61	56%	0.557	31%	0.306	S	S	*	.	H	α-helix	trans	-64.3	-38.6	172.1	-72	174.7	-179.9	-178.9	0	112.6	K492 Q493 Q494 Q498 S499 A500 N660	K492-K496 WeakPolarHBondContact O-CG 3.32Å; K492-K496 PolarHBondContact O-N 2.97Å; Q493-K496 PolarHBondContact O-N 2.89Å; Q494-K496 PolarHBondContact O-N 3.09Å; K496-Q498 VanDerWaalsContact C-N 3.33Å; K496-S499 PolarHBondContact O-N 3.48Å; K496-A500 WeakPolarHBondContact O-CB 3.44Å; K496-A500 PolarHBondContact O-N 3.35Å; K496-N660 HydrophobicContact CB-CB 4.32Å; K496-N660 WeakPolarHBondContact CB-OD1 3.31Å; K496-N660 VanDerWaalsContact CD-OD1 3.31Å; K496-N660 WeakPolarHBondContact CD-OD1 3.4Å
497	R	86.3	Confident	84.5	Confident	19 Å²	19	60.4 Å²	60.4	7%	0.072	30%	0.3	C	S	.	.	H	α-helix	trans	-59.3	-44.6	174.5	-160.7	-176.4	81.2	175.3	3.8	110.7	Q493 Q494 A500 I501 F575 P577 N660 E666	Q493-R497 PolarHBondContact O-N 3.36Å; Q494-R497 WeakPolarHBondContact O-CA 3.42Å; Q494-R497 VanDerWaalsContact O-CB 3.31Å; Q494-R497 WeakPolarHBondContact O-CB 3.18Å; Q494-R497 PolarHBondContact O-N 2.62Å; Q494-R497 VanDerWaalsContact O-N 3.1Å; R497-A500 PolarHBondContact O-N 2.91Å; R497-I501 HydrophobicContact CG-CD1 4.3Å; R497-I501 WeakPolarHBondContact O-CG1 3.48Å; R497-I501 PolarHBondContact O-N 3.22Å; R497-I501 VanDerWaalsContact O-N 3.1Å; R497-F575 PolarHBondContact NH2-O 2.93Å; R497-P577 HydrophobicContact CG-CG 4.31Å; R497-N660 HydrophobicContact CB-CB 4.14Å; R497-N660 WeakPolarHBondContact CG-O 3.36Å; R497-E666 IonicContact CZ-OE1 2.8Å; R497-E666 IonicContact CZ-OE2 2.69Å; R497-E666 IonicContact NH1-OE1 3.81Å; R497-E666 PolarHBondContact NH1-OE1 3.16Å; R497-E666 IonicContact NH1-OE2 2.75Å; R497-E666 PolarHBondContact NH1-OE2 3.01Å
498	Q	88.6	Confident	85.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-50	173.6	-60.3	-50.4	-84.7	0	0	111.4	W480 M490 Q494 Q495 K496 A500 I501 W502 F575	W480-Q498 HydrophobicContact CD2-CB 3.46Å; W480-Q498 VanDerWaalsContact CD2-CB 3.46Å; W480-Q498 HydrophobicContact CD2-CG 4.16Å; W480-Q498 HydrophobicContact CE3-CB 3.7Å; W480-Q498 HydrophobicContact CE3-CG 3.86Å; W480-Q498 HydrophobicContact CG-CB 3.91Å; W480-Q498 HydrophobicContact CH2-CB 4.24Å; W480-Q498 HydrophobicContact CH2-CG 4.28Å; W480-Q498 HydrophobicContact CZ2-CB 3.99Å; W480-Q498 HydrophobicContact CZ3-CB 4.08Å; W480-Q498 HydrophobicContact CZ3-CG 3.92Å; M490-Q498 HydrophobicContact CE-CG 3.37Å; M490-Q498 HydrophobicContact SD-CG 4.3Å; Q494-Q498 WeakPolarHBondContact O-CG 3.31Å; Q494-Q498 PolarHBondContact O-N 2.99Å; Q495-Q498 PolarHBondContact O-N 3.11Å; K496-Q498 VanDerWaalsContact C-N 3.33Å; Q498-A500 VanDerWaalsContact C-N 3.29Å; Q498-A500 PolarHBondContact O-N 3.14Å; Q498-I501 PolarHBondContact O-N 2.79Å; Q498-W502 VanDerWaalsContact O-CB 3.24Å; Q498-W502 WeakPolarHBondContact O-CB 3.46Å; Q498-W502 PolarHBondContact O-N 2.9Å; Q498-F575 PolarHBondContact NE2-O 2.98Å
499	S	90	Very high	87.3	Confident	59 Å²	59	54.1 Å²	54.1	41%	0.413	26%	0.256	S	S	.	.	H	α-helix	trans	-60.1	-35.4	179.1	-64.1	0	0	0	0	113.5	W480 Q495 K496 E503	W480-S499 PolarHBondContact NE1-OG 3.34Å; Q495-S499 PolarHBondContact O-N 2.82Å; Q495-S499 PolarHBondContact O-OG 3.22Å; K496-S499 PolarHBondContact O-N 3.48Å; S499-E503 WeakPolarHBondContact O-CB 3.45Å; S499-E503 PolarHBondContact O-N 3.27Å
500	A	89.7	Confident	88	Confident	4 Å²	4	48 Å²	48	3%	0.033	23%	0.233	C	C	.	.	H	α-helix	trans	-72	-40.6	177.5	0	0	0	0	0	112.8	K496 R497 Q498 E503 F504 I657	K496-A500 WeakPolarHBondContact O-CB 3.44Å; K496-A500 PolarHBondContact O-N 3.35Å; R497-A500 PolarHBondContact O-N 2.91Å; Q498-A500 VanDerWaalsContact C-N 3.29Å; Q498-A500 PolarHBondContact O-N 3.14Å; A500-E503 PolarHBondContact O-N 3.24Å; A500-F504 PolarHBondContact O-N 3.47Å; A500-I657 HydrophobicContact CB-CG1 3.87Å
501	I	88.7	Confident	88.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-42.4	172.6	-65.7	167.7	0	0	0	110.3	R497 Q498 E503 F504 I505 F575 P577 F580 I657	R497-I501 HydrophobicContact CG-CD1 4.3Å; R497-I501 WeakPolarHBondContact O-CG1 3.48Å; R497-I501 PolarHBondContact O-N 3.22Å; R497-I501 VanDerWaalsContact O-N 3.1Å; Q498-I501 PolarHBondContact O-N 2.79Å; I501-E503 PolarHBondContact O-N 2.92Å; I501-F504 WeakPolarHBondContact O-CB 3.42Å; I501-F504 PolarHBondContact O-N 3.24Å; I501-I505 HydrophobicContact CG2-CD1 4.1Å; I501-I505 PolarHBondContact O-N 2.71Å; I501-F575 HydrophobicContact CB-CB 4.37Å; I501-F575 HydrophobicContact CD1-CB 3.8Å; I501-F575 HydrophobicContact CG2-CB 3.87Å; I501-F575 HydrophobicContact CG2-CD1 3.8Å; I501-F575 HydrophobicContact CG2-CG 3.94Å; I501-P577 HydrophobicContact CD1-CG 4.19Å; I501-F580 HydrophobicContact CG2-CD2 4.35Å; I501-F580 HydrophobicContact CG2-CE2 3.47Å; I501-F580 VanDerWaalsContact CG2-CE2 3.47Å; I501-F580 HydrophobicContact CG2-CZ 3.9Å; I501-I657 HydrophobicContact CG1-CD1 4.05Å; I501-I657 HydrophobicContact CG1-CG1 4.1Å; I501-I657 HydrophobicContact CG1-CG2 4.36Å
502	W	89.6	Confident	89.2	Confident	14 Å²	14	44 Å²	44	5%	0.053	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-41.5	176.8	-166.9	-111.6	0	0	0	111.7	I476 E477 W480 I483 Q498 F504 I505 Y506 L565 F575	I476-W502 HydrophobicContact CG2-CH2 3.37Å; I476-W502 HydrophobicContact CG2-CZ2 3.39Å; I476-W502 HydrophobicContact CG2-CZ3 4.29Å; E477-W502 HydrophobicContact CB-CH2 4.17Å; E477-W502 HydrophobicContact CB-CZ2 3.97Å; E477-W502 WeakPolarHBondContact O-CZ2 2.96Å; W480-W502 HydrophobicContact CB-CB 4Å; W480-W502 HydrophobicContact CB-CD2 3.68Å; W480-W502 HydrophobicContact CB-CE3 3.85Å; W480-W502 HydrophobicContact CB-CG 3.76Å; W480-W502 HydrophobicContact CG-CB 4.3Å; W480-W502 HydrophobicContact CG-CG 4.33Å; I483-W502 HydrophobicContact CD1-CH2 3.53Å; I483-W502 HydrophobicContact CD1-CZ3 3.68Å; Q498-W502 VanDerWaalsContact O-CB 3.24Å; Q498-W502 WeakPolarHBondContact O-CB 3.46Å; Q498-W502 PolarHBondContact O-N 2.9Å; W502-F504 VanDerWaalsContact C-N 3.28Å; W502-F504 PolarHBondContact O-N 3.27Å; W502-I505 PolarHBondContact O-N 3.48Å; W502-Y506 WeakPolarHBondContact O-CB 3.46Å; W502-Y506 PolarHBondContact O-N 3.04Å; W502-L565 HydrophobicContact CH2-CD1 4.42Å; W502-L565 HydrophobicContact CZ3-CD1 3.94Å; W502-F575 HydrophobicContact CE3-CE2 4.08Å; W502-F575 HydrophobicContact CE3-CZ 4.06Å; W502-F575 HydrophobicContact CZ3-CE2 4.23Å; W502-F575 AromaticContact CZ3-CZ 3.96Å; W502-F575 HydrophobicContact CZ3-CZ 3.96Å
503	E	92	Very high	89.4	Confident	97 Å²	97	39.9 Å²	39.9	45%	0.453	19%	0.19	S	C	.	.	H	α-helix	trans	-58.3	-40.2	174.9	-169.9	174.9	-160.9	0	0	111.4	S499 A500 I501 T507 L653	S499-E503 WeakPolarHBondContact O-CB 3.45Å; S499-E503 PolarHBondContact O-N 3.27Å; A500-E503 PolarHBondContact O-N 3.24Å; I501-E503 PolarHBondContact O-N 2.92Å; E503-T507 HydrophobicContact CG-CG2 4.14Å; E503-T507 VanDerWaalsContact O-CB 3.23Å; E503-T507 WeakPolarHBondContact O-CB 3.43Å; E503-T507 WeakPolarHBondContact O-CG2 3.32Å; E503-T507 PolarHBondContact O-N 3.35Å; E503-T507 PolarHBondContact O-OG1 2.85Å; E503-L653 HydrophobicContact CB-CD2 4.21Å; E503-L653 HydrophobicContact CG-CD2 3.8Å
504	F	90.9	Very high	89.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.7	-54.5	174.9	168.5	-122.6	0	0	0	112.4	A500 I501 W502 T507 E508 L561 F580 I584 Y650 L653 M654	A500-F504 PolarHBondContact O-N 3.47Å; I501-F504 WeakPolarHBondContact O-CB 3.42Å; I501-F504 PolarHBondContact O-N 3.24Å; W502-F504 VanDerWaalsContact C-N 3.28Å; W502-F504 PolarHBondContact O-N 3.27Å; F504-T507 PolarHBondContact O-OG1 2.82Å; F504-E508 PolarHBondContact O-N 3.06Å; F504-L561 HydrophobicContact CE1-CD2 3.69Å; F504-L561 HydrophobicContact CZ-CD2 4.01Å; F504-F580 HydrophobicContact CD1-CD1 4.48Å; F504-F580 HydrophobicContact CE1-CB 4.44Å; F504-F580 AromaticContact CE1-CD1 3.91Å; F504-F580 HydrophobicContact CE1-CD1 3.91Å; F504-F580 HydrophobicContact CE1-CG 4.16Å; F504-I584 HydrophobicContact CZ-CD1 4.49Å; F504-Y650 HydrophobicContact CD2-CD1 4.31Å; F504-Y650 HydrophobicContact CD2-CE1 4.5Å; F504-Y650 AromaticContact CE2-CD1 3.88Å; F504-Y650 HydrophobicContact CE2-CD1 3.88Å; F504-Y650 AromaticContact CE2-CE1 3.98Å; F504-Y650 HydrophobicContact CE2-CE1 3.98Å; F504-L653 HydrophobicContact CD2-CD1 4.2Å; F504-M654 HydrophobicContact CB-CE 4.47Å; F504-M654 HydrophobicContact CD1-CE 4.16Å; F504-M654 HydrophobicContact CD2-CE 3.88Å; F504-M654 HydrophobicContact CE1-CE 4.35Å; F504-M654 HydrophobicContact CE2-CE 4.09Å; F504-M654 HydrophobicContact CG-CE 3.92Å; F504-M654 HydrophobicContact CZ-CE 4.32Å
505	I	90.6	Very high	90.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.3	-47.6	-178.2	-54.2	169.2	0	0	0	111.2	I476 I501 W502 T507 E508 A509 W557 L565 F575 F580	I476-I505 HydrophobicContact CD1-CG2 4.2Å; I476-I505 WeakPolarHBondContact CD1-O 3.28Å; I501-I505 HydrophobicContact CG2-CD1 4.1Å; I501-I505 PolarHBondContact O-N 2.71Å; W502-I505 PolarHBondContact O-N 3.48Å; I505-T507 PolarHBondContact O-N 3.39Å; I505-E508 WeakPolarHBondContact O-CB 3.4Å; I505-E508 PolarHBondContact O-N 3.22Å; I505-E508 VanDerWaalsContact O-N 3.09Å; I505-A509 PolarHBondContact O-N 3.36Å; I505-W557 HydrophobicContact CG2-CH2 3.8Å; I505-W557 HydrophobicContact CG2-CZ3 3.67Å; I505-L565 HydrophobicContact CG2-CD2 4.35Å; I505-F575 HydrophobicContact CD1-CD1 4.07Å; I505-F575 HydrophobicContact CD1-CE1 3.48Å; I505-F575 VanDerWaalsContact CD1-CE1 3.48Å; I505-F575 HydrophobicContact CD1-CZ 4.1Å; I505-F580 HydrophobicContact CD1-CE1 4.17Å; I505-F580 HydrophobicContact CD1-CZ 3.82Å; I505-F580 HydrophobicContact CG1-CE1 4.35Å; I505-F580 HydrophobicContact CG1-CZ 4.36Å
506	Y	90.9	Very high	90.4	Very high	89 Å²	89	32.8 Å²	32.8	35%	0.349	15%	0.153	S	C	.	.	H	α-helix	trans	-64.7	-39.1	-178.1	-178.3	-94	0	0	0	112.2	I476 W502 E508 N510	I476-Y506 HydrophobicContact CB-CD2 4.44Å; I476-Y506 HydrophobicContact CG2-CD2 4.06Å; W502-Y506 WeakPolarHBondContact O-CB 3.46Å; W502-Y506 PolarHBondContact O-N 3.04Å; Y506-E508 VanDerWaalsContact C-N 3.26Å; Y506-E508 PolarHBondContact O-N 3.12Å; Y506-N510 WeakPolarHBondContact CD1-ND2 3.11Å; Y506-N510 WeakPolarHBondContact CE1-ND2 3.46Å; Y506-N510 VanDerWaalsContact CZ-ND2 3.27Å; Y506-N510 WeakPolarHBondContact O-CB 3.5Å; Y506-N510 PolarHBondContact O-N 3.17Å; Y506-N510 PolarHBondContact O-ND2 3.02Å
507	T	93.4	Very high	90.5	Very high	38 Å²	38	27.8 Å²	27.8	23%	0.233	13%	0.134	C	C	.	.	H	α-helix	trans	-72.1	-20.8	174.5	57.8	0	0	0	0	112.8	E503 F504 I505 Y511 R646	E503-T507 HydrophobicContact CG-CG2 4.14Å; E503-T507 VanDerWaalsContact O-CB 3.23Å; E503-T507 WeakPolarHBondContact O-CB 3.43Å; E503-T507 WeakPolarHBondContact O-CG2 3.32Å; E503-T507 PolarHBondContact O-N 3.35Å; E503-T507 PolarHBondContact O-OG1 2.85Å; F504-T507 PolarHBondContact O-OG1 2.82Å; I505-T507 PolarHBondContact O-N 3.39Å; T507-Y511 VanDerWaalsContact O-CB 3.26Å; T507-Y511 WeakPolarHBondContact O-CB 3.24Å; T507-Y511 PolarHBondContact O-N 3.04Å; T507-R646 VanDerWaalsContact CB-NH1 3.32Å; T507-R646 PolarHBondContact OG1-NH1 2.67Å; T507-R646 PolarHBondContact OG1-NH2 3.3Å; T507-R646 VanDerWaalsContact OG1-NH2 3.17Å
508	E	93.1	Very high	90.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-74.6	-55.3	179.5	-166.7	53	-130.2	0	0	112.5	F504 I505 Y506 N510 Y511 I512 N553 W557 L561 R646 Y650	F504-E508 PolarHBondContact O-N 3.06Å; I505-E508 WeakPolarHBondContact O-CB 3.4Å; I505-E508 PolarHBondContact O-N 3.22Å; I505-E508 VanDerWaalsContact O-N 3.09Å; Y506-E508 VanDerWaalsContact C-N 3.26Å; Y506-E508 PolarHBondContact O-N 3.12Å; E508-N510 PolarHBondContact O-N 2.88Å; E508-Y511 CarbonylContact O-C 3.53Å; E508-Y511 WeakPolarHBondContact O-CA 3.49Å; E508-Y511 WeakPolarHBondContact O-CB 3.46Å; E508-Y511 PolarHBondContact O-N 2.74Å; E508-I512 HydrophobicContact CG-CD1 4.39Å; E508-I512 WeakPolarHBondContact O-CG1 3.28Å; E508-I512 PolarHBondContact O-N 2.87Å; E508-N553 PolarHBondContact OE1-OD1 3.35Å; E508-W557 HydrophobicContact CB-CE3 4.36Å; E508-W557 HydrophobicContact CG-CE3 4.26Å; E508-L561 HydrophobicContact CB-CD1 4.14Å; E508-L561 HydrophobicContact CG-CD1 3.79Å; E508-R646 IonicContact OE2-CZ 2.72Å; E508-R646 IonicContact OE2-NE 3.97Å; E508-R646 PolarHBondContact OE2-NE 3.12Å; E508-R646 VanDerWaalsContact OE2-NE 3.16Å; E508-R646 IonicContact OE2-NH2 3.63Å; E508-R646 PolarHBondContact OE2-NH2 2.97Å; E508-Y650 WeakPolarHBondContact OE2-CE1 3.32Å; E508-Y650 PolarHBondContact OE2-OH 3.2Å
509	A	91.4	Very high	90.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.9	-26.4	177.1	0	0	0	0	0	112.7	I476 I505 I512 K513 W557	I476-A509 HydrophobicContact CD1-CB 3.42Å; I476-A509 VanDerWaalsContact CD1-CB 3.42Å; I476-A509 HydrophobicContact CG1-CB 3.99Å; I505-A509 PolarHBondContact O-N 3.36Å; A509-I512 PolarHBondContact O-N 3Å; A509-K513 WeakPolarHBondContact O-CB 3.5Å; A509-K513 WeakPolarHBondContact O-CD 3.39Å; A509-K513 VanDerWaalsContact O-CG 3.22Å; A509-K513 WeakPolarHBondContact O-CG 3.33Å; A509-K513 PolarHBondContact O-N 2.65Å; A509-W557 HydrophobicContact CB-CE3 4.21Å; A509-W557 HydrophobicContact CB-CH2 3.93Å; A509-W557 HydrophobicContact CB-CZ2 4.19Å; A509-W557 HydrophobicContact CB-CZ3 3.89Å
510	N	90.3	Very high	90.6	Very high	58 Å²	58	25.6 Å²	25.6	31%	0.31	12%	0.119	S	C	.	.	H	α-helix	trans	-72.5	-30.7	170.8	-74.4	-48.7	0	0	0	112.7	Y506 E508 Y514	Y506-N510 WeakPolarHBondContact CD1-ND2 3.11Å; Y506-N510 WeakPolarHBondContact CE1-ND2 3.46Å; Y506-N510 VanDerWaalsContact CZ-ND2 3.27Å; Y506-N510 WeakPolarHBondContact O-CB 3.5Å; Y506-N510 PolarHBondContact O-N 3.17Å; Y506-N510 PolarHBondContact O-ND2 3.02Å; E508-N510 PolarHBondContact O-N 2.88Å; N510-Y514 VanDerWaalsContact O-CB 3.23Å; N510-Y514 WeakPolarHBondContact O-CB 3.42Å; N510-Y514 PolarHBondContact O-N 2.68Å
511	Y	92.6	Very high	90.4	Very high	15 Å²	15	28.9 Å²	28.9	6%	0.059	13%	0.131	C	C	.	.	H	α-helix	trans	-72	-33.9	169.3	176.9	-114.6	0	0	0	112.6	T507 E508 Y514 L515 N553 Y594 P643 R646	T507-Y511 VanDerWaalsContact O-CB 3.26Å; T507-Y511 WeakPolarHBondContact O-CB 3.24Å; T507-Y511 PolarHBondContact O-N 3.04Å; E508-Y511 CarbonylContact O-C 3.53Å; E508-Y511 WeakPolarHBondContact O-CA 3.49Å; E508-Y511 WeakPolarHBondContact O-CB 3.46Å; E508-Y511 PolarHBondContact O-N 2.74Å; Y511-Y514 HydrophobicContact CD2-CD1 4.21Å; Y511-Y514 HydrophobicContact CE2-CD1 4.27Å; Y511-Y514 WeakPolarHBondContact O-CB 3.32Å; Y511-Y514 PolarHBondContact O-N 3.06Å; Y511-L515 HydrophobicContact CD1-CD1 4.28Å; Y511-L515 HydrophobicContact CD2-CG 4.49Å; Y511-L515 HydrophobicContact CE1-CD1 3.66Å; Y511-L515 HydrophobicContact CE1-CG 4.19Å; Y511-L515 HydrophobicContact CE2-CD1 4.33Å; Y511-L515 HydrophobicContact CE2-CD2 4.11Å; Y511-L515 HydrophobicContact CE2-CG 3.98Å; Y511-L515 WeakPolarHBondContact O-CG 3.47Å; Y511-L515 PolarHBondContact O-N 2.71Å; Y511-N553 HydrophobicContact CE1-CB 4.47Å; Y511-N553 WeakPolarHBondContact CE1-OD1 3.32Å; Y511-Y594 PolarHBondContact OH-OH 3.31Å; Y511-P643 VanDerWaalsContact OH-CA 3.25Å; Y511-P643 WeakPolarHBondContact OH-CA 3.44Å; Y511-P643 VanDerWaalsContact OH-CB 3.3Å; Y511-P643 WeakPolarHBondContact OH-CB 3.17Å; Y511-P643 WeakPolarHBondContact OH-CG 3.19Å; Y511-R646 HydrophobicContact CD1-CB 4.48Å; Y511-R646 HydrophobicContact CD1-CG 3.68Å; Y511-R646 HydrophobicContact CD2-CB 4.14Å; Y511-R646 HydrophobicContact CD2-CG 4.08Å; Y511-R646 HydrophobicContact CE1-CB 4.21Å; Y511-R646 HydrophobicContact CE1-CG 3.7Å; Y511-R646 HydrophobicContact CE2-CB 3.89Å; Y511-R646 HydrophobicContact CE2-CG 4.14Å; Y511-R646 HydrophobicContact CG-CB 4.44Å; Y511-R646 HydrophobicContact CG-CG 3.87Å
512	I	92.7	Very high	90.4	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-67.8	-44.7	172	-64.5	170.1	0	0	0	110.6	F474 E508 A509 Y514 L515 R516 F550 N553 I554 W557	F474-I512 HydrophobicContact CD1-CD1 4.4Å; F474-I512 HydrophobicContact CD1-CG2 4.02Å; F474-I512 HydrophobicContact CE1-CD1 4.14Å; F474-I512 HydrophobicContact CE1-CG2 3.82Å; F474-I512 HydrophobicContact CZ-CG2 4.39Å; E508-I512 HydrophobicContact CG-CD1 4.39Å; E508-I512 WeakPolarHBondContact O-CG1 3.28Å; E508-I512 PolarHBondContact O-N 2.87Å; A509-I512 PolarHBondContact O-N 3Å; I512-Y514 VanDerWaalsContact C-N 3.28Å; I512-Y514 PolarHBondContact O-N 3.5Å; I512-L515 PolarHBondContact O-N 2.63Å; I512-R516 WeakPolarHBondContact O-CB 3.38Å; I512-R516 PolarHBondContact O-N 2.65Å; I512-F550 HydrophobicContact CG2-CD2 4.47Å; I512-F550 HydrophobicContact CG2-CE2 3.79Å; I512-F550 WeakPolarHBondContact O-CE2 3.15Å; I512-N553 HydrophobicContact CD1-CB 4.49Å; I512-N553 HydrophobicContact CG1-CB 4.1Å; I512-I554 HydrophobicContact CG2-CG1 4.16Å; I512-W557 HydrophobicContact CD1-CB 3.55Å; I512-W557 HydrophobicContact CD1-CD2 4.38Å; I512-W557 HydrophobicContact CD1-CG 3.95Å
513	K	89.4	Confident	90.4	Very high	84 Å²	84	28.6 Å²	28.6	37%	0.365	13%	0.13	S	C	.	.	H	α-helix	trans	-57.6	-42.3	170.9	-73	164.4	-170.1	169.3	0	111.5	F474 A509 R516 T517	F474-K513 WeakPolarHBondContact O-CE 3.48Å; F474-K513 PolarHBondContact O-NZ 2.89Å; A509-K513 WeakPolarHBondContact O-CB 3.5Å; A509-K513 WeakPolarHBondContact O-CD 3.39Å; A509-K513 VanDerWaalsContact O-CG 3.22Å; A509-K513 WeakPolarHBondContact O-CG 3.33Å; A509-K513 PolarHBondContact O-N 2.65Å; K513-R516 WeakPolarHBondContact O-CB 3.44Å; K513-R516 PolarHBondContact O-N 3.48Å; K513-T517 WeakPolarHBondContact O-CG2 3.39Å; K513-T517 PolarHBondContact O-N 3.5Å; K513-T517 VanDerWaalsContact O-N 3.09Å
514	Y	89.9	Confident	90.1	Very high	20 Å²	20	24.7 Å²	24.7	8%	0.078	11%	0.114	C	C	.	.	H	α-helix	trans	-58.1	-53	174.7	177.8	-89.2	0	0	0	112.3	N510 Y511 I512 R516 T517 I518 H632 Q639 K642	N510-Y514 VanDerWaalsContact O-CB 3.23Å; N510-Y514 WeakPolarHBondContact O-CB 3.42Å; N510-Y514 PolarHBondContact O-N 2.68Å; Y511-Y514 HydrophobicContact CD2-CD1 4.21Å; Y511-Y514 HydrophobicContact CE2-CD1 4.27Å; Y511-Y514 WeakPolarHBondContact O-CB 3.32Å; Y511-Y514 PolarHBondContact O-N 3.06Å; I512-Y514 VanDerWaalsContact C-N 3.28Å; I512-Y514 PolarHBondContact O-N 3.5Å; Y514-R516 VanDerWaalsContact C-N 3.29Å; Y514-R516 PolarHBondContact O-N 3.32Å; Y514-T517 PolarHBondContact O-N 3.15Å; Y514-T517 PolarHBondContact O-OG1 3.37Å; Y514-I518 HydrophobicContact CD1-CD1 4.37Å; Y514-I518 HydrophobicContact CE1-CD1 3.63Å; Y514-I518 HydrophobicContact CE1-CG1 4.36Å; Y514-I518 PolarHBondContact O-N 3.05Å; Y514-H632 AromaticContact CD2-CD2 3.51Å; Y514-H632 AromaticContact CD2-CE1 3.73Å; Y514-H632 AromaticContact CD2-NE2 3.28Å; Y514-H632 VanDerWaalsContact CD2-NE2 3.28Å; Y514-H632 WeakPolarHBondContact CD2-NE2 3.3Å; Y514-H632 AromaticContact CE2-CD2 3.58Å; Y514-H632 AromaticContact CE2-CG 3.8Å; Y514-H632 AromaticContact CE2-NE2 3.83Å; Y514-Q639 WeakPolarHBondContact OH-CA 3.27Å; Y514-Q639 WeakPolarHBondContact OH-CB 3.31Å; Y514-Q639 WeakPolarHBondContact OH-CG 3.44Å; Y514-Q639 PolarHBondContact OH-O 3.16Å; Y514-K642 HydrophobicContact CD1-CB 4.3Å; Y514-K642 HydrophobicContact CE1-CB 3.56Å; Y514-K642 HydrophobicContact CE1-CG 3.59Å; Y514-K642 HydrophobicContact CE2-CG 4.15Å; Y514-K642 WeakPolarHBondContact OH-CG 3.33Å
515	L	92	Very high	89.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.1	-39.5	176.2	-73.1	179.3	0	0	0	112.2	Y511 I512 T517 I518 I519 I546 I549 F550 P643	Y511-L515 HydrophobicContact CD1-CD1 4.28Å; Y511-L515 HydrophobicContact CD2-CG 4.49Å; Y511-L515 HydrophobicContact CE1-CD1 3.66Å; Y511-L515 HydrophobicContact CE1-CG 4.19Å; Y511-L515 HydrophobicContact CE2-CD1 4.33Å; Y511-L515 HydrophobicContact CE2-CD2 4.11Å; Y511-L515 HydrophobicContact CE2-CG 3.98Å; Y511-L515 WeakPolarHBondContact O-CG 3.47Å; Y511-L515 PolarHBondContact O-N 2.71Å; I512-L515 PolarHBondContact O-N 2.63Å; L515-T517 VanDerWaalsContact C-N 3.29Å; L515-T517 PolarHBondContact O-N 2.95Å; L515-I518 WeakPolarHBondContact O-CB 3.4Å; L515-I518 PolarHBondContact O-N 2.83Å; L515-I518 VanDerWaalsContact O-N 3.09Å; L515-I519 PolarHBondContact O-N 3.2Å; L515-I519 VanDerWaalsContact O-N 3.09Å; L515-I546 HydrophobicContact CD2-CD1 3.76Å; L515-I546 HydrophobicContact CD2-CG1 4.48Å; L515-I549 HydrophobicContact CD1-CG2 4.12Å; L515-I549 HydrophobicContact CD2-CG2 4.49Å; L515-F550 HydrophobicContact CB-CD2 3.54Å; L515-F550 HydrophobicContact CB-CE2 4.11Å; L515-F550 HydrophobicContact CB-CG 4.42Å; L515-F550 HydrophobicContact CD1-CB 4.31Å; L515-F550 HydrophobicContact CD1-CD2 4.09Å; L515-F550 HydrophobicContact CG-CD2 4.5Å; L515-P643 HydrophobicContact CD2-CG 4.32Å
516	R	90.9	Very high	89.7	Confident	60 Å²	60	25.1 Å²	25.1	23%	0.226	12%	0.117	C	C	.	.	H	α-helix	trans	-56.5	-40.3	173.2	171.2	164.9	-171.4	155.7	10.1	112.2	S392 S394 D395 I512 K513 Y514 I518 I519 D520 F550	S392-R516 PolarHBondContact OG-NH2 3.08Å; S394-R516 WeakPolarHBondContact OG-CD 3.32Å; S394-R516 WeakPolarHBondContact OG-CG 3.22Å; S394-R516 VanDerWaalsContact OG-CZ 3.25Å; S394-R516 PolarHBondContact OG-NE 2.63Å; S394-R516 PolarHBondContact OG-NH2 2.84Å; D395-R516 IonicContact OD1-CZ 2.71Å; D395-R516 IonicContact OD1-NH1 3.42Å; D395-R516 PolarHBondContact OD1-NH1 2.87Å; D395-R516 IonicContact OD1-NH2 2.68Å; D395-R516 PolarHBondContact OD1-NH2 2.69Å; D395-R516 IonicContact OD2-CZ 2.6Å; D395-R516 IonicContact OD2-NH1 3.17Å; D395-R516 IonicContact OD2-NH2 3.12Å; D395-R516 PolarHBondContact OD2-NH2 3.42Å; I512-R516 WeakPolarHBondContact O-CB 3.38Å; I512-R516 PolarHBondContact O-N 2.65Å; K513-R516 WeakPolarHBondContact O-CB 3.44Å; K513-R516 PolarHBondContact O-N 3.48Å; Y514-R516 VanDerWaalsContact C-N 3.29Å; Y514-R516 PolarHBondContact O-N 3.32Å; R516-I518 VanDerWaalsContact C-N 3.34Å; R516-I518 PolarHBondContact O-N 3.03Å; R516-I519 PolarHBondContact O-N 2.9Å; R516-D520 VanDerWaalsContact CG-OD2 3.23Å; R516-D520 WeakPolarHBondContact CG-OD2 3.48Å; R516-D520 IonicContact CZ-OD2 3.21Å; R516-D520 IonicContact NE-OD2 2.7Å; R516-D520 PolarHBondContact NE-OD2 2.7Å; R516-D520 IonicContact NH2-OD2 3.04Å; R516-D520 WeakPolarHBondContact O-CB 3.48Å; R516-D520 PolarHBondContact O-N 3Å; R516-F550 HydrophobicContact CB-CE2 4.03Å; R516-F550 HydrophobicContact CB-CZ 4.03Å
517	T	87.5	Confident	89.4	Confident	24 Å²	24	23.8 Å²	23.8	15%	0.147	12%	0.116	C	C	.	.	H	α-helix	trans	-64.5	-34.6	175.8	70.6	0	0	0	0	113.3	K513 Y514 L515 Y521	K513-T517 WeakPolarHBondContact O-CG2 3.39Å; K513-T517 PolarHBondContact O-N 3.5Å; K513-T517 VanDerWaalsContact O-N 3.09Å; Y514-T517 PolarHBondContact O-N 3.15Å; Y514-T517 PolarHBondContact O-OG1 3.37Å; L515-T517 VanDerWaalsContact C-N 3.29Å; L515-T517 PolarHBondContact O-N 2.95Å; T517-Y521 HydrophobicContact CG2-CE2 4.22Å; T517-Y521 WeakPolarHBondContact O-CB 3.46Å; T517-Y521 WeakPolarHBondContact O-CD2 3.39Å; T517-Y521 PolarHBondContact O-N 3.5Å; T517-Y521 VanDerWaalsContact O-N 3.08Å
518	I	89.8	Confident	88.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.7	-46.2	174.8	-61.8	178.1	0	0	0	109.9	Y514 L515 R516 Y522 L523 I546 L636 Q639 L640	Y514-I518 HydrophobicContact CD1-CD1 4.37Å; Y514-I518 HydrophobicContact CE1-CD1 3.63Å; Y514-I518 HydrophobicContact CE1-CG1 4.36Å; Y514-I518 PolarHBondContact O-N 3.05Å; L515-I518 WeakPolarHBondContact O-CB 3.4Å; L515-I518 PolarHBondContact O-N 2.83Å; L515-I518 VanDerWaalsContact O-N 3.09Å; R516-I518 VanDerWaalsContact C-N 3.34Å; R516-I518 PolarHBondContact O-N 3.03Å; I518-Y522 WeakPolarHBondContact O-CB 3.44Å; I518-Y522 PolarHBondContact O-N 3.04Å; I518-L523 PolarHBondContact O-N 3.41Å; I518-I546 HydrophobicContact CG2-CG1 4.45Å; I518-L636 HydrophobicContact CG2-CD1 4.33Å; I518-Q639 HydrophobicContact CD1-CB 4.07Å; I518-Q639 HydrophobicContact CG1-CB 4.41Å; I518-L640 HydrophobicContact CG2-CD2 4.38Å
519	I	90.7	Very high	88.2	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.12	C	C	.	.	I	π-helix	trans	-65.9	-50.4	-177.8	-69.4	170.6	0	0	0	111.2	L393 L397 L515 R516 L523 A524 F550	L393-I519 HydrophobicContact CB-CG2 3.94Å; L393-I519 HydrophobicContact CD2-CG2 3.89Å; L393-I519 HydrophobicContact CG-CG2 3.78Å; L397-I519 HydrophobicContact CD1-CD1 4.03Å; L397-I519 HydrophobicContact CD1-CG2 4.2Å; L515-I519 PolarHBondContact O-N 3.2Å; L515-I519 VanDerWaalsContact O-N 3.09Å; R516-I519 PolarHBondContact O-N 2.9Å; I519-L523 HydrophobicContact CG1-CD2 4.35Å; I519-L523 WeakPolarHBondContact O-CB 3.32Å; I519-L523 PolarHBondContact O-N 3.33Å; I519-A524 PolarHBondContact O-N 3.36Å; I519-F550 HydrophobicContact CD1-CB 3.56Å; I519-F550 HydrophobicContact CD1-CD1 3.3Å; I519-F550 HydrophobicContact CD1-CD2 4.1Å; I519-F550 HydrophobicContact CD1-CE1 3.89Å; I519-F550 HydrophobicContact CD1-CG 3.41Å; I519-F550 VanDerWaalsContact CD1-CG 3.41Å; I519-F550 HydrophobicContact CD1-CZ 4.49Å
520	D	87.2	Confident	87.6	Confident	32 Å²	32	28.9 Å²	28.9	17%	0.171	13%	0.133	C	C	.	.	I	π-helix	trans	-78.2	-27.3	-173	-66.9	-20.8	0	0	0	113.7	S392 S394 R516 P525	S392-D520 WeakPolarHBondContact CB-OD1 3.32Å; S392-D520 PolarHBondContact OG-OD2 3.1Å; S394-D520 VanDerWaalsContact CB-OD1 3.26Å; S394-D520 WeakPolarHBondContact CB-OD1 3.34Å; S394-D520 PolarHBondContact N-OD1 3.3Å; S394-D520 VanDerWaalsContact N-OD1 3.1Å; S394-D520 PolarHBondContact OG-OD1 3.44Å; S394-D520 PolarHBondContact OG-OD2 2.95Å; R516-D520 VanDerWaalsContact CG-OD2 3.23Å; R516-D520 WeakPolarHBondContact CG-OD2 3.48Å; R516-D520 IonicContact CZ-OD2 3.21Å; R516-D520 IonicContact NE-OD2 2.7Å; R516-D520 PolarHBondContact NE-OD2 2.7Å; R516-D520 IonicContact NH2-OD2 3.04Å; R516-D520 WeakPolarHBondContact O-CB 3.48Å; R516-D520 PolarHBondContact O-N 3Å; D520-P525 WeakPolarHBondContact O-CD 3.45Å
521	Y	85.5	Confident	86.7	Confident	72 Å²	72	33.8 Å²	33.8	28%	0.282	16%	0.155	S	C	.	.	I	π-helix	trans	-103	-20.2	-178.8	-59.6	-44.4	0	0	0	115.6	T517 Q628	T517-Y521 HydrophobicContact CG2-CE2 4.22Å; T517-Y521 WeakPolarHBondContact O-CB 3.46Å; T517-Y521 WeakPolarHBondContact O-CD2 3.39Å; T517-Y521 PolarHBondContact O-N 3.5Å; T517-Y521 VanDerWaalsContact O-N 3.08Å; Y521-Q628 HydrophobicContact CD1-CB 4.28Å; Y521-Q628 HydrophobicContact CG-CB 4.26Å
522	Y	89.2	Confident	85.6	Confident	6 Å²	6	34.5 Å²	34.5	2%	0.024	16%	0.161	C	C	.	.	I	π-helix	trans	-116.8	-51.1	176.5	-59.3	-98.5	0	0	0	112.6	I518 F526 F621 L622 A625 D626 L636 Q639	I518-Y522 WeakPolarHBondContact O-CB 3.44Å; I518-Y522 PolarHBondContact O-N 3.04Å; Y522-F526 WeakPolarHBondContact O-CB 3.47Å; Y522-F526 PolarHBondContact O-N 3.01Å; Y522-F621 WeakPolarHBondContact O-CZ 3.3Å; Y522-L622 HydrophobicContact CD1-CD2 4.36Å; Y522-A625 HydrophobicContact CD1-CB 3.3Å; Y522-A625 HydrophobicContact CE1-CB 3.36Å; Y522-A625 HydrophobicContact CG-CB 3.99Å; Y522-D626 WeakPolarHBondContact CE1-OD1 3.48Å; Y522-D626 WeakPolarHBondContact OH-CA 3.45Å; Y522-D626 PolarHBondContact OH-OD1 3.28Å; Y522-L636 HydrophobicContact CD1-CB 3.95Å; Y522-L636 HydrophobicContact CD1-CD1 3.85Å; Y522-L636 HydrophobicContact CD1-CD2 4.05Å; Y522-L636 HydrophobicContact CD1-CG 4.15Å; Y522-L636 HydrophobicContact CD2-CD1 4.2Å; Y522-L636 HydrophobicContact CE1-CB 3.65Å; Y522-L636 HydrophobicContact CE1-CD1 4.21Å; Y522-L636 HydrophobicContact CE1-CG 4.34Å; Y522-L636 HydrophobicContact CG-CD1 3.84Å; Y522-Q639 PolarHBondContact OH-NE2 2.83Å; Y522-Q639 VanDerWaalsContact OH-NE2 3.16Å
523	L	88.3	Confident	84.9	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.016	16%	0.163	C	C	.	.	I	π-helix	trans	-72.9	-52.5	-170.6	-175.5	56.7	0	0	0	112.7	L393 I518 I519 F526 L527 F543 I546 E547	L393-L523 HydrophobicContact CD2-CD2 4.42Å; L393-L523 HydrophobicContact CD2-CG 4.27Å; I518-L523 PolarHBondContact O-N 3.41Å; I519-L523 HydrophobicContact CG1-CD2 4.35Å; I519-L523 WeakPolarHBondContact O-CB 3.32Å; I519-L523 PolarHBondContact O-N 3.33Å; L523-F526 WeakPolarHBondContact O-CB 3.17Å; L523-F526 PolarHBondContact O-N 3.28Å; L523-F526 VanDerWaalsContact O-N 3.12Å; L523-L527 HydrophobicContact CD1-CD1 4.03Å; L523-L527 HydrophobicContact CD1-CG 4.06Å; L523-L527 HydrophobicContact CG-CD1 3.9Å; L523-L527 HydrophobicContact CG-CG 4.37Å; L523-L527 WeakPolarHBondContact O-CG 3.49Å; L523-L527 PolarHBondContact O-N 3.44Å; L523-F543 HydrophobicContact CD1-CB 4.43Å; L523-F543 HydrophobicContact CD1-CD1 4.45Å; L523-F543 HydrophobicContact CD1-CD2 3.55Å; L523-F543 HydrophobicContact CD1-CE2 3.82Å; L523-F543 HydrophobicContact CD1-CG 3.89Å; L523-F543 HydrophobicContact CD1-CZ 4.39Å; L523-I546 HydrophobicContact CD2-CG2 3.89Å; L523-E547 HydrophobicContact CD2-CG 3.51Å; L523-E547 WeakPolarHBondContact CD2-OE1 3.4Å
524	A	87	Confident	84.4	Confident	14 Å²	14	31 Å²	31	12%	0.116	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-47.1	179.9	0	0	0	0	0	112.7	L393 I519 F526 L527 E528	L393-A524 HydrophobicContact CB-CB 3.78Å; L393-A524 HydrophobicContact CD2-CB 3.88Å; I519-A524 PolarHBondContact O-N 3.36Å; A524-F526 VanDerWaalsContact C-N 3.29Å; A524-F526 PolarHBondContact O-N 2.82Å; A524-L527 PolarHBondContact O-N 2.99Å; A524-E528 PolarHBondContact O-N 3.08Å; A524-E528 VanDerWaalsContact O-N 3.09Å
525	P	85.3	Confident	83.5	Confident	9 Å²	9	36 Å²	36	6%	0.058	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-32.9	172.2	-25.6	37.3	0	0	0	113.8	Y382 D520 I529 F621 W624	Y382-P525 HydrophobicContact CE1-CB 4.02Å; Y382-P525 HydrophobicContact CE1-CG 4.39Å; D520-P525 WeakPolarHBondContact O-CD 3.45Å; P525-I529 VanDerWaalsContact O-CB 3.31Å; P525-I529 WeakPolarHBondContact O-CB 3.28Å; P525-I529 VanDerWaalsContact O-CD1 3.25Å; P525-I529 WeakPolarHBondContact O-CD1 3.21Å; P525-I529 WeakPolarHBondContact O-CG1 3.34Å; P525-I529 PolarHBondContact O-N 3.25Å; P525-F621 HydrophobicContact CB-CE2 3.99Å; P525-F621 HydrophobicContact CB-CZ 4.32Å; P525-W624 HydrophobicContact CB-CH2 4.47Å; P525-W624 HydrophobicContact CB-CZ3 4.14Å; P525-W624 HydrophobicContact CG-CH2 4.43Å; P525-W624 HydrophobicContact CG-CZ3 4.36Å
526	F	87.5	Confident	82.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.1	-43	175	-179.3	-93.9	0	0	0	112	Y522 L523 A524 R530 F534 L537 T539 I542 F543 F618 F621	Y522-F526 WeakPolarHBondContact O-CB 3.47Å; Y522-F526 PolarHBondContact O-N 3.01Å; L523-F526 WeakPolarHBondContact O-CB 3.17Å; L523-F526 PolarHBondContact O-N 3.28Å; L523-F526 VanDerWaalsContact O-N 3.12Å; A524-F526 VanDerWaalsContact C-N 3.29Å; A524-F526 PolarHBondContact O-N 2.82Å; F526-R530 HydrophobicContact CE1-CG 4.26Å; F526-R530 WeakPolarHBondContact O-CA 3.36Å; F526-R530 WeakPolarHBondContact O-CB 3.48Å; F526-R530 PolarHBondContact O-N 2.9Å; F526-F534 AromaticContact CD2-CD2 3.7Å; F526-F534 HydrophobicContact CD2-CD2 3.7Å; F526-F534 HydrophobicContact CD2-CE2 4.13Å; F526-F534 HydrophobicContact CD2-CG 4.31Å; F526-F534 HydrophobicContact CE2-CB 3.77Å; F526-F534 AromaticContact CE2-CD2 3.6Å; F526-F534 HydrophobicContact CE2-CD2 3.6Å; F526-F534 HydrophobicContact CE2-CE2 4.33Å; F526-F534 AromaticContact CE2-CG 3.73Å; F526-F534 HydrophobicContact CE2-CG 3.73Å; F526-F534 HydrophobicContact CZ-CB 3.92Å; F526-F534 HydrophobicContact CZ-CD2 4.46Å; F526-F534 HydrophobicContact CZ-CG 4.39Å; F526-L537 HydrophobicContact CE2-CD1 4.24Å; F526-L537 HydrophobicContact CZ-CB 3.9Å; F526-L537 HydrophobicContact CZ-CD1 4.45Å; F526-T539 HydrophobicContact CD1-CG2 4.07Å; F526-T539 HydrophobicContact CE1-CG2 3.75Å; F526-I542 HydrophobicContact CE1-CD1 4.27Å; F526-I542 HydrophobicContact CE2-CD1 3.89Å; F526-I542 HydrophobicContact CZ-CD1 3.56Å; F526-F543 HydrophobicContact CB-CE2 4.04Å; F526-F543 HydrophobicContact CB-CZ 4.08Å; F526-F543 AromaticContact CD1-CE2 3.76Å; F526-F543 HydrophobicContact CD1-CE2 3.76Å; F526-F543 HydrophobicContact CE1-CE2 4.36Å; F526-F543 AromaticContact CG-CE2 3.84Å; F526-F543 HydrophobicContact CG-CE2 3.84Å; F526-F543 HydrophobicContact CG-CZ 4.26Å; F526-F618 HydrophobicContact CD2-CD2 4.4Å; F526-F618 AromaticContact CD2-CE2 3.96Å; F526-F618 HydrophobicContact CD2-CE2 3.96Å; F526-F618 HydrophobicContact CE2-CD2 4Å; F526-F618 AromaticContact CE2-CE2 3.65Å; F526-F618 HydrophobicContact CE2-CE2 3.65Å; F526-F621 HydrophobicContact CB-CE1 4.03Å; F526-F621 HydrophobicContact CB-CZ 3.84Å; F526-F621 HydrophobicContact CD2-CD1 4.43Å; F526-F621 AromaticContact CD2-CE1 3.97Å; F526-F621 HydrophobicContact CD2-CE1 3.97Å; F526-F621 HydrophobicContact CD2-CZ 4.5Å; F526-F621 HydrophobicContact CG-CE1 4.49Å
527	L	84	Confident	82	Confident	62 Å²	62	41 Å²	41	33%	0.325	20%	0.202	S	C	.	.	H	α-helix	trans	-63.6	-52.6	-178.4	-75.2	170.2	0	0	0	112.2	L393 L523 A524 I529 R530 T539	L393-L527 HydrophobicContact CD2-CD1 3.8Å; L523-L527 HydrophobicContact CD1-CD1 4.03Å; L523-L527 HydrophobicContact CD1-CG 4.06Å; L523-L527 HydrophobicContact CG-CD1 3.9Å; L523-L527 HydrophobicContact CG-CG 4.37Å; L523-L527 WeakPolarHBondContact O-CG 3.49Å; L523-L527 PolarHBondContact O-N 3.44Å; A524-L527 PolarHBondContact O-N 2.99Å; L527-I529 PolarHBondContact O-N 3.4Å; L527-R530 VanDerWaalsContact O-CB 3.25Å; L527-R530 WeakPolarHBondContact O-CB 3.4Å; L527-R530 PolarHBondContact O-N 3.22Å; L527-R530 VanDerWaalsContact O-N 3.17Å; L527-T539 HydrophobicContact CD2-CG2 3.57Å
528	E	80.5	Confident	81.5	Confident	69 Å²	69	42.8 Å²	42.8	32%	0.322	21%	0.211	S	C	.	.	H	α-helix	trans	-61.6	-33.3	-179.6	-69.8	-175.3	-121.6	0	0	112.1	T311 Y382 N386 A524	T311-E528 VanDerWaalsContact CB-O 3.27Å; T311-E528 WeakPolarHBondContact CB-O 3.25Å; T311-E528 WeakPolarHBondContact CG2-O 3.44Å; Y382-E528 HydrophobicContact CE2-CB 4.36Å; Y382-E528 VanDerWaalsContact OH-CB 3.27Å; Y382-E528 WeakPolarHBondContact OH-CB 3.3Å; Y382-E528 PolarHBondContact OH-OE1 3.3Å; Y382-E528 PolarHBondContact OH-OE2 3.19Å; N386-E528 VanDerWaalsContact ND2-CD 3.32Å; N386-E528 PolarHBondContact ND2-OE1 2.91Å; N386-E528 VanDerWaalsContact ND2-OE1 3.11Å; N386-E528 PolarHBondContact ND2-OE2 2.92Å; A524-E528 PolarHBondContact O-N 3.08Å; A524-E528 VanDerWaalsContact O-N 3.09Å
529	I	80	Confident	81	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	1	-176.1	-52.6	172.3	0	0	0	111.2	W378 F379 Y382 P525 L527 E531 S532 L533 F534	W378-I529 HydrophobicContact CH2-CB 4.38Å; W378-I529 HydrophobicContact CH2-CD1 3.57Å; W378-I529 HydrophobicContact CH2-CG1 3.76Å; W378-I529 HydrophobicContact CH2-CG2 3.69Å; W378-I529 HydrophobicContact CZ3-CD1 3.76Å; W378-I529 HydrophobicContact CZ3-CG1 4.34Å; W378-I529 HydrophobicContact CZ3-CG2 3.87Å; F379-I529 HydrophobicContact CD1-CD1 3.74Å; F379-I529 HydrophobicContact CE1-CD1 3.74Å; F379-I529 HydrophobicContact CE1-CG2 4.45Å; Y382-I529 HydrophobicContact CD1-CD1 4.16Å; Y382-I529 HydrophobicContact CD2-CD1 4.44Å; Y382-I529 HydrophobicContact CE1-CD1 4.04Å; Y382-I529 HydrophobicContact CE2-CD1 4.29Å; Y382-I529 HydrophobicContact CE2-CG1 4.3Å; Y382-I529 HydrophobicContact CG-CD1 4.37Å; P525-I529 VanDerWaalsContact O-CB 3.31Å; P525-I529 WeakPolarHBondContact O-CB 3.28Å; P525-I529 VanDerWaalsContact O-CD1 3.25Å; P525-I529 WeakPolarHBondContact O-CD1 3.21Å; P525-I529 WeakPolarHBondContact O-CG1 3.34Å; P525-I529 PolarHBondContact O-N 3.25Å; L527-I529 PolarHBondContact O-N 3.4Å; I529-E531 PolarHBondContact O-N 3.28Å; I529-S532 PolarHBondContact O-N 3.27Å; I529-S532 PolarHBondContact O-OG 3.47Å; I529-S532 VanDerWaalsContact O-OG 3.1Å; I529-L533 HydrophobicContact CG2-CB 4.19Å; I529-L533 HydrophobicContact CG2-CD1 3.68Å; I529-L533 HydrophobicContact CG2-CG 3.97Å; I529-L533 PolarHBondContact O-N 3Å; I529-F534 HydrophobicContact CG2-CE2 4.33Å
530	R	78.9	Confident	80.4	Confident	75 Å²	75	45.5 Å²	45.5	28%	0.283	23%	0.231	S	C	.	.	H	α-helix	trans	-62.9	-50.4	-171.4	-170.2	177.4	174.6	-132.5	-3.1	112.3	F526 L527 S532 F534 E535 L537	F526-R530 HydrophobicContact CE1-CG 4.26Å; F526-R530 WeakPolarHBondContact O-CA 3.36Å; F526-R530 WeakPolarHBondContact O-CB 3.48Å; F526-R530 PolarHBondContact O-N 2.9Å; L527-R530 VanDerWaalsContact O-CB 3.25Å; L527-R530 WeakPolarHBondContact O-CB 3.4Å; L527-R530 PolarHBondContact O-N 3.22Å; L527-R530 VanDerWaalsContact O-N 3.17Å; R530-S532 VanDerWaalsContact C-N 3.27Å; R530-S532 PolarHBondContact O-N 3.48Å; R530-F534 HydrophobicContact CG-CB 4.33Å; R530-F534 CarbonylContact O-C 3.56Å; R530-F534 VanDerWaalsContact O-CA 3.27Å; R530-F534 WeakPolarHBondContact O-CA 3.15Å; R530-F534 PolarHBondContact O-N 2.96Å; R530-E535 PolarHBondContact O-N 3.16Å; R530-L537 PolarHBondContact NE-O 2.9Å; R530-L537 PolarHBondContact NH2-O 3.49Å
531	E	71	Confident	80.1	Confident	162 Å²	162	48.4 Å²	48.4	76%	0.757	24%	0.239	S	C	*	.	H	α-helix	trans	-63	-35.8	-176.7	-62.9	179.6	-161.4	0	0	112.1	K346 I529	K346-E531 VanDerWaalsContact CE-O 3.29Å; K346-E531 WeakPolarHBondContact CE-O 3.34Å; K346-E531 PolarHBondContact NZ-O 3.1Å; I529-E531 PolarHBondContact O-N 3.28Å
532	S	71.5	Confident	80	Confident	29 Å²	29	45 Å²	45	20%	0.203	23%	0.226	C	C	.	.	H	α-helix	trans	-84.1	-28	-173.9	70.4	0	0	0	0	114.1	T311 P313 K346 I529 R530	T311-S532 WeakPolarHBondContact O-CB 3.31Å; T311-S532 PolarHBondContact O-OG 2.9Å; P313-S532 VanDerWaalsContact CD-OG 3.3Å; P313-S532 WeakPolarHBondContact CD-OG 3.48Å; K346-S532 VanDerWaalsContact CE-C 3.46Å; K346-S532 WeakPolarHBondContact CE-O 3.38Å; K346-S532 WeakPolarHBondContact CG-O 3.49Å; I529-S532 PolarHBondContact O-N 3.27Å; I529-S532 PolarHBondContact O-OG 3.47Å; I529-S532 VanDerWaalsContact O-OG 3.1Å; R530-S532 VanDerWaalsContact C-N 3.27Å; R530-S532 PolarHBondContact O-N 3.48Å
533	L	76.5	Confident	79.9	Confident	11 Å²	11	44.8 Å²	44.8	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-123.9	-33.7	178.5	-72.6	-177.2	0	0	0	116.1	P313 L375 F379 I529	P313-L533 HydrophobicContact CB-CD1 4.11Å; P313-L533 HydrophobicContact CB-CD2 4.27Å; P313-L533 HydrophobicContact CB-CG 4.22Å; P313-L533 HydrophobicContact CG-CD1 4.22Å; P313-L533 HydrophobicContact CG-CD2 3.67Å; P313-L533 HydrophobicContact CG-CG 3.77Å; L375-L533 HydrophobicContact CD1-CD1 3.9Å; F379-L533 HydrophobicContact CZ-CD1 4.44Å; I529-L533 HydrophobicContact CG2-CB 4.19Å; I529-L533 HydrophobicContact CG2-CD1 3.68Å; I529-L533 HydrophobicContact CG2-CG 3.97Å; I529-L533 PolarHBondContact O-N 3Å
534	F	80	Confident	79.8	Confident	3 Å²	3	45.5 Å²	45.5	1%	0.013	23%	0.233	C	C	.	.			trans	-125.3	24	-160.6	-51.2	-52.3	0	0	0	114.2	F526 I529 R530 N536 L537 N617 F618 F621	F526-F534 AromaticContact CD2-CD2 3.7Å; F526-F534 HydrophobicContact CD2-CD2 3.7Å; F526-F534 HydrophobicContact CD2-CE2 4.13Å; F526-F534 HydrophobicContact CD2-CG 4.31Å; F526-F534 HydrophobicContact CE2-CB 3.77Å; F526-F534 AromaticContact CE2-CD2 3.6Å; F526-F534 HydrophobicContact CE2-CD2 3.6Å; F526-F534 HydrophobicContact CE2-CE2 4.33Å; F526-F534 AromaticContact CE2-CG 3.73Å; F526-F534 HydrophobicContact CE2-CG 3.73Å; F526-F534 HydrophobicContact CZ-CB 3.92Å; F526-F534 HydrophobicContact CZ-CD2 4.46Å; F526-F534 HydrophobicContact CZ-CG 4.39Å; I529-F534 HydrophobicContact CG2-CE2 4.33Å; R530-F534 HydrophobicContact CG-CB 4.33Å; R530-F534 CarbonylContact O-C 3.56Å; R530-F534 VanDerWaalsContact O-CA 3.27Å; R530-F534 WeakPolarHBondContact O-CA 3.15Å; R530-F534 PolarHBondContact O-N 2.96Å; F534-N536 PolarHBondContact O-N 3.15Å; F534-N536 VanDerWaalsContact O-N 3.11Å; F534-L537 HydrophobicContact CB-CB 4.2Å; F534-L537 HydrophobicContact CB-CD1 4.1Å; F534-L537 HydrophobicContact CB-CG 4.33Å; F534-L537 HydrophobicContact CD1-CD1 3.95Å; F534-L537 HydrophobicContact CG-CD1 4.27Å; F534-L537 WeakPolarHBondContact O-CA 3.35Å; F534-L537 WeakPolarHBondContact O-CB 3.43Å; F534-L537 PolarHBondContact O-N 3.46Å; F534-N617 HydrophobicContact CE1-CB 4.26Å; F534-F618 HydrophobicContact CD1-CB 4.32Å; F534-F618 HydrophobicContact CD1-CD2 4.37Å; F534-F618 HydrophobicContact CE1-CB 3.83Å; F534-F618 HydrophobicContact CE1-CD2 4.14Å; F534-F618 HydrophobicContact CE1-CG 4.48Å; F534-F618 HydrophobicContact CZ-CD2 4.36Å; F534-F621 HydrophobicContact CE2-CB 4.5Å; F534-F621 HydrophobicContact CE2-CG 4.28Å; F534-F621 HydrophobicContact CZ-CB 3.94Å; F534-F621 HydrophobicContact CZ-CG 4.2Å
535	E	70.7	Confident	79.9	Confident	125 Å²	125	45 Å²	45	58%	0.584	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.4	-39.5	177.5	179.1	-174	-165.5	0	0	113.9	K346 R530 L537	K346-E535 IonicContact NZ-OE2 3.63Å; K346-E535 PolarHBondContact NZ-OE2 3.09Å; R530-E535 PolarHBondContact O-N 3.16Å; E535-L537 VanDerWaalsContact C-N 3.26Å; E535-L537 PolarHBondContact O-N 2.8Å
536	N	73.4	Confident	80.2	Confident	143 Å²	143	44.7 Å²	44.7	77%	0.765	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-1.8	178.5	-63.6	-18	0	0	0	114.1	F534	F534-N536 PolarHBondContact O-N 3.15Å; F534-N536 VanDerWaalsContact O-N 3.11Å
537	L	78.5	Confident	80.4	Confident	22 Å²	22	47.4 Å²	47.4	12%	0.115	24%	0.239	C	C	.	.	S	Bend	trans	-104.1	135.2	179.9	-60.8	-175.1	0	0	0	110.7	F526 R530 F534 E535 I542 Y607 A611 F618	F526-L537 HydrophobicContact CE2-CD1 4.24Å; F526-L537 HydrophobicContact CZ-CB 3.9Å; F526-L537 HydrophobicContact CZ-CD1 4.45Å; R530-L537 PolarHBondContact NE-O 2.9Å; R530-L537 PolarHBondContact NH2-O 3.49Å; F534-L537 HydrophobicContact CB-CB 4.2Å; F534-L537 HydrophobicContact CB-CD1 4.1Å; F534-L537 HydrophobicContact CB-CG 4.33Å; F534-L537 HydrophobicContact CD1-CD1 3.95Å; F534-L537 HydrophobicContact CG-CD1 4.27Å; F534-L537 WeakPolarHBondContact O-CA 3.35Å; F534-L537 WeakPolarHBondContact O-CB 3.43Å; F534-L537 PolarHBondContact O-N 3.46Å; E535-L537 VanDerWaalsContact C-N 3.26Å; E535-L537 PolarHBondContact O-N 2.8Å; L537-I542 HydrophobicContact CB-CD1 4.02Å; L537-I542 HydrophobicContact CD1-CD1 4.25Å; L537-Y607 WeakPolarHBondContact CA-OH 3.42Å; L537-Y607 HydrophobicContact CD2-CE1 4.42Å; L537-A611 HydrophobicContact CD1-CB 4.41Å; L537-A611 HydrophobicContact CD2-CB 3.72Å; L537-F618 HydrophobicContact CD1-CB 4.17Å; L537-F618 HydrophobicContact CD1-CD1 4.18Å; L537-F618 HydrophobicContact CD1-CD2 3.8Å; L537-F618 HydrophobicContact CD1-CE2 4.22Å; L537-F618 HydrophobicContact CD1-CG 3.79Å
538	D	76.1	Confident	80.7	Confident	62 Å²	62	47.7 Å²	47.7	33%	0.332	24%	0.239	S	C	.	.			trans	-94.3	132.6	179.8	-170.1	-46.7	0	0	0	110.1	G540 W541 I542 Y607	D538-G540 PolarHBondContact OD1-N 3.01Å; D538-W541 HydrophobicContact CB-CB 4.2Å; D538-W541 HydrophobicContact CB-CG 4.37Å; D538-W541 VanDerWaalsContact CG-CD1 3.41Å; D538-W541 PolarHBondContact OD1-N 3.05Å; D538-I542 WeakPolarHBondContact O-CD1 3.35Å; D538-I542 WeakPolarHBondContact O-CG1 3.25Å; D538-I542 PolarHBondContact O-N 3.43Å; D538-Y607 PolarHBondContact N-OH 2.97Å
539	T	80.4	Confident	81.3	Confident	38 Å²	38	44.4 Å²	44.4	23%	0.233	22%	0.224	C	C	.	.	S	Bend	trans	-66.3	-45.7	179.8	42.6	0	0	0	0	111.6	F526 L527 W541 I542 F543	F526-T539 HydrophobicContact CD1-CG2 4.07Å; F526-T539 HydrophobicContact CE1-CG2 3.75Å; L527-T539 HydrophobicContact CD2-CG2 3.57Å; T539-W541 PolarHBondContact O-N 3.38Å; T539-I542 PolarHBondContact O-N 2.69Å; T539-I542 VanDerWaalsContact O-N 3.12Å; T539-F543 PolarHBondContact O-N 2.77Å
540	G	76.2	Confident	82	Confident	19 Å²	19	44.4 Å²	44.4	20%	0.196	22%	0.224	C	C	.	.	H	α-helix	trans	-66.1	-36.7	-178.8	0	0	0	0	0	112.3	D538 I542 G544 C604	D538-G540 PolarHBondContact OD1-N 3.01Å; G540-I542 VanDerWaalsContact C-N 3.28Å; G540-I542 PolarHBondContact O-N 3.42Å; G540-G544 WeakPolarHBondContact O-CA 3.38Å; G540-G544 PolarHBondContact O-N 2.87Å; G540-C604 PolarHBondContact O-SG 3.17Å
541	W	81.1	Confident	82.6	Confident	92 Å²	92	43.2 Å²	43.2	35%	0.348	22%	0.22	S	C	.	.	H	α-helix	trans	-78.4	-4.2	174.8	-63.6	116.2	0	0	0	114.7	D538 T539 R603 C604 Y607	D538-W541 HydrophobicContact CB-CB 4.2Å; D538-W541 HydrophobicContact CB-CG 4.37Å; D538-W541 VanDerWaalsContact CG-CD1 3.41Å; D538-W541 PolarHBondContact OD1-N 3.05Å; T539-W541 PolarHBondContact O-N 3.38Å; W541-R603 HydrophobicContact CE3-CB 4.06Å; W541-R603 HydrophobicContact CZ3-CB 3.62Å; W541-R603 HydrophobicContact CZ3-CG 4.37Å; W541-C604 WeakPolarHBondContact O-CA 3.48Å; W541-C604 WeakPolarHBondContact O-CB 3.14Å; W541-Y607 HydrophobicContact CB-CD1 3.53Å; W541-Y607 HydrophobicContact CB-CD2 3.93Å; W541-Y607 HydrophobicContact CB-CE1 3.82Å; W541-Y607 HydrophobicContact CB-CE2 4.2Å; W541-Y607 HydrophobicContact CB-CG 3.59Å; W541-Y607 HydrophobicContact CG-CD2 4.44Å; W541-Y607 HydrophobicContact CG-CG 4.49Å; W541-Y607 VanDerWaalsContact O-CD1 3.25Å; W541-Y607 WeakPolarHBondContact O-CD1 3.27Å
542	I	84.3	Confident	83.7	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-100.8	-54.8	170.6	-67.8	166.7	0	0	0	110.6	F526 L537 D538 T539 G540 Y607 F618 L636 L640	F526-I542 HydrophobicContact CE1-CD1 4.27Å; F526-I542 HydrophobicContact CE2-CD1 3.89Å; F526-I542 HydrophobicContact CZ-CD1 3.56Å; L537-I542 HydrophobicContact CB-CD1 4.02Å; L537-I542 HydrophobicContact CD1-CD1 4.25Å; D538-I542 WeakPolarHBondContact O-CD1 3.35Å; D538-I542 WeakPolarHBondContact O-CG1 3.25Å; D538-I542 PolarHBondContact O-N 3.43Å; T539-I542 PolarHBondContact O-N 2.69Å; T539-I542 VanDerWaalsContact O-N 3.12Å; G540-I542 VanDerWaalsContact C-N 3.28Å; G540-I542 PolarHBondContact O-N 3.42Å; I542-Y607 HydrophobicContact CD1-CE1 4.29Å; I542-Y607 HydrophobicContact CG1-CD1 3.93Å; I542-Y607 HydrophobicContact CG1-CE1 3.85Å; I542-F618 HydrophobicContact CD1-CE1 4.45Å; I542-F618 HydrophobicContact CD1-CE2 3.99Å; I542-F618 HydrophobicContact CD1-CZ 3.69Å; I542-F618 HydrophobicContact CG1-CZ 4.23Å; I542-F618 HydrophobicContact CG2-CZ 4.11Å; I542-L636 HydrophobicContact CG2-CD2 4.32Å; I542-L640 WeakPolarHBondContact O-CD1 3.26Å
543	F	87.6	Confident	84.7	Confident	3 Å²	3	34.4 Å²	34.4	1%	0.013	18%	0.177	C	C	.	.	H	α-helix	trans	-98.7	-16.5	-169.8	-62.9	-78.6	0	0	0	114	L523 F526 T539 I546 L636	L523-F543 HydrophobicContact CD1-CB 4.43Å; L523-F543 HydrophobicContact CD1-CD1 4.45Å; L523-F543 HydrophobicContact CD1-CD2 3.55Å; L523-F543 HydrophobicContact CD1-CE2 3.82Å; L523-F543 HydrophobicContact CD1-CG 3.89Å; L523-F543 HydrophobicContact CD1-CZ 4.39Å; F526-F543 HydrophobicContact CB-CE2 4.04Å; F526-F543 HydrophobicContact CB-CZ 4.08Å; F526-F543 AromaticContact CD1-CE2 3.76Å; F526-F543 HydrophobicContact CD1-CE2 3.76Å; F526-F543 HydrophobicContact CE1-CE2 4.36Å; F526-F543 AromaticContact CG-CE2 3.84Å; F526-F543 HydrophobicContact CG-CE2 3.84Å; F526-F543 HydrophobicContact CG-CZ 4.26Å; T539-F543 PolarHBondContact O-N 2.77Å; F543-I546 HydrophobicContact CB-CG2 3.92Å; F543-L636 HydrophobicContact CD1-CD1 4.26Å; F543-L636 HydrophobicContact CD1-CD2 4.36Å; F543-L636 HydrophobicContact CE1-CD1 3.93Å; F543-L636 HydrophobicContact CE1-CD2 3.68Å; F543-L636 HydrophobicContact CE1-CG 4.45Å; F543-L636 HydrophobicContact CZ-CD2 4.23Å
544	G	85.8	Confident	85.4	Confident	17 Å²	17	33.9 Å²	33.9	18%	0.175	17%	0.174	C	C	.	.			trans	66.4	-164.6	-166.1	0	0	0	0	0	111.6	G540 I546	G540-G544 WeakPolarHBondContact O-CA 3.38Å; G540-G544 PolarHBondContact O-N 2.87Å; G544-I546 PolarHBondContact O-N 3.12Å
545	N	88.5	Confident	85.9	Confident	5 Å²	5	35.9 Å²	35.9	3%	0.027	18%	0.183	C	C	.	.	S	Bend	trans	-80.6	51.5	174.8	59.4	-59.2	0	0	0	112.1	E547 E548 I549 V593 Y597	N545-E547 VanDerWaalsContact C-N 3.35Å; N545-E548 WeakPolarHBondContact CA-OE2 3.3Å; N545-E548 HydrophobicContact CB-CB 4.4Å; N545-E548 VanDerWaalsContact CB-CD 3.46Å; N545-E548 HydrophobicContact CB-CG 4.43Å; N545-E548 VanDerWaalsContact CB-OE1 3.32Å; N545-E548 WeakPolarHBondContact CB-OE1 3.37Å; N545-E548 WeakPolarHBondContact CB-OE2 3.31Å; N545-E548 PolarHBondContact O-N 3.23Å; N545-I549 WeakPolarHBondContact O-CG1 3.42Å; N545-I549 PolarHBondContact O-N 2.88Å; N545-I549 VanDerWaalsContact O-N 3.13Å; N545-V593 PolarHBondContact ND2-O 2.75Å; N545-Y597 WeakPolarHBondContact OD1-CA 3.25Å; N545-Y597 WeakPolarHBondContact OD1-CB 3.16Å; N545-Y597 PolarHBondContact OD1-N 2.94Å
546	I	90.9	Very high	86.9	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-71.6	-27.2	-173.2	-164.7	62.1	0	0	0	113.1	L515 I518 L523 F543 G544 I549 F550 Y597 L640 P643	L515-I546 HydrophobicContact CD2-CD1 3.76Å; L515-I546 HydrophobicContact CD2-CG1 4.48Å; I518-I546 HydrophobicContact CG2-CG1 4.45Å; L523-I546 HydrophobicContact CD2-CG2 3.89Å; F543-I546 HydrophobicContact CB-CG2 3.92Å; G544-I546 PolarHBondContact O-N 3.12Å; I546-I549 HydrophobicContact CD1-CB 4.42Å; I546-I549 HydrophobicContact CD1-CG2 4.39Å; I546-F550 WeakPolarHBondContact O-CB 3.32Å; I546-F550 PolarHBondContact O-N 3.06Å; I546-Y597 HydrophobicContact CB-CE2 4.37Å; I546-Y597 HydrophobicContact CD1-CE2 3.91Å; I546-L640 HydrophobicContact CD1-CD2 4.33Å; I546-L640 HydrophobicContact CG1-CD2 4.38Å; I546-P643 HydrophobicContact CD1-CG 4.08Å
547	E	92.1	Very high	87.7	Confident	58 Å²	58	23.1 Å²	23.1	27%	0.271	12%	0.119	S	C	.	.	H	α-helix	trans	-69.1	-41.7	175.9	-63.4	-175.1	-134.6	0	0	110.6	L397 L523 N545 F550 K551	L397-E547 HydrophobicContact CD1-CB 4.29Å; L397-E547 HydrophobicContact CD1-CG 4.16Å; L523-E547 HydrophobicContact CD2-CG 3.51Å; L523-E547 WeakPolarHBondContact CD2-OE1 3.4Å; N545-E547 VanDerWaalsContact C-N 3.35Å; E547-F550 WeakPolarHBondContact O-CB 3.3Å; E547-F550 PolarHBondContact O-N 3.08Å; E547-K551 WeakPolarHBondContact O-CG 3.37Å; E547-K551 PolarHBondContact O-N 3.29Å
548	E	90.7	Very high	88.1	Confident	68 Å²	68	22.1 Å²	22.1	32%	0.318	11%	0.113	S	C	.	.	H	α-helix	trans	-68	-37.6	177.2	-55.2	96.1	124.2	0	0	111.3	N545 A552 V593	N545-E548 WeakPolarHBondContact CA-OE2 3.3Å; N545-E548 HydrophobicContact CB-CB 4.4Å; N545-E548 VanDerWaalsContact CB-CD 3.46Å; N545-E548 HydrophobicContact CB-CG 4.43Å; N545-E548 VanDerWaalsContact CB-OE1 3.32Å; N545-E548 WeakPolarHBondContact CB-OE1 3.37Å; N545-E548 WeakPolarHBondContact CB-OE2 3.31Å; N545-E548 PolarHBondContact O-N 3.23Å; E548-A552 VanDerWaalsContact O-CB 3.31Å; E548-A552 WeakPolarHBondContact O-CB 3.38Å; E548-A552 PolarHBondContact O-N 3.29Å; E548-V593 HydrophobicContact CB-CG1 4.27Å
549	I	93.4	Very high	88.5	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.5	-44.9	169.4	-65.7	-76.5	0	0	0	110.5	L515 N545 I546 A552 N553 V593 Y594 Y597 P643	L515-I549 HydrophobicContact CD1-CG2 4.12Å; L515-I549 HydrophobicContact CD2-CG2 4.49Å; N545-I549 WeakPolarHBondContact O-CG1 3.42Å; N545-I549 PolarHBondContact O-N 2.88Å; N545-I549 VanDerWaalsContact O-N 3.13Å; I546-I549 HydrophobicContact CD1-CB 4.42Å; I546-I549 HydrophobicContact CD1-CG2 4.39Å; I549-A552 PolarHBondContact O-N 3.45Å; I549-N553 PolarHBondContact O-N 3.33Å; I549-N553 VanDerWaalsContact O-N 3.13Å; I549-N553 PolarHBondContact O-ND2 3.24Å; I549-V593 HydrophobicContact CD1-CG2 4.05Å; I549-Y594 HydrophobicContact CD1-CD1 3.78Å; I549-Y594 HydrophobicContact CD1-CD2 3.38Å; I549-Y594 HydrophobicContact CD1-CE1 3.91Å; I549-Y594 HydrophobicContact CD1-CE2 3.54Å; I549-Y594 HydrophobicContact CD1-CG 3.52Å; I549-Y594 HydrophobicContact CG2-CE1 4.39Å; I549-Y594 HydrophobicContact CG2-CE2 4.21Å; I549-Y597 HydrophobicContact CD1-CD2 4.4Å; I549-Y597 HydrophobicContact CD1-CG 4.18Å; I549-Y597 HydrophobicContact CG1-CD2 3.86Å; I549-Y597 HydrophobicContact CG1-CG 4.14Å; I549-P643 HydrophobicContact CG2-CB 4.45Å
550	F	94.3	Very high	88.7	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.8	-48.2	177.2	-178	-122.1	0	0	0	112	L397 I398 I512 L515 R516 I519 I546 E547 A552 N553 I554	L397-F550 HydrophobicContact CB-CD1 4.07Å; L397-F550 HydrophobicContact CB-CE1 4.11Å; L397-F550 HydrophobicContact CD1-CD1 3.98Å; L397-F550 HydrophobicContact CD1-CE1 4.37Å; I398-F550 HydrophobicContact CD1-CZ 4.16Å; I398-F550 HydrophobicContact CG1-CE1 4.23Å; I398-F550 HydrophobicContact CG1-CZ 4.19Å; I512-F550 HydrophobicContact CG2-CD2 4.47Å; I512-F550 HydrophobicContact CG2-CE2 3.79Å; I512-F550 WeakPolarHBondContact O-CE2 3.15Å; L515-F550 HydrophobicContact CB-CD2 3.54Å; L515-F550 HydrophobicContact CB-CE2 4.11Å; L515-F550 HydrophobicContact CB-CG 4.42Å; L515-F550 HydrophobicContact CD1-CB 4.31Å; L515-F550 HydrophobicContact CD1-CD2 4.09Å; L515-F550 HydrophobicContact CG-CD2 4.5Å; R516-F550 HydrophobicContact CB-CE2 4.03Å; R516-F550 HydrophobicContact CB-CZ 4.03Å; I519-F550 HydrophobicContact CD1-CB 3.56Å; I519-F550 HydrophobicContact CD1-CD1 3.3Å; I519-F550 HydrophobicContact CD1-CD2 4.1Å; I519-F550 HydrophobicContact CD1-CE1 3.89Å; I519-F550 HydrophobicContact CD1-CG 3.41Å; I519-F550 VanDerWaalsContact CD1-CG 3.41Å; I519-F550 HydrophobicContact CD1-CZ 4.49Å; I546-F550 WeakPolarHBondContact O-CB 3.32Å; I546-F550 PolarHBondContact O-N 3.06Å; E547-F550 WeakPolarHBondContact O-CB 3.3Å; E547-F550 PolarHBondContact O-N 3.08Å; F550-A552 VanDerWaalsContact C-N 3.29Å; F550-A552 PolarHBondContact O-N 3.09Å; F550-N553 PolarHBondContact O-N 3.34Å; F550-I554 HydrophobicContact CD1-CD1 3.54Å; F550-I554 HydrophobicContact CD2-CD1 3.99Å; F550-I554 HydrophobicContact CD2-CG1 4.43Å; F550-I554 HydrophobicContact CE1-CD1 3.4Å; F550-I554 VanDerWaalsContact CE1-CD1 3.4Å; F550-I554 HydrophobicContact CE2-CD1 3.87Å; F550-I554 HydrophobicContact CE2-CG1 4.34Å; F550-I554 HydrophobicContact CG-CD1 3.86Å; F550-I554 HydrophobicContact CZ-CD1 3.59Å; F550-I554 HydrophobicContact CZ-CG1 4.45Å; F550-I554 WeakPolarHBondContact O-CD1 3.4Å; F550-I554 WeakPolarHBondContact O-CG1 3.41Å; F550-I554 PolarHBondContact O-N 2.86Å
551	K	92.1	Very high	89.2	Confident	49 Å²	49	21.9 Å²	21.9	21%	0.213	10%	0.101	C	C	.	.	H	α-helix	trans	-57.2	-39.7	174.1	-70.6	-163.6	177.1	-169	0	112	D400 E547 I554 K555	D400-K551 WeakPolarHBondContact OD2-CE 3.45Å; D400-K551 IonicContact OD2-NZ 2.71Å; D400-K551 PolarHBondContact OD2-NZ 3Å; E547-K551 WeakPolarHBondContact O-CG 3.37Å; E547-K551 PolarHBondContact O-N 3.29Å; K551-I554 PolarHBondContact O-N 3.49Å; K551-K555 WeakPolarHBondContact O-CB 3.47Å; K551-K555 VanDerWaalsContact O-CG 3.28Å; K551-K555 WeakPolarHBondContact O-CG 3.47Å; K551-K555 PolarHBondContact O-N 3.17Å
552	A	92.6	Very high	89.3	Confident	6 Å²	6	17.6 Å²	17.6	5%	0.05	9%	0.085	C	C	.	.	H	α-helix	trans	-65	-43.3	178.5	0	0	0	0	0	113.2	E548 I549 F550 K555 L556 L590 F591 V593	E548-A552 VanDerWaalsContact O-CB 3.31Å; E548-A552 WeakPolarHBondContact O-CB 3.38Å; E548-A552 PolarHBondContact O-N 3.29Å; I549-A552 PolarHBondContact O-N 3.45Å; F550-A552 VanDerWaalsContact C-N 3.29Å; F550-A552 PolarHBondContact O-N 3.09Å; A552-K555 PolarHBondContact O-N 3.45Å; A552-L556 PolarHBondContact O-N 3.14Å; A552-L590 WeakPolarHBondContact CB-O 2.84Å; A552-F591 HydrophobicContact CB-CD1 4.01Å; A552-F591 HydrophobicContact CB-CE1 4.23Å; A552-V593 HydrophobicContact CB-CG2 3.89Å
553	N	93.1	Very high	89.1	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-72.6	-33.9	177.4	-69.5	-90.2	0	0	0	112	E508 Y511 I512 I549 F550 K555 L556 W557 F591 Y594 Y650	E508-N553 PolarHBondContact OE1-OD1 3.35Å; Y511-N553 HydrophobicContact CE1-CB 4.47Å; Y511-N553 WeakPolarHBondContact CE1-OD1 3.32Å; I512-N553 HydrophobicContact CD1-CB 4.49Å; I512-N553 HydrophobicContact CG1-CB 4.1Å; I549-N553 PolarHBondContact O-N 3.33Å; I549-N553 VanDerWaalsContact O-N 3.13Å; I549-N553 PolarHBondContact O-ND2 3.24Å; F550-N553 PolarHBondContact O-N 3.34Å; N553-K555 VanDerWaalsContact C-N 3.34Å; N553-L556 PolarHBondContact O-N 3.06Å; N553-W557 WeakPolarHBondContact O-CB 3.37Å; N553-W557 PolarHBondContact O-N 2.6Å; N553-F591 WeakPolarHBondContact OD1-CZ 3.36Å; N553-Y594 PolarHBondContact ND2-OH 2.72Å; N553-Y650 PolarHBondContact OD1-OH 3.16Å
554	I	92.4	Very high	88.7	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.7	-43.1	169.1	-70.8	161.7	0	0	0	111	I398 C401 F474 I512 F550 K551 W557 L558	I398-I554 HydrophobicContact CB-CD1 4.49Å; I398-I554 HydrophobicContact CG1-CD1 3.51Å; I398-I554 HydrophobicContact CG1-CG1 4.3Å; C401-I554 HydrophobicContact CB-CG2 3.57Å; F474-I554 HydrophobicContact CZ-CG1 4.44Å; I512-I554 HydrophobicContact CG2-CG1 4.16Å; F550-I554 HydrophobicContact CD1-CD1 3.54Å; F550-I554 HydrophobicContact CD2-CD1 3.99Å; F550-I554 HydrophobicContact CD2-CG1 4.43Å; F550-I554 HydrophobicContact CE1-CD1 3.4Å; F550-I554 VanDerWaalsContact CE1-CD1 3.4Å; F550-I554 HydrophobicContact CE2-CD1 3.87Å; F550-I554 HydrophobicContact CE2-CG1 4.34Å; F550-I554 HydrophobicContact CG-CD1 3.86Å; F550-I554 HydrophobicContact CZ-CD1 3.59Å; F550-I554 HydrophobicContact CZ-CG1 4.45Å; F550-I554 WeakPolarHBondContact O-CD1 3.4Å; F550-I554 WeakPolarHBondContact O-CG1 3.41Å; F550-I554 PolarHBondContact O-N 2.86Å; K551-I554 PolarHBondContact O-N 3.49Å; I554-W557 PolarHBondContact O-N 3.48Å; I554-L558 HydrophobicContact CG2-CD1 3.47Å; I554-L558 VanDerWaalsContact CG2-CD1 3.47Å; I554-L558 HydrophobicContact CG2-CG 4.03Å; I554-L558 WeakPolarHBondContact O-CB 3.47Å; I554-L558 WeakPolarHBondContact O-CG 2.9Å; I554-L558 PolarHBondContact O-N 2.9Å
555	K	90	Very high	88.5	Confident	45 Å²	45	19.4 Å²	19.4	20%	0.196	9%	0.091	C	C	.	.	H	α-helix	trans	-62.5	-44.2	176.4	-75.6	170.5	179.8	-176.8	0	111.5	E404 K551 A552 N553 W557 Q559 L590	E404-K555 IonicContact OE1-NZ 3.95Å; E404-K555 WeakPolarHBondContact OE2-CE 3.26Å; E404-K555 IonicContact OE2-NZ 2.77Å; E404-K555 PolarHBondContact OE2-NZ 2.82Å; K551-K555 WeakPolarHBondContact O-CB 3.47Å; K551-K555 VanDerWaalsContact O-CG 3.28Å; K551-K555 WeakPolarHBondContact O-CG 3.47Å; K551-K555 PolarHBondContact O-N 3.17Å; A552-K555 PolarHBondContact O-N 3.45Å; N553-K555 VanDerWaalsContact C-N 3.34Å; K555-W557 VanDerWaalsContact C-N 3.33Å; K555-W557 PolarHBondContact O-N 3.35Å; K555-Q559 VanDerWaalsContact O-CB 3.22Å; K555-Q559 WeakPolarHBondContact O-CB 3.25Å; K555-Q559 WeakPolarHBondContact O-CG 3.22Å; K555-Q559 PolarHBondContact O-N 3.15Å; K555-L590 HydrophobicContact CB-CD2 4.17Å
556	L	90.8	Very high	88.1	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-55.9	-47.3	172	-178.2	64.7	0	0	0	111.6	A552 N553 Y560 L561 A583 I587 L590 F591	A552-L556 PolarHBondContact O-N 3.14Å; N553-L556 PolarHBondContact O-N 3.06Å; L556-Y560 HydrophobicContact CD1-CD2 4.22Å; L556-Y560 PolarHBondContact O-N 3.34Å; L556-Y560 VanDerWaalsContact O-N 3.15Å; L556-L561 HydrophobicContact CG-CD1 4.34Å; L556-L561 PolarHBondContact O-N 3.28Å; L556-A583 HydrophobicContact CD1-CB 4.28Å; L556-I587 HydrophobicContact CD1-CG1 4.39Å; L556-L590 HydrophobicContact CB-CD1 4.41Å; L556-L590 HydrophobicContact CD1-CD1 4.25Å; L556-F591 HydrophobicContact CB-CE1 4.46Å; L556-F591 HydrophobicContact CB-CZ 4.45Å; L556-F591 HydrophobicContact CD2-CE1 4.39Å; L556-F591 HydrophobicContact CD2-CE2 4.26Å; L556-F591 HydrophobicContact CD2-CZ 3.61Å
557	W	90.9	Very high	87.4	Confident	1 Å²	1	26.8 Å²	26.8	0%	0.004	12%	0.122	C	C	.	.	I	π-helix	trans	-61.8	-55.6	179.5	-178.1	-98.8	0	0	0	112.9	L473 F474 I476 I505 E508 A509 I512 N553 I554 K555 L561 T562 L565	L473-W557 PolarHBondContact O-NE1 3.09Å; F474-W557 AromaticContact CD1-CD1 3.54Å; F474-W557 HydrophobicContact CD1-CD2 4.39Å; F474-W557 HydrophobicContact CD1-CG 4.1Å; F474-W557 AromaticContact CD1-NE1 3.5Å; F474-W557 HydrophobicContact CE1-CB 4.47Å; F474-W557 AromaticContact CE1-CD1 3.3Å; F474-W557 AromaticContact CE1-CG 3.9Å; F474-W557 HydrophobicContact CE1-CG 3.9Å; F474-W557 AromaticContact CE1-NE1 3.75Å; I476-W557 HydrophobicContact CD1-CH2 3.47Å; I476-W557 VanDerWaalsContact CD1-CH2 3.47Å; I476-W557 HydrophobicContact CD1-CZ2 4.36Å; I476-W557 HydrophobicContact CD1-CZ3 3.96Å; I476-W557 HydrophobicContact CG1-CH2 3.82Å; I476-W557 HydrophobicContact CG1-CZ2 4.31Å; I505-W557 HydrophobicContact CG2-CH2 3.8Å; I505-W557 HydrophobicContact CG2-CZ3 3.67Å; E508-W557 HydrophobicContact CB-CE3 4.36Å; E508-W557 HydrophobicContact CG-CE3 4.26Å; A509-W557 HydrophobicContact CB-CE3 4.21Å; A509-W557 HydrophobicContact CB-CH2 3.93Å; A509-W557 HydrophobicContact CB-CZ2 4.19Å; A509-W557 HydrophobicContact CB-CZ3 3.89Å; I512-W557 HydrophobicContact CD1-CB 3.55Å; I512-W557 HydrophobicContact CD1-CD2 4.38Å; I512-W557 HydrophobicContact CD1-CG 3.95Å; N553-W557 WeakPolarHBondContact O-CB 3.37Å; N553-W557 PolarHBondContact O-N 2.6Å; I554-W557 PolarHBondContact O-N 3.48Å; K555-W557 VanDerWaalsContact C-N 3.33Å; K555-W557 PolarHBondContact O-N 3.35Å; W557-L561 HydrophobicContact CE3-CB 4.01Å; W557-L561 HydrophobicContact CE3-CD1 3.85Å; W557-L561 HydrophobicContact CZ3-CB 4.26Å; W557-L561 HydrophobicContact CZ3-CD1 4.27Å; W557-L561 PolarHBondContact O-N 3.19Å; W557-L561 VanDerWaalsContact O-N 3.15Å; W557-T562 PolarHBondContact NE1-OG1 3.18Å; W557-T562 WeakPolarHBondContact O-CB 3.37Å; W557-T562 PolarHBondContact O-N 2.87Å; W557-T562 PolarHBondContact O-OG1 2.95Å; W557-L565 HydrophobicContact CH2-CD2 3.95Å; W557-L565 HydrophobicContact CZ2-CD2 4.21Å
558	L	87.7	Confident	86.9	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.111	C	C	.	.	I	π-helix	trans	-71	-38.6	-173.1	-67.1	175.9	0	0	0	113	C401 L402 L405 L413 I554	C401-L558 HydrophobicContact CB-CD1 4.43Å; L402-L558 HydrophobicContact CD2-CD1 3.75Å; L402-L558 HydrophobicContact CD2-CD2 4.19Å; L402-L558 HydrophobicContact CG-CD1 3.99Å; L405-L558 HydrophobicContact CD1-CB 4.23Å; L405-L558 HydrophobicContact CD1-CD1 4.36Å; L413-L558 HydrophobicContact CD1-CD2 4.42Å; I554-L558 HydrophobicContact CG2-CD1 3.47Å; I554-L558 VanDerWaalsContact CG2-CD1 3.47Å; I554-L558 HydrophobicContact CG2-CG 4.03Å; I554-L558 WeakPolarHBondContact O-CB 3.47Å; I554-L558 WeakPolarHBondContact O-CG 2.9Å; I554-L558 PolarHBondContact O-N 2.9Å
559	Q	84.1	Confident	86.4	Confident	69 Å²	69	24.8 Å²	24.8	32%	0.322	11%	0.11	S	C	.	.	I	π-helix	trans	-84.2	-32.5	-175.4	-63.3	174.8	2.8	0	0	112.8	L405 K555	L405-Q559 HydrophobicContact CD2-CG 3.51Å; K555-Q559 VanDerWaalsContact O-CB 3.22Å; K555-Q559 WeakPolarHBondContact O-CB 3.25Å; K555-Q559 WeakPolarHBondContact O-CG 3.22Å; K555-Q559 PolarHBondContact O-N 3.15Å
560	Y	84.9	Confident	85.8	Confident	45 Å²	45	32.5 Å²	32.5	18%	0.176	14%	0.139	C	C	.	.	I	π-helix	trans	-127.3	-22.4	-167.6	-54.6	-86.5	0	0	0	116.3	L556 P564 S582 A583 H586 L590	L556-Y560 HydrophobicContact CD1-CD2 4.22Å; L556-Y560 PolarHBondContact O-N 3.34Å; L556-Y560 VanDerWaalsContact O-N 3.15Å; Y560-P564 WeakPolarHBondContact O-CD 3.48Å; Y560-P564 WeakPolarHBondContact O-CG 3.44Å; Y560-S582 WeakPolarHBondContact CE1-OG 3.43Å; Y560-A583 VanDerWaalsContact CB-CB 3.5Å; Y560-A583 HydrophobicContact CD1-CB 4.37Å; Y560-A583 HydrophobicContact CG-CB 4.1Å; Y560-H586 AromaticContact CE1-CD2 3.76Å; Y560-H586 AromaticContact CZ-CD2 3.86Å; Y560-H586 PolarHBondContact OH-CD2 2.93Å; Y560-L590 HydrophobicContact CD2-CD1 4.27Å; Y560-L590 HydrophobicContact CE2-CD1 3.79Å
561	L	85.6	Confident	85.1	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	16%	0.159	C	C	.	.	I	π-helix	trans	-103.8	-32.5	-178.2	-57.5	-179.3	0	0	0	113.2	F504 E508 L556 W557 L565 F580 A583	F504-L561 HydrophobicContact CE1-CD2 3.69Å; F504-L561 HydrophobicContact CZ-CD2 4.01Å; E508-L561 HydrophobicContact CB-CD1 4.14Å; E508-L561 HydrophobicContact CG-CD1 3.79Å; L556-L561 HydrophobicContact CG-CD1 4.34Å; L556-L561 PolarHBondContact O-N 3.28Å; W557-L561 HydrophobicContact CE3-CB 4.01Å; W557-L561 HydrophobicContact CE3-CD1 3.85Å; W557-L561 HydrophobicContact CZ3-CB 4.26Å; W557-L561 HydrophobicContact CZ3-CD1 4.27Å; W557-L561 PolarHBondContact O-N 3.19Å; W557-L561 VanDerWaalsContact O-N 3.15Å; L561-L565 WeakPolarHBondContact O-CB 3.47Å; L561-L565 PolarHBondContact O-N 3.27Å; L561-F580 HydrophobicContact CD2-CD1 3.72Å; L561-F580 HydrophobicContact CD2-CE1 3.88Å; L561-A583 HydrophobicContact CD2-CB 4.45Å
562	T	83.7	Confident	84.4	Confident	3 Å²	3	34 Å²	34	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-71.4	-41.6	-172	-53.5	0	0	0	0	112.7	L413 W557 L565 R566	L413-T562 HydrophobicContact CD2-CG2 3.66Å; W557-T562 PolarHBondContact NE1-OG1 3.18Å; W557-T562 WeakPolarHBondContact O-CB 3.37Å; W557-T562 PolarHBondContact O-N 2.87Å; W557-T562 PolarHBondContact O-OG1 2.95Å; T562-L565 PolarHBondContact O-N 2.96Å; T562-R566 PolarHBondContact O-N 2.71Å
563	E	80.1	Confident	83.7	Confident	41 Å²	41	37.8 Å²	37.8	19%	0.192	17%	0.169	C	C	.	.	H	α-helix	trans	-69.9	-45.6	-178.7	-68.8	-63.3	93.6	0	0	113.2	N412 L413 L565 R566 E567	N412-E563 VanDerWaalsContact CB-OE2 3.26Å; N412-E563 WeakPolarHBondContact CB-OE2 3.47Å; N412-E563 PolarHBondContact ND2-OE2 2.8Å; L413-E563 HydrophobicContact CD2-CG 4.5Å; E563-L565 VanDerWaalsContact C-N 3.26Å; E563-L565 PolarHBondContact O-N 3.15Å; E563-R566 PolarHBondContact O-N 2.84Å; E563-R566 IonicContact OE1-NH1 3.79Å; E563-R566 PolarHBondContact OE1-NH1 2.69Å; E563-E567 PolarHBondContact O-N 3.2Å
564	P	79.8	Confident	83	Confident	17 Å²	17	39.3 Å²	39.3	11%	0.11	18%	0.182	C	C	.	.	H	α-helix	trans	-52.9	-41	168	-32.8	39.9	0	0	0	114	Y560 I568 I579 F580	Y560-P564 WeakPolarHBondContact O-CD 3.48Å; Y560-P564 WeakPolarHBondContact O-CG 3.44Å; P564-I568 WeakPolarHBondContact O-CB 3.33Å; P564-I568 WeakPolarHBondContact O-CG1 3.23Å; P564-I568 PolarHBondContact O-N 2.95Å; P564-I579 HydrophobicContact CB-CG2 3.68Å; P564-I579 HydrophobicContact CG-CG2 3.6Å; P564-F580 HydrophobicContact CB-CE1 4.43Å
565	L	81.8	Confident	82.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.3	-35.6	177.4	-176.2	61.7	0	0	0	111.7	I483 W502 I505 W557 L561 T562 E563 R569 F575	I483-L565 HydrophobicContact CD1-CD1 4.01Å; W502-L565 HydrophobicContact CH2-CD1 4.42Å; W502-L565 HydrophobicContact CZ3-CD1 3.94Å; I505-L565 HydrophobicContact CG2-CD2 4.35Å; W557-L565 HydrophobicContact CH2-CD2 3.95Å; W557-L565 HydrophobicContact CZ2-CD2 4.21Å; L561-L565 WeakPolarHBondContact O-CB 3.47Å; L561-L565 PolarHBondContact O-N 3.27Å; T562-L565 PolarHBondContact O-N 2.96Å; E563-L565 VanDerWaalsContact C-N 3.26Å; E563-L565 PolarHBondContact O-N 3.15Å; L565-R569 VanDerWaalsContact O-CB 3.32Å; L565-R569 WeakPolarHBondContact O-CB 3.43Å; L565-R569 WeakPolarHBondContact O-CD 3.3Å; L565-R569 WeakPolarHBondContact O-CG 3.36Å; L565-R569 PolarHBondContact O-N 3.46Å; L565-F575 HydrophobicContact CD1-CZ 4.09Å
566	R	79	Confident	81.6	Confident	52 Å²	52	39.5 Å²	39.5	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-71.2	-41.2	174.4	-79.8	-160.5	171.6	99.1	-2.3	113.4	L413 T562 E563 R569 R570	L413-R566 PolarHBondContact O-NH2 2.9Å; T562-R566 PolarHBondContact O-N 2.71Å; E563-R566 PolarHBondContact O-N 2.84Å; E563-R566 IonicContact OE1-NH1 3.79Å; E563-R566 PolarHBondContact OE1-NH1 2.69Å; R566-R569 PolarHBondContact O-N 2.68Å; R566-R570 WeakPolarHBondContact O-CG 3.42Å; R566-R570 PolarHBondContact O-N 3.21Å
567	E	77	Confident	80.9	Confident	108 Å²	108	39.6 Å²	39.6	51%	0.505	19%	0.187	S	C	.	.	H	α-helix	trans	-60.5	-48.7	175.7	-176.3	172.4	-156.3	0	0	110.6	E563 R569 R570 N571	E563-E567 PolarHBondContact O-N 3.2Å; E567-R569 VanDerWaalsContact C-N 3.34Å; E567-R569 PolarHBondContact O-N 3.09Å; E567-R570 WeakPolarHBondContact O-CB 3.41Å; E567-R570 PolarHBondContact O-N 3.46Å; E567-N571 PolarHBondContact O-N 2.96Å; E567-N571 PolarHBondContact O-OD1 2.97Å
568	I	80.3	Confident	80.4	Confident	8 Å²	8	42 Å²	42	4%	0.041	20%	0.202	C	C	.	.	H	α-helix	trans	-68	-32.6	179.3	-68.6	169.9	0	0	0	111.8	I483 P564 R570 G572 D573 F575 I579	I483-I568 HydrophobicContact CG2-CG2 4Å; P564-I568 WeakPolarHBondContact O-CB 3.33Å; P564-I568 WeakPolarHBondContact O-CG1 3.23Å; P564-I568 PolarHBondContact O-N 2.95Å; I568-R570 PolarHBondContact O-N 3.2Å; I568-G572 VanDerWaalsContact O-CA 3.27Å; I568-G572 WeakPolarHBondContact O-CA 3.09Å; I568-G572 PolarHBondContact O-N 3.41Å; I568-D573 WeakPolarHBondContact CG2-O 3.22Å; I568-F575 HydrophobicContact CB-CE1 4.46Å; I568-F575 HydrophobicContact CB-CZ 4.38Å; I568-F575 HydrophobicContact CD1-CB 4.3Å; I568-F575 HydrophobicContact CD1-CD1 3.27Å; I568-F575 HydrophobicContact CD1-CD2 4.33Å; I568-F575 HydrophobicContact CD1-CE1 3.52Å; I568-F575 HydrophobicContact CD1-CG 3.71Å; I568-F575 HydrophobicContact CD1-CZ 4.16Å; I568-F575 HydrophobicContact CG2-CD2 4.23Å; I568-F575 HydrophobicContact CG2-CE1 4.33Å; I568-F575 HydrophobicContact CG2-CE2 3.82Å; I568-F575 HydrophobicContact CG2-CZ 3.87Å; I568-I579 HydrophobicContact CD1-CD1 4.2Å
569	R	81.2	Confident	79.9	Confident	77 Å²	77	45 Å²	45	29%	0.291	22%	0.218	S	C	.	.	H	α-helix	trans	-62.9	-34.6	169	-80.8	170.2	173.4	155.1	-1.4	113.8	F475 E477 I483 L565 R566 E567	F475-R569 PolarHBondContact O-NH2 3.2Å; E477-R569 VanDerWaalsContact CD-NH2 3.31Å; E477-R569 IonicContact OE1-CZ 2.6Å; E477-R569 IonicContact OE1-NE 3.5Å; E477-R569 PolarHBondContact OE1-NE 2.75Å; E477-R569 IonicContact OE1-NH2 3.51Å; E477-R569 PolarHBondContact OE1-NH2 2.77Å; E477-R569 VanDerWaalsContact OE1-NH2 3.17Å; E477-R569 IonicContact OE2-CZ 3Å; E477-R569 IonicContact OE2-NE 3.47Å; E477-R569 PolarHBondContact OE2-NE 3.34Å; E477-R569 IonicContact OE2-NH2 3.51Å; E477-R569 PolarHBondContact OE2-NH2 2.73Å; I483-R569 HydrophobicContact CD1-CG 4.07Å; I483-R569 HydrophobicContact CG2-CB 4.4Å; I483-R569 HydrophobicContact CG2-CG 3.96Å; L565-R569 VanDerWaalsContact O-CB 3.32Å; L565-R569 WeakPolarHBondContact O-CB 3.43Å; L565-R569 WeakPolarHBondContact O-CD 3.3Å; L565-R569 WeakPolarHBondContact O-CG 3.36Å; L565-R569 PolarHBondContact O-N 3.46Å; R566-R569 PolarHBondContact O-N 2.68Å; E567-R569 VanDerWaalsContact C-N 3.34Å; E567-R569 PolarHBondContact O-N 3.09Å
570	R	79.8	Confident	79.7	Confident	162 Å²	162	41.9 Å²	41.9	61%	0.611	20%	0.203	S	C	*	.	H	α-helix	trans	-72.9	-55.9	176.4	-71.2	167	176.6	157.5	0.5	110.5	K485 R566 E567 I568	K485-R570 PolarHBondContact NZ-O 2.8Å; R566-R570 WeakPolarHBondContact O-CG 3.42Å; R566-R570 PolarHBondContact O-N 3.21Å; E567-R570 WeakPolarHBondContact O-CB 3.41Å; E567-R570 PolarHBondContact O-N 3.46Å; I568-R570 PolarHBondContact O-N 3.2Å
571	N	79.7	Confident	79.6	Confident	77 Å²	77	42.4 Å²	42.4	41%	0.412	21%	0.206	S	C	.	.	H	α-helix	trans	-74.9	-42.1	-171.9	-55	1.7	0	0	0	111.8	K485 E567 D573	K485-N571 PolarHBondContact NZ-O 3.29Å; E567-N571 PolarHBondContact O-N 2.96Å; E567-N571 PolarHBondContact O-OD1 2.97Å; N571-D573 HydrophobicContact CB-CB 4.42Å; N571-D573 WeakPolarHBondContact CB-OD2 3.47Å; N571-D573 PolarHBondContact ND2-OD2 3.33Å
572	G	77.4	Confident	79.3	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.021	23%	0.227	C	C	.	.			trans	80.4	18	-172.3	0	0	0	0	0	114.4	I483 V484 K485 I568	I483-G572 WeakPolarHBondContact O-CA 3.26Å; V484-G572 WeakPolarHBondContact CA-O 3.31Å; K485-G572 PolarHBondContact N-O 3.31Å; I568-G572 VanDerWaalsContact O-CA 3.27Å; I568-G572 WeakPolarHBondContact O-CA 3.09Å; I568-G572 PolarHBondContact O-N 3.41Å
573	D	77.9	Confident	79.2	Confident	86 Å²	86	45.3 Å²	45.3	46%	0.46	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-72.9	169.9	178	-67.1	-43	0	0	0	112.6	V484 I568 N571	V484-D573 WeakPolarHBondContact CG2-O 3.05Å; I568-D573 WeakPolarHBondContact CG2-O 3.22Å; N571-D573 HydrophobicContact CB-CB 4.42Å; N571-D573 WeakPolarHBondContact CB-OD2 3.47Å; N571-D573 PolarHBondContact ND2-OD2 3.33Å
574	A	78.1	Confident	79.3	Confident	32 Å²	32	43.4 Å²	43.4	26%	0.264	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-80.4	137.9	174.1	0	0	0	0	0	111.9	V484 M490 T576	V484-A574 HydrophobicContact CG1-CB 4.18Å; M490-A574 HydrophobicContact CE-CB 3.58Å; M490-A574 HydrophobicContact SD-CB 4.3Å; A574-T576 PolarHBondContact O-N 2.87Å
575	F	78.4	Confident	79.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-57.2	134.3	172.1	-69.6	-94.7	0	0	0	111.5	V484 R497 Q498 I501 W502 I505 L565 I568 F580	V484-F575 HydrophobicContact CG2-CD2 4.16Å; V484-F575 HydrophobicContact CG2-CE2 4.26Å; R497-F575 PolarHBondContact NH2-O 2.93Å; Q498-F575 PolarHBondContact NE2-O 2.98Å; I501-F575 HydrophobicContact CB-CB 4.37Å; I501-F575 HydrophobicContact CD1-CB 3.8Å; I501-F575 HydrophobicContact CG2-CB 3.87Å; I501-F575 HydrophobicContact CG2-CD1 3.8Å; I501-F575 HydrophobicContact CG2-CG 3.94Å; W502-F575 HydrophobicContact CE3-CE2 4.08Å; W502-F575 HydrophobicContact CE3-CZ 4.06Å; W502-F575 HydrophobicContact CZ3-CE2 4.23Å; W502-F575 AromaticContact CZ3-CZ 3.96Å; W502-F575 HydrophobicContact CZ3-CZ 3.96Å; I505-F575 HydrophobicContact CD1-CD1 4.07Å; I505-F575 HydrophobicContact CD1-CE1 3.48Å; I505-F575 VanDerWaalsContact CD1-CE1 3.48Å; I505-F575 HydrophobicContact CD1-CZ 4.1Å; L565-F575 HydrophobicContact CD1-CZ 4.09Å; I568-F575 HydrophobicContact CB-CE1 4.46Å; I568-F575 HydrophobicContact CB-CZ 4.38Å; I568-F575 HydrophobicContact CD1-CB 4.3Å; I568-F575 HydrophobicContact CD1-CD1 3.27Å; I568-F575 HydrophobicContact CD1-CD2 4.33Å; I568-F575 HydrophobicContact CD1-CE1 3.52Å; I568-F575 HydrophobicContact CD1-CG 3.71Å; I568-F575 HydrophobicContact CD1-CZ 4.16Å; I568-F575 HydrophobicContact CG2-CD2 4.23Å; I568-F575 HydrophobicContact CG2-CE1 4.33Å; I568-F575 HydrophobicContact CG2-CE2 3.82Å; I568-F575 HydrophobicContact CG2-CZ 3.87Å; F575-F580 HydrophobicContact CD1-CE2 4.41Å; F575-F580 HydrophobicContact CD1-CZ 4.09Å
576	T	76.6	Confident	79.7	Confident	50 Å²	50	49.2 Å²	49.2	31%	0.307	25%	0.248	S	C	.	.			trans	-110.1	130.6	174.8	-64.9	0	0	0	0	109.4	A574 V578 I579	A574-T576 PolarHBondContact O-N 2.87Å; T576-V578 HydrophobicContact CG2-CB 4.17Å; T576-V578 HydrophobicContact CG2-CG2 4.1Å; T576-V578 PolarHBondContact O-N 3.49Å; T576-I579 WeakPolarHBondContact O-CG1 3.49Å; T576-I579 PolarHBondContact O-N 3.36Å
577	P	75.8	Confident	80.1	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-56.4	-35.8	-174.8	-25.6	32.7	0	0	0	114.4	R497 I501 I579 F580 I657 V670	R497-P577 HydrophobicContact CG-CG 4.31Å; I501-P577 HydrophobicContact CD1-CG 4.19Å; P577-I579 PolarHBondContact O-N 2.92Å; P577-I579 VanDerWaalsContact O-N 3.15Å; P577-F580 PolarHBondContact O-N 2.89Å; P577-I657 HydrophobicContact CB-CG2 3.93Å; P577-I657 HydrophobicContact CG-CG2 4.15Å; P577-V670 HydrophobicContact CB-CG2 3.53Å; P577-V670 HydrophobicContact CG-CG2 4.47Å
578	V	78.8	Confident	80.6	Confident	51 Å²	51	43.2 Å²	43.2	31%	0.309	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-57.1	-29.2	-176.3	-176.3	0	0	0	0	113.2	T576 F580 K581 E666 E669	T576-V578 HydrophobicContact CG2-CB 4.17Å; T576-V578 HydrophobicContact CG2-CG2 4.1Å; T576-V578 PolarHBondContact O-N 3.49Å; V578-F580 PolarHBondContact O-N 3.16Å; V578-F580 VanDerWaalsContact O-N 3.08Å; V578-K581 VanDerWaalsContact O-CB 3.25Å; V578-K581 WeakPolarHBondContact O-CB 3.41Å; V578-K581 PolarHBondContact O-N 3.44Å; V578-E666 HydrophobicContact CG2-CG 4.34Å; V578-E669 VanDerWaalsContact CG1-OE2 3.26Å; V578-E669 WeakPolarHBondContact CG1-OE2 3.28Å; V578-E669 VanDerWaalsContact CG2-OE2 3.25Å; V578-E669 WeakPolarHBondContact CG2-OE2 3.38Å
579	I	78.8	Confident	80.9	Confident	64 Å²	64	47.8 Å²	47.8	33%	0.328	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-59.4	-28	-177.7	-54.6	168	0	0	0	111.3	P564 I568 T576 P577	P564-I579 HydrophobicContact CB-CG2 3.68Å; P564-I579 HydrophobicContact CG-CG2 3.6Å; I568-I579 HydrophobicContact CD1-CD1 4.2Å; T576-I579 WeakPolarHBondContact O-CG1 3.49Å; T576-I579 PolarHBondContact O-N 3.36Å; P577-I579 PolarHBondContact O-N 2.92Å; P577-I579 VanDerWaalsContact O-N 3.15Å
580	F	80	Confident	81.3	Confident	3 Å²	3	45.7 Å²	45.7	1%	0.013	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-88.2	1.9	179.7	-53.5	-72.8	0	0	0	114.2	I501 F504 I505 L561 P564 F575 P577 V578 S582 A583 I584	I501-F580 HydrophobicContact CG2-CD2 4.35Å; I501-F580 HydrophobicContact CG2-CE2 3.47Å; I501-F580 VanDerWaalsContact CG2-CE2 3.47Å; I501-F580 HydrophobicContact CG2-CZ 3.9Å; F504-F580 HydrophobicContact CD1-CD1 4.48Å; F504-F580 HydrophobicContact CE1-CB 4.44Å; F504-F580 AromaticContact CE1-CD1 3.91Å; F504-F580 HydrophobicContact CE1-CD1 3.91Å; F504-F580 HydrophobicContact CE1-CG 4.16Å; I505-F580 HydrophobicContact CD1-CE1 4.17Å; I505-F580 HydrophobicContact CD1-CZ 3.82Å; I505-F580 HydrophobicContact CG1-CE1 4.35Å; I505-F580 HydrophobicContact CG1-CZ 4.36Å; L561-F580 HydrophobicContact CD2-CD1 3.72Å; L561-F580 HydrophobicContact CD2-CE1 3.88Å; P564-F580 HydrophobicContact CB-CE1 4.43Å; F575-F580 HydrophobicContact CD1-CE2 4.41Å; F575-F580 HydrophobicContact CD1-CZ 4.09Å; P577-F580 PolarHBondContact O-N 2.89Å; V578-F580 PolarHBondContact O-N 3.16Å; V578-F580 VanDerWaalsContact O-N 3.08Å; F580-S582 VanDerWaalsContact C-N 3.35Å; F580-S582 PolarHBondContact O-N 2.8Å; F580-A583 HydrophobicContact CB-CB 4.46Å; F580-A583 WeakPolarHBondContact O-CB 3.2Å; F580-A583 PolarHBondContact O-N 3Å; F580-A583 VanDerWaalsContact O-N 3.12Å; F580-I584 HydrophobicContact CB-CD1 4.49Å; F580-I584 PolarHBondContact O-N 3.5Å
581	K	81.4	Confident	81.9	Confident	56 Å²	56	38 Å²	38	24%	0.243	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-44.6	180	-163.4	176.5	-166.7	-180	0	112.3	V578 I584 T585 E669 E672 M673	V578-K581 VanDerWaalsContact O-CB 3.25Å; V578-K581 WeakPolarHBondContact O-CB 3.41Å; V578-K581 PolarHBondContact O-N 3.44Å; K581-I584 PolarHBondContact O-N 2.78Å; K581-T585 WeakPolarHBondContact O-CB 3.44Å; K581-T585 WeakPolarHBondContact O-CG2 3.5Å; K581-T585 PolarHBondContact O-N 3.01Å; K581-T585 PolarHBondContact O-OG1 3.41Å; K581-E669 HydrophobicContact CD-CB 4.33Å; K581-E669 HydrophobicContact CD-CG 4.44Å; K581-E669 VanDerWaalsContact CD-OE1 3.27Å; K581-E669 WeakPolarHBondContact CD-OE1 3.5Å; K581-E669 WeakPolarHBondContact CE-OE1 3.47Å; K581-E669 IonicContact NZ-OE1 2.79Å; K581-E669 PolarHBondContact NZ-OE1 3.29Å; K581-E672 WeakPolarHBondContact CE-OE2 3.29Å; K581-E672 IonicContact NZ-OE2 3.91Å; K581-E672 PolarHBondContact NZ-OE2 3.41Å; K581-M673 WeakPolarHBondContact CA-SD 3.48Å; K581-M673 HydrophobicContact CB-SD 4.19Å; K581-M673 HydrophobicContact CG-CG 4.31Å; K581-M673 HydrophobicContact CG-SD 4.49Å
582	S	78.8	Confident	82.2	Confident	64 Å²	64	37.1 Å²	37.1	45%	0.448	22%	0.215	S	C	.	.	H	α-helix	trans	-63.6	-42.4	174.2	177.7	0	0	0	0	112.3	Y560 F580 I584 T585 H586	Y560-S582 WeakPolarHBondContact CE1-OG 3.43Å; F580-S582 VanDerWaalsContact C-N 3.35Å; F580-S582 PolarHBondContact O-N 2.8Å; S582-I584 VanDerWaalsContact C-N 3.28Å; S582-I584 PolarHBondContact O-N 2.92Å; S582-T585 PolarHBondContact O-OG1 3.43Å; S582-H586 PolarHBondContact O-CD2 2.98Å; S582-H586 PolarHBondContact O-N 3.25Å
583	A	81.9	Confident	82.8	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-57.7	-42.2	178.1	0	0	0	0	0	112.3	L556 Y560 L561 F580	L556-A583 HydrophobicContact CD1-CB 4.28Å; Y560-A583 VanDerWaalsContact CB-CB 3.5Å; Y560-A583 HydrophobicContact CD1-CB 4.37Å; Y560-A583 HydrophobicContact CG-CB 4.1Å; L561-A583 HydrophobicContact CD2-CB 4.45Å; F580-A583 HydrophobicContact CB-CB 4.46Å; F580-A583 WeakPolarHBondContact O-CB 3.2Å; F580-A583 PolarHBondContact O-N 3Å; F580-A583 VanDerWaalsContact O-N 3.12Å
584	I	83	Confident	83.3	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-88.6	-32.3	-170.4	-69.6	-179.4	0	0	0	112.6	F504 F580 K581 S582 H586 I587 M654 M673 I677	F504-I584 HydrophobicContact CZ-CD1 4.49Å; F580-I584 HydrophobicContact CB-CD1 4.49Å; F580-I584 PolarHBondContact O-N 3.5Å; K581-I584 PolarHBondContact O-N 2.78Å; S582-I584 VanDerWaalsContact C-N 3.28Å; S582-I584 PolarHBondContact O-N 2.92Å; I584-H586 PolarHBondContact O-N 3.22Å; I584-I587 HydrophobicContact CB-CD1 4.39Å; I584-I587 HydrophobicContact CG1-CD1 3.94Å; I584-I587 HydrophobicContact CG2-CD1 4.5Å; I584-I587 WeakPolarHBondContact O-CB 3.39Å; I584-I587 PolarHBondContact O-N 3.27Å; I584-I587 VanDerWaalsContact O-N 3.13Å; I584-M654 HydrophobicContact CD1-CE 3.49Å; I584-M654 VanDerWaalsContact CD1-CE 3.49Å; I584-M654 HydrophobicContact CD1-CG 3.86Å; I584-M654 HydrophobicContact CD1-SD 3.22Å; I584-M654 WeakPolarHBondContact CD1-SD 3.44Å; I584-M673 HydrophobicContact CB-CB 4.4Å; I584-M673 HydrophobicContact CB-CG 4.03Å; I584-M673 HydrophobicContact CB-SD 3.96Å; I584-M673 HydrophobicContact CD1-SD 3.79Å; I584-M673 HydrophobicContact CG1-SD 4.29Å; I584-M673 HydrophobicContact CG2-CB 3.76Å; I584-M673 HydrophobicContact CG2-CG 3.87Å; I584-M673 HydrophobicContact CG2-SD 4.37Å; I584-I677 HydrophobicContact CB-CD1 4.45Å; I584-I677 HydrophobicContact CD1-CD1 4.14Å; I584-I677 HydrophobicContact CG1-CD1 4.33Å; I584-I677 HydrophobicContact CG2-CD1 3.39Å; I584-I677 HydrophobicContact CG2-CG1 3.74Å
585	T	83.6	Confident	83.7	Confident	68 Å²	68	35.3 Å²	35.3	42%	0.417	20%	0.2	S	C	.	.	H	α-helix	trans	-62.5	-25	171.8	43.5	0	0	0	0	112.9	K581 S582	K581-T585 WeakPolarHBondContact O-CB 3.44Å; K581-T585 WeakPolarHBondContact O-CG2 3.5Å; K581-T585 PolarHBondContact O-N 3.01Å; K581-T585 PolarHBondContact O-OG1 3.41Å; S582-T585 PolarHBondContact O-OG1 3.43Å
586	H	86	Confident	83.8	Confident	70 Å²	70	40.1 Å²	40.1	32%	0.324	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	0.2	173.9	-71.2	-56.1	0	0	0	115.5	Y560 S582 I584 D589 L590	Y560-H586 AromaticContact CE1-CD2 3.76Å; Y560-H586 AromaticContact CZ-CD2 3.86Å; Y560-H586 PolarHBondContact OH-CD2 2.93Å; S582-H586 PolarHBondContact O-CD2 2.98Å; S582-H586 PolarHBondContact O-N 3.25Å; I584-H586 PolarHBondContact O-N 3.22Å; H586-D589 IonicContact CE1-OD2 2.7Å; H586-D589 IonicContact CG-OD2 3.46Å; H586-D589 IonicContact ND1-OD2 3.83Å; H586-D589 PolarHBondContact ND1-OD2 3.41Å; H586-D589 PolarHBondContact O-N 3.27Å; H586-L590 HydrophobicContact CB-CD1 4.24Å; H586-L590 WeakPolarHBondContact O-CB 3.39Å; H586-L590 VanDerWaalsContact O-CG 3.29Å; H586-L590 WeakPolarHBondContact O-CG 3.45Å; H586-L590 PolarHBondContact O-N 3.28Å
587	I	88.1	Confident	84.4	Confident	2 Å²	2	38 Å²	38	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-56.9	-44.9	173.7	-82.8	175.1	0	0	0	112.3	L556 I584 D589 L590 F591 I677 F680	L556-I587 HydrophobicContact CD1-CG1 4.39Å; I584-I587 HydrophobicContact CB-CD1 4.39Å; I584-I587 HydrophobicContact CG1-CD1 3.94Å; I584-I587 HydrophobicContact CG2-CD1 4.5Å; I584-I587 WeakPolarHBondContact O-CB 3.39Å; I584-I587 PolarHBondContact O-N 3.27Å; I584-I587 VanDerWaalsContact O-N 3.13Å; I587-D589 VanDerWaalsContact C-N 3.3Å; I587-D589 PolarHBondContact O-N 2.77Å; I587-L590 PolarHBondContact O-N 2.96Å; I587-F591 HydrophobicContact CG1-CD2 4.46Å; I587-F591 HydrophobicContact CG1-CE2 4.28Å; I587-F591 HydrophobicContact CG2-CD2 3.74Å; I587-F591 HydrophobicContact CG2-CE2 4.29Å; I587-F591 HydrophobicContact CG2-CG 4.41Å; I587-F591 VanDerWaalsContact O-CB 3.27Å; I587-F591 WeakPolarHBondContact O-CB 3.47Å; I587-F591 PolarHBondContact O-N 2.72Å; I587-I677 HydrophobicContact CD1-CD1 4.24Å; I587-I677 HydrophobicContact CD1-CG1 4.41Å; I587-F680 HydrophobicContact CG2-CD1 4.19Å; I587-F680 HydrophobicContact CG2-CE1 4.25Å
588	P	87.5	Confident	84.8	Confident	33 Å²	33	38.8 Å²	38.8	21%	0.214	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-37.6	179.6	-26.4	36.6	0	0	0	113.7	S592 F680	P588-S592 PolarHBondContact O-N 3.45Å; P588-F680 HydrophobicContact CB-CB 4.47Å; P588-F680 HydrophobicContact CB-CD2 3.73Å; P588-F680 HydrophobicContact CB-CE2 4.09Å; P588-F680 HydrophobicContact CB-CG 4.1Å; P588-F680 HydrophobicContact CG-CB 4.2Å; P588-F680 HydrophobicContact CG-CD2 4.34Å; P588-F680 HydrophobicContact CG-CG 4.22Å; P588-F680 WeakPolarHBondContact O-CE2 3.46Å
589	D	87.1	Confident	84.9	Confident	103 Å²	103	36.7 Å²	36.7	55%	0.551	20%	0.199	S	C	*	.	H	α-helix	trans	-68.8	-56.9	177.3	-55.5	-40.5	0	0	0	110.7	H586 I587 F591 S592	H586-D589 IonicContact CE1-OD2 2.7Å; H586-D589 IonicContact CG-OD2 3.46Å; H586-D589 IonicContact ND1-OD2 3.83Å; H586-D589 PolarHBondContact ND1-OD2 3.41Å; H586-D589 PolarHBondContact O-N 3.27Å; I587-D589 VanDerWaalsContact C-N 3.3Å; I587-D589 PolarHBondContact O-N 2.77Å; D589-F591 PolarHBondContact O-N 3.22Å; D589-S592 VanDerWaalsContact O-CB 3.31Å; D589-S592 WeakPolarHBondContact O-CB 3.05Å; D589-S592 PolarHBondContact O-N 3.24Å; D589-S592 PolarHBondContact O-OG 3.46Å
590	L	88.2	Confident	84.9	Confident	33 Å²	33	35.1 Å²	35.1	17%	0.173	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-40.7	-175.3	-68.8	169.7	0	0	0	112.1	A552 K555 L556 Y560 H586 I587	A552-L590 WeakPolarHBondContact CB-O 2.84Å; K555-L590 HydrophobicContact CB-CD2 4.17Å; L556-L590 HydrophobicContact CB-CD1 4.41Å; L556-L590 HydrophobicContact CD1-CD1 4.25Å; Y560-L590 HydrophobicContact CD2-CD1 4.27Å; Y560-L590 HydrophobicContact CE2-CD1 3.79Å; H586-L590 HydrophobicContact CB-CD1 4.24Å; H586-L590 WeakPolarHBondContact O-CB 3.39Å; H586-L590 VanDerWaalsContact O-CG 3.29Å; H586-L590 WeakPolarHBondContact O-CG 3.45Å; H586-L590 PolarHBondContact O-N 3.28Å; I587-L590 PolarHBondContact O-N 2.96Å
591	F	91.8	Very high	85.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	9.8	-176.1	-66.3	-7.6	0	0	0	113.2	A552 N553 L556 I587 D589 V593 Y594 L647 Y650 F680	A552-F591 HydrophobicContact CB-CD1 4.01Å; A552-F591 HydrophobicContact CB-CE1 4.23Å; N553-F591 WeakPolarHBondContact OD1-CZ 3.36Å; L556-F591 HydrophobicContact CB-CE1 4.46Å; L556-F591 HydrophobicContact CB-CZ 4.45Å; L556-F591 HydrophobicContact CD2-CE1 4.39Å; L556-F591 HydrophobicContact CD2-CE2 4.26Å; L556-F591 HydrophobicContact CD2-CZ 3.61Å; I587-F591 HydrophobicContact CG1-CD2 4.46Å; I587-F591 HydrophobicContact CG1-CE2 4.28Å; I587-F591 HydrophobicContact CG2-CD2 3.74Å; I587-F591 HydrophobicContact CG2-CE2 4.29Å; I587-F591 HydrophobicContact CG2-CG 4.41Å; I587-F591 VanDerWaalsContact O-CB 3.27Å; I587-F591 WeakPolarHBondContact O-CB 3.47Å; I587-F591 PolarHBondContact O-N 2.72Å; D589-F591 PolarHBondContact O-N 3.22Å; F591-V593 PolarHBondContact O-N 2.94Å; F591-Y594 HydrophobicContact CB-CD2 3.56Å; F591-Y594 HydrophobicContact CB-CE2 4Å; F591-Y594 HydrophobicContact CB-CG 4.45Å; F591-Y594 HydrophobicContact CD1-CD2 4.2Å; F591-Y594 AromaticContact CD1-CE2 3.78Å; F591-Y594 HydrophobicContact CD1-CE2 3.78Å; F591-Y594 HydrophobicContact CD2-CD2 4.41Å; F591-Y594 HydrophobicContact CD2-CE2 4.11Å; F591-Y594 HydrophobicContact CE1-CE2 4.25Å; F591-Y594 AromaticContact CG-CD2 3.83Å; F591-Y594 HydrophobicContact CG-CD2 3.83Å; F591-Y594 AromaticContact CG-CE2 3.7Å; F591-Y594 HydrophobicContact CG-CE2 3.7Å; F591-Y594 VanDerWaalsContact O-CB 3.28Å; F591-Y594 WeakPolarHBondContact O-CB 3.14Å; F591-Y594 PolarHBondContact O-N 2.95Å; F591-L647 HydrophobicContact CD2-CD1 4.15Å; F591-Y650 HydrophobicContact CD2-CE2 4.25Å; F591-Y650 HydrophobicContact CE2-CD2 4.22Å; F591-Y650 AromaticContact CE2-CE2 3.48Å; F591-Y650 HydrophobicContact CE2-CE2 3.48Å; F591-Y650 VanDerWaalsContact CE2-CE2 3.48Å; F591-Y650 AromaticContact CE2-CZ 3.74Å; F591-Y650 HydrophobicContact CZ-CE2 4.33Å; F591-F680 HydrophobicContact CB-CE1 3.81Å; F591-F680 HydrophobicContact CB-CZ 3.89Å
592	S	86.5	Confident	85	Confident	59 Å²	59	36.6 Å²	36.6	41%	0.413	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-35.2	170.1	55.4	0	0	0	0	113	P588 D589 Y594 K595	P588-S592 PolarHBondContact O-N 3.45Å; D589-S592 VanDerWaalsContact O-CB 3.31Å; D589-S592 WeakPolarHBondContact O-CB 3.05Å; D589-S592 PolarHBondContact O-N 3.24Å; D589-S592 PolarHBondContact O-OG 3.46Å; S592-Y594 PolarHBondContact O-N 2.96Å; S592-K595 VanDerWaalsContact O-CB 3.31Å; S592-K595 WeakPolarHBondContact O-CB 3.38Å; S592-K595 PolarHBondContact O-N 3.4Å; S592-K595 VanDerWaalsContact O-N 3.08Å
593	V	89.4	Confident	84.8	Confident	39 Å²	39	35.2 Å²	35.2	24%	0.236	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-23.4	172.8	-65.7	0	0	0	0	115.1	N545 E548 I549 A552 F591 K595 Y597	N545-V593 PolarHBondContact ND2-O 2.75Å; E548-V593 HydrophobicContact CB-CG1 4.27Å; I549-V593 HydrophobicContact CD1-CG2 4.05Å; A552-V593 HydrophobicContact CB-CG2 3.89Å; F591-V593 PolarHBondContact O-N 2.94Å; V593-K595 VanDerWaalsContact C-N 3.27Å; V593-K595 PolarHBondContact O-N 3.03Å; V593-Y597 PolarHBondContact O-N 3.38Å
594	Y	90.1	Very high	84.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-26.3	174.6	-81.1	-103.7	0	0	0	112.6	Y511 I549 N553 F591 S592 Y597 Y598 P643 L647	Y511-Y594 PolarHBondContact OH-OH 3.31Å; I549-Y594 HydrophobicContact CD1-CD1 3.78Å; I549-Y594 HydrophobicContact CD1-CD2 3.38Å; I549-Y594 HydrophobicContact CD1-CE1 3.91Å; I549-Y594 HydrophobicContact CD1-CE2 3.54Å; I549-Y594 HydrophobicContact CD1-CG 3.52Å; I549-Y594 HydrophobicContact CG2-CE1 4.39Å; I549-Y594 HydrophobicContact CG2-CE2 4.21Å; N553-Y594 PolarHBondContact ND2-OH 2.72Å; F591-Y594 HydrophobicContact CB-CD2 3.56Å; F591-Y594 HydrophobicContact CB-CE2 4Å; F591-Y594 HydrophobicContact CB-CG 4.45Å; F591-Y594 HydrophobicContact CD1-CD2 4.2Å; F591-Y594 AromaticContact CD1-CE2 3.78Å; F591-Y594 HydrophobicContact CD1-CE2 3.78Å; F591-Y594 HydrophobicContact CD2-CD2 4.41Å; F591-Y594 HydrophobicContact CD2-CE2 4.11Å; F591-Y594 HydrophobicContact CE1-CE2 4.25Å; F591-Y594 AromaticContact CG-CD2 3.83Å; F591-Y594 HydrophobicContact CG-CD2 3.83Å; F591-Y594 AromaticContact CG-CE2 3.7Å; F591-Y594 HydrophobicContact CG-CE2 3.7Å; F591-Y594 VanDerWaalsContact O-CB 3.28Å; F591-Y594 WeakPolarHBondContact O-CB 3.14Å; F591-Y594 PolarHBondContact O-N 2.95Å; S592-Y594 PolarHBondContact O-N 2.96Å; Y594-Y597 PolarHBondContact O-N 3.46Å; Y594-Y598 HydrophobicContact CD1-CE2 4.42Å; Y594-Y598 WeakPolarHBondContact O-CB 3.04Å; Y594-Y598 WeakPolarHBondContact O-CD2 3.48Å; Y594-Y598 PolarHBondContact O-N 2.92Å; Y594-P643 HydrophobicContact CE1-CB 3.91Å; Y594-P643 WeakPolarHBondContact CE1-O 3.37Å; Y594-L647 HydrophobicContact CD1-CB 4.28Å; Y594-L647 HydrophobicContact CD1-CD1 4.45Å; Y594-L647 HydrophobicContact CD1-CD2 4.41Å; Y594-L647 HydrophobicContact CE1-CB 4.33Å
595	K	85.5	Confident	84.7	Confident	43 Å²	43	39.8 Å²	39.8	19%	0.187	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-53.3	176.1	-70.6	171.3	-178.4	-176.9	0	110.6	S592 V593 Y597 V599 E683 I684	S592-K595 VanDerWaalsContact O-CB 3.31Å; S592-K595 WeakPolarHBondContact O-CB 3.38Å; S592-K595 PolarHBondContact O-N 3.4Å; S592-K595 VanDerWaalsContact O-N 3.08Å; V593-K595 VanDerWaalsContact C-N 3.27Å; V593-K595 PolarHBondContact O-N 3.03Å; K595-Y597 VanDerWaalsContact C-N 3.33Å; K595-Y597 PolarHBondContact O-N 3.32Å; K595-V599 WeakPolarHBondContact O-CB 3.47Å; K595-V599 VanDerWaalsContact O-CG2 3.31Å; K595-V599 WeakPolarHBondContact O-CG2 3.29Å; K595-V599 PolarHBondContact O-N 2.91Å; K595-E683 WeakPolarHBondContact CE-OE1 3.38Å; K595-E683 VanDerWaalsContact CE-OE2 3.28Å; K595-E683 WeakPolarHBondContact CE-OE2 3.41Å; K595-E683 IonicContact NZ-OE1 3.71Å; K595-E683 PolarHBondContact NZ-OE1 2.94Å; K595-E683 IonicContact NZ-OE2 2.69Å; K595-E683 PolarHBondContact NZ-OE2 3.26Å; K595-I684 HydrophobicContact CG-CD1 4.21Å; K595-I684 HydrophobicContact CG-CG1 3.59Å
596	Q	81.8	Confident	84.3	Confident	102 Å²	102	40.2 Å²	40.2	48%	0.477	22%	0.216	S	C	.	.	H	α-helix	trans	-64	-35.4	177	-177.2	173.7	-15.9	0	0	112.7	N600	Q596-N600 WeakPolarHBondContact O-CB 3.31Å; Q596-N600 PolarHBondContact O-N 3.38Å; Q596-N600 PolarHBondContact O-ND2 3.17Å
597	Y	87.4	Confident	83.9	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-66.6	-51.4	178.9	-170.4	-89.3	0	0	0	111.9	N545 I546 I549 V593 Y594 K595 V599 N600 L601 L640 P643 T644	N545-Y597 WeakPolarHBondContact OD1-CA 3.25Å; N545-Y597 WeakPolarHBondContact OD1-CB 3.16Å; N545-Y597 PolarHBondContact OD1-N 2.94Å; I546-Y597 HydrophobicContact CB-CE2 4.37Å; I546-Y597 HydrophobicContact CD1-CE2 3.91Å; I549-Y597 HydrophobicContact CD1-CD2 4.4Å; I549-Y597 HydrophobicContact CD1-CG 4.18Å; I549-Y597 HydrophobicContact CG1-CD2 3.86Å; I549-Y597 HydrophobicContact CG1-CG 4.14Å; V593-Y597 PolarHBondContact O-N 3.38Å; Y594-Y597 PolarHBondContact O-N 3.46Å; K595-Y597 VanDerWaalsContact C-N 3.33Å; K595-Y597 PolarHBondContact O-N 3.32Å; Y597-V599 PolarHBondContact O-N 3.12Å; Y597-N600 PolarHBondContact O-N 2.79Å; Y597-L601 HydrophobicContact CE1-CD1 4.25Å; Y597-L601 HydrophobicContact CE1-CD2 4.31Å; Y597-L601 WeakPolarHBondContact O-CB 3.46Å; Y597-L601 PolarHBondContact O-N 2.88Å; Y597-L640 WeakPolarHBondContact CE1-O 3.36Å; Y597-L640 WeakPolarHBondContact OH-CA 3.42Å; Y597-L640 WeakPolarHBondContact OH-CB 3.2Å; Y597-L640 WeakPolarHBondContact OH-CD2 3.35Å; Y597-L640 PolarHBondContact OH-O 2.88Å; Y597-P643 HydrophobicContact CD1-CB 4.32Å; Y597-P643 HydrophobicContact CE1-CB 3.86Å; Y597-P643 HydrophobicContact CE1-CG 3.99Å; Y597-T644 HydrophobicContact CD1-CG2 4.46Å; Y597-T644 HydrophobicContact CE1-CG2 4.46Å
598	Y	85.6	Confident	83.7	Confident	19 Å²	19	40.6 Å²	40.6	8%	0.075	22%	0.216	C	C	.	.	H	α-helix	trans	-55.1	-49.6	178.6	-102.1	-99.3	0	0	0	112.2	Y594 N600 L601 T644 L647 I684 M688	Y594-Y598 HydrophobicContact CD1-CE2 4.42Å; Y594-Y598 WeakPolarHBondContact O-CB 3.04Å; Y594-Y598 WeakPolarHBondContact O-CD2 3.48Å; Y594-Y598 PolarHBondContact O-N 2.92Å; Y598-N600 VanDerWaalsContact C-N 3.34Å; Y598-N600 PolarHBondContact O-N 3.38Å; Y598-L601 PolarHBondContact O-N 3.01Å; Y598-T644 HydrophobicContact CD1-CG2 4.02Å; Y598-T644 HydrophobicContact CD2-CG2 3.81Å; Y598-T644 HydrophobicContact CE1-CG2 3.85Å; Y598-T644 HydrophobicContact CE2-CG2 3.61Å; Y598-T644 HydrophobicContact CG-CG2 4.02Å; Y598-T644 VanDerWaalsContact CZ-CB 3.41Å; Y598-T644 WeakPolarHBondContact OH-CA 3.39Å; Y598-T644 WeakPolarHBondContact OH-CB 3.43Å; Y598-T644 PolarHBondContact OH-O 2.78Å; Y598-L647 HydrophobicContact CD2-CD2 4.41Å; Y598-L647 HydrophobicContact CE2-CB 4.35Å; Y598-L647 HydrophobicContact CE2-CD2 3.52Å; Y598-I684 HydrophobicContact CD1-CG2 4.03Å; Y598-I684 HydrophobicContact CD2-CG2 3.77Å; Y598-I684 HydrophobicContact CE1-CG2 4.21Å; Y598-I684 HydrophobicContact CE2-CG2 3.98Å; Y598-I684 HydrophobicContact CG-CG2 3.78Å; Y598-M688 HydrophobicContact CD1-CG 4.47Å; Y598-M688 HydrophobicContact CD1-SD 3.75Å; Y598-M688 HydrophobicContact CE1-SD 4.32Å
599	V	79.4	Confident	83.5	Confident	7 Å²	7	43.8 Å²	43.8	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-57.9	-43.8	179.9	159.3	0	0	0	0	112.1	K595 Y597 R603 Q687 E691	K595-V599 WeakPolarHBondContact O-CB 3.47Å; K595-V599 VanDerWaalsContact O-CG2 3.31Å; K595-V599 WeakPolarHBondContact O-CG2 3.29Å; K595-V599 PolarHBondContact O-N 2.91Å; Y597-V599 PolarHBondContact O-N 3.12Å; V599-R603 VanDerWaalsContact CG1-NH1 3.26Å; V599-Q687 HydrophobicContact CG2-CG 4.3Å; V599-E691 HydrophobicContact CG1-CB 4.47Å; V599-E691 WeakPolarHBondContact CG1-OE2 3.36Å; V599-E691 HydrophobicContact CG2-CB 4.32Å; V599-E691 HydrophobicContact CG2-CG 4.41Å; V599-E691 WeakPolarHBondContact CG2-OE1 3.33Å
600	N	80.5	Confident	82.9	Confident	30 Å²	30	42.3 Å²	42.3	16%	0.16	22%	0.218	C	C	.	.	H	α-helix	trans	-87.1	-20.2	-175.1	-69.9	-52.8	0	0	0	113.8	Q596 Y597 Y598 S602 R603 C604	Q596-N600 WeakPolarHBondContact O-CB 3.31Å; Q596-N600 PolarHBondContact O-N 3.38Å; Q596-N600 PolarHBondContact O-ND2 3.17Å; Y597-N600 PolarHBondContact O-N 2.79Å; Y598-N600 VanDerWaalsContact C-N 3.34Å; Y598-N600 PolarHBondContact O-N 3.38Å; N600-S602 VanDerWaalsContact C-N 3.27Å; N600-S602 PolarHBondContact O-N 3.4Å; N600-S602 VanDerWaalsContact O-N 3.12Å; N600-R603 CarbonylContact O-C 3.43Å; N600-R603 WeakPolarHBondContact O-CA 3.4Å; N600-R603 WeakPolarHBondContact O-CB 3.4Å; N600-R603 PolarHBondContact O-N 2.79Å; N600-R603 PolarHBondContact OD1-NH1 3.11Å; N600-C604 PolarHBondContact O-N 3.35Å; N600-C604 PolarHBondContact O-SG 3.16Å
601	L	84.1	Confident	82.5	Confident	19 Å²	19	41 Å²	41	10%	0.099	21%	0.212	C	C	.	.	H	α-helix	trans	-53	-38.7	-176.8	-175.9	61.1	0	0	0	114.1	Y597 Y598 R603 R605 W637 L640 T641 T644	Y597-L601 HydrophobicContact CE1-CD1 4.25Å; Y597-L601 HydrophobicContact CE1-CD2 4.31Å; Y597-L601 WeakPolarHBondContact O-CB 3.46Å; Y597-L601 PolarHBondContact O-N 2.88Å; Y598-L601 PolarHBondContact O-N 3.01Å; L601-R603 VanDerWaalsContact C-N 3.34Å; L601-R605 WeakPolarHBondContact O-CB 3.27Å; L601-R605 PolarHBondContact O-N 3Å; L601-W637 HydrophobicContact CD1-CZ2 4.46Å; L601-W637 HydrophobicContact CG-CZ2 4.28Å; L601-L640 HydrophobicContact CD1-CB 4.07Å; L601-L640 WeakPolarHBondContact CD1-O 3.38Å; L601-T641 HydrophobicContact CD2-CG2 4.46Å; L601-T644 HydrophobicContact CD2-CG2 3.65Å
602	S	78.8	Confident	82.2	Confident	72 Å²	72	43.1 Å²	43.1	50%	0.503	22%	0.224	S	C	.	.	H	α-helix	trans	-68.9	-30.2	175.2	-67.4	0	0	0	0	113.5	N600 S606	N600-S602 VanDerWaalsContact C-N 3.27Å; N600-S602 PolarHBondContact O-N 3.4Å; N600-S602 VanDerWaalsContact O-N 3.12Å; S602-S606 PolarHBondContact O-N 2.86Å; S602-S606 PolarHBondContact O-OG 2.94Å
603	R	74.9	Confident	81.8	Confident	35 Å²	35	47.1 Å²	47.1	13%	0.132	23%	0.23	C	C	.	.	H	α-helix	trans	-78.1	-44.8	176.3	-55.8	168.1	-164	160.6	0.6	109.5	W541 V599 N600 L601 R605 S606 Y607 E691 Q887	W541-R603 HydrophobicContact CE3-CB 4.06Å; W541-R603 HydrophobicContact CZ3-CB 3.62Å; W541-R603 HydrophobicContact CZ3-CG 4.37Å; V599-R603 VanDerWaalsContact CG1-NH1 3.26Å; N600-R603 CarbonylContact O-C 3.43Å; N600-R603 WeakPolarHBondContact O-CA 3.4Å; N600-R603 WeakPolarHBondContact O-CB 3.4Å; N600-R603 PolarHBondContact O-N 2.79Å; N600-R603 PolarHBondContact OD1-NH1 3.11Å; L601-R603 VanDerWaalsContact C-N 3.34Å; R603-R605 VanDerWaalsContact C-N 3.3Å; R603-R605 PolarHBondContact O-N 3.01Å; R603-S606 WeakPolarHBondContact O-CB 3.39Å; R603-S606 PolarHBondContact O-N 3.38Å; R603-Y607 PolarHBondContact O-N 2.86Å; R603-E691 IonicContact NH2-OE2 2.72Å; R603-Q887 VanDerWaalsContact CZ-NE2 3.28Å; R603-Q887 VanDerWaalsContact CZ-OE1 3.25Å; R603-Q887 VanDerWaalsContact NH2-NE2 3.15Å
604	C	81.6	Confident	81.1	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.02	25%	0.247	C	C	.	.	H	α-helix	trans	-62.5	-35	174.7	-55.8	0	0	0	0	112.3	G540 W541 N600 S606 T608	G540-C604 PolarHBondContact O-SG 3.17Å; W541-C604 WeakPolarHBondContact O-CA 3.48Å; W541-C604 WeakPolarHBondContact O-CB 3.14Å; N600-C604 PolarHBondContact O-N 3.35Å; N600-C604 PolarHBondContact O-SG 3.16Å; C604-S606 VanDerWaalsContact C-N 3.32Å; C604-S606 PolarHBondContact O-N 2.89Å; C604-T608 WeakPolarHBondContact O-CB 3.3Å; C604-T608 PolarHBondContact O-N 3.38Å; C604-T608 PolarHBondContact O-OG1 2.93Å
605	R	81.3	Confident	80.6	Confident	94 Å²	94	52.3 Å²	52.3	36%	0.355	26%	0.255	S	S	.	.	H	α-helix	trans	-53.5	-49.5	167.5	-173	177.8	177.8	72.4	-6.8	111.8	L601 R603 Q609 W637	L601-R605 WeakPolarHBondContact O-CB 3.27Å; L601-R605 PolarHBondContact O-N 3Å; R603-R605 VanDerWaalsContact C-N 3.3Å; R603-R605 PolarHBondContact O-N 3.01Å; R605-Q609 WeakPolarHBondContact O-CB 3.44Å; R605-Q609 VanDerWaalsContact O-CG 3.22Å; R605-Q609 WeakPolarHBondContact O-CG 3.22Å; R605-Q609 PolarHBondContact O-N 2.78Å; R605-W637 VanDerWaalsContact CA-NE1 3.34Å; R605-W637 HydrophobicContact CB-CZ2 3.94Å; R605-W637 HydrophobicContact CG-CD2 4.19Å; R605-W637 HydrophobicContact CG-CG 4.46Å; R605-W637 HydrophobicContact CG-CZ2 3.9Å
606	S	74	Confident	80.5	Confident	77 Å²	77	54.7 Å²	54.7	54%	0.538	27%	0.273	S	S	.	.	H	α-helix	trans	-74.6	-41.5	-171.4	-55.5	0	0	0	0	111.1	S602 R603 C604 E610	S602-S606 PolarHBondContact O-N 2.86Å; S602-S606 PolarHBondContact O-OG 2.94Å; R603-S606 WeakPolarHBondContact O-CB 3.39Å; R603-S606 PolarHBondContact O-N 3.38Å; C604-S606 VanDerWaalsContact C-N 3.32Å; C604-S606 PolarHBondContact O-N 2.89Å; S606-E610 PolarHBondContact O-N 2.62Å; S606-E610 VanDerWaalsContact O-N 3.15Å
607	Y	79.4	Confident	80.7	Confident	71 Å²	71	50.3 Å²	50.3	28%	0.278	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-52.4	173.2	-174.7	-92.2	0	0	0	111.7	L537 D538 W541 I542 R603 Q609 E610 A611	L537-Y607 WeakPolarHBondContact CA-OH 3.42Å; L537-Y607 HydrophobicContact CD2-CE1 4.42Å; D538-Y607 PolarHBondContact N-OH 2.97Å; W541-Y607 HydrophobicContact CB-CD1 3.53Å; W541-Y607 HydrophobicContact CB-CD2 3.93Å; W541-Y607 HydrophobicContact CB-CE1 3.82Å; W541-Y607 HydrophobicContact CB-CE2 4.2Å; W541-Y607 HydrophobicContact CB-CG 3.59Å; W541-Y607 HydrophobicContact CG-CD2 4.44Å; W541-Y607 HydrophobicContact CG-CG 4.49Å; W541-Y607 VanDerWaalsContact O-CD1 3.25Å; W541-Y607 WeakPolarHBondContact O-CD1 3.27Å; I542-Y607 HydrophobicContact CD1-CE1 4.29Å; I542-Y607 HydrophobicContact CG1-CD1 3.93Å; I542-Y607 HydrophobicContact CG1-CE1 3.85Å; R603-Y607 PolarHBondContact O-N 2.86Å; Y607-Q609 VanDerWaalsContact C-N 3.32Å; Y607-Q609 PolarHBondContact O-N 2.74Å; Y607-E610 PolarHBondContact O-N 3.07Å; Y607-E610 VanDerWaalsContact O-N 3.13Å; Y607-A611 WeakPolarHBondContact O-CB 3.36Å; Y607-A611 PolarHBondContact O-N 2.96Å
608	T	82.9	Confident	80.7	Confident	10 Å²	10	50.1 Å²	50.1	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-59.1	-42.1	179.1	-57.8	0	0	0	0	111.7	C604 E610 A611 V612 F618 L622	C604-T608 WeakPolarHBondContact O-CB 3.3Å; C604-T608 PolarHBondContact O-N 3.38Å; C604-T608 PolarHBondContact O-OG1 2.93Å; T608-E610 PolarHBondContact O-N 3.1Å; T608-A611 PolarHBondContact O-N 3.12Å; T608-V612 WeakPolarHBondContact O-CG2 3.4Å; T608-V612 PolarHBondContact O-N 2.74Å; T608-F618 HydrophobicContact CG2-CE1 4.11Å; T608-F618 HydrophobicContact CG2-CZ 4.37Å; T608-L622 HydrophobicContact CG2-CD1 4.38Å
609	Q	83.2	Confident	80.8	Confident	99 Å²	99	50.9 Å²	50.9	46%	0.463	26%	0.26	S	S	.	.	H	α-helix	trans	-63.7	-37.6	177.2	-77.8	179.9	22.4	0	0	113	R605 Y607 R613	R605-Q609 WeakPolarHBondContact O-CB 3.44Å; R605-Q609 VanDerWaalsContact O-CG 3.22Å; R605-Q609 WeakPolarHBondContact O-CG 3.22Å; R605-Q609 PolarHBondContact O-N 2.78Å; Y607-Q609 VanDerWaalsContact C-N 3.32Å; Y607-Q609 PolarHBondContact O-N 2.74Å; Q609-R613 VanDerWaalsContact O-CD 3.28Å; Q609-R613 WeakPolarHBondContact O-CD 3.27Å; Q609-R613 WeakPolarHBondContact O-CG 3.3Å; Q609-R613 PolarHBondContact O-N 3.3Å
610	E	75.4	Confident	81.2	Confident	73 Å²	73	50.8 Å²	50.8	34%	0.341	26%	0.259	S	S	.	.	H	α-helix	trans	-79.1	-33.5	176.9	-171.8	58.2	-161.5	0	0	112.1	S606 Y607 T608 V612 R613 Q614	S606-E610 PolarHBondContact O-N 2.62Å; S606-E610 VanDerWaalsContact O-N 3.15Å; Y607-E610 PolarHBondContact O-N 3.07Å; Y607-E610 VanDerWaalsContact O-N 3.13Å; T608-E610 PolarHBondContact O-N 3.1Å; E610-V612 PolarHBondContact O-N 2.95Å; E610-R613 CarbonylContact O-C 3.59Å; E610-R613 WeakPolarHBondContact O-CA 3.43Å; E610-R613 WeakPolarHBondContact O-CB 3.37Å; E610-R613 PolarHBondContact O-N 3.39Å; E610-R613 WeakPolarHBondContact OE2-CD 3.48Å; E610-R613 IonicContact OE2-CZ 3.05Å; E610-R613 IonicContact OE2-NE 3.83Å; E610-R613 PolarHBondContact OE2-NE 3.5Å; E610-R613 IonicContact OE2-NH2 2.77Å; E610-R613 PolarHBondContact OE2-NH2 2.95Å; E610-Q614 HydrophobicContact CG-CG 4.32Å; E610-Q614 WeakPolarHBondContact O-CG 3.42Å; E610-Q614 PolarHBondContact O-N 3.23Å; E610-Q614 PolarHBondContact OE1-NE2 2.91Å
611	A	79.9	Confident	81.7	Confident	6 Å²	6	49.3 Å²	49.3	5%	0.05	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-44.8	170.8	0	0	0	0	0	112.1	L537 Y607 T608 R613 Q614 S615 F618	L537-A611 HydrophobicContact CD1-CB 4.41Å; L537-A611 HydrophobicContact CD2-CB 3.72Å; Y607-A611 WeakPolarHBondContact O-CB 3.36Å; Y607-A611 PolarHBondContact O-N 2.96Å; T608-A611 PolarHBondContact O-N 3.12Å; A611-R613 PolarHBondContact O-N 3.36Å; A611-Q614 PolarHBondContact O-N 3.02Å; A611-S615 PolarHBondContact O-N 2.79Å; A611-F618 HydrophobicContact CB-CD1 3.83Å; A611-F618 HydrophobicContact CB-CE1 3.82Å
612	V	84.5	Confident	81.9	Confident	43 Å²	43	49.4 Å²	49.4	26%	0.261	25%	0.252	S	S	.	.	H	α-helix	trans	-61.6	-30.6	173	168.3	0	0	0	0	112.1	T608 E610 F618 C619 L622	T608-V612 WeakPolarHBondContact O-CG2 3.4Å; T608-V612 PolarHBondContact O-N 2.74Å; E610-V612 PolarHBondContact O-N 2.95Å; V612-F618 HydrophobicContact CG2-CD1 3.68Å; V612-F618 HydrophobicContact CG2-CE1 3.76Å; V612-C619 HydrophobicContact CG1-CB 4.08Å; V612-L622 HydrophobicContact CG2-CD1 3.56Å
613	R	79	Confident	82.3	Confident	144 Å²	144	50.2 Å²	50.2	54%	0.543	25%	0.248	S	C	.	.	H	α-helix	trans	-82.1	-24.3	179	-72.1	168.1	42	52.4	13	113.7	S3 Q609 E610 A611	S3-R613 PolarHBondContact OG-NH1 3.47Å; Q609-R613 VanDerWaalsContact O-CD 3.28Å; Q609-R613 WeakPolarHBondContact O-CD 3.27Å; Q609-R613 WeakPolarHBondContact O-CG 3.3Å; Q609-R613 PolarHBondContact O-N 3.3Å; E610-R613 CarbonylContact O-C 3.59Å; E610-R613 WeakPolarHBondContact O-CA 3.43Å; E610-R613 WeakPolarHBondContact O-CB 3.37Å; E610-R613 PolarHBondContact O-N 3.39Å; E610-R613 WeakPolarHBondContact OE2-CD 3.48Å; E610-R613 IonicContact OE2-CZ 3.05Å; E610-R613 IonicContact OE2-NE 3.83Å; E610-R613 PolarHBondContact OE2-NE 3.5Å; E610-R613 IonicContact OE2-NH2 2.77Å; E610-R613 PolarHBondContact OE2-NH2 2.95Å; A611-R613 PolarHBondContact O-N 3.36Å
614	Q	74.5	Confident	83	Confident	123 Å²	123	48.8 Å²	48.8	58%	0.575	24%	0.242	S	C	*	.	H	α-helix	trans	-95.6	-28.1	179.4	-67.5	-177.4	12.5	0	0	113.2	E610 A611	E610-Q614 HydrophobicContact CG-CG 4.32Å; E610-Q614 WeakPolarHBondContact O-CG 3.42Å; E610-Q614 PolarHBondContact O-N 3.23Å; E610-Q614 PolarHBondContact OE1-NE2 2.91Å; A611-Q614 PolarHBondContact O-N 3.02Å
615	S	79.6	Confident	83.3	Confident	25 Å²	25	48.7 Å²	48.7	18%	0.175	24%	0.241	C	C	.	.			trans	-123.2	104.7	-177.9	-177.4	0	0	0	0	112.5	A611 N617 F618 C619	A611-S615 PolarHBondContact O-N 2.79Å; S615-N617 PolarHBondContact O-N 2.95Å; S615-F618 PolarHBondContact O-N 2.95Å; S615-F618 VanDerWaalsContact O-N 3.09Å; S615-F618 PolarHBondContact OG-N 2.97Å; S615-C619 PolarHBondContact O-N 3.34Å
616	T	83.4	Confident	83.5	Confident	93 Å²	93	46.5 Å²	46.5	57%	0.571	24%	0.237	S	C	*	.	H	α-helix	trans	-57.3	-34.4	171.1	-36.1	0	0	0	0	112	F618 C619 T620	T616-F618 VanDerWaalsContact C-N 3.3Å; T616-F618 PolarHBondContact O-N 2.77Å; T616-C619 WeakPolarHBondContact O-CB 3.38Å; T616-C619 PolarHBondContact O-N 3.37Å; T616-T620 PolarHBondContact O-N 3.39Å; T616-T620 PolarHBondContact O-OG1 2.79Å; T616-T620 VanDerWaalsContact O-OG1 3.12Å
617	N	85.5	Confident	84	Confident	9 Å²	9	49.2 Å²	49.2	5%	0.048	24%	0.241	C	C	.	.	H	α-helix	trans	-66.2	-34.9	178.8	-65.8	4.8	0	0	0	111.3	N347 L375 F534 S615 F621	N347-N617 PolarHBondContact ND2-OD1 3.11Å; L375-N617 HydrophobicContact CD2-CB 4.16Å; F534-N617 HydrophobicContact CE1-CB 4.26Å; S615-N617 PolarHBondContact O-N 2.95Å; N617-F621 WeakPolarHBondContact O-CB 3.31Å; N617-F621 PolarHBondContact O-N 3.47Å
618	F	87.4	Confident	84	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-74	-36.6	175	-173.9	-118.5	0	0	0	111.6	F526 F534 L537 I542 T608 A611 V612 S615 T616 F621 L622	F526-F618 HydrophobicContact CD2-CD2 4.4Å; F526-F618 AromaticContact CD2-CE2 3.96Å; F526-F618 HydrophobicContact CD2-CE2 3.96Å; F526-F618 HydrophobicContact CE2-CD2 4Å; F526-F618 AromaticContact CE2-CE2 3.65Å; F526-F618 HydrophobicContact CE2-CE2 3.65Å; F534-F618 HydrophobicContact CD1-CB 4.32Å; F534-F618 HydrophobicContact CD1-CD2 4.37Å; F534-F618 HydrophobicContact CE1-CB 3.83Å; F534-F618 HydrophobicContact CE1-CD2 4.14Å; F534-F618 HydrophobicContact CE1-CG 4.48Å; F534-F618 HydrophobicContact CZ-CD2 4.36Å; L537-F618 HydrophobicContact CD1-CB 4.17Å; L537-F618 HydrophobicContact CD1-CD1 4.18Å; L537-F618 HydrophobicContact CD1-CD2 3.8Å; L537-F618 HydrophobicContact CD1-CE2 4.22Å; L537-F618 HydrophobicContact CD1-CG 3.79Å; I542-F618 HydrophobicContact CD1-CE1 4.45Å; I542-F618 HydrophobicContact CD1-CE2 3.99Å; I542-F618 HydrophobicContact CD1-CZ 3.69Å; I542-F618 HydrophobicContact CG1-CZ 4.23Å; I542-F618 HydrophobicContact CG2-CZ 4.11Å; T608-F618 HydrophobicContact CG2-CE1 4.11Å; T608-F618 HydrophobicContact CG2-CZ 4.37Å; A611-F618 HydrophobicContact CB-CD1 3.83Å; A611-F618 HydrophobicContact CB-CE1 3.82Å; V612-F618 HydrophobicContact CG2-CD1 3.68Å; V612-F618 HydrophobicContact CG2-CE1 3.76Å; S615-F618 PolarHBondContact O-N 2.95Å; S615-F618 VanDerWaalsContact O-N 3.09Å; S615-F618 PolarHBondContact OG-N 2.97Å; T616-F618 VanDerWaalsContact C-N 3.3Å; T616-F618 PolarHBondContact O-N 2.77Å; F618-F621 HydrophobicContact CD2-CD1 4.04Å; F618-F621 HydrophobicContact CE2-CD1 4.06Å; F618-F621 HydrophobicContact CE2-CE1 4.47Å; F618-F621 WeakPolarHBondContact O-CB 3.16Å; F618-F621 PolarHBondContact O-N 2.92Å; F618-L622 HydrophobicContact CD1-CD1 4.45Å; F618-L622 HydrophobicContact CE1-CD1 3.93Å; F618-L622 HydrophobicContact CE1-CG 4.44Å; F618-L622 HydrophobicContact CE2-CD2 4.29Å; F618-L622 HydrophobicContact CE2-CG 4.38Å; F618-L622 HydrophobicContact CZ-CD1 4.04Å; F618-L622 HydrophobicContact CZ-CD2 4.23Å; F618-L622 HydrophobicContact CZ-CG 4.23Å; F618-L622 PolarHBondContact O-N 3.44Å
619	C	88.3	Confident	83.2	Confident	36 Å²	36	47.3 Å²	47.3	24%	0.243	24%	0.238	C	C	.	.	H	α-helix	trans	-58.8	-49.6	169.5	-166.6	0	0	0	0	111.5	V612 S615 T616 F621 L622 E623	V612-C619 HydrophobicContact CG1-CB 4.08Å; S615-C619 PolarHBondContact O-N 3.34Å; T616-C619 WeakPolarHBondContact O-CB 3.38Å; T616-C619 PolarHBondContact O-N 3.37Å; C619-F621 VanDerWaalsContact C-N 3.3Å; C619-F621 PolarHBondContact O-N 3.31Å; C619-L622 PolarHBondContact O-N 3.17Å; C619-E623 WeakPolarHBondContact O-CB 3.39Å; C619-E623 WeakPolarHBondContact O-CG 3.11Å; C619-E623 PolarHBondContact O-N 3.11Å
620	T	87.9	Confident	82	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.025	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-34	177.2	-61	0	0	0	0	112.7	S372 L375 K376 T616 W624	S372-T620 WeakPolarHBondContact O-CG2 3.49Å; S372-T620 VanDerWaalsContact OG-CG2 3.32Å; S372-T620 WeakPolarHBondContact OG-CG2 3.39Å; S372-T620 PolarHBondContact OG-OG1 2.8Å; L375-T620 HydrophobicContact CB-CG2 4.03Å; L375-T620 HydrophobicContact CD2-CG2 3.64Å; L375-T620 HydrophobicContact CG-CG2 4.37Å; K376-T620 HydrophobicContact CD-CG2 4.27Å; K376-T620 HydrophobicContact CG-CG2 3.56Å; T616-T620 PolarHBondContact O-N 3.39Å; T616-T620 PolarHBondContact O-OG1 2.79Å; T616-T620 VanDerWaalsContact O-OG1 3.12Å; T620-W624 WeakPolarHBondContact O-CB 3.28Å; T620-W624 PolarHBondContact O-N 3.01Å; T620-W624 VanDerWaalsContact O-N 3.09Å
621	F	90.3	Very high	81.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.8	-50.7	173.6	170.4	-106.1	0	0	0	112.5	F379 Y522 P525 F526 F534 N617 F618 C619 E623 W624 A625	F379-F621 HydrophobicContact CD1-CD2 4.43Å; F379-F621 AromaticContact CE1-CD2 3.83Å; F379-F621 HydrophobicContact CE1-CD2 3.83Å; F379-F621 HydrophobicContact CE2-CB 3.9Å; F379-F621 HydrophobicContact CE2-CD2 4.01Å; F379-F621 HydrophobicContact CE2-CG 4.48Å; F379-F621 HydrophobicContact CZ-CB 3.76Å; F379-F621 AromaticContact CZ-CD2 3.62Å; F379-F621 HydrophobicContact CZ-CD2 3.62Å; F379-F621 HydrophobicContact CZ-CG 4.16Å; Y522-F621 WeakPolarHBondContact O-CZ 3.3Å; P525-F621 HydrophobicContact CB-CE2 3.99Å; P525-F621 HydrophobicContact CB-CZ 4.32Å; F526-F621 HydrophobicContact CB-CE1 4.03Å; F526-F621 HydrophobicContact CB-CZ 3.84Å; F526-F621 HydrophobicContact CD2-CD1 4.43Å; F526-F621 AromaticContact CD2-CE1 3.97Å; F526-F621 HydrophobicContact CD2-CE1 3.97Å; F526-F621 HydrophobicContact CD2-CZ 4.5Å; F526-F621 HydrophobicContact CG-CE1 4.49Å; F534-F621 HydrophobicContact CE2-CB 4.5Å; F534-F621 HydrophobicContact CE2-CG 4.28Å; F534-F621 HydrophobicContact CZ-CB 3.94Å; F534-F621 HydrophobicContact CZ-CG 4.2Å; N617-F621 WeakPolarHBondContact O-CB 3.31Å; N617-F621 PolarHBondContact O-N 3.47Å; F618-F621 HydrophobicContact CD2-CD1 4.04Å; F618-F621 HydrophobicContact CE2-CD1 4.06Å; F618-F621 HydrophobicContact CE2-CE1 4.47Å; F618-F621 WeakPolarHBondContact O-CB 3.16Å; F618-F621 PolarHBondContact O-N 2.92Å; C619-F621 VanDerWaalsContact C-N 3.3Å; C619-F621 PolarHBondContact O-N 3.31Å; F621-E623 PolarHBondContact O-N 2.82Å; F621-W624 HydrophobicContact CD2-CE3 4.24Å; F621-W624 HydrophobicContact CE2-CE3 4.18Å; F621-W624 HydrophobicContact CE2-CZ3 4.15Å; F621-W624 WeakPolarHBondContact O-CA 3.16Å; F621-W624 WeakPolarHBondContact O-CB 3.42Å; F621-W624 PolarHBondContact O-N 2.97Å; F621-A625 PolarHBondContact O-N 3.47Å
622	L	89.1	Confident	80.6	Confident	20 Å²	20	55.4 Å²	55.4	11%	0.105	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-43.5	176.5	-64.3	-176	0	0	0	111.3	Y522 T608 V612 F618 C619 W624 A625 D626 L636	Y522-L622 HydrophobicContact CD1-CD2 4.36Å; T608-L622 HydrophobicContact CG2-CD1 4.38Å; V612-L622 HydrophobicContact CG2-CD1 3.56Å; F618-L622 HydrophobicContact CD1-CD1 4.45Å; F618-L622 HydrophobicContact CE1-CD1 3.93Å; F618-L622 HydrophobicContact CE1-CG 4.44Å; F618-L622 HydrophobicContact CE2-CD2 4.29Å; F618-L622 HydrophobicContact CE2-CG 4.38Å; F618-L622 HydrophobicContact CZ-CD1 4.04Å; F618-L622 HydrophobicContact CZ-CD2 4.23Å; F618-L622 HydrophobicContact CZ-CG 4.23Å; F618-L622 PolarHBondContact O-N 3.44Å; C619-L622 PolarHBondContact O-N 3.17Å; L622-W624 PolarHBondContact O-N 2.95Å; L622-W624 VanDerWaalsContact O-N 3.09Å; L622-A625 PolarHBondContact O-N 2.97Å; L622-D626 VanDerWaalsContact O-CB 3.28Å; L622-D626 WeakPolarHBondContact O-CB 3.16Å; L622-D626 PolarHBondContact O-N 2.93Å; L622-L636 HydrophobicContact CD2-CB 4.31Å; L622-L636 HydrophobicContact CD2-CD2 3.56Å
623	E	87.2	Confident	79.9	Confident	89 Å²	89	64.4 Å²	64.4	42%	0.416	31%	0.308	S	S	.	.	H	α-helix	trans	-63.3	-13.3	173.4	-69.8	-179.4	-164.3	0	0	114.2	K376 C619 F621 Q627	K376-E623 PolarHBondContact NZ-O 2.77Å; K376-E623 IonicContact NZ-OE2 2.66Å; K376-E623 PolarHBondContact NZ-OE2 3.34Å; C619-E623 WeakPolarHBondContact O-CB 3.39Å; C619-E623 WeakPolarHBondContact O-CG 3.11Å; C619-E623 PolarHBondContact O-N 3.11Å; F621-E623 PolarHBondContact O-N 2.82Å; E623-Q627 PolarHBondContact O-NE2 2.91Å
624	W	89	Confident	80.1	Confident	6 Å²	6	61.1 Å²	61.1	2%	0.023	30%	0.298	C	S	.	.	H	α-helix	trans	-89.9	-50.7	171	167.8	85.5	0	0	0	110.4	K376 F379 D380 K383 P525 T620 F621 L622 D626 Q627 Q628	K376-W624 HydrophobicContact CD-CB 4.38Å; K376-W624 HydrophobicContact CG-CB 4.17Å; F379-W624 HydrophobicContact CB-CD2 3.46Å; F379-W624 VanDerWaalsContact CB-CD2 3.46Å; F379-W624 HydrophobicContact CB-CE3 3.99Å; F379-W624 HydrophobicContact CB-CG 3.84Å; F379-W624 HydrophobicContact CB-CH2 4.19Å; F379-W624 HydrophobicContact CB-CZ2 3.67Å; F379-W624 HydrophobicContact CB-CZ3 4.33Å; F379-W624 HydrophobicContact CD2-CB 3.91Å; F379-W624 AromaticContact CD2-CD2 3.92Å; F379-W624 HydrophobicContact CD2-CD2 3.92Å; F379-W624 HydrophobicContact CD2-CE3 4.24Å; F379-W624 AromaticContact CD2-CG 3.76Å; F379-W624 HydrophobicContact CD2-CG 3.76Å; F379-W624 HydrophobicContact CE2-CB 4.5Å; F379-W624 AromaticContact CG-CD2 3.95Å; F379-W624 HydrophobicContact CG-CD2 3.95Å; F379-W624 HydrophobicContact CG-CE3 4.17Å; F379-W624 HydrophobicContact CG-CG 4.21Å; F379-W624 WeakPolarHBondContact O-CZ2 3.36Å; D380-W624 PolarHBondContact OD1-NE1 3.42Å; K383-W624 HydrophobicContact CB-CH2 4.34Å; K383-W624 HydrophobicContact CB-CZ2 3.98Å; K383-W624 HydrophobicContact CD-CH2 4.38Å; K383-W624 HydrophobicContact CD-CZ2 4.08Å; P525-W624 HydrophobicContact CB-CH2 4.47Å; P525-W624 HydrophobicContact CB-CZ3 4.14Å; P525-W624 HydrophobicContact CG-CH2 4.43Å; P525-W624 HydrophobicContact CG-CZ3 4.36Å; T620-W624 WeakPolarHBondContact O-CB 3.28Å; T620-W624 PolarHBondContact O-N 3.01Å; T620-W624 VanDerWaalsContact O-N 3.09Å; F621-W624 HydrophobicContact CD2-CE3 4.24Å; F621-W624 HydrophobicContact CE2-CE3 4.18Å; F621-W624 HydrophobicContact CE2-CZ3 4.15Å; F621-W624 WeakPolarHBondContact O-CA 3.16Å; F621-W624 WeakPolarHBondContact O-CB 3.42Å; F621-W624 PolarHBondContact O-N 2.97Å; L622-W624 PolarHBondContact O-N 2.95Å; L622-W624 VanDerWaalsContact O-N 3.09Å; W624-D626 VanDerWaalsContact C-N 3.33Å; W624-D626 PolarHBondContact O-N 2.85Å; W624-Q627 WeakPolarHBondContact O-CB 3.3Å; W624-Q627 PolarHBondContact O-N 3.27Å; W624-Q628 HydrophobicContact CD2-CG 4.06Å; W624-Q628 VanDerWaalsContact CE2-NE2 3.29Å; W624-Q628 HydrophobicContact CE3-CG 4.34Å; W624-Q628 HydrophobicContact CH2-CG 3.99Å; W624-Q628 HydrophobicContact CZ2-CG 3.67Å; W624-Q628 HydrophobicContact CZ3-CG 4.3Å
625	A	87.4	Confident	80.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-38.1	-178.6	0	0	0	0	0	112.5	Y522 F621 L622 Q627 Q628	Y522-A625 HydrophobicContact CD1-CB 3.3Å; Y522-A625 HydrophobicContact CE1-CB 3.36Å; Y522-A625 HydrophobicContact CG-CB 3.99Å; F621-A625 PolarHBondContact O-N 3.47Å; L622-A625 PolarHBondContact O-N 2.97Å; A625-Q627 PolarHBondContact O-N 3.42Å; A625-Q628 PolarHBondContact O-N 2.83Å
626	D	86.5	Confident	80.9	Confident	49 Å²	49	56.9 Å²	56.9	26%	0.262	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-14.1	171.7	-72.6	-8	0	0	0	113.9	Y522 L622 W624 P635 L636	Y522-D626 WeakPolarHBondContact CE1-OD1 3.48Å; Y522-D626 WeakPolarHBondContact OH-CA 3.45Å; Y522-D626 PolarHBondContact OH-OD1 3.28Å; L622-D626 VanDerWaalsContact O-CB 3.28Å; L622-D626 WeakPolarHBondContact O-CB 3.16Å; L622-D626 PolarHBondContact O-N 2.93Å; W624-D626 VanDerWaalsContact C-N 3.33Å; W624-D626 PolarHBondContact O-N 2.85Å; D626-P635 WeakPolarHBondContact OD1-CA 3.33Å; D626-L636 PolarHBondContact OD1-N 3.13Å
627	Q	83.8	Confident	80.9	Confident	133 Å²	133	55.1 Å²	55.1	62%	0.621	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-10.9	175	-63	-180	64.2	0	0	113.6	E623 W624 A625	E623-Q627 PolarHBondContact O-NE2 2.91Å; W624-Q627 WeakPolarHBondContact O-CB 3.3Å; W624-Q627 PolarHBondContact O-N 3.27Å; A625-Q627 PolarHBondContact O-N 3.42Å
628	Q	79.3	Confident	80.9	Confident	28 Å²	28	58 Å²	58	13%	0.131	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-22.2	-174.8	-64.4	-57.7	-35.6	0	0	113.9	D380 K383 Y521 W624 A625	D380-Q628 PolarHBondContact OD1-NE2 2.82Å; K383-Q628 HydrophobicContact CD-CG 4.4Å; K383-Q628 VanDerWaalsContact CD-OE1 3.27Å; Y521-Q628 HydrophobicContact CD1-CB 4.28Å; Y521-Q628 HydrophobicContact CG-CB 4.26Å; W624-Q628 HydrophobicContact CD2-CG 4.06Å; W624-Q628 VanDerWaalsContact CE2-NE2 3.29Å; W624-Q628 HydrophobicContact CE3-CG 4.34Å; W624-Q628 HydrophobicContact CH2-CG 3.99Å; W624-Q628 HydrophobicContact CZ2-CG 3.67Å; W624-Q628 HydrophobicContact CZ3-CG 4.3Å; A625-Q628 PolarHBondContact O-N 2.83Å
629	G	66	Low	81	Confident	14 Å²	14	58.1 Å²	58.1	14%	0.144	28%	0.28	C	S	.	.			trans	-90.3	102.4	177.1	0	0	0	0	0	112.3	D631 H632	G629-D631 VanDerWaalsContact C-N 3.28Å; G629-D631 PolarHBondContact O-N 2.76Å; G629-H632 PolarHBondContact O-N 2.98Å
630	H	57.9	Low	81	Confident	166 Å²	166	56.5 Å²	56.5	77%	0.769	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-34.3	-178	-74.6	-69.2	0	0	0	113.8
631	D	62.1	Low	81	Confident	135 Å²	135	57.7 Å²	57.7	72%	0.722	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-18.7	-176	-58.8	-58.8	0	0	0	114.1	G629	G629-D631 VanDerWaalsContact C-N 3.28Å; G629-D631 PolarHBondContact O-N 2.76Å
632	H	64.6	Low	81	Confident	47 Å²	47	60.5 Å²	60.5	22%	0.218	29%	0.288	C	S	.	.			trans	-131.2	83.4	-165.1	-55.7	-30	0	0	0	112.1	Y514 G629 E634 Q639	Y514-H632 AromaticContact CD2-CD2 3.51Å; Y514-H632 AromaticContact CD2-CE1 3.73Å; Y514-H632 AromaticContact CD2-NE2 3.28Å; Y514-H632 VanDerWaalsContact CD2-NE2 3.28Å; Y514-H632 WeakPolarHBondContact CD2-NE2 3.3Å; Y514-H632 AromaticContact CE2-CD2 3.58Å; Y514-H632 AromaticContact CE2-CG 3.8Å; Y514-H632 AromaticContact CE2-NE2 3.83Å; G629-H632 PolarHBondContact O-N 2.98Å; H632-E634 PolarHBondContact O-N 3.5Å; H632-E634 VanDerWaalsContact O-N 3.09Å; H632-Q639 PolarHBondContact O-NE2 3.42Å
633	R	70.2	Confident	81.1	Confident	232 Å²	232	59.5 Å²	59.5	88%	0.875	28%	0.283	S	S	*	.			trans	-77.5	19.1	178.9	-54.6	-177.3	-176.8	-173.3	0.3	114.6
634	E	81.3	Confident	81	Confident	74 Å²	74	56.4 Å²	56.4	35%	0.346	27%	0.27	S	S	.	.	S	Bend	trans	-98.3	140.9	178.5	-65.9	175.4	151.4	0	0	108.7	H632 D638 Q639 K642	H632-E634 PolarHBondContact O-N 3.5Å; H632-E634 VanDerWaalsContact O-N 3.09Å; E634-D638 HydrophobicContact CB-CB 4.3Å; E634-Q639 HydrophobicContact CB-CG 4.26Å; E634-Q639 WeakPolarHBondContact O-CG 3.25Å; E634-Q639 PolarHBondContact O-NE2 3.12Å; E634-K642 IonicContact OE1-NZ 2.72Å; E634-K642 PolarHBondContact OE1-NZ 2.82Å; E634-K642 WeakPolarHBondContact OE2-CE 3.36Å; E634-K642 IonicContact OE2-NZ 3.17Å; E634-K642 PolarHBondContact OE2-NZ 2.69Å
635	P	83.9	Confident	81	Confident	54 Å²	54	58.2 Å²	58.2	35%	0.351	28%	0.282	S	S	.	.			trans	-69.2	153.4	-178.4	30.5	-36.3	0	0	0	111.6	D626 W637 D638 Q639	D626-P635 WeakPolarHBondContact OD1-CA 3.33Å; P635-W637 PolarHBondContact O-N 3.5Å; P635-D638 WeakPolarHBondContact CD-OD2 3.42Å; P635-D638 HydrophobicContact CG-CB 4.26Å; P635-D638 WeakPolarHBondContact CG-OD2 3.48Å; P635-D638 PolarHBondContact O-N 3.36Å; P635-Q639 PolarHBondContact O-N 2.81Å; P635-Q639 VanDerWaalsContact O-N 3.16Å
636	L	87.5	Confident	81.3	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-37.8	-46.2	-176.7	176.7	59.2	0	0	0	115.1	I518 Y522 I542 F543 L622 D626 Q639 L640	I518-L636 HydrophobicContact CG2-CD1 4.33Å; Y522-L636 HydrophobicContact CD1-CB 3.95Å; Y522-L636 HydrophobicContact CD1-CD1 3.85Å; Y522-L636 HydrophobicContact CD1-CD2 4.05Å; Y522-L636 HydrophobicContact CD1-CG 4.15Å; Y522-L636 HydrophobicContact CD2-CD1 4.2Å; Y522-L636 HydrophobicContact CE1-CB 3.65Å; Y522-L636 HydrophobicContact CE1-CD1 4.21Å; Y522-L636 HydrophobicContact CE1-CG 4.34Å; Y522-L636 HydrophobicContact CG-CD1 3.84Å; I542-L636 HydrophobicContact CG2-CD2 4.32Å; F543-L636 HydrophobicContact CD1-CD1 4.26Å; F543-L636 HydrophobicContact CD1-CD2 4.36Å; F543-L636 HydrophobicContact CE1-CD1 3.93Å; F543-L636 HydrophobicContact CE1-CD2 3.68Å; F543-L636 HydrophobicContact CE1-CG 4.45Å; F543-L636 HydrophobicContact CZ-CD2 4.23Å; L622-L636 HydrophobicContact CD2-CB 4.31Å; L622-L636 HydrophobicContact CD2-CD2 3.56Å; D626-L636 PolarHBondContact OD1-N 3.13Å; L636-Q639 VanDerWaalsContact O-CB 3.31Å; L636-Q639 WeakPolarHBondContact O-CB 3.3Å; L636-Q639 PolarHBondContact O-N 3.17Å; L636-L640 HydrophobicContact CD1-CD1 4.05Å; L636-L640 HydrophobicContact CD1-CG 4.06Å; L636-L640 HydrophobicContact CG-CD1 4.03Å; L636-L640 HydrophobicContact CG-CG 4.45Å; L636-L640 WeakPolarHBondContact O-CG 3.3Å; L636-L640 PolarHBondContact O-N 3.08Å
637	W	84.4	Confident	81.4	Confident	57 Å²	57	56.1 Å²	56.1	22%	0.216	27%	0.27	C	S	.	.	H	α-helix	trans	-68	-40.3	-177.3	-168.3	83.8	0	0	0	113.3	L601 R605 P635 Q639 L640 T641	L601-W637 HydrophobicContact CD1-CZ2 4.46Å; L601-W637 HydrophobicContact CG-CZ2 4.28Å; R605-W637 VanDerWaalsContact CA-NE1 3.34Å; R605-W637 HydrophobicContact CB-CZ2 3.94Å; R605-W637 HydrophobicContact CG-CD2 4.19Å; R605-W637 HydrophobicContact CG-CG 4.46Å; R605-W637 HydrophobicContact CG-CZ2 3.9Å; P635-W637 PolarHBondContact O-N 3.5Å; W637-Q639 PolarHBondContact O-N 3.23Å; W637-L640 PolarHBondContact O-N 3.25Å; W637-T641 HydrophobicContact CD2-CG2 4.33Å; W637-T641 HydrophobicContact CE3-CG2 3.78Å; W637-T641 HydrophobicContact CH2-CG2 3.28Å; W637-T641 HydrophobicContact CZ2-CG2 3.82Å; W637-T641 HydrophobicContact CZ3-CG2 3.24Å; W637-T641 PolarHBondContact O-N 3.34Å
638	D	85.9	Confident	81.7	Confident	68 Å²	68	51.7 Å²	51.7	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-65.7	-30.8	176	-65.7	-20.5	0	0	0	109.7	E634 P635 T641	E634-D638 HydrophobicContact CB-CB 4.3Å; P635-D638 WeakPolarHBondContact CD-OD2 3.42Å; P635-D638 HydrophobicContact CG-CB 4.26Å; P635-D638 WeakPolarHBondContact CG-OD2 3.48Å; P635-D638 PolarHBondContact O-N 3.36Å; D638-T641 PolarHBondContact O-N 2.93Å; D638-T641 PolarHBondContact O-OG1 3.4Å
639	Q	87.8	Confident	82.3	Confident	3 Å²	3	53.7 Å²	53.7	1%	0.014	26%	0.262	C	S	.	.	H	α-helix	trans	-64.3	-43.8	171.1	-61.2	-164.2	15.5	0	0	112.9	Y514 I518 Y522 H632 E634 P635 L636 W637 T641 K642	Y514-Q639 WeakPolarHBondContact OH-CA 3.27Å; Y514-Q639 WeakPolarHBondContact OH-CB 3.31Å; Y514-Q639 WeakPolarHBondContact OH-CG 3.44Å; Y514-Q639 PolarHBondContact OH-O 3.16Å; I518-Q639 HydrophobicContact CD1-CB 4.07Å; I518-Q639 HydrophobicContact CG1-CB 4.41Å; Y522-Q639 PolarHBondContact OH-NE2 2.83Å; Y522-Q639 VanDerWaalsContact OH-NE2 3.16Å; H632-Q639 PolarHBondContact O-NE2 3.42Å; E634-Q639 HydrophobicContact CB-CG 4.26Å; E634-Q639 WeakPolarHBondContact O-CG 3.25Å; E634-Q639 PolarHBondContact O-NE2 3.12Å; P635-Q639 PolarHBondContact O-N 2.81Å; P635-Q639 VanDerWaalsContact O-N 3.16Å; L636-Q639 VanDerWaalsContact O-CB 3.31Å; L636-Q639 WeakPolarHBondContact O-CB 3.3Å; L636-Q639 PolarHBondContact O-N 3.17Å; W637-Q639 PolarHBondContact O-N 3.23Å; Q639-T641 PolarHBondContact O-N 2.94Å; Q639-K642 WeakPolarHBondContact O-CG 3.36Å; Q639-K642 PolarHBondContact O-N 2.9Å
640	L	89.3	Confident	83.5	Confident	2 Å²	2	53 Å²	53	1%	0.01	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-5.2	175.2	-66.9	170.6	0	0	0	114	I518 I542 I546 Y597 L601 L636 W637 P643	I518-L640 HydrophobicContact CG2-CD2 4.38Å; I542-L640 WeakPolarHBondContact O-CD1 3.26Å; I546-L640 HydrophobicContact CD1-CD2 4.33Å; I546-L640 HydrophobicContact CG1-CD2 4.38Å; Y597-L640 WeakPolarHBondContact CE1-O 3.36Å; Y597-L640 WeakPolarHBondContact OH-CA 3.42Å; Y597-L640 WeakPolarHBondContact OH-CB 3.2Å; Y597-L640 WeakPolarHBondContact OH-CD2 3.35Å; Y597-L640 PolarHBondContact OH-O 2.88Å; L601-L640 HydrophobicContact CD1-CB 4.07Å; L601-L640 WeakPolarHBondContact CD1-O 3.38Å; L636-L640 HydrophobicContact CD1-CD1 4.05Å; L636-L640 HydrophobicContact CD1-CG 4.06Å; L636-L640 HydrophobicContact CG-CD1 4.03Å; L636-L640 HydrophobicContact CG-CG 4.45Å; L636-L640 WeakPolarHBondContact O-CG 3.3Å; L636-L640 PolarHBondContact O-N 3.08Å; W637-L640 PolarHBondContact O-N 3.25Å; L640-P643 WeakPolarHBondContact O-CD 3.25Å
641	T	88.3	Confident	85.1	Confident	30 Å²	30	49 Å²	49	18%	0.184	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-7.5	168.3	71.7	0	0	0	0	115	L601 W637 D638 Q639 T644 T645	L601-T641 HydrophobicContact CD2-CG2 4.46Å; W637-T641 HydrophobicContact CD2-CG2 4.33Å; W637-T641 HydrophobicContact CE3-CG2 3.78Å; W637-T641 HydrophobicContact CH2-CG2 3.28Å; W637-T641 HydrophobicContact CZ2-CG2 3.82Å; W637-T641 HydrophobicContact CZ3-CG2 3.24Å; W637-T641 PolarHBondContact O-N 3.34Å; D638-T641 PolarHBondContact O-N 2.93Å; D638-T641 PolarHBondContact O-OG1 3.4Å; Q639-T641 PolarHBondContact O-N 2.94Å; T641-T644 PolarHBondContact O-OG1 2.96Å; T641-T645 PolarHBondContact O-N 3.48Å; T641-T645 PolarHBondContact O-OG1 2.7Å
642	K	89.2	Confident	86.5	Confident	58 Å²	58	48.2 Å²	48.2	25%	0.252	23%	0.228	S	C	.	.	H	α-helix	trans	-66.3	-34.7	175.1	-56.4	-46.9	-174.4	-165.1	0	113.6	Y514 E634 Q639 T644 T645 R646	Y514-K642 HydrophobicContact CD1-CB 4.3Å; Y514-K642 HydrophobicContact CE1-CB 3.56Å; Y514-K642 HydrophobicContact CE1-CG 3.59Å; Y514-K642 HydrophobicContact CE2-CG 4.15Å; Y514-K642 WeakPolarHBondContact OH-CG 3.33Å; E634-K642 IonicContact OE1-NZ 2.72Å; E634-K642 PolarHBondContact OE1-NZ 2.82Å; E634-K642 WeakPolarHBondContact OE2-CE 3.36Å; E634-K642 IonicContact OE2-NZ 3.17Å; E634-K642 PolarHBondContact OE2-NZ 2.69Å; Q639-K642 WeakPolarHBondContact O-CG 3.36Å; Q639-K642 PolarHBondContact O-N 2.9Å; K642-T644 PolarHBondContact O-N 3.09Å; K642-T645 CarbonylContact O-C 3.56Å; K642-T645 WeakPolarHBondContact O-CB 3.28Å; K642-T645 PolarHBondContact O-N 3.43Å; K642-R646 WeakPolarHBondContact O-CB 3.37Å; K642-R646 PolarHBondContact O-N 2.76Å
643	P	90.8	Very high	87.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.4	-44.4	175.4	-26.6	35.7	0	0	0	113.8	Y511 L515 I546 I549 Y594 Y597 L640 T645 R646 L647	Y511-P643 VanDerWaalsContact OH-CA 3.25Å; Y511-P643 WeakPolarHBondContact OH-CA 3.44Å; Y511-P643 VanDerWaalsContact OH-CB 3.3Å; Y511-P643 WeakPolarHBondContact OH-CB 3.17Å; Y511-P643 WeakPolarHBondContact OH-CG 3.19Å; L515-P643 HydrophobicContact CD2-CG 4.32Å; I546-P643 HydrophobicContact CD1-CG 4.08Å; I549-P643 HydrophobicContact CG2-CB 4.45Å; Y594-P643 HydrophobicContact CE1-CB 3.91Å; Y594-P643 WeakPolarHBondContact CE1-O 3.37Å; Y597-P643 HydrophobicContact CD1-CB 4.32Å; Y597-P643 HydrophobicContact CE1-CB 3.86Å; Y597-P643 HydrophobicContact CE1-CG 3.99Å; L640-P643 WeakPolarHBondContact O-CD 3.25Å; P643-T645 VanDerWaalsContact C-N 3.33Å; P643-T645 PolarHBondContact O-N 2.82Å; P643-R646 PolarHBondContact O-N 2.71Å; P643-L647 PolarHBondContact O-N 2.7Å
644	T	86	Confident	88.9	Confident	24 Å²	24	35.5 Å²	35.5	15%	0.147	18%	0.179	C	C	.	.	H	α-helix	trans	-65.3	-39.9	176.9	65	0	0	0	0	111.1	Y597 Y598 L601 T641 K642 L647 T648	Y597-T644 HydrophobicContact CD1-CG2 4.46Å; Y597-T644 HydrophobicContact CE1-CG2 4.46Å; Y598-T644 HydrophobicContact CD1-CG2 4.02Å; Y598-T644 HydrophobicContact CD2-CG2 3.81Å; Y598-T644 HydrophobicContact CE1-CG2 3.85Å; Y598-T644 HydrophobicContact CE2-CG2 3.61Å; Y598-T644 HydrophobicContact CG-CG2 4.02Å; Y598-T644 VanDerWaalsContact CZ-CB 3.41Å; Y598-T644 WeakPolarHBondContact OH-CA 3.39Å; Y598-T644 WeakPolarHBondContact OH-CB 3.43Å; Y598-T644 PolarHBondContact OH-O 2.78Å; L601-T644 HydrophobicContact CD2-CG2 3.65Å; T641-T644 PolarHBondContact O-OG1 2.96Å; K642-T644 PolarHBondContact O-N 3.09Å; T644-L647 PolarHBondContact O-N 2.83Å; T644-T648 PolarHBondContact O-N 3.33Å
645	T	89.6	Confident	89.3	Confident	43 Å²	43	34 Å²	34	26%	0.264	17%	0.172	S	C	.	.	H	α-helix	trans	-61.1	-46.4	173.2	-52.5	0	0	0	0	111.6	I160 T641 K642 P643 L647 T648 Q649	I160-T645 HydrophobicContact CD1-CG2 4.14Å; T641-T645 PolarHBondContact O-N 3.48Å; T641-T645 PolarHBondContact O-OG1 2.7Å; K642-T645 CarbonylContact O-C 3.56Å; K642-T645 WeakPolarHBondContact O-CB 3.28Å; K642-T645 PolarHBondContact O-N 3.43Å; P643-T645 VanDerWaalsContact C-N 3.33Å; P643-T645 PolarHBondContact O-N 2.82Å; T645-L647 PolarHBondContact O-N 2.9Å; T645-T648 PolarHBondContact O-N 3.38Å; T645-T648 PolarHBondContact O-OG1 3.43Å; T645-Q649 WeakPolarHBondContact O-CG 3.46Å; T645-Q649 PolarHBondContact O-N 2.89Å
646	R	93.5	Very high	89.6	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.015	17%	0.168	C	C	.	.	H	α-helix	trans	-60.7	-44.3	179.6	179.3	60.5	177.3	171.8	-0.9	111.7	T507 E508 Y511 K642 P643 T648 Q649 Y650	T507-R646 VanDerWaalsContact CB-NH1 3.32Å; T507-R646 PolarHBondContact OG1-NH1 2.67Å; T507-R646 PolarHBondContact OG1-NH2 3.3Å; T507-R646 VanDerWaalsContact OG1-NH2 3.17Å; E508-R646 IonicContact OE2-CZ 2.72Å; E508-R646 IonicContact OE2-NE 3.97Å; E508-R646 PolarHBondContact OE2-NE 3.12Å; E508-R646 VanDerWaalsContact OE2-NE 3.16Å; E508-R646 IonicContact OE2-NH2 3.63Å; E508-R646 PolarHBondContact OE2-NH2 2.97Å; Y511-R646 HydrophobicContact CD1-CB 4.48Å; Y511-R646 HydrophobicContact CD1-CG 3.68Å; Y511-R646 HydrophobicContact CD2-CB 4.14Å; Y511-R646 HydrophobicContact CD2-CG 4.08Å; Y511-R646 HydrophobicContact CE1-CB 4.21Å; Y511-R646 HydrophobicContact CE1-CG 3.7Å; Y511-R646 HydrophobicContact CE2-CB 3.89Å; Y511-R646 HydrophobicContact CE2-CG 4.14Å; Y511-R646 HydrophobicContact CG-CB 4.44Å; Y511-R646 HydrophobicContact CG-CG 3.87Å; K642-R646 WeakPolarHBondContact O-CB 3.37Å; K642-R646 PolarHBondContact O-N 2.76Å; P643-R646 PolarHBondContact O-N 2.71Å; R646-T648 VanDerWaalsContact C-N 3.27Å; R646-T648 PolarHBondContact O-N 2.82Å; R646-Q649 VanDerWaalsContact CD-OE1 3.3Å; R646-Q649 WeakPolarHBondContact O-CA 3.48Å; R646-Q649 VanDerWaalsContact O-CB 3.3Å; R646-Q649 WeakPolarHBondContact O-CB 3.49Å; R646-Q649 PolarHBondContact O-N 2.76Å; R646-Y650 HydrophobicContact CG-CE2 3.98Å; R646-Y650 PolarHBondContact NE-OH 2.89Å
647	L	89.2	Confident	89.7	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-54.4	-46.5	177.9	-173.5	71.2	0	0	0	111	F591 Y594 Y598 P643 T644 T645 Q649 Y650 F680 I681 I684	F591-L647 HydrophobicContact CD2-CD1 4.15Å; Y594-L647 HydrophobicContact CD1-CB 4.28Å; Y594-L647 HydrophobicContact CD1-CD1 4.45Å; Y594-L647 HydrophobicContact CD1-CD2 4.41Å; Y594-L647 HydrophobicContact CE1-CB 4.33Å; Y598-L647 HydrophobicContact CD2-CD2 4.41Å; Y598-L647 HydrophobicContact CE2-CB 4.35Å; Y598-L647 HydrophobicContact CE2-CD2 3.52Å; P643-L647 PolarHBondContact O-N 2.7Å; T644-L647 PolarHBondContact O-N 2.83Å; T645-L647 PolarHBondContact O-N 2.9Å; L647-Q649 VanDerWaalsContact C-N 3.25Å; L647-Q649 PolarHBondContact O-N 2.7Å; L647-Y650 HydrophobicContact CD1-CD2 4.38Å; L647-Y650 WeakPolarHBondContact O-CD2 3.49Å; L647-Y650 PolarHBondContact O-N 3.36Å; L647-F680 HydrophobicContact CD1-CD1 4.5Å; L647-F680 HydrophobicContact CD1-CE1 4.05Å; L647-I681 HydrophobicContact CD2-CG1 4.39Å; L647-I681 HydrophobicContact CG-CG1 4.12Å; L647-I681 WeakPolarHBondContact O-CD1 3.33Å; L647-I684 HydrophobicContact CD2-CD1 3.59Å; L647-I684 HydrophobicContact CD2-CG2 4.23Å
648	T	88.6	Confident	89.8	Confident	41 Å²	41	33.3 Å²	33.3	25%	0.252	17%	0.168	S	C	.	.	H	α-helix	trans	-66.4	-21.6	176.4	64	0	0	0	0	114.7	T644 T645 R646	T644-T648 PolarHBondContact O-N 3.33Å; T645-T648 PolarHBondContact O-N 3.38Å; T645-T648 PolarHBondContact O-OG1 3.43Å; R646-T648 VanDerWaalsContact C-N 3.27Å; R646-T648 PolarHBondContact O-N 2.82Å
649	Q	92.4	Very high	89.9	Confident	69 Å²	69	36.9 Å²	36.9	32%	0.322	18%	0.181	S	C	.	.	H	α-helix	trans	-71.2	-30.4	177.5	-68.9	171.3	-1.2	0	0	112.4	T645 R646 L647 R651 L652 L653	T645-Q649 WeakPolarHBondContact O-CG 3.46Å; T645-Q649 PolarHBondContact O-N 2.89Å; R646-Q649 VanDerWaalsContact CD-OE1 3.3Å; R646-Q649 WeakPolarHBondContact O-CA 3.48Å; R646-Q649 VanDerWaalsContact O-CB 3.3Å; R646-Q649 WeakPolarHBondContact O-CB 3.49Å; R646-Q649 PolarHBondContact O-N 2.76Å; L647-Q649 VanDerWaalsContact C-N 3.25Å; L647-Q649 PolarHBondContact O-N 2.7Å; Q649-R651 VanDerWaalsContact C-N 3.26Å; Q649-R651 PolarHBondContact O-N 2.69Å; Q649-L652 CarbonylContact O-C 3.57Å; Q649-L652 WeakPolarHBondContact O-CA 3.45Å; Q649-L652 WeakPolarHBondContact O-CB 3.3Å; Q649-L652 PolarHBondContact O-N 2.93Å; Q649-L653 HydrophobicContact CB-CD1 4.27Å; Q649-L653 WeakPolarHBondContact O-CB 3.1Å; Q649-L653 VanDerWaalsContact O-CG 3.32Å; Q649-L653 WeakPolarHBondContact O-CG 3.32Å; Q649-L653 PolarHBondContact O-N 3.09Å
650	Y	92	Very high	89.7	Confident	1 Å²	1	37.9 Å²	37.9	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-39.2	179.7	-62	-63.6	0	0	0	111.9	F504 E508 N553 F591 R646 L647 L652 L653 M654	F504-Y650 HydrophobicContact CD2-CD1 4.31Å; F504-Y650 HydrophobicContact CD2-CE1 4.5Å; F504-Y650 AromaticContact CE2-CD1 3.88Å; F504-Y650 HydrophobicContact CE2-CD1 3.88Å; F504-Y650 AromaticContact CE2-CE1 3.98Å; F504-Y650 HydrophobicContact CE2-CE1 3.98Å; E508-Y650 WeakPolarHBondContact OE2-CE1 3.32Å; E508-Y650 PolarHBondContact OE2-OH 3.2Å; N553-Y650 PolarHBondContact OD1-OH 3.16Å; F591-Y650 HydrophobicContact CD2-CE2 4.25Å; F591-Y650 HydrophobicContact CE2-CD2 4.22Å; F591-Y650 AromaticContact CE2-CE2 3.48Å; F591-Y650 HydrophobicContact CE2-CE2 3.48Å; F591-Y650 VanDerWaalsContact CE2-CE2 3.48Å; F591-Y650 AromaticContact CE2-CZ 3.74Å; F591-Y650 HydrophobicContact CZ-CE2 4.33Å; R646-Y650 HydrophobicContact CG-CE2 3.98Å; R646-Y650 PolarHBondContact NE-OH 2.89Å; L647-Y650 HydrophobicContact CD1-CD2 4.38Å; L647-Y650 WeakPolarHBondContact O-CD2 3.49Å; L647-Y650 PolarHBondContact O-N 3.36Å; Y650-L652 VanDerWaalsContact C-N 3.34Å; Y650-L652 PolarHBondContact O-N 3.23Å; Y650-L653 PolarHBondContact O-N 3.42Å; Y650-M654 WeakPolarHBondContact O-CG 3.32Å; Y650-M654 PolarHBondContact O-N 3.3Å
651	R	90.3	Very high	89.4	Confident	80 Å²	80	38.2 Å²	38.2	30%	0.302	19%	0.189	S	C	.	.	H	α-helix	trans	-60.1	-41.8	173.1	-165.5	177.3	-166.3	173	9.2	112.2	Q649 E655 F674 I677 S678 I681 E682	Q649-R651 VanDerWaalsContact C-N 3.26Å; Q649-R651 PolarHBondContact O-N 2.69Å; R651-E655 VanDerWaalsContact O-CB 3.32Å; R651-E655 WeakPolarHBondContact O-CB 3.39Å; R651-E655 PolarHBondContact O-N 3.34Å; R651-E655 VanDerWaalsContact O-N 3.08Å; R651-F674 HydrophobicContact CG-CD2 4.25Å; R651-F674 HydrophobicContact CG-CE2 3.56Å; R651-F674 HydrophobicContact CG-CZ 4.05Å; R651-F674 WeakPolarHBondContact O-CE2 3.38Å; R651-I677 HydrophobicContact CB-CG2 4.11Å; R651-S678 PolarHBondContact NE-OG 2.87Å; R651-S678 VanDerWaalsContact NH2-CB 3.32Å; R651-S678 PolarHBondContact NH2-OG 2.86Å; R651-I681 HydrophobicContact CB-CD1 3.95Å; R651-E682 IonicContact CZ-OE1 2.76Å; R651-E682 IonicContact NH1-OE1 3.72Å; R651-E682 PolarHBondContact NH1-OE1 3.39Å; R651-E682 IonicContact NH2-OE1 2.73Å; R651-E682 PolarHBondContact NH2-OE1 3.21Å
652	L	92.9	Very high	88.7	Confident	119 Å²	119	39.9 Å²	39.9	62%	0.623	20%	0.2	S	C	*	.	H	α-helix	trans	-72.7	-35.8	179.4	-60.7	177	0	0	0	112.6	Q649 Y650 S656	Q649-L652 CarbonylContact O-C 3.57Å; Q649-L652 WeakPolarHBondContact O-CA 3.45Å; Q649-L652 WeakPolarHBondContact O-CB 3.3Å; Q649-L652 PolarHBondContact O-N 2.93Å; Y650-L652 VanDerWaalsContact C-N 3.34Å; Y650-L652 PolarHBondContact O-N 3.23Å; L652-S656 WeakPolarHBondContact O-CB 3.38Å; L652-S656 PolarHBondContact O-N 3.32Å
653	L	92.6	Very high	88.2	Confident	11 Å²	11	41 Å²	41	6%	0.058	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-44.5	177.5	-70.3	163.5	0	0	0	110.7	E503 F504 Q649 Y650 E655 S656 I657	E503-L653 HydrophobicContact CB-CD2 4.21Å; E503-L653 HydrophobicContact CG-CD2 3.8Å; F504-L653 HydrophobicContact CD2-CD1 4.2Å; Q649-L653 HydrophobicContact CB-CD1 4.27Å; Q649-L653 WeakPolarHBondContact O-CB 3.1Å; Q649-L653 VanDerWaalsContact O-CG 3.32Å; Q649-L653 WeakPolarHBondContact O-CG 3.32Å; Q649-L653 PolarHBondContact O-N 3.09Å; Y650-L653 PolarHBondContact O-N 3.42Å; L653-E655 PolarHBondContact O-N 3Å; L653-S656 VanDerWaalsContact O-CB 3.32Å; L653-S656 WeakPolarHBondContact O-CB 3.32Å; L653-S656 PolarHBondContact O-N 3.38Å; L653-S656 VanDerWaalsContact O-N 3.15Å; L653-I657 WeakPolarHBondContact O-CG1 3.42Å; L653-I657 PolarHBondContact O-N 3.09Å
654	M	90.7	Very high	87.7	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-36.7	174.3	-66.3	-45.5	117.6	0	0	112.7	F504 I584 Y650 S656 I657 R658 F674 I677	F504-M654 HydrophobicContact CB-CE 4.47Å; F504-M654 HydrophobicContact CD1-CE 4.16Å; F504-M654 HydrophobicContact CD2-CE 3.88Å; F504-M654 HydrophobicContact CE1-CE 4.35Å; F504-M654 HydrophobicContact CE2-CE 4.09Å; F504-M654 HydrophobicContact CG-CE 3.92Å; F504-M654 HydrophobicContact CZ-CE 4.32Å; I584-M654 HydrophobicContact CD1-CE 3.49Å; I584-M654 VanDerWaalsContact CD1-CE 3.49Å; I584-M654 HydrophobicContact CD1-CG 3.86Å; I584-M654 HydrophobicContact CD1-SD 3.22Å; I584-M654 WeakPolarHBondContact CD1-SD 3.44Å; Y650-M654 WeakPolarHBondContact O-CG 3.32Å; Y650-M654 PolarHBondContact O-N 3.3Å; M654-S656 VanDerWaalsContact C-N 3.28Å; M654-S656 PolarHBondContact O-N 3.09Å; M654-I657 HydrophobicContact CE-CD1 3.76Å; M654-I657 PolarHBondContact O-N 2.97Å; M654-I657 HydrophobicContact SD-CD1 3.91Å; M654-R658 WeakPolarHBondContact O-CB 3.43Å; M654-R658 PolarHBondContact O-N 3Å; M654-F674 HydrophobicContact CB-CB 4.34Å; M654-F674 HydrophobicContact CB-CD2 4.34Å; M654-I677 HydrophobicContact CG-CD1 3.66Å
655	E	90.4	Very high	87.5	Confident	43 Å²	43	49.5 Å²	49.5	20%	0.201	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-34.2	171.6	178.3	64.1	170.7	0	0	112.6	R651 L653 R658 K659 F674	R651-E655 VanDerWaalsContact O-CB 3.32Å; R651-E655 WeakPolarHBondContact O-CB 3.39Å; R651-E655 PolarHBondContact O-N 3.34Å; R651-E655 VanDerWaalsContact O-N 3.08Å; L653-E655 PolarHBondContact O-N 3Å; E655-R658 IonicContact OE1-NH2 2.68Å; E655-R658 IonicContact OE2-CZ 2.68Å; E655-R658 VanDerWaalsContact OE2-CZ 3.28Å; E655-R658 IonicContact OE2-NE 3.44Å; E655-R658 PolarHBondContact OE2-NE 3.47Å; E655-R658 IonicContact OE2-NH2 3.87Å; E655-R658 PolarHBondContact OE2-NH2 3.34Å; E655-K659 HydrophobicContact CG-CD 4.21Å; E655-K659 WeakPolarHBondContact O-CB 3.43Å; E655-K659 WeakPolarHBondContact O-CD 3.31Å; E655-K659 WeakPolarHBondContact O-CG 3.37Å; E655-K659 PolarHBondContact O-N 3.44Å; E655-K659 VanDerWaalsContact O-N 3.16Å; E655-K659 WeakPolarHBondContact OE1-CE 3.21Å; E655-K659 IonicContact OE1-NZ 2.83Å; E655-K659 PolarHBondContact OE1-NZ 3.48Å; E655-F674 HydrophobicContact CB-CD2 4.16Å; E655-F674 HydrophobicContact CB-CE2 3.88Å
656	S	90.1	Very high	87.2	Confident	38 Å²	38	48.2 Å²	48.2	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-67.4	-42	173.3	-165.5	0	0	0	0	111.8	L652 L653 M654 N660	L652-S656 WeakPolarHBondContact O-CB 3.38Å; L652-S656 PolarHBondContact O-N 3.32Å; L653-S656 VanDerWaalsContact O-CB 3.32Å; L653-S656 WeakPolarHBondContact O-CB 3.32Å; L653-S656 PolarHBondContact O-N 3.38Å; L653-S656 VanDerWaalsContact O-N 3.15Å; M654-S656 VanDerWaalsContact C-N 3.28Å; M654-S656 PolarHBondContact O-N 3.09Å; S656-N660 PolarHBondContact O-ND2 3.09Å
657	I	89.1	Confident	86.8	Confident	4 Å²	4	53 Å²	53	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-46.1	176.3	-66.2	167.6	0	0	0	110.4	A500 I501 P577 L653 M654 K659 N660 C661 V670	A500-I657 HydrophobicContact CB-CG1 3.87Å; I501-I657 HydrophobicContact CG1-CD1 4.05Å; I501-I657 HydrophobicContact CG1-CG1 4.1Å; I501-I657 HydrophobicContact CG1-CG2 4.36Å; P577-I657 HydrophobicContact CB-CG2 3.93Å; P577-I657 HydrophobicContact CG-CG2 4.15Å; L653-I657 WeakPolarHBondContact O-CG1 3.42Å; L653-I657 PolarHBondContact O-N 3.09Å; M654-I657 HydrophobicContact CE-CD1 3.76Å; M654-I657 PolarHBondContact O-N 2.97Å; M654-I657 HydrophobicContact SD-CD1 3.91Å; I657-K659 PolarHBondContact O-N 3Å; I657-N660 CarbonylContact O-C 3.51Å; I657-N660 PolarHBondContact O-N 3.44Å; I657-C661 PolarHBondContact O-N 2.74Å; I657-C661 VanDerWaalsContact O-N 3.13Å; I657-C661 PolarHBondContact O-SG 3.03Å; I657-V670 HydrophobicContact CB-CG1 4.41Å; I657-V670 HydrophobicContact CG2-CG1 4.09Å; I657-V670 HydrophobicContact CG2-CG2 4.17Å
658	R	88.3	Confident	86.7	Confident	59 Å²	59	58.6 Å²	58.6	22%	0.223	31%	0.305	C	S	.	.	H	α-helix	trans	-53.7	-50.6	178.1	-166.1	164.4	65.3	152	1.3	111.4	M654 E655 N660 C661 E667 V670 S671	M654-R658 WeakPolarHBondContact O-CB 3.43Å; M654-R658 PolarHBondContact O-N 3Å; E655-R658 IonicContact OE1-NH2 2.68Å; E655-R658 IonicContact OE2-CZ 2.68Å; E655-R658 VanDerWaalsContact OE2-CZ 3.28Å; E655-R658 IonicContact OE2-NE 3.44Å; E655-R658 PolarHBondContact OE2-NE 3.47Å; E655-R658 IonicContact OE2-NH2 3.87Å; E655-R658 PolarHBondContact OE2-NH2 3.34Å; R658-N660 PolarHBondContact O-N 2.95Å; R658-C661 WeakPolarHBondContact O-CB 3.31Å; R658-C661 PolarHBondContact O-N 3.15Å; R658-C661 VanDerWaalsContact O-N 3.11Å; R658-E667 HydrophobicContact CG-CG 4.35Å; R658-V670 HydrophobicContact CB-CG1 3.73Å; R658-V670 HydrophobicContact CG-CG1 4.29Å; R658-S671 PolarHBondContact NH1-OG 3Å
659	K	87.2	Confident	86.6	Confident	143 Å²	143	58.6 Å²	58.6	62%	0.622	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.3	177.7	-79.9	168.3	165.5	149.6	0	115.8	E655 I657	E655-K659 HydrophobicContact CG-CD 4.21Å; E655-K659 WeakPolarHBondContact O-CB 3.43Å; E655-K659 WeakPolarHBondContact O-CD 3.31Å; E655-K659 WeakPolarHBondContact O-CG 3.37Å; E655-K659 PolarHBondContact O-N 3.44Å; E655-K659 VanDerWaalsContact O-N 3.16Å; E655-K659 WeakPolarHBondContact OE1-CE 3.21Å; E655-K659 IonicContact OE1-NZ 2.83Å; E655-K659 PolarHBondContact OE1-NZ 3.48Å; I657-K659 PolarHBondContact O-N 3Å
660	N	82.9	Confident	86.3	Confident	24 Å²	24	55.3 Å²	55.3	13%	0.128	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	8	177.3	-64.5	-76.1	0	0	0	113.3	K496 R497 S656 I657 R658	K496-N660 HydrophobicContact CB-CB 4.32Å; K496-N660 WeakPolarHBondContact CB-OD1 3.31Å; K496-N660 VanDerWaalsContact CD-OD1 3.31Å; K496-N660 WeakPolarHBondContact CD-OD1 3.4Å; R497-N660 HydrophobicContact CB-CB 4.14Å; R497-N660 WeakPolarHBondContact CG-O 3.36Å; S656-N660 PolarHBondContact O-ND2 3.09Å; I657-N660 CarbonylContact O-C 3.51Å; I657-N660 PolarHBondContact O-N 3.44Å; R658-N660 PolarHBondContact O-N 2.95Å
661	C	82.9	Confident	86.2	Confident	9 Å²	9	56.7 Å²	56.7	6%	0.061	30%	0.296	C	S	.	.			trans	-64.5	159.7	164.9	-65.2	0	0	0	0	110.2	Q493 I657 R658 E666 E667	Q493-C661 PolarHBondContact NE2-O 2.9Å; I657-C661 PolarHBondContact O-N 2.74Å; I657-C661 VanDerWaalsContact O-N 3.13Å; I657-C661 PolarHBondContact O-SG 3.03Å; R658-C661 WeakPolarHBondContact O-CB 3.31Å; R658-C661 PolarHBondContact O-N 3.15Å; R658-C661 VanDerWaalsContact O-N 3.11Å; C661-E666 HydrophobicContact CB-CB 4.3Å; C661-E667 HydrophobicContact CB-CB 4.27Å
662	C	73.8	Confident	86.1	Confident	64 Å²	64	56.5 Å²	56.5	43%	0.432	30%	0.299	S	S	.	.			trans	-135.6	-5.1	178.8	59.4	0	0	0	0	114
663	N	78.5	Confident	85.9	Confident	83 Å²	83	51 Å²	51	44%	0.444	27%	0.27	S	S	.	.	S	Bend	trans	-119.9	130.8	-175.7	-60.8	-27.7	0	0	0	107.9	T665 E666 E667	N663-T665 PolarHBondContact O-N 3.27Å; N663-T665 VanDerWaalsContact O-N 3.13Å; N663-E666 HydrophobicContact CB-CB 4.19Å; N663-E666 HydrophobicContact CB-CG 3.96Å; N663-E666 PolarHBondContact ND2-OE1 2.8Å; N663-E666 WeakPolarHBondContact O-CB 3.29Å; N663-E666 PolarHBondContact O-N 3.04Å; N663-E667 PolarHBondContact O-N 3.46Å
664	S	80.8	Confident	85.8	Confident	100 Å²	100	51.9 Å²	51.9	70%	0.699	27%	0.274	S	S	*	.	H	α-helix	trans	-57.4	-32.6	-175.2	-169.3	0	0	0	0	113.4	Q668	S664-Q668 PolarHBondContact O-N 2.91Å; S664-Q668 VanDerWaalsContact O-N 3.08Å
665	T	82.8	Confident	85.9	Confident	101 Å²	101	55.3 Å²	55.3	62%	0.62	29%	0.292	S	S	*	.	H	α-helix	trans	-70.6	-44.4	176.5	-39.9	0	0	0	0	111.8	N663 E667 Q668 E669	N663-T665 PolarHBondContact O-N 3.27Å; N663-T665 VanDerWaalsContact O-N 3.13Å; T665-E667 VanDerWaalsContact C-N 3.3Å; T665-E667 PolarHBondContact O-N 2.84Å; T665-Q668 PolarHBondContact O-N 3.21Å; T665-E669 WeakPolarHBondContact O-CG 3.34Å; T665-E669 PolarHBondContact O-N 2.69Å; T665-E669 VanDerWaalsContact O-N 3.08Å
666	E	82.1	Confident	85.9	Confident	17 Å²	17	54.8 Å²	54.8	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-42.6	173.9	-70.9	177.8	-164	0	0	110.9	R497 V578 C661 N663 E669 V670	R497-E666 IonicContact CZ-OE1 2.8Å; R497-E666 IonicContact CZ-OE2 2.69Å; R497-E666 IonicContact NH1-OE1 3.81Å; R497-E666 PolarHBondContact NH1-OE1 3.16Å; R497-E666 IonicContact NH1-OE2 2.75Å; R497-E666 PolarHBondContact NH1-OE2 3.01Å; V578-E666 HydrophobicContact CG2-CG 4.34Å; C661-E666 HydrophobicContact CB-CB 4.3Å; N663-E666 HydrophobicContact CB-CB 4.19Å; N663-E666 HydrophobicContact CB-CG 3.96Å; N663-E666 PolarHBondContact ND2-OE1 2.8Å; N663-E666 WeakPolarHBondContact O-CB 3.29Å; N663-E666 PolarHBondContact O-N 3.04Å; E666-E669 PolarHBondContact O-N 2.67Å; E666-V670 WeakPolarHBondContact O-CB 3.32Å; E666-V670 WeakPolarHBondContact O-CG2 3.41Å; E666-V670 PolarHBondContact O-N 3.34Å
667	E	86.2	Confident	85.9	Confident	104 Å²	104	53.1 Å²	53.1	49%	0.486	28%	0.281	S	S	.	.	H	α-helix	trans	-65.5	-39.4	-179.6	-173.4	171.4	-170.8	0	0	112.1	R658 C661 N663 T665 S671	R658-E667 HydrophobicContact CG-CG 4.35Å; C661-E667 HydrophobicContact CB-CB 4.27Å; N663-E667 PolarHBondContact O-N 3.46Å; T665-E667 VanDerWaalsContact C-N 3.3Å; T665-E667 PolarHBondContact O-N 2.84Å; E667-S671 WeakPolarHBondContact O-CB 3.47Å; E667-S671 PolarHBondContact O-N 2.96Å
668	Q	86.2	Confident	86	Confident	119 Å²	119	53.2 Å²	53.2	56%	0.556	28%	0.282	S	S	*	.	H	α-helix	trans	-62.2	-52.2	174.1	-174	-175.6	-40.2	0	0	111.3	S664 T665 V670 S671 E672	S664-Q668 PolarHBondContact O-N 2.91Å; S664-Q668 VanDerWaalsContact O-N 3.08Å; T665-Q668 PolarHBondContact O-N 3.21Å; Q668-V670 VanDerWaalsContact C-N 3.32Å; Q668-V670 PolarHBondContact O-N 3.48Å; Q668-S671 CarbonylContact O-C 3.56Å; Q668-S671 WeakPolarHBondContact O-CA 3.36Å; Q668-S671 WeakPolarHBondContact O-CB 3.32Å; Q668-S671 PolarHBondContact O-N 3.15Å; Q668-E672 PolarHBondContact NE2-OE1 3.3Å; Q668-E672 WeakPolarHBondContact O-CG 3.39Å; Q668-E672 PolarHBondContact O-N 2.87Å
669	E	85.8	Confident	86.1	Confident	40 Å²	40	56.5 Å²	56.5	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-65.9	-34	-177.5	-64.1	-164	108.4	0	0	112.8	V578 K581 T665 E666 S671 E672 M673	V578-E669 VanDerWaalsContact CG1-OE2 3.26Å; V578-E669 WeakPolarHBondContact CG1-OE2 3.28Å; V578-E669 VanDerWaalsContact CG2-OE2 3.25Å; V578-E669 WeakPolarHBondContact CG2-OE2 3.38Å; K581-E669 HydrophobicContact CD-CB 4.33Å; K581-E669 HydrophobicContact CD-CG 4.44Å; K581-E669 VanDerWaalsContact CD-OE1 3.27Å; K581-E669 WeakPolarHBondContact CD-OE1 3.5Å; K581-E669 WeakPolarHBondContact CE-OE1 3.47Å; K581-E669 IonicContact NZ-OE1 2.79Å; K581-E669 PolarHBondContact NZ-OE1 3.29Å; T665-E669 WeakPolarHBondContact O-CG 3.34Å; T665-E669 PolarHBondContact O-N 2.69Å; T665-E669 VanDerWaalsContact O-N 3.08Å; E666-E669 PolarHBondContact O-N 2.67Å; E669-S671 VanDerWaalsContact C-N 3.33Å; E669-E672 PolarHBondContact O-N 3.1Å; E669-M673 WeakPolarHBondContact O-CG 3.45Å; E669-M673 PolarHBondContact O-N 3.21Å
670	V	87.8	Confident	86.3	Confident	1 Å²	1	50 Å²	50	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-71.7	-28.7	172.1	-179.7	0	0	0	0	111.5	P577 I657 R658 E666 Q668 M673 F674	P577-V670 HydrophobicContact CB-CG2 3.53Å; P577-V670 HydrophobicContact CG-CG2 4.47Å; I657-V670 HydrophobicContact CB-CG1 4.41Å; I657-V670 HydrophobicContact CG2-CG1 4.09Å; I657-V670 HydrophobicContact CG2-CG2 4.17Å; R658-V670 HydrophobicContact CB-CG1 3.73Å; R658-V670 HydrophobicContact CG-CG1 4.29Å; E666-V670 WeakPolarHBondContact O-CB 3.32Å; E666-V670 WeakPolarHBondContact O-CG2 3.41Å; E666-V670 PolarHBondContact O-N 3.34Å; Q668-V670 VanDerWaalsContact C-N 3.32Å; Q668-V670 PolarHBondContact O-N 3.48Å; V670-M673 HydrophobicContact CB-CE 4.09Å; V670-M673 HydrophobicContact CG1-CE 4.47Å; V670-M673 HydrophobicContact CG2-CE 3.58Å; V670-F674 WeakPolarHBondContact O-CB 3.15Å; V670-F674 PolarHBondContact O-N 2.68Å
671	S	88.3	Confident	86.6	Confident	29 Å²	29	49.2 Å²	49.2	20%	0.203	27%	0.268	C	S	.	.	H	α-helix	trans	-73.4	-34	171.4	-155.8	0	0	0	0	112.8	R658 E667 Q668 E669 F674 N675	R658-S671 PolarHBondContact NH1-OG 3Å; E667-S671 WeakPolarHBondContact O-CB 3.47Å; E667-S671 PolarHBondContact O-N 2.96Å; Q668-S671 CarbonylContact O-C 3.56Å; Q668-S671 WeakPolarHBondContact O-CA 3.36Å; Q668-S671 WeakPolarHBondContact O-CB 3.32Å; Q668-S671 PolarHBondContact O-N 3.15Å; E669-S671 VanDerWaalsContact C-N 3.33Å; S671-F674 PolarHBondContact O-N 3.35Å; S671-N675 WeakPolarHBondContact O-CB 3.2Å; S671-N675 PolarHBondContact O-N 3.02Å; S671-N675 PolarHBondContact O-OD1 2.76Å
672	E	88.3	Confident	86.9	Confident	77 Å²	77	52.7 Å²	52.7	36%	0.36	28%	0.283	S	S	.	.	H	α-helix	trans	-60.6	-47.9	169.8	-69.8	165.1	-168	0	0	110.4	K581 Q668 E669 F674 N675 S676	K581-E672 WeakPolarHBondContact CE-OE2 3.29Å; K581-E672 IonicContact NZ-OE2 3.91Å; K581-E672 PolarHBondContact NZ-OE2 3.41Å; Q668-E672 PolarHBondContact NE2-OE1 3.3Å; Q668-E672 WeakPolarHBondContact O-CG 3.39Å; Q668-E672 PolarHBondContact O-N 2.87Å; E669-E672 PolarHBondContact O-N 3.1Å; E672-F674 PolarHBondContact O-N 2.94Å; E672-N675 PolarHBondContact O-N 3.43Å; E672-S676 PolarHBondContact O-N 2.82Å; E672-S676 VanDerWaalsContact O-N 3.08Å
673	M	90	Very high	87.7	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.02	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-43.5	173.3	-75.6	-169.5	-73.6	0	0	113.2	K581 I584 E669 V670 I677	K581-M673 WeakPolarHBondContact CA-SD 3.48Å; K581-M673 HydrophobicContact CB-SD 4.19Å; K581-M673 HydrophobicContact CG-CG 4.31Å; K581-M673 HydrophobicContact CG-SD 4.49Å; I584-M673 HydrophobicContact CB-CB 4.4Å; I584-M673 HydrophobicContact CB-CG 4.03Å; I584-M673 HydrophobicContact CB-SD 3.96Å; I584-M673 HydrophobicContact CD1-SD 3.79Å; I584-M673 HydrophobicContact CG1-SD 4.29Å; I584-M673 HydrophobicContact CG2-CB 3.76Å; I584-M673 HydrophobicContact CG2-CG 3.87Å; I584-M673 HydrophobicContact CG2-SD 4.37Å; E669-M673 WeakPolarHBondContact O-CG 3.45Å; E669-M673 PolarHBondContact O-N 3.21Å; V670-M673 HydrophobicContact CB-CE 4.09Å; V670-M673 HydrophobicContact CG1-CE 4.47Å; V670-M673 HydrophobicContact CG2-CE 3.58Å; M673-I677 PolarHBondContact O-N 2.84Å
674	F	90.3	Very high	88.1	Confident	28 Å²	28	50 Å²	50	12%	0.123	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-38.8	178.5	173.6	-90.9	0	0	0	112.6	R651 M654 E655 V670 S671 E672 S678	R651-F674 HydrophobicContact CG-CD2 4.25Å; R651-F674 HydrophobicContact CG-CE2 3.56Å; R651-F674 HydrophobicContact CG-CZ 4.05Å; R651-F674 WeakPolarHBondContact O-CE2 3.38Å; M654-F674 HydrophobicContact CB-CB 4.34Å; M654-F674 HydrophobicContact CB-CD2 4.34Å; E655-F674 HydrophobicContact CB-CD2 4.16Å; E655-F674 HydrophobicContact CB-CE2 3.88Å; V670-F674 WeakPolarHBondContact O-CB 3.15Å; V670-F674 PolarHBondContact O-N 2.68Å; S671-F674 PolarHBondContact O-N 3.35Å; E672-F674 PolarHBondContact O-N 2.94Å; F674-S678 WeakPolarHBondContact CE1-OG 3.41Å; F674-S678 VanDerWaalsContact O-CB 3.28Å; F674-S678 WeakPolarHBondContact O-CB 3.49Å; F674-S678 PolarHBondContact O-N 2.96Å; F674-S678 PolarHBondContact O-OG 3.02Å
675	N	91.3	Very high	88.4	Confident	74 Å²	74	47.9 Å²	47.9	40%	0.396	24%	0.242	S	C	.	.	H	α-helix	trans	-66.7	-48.8	178.1	-70	-3.2	0	0	0	110.7	S671 E672 I677 S678 E679	S671-N675 WeakPolarHBondContact O-CB 3.2Å; S671-N675 PolarHBondContact O-N 3.02Å; S671-N675 PolarHBondContact O-OD1 2.76Å; E672-N675 PolarHBondContact O-N 3.43Å; N675-I677 PolarHBondContact O-N 2.92Å; N675-S678 WeakPolarHBondContact O-CA 3.5Å; N675-S678 VanDerWaalsContact O-CB 3.32Å; N675-S678 WeakPolarHBondContact O-CB 3.31Å; N675-S678 PolarHBondContact O-N 2.85Å; N675-E679 WeakPolarHBondContact O-CG 3.46Å; N675-E679 PolarHBondContact O-N 2.79Å
676	S	91	Very high	88.6	Confident	32 Å²	32	49.3 Å²	49.3	22%	0.224	24%	0.242	C	C	.	.	H	α-helix	trans	-56.4	-45.9	178.2	179	0	0	0	0	112.9	E672 S678 F680	E672-S676 PolarHBondContact O-N 2.82Å; E672-S676 VanDerWaalsContact O-N 3.08Å; S676-S678 VanDerWaalsContact C-N 3.34Å; S676-S678 PolarHBondContact O-N 3.27Å; S676-F680 WeakPolarHBondContact O-CB 3.44Å; S676-F680 PolarHBondContact O-N 3.17Å; S676-F680 VanDerWaalsContact O-N 3.14Å
677	I	90	Very high	88.6	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-64	-38.7	173.5	-73.7	163.8	0	0	0	111.7	I584 I587 R651 M654 M673 N675 I681	I584-I677 HydrophobicContact CB-CD1 4.45Å; I584-I677 HydrophobicContact CD1-CD1 4.14Å; I584-I677 HydrophobicContact CG1-CD1 4.33Å; I584-I677 HydrophobicContact CG2-CD1 3.39Å; I584-I677 HydrophobicContact CG2-CG1 3.74Å; I587-I677 HydrophobicContact CD1-CD1 4.24Å; I587-I677 HydrophobicContact CD1-CG1 4.41Å; R651-I677 HydrophobicContact CB-CG2 4.11Å; M654-I677 HydrophobicContact CG-CD1 3.66Å; M673-I677 PolarHBondContact O-N 2.84Å; N675-I677 PolarHBondContact O-N 2.92Å; I677-I681 HydrophobicContact CG2-CD1 3.55Å; I677-I681 HydrophobicContact CG2-CG1 4.38Å; I677-I681 WeakPolarHBondContact O-CB 3.48Å; I677-I681 WeakPolarHBondContact O-CD1 3.39Å; I677-I681 VanDerWaalsContact O-CG1 3.24Å; I677-I681 WeakPolarHBondContact O-CG1 3.31Å; I677-I681 PolarHBondContact O-N 3.07Å
678	S	91.2	Very high	88.4	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-64.4	-48.4	-179.8	-66.3	0	0	0	0	111.9	R651 F674 N675 S676 I681 E682	R651-S678 PolarHBondContact NE-OG 2.87Å; R651-S678 VanDerWaalsContact NH2-CB 3.32Å; R651-S678 PolarHBondContact NH2-OG 2.86Å; F674-S678 WeakPolarHBondContact CE1-OG 3.41Å; F674-S678 VanDerWaalsContact O-CB 3.28Å; F674-S678 WeakPolarHBondContact O-CB 3.49Å; F674-S678 PolarHBondContact O-N 2.96Å; F674-S678 PolarHBondContact O-OG 3.02Å; N675-S678 WeakPolarHBondContact O-CA 3.5Å; N675-S678 VanDerWaalsContact O-CB 3.32Å; N675-S678 WeakPolarHBondContact O-CB 3.31Å; N675-S678 PolarHBondContact O-N 2.85Å; S676-S678 VanDerWaalsContact C-N 3.34Å; S676-S678 PolarHBondContact O-N 3.27Å; S678-I681 PolarHBondContact O-N 3.36Å; S678-E682 WeakPolarHBondContact O-CB 3.34Å; S678-E682 WeakPolarHBondContact O-CG 3.22Å; S678-E682 PolarHBondContact O-N 2.84Å
679	E	91.5	Very high	88.1	Confident	128 Å²	128	46.5 Å²	46.5	60%	0.598	23%	0.23	S	C	*	.	H	α-helix	trans	-60.6	-45.4	178.4	-71.7	164.8	-156.1	0	0	111.1	N675 I681 E682 E683	N675-E679 WeakPolarHBondContact O-CG 3.46Å; N675-E679 PolarHBondContact O-N 2.79Å; E679-I681 PolarHBondContact O-N 2.81Å; E679-E682 PolarHBondContact O-N 3.19Å; E679-E683 WeakPolarHBondContact O-CB 3.44Å; E679-E683 PolarHBondContact O-N 3.13Å
680	F	91.2	Very high	87.9	Confident	8 Å²	8	48.7 Å²	48.7	4%	0.035	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-40	176.8	179.3	-115.4	0	0	0	113.6	I587 P588 F591 L647 S676 E682 E683 I684	I587-F680 HydrophobicContact CG2-CD1 4.19Å; I587-F680 HydrophobicContact CG2-CE1 4.25Å; P588-F680 HydrophobicContact CB-CB 4.47Å; P588-F680 HydrophobicContact CB-CD2 3.73Å; P588-F680 HydrophobicContact CB-CE2 4.09Å; P588-F680 HydrophobicContact CB-CG 4.1Å; P588-F680 HydrophobicContact CG-CB 4.2Å; P588-F680 HydrophobicContact CG-CD2 4.34Å; P588-F680 HydrophobicContact CG-CG 4.22Å; P588-F680 WeakPolarHBondContact O-CE2 3.46Å; F591-F680 HydrophobicContact CB-CE1 3.81Å; F591-F680 HydrophobicContact CB-CZ 3.89Å; L647-F680 HydrophobicContact CD1-CD1 4.5Å; L647-F680 HydrophobicContact CD1-CE1 4.05Å; S676-F680 WeakPolarHBondContact O-CB 3.44Å; S676-F680 PolarHBondContact O-N 3.17Å; S676-F680 VanDerWaalsContact O-N 3.14Å; F680-E682 VanDerWaalsContact C-N 3.35Å; F680-E683 PolarHBondContact O-N 3.19Å; F680-I684 HydrophobicContact CD1-CD1 4.12Å; F680-I684 HydrophobicContact CD2-CD1 4.44Å; F680-I684 HydrophobicContact CE1-CD1 3.6Å; F680-I684 HydrophobicContact CE2-CD1 3.97Å; F680-I684 HydrophobicContact CZ-CD1 3.52Å; F680-I684 PolarHBondContact O-N 3.12Å
681	I	89	Confident	87.5	Confident	7 Å²	7	50.8 Å²	50.8	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-67.7	-37.4	174.2	-71.8	167.9	0	0	0	110.8	L647 R651 I677 S678 E679 I684 N685	L647-I681 HydrophobicContact CD2-CG1 4.39Å; L647-I681 HydrophobicContact CG-CG1 4.12Å; L647-I681 WeakPolarHBondContact O-CD1 3.33Å; R651-I681 HydrophobicContact CB-CD1 3.95Å; I677-I681 HydrophobicContact CG2-CD1 3.55Å; I677-I681 HydrophobicContact CG2-CG1 4.38Å; I677-I681 WeakPolarHBondContact O-CB 3.48Å; I677-I681 WeakPolarHBondContact O-CD1 3.39Å; I677-I681 VanDerWaalsContact O-CG1 3.24Å; I677-I681 WeakPolarHBondContact O-CG1 3.31Å; I677-I681 PolarHBondContact O-N 3.07Å; S678-I681 PolarHBondContact O-N 3.36Å; E679-I681 PolarHBondContact O-N 2.81Å; I681-I684 PolarHBondContact O-N 2.64Å; I681-N685 WeakPolarHBondContact CG2-ND2 3.35Å; I681-N685 WeakPolarHBondContact O-CB 3.38Å; I681-N685 PolarHBondContact O-N 3.42Å; I681-N685 PolarHBondContact O-ND2 3Å
682	E	89.8	Confident	86.9	Confident	81 Å²	81	51.5 Å²	51.5	38%	0.379	26%	0.259	S	S	.	.	H	α-helix	trans	-71.4	-34.8	178.4	-74.1	169.1	-157	0	0	111.4	R651 S678 E679 F680 N685 Q686	R651-E682 IonicContact CZ-OE1 2.76Å; R651-E682 IonicContact NH1-OE1 3.72Å; R651-E682 PolarHBondContact NH1-OE1 3.39Å; R651-E682 IonicContact NH2-OE1 2.73Å; R651-E682 PolarHBondContact NH2-OE1 3.21Å; S678-E682 WeakPolarHBondContact O-CB 3.34Å; S678-E682 WeakPolarHBondContact O-CG 3.22Å; S678-E682 PolarHBondContact O-N 2.84Å; E679-E682 PolarHBondContact O-N 3.19Å; F680-E682 VanDerWaalsContact C-N 3.35Å; E682-N685 PolarHBondContact O-N 2.88Å; E682-Q686 WeakPolarHBondContact O-CB 3.4Å; E682-Q686 VanDerWaalsContact O-CG 3.23Å; E682-Q686 WeakPolarHBondContact O-CG 3.41Å; E682-Q686 PolarHBondContact O-N 3.22Å
683	E	89.8	Confident	86.5	Confident	89 Å²	89	54 Å²	54	42%	0.416	27%	0.269	S	S	.	.	H	α-helix	trans	-60.5	-50.7	168.9	-165.1	-155.8	166.6	0	0	111.8	K595 E679 F680 N685 Q686 Q687	K595-E683 WeakPolarHBondContact CE-OE1 3.38Å; K595-E683 VanDerWaalsContact CE-OE2 3.28Å; K595-E683 WeakPolarHBondContact CE-OE2 3.41Å; K595-E683 IonicContact NZ-OE1 3.71Å; K595-E683 PolarHBondContact NZ-OE1 2.94Å; K595-E683 IonicContact NZ-OE2 2.69Å; K595-E683 PolarHBondContact NZ-OE2 3.26Å; E679-E683 WeakPolarHBondContact O-CB 3.44Å; E679-E683 PolarHBondContact O-N 3.13Å; F680-E683 PolarHBondContact O-N 3.19Å; E683-N685 VanDerWaalsContact C-N 3.31Å; E683-N685 PolarHBondContact O-N 2.73Å; E683-Q686 PolarHBondContact O-N 2.84Å; E683-Q686 VanDerWaalsContact O-N 3.16Å; E683-Q687 PolarHBondContact O-N 2.87Å
684	I	87.3	Confident	86.1	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-58.6	-42	177.4	-78.5	167.6	0	0	0	111.4	K595 Y598 L647 F680 I681 M688	K595-I684 HydrophobicContact CG-CD1 4.21Å; K595-I684 HydrophobicContact CG-CG1 3.59Å; Y598-I684 HydrophobicContact CD1-CG2 4.03Å; Y598-I684 HydrophobicContact CD2-CG2 3.77Å; Y598-I684 HydrophobicContact CE1-CG2 4.21Å; Y598-I684 HydrophobicContact CE2-CG2 3.98Å; Y598-I684 HydrophobicContact CG-CG2 3.78Å; L647-I684 HydrophobicContact CD2-CD1 3.59Å; L647-I684 HydrophobicContact CD2-CG2 4.23Å; F680-I684 HydrophobicContact CD1-CD1 4.12Å; F680-I684 HydrophobicContact CD2-CD1 4.44Å; F680-I684 HydrophobicContact CE1-CD1 3.6Å; F680-I684 HydrophobicContact CE2-CD1 3.97Å; F680-I684 HydrophobicContact CZ-CD1 3.52Å; F680-I684 PolarHBondContact O-N 3.12Å; I681-I684 PolarHBondContact O-N 2.64Å; I684-M688 VanDerWaalsContact O-CB 3.3Å; I684-M688 WeakPolarHBondContact O-CB 3.35Å; I684-M688 PolarHBondContact O-N 3.48Å
685	N	86.5	Confident	85.6	Confident	57 Å²	57	57.5 Å²	57.5	31%	0.305	29%	0.286	S	S	.	.	H	α-helix	trans	-67.3	-39.7	176.9	-76.5	-58.3	0	0	0	112.2	I681 E682 E683 M689	I681-N685 WeakPolarHBondContact CG2-ND2 3.35Å; I681-N685 WeakPolarHBondContact O-CB 3.38Å; I681-N685 PolarHBondContact O-N 3.42Å; I681-N685 PolarHBondContact O-ND2 3Å; E682-N685 PolarHBondContact O-N 2.88Å; E683-N685 VanDerWaalsContact C-N 3.31Å; E683-N685 PolarHBondContact O-N 2.73Å; N685-M689 WeakPolarHBondContact O-CB 3.49Å; N685-M689 WeakPolarHBondContact O-CG 3.25Å; N685-M689 PolarHBondContact O-N 3.43Å
686	Q	86.7	Confident	85.1	Confident	131 Å²	131	59.8 Å²	59.8	61%	0.612	29%	0.294	S	S	*	.	H	α-helix	trans	-63.9	-43.8	175.5	-74.9	174.2	50.4	0	0	111.8	E682 E683 M689 T690	E682-Q686 WeakPolarHBondContact O-CB 3.4Å; E682-Q686 VanDerWaalsContact O-CG 3.23Å; E682-Q686 WeakPolarHBondContact O-CG 3.41Å; E682-Q686 PolarHBondContact O-N 3.22Å; E683-Q686 PolarHBondContact O-N 2.84Å; E683-Q686 VanDerWaalsContact O-N 3.16Å; Q686-M689 PolarHBondContact O-N 3.35Å; Q686-T690 WeakPolarHBondContact O-CB 3.4Å; Q686-T690 PolarHBondContact O-N 3.06Å; Q686-T690 PolarHBondContact O-OG1 3.15Å
687	Q	82.9	Confident	84.8	Confident	64 Å²	64	60.8 Å²	60.8	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-62	-51.8	174.9	-176.7	176.1	-2.9	0	0	111.1	V599 E683 M689 T690 E691	V599-Q687 HydrophobicContact CG2-CG 4.3Å; E683-Q687 PolarHBondContact O-N 2.87Å; Q687-M689 VanDerWaalsContact C-N 3.33Å; Q687-M689 PolarHBondContact O-N 3.44Å; Q687-T690 PolarHBondContact O-N 2.91Å; Q687-T690 VanDerWaalsContact O-N 3.13Å; Q687-E691 HydrophobicContact CG-CG 4.42Å; Q687-E691 WeakPolarHBondContact CG-OE1 3.48Å; Q687-E691 PolarHBondContact NE2-OE1 3.04Å; Q687-E691 PolarHBondContact O-N 2.99Å
688	M	81.2	Confident	84.6	Confident	46 Å²	46	60.7 Å²	60.7	23%	0.227	30%	0.301	C	S	.	.	H	α-helix	trans	-54.8	-46.5	177.8	-179.6	-161.2	66.2	0	0	111.9	Y598 I684 T690 T692	Y598-M688 HydrophobicContact CD1-CG 4.47Å; Y598-M688 HydrophobicContact CD1-SD 3.75Å; Y598-M688 HydrophobicContact CE1-SD 4.32Å; I684-M688 VanDerWaalsContact O-CB 3.3Å; I684-M688 WeakPolarHBondContact O-CB 3.35Å; I684-M688 PolarHBondContact O-N 3.48Å; M688-T690 VanDerWaalsContact C-N 3.34Å; M688-T690 PolarHBondContact O-N 3.44Å; M688-T692 VanDerWaalsContact O-CB 3.25Å; M688-T692 WeakPolarHBondContact O-CB 3.4Å; M688-T692 PolarHBondContact O-N 3.5Å; M688-T692 PolarHBondContact O-OG1 3.01Å
689	M	80.4	Confident	84.2	Confident	71 Å²	71	64.1 Å²	64.1	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-67.1	-35.2	179.8	-72.8	-68.6	-87	0	0	112.3	N685 Q686 Q687 K693	N685-M689 WeakPolarHBondContact O-CB 3.49Å; N685-M689 WeakPolarHBondContact O-CG 3.25Å; N685-M689 PolarHBondContact O-N 3.43Å; Q686-M689 PolarHBondContact O-N 3.35Å; Q687-M689 VanDerWaalsContact C-N 3.33Å; Q687-M689 PolarHBondContact O-N 3.44Å; M689-K693 WeakPolarHBondContact O-CB 3.41Å; M689-K693 WeakPolarHBondContact O-CD 3.46Å; M689-K693 WeakPolarHBondContact O-CG 3.23Å; M689-K693 PolarHBondContact O-N 2.81Å
690	T	82	Confident	83.9	Confident	85 Å²	85	62.5 Å²	62.5	52%	0.521	31%	0.311	S	S	.	.	H	α-helix	trans	-69.3	-51	177	-57.8	0	0	0	0	110.9	Q686 Q687 M688 T692 K693 T694	Q686-T690 WeakPolarHBondContact O-CB 3.4Å; Q686-T690 PolarHBondContact O-N 3.06Å; Q686-T690 PolarHBondContact O-OG1 3.15Å; Q687-T690 PolarHBondContact O-N 2.91Å; Q687-T690 VanDerWaalsContact O-N 3.13Å; M688-T690 VanDerWaalsContact C-N 3.34Å; M688-T690 PolarHBondContact O-N 3.44Å; T690-T692 VanDerWaalsContact C-N 3.32Å; T690-T692 PolarHBondContact O-N 2.82Å; T690-K693 PolarHBondContact O-N 2.88Å; T690-T694 PolarHBondContact O-N 3.45Å; T690-T694 PolarHBondContact O-OG1 2.98Å
691	E	78.5	Confident	83.8	Confident	46 Å²	46	62.5 Å²	62.5	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-68.3	-29.1	-179.2	-71.2	-164	-128.6	0	0	113.5	V599 R603 Q687 T694 W695	V599-E691 HydrophobicContact CG1-CB 4.47Å; V599-E691 WeakPolarHBondContact CG1-OE2 3.36Å; V599-E691 HydrophobicContact CG2-CB 4.32Å; V599-E691 HydrophobicContact CG2-CG 4.41Å; V599-E691 WeakPolarHBondContact CG2-OE1 3.33Å; R603-E691 IonicContact NH2-OE2 2.72Å; Q687-E691 HydrophobicContact CG-CG 4.42Å; Q687-E691 WeakPolarHBondContact CG-OE1 3.48Å; Q687-E691 PolarHBondContact NE2-OE1 3.04Å; Q687-E691 PolarHBondContact O-N 2.99Å; E691-T694 WeakPolarHBondContact CA-OG1 3.48Å; E691-T694 PolarHBondContact O-OG1 3.45Å; E691-T694 VanDerWaalsContact O-OG1 3.07Å; E691-W695 WeakPolarHBondContact O-CB 3.38Å; E691-W695 PolarHBondContact O-N 3.25Å; E691-W695 VanDerWaalsContact O-N 3.12Å
692	T	75.7	Confident	83.6	Confident	44 Å²	44	62.4 Å²	62.4	27%	0.27	31%	0.311	S	S	.	.	H	α-helix	trans	-66	-49.1	171.3	-58.6	0	0	0	0	110.4	M688 T690 T694 W695 E696	M688-T692 VanDerWaalsContact O-CB 3.25Å; M688-T692 WeakPolarHBondContact O-CB 3.4Å; M688-T692 PolarHBondContact O-N 3.5Å; M688-T692 PolarHBondContact O-OG1 3.01Å; T690-T692 VanDerWaalsContact C-N 3.32Å; T690-T692 PolarHBondContact O-N 2.82Å; T692-T694 PolarHBondContact O-N 3.13Å; T692-W695 PolarHBondContact O-N 3.32Å; T692-E696 HydrophobicContact CG2-CG 4.38Å; T692-E696 WeakPolarHBondContact O-CG 3.28Å; T692-E696 PolarHBondContact O-N 3.39Å
693	K	80	Confident	83.1	Confident	130 Å²	130	61 Å²	61	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-61.2	-40.9	178.3	-72.1	168.1	-175.2	178.2	0	112.7	M689 T690 W695 S697	M689-K693 WeakPolarHBondContact O-CB 3.41Å; M689-K693 WeakPolarHBondContact O-CD 3.46Å; M689-K693 WeakPolarHBondContact O-CG 3.23Å; M689-K693 PolarHBondContact O-N 2.81Å; T690-K693 PolarHBondContact O-N 2.88Å; K693-W695 VanDerWaalsContact C-N 3.35Å; K693-S697 WeakPolarHBondContact O-CB 3.47Å; K693-S697 PolarHBondContact O-N 2.9Å
694	T	82.3	Confident	82.9	Confident	42 Å²	42	60.1 Å²	60.1	26%	0.258	31%	0.306	S	S	.	.	H	α-helix	trans	-67	-36.1	176.8	53.3	0	0	0	0	112.3	T690 E691 T692 L698 T889	T690-T694 PolarHBondContact O-N 3.45Å; T690-T694 PolarHBondContact O-OG1 2.98Å; E691-T694 WeakPolarHBondContact CA-OG1 3.48Å; E691-T694 PolarHBondContact O-OG1 3.45Å; E691-T694 VanDerWaalsContact O-OG1 3.07Å; T692-T694 PolarHBondContact O-N 3.13Å; T694-L698 PolarHBondContact O-N 3.34Å; T694-L698 VanDerWaalsContact O-N 3.13Å; T694-T889 HydrophobicContact CG2-CG2 4.31Å
695	W	78.4	Confident	82.8	Confident	62 Å²	62	60.1 Å²	60.1	24%	0.235	31%	0.306	C	S	.	.	H	α-helix	trans	-70.3	-44.5	175.3	179.5	-105.7	0	0	0	112.7	E691 T692 K693 S697 L698 E699 L733 Q887	E691-W695 WeakPolarHBondContact O-CB 3.38Å; E691-W695 PolarHBondContact O-N 3.25Å; E691-W695 VanDerWaalsContact O-N 3.12Å; T692-W695 PolarHBondContact O-N 3.32Å; K693-W695 VanDerWaalsContact C-N 3.35Å; W695-S697 VanDerWaalsContact C-N 3.26Å; W695-S697 PolarHBondContact O-N 3.01Å; W695-L698 HydrophobicContact CE3-CD2 3.94Å; W695-L698 HydrophobicContact CZ3-CD2 3.84Å; W695-L698 PolarHBondContact O-N 2.86Å; W695-L698 VanDerWaalsContact O-N 3.09Å; W695-E699 PolarHBondContact O-N 2.72Å; W695-L733 HydrophobicContact CH2-CB 3.88Å; W695-L733 HydrophobicContact CH2-CD2 3.89Å; W695-L733 HydrophobicContact CH2-CG 4.3Å; W695-L733 HydrophobicContact CZ2-CD2 4.28Å; W695-L733 HydrophobicContact CZ3-CB 4.41Å; W695-L733 HydrophobicContact CZ3-CD2 4.05Å; W695-Q887 HydrophobicContact CE3-CG 4.49Å
696	E	81.6	Confident	82.3	Confident	123 Å²	123	59 Å²	59	58%	0.575	30%	0.299	S	S	*	.	H	α-helix	trans	-60	-38.2	175.9	-73.3	-178.5	155.7	0	0	111.6	T692 E699 L700	T692-E696 HydrophobicContact CG2-CG 4.38Å; T692-E696 WeakPolarHBondContact O-CG 3.28Å; T692-E696 PolarHBondContact O-N 3.39Å; E696-E699 PolarHBondContact O-N 2.94Å; E696-L700 WeakPolarHBondContact O-CB 3.48Å; E696-L700 PolarHBondContact O-N 2.88Å
697	S	85.2	Confident	81.3	Confident	53 Å²	53	53.8 Å²	53.8	37%	0.371	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-45.5	171.8	-173.5	0	0	0	0	112.2	K693 W695 L700 L701	K693-S697 WeakPolarHBondContact O-CB 3.47Å; K693-S697 PolarHBondContact O-N 2.9Å; W695-S697 VanDerWaalsContact C-N 3.26Å; W695-S697 PolarHBondContact O-N 3.01Å; S697-L700 PolarHBondContact O-N 3.26Å; S697-L701 WeakPolarHBondContact O-CB 3.22Å; S697-L701 PolarHBondContact O-N 3.12Å
698	L	86.5	Confident	79.7	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-40.4	177.3	-169.5	78.1	0	0	0	112.5	T694 W695 L701 A702 I732 L733 R888 V890 L913	T694-L698 PolarHBondContact O-N 3.34Å; T694-L698 VanDerWaalsContact O-N 3.13Å; W695-L698 HydrophobicContact CE3-CD2 3.94Å; W695-L698 HydrophobicContact CZ3-CD2 3.84Å; W695-L698 PolarHBondContact O-N 2.86Å; W695-L698 VanDerWaalsContact O-N 3.09Å; L698-L701 WeakPolarHBondContact O-CB 3.48Å; L698-L701 PolarHBondContact O-N 3.25Å; L698-A702 VanDerWaalsContact O-CB 3.29Å; L698-A702 WeakPolarHBondContact O-CB 3.48Å; L698-A702 PolarHBondContact O-N 3.05Å; L698-I732 HydrophobicContact CD1-CG2 4.12Å; L698-I732 HydrophobicContact CG-CG2 4.44Å; L698-L733 HydrophobicContact CD2-CD2 3.72Å; L698-L733 HydrophobicContact CG-CD2 3.91Å; L698-R888 HydrophobicContact CD1-CG 4.36Å; L698-R888 HydrophobicContact CD2-CB 4.4Å; L698-R888 WeakPolarHBondContact CD2-O 3.44Å; L698-V890 HydrophobicContact CB-CG2 4.48Å; L698-V890 HydrophobicContact CD1-CG2 3.9Å; L698-L913 HydrophobicContact CD1-CD2 3.7Å
699	E	82.2	Confident	78.2	Confident	77 Å²	77	56.1 Å²	56.1	36%	0.36	30%	0.296	S	S	.	.	H	α-helix	trans	-71.1	-35.2	175.9	177.8	149.5	-139.3	0	0	112.1	W695 E696 L701 A702 S703 K729 L733	W695-E699 PolarHBondContact O-N 2.72Å; E696-E699 PolarHBondContact O-N 2.94Å; E699-L701 VanDerWaalsContact C-N 3.3Å; E699-L701 PolarHBondContact O-N 3.26Å; E699-A702 PolarHBondContact O-N 3.46Å; E699-S703 VanDerWaalsContact O-CB 3.23Å; E699-S703 WeakPolarHBondContact O-CB 3.47Å; E699-S703 PolarHBondContact O-N 3.14Å; E699-S703 PolarHBondContact O-OG 3.27Å; E699-K729 IonicContact OE1-NZ 2.74Å; E699-K729 PolarHBondContact OE1-NZ 3.05Å; E699-L733 HydrophobicContact CB-CD2 4.45Å
700	L	85.9	Confident	76.5	Confident	94 Å²	94	55.5 Å²	55.5	49%	0.492	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-36.5	172.3	-174.7	64	0	0	0	111.8	E696 S697 S703 K704	E696-L700 WeakPolarHBondContact O-CB 3.48Å; E696-L700 PolarHBondContact O-N 2.88Å; S697-L700 PolarHBondContact O-N 3.26Å; L700-S703 PolarHBondContact O-OG 3.21Å; L700-K704 HydrophobicContact CD1-CD 4.37Å; L700-K704 HydrophobicContact CG-CD 4.47Å; L700-K704 WeakPolarHBondContact O-CB 3.48Å; L700-K704 WeakPolarHBondContact O-CD 3.48Å; L700-K704 VanDerWaalsContact O-CG 3.3Å; L700-K704 WeakPolarHBondContact O-CG 3.49Å; L700-K704 PolarHBondContact O-N 3.33Å
701	L	87.4	Confident	74.7	Confident	9 Å²	9	55.3 Å²	55.3	5%	0.047	29%	0.286	C	S	.	.	H	α-helix	trans	-65.9	-55.8	170.3	178.8	69.2	0	0	0	110.8	S697 L698 E699 S703 K704 L705 V890 L913 L918	S697-L701 WeakPolarHBondContact O-CB 3.22Å; S697-L701 PolarHBondContact O-N 3.12Å; L698-L701 WeakPolarHBondContact O-CB 3.48Å; L698-L701 PolarHBondContact O-N 3.25Å; E699-L701 VanDerWaalsContact C-N 3.3Å; E699-L701 PolarHBondContact O-N 3.26Å; L701-S703 PolarHBondContact O-N 2.79Å; L701-K704 PolarHBondContact O-N 2.96Å; L701-L705 HydrophobicContact CD1-CD1 4.23Å; L701-L705 HydrophobicContact CD1-CG 4.29Å; L701-L705 HydrophobicContact CD2-CD1 4.5Å; L701-L705 HydrophobicContact CG-CD1 3.89Å; L701-L705 HydrophobicContact CG-CG 4.36Å; L701-L705 WeakPolarHBondContact O-CG 3.19Å; L701-L705 PolarHBondContact O-N 2.72Å; L701-V890 HydrophobicContact CD2-CG2 3.73Å; L701-L913 HydrophobicContact CD2-CD1 4.12Å; L701-L913 HydrophobicContact CD2-CD2 4.15Å; L701-L913 HydrophobicContact CD2-CG 4.47Å; L701-L918 HydrophobicContact CD2-CD1 4.12Å
702	A	84.9	Confident	73.2	Confident	4 Å²	4	59.1 Å²	59.1	3%	0.033	31%	0.308	C	S	.	.	H	α-helix	trans	-65	-23.2	-175.5	0	0	0	0	0	114.1	L698 E699 K729 I732 L733	L698-A702 VanDerWaalsContact O-CB 3.29Å; L698-A702 WeakPolarHBondContact O-CB 3.48Å; L698-A702 PolarHBondContact O-N 3.05Å; E699-A702 PolarHBondContact O-N 3.46Å; A702-K729 HydrophobicContact CB-CG 4.01Å; A702-I732 HydrophobicContact CB-CG2 4.11Å; A702-L733 HydrophobicContact CB-CD2 3.92Å; A702-L733 HydrophobicContact CB-CG 4.07Å
703	S	80.7	Confident	71.5	Confident	53 Å²	53	62.4 Å²	62.4	37%	0.371	32%	0.324	S	S	.	.	H	α-helix	trans	-86.7	-17.4	174	58.6	0	0	0	0	114.2	E699 L700 L701	E699-S703 VanDerWaalsContact O-CB 3.23Å; E699-S703 WeakPolarHBondContact O-CB 3.47Å; E699-S703 PolarHBondContact O-N 3.14Å; E699-S703 PolarHBondContact O-OG 3.27Å; L700-S703 PolarHBondContact O-OG 3.21Å; L701-S703 PolarHBondContact O-N 2.79Å
704	K	85.8	Confident	69.6	Low	70 Å²	70	64.5 Å²	64.5	30%	0.304	34%	0.342	S	S	.	.	H	α-helix	trans	-95.7	-21.9	173.9	-72.8	176.4	179.3	173.9	0	113.5	L700 L701 Y930 W931	L700-K704 HydrophobicContact CD1-CD 4.37Å; L700-K704 HydrophobicContact CG-CD 4.47Å; L700-K704 WeakPolarHBondContact O-CB 3.48Å; L700-K704 WeakPolarHBondContact O-CD 3.48Å; L700-K704 VanDerWaalsContact O-CG 3.3Å; L700-K704 WeakPolarHBondContact O-CG 3.49Å; L700-K704 PolarHBondContact O-N 3.33Å; L701-K704 PolarHBondContact O-N 2.96Å; K704-Y930 CarbonylContact O-C 3.55Å; K704-Y930 WeakPolarHBondContact O-CA 2.85Å; K704-Y930 WeakPolarHBondContact O-CB 3.41Å; K704-W931 HydrophobicContact CB-CG 4.49Å; K704-W931 PolarHBondContact O-N 2.8Å
705	L	84.5	Confident	67.7	Low	1 Å²	1	66.2 Å²	66.2	1%	0.005	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	141.3	179.1	-80.3	168.4	0	0	0	112.5	L701 Y725 F728 I732 L918 T920 W931 L933	L701-L705 HydrophobicContact CD1-CD1 4.23Å; L701-L705 HydrophobicContact CD1-CG 4.29Å; L701-L705 HydrophobicContact CD2-CD1 4.5Å; L701-L705 HydrophobicContact CG-CD1 3.89Å; L701-L705 HydrophobicContact CG-CG 4.36Å; L701-L705 WeakPolarHBondContact O-CG 3.19Å; L701-L705 PolarHBondContact O-N 2.72Å; L705-Y725 WeakPolarHBondContact O-CE2 3.29Å; L705-Y725 PolarHBondContact O-OH 3.42Å; L705-F728 HydrophobicContact CB-CE1 4.32Å; L705-F728 HydrophobicContact CD1-CE1 4.35Å; L705-I732 HydrophobicContact CD1-CD1 3.41Å; L705-I732 VanDerWaalsContact CD1-CD1 3.41Å; L705-L918 HydrophobicContact CD1-CD1 4.05Å; L705-T920 HydrophobicContact CD2-CG2 3.72Å; L705-W931 CarbonylContact C-O 3.51Å; L705-W931 WeakPolarHBondContact CA-O 3.47Å; L705-W931 HydrophobicContact CD2-CB 3.96Å; L705-L933 HydrophobicContact CD2-CD1 3.91Å
706	I	76.6	Confident	66.2	Low	33 Å²	33	70.7 Å²	70.7	17%	0.169	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.3	171.5	-61.1	176.6	0	0	0	107.7	Y930 W931 K932 L933	I706-Y930 HydrophobicContact CD1-CD1 4.02Å; I706-Y930 HydrophobicContact CD1-CD2 4.49Å; I706-Y930 HydrophobicContact CD1-CG 3.79Å; I706-Y930 HydrophobicContact CG1-CD1 4.27Å; I706-Y930 HydrophobicContact CG1-CG 4.41Å; I706-W931 PolarHBondContact N-O 3.48Å; I706-K932 CarbonylContact O-C 3.59Å; I706-K932 WeakPolarHBondContact O-CA 3.43Å; I706-L933 PolarHBondContact O-N 2.8Å
707	C	63.9	Low	64.6	Low	22 Å²	22	68.6 Å²	68.6	15%	0.149	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	144.1	180	-161.6	0	0	0	0	112.3	D709 F710 F728	C707-D709 PolarHBondContact O-N 3.37Å; C707-D709 VanDerWaalsContact O-N 3.17Å; C707-F710 HydrophobicContact CB-CD2 4.24Å; C707-F710 HydrophobicContact CB-CE2 3.98Å; C707-F728 HydrophobicContact CB-CD1 4.44Å; C707-F728 HydrophobicContact CB-CG 4.45Å
708	C	50.3	Low	62.9	Low	44 Å²	44	73.9 Å²	73.9	30%	0.297	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	84.9	176.3	-85.9	0	0	0	0	112.7	K932 L933	C708-K932 WeakPolarHBondContact SG-CE 3.35Å; C708-K932 WeakPolarHBondContact SG-CG 3.5Å; C708-L933 VanDerWaalsContact CB-O 3.28Å; C708-L933 WeakPolarHBondContact CB-O 3.42Å; C708-L933 PolarHBondContact SG-O 2.95Å
709	D	50	Low	60.8	Low	115 Å²	115	77.4 Å²	77.4	62%	0.615	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154.6	-13.8	150.7	-92.3	-42.5	0	0	0	112.3	C707	C707-D709 PolarHBondContact O-N 3.37Å; C707-D709 VanDerWaalsContact O-N 3.17Å
710	F	45.3	Very low	59.1	Low	58 Å²	58	79.4 Å²	79.4	25%	0.254	42%	0.417	S	S	.	.	S	Bend	trans	-101.2	21.4	-160.1	-54.3	-58.1	0	0	0	116.8	C707 L721 D724	C707-F710 HydrophobicContact CB-CD2 4.24Å; C707-F710 HydrophobicContact CB-CE2 3.98Å; F710-L721 HydrophobicContact CB-CD1 4.33Å; F710-L721 HydrophobicContact CB-CD2 3.86Å; F710-L721 HydrophobicContact CB-CG 3.97Å; F710-L721 HydrophobicContact CD1-CD2 4.1Å; F710-L721 HydrophobicContact CD1-CG 3.68Å; F710-L721 HydrophobicContact CD2-CD2 4.37Å; F710-L721 HydrophobicContact CE1-CG 4.38Å; F710-L721 HydrophobicContact CG-CD2 3.86Å; F710-L721 HydrophobicContact CG-CG 3.92Å; F710-D724 HydrophobicContact CE1-CB 4.48Å; F710-D724 HydrophobicContact CZ-CB 3.79Å
711	L	43.6	Very low	57	Low	81 Å²	81	77.3 Å²	77.3	42%	0.424	41%	0.406	S	S	.	.	S	Bend	trans	-130.5	-20.2	-178.5	-73.6	172	0	0	0	114.7	K932	L711-K932 HydrophobicContact CD1-CD 4Å
712	D	46.4	Very low	55.2	Low	125 Å²	125	82.2 Å²	82.2	67%	0.668	43%	0.431	S	S	*	.	S	Bend	trans	-110	-0.7	-165.4	-55.5	-73.8	0	0	0	112.1	K932	D712-K932 IonicContact OD1-NZ 2.63Å; D712-K932 IonicContact OD2-NZ 3Å; D712-K932 PolarHBondContact OD2-NZ 2.73Å
713	N	40.6	Very low	53.7	Low	114 Å²	114	84.1 Å²	84.1	61%	0.61	44%	0.444	S	S	*	.	S	Bend	trans	-122.5	137.3	174.4	-73.7	-53.9	0	0	0	111.8	V715	N713-V715 HydrophobicContact CB-CG2 3.94Å; N713-V715 PolarHBondContact O-N 3.27Å
714	N	40.3	Very low	52.4	Low	174 Å²	174	83.4 Å²	83.4	93%	0.93	44%	0.436	S	S	*	.			trans	-73.3	85.9	168.3	-91.8	-10.1	0	0	0	110
715	V	41.3	Very low	50.9	Low	78 Å²	78	83.6 Å²	83.6	47%	0.473	44%	0.435	S	S	.	.			trans	-101.7	106.1	173.7	-176.7	0	0	0	0	108.6	N713 D717	N713-V715 HydrophobicContact CB-CG2 3.94Å; N713-V715 PolarHBondContact O-N 3.27Å; V715-D717 HydrophobicContact CG1-CB 4.28Å; V715-D717 PolarHBondContact O-N 3.31Å
716	D	47	Very low	49.7	Very low	155 Å²	155	85.7 Å²	85.7	83%	0.829	45%	0.45	S	S	*	.			trans	-67.5	-11.2	177.5	-74	-52.7	0	0	0	113.2	Y718	D716-Y718 WeakPolarHBondContact O-CD2 3.48Å; D716-Y718 PolarHBondContact O-N 3.05Å
717	D	49.5	Very low	49	Very low	80 Å²	80	92 Å²	92	43%	0.428	47%	0.472	S	S	.	.			trans	-96.7	82.2	-179	-157.2	-28.8	0	0	0	113.1	V715 T719 Q720	V715-D717 HydrophobicContact CG1-CB 4.28Å; V715-D717 PolarHBondContact O-N 3.31Å; D717-T719 PolarHBondContact O-N 2.8Å; D717-T719 VanDerWaalsContact O-N 3.12Å; D717-T719 WeakPolarHBondContact OD1-CA 3.38Å; D717-T719 WeakPolarHBondContact OD1-CB 3.11Å; D717-T719 PolarHBondContact OD1-N 3.14Å; D717-T719 PolarHBondContact OD1-OG1 3.03Å; D717-Q720 PolarHBondContact O-N 3.39Å
718	Y	47.9	Very low	49.2	Very low	164 Å²	164	92.5 Å²	92.5	64%	0.643	47%	0.472	S	S	*	.	H	α-helix	trans	-58.6	-18.2	172.7	-65.2	-96.6	0	0	0	113.5	D716 L721 I722	D716-Y718 WeakPolarHBondContact O-CD2 3.48Å; D716-Y718 PolarHBondContact O-N 3.05Å; Y718-L721 WeakPolarHBondContact O-CB 3.46Å; Y718-L721 PolarHBondContact O-N 2.8Å; Y718-I722 WeakPolarHBondContact O-CG1 3.26Å; Y718-I722 PolarHBondContact O-N 2.92Å
719	T	42.6	Very low	50	Low	74 Å²	74	92.9 Å²	92.9	45%	0.454	47%	0.468	S	S	.	.	H	α-helix	trans	-70.6	-43	-176.6	-22.9	0	0	0	0	110.9	D717 I722 S723	D717-T719 PolarHBondContact O-N 2.8Å; D717-T719 VanDerWaalsContact O-N 3.12Å; D717-T719 WeakPolarHBondContact OD1-CA 3.38Å; D717-T719 WeakPolarHBondContact OD1-CB 3.11Å; D717-T719 PolarHBondContact OD1-N 3.14Å; D717-T719 PolarHBondContact OD1-OG1 3.03Å; T719-I722 PolarHBondContact O-N 3.38Å; T719-S723 PolarHBondContact O-N 2.97Å
720	Q	47.7	Very low	50.8	Low	119 Å²	119	94.6 Å²	94.6	56%	0.556	47%	0.47	S	S	*	.	H	α-helix	trans	-68.1	-39.1	174.5	-172.8	169.1	-3.5	0	0	111.5	D717 I722 S723 D724	D717-Q720 PolarHBondContact O-N 3.39Å; Q720-I722 VanDerWaalsContact C-N 3.29Å; Q720-I722 PolarHBondContact O-N 3.38Å; Q720-S723 WeakPolarHBondContact O-CB 3.44Å; Q720-S723 PolarHBondContact O-N 3.07Å; Q720-S723 VanDerWaalsContact O-N 3.15Å; Q720-D724 WeakPolarHBondContact CG-OD2 3.49Å; Q720-D724 PolarHBondContact O-N 2.83Å
721	L	41.3	Very low	52.1	Low	51 Å²	51	95.2 Å²	95.2	27%	0.267	48%	0.482	S	S	.	.	H	α-helix	trans	-56	-42.8	174.7	-149.5	170.1	0	0	0	111.6	F710 Y718 Y725	F710-L721 HydrophobicContact CB-CD1 4.33Å; F710-L721 HydrophobicContact CB-CD2 3.86Å; F710-L721 HydrophobicContact CB-CG 3.97Å; F710-L721 HydrophobicContact CD1-CD2 4.1Å; F710-L721 HydrophobicContact CD1-CG 3.68Å; F710-L721 HydrophobicContact CD2-CD2 4.37Å; F710-L721 HydrophobicContact CE1-CG 4.38Å; F710-L721 HydrophobicContact CG-CD2 3.86Å; F710-L721 HydrophobicContact CG-CG 3.92Å; Y718-L721 WeakPolarHBondContact O-CB 3.46Å; Y718-L721 PolarHBondContact O-N 2.8Å; L721-Y725 VanDerWaalsContact O-CB 3.3Å; L721-Y725 WeakPolarHBondContact O-CB 3.28Å; L721-Y725 PolarHBondContact O-N 2.84Å; L721-Y725 VanDerWaalsContact O-N 3.17Å
722	I	50.1	Low	53.9	Low	112 Å²	112	91.5 Å²	91.5	57%	0.574	46%	0.462	S	S	*	.	H	α-helix	trans	-71.6	-41	175.6	-67.8	164.9	0	0	0	111.9	Y718 T719 Q720 D724 S726	Y718-I722 WeakPolarHBondContact O-CG1 3.26Å; Y718-I722 PolarHBondContact O-N 2.92Å; T719-I722 PolarHBondContact O-N 3.38Å; Q720-I722 VanDerWaalsContact C-N 3.29Å; Q720-I722 PolarHBondContact O-N 3.38Å; I722-D724 VanDerWaalsContact C-N 3.34Å; I722-D724 PolarHBondContact O-N 2.71Å; I722-S726 VanDerWaalsContact O-CB 3.26Å; I722-S726 WeakPolarHBondContact O-CB 3.17Å; I722-S726 PolarHBondContact O-N 2.85Å; I722-S726 PolarHBondContact O-OG 2.96Å
723	S	52	Low	55.4	Low	43 Å²	43	86.8 Å²	86.8	30%	0.301	44%	0.437	S	S	.	.	H	α-helix	trans	-52.3	-53.1	174.3	160.5	0	0	0	0	111.2	T719 Q720 S726 R727	T719-S723 PolarHBondContact O-N 2.97Å; Q720-S723 WeakPolarHBondContact O-CB 3.44Å; Q720-S723 PolarHBondContact O-N 3.07Å; Q720-S723 VanDerWaalsContact O-N 3.15Å; S723-S726 WeakPolarHBondContact O-CB 3.37Å; S723-S726 PolarHBondContact O-N 2.8Å; S723-R727 WeakPolarHBondContact O-CG 3.5Å; S723-R727 PolarHBondContact O-N 3.38Å; S723-R727 PolarHBondContact OG-NH1 3.33Å
724	D	54	Low	56.9	Low	38 Å²	38	83.4 Å²	83.4	20%	0.203	42%	0.422	C	S	.	.	H	α-helix	trans	-85.1	-29.4	-165	-61.2	-20.3	0	0	0	111.7	F710 Q720 I722 S726 R727 F728	F710-D724 HydrophobicContact CE1-CB 4.48Å; F710-D724 HydrophobicContact CZ-CB 3.79Å; Q720-D724 WeakPolarHBondContact CG-OD2 3.49Å; Q720-D724 PolarHBondContact O-N 2.83Å; I722-D724 VanDerWaalsContact C-N 3.34Å; I722-D724 PolarHBondContact O-N 2.71Å; D724-S726 VanDerWaalsContact C-N 3.35Å; D724-R727 IonicContact OD1-CZ 3.94Å; D724-R727 IonicContact OD1-NE 2.71Å; D724-R727 IonicContact OD1-NH1 3.28Å; D724-R727 PolarHBondContact OD1-NH1 2.93Å; D724-F728 WeakPolarHBondContact O-CB 3.36Å; D724-F728 PolarHBondContact O-N 2.89Å
725	Y	55	Low	58.4	Low	75 Å²	75	77.4 Å²	77.4	29%	0.294	39%	0.393	S	S	.	.	H	α-helix	trans	-60.5	-42.7	162.3	-177.2	-88.3	0	0	0	112.1	L705 L721 F728 K729	L705-Y725 WeakPolarHBondContact O-CE2 3.29Å; L705-Y725 PolarHBondContact O-OH 3.42Å; L721-Y725 VanDerWaalsContact O-CB 3.3Å; L721-Y725 WeakPolarHBondContact O-CB 3.28Å; L721-Y725 PolarHBondContact O-N 2.84Å; L721-Y725 VanDerWaalsContact O-N 3.17Å; Y725-F728 PolarHBondContact O-N 3.31Å; Y725-K729 PolarHBondContact O-N 2.81Å
726	S	58.4	Low	60.4	Low	45 Å²	45	74.2 Å²	74.2	32%	0.315	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-47	179.1	-58.3	0	0	0	0	111.1	I722 S723 D724 F728 K729 F730	I722-S726 VanDerWaalsContact O-CB 3.26Å; I722-S726 WeakPolarHBondContact O-CB 3.17Å; I722-S726 PolarHBondContact O-N 2.85Å; I722-S726 PolarHBondContact O-OG 2.96Å; S723-S726 WeakPolarHBondContact O-CB 3.37Å; S723-S726 PolarHBondContact O-N 2.8Å; D724-S726 VanDerWaalsContact C-N 3.35Å; S726-F728 VanDerWaalsContact C-N 3.29Å; S726-F728 PolarHBondContact O-N 2.65Å; S726-K729 PolarHBondContact O-N 2.83Å; S726-F730 WeakPolarHBondContact O-CD2 3.39Å; S726-F730 PolarHBondContact O-N 2.91Å
727	R	62	Low	61.9	Low	165 Å²	165	72.5 Å²	72.5	62%	0.623	36%	0.358	S	S	*	.	H	α-helix	trans	-54.2	-44	172.4	-75.5	171.2	170.4	157.8	-7	111.9	S723 D724 F730 S731	S723-R727 WeakPolarHBondContact O-CG 3.5Å; S723-R727 PolarHBondContact O-N 3.38Å; S723-R727 PolarHBondContact OG-NH1 3.33Å; D724-R727 IonicContact OD1-CZ 3.94Å; D724-R727 IonicContact OD1-NE 2.71Å; D724-R727 IonicContact OD1-NH1 3.28Å; D724-R727 PolarHBondContact OD1-NH1 2.93Å; R727-F730 PolarHBondContact O-N 2.97Å; R727-S731 VanDerWaalsContact O-CB 3.31Å; R727-S731 WeakPolarHBondContact O-CB 3.18Å; R727-S731 PolarHBondContact O-N 3.42Å
728	F	67.4	Low	63.4	Low	33 Å²	33	70.1 Å²	70.1	15%	0.145	35%	0.345	C	S	.	.	H	α-helix	trans	-65.2	-44.7	178	-174.8	-99.4	0	0	0	112.5	L705 C707 D724 Y725 S726 F730 S731 I732 L933 P937	L705-F728 HydrophobicContact CB-CE1 4.32Å; L705-F728 HydrophobicContact CD1-CE1 4.35Å; C707-F728 HydrophobicContact CB-CD1 4.44Å; C707-F728 HydrophobicContact CB-CG 4.45Å; D724-F728 WeakPolarHBondContact O-CB 3.36Å; D724-F728 PolarHBondContact O-N 2.89Å; Y725-F728 PolarHBondContact O-N 3.31Å; S726-F728 VanDerWaalsContact C-N 3.29Å; S726-F728 PolarHBondContact O-N 2.65Å; F728-F730 PolarHBondContact O-N 2.88Å; F728-S731 WeakPolarHBondContact O-CB 3.43Å; F728-S731 PolarHBondContact O-N 2.97Å; F728-I732 HydrophobicContact CD1-CD1 4.27Å; F728-I732 HydrophobicContact CE1-CD1 3.49Å; F728-I732 VanDerWaalsContact CE1-CD1 3.49Å; F728-I732 HydrophobicContact CE1-CG1 4.41Å; F728-I732 HydrophobicContact CE2-CD1 4.35Å; F728-I732 HydrophobicContact CZ-CD1 3.54Å; F728-I732 HydrophobicContact CZ-CG1 4.34Å; F728-I732 PolarHBondContact O-N 3.04Å; F728-L933 HydrophobicContact CE2-CD2 4.19Å; F728-L933 HydrophobicContact CZ-CD1 4.2Å; F728-L933 HydrophobicContact CZ-CD2 3.89Å; F728-P937 HydrophobicContact CE2-CG 4.03Å; F728-P937 HydrophobicContact CZ-CG 4.4Å
729	K	67.7	Low	64.9	Low	51 Å²	51	64.3 Å²	64.3	22%	0.222	33%	0.328	C	S	.	.	H	α-helix	trans	-61.2	-45.5	175.2	-161.2	-158.9	-179.4	-148.8	0	111.2	E699 A702 Y725 S726 S731 I732 L733	E699-K729 IonicContact OE1-NZ 2.74Å; E699-K729 PolarHBondContact OE1-NZ 3.05Å; A702-K729 HydrophobicContact CB-CG 4.01Å; Y725-K729 PolarHBondContact O-N 2.81Å; S726-K729 PolarHBondContact O-N 2.83Å; K729-S731 VanDerWaalsContact C-N 3.32Å; K729-S731 PolarHBondContact O-N 2.82Å; K729-I732 PolarHBondContact O-N 3.36Å; K729-L733 HydrophobicContact CD-CD1 4.16Å; K729-L733 HydrophobicContact CG-CD1 4.11Å; K729-L733 WeakPolarHBondContact O-CB 3.2Å; K729-L733 WeakPolarHBondContact O-CG 3.32Å; K729-L733 PolarHBondContact O-N 3.27Å
730	F	67.7	Low	66.4	Low	152 Å²	152	63.1 Å²	63.1	67%	0.667	32%	0.323	S	S	*	.	H	α-helix	trans	-63.8	-35.8	175.5	-75.9	-60.5	0	0	0	112.5	S726 R727 F728 L733 S734	S726-F730 WeakPolarHBondContact O-CD2 3.39Å; S726-F730 PolarHBondContact O-N 2.91Å; R727-F730 PolarHBondContact O-N 2.97Å; F728-F730 PolarHBondContact O-N 2.88Å; F730-L733 PolarHBondContact O-N 3.47Å; F730-S734 WeakPolarHBondContact O-CB 3.2Å; F730-S734 PolarHBondContact O-N 2.85Å
731	S	71.1	Confident	67.6	Low	70 Å²	70	59.4 Å²	59.4	49%	0.49	31%	0.309	S	S	.	.	H	α-helix	trans	-62.9	-47.8	176.3	-171	0	0	0	0	111.6	R727 F728 K729 L733 S734 R888	R727-S731 VanDerWaalsContact O-CB 3.31Å; R727-S731 WeakPolarHBondContact O-CB 3.18Å; R727-S731 PolarHBondContact O-N 3.42Å; F728-S731 WeakPolarHBondContact O-CB 3.43Å; F728-S731 PolarHBondContact O-N 2.97Å; K729-S731 VanDerWaalsContact C-N 3.32Å; K729-S731 PolarHBondContact O-N 2.82Å; S731-L733 PolarHBondContact O-N 2.83Å; S731-S734 PolarHBondContact O-N 3.39Å; S731-S734 PolarHBondContact O-OG 3.47Å; S731-R888 PolarHBondContact O-NH1 2.79Å
732	I	81	Confident	69.2	Low	3 Å²	3	58.9 Å²	58.9	2%	0.015	31%	0.308	C	S	.	.	H	α-helix	trans	-65.5	-40	176	-70.4	-177.2	0	0	0	112.2	L698 A702 L705 F728 K729 S734 R888 L918	L698-I732 HydrophobicContact CD1-CG2 4.12Å; L698-I732 HydrophobicContact CG-CG2 4.44Å; A702-I732 HydrophobicContact CB-CG2 4.11Å; L705-I732 HydrophobicContact CD1-CD1 3.41Å; L705-I732 VanDerWaalsContact CD1-CD1 3.41Å; F728-I732 HydrophobicContact CD1-CD1 4.27Å; F728-I732 HydrophobicContact CE1-CD1 3.49Å; F728-I732 VanDerWaalsContact CE1-CD1 3.49Å; F728-I732 HydrophobicContact CE1-CG1 4.41Å; F728-I732 HydrophobicContact CE2-CD1 4.35Å; F728-I732 HydrophobicContact CZ-CD1 3.54Å; F728-I732 HydrophobicContact CZ-CG1 4.34Å; F728-I732 PolarHBondContact O-N 3.04Å; K729-I732 PolarHBondContact O-N 3.36Å; I732-S734 VanDerWaalsContact C-N 3.31Å; I732-S734 PolarHBondContact O-N 3.09Å; I732-R888 PolarHBondContact O-NH1 3.04Å; I732-L918 HydrophobicContact CD1-CD1 4.42Å
733	L	78.7	Confident	70.2	Confident	26 Å²	26	55.8 Å²	55.8	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-78.6	-9.5	179.7	-67.6	-176.7	0	0	0	114.3	W695 L698 E699 A702 K729 F730 S731	W695-L733 HydrophobicContact CH2-CB 3.88Å; W695-L733 HydrophobicContact CH2-CD2 3.89Å; W695-L733 HydrophobicContact CH2-CG 4.3Å; W695-L733 HydrophobicContact CZ2-CD2 4.28Å; W695-L733 HydrophobicContact CZ3-CB 4.41Å; W695-L733 HydrophobicContact CZ3-CD2 4.05Å; L698-L733 HydrophobicContact CD2-CD2 3.72Å; L698-L733 HydrophobicContact CG-CD2 3.91Å; E699-L733 HydrophobicContact CB-CD2 4.45Å; A702-L733 HydrophobicContact CB-CD2 3.92Å; A702-L733 HydrophobicContact CB-CG 4.07Å; K729-L733 HydrophobicContact CD-CD1 4.16Å; K729-L733 HydrophobicContact CG-CD1 4.11Å; K729-L733 WeakPolarHBondContact O-CB 3.2Å; K729-L733 WeakPolarHBondContact O-CG 3.32Å; K729-L733 PolarHBondContact O-N 3.27Å; F730-L733 PolarHBondContact O-N 3.47Å; S731-L733 PolarHBondContact O-N 2.83Å
734	S	71.6	Confident	71	Confident	44 Å²	44	56.2 Å²	56.2	31%	0.308	29%	0.29	S	S	.	.	S	Bend	trans	-68.5	145.2	176.4	68.6	0	0	0	0	111.7	F730 S731 I732 R888	F730-S734 WeakPolarHBondContact O-CB 3.2Å; F730-S734 PolarHBondContact O-N 2.85Å; S731-S734 PolarHBondContact O-N 3.39Å; S731-S734 PolarHBondContact O-OG 3.47Å; I732-S734 VanDerWaalsContact C-N 3.31Å; I732-S734 PolarHBondContact O-N 3.09Å; S734-R888 PolarHBondContact O-NH1 2.85Å
735	P	73	Confident	71.6	Confident	48 Å²	48	56.7 Å²	56.7	31%	0.312	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-73.2	152.4	171.7	34.2	-36.5	0	0	0	110.8	K737 T885 I886	P735-K737 PolarHBondContact O-N 3.21Å; P735-T885 HydrophobicContact CG-CG2 4.38Å; P735-I886 CarbonylContact C-O 3.6Å
736	I	81.7	Confident	71.6	Confident	11 Å²	11	55.3 Å²	55.3	6%	0.056	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	121.6	-179.5	-60.5	162	0	0	0	108.5	L738 T885 I886 R888 T914 D915 Y991	I736-L738 HydrophobicContact CG2-CD2 4.4Å; I736-L738 PolarHBondContact O-N 3.49Å; I736-T885 CarbonylContact O-C 3.53Å; I736-T885 WeakPolarHBondContact O-CA 3.42Å; I736-T885 VanDerWaalsContact O-CB 3.26Å; I736-T885 WeakPolarHBondContact O-CB 3.41Å; I736-I886 PolarHBondContact N-O 2.93Å; I736-I886 PolarHBondContact O-N 3.38Å; I736-R888 HydrophobicContact CD1-CB 4.28Å; I736-R888 HydrophobicContact CD1-CG 4.46Å; I736-R888 HydrophobicContact CG1-CB 4.26Å; I736-T914 VanDerWaalsContact CD1-OG1 3.27Å; I736-T914 WeakPolarHBondContact CD1-OG1 3.36Å; I736-D915 HydrophobicContact CD1-CB 3.75Å; I736-D915 HydrophobicContact CG1-CB 4.2Å; I736-Y991 HydrophobicContact CG2-CE2 4.49Å
737	K	79.9	Confident	71.3	Confident	119 Å²	119	56.8 Å²	56.8	52%	0.517	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	122.3	171	-66.8	180	176	-177.1	0	109.8	P735 E855 T885	P735-K737 PolarHBondContact O-N 3.21Å; K737-E855 IonicContact NZ-OE1 2.72Å; K737-T885 HydrophobicContact CG-CG2 4.38Å
738	L	80.7	Confident	70.5	Confident	29 Å²	29	54.8 Å²	54.8	15%	0.152	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-80.2	165.5	172.9	-54.9	-167.1	0	0	0	111.4	I736 R884 I886	I736-L738 HydrophobicContact CG2-CD2 4.4Å; I736-L738 PolarHBondContact O-N 3.49Å; L738-R884 HydrophobicContact CB-CB 4.25Å; L738-R884 WeakPolarHBondContact CB-O 3.5Å; L738-R884 HydrophobicContact CD1-CB 3.99Å; L738-R884 HydrophobicContact CG-CB 4.29Å; L738-R884 WeakPolarHBondContact CG-O 3.37Å; L738-R884 PolarHBondContact N-O 2.75Å; L738-I886 HydrophobicContact CD1-CD1 3.85Å; L738-I886 HydrophobicContact CD1-CG1 4.07Å; L738-I886 HydrophobicContact CD2-CB 4.4Å; L738-I886 HydrophobicContact CD2-CD1 4.07Å; L738-I886 HydrophobicContact CD2-CG1 4.2Å; L738-I886 HydrophobicContact CG-CD1 4.47Å; L738-I886 HydrophobicContact CG-CG1 4.41Å
739	P	79.9	Confident	69.4	Low	42 Å²	42	60.7 Å²	60.7	27%	0.273	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-58.1	153.4	168.8	-19.8	31.1	0	0	0	112.2	M995 P997	P739-M995 VanDerWaalsContact CG-O 3.3Å; P739-M995 WeakPolarHBondContact CG-O 3.26Å; P739-P997 HydrophobicContact CB-CB 4.15Å
740	S	73.3	Confident	68.1	Low	50 Å²	50	60 Å²	60	35%	0.35	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-68.4	143.4	165.4	-57.2	0	0	0	0	109.7
741	P	72.2	Confident	66.9	Low	41 Å²	41	53.8 Å²	53.8	27%	0.266	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-64.4	147.5	173.4	28.7	-34.7	0	0	0	110.9	E998 L1000	P741-E998 CarbonylContact C-O 3.55Å; P741-E998 VanDerWaalsContact CA-O 3.24Å; P741-E998 WeakPolarHBondContact CA-O 3.15Å; P741-E998 HydrophobicContact CB-CB 4.39Å; P741-E998 WeakPolarHBondContact CB-O 3.24Å; P741-L1000 HydrophobicContact CB-CD1 3.84Å; P741-L1000 HydrophobicContact CB-CG 4.26Å; P741-L1000 HydrophobicContact CG-CD1 4.31Å
742	V	75.5	Confident	65.6	Low	40 Å²	40	53.4 Å²	53.4	24%	0.242	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116.8	174	173.5	0	0	0	0	108	L744 P997 E998 V999 L1000	V742-L744 HydrophobicContact CG1-CD2 4.05Å; V742-L744 HydrophobicContact CG1-CG 4.43Å; V742-P997 HydrophobicContact CG2-CB 4.13Å; V742-E998 PolarHBondContact N-O 3.23Å; V742-V999 WeakPolarHBondContact O-CA 3.38Å; V742-L1000 PolarHBondContact O-N 3.4Å
743	I	71.7	Confident	63.7	Low	47 Å²	47	61.2 Å²	61.2	24%	0.241	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117	179.2	-54.3	178.4	0	0	0	108.8	F745 L1000 V1002	I743-F745 HydrophobicContact CB-CE2 4.31Å; I743-F745 HydrophobicContact CB-CZ 4.47Å; I743-F745 HydrophobicContact CG2-CD2 4.32Å; I743-F745 HydrophobicContact CG2-CE1 4.04Å; I743-F745 HydrophobicContact CG2-CE2 3.73Å; I743-F745 HydrophobicContact CG2-CZ 3.58Å; I743-L1000 WeakPolarHBondContact CA-O 3.35Å; I743-L1000 HydrophobicContact CG1-CB 4.5Å; I743-V1002 HydrophobicContact CG2-CB 4.42Å; I743-V1002 HydrophobicContact CG2-CG2 3.63Å
744	L	69.5	Low	61.9	Low	52 Å²	52	61.8 Å²	61.8	27%	0.272	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	132.9	173.3	-59.8	-178.7	0	0	0	109	V742 V848 V999 L1000 V1002	V742-L744 HydrophobicContact CG1-CD2 4.05Å; V742-L744 HydrophobicContact CG1-CG 4.43Å; L744-V848 HydrophobicContact CD2-CG1 4.04Å; L744-V848 HydrophobicContact CD2-CG2 4.03Å; L744-V999 HydrophobicContact CD1-CG1 3.57Å; L744-V999 HydrophobicContact CG-CG1 3.97Å; L744-L1000 PolarHBondContact N-O 2.65Å; L744-V1002 PolarHBondContact O-N 2.86Å
745	F	65.8	Low	60.2	Low	48 Å²	48	63.1 Å²	63.1	21%	0.211	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121	178.1	-64.6	-83.2	0	0	0	108.9	I743 I751 M849 V1002	I743-F745 HydrophobicContact CB-CE2 4.31Å; I743-F745 HydrophobicContact CB-CZ 4.47Å; I743-F745 HydrophobicContact CG2-CD2 4.32Å; I743-F745 HydrophobicContact CG2-CE1 4.04Å; I743-F745 HydrophobicContact CG2-CE2 3.73Å; I743-F745 HydrophobicContact CG2-CZ 3.58Å; F745-I751 HydrophobicContact CB-CD1 3.9Å; F745-I751 HydrophobicContact CD1-CD1 3.49Å; F745-I751 VanDerWaalsContact CD1-CD1 3.49Å; F745-I751 HydrophobicContact CE1-CD1 4.38Å; F745-I751 HydrophobicContact CG-CD1 4.06Å; F745-M849 HydrophobicContact CE2-CE 4.3Å; F745-V1002 HydrophobicContact CD1-CB 3.57Å; F745-V1002 HydrophobicContact CD1-CG1 3.46Å; F745-V1002 VanDerWaalsContact CD1-CG1 3.46Å; F745-V1002 HydrophobicContact CD1-CG2 4.15Å; F745-V1002 HydrophobicContact CE1-CB 3.85Å; F745-V1002 HydrophobicContact CE1-CG1 3.75Å; F745-V1002 HydrophobicContact CE1-CG2 3.91Å; F745-V1002 HydrophobicContact CG-CB 4.43Å
746	N	53.7	Low	58.6	Low	46 Å²	46	64.2 Å²	64.2	25%	0.246	34%	0.339	C	S	.	.	S	Bend	trans	-67.9	-35.4	-176.9	-90.5	30.6	0	0	0	113.2	F846 I1001 V1002 Q1003	N746-F846 WeakPolarHBondContact O-CE1 3.41Å; N746-I1001 VanDerWaalsContact OD1-CG2 3.27Å; N746-I1001 WeakPolarHBondContact OD1-CG2 3.31Å; N746-V1002 PolarHBondContact N-O 2.96Å; N746-Q1003 HydrophobicContact CB-CG 4.45Å; N746-Q1003 PolarHBondContact ND2-NE2 3.31Å; N746-Q1003 VanDerWaalsContact ND2-NE2 3.19Å
747	D	53.6	Low	56.5	Low	75 Å²	75	66.5 Å²	66.5	40%	0.401	36%	0.356	S	S	.	.			trans	-134.4	98.7	-175.1	-66.1	-73.1	0	0	0	112.8	H749 I751 P1004	D747-H749 VanDerWaalsContact C-N 3.31Å; D747-H749 PolarHBondContact O-N 2.9Å; D747-I751 WeakPolarHBondContact O-CD1 3.3Å; D747-I751 VanDerWaalsContact O-CG1 3.3Å; D747-I751 WeakPolarHBondContact O-CG1 3.21Å; D747-I751 PolarHBondContact O-N 3.36Å; D747-P1004 HydrophobicContact CB-CG 4.27Å
748	Y	44.3	Very low	54.3	Low	124 Å²	124	62.9 Å²	62.9	49%	0.486	35%	0.345	S	S	.	.	H	α-helix	trans	-64.3	-35.5	177.9	-156.7	-100.2	0	0	0	112.4	I751 S752 P847	Y748-I751 PolarHBondContact O-N 3.46Å; Y748-S752 PolarHBondContact O-N 3.32Å; Y748-P847 HydrophobicContact CD2-CB 4.28Å; Y748-P847 HydrophobicContact CD2-CG 3.52Å; Y748-P847 HydrophobicContact CE2-CG 4.28Å; Y748-P847 HydrophobicContact CG-CG 3.79Å
749	H	44.4	Very low	52.2	Low	156 Å²	156	64.8 Å²	64.8	72%	0.722	36%	0.358	S	S	*	.	H	α-helix	trans	-67.9	-45.8	178.2	-83.6	-68.6	0	0	0	113	D747 I751 S752	D747-H749 VanDerWaalsContact C-N 3.31Å; D747-H749 PolarHBondContact O-N 2.9Å; H749-I751 PolarHBondContact O-N 3.23Å; H749-S752 PolarHBondContact O-N 2.93Å; H749-S752 PolarHBondContact O-OG 2.89Å
750	S	41.4	Very low	49.9	Very low	38 Å²	38	70.3 Å²	70.3	27%	0.266	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-28.4	176.5	-54.2	0	0	0	0	112.8	S754	S750-S754 PolarHBondContact O-OG 3.44Å
751	I	41.1	Very low	47.9	Very low	21 Å²	21	71.5 Å²	71.5	11%	0.108	39%	0.386	C	S	.	.	H	α-helix	trans	-82.9	-38.7	-179.2	-70.5	172.1	0	0	0	111.8	F745 D747 Y748 H749 Q753 S754 I755 V1002 P1004	F745-I751 HydrophobicContact CB-CD1 3.9Å; F745-I751 HydrophobicContact CD1-CD1 3.49Å; F745-I751 VanDerWaalsContact CD1-CD1 3.49Å; F745-I751 HydrophobicContact CE1-CD1 4.38Å; F745-I751 HydrophobicContact CG-CD1 4.06Å; D747-I751 WeakPolarHBondContact O-CD1 3.3Å; D747-I751 VanDerWaalsContact O-CG1 3.3Å; D747-I751 WeakPolarHBondContact O-CG1 3.21Å; D747-I751 PolarHBondContact O-N 3.36Å; Y748-I751 PolarHBondContact O-N 3.46Å; H749-I751 PolarHBondContact O-N 3.23Å; I751-Q753 PolarHBondContact O-N 2.89Å; I751-S754 WeakPolarHBondContact CA-OG 3.44Å; I751-S754 PolarHBondContact O-N 2.75Å; I751-S754 VanDerWaalsContact O-N 3.09Å; I751-S754 PolarHBondContact O-OG 3.33Å; I751-I755 HydrophobicContact CG2-CD1 3.49Å; I751-I755 VanDerWaalsContact CG2-CD1 3.49Å; I751-I755 HydrophobicContact CG2-CG1 3.92Å; I751-I755 WeakPolarHBondContact O-CG1 3.41Å; I751-I755 PolarHBondContact O-N 2.72Å; I751-V1002 HydrophobicContact CD1-CG1 4.38Å; I751-P1004 HydrophobicContact CD1-CG 4.4Å; I751-P1004 HydrophobicContact CG1-CG 4.15Å
752	S	44.7	Very low	45.9	Very low	62 Å²	62	73.7 Å²	73.7	43%	0.434	40%	0.395	S	S	.	.	H	α-helix	trans	-59.1	-29.2	175.8	70.6	0	0	0	0	113.7	Y748 H749 P756	Y748-S752 PolarHBondContact O-N 3.32Å; H749-S752 PolarHBondContact O-N 2.93Å; H749-S752 PolarHBondContact O-OG 2.89Å; S752-P756 VanDerWaalsContact O-CD 3.28Å; S752-P756 WeakPolarHBondContact O-CD 3.49Å
753	Q	41.2	Very low	43.9	Very low	166 Å²	166	74 Å²	74	78%	0.776	40%	0.401	S	S	*	.	H	α-helix	trans	-85.9	-20.2	177	-63.4	-172	5.3	0	0	114.1	I751	I751-Q753 PolarHBondContact O-N 2.89Å
754	S	39.7	Very low	42	Very low	39 Å²	39	79.1 Å²	79.1	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-98.8	-30.5	-177.2	46.8	0	0	0	0	114	S750 I751 P756 S757 C758	S750-S754 PolarHBondContact O-OG 3.44Å; I751-S754 WeakPolarHBondContact CA-OG 3.44Å; I751-S754 PolarHBondContact O-N 2.75Å; I751-S754 VanDerWaalsContact O-N 3.09Å; I751-S754 PolarHBondContact O-OG 3.33Å; S754-P756 VanDerWaalsContact C-CD 3.41Å; S754-P756 VanDerWaalsContact C-N 3.32Å; S754-S757 PolarHBondContact O-N 3.08Å; S754-S757 PolarHBondContact O-OG 3.25Å; S754-C758 PolarHBondContact O-N 3.2Å
755	I	37.4	Very low	40.1	Very low	71 Å²	71	82 Å²	82	36%	0.364	44%	0.438	S	S	.	.	H	α-helix	trans	-52.4	-37.6	172.9	-73.5	174.9	0	0	0	114	I751 S757 C758 T759	I751-I755 HydrophobicContact CG2-CD1 3.49Å; I751-I755 VanDerWaalsContact CG2-CD1 3.49Å; I751-I755 HydrophobicContact CG2-CG1 3.92Å; I751-I755 WeakPolarHBondContact O-CG1 3.41Å; I751-I755 PolarHBondContact O-N 2.72Å; I755-S757 PolarHBondContact O-N 3.23Å; I755-S757 VanDerWaalsContact O-N 3.12Å; I755-C758 PolarHBondContact O-N 3.36Å; I755-T759 HydrophobicContact CG2-CG2 3.99Å; I755-T759 WeakPolarHBondContact O-CB 3.49Å; I755-T759 WeakPolarHBondContact O-CG2 3.3Å; I755-T759 PolarHBondContact O-N 3.03Å; I755-T759 PolarHBondContact O-OG1 3.24Å
756	P	38.6	Very low	38.5	Very low	72 Å²	72	87 Å²	87	47%	0.468	46%	0.455	S	S	.	.	H	α-helix	trans	-62.8	-13.6	176	-26.6	36.4	0	0	0	115.7	S752 S754	S752-P756 VanDerWaalsContact O-CD 3.28Å; S752-P756 WeakPolarHBondContact O-CD 3.49Å; S754-P756 VanDerWaalsContact C-CD 3.41Å; S754-P756 VanDerWaalsContact C-N 3.32Å
757	S	37.4	Very low	37.4	Very low	58 Å²	58	90.6 Å²	90.6	41%	0.406	47%	0.474	S	S	.	.	H	α-helix	trans	-95	-47.8	173.7	71.9	0	0	0	0	111.6	S754 I755 T759 K760 S761	S754-S757 PolarHBondContact O-N 3.08Å; S754-S757 PolarHBondContact O-OG 3.25Å; I755-S757 PolarHBondContact O-N 3.23Å; I755-S757 VanDerWaalsContact O-N 3.12Å; S757-T759 VanDerWaalsContact C-N 3.29Å; S757-T759 PolarHBondContact O-N 2.8Å; S757-K760 PolarHBondContact O-N 3.36Å; S757-S761 PolarHBondContact O-N 3.13Å; S757-S761 VanDerWaalsContact O-N 3.11Å
758	C	33.8	Very low	36.5	Very low	43 Å²	43	93.6 Å²	93.6	29%	0.291	48%	0.48	S	S	.	.	H	α-helix	trans	-60	-37.7	177.4	-63.5	0	0	0	0	112.5	S754 I755 K760 S761 L762	S754-C758 PolarHBondContact O-N 3.2Å; I755-C758 PolarHBondContact O-N 3.36Å; C758-K760 VanDerWaalsContact C-N 3.33Å; C758-K760 PolarHBondContact O-N 2.87Å; C758-S761 PolarHBondContact O-N 3.17Å; C758-L762 WeakPolarHBondContact O-CB 3.3Å; C758-L762 WeakPolarHBondContact O-CG 3.45Å; C758-L762 PolarHBondContact O-N 3.17Å
759	T	37.3	Very low	35.9	Very low	69 Å²	69	98 Å²	98	42%	0.423	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-35.9	174.9	46.1	0	0	0	0	112.7	I755 S757 A763	I755-T759 HydrophobicContact CG2-CG2 3.99Å; I755-T759 WeakPolarHBondContact O-CB 3.49Å; I755-T759 WeakPolarHBondContact O-CG2 3.3Å; I755-T759 PolarHBondContact O-N 3.03Å; I755-T759 PolarHBondContact O-OG1 3.24Å; S757-T759 VanDerWaalsContact C-N 3.29Å; S757-T759 PolarHBondContact O-N 2.8Å; T759-A763 VanDerWaalsContact O-CB 3.28Å; T759-A763 WeakPolarHBondContact O-CB 3.23Å; T759-A763 PolarHBondContact O-N 2.86Å
760	K	32.2	Very low	35.1	Very low	159 Å²	159	98 Å²	98	69%	0.691	50%	0.5	S	S	*	.	H	α-helix	trans	-69.3	-39.8	174.6	-72.2	179.8	178	177.6	0	112.2	S757 C758 F764	S757-K760 PolarHBondContact O-N 3.36Å; C758-K760 VanDerWaalsContact C-N 3.33Å; C758-K760 PolarHBondContact O-N 2.87Å; K760-F764 PolarHBondContact O-N 3.03Å
761	S	31.4	Very low	34.4	Very low	74 Å²	74	102 Å²	102	52%	0.517	53%	0.529	S	S	.	.	H	α-helix	trans	-67	-36.5	175.1	-61	0	0	0	0	112.9	S757 C758 F764	S757-S761 PolarHBondContact O-N 3.13Å; S757-S761 VanDerWaalsContact O-N 3.11Å; C758-S761 PolarHBondContact O-N 3.17Å; S761-F764 VanDerWaalsContact O-CB 3.29Å; S761-F764 WeakPolarHBondContact O-CB 3.34Å; S761-F764 PolarHBondContact O-N 2.83Å
762	L	28.3	Very low	33.7	Very low	88 Å²	88	104.3 Å²	104.3	46%	0.461	56%	0.557	S	S	.	*	H	α-helix	trans	-81.5	-28.8	178.7	-68.1	173.6	0	0	0	113.5	C758 F764 L765 R766	C758-L762 WeakPolarHBondContact O-CB 3.3Å; C758-L762 WeakPolarHBondContact O-CG 3.45Å; C758-L762 PolarHBondContact O-N 3.17Å; L762-F764 PolarHBondContact O-N 2.77Å; L762-L765 HydrophobicContact CD2-CD1 4.07Å; L762-L765 PolarHBondContact O-N 3.42Å; L762-R766 PolarHBondContact O-N 3.43Å; L762-R766 VanDerWaalsContact O-N 3.09Å
763	A	33.6	Very low	32.8	Very low	45 Å²	45	106.8 Å²	106.8	37%	0.372	57%	0.574	S	S	.	*	H	α-helix	trans	-58.5	-31	167.6	0	0	0	0	0	111.8	T759 L765 R766 N767	T759-A763 VanDerWaalsContact O-CB 3.28Å; T759-A763 WeakPolarHBondContact O-CB 3.23Å; T759-A763 PolarHBondContact O-N 2.86Å; A763-L765 PolarHBondContact O-N 2.86Å; A763-R766 PolarHBondContact O-N 2.94Å; A763-N767 WeakPolarHBondContact O-CB 3.38Å; A763-N767 PolarHBondContact O-N 2.85Å
764	F	32.2	Very low	32.2	Very low	156 Å²	156	104.3 Å²	104.3	68%	0.684	57%	0.572	S	S	*	*	H	α-helix	trans	-66.2	-20.6	173.5	-118.9	-78.1	0	0	0	114.3	K760 S761 L762	K760-F764 PolarHBondContact O-N 3.03Å; S761-F764 VanDerWaalsContact O-CB 3.29Å; S761-F764 WeakPolarHBondContact O-CB 3.34Å; S761-F764 PolarHBondContact O-N 2.83Å; L762-F764 PolarHBondContact O-N 2.77Å
765	L	31	Very low	31.4	Very low	113 Å²	113	109 Å²	109	59%	0.592	59%	0.594	S	S	*	*	H	α-helix	trans	-88.2	-46.8	170.7	-63.1	-179.6	0	0	0	111.3	L762 A763 N767 R768	L762-L765 HydrophobicContact CD2-CD1 4.07Å; L762-L765 PolarHBondContact O-N 3.42Å; A763-L765 PolarHBondContact O-N 2.86Å; L765-N767 PolarHBondContact O-N 3.01Å; L765-R768 PolarHBondContact O-N 2.93Å; L765-R768 VanDerWaalsContact O-N 3.16Å
766	R	31.3	Very low	30.9	Very low	151 Å²	151	115.9 Å²	115.9	57%	0.57	62%	0.621	S	S	*	*	H	α-helix	trans	-60	-31.7	178.9	-107.8	178	175.1	168.6	-5.3	112.9	L762 A763 R768 S874 D876	L762-R766 PolarHBondContact O-N 3.43Å; L762-R766 VanDerWaalsContact O-N 3.09Å; A763-R766 PolarHBondContact O-N 2.94Å; R766-R768 VanDerWaalsContact C-N 3.34Å; R766-R768 PolarHBondContact O-N 2.66Å; R766-S874 PolarHBondContact NH1-O 3.1Å; R766-D876 IonicContact CZ-OD2 3.76Å; R766-D876 IonicContact NE-OD2 3.38Å; R766-D876 PolarHBondContact NE-OD2 2.85Å; R766-D876 IonicContact NH2-OD2 2.81Å; R766-D876 PolarHBondContact NH2-OD2 3.01Å
767	N	31.2	Very low	30.2	Very low	123 Å²	123	117.8 Å²	117.8	66%	0.658	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-78.8	-3	178.9	-76.1	-11.6	0	0	0	115.7	A763 L765 R769	A763-N767 WeakPolarHBondContact O-CB 3.38Å; A763-N767 PolarHBondContact O-N 2.85Å; L765-N767 PolarHBondContact O-N 3.01Å; N767-R769 VanDerWaalsContact C-N 3.26Å; N767-R769 PolarHBondContact O-N 2.68Å
768	R	33.2	Very low	29.8	Very low	138 Å²	138	120 Å²	120	52%	0.521	65%	0.648	S	S	.	*	G	3₁₀ helix	trans	-76.9	2.7	-179.3	-77.3	-168.4	-178.9	-171.3	3.3	115.8	L765 R766	L765-R768 PolarHBondContact O-N 2.93Å; L765-R768 VanDerWaalsContact O-N 3.16Å; R766-R768 VanDerWaalsContact C-N 3.34Å; R766-R768 PolarHBondContact O-N 2.66Å
769	R	32.5	Very low	29.3	Very low	217 Å²	217	124.7 Å²	124.7	82%	0.819	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-106.2	8.7	176	-71.4	-169.2	178.6	177.8	2.2	115.4	N767	N767-R769 VanDerWaalsContact C-N 3.26Å; N767-R769 PolarHBondContact O-N 2.68Å
770	L	28.6	Very low	29	Very low	154 Å²	154	128.1 Å²	128.1	81%	0.806	69%	0.685	S	S	*	*			trans	-132.7	53.9	179.1	-70.2	175.7	0	0	0	113.4	G772	L770-G772 VanDerWaalsContact C-N 3.33Å; L770-G772 PolarHBondContact O-N 3.46Å; L770-G772 VanDerWaalsContact O-N 3.11Å
771	S	26.1	Very low	28.6	Very low	124 Å²	124	125.4 Å²	125.4	87%	0.867	69%	0.687	S	S	*	*			trans	-82	76.1	169.3	58.3	0	0	0	0	111.2
772	G	25.4	Very low	28.5	Very low	68 Å²	68	129.8 Å²	129.8	70%	0.701	70%	0.703	S	S	*	*			trans	-146.3	42.5	-175.2	0	0	0	0	0	114	L770	L770-G772 VanDerWaalsContact C-N 3.33Å; L770-G772 PolarHBondContact O-N 3.46Å; L770-G772 VanDerWaalsContact O-N 3.11Å
773	S	26.8	Very low	28.3	Very low	115 Å²	115	129.9 Å²	129.9	80%	0.804	71%	0.71	S	S	*	*			trans	-67	147.5	176.1	-48.4	0	0	0	0	111.4
774	P	28.3	Very low	28	Very low	113 Å²	113	135.2 Å²	135.2	73%	0.734	73%	0.733	S	S	*	*				-144.7	146.3	90.6	36.8	-21.3	0	0	0	116.7
775	L	23.5	Very low	27.6	Very low	138 Å²	138	131.8 Å²	131.8	72%	0.723	73%	0.733	S	S	*	*			trans	47.9	105.3	136.4	-56.2	172.1	0	0	0	119.9	T777	L775-T777 HydrophobicContact CD2-CG2 4.46Å
776	F	26.1	Very low	27.2	Very low	215 Å²	215	137.4 Å²	137.4	94%	0.943	75%	0.747	S	S	*	*				-133.7	126.5	123.3	-102.3	-81.5	0	0	0	109.3
777	T	23.6	Very low	27.1	Very low	112 Å²	112	136.6 Å²	136.6	69%	0.687	76%	0.759	S	S	*	*			trans	-129.4	115.3	-177.4	50.8	0	0	0	0	110.8	L775	L775-T777 HydrophobicContact CD2-CG2 4.46Å
778	S	28.8	Very low	26.9	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	76%	0.761	S	S	*	*			trans	172.3	151.2	158.4	33	0	0	0	0	109.8
779	N	24.5	Very low	26.5	Very low	141 Å²	141	137.2 Å²	137.2	75%	0.754	77%	0.77	S	S	*	*			cis	-160.6	171.6	-28.1	-116.1	-1.8	0	0	0	108.7
780	N	30.2	Very low	26.2	Very low	141 Å²	141	132.6 Å²	132.6	75%	0.754	76%	0.762	S	S	*	*			trans	70	114.8	175.9	-48.7	-16	0	0	0	113.5
781	S	23.9	Very low	26.3	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	76%	0.762	S	S	*	*			cis	72.7	117.2	47.4	86.2	0	0	0	0	114.4
782	I	29.5	Very low	26.3	Very low	166 Å²	166	134.5 Å²	134.5	85%	0.851	76%	0.757	S	S	*	*				-168.2	152.3	118.1	-97.5	161.6	0	0	0	108.3
783	S	25.1	Very low	26.3	Very low	89 Å²	89	137.2 Å²	137.2	62%	0.622	76%	0.76	S	S	*	*			trans	-91.4	171.7	-178.7	45.8	0	0	0	0	113.2
784	D	25.5	Very low	26.4	Very low	157 Å²	157	138.7 Å²	138.7	84%	0.84	77%	0.765	S	S	*	*			trans	119.5	153.7	140.8	-67.7	-60.9	0	0	0	118.7
785	A	24.1	Very low	26.3	Very low	85 Å²	85	138.6 Å²	138.6	70%	0.702	77%	0.766	S	S	*	*			trans	-128.9	161.9	-172.9	0	0	0	0	0	111
786	R	22.9	Very low	26.4	Very low	230 Å²	230	136.6 Å²	136.6	87%	0.868	76%	0.763	S	S	*	*			trans	83.6	110.8	177.2	-50.3	168.3	-179.4	162.5	0.1	116.1
787	T	30.2	Very low	26.5	Very low	135 Å²	135	133.1 Å²	133.1	83%	0.828	75%	0.754	S	S	*	*				-177.8	102.6	128.8	-69.8	0	0	0	0	105
788	I	26.1	Very low	26.6	Very low	136 Å²	136	139.2 Å²	139.2	70%	0.697	77%	0.765	S	S	*	*				76.3	104.3	63.5	-62.5	179.7	0	0	0	113.5
789	L	25.7	Very low	26.7	Very low	137 Å²	137	138.7 Å²	138.7	72%	0.717	76%	0.761	S	S	*	*			trans	55.8	133	153.1	-94.1	65.3	0	0	0	122.9
790	N	26.4	Very low	26.9	Very low	120 Å²	120	139.4 Å²	139.4	64%	0.642	77%	0.765	S	S	*	*			trans	65.1	149.4	143.8	-57.7	-9	0	0	0	117.9
791	H	30.8	Very low	27	Very low	177 Å²	177	138.2 Å²	138.2	82%	0.819	77%	0.768	S	S	*	*			cis	-144.3	-180	38.7	-82.2	-93.7	0	0	0	114.7
792	N	25.1	Very low	27.4	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	76%	0.762	S	S	*	*			trans	-97.5	154.2	-167.6	-68	-27.3	0	0	0	115.5
793	T	25.2	Very low	27.5	Very low	125 Å²	125	137.1 Å²	137.1	77%	0.767	77%	0.767	S	S	*	*			trans	47.9	122	143.6	55.5	0	0	0	0	121.4
794	T	28.6	Very low	27.9	Very low	146 Å²	146	136 Å²	136	90%	0.896	77%	0.77	S	S	*	*				-168.5	163.1	113.2	15.7	0	0	0	0	112.7
795	S	26.9	Very low	28.1	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	77%	0.766	S	S	*	*			trans	-93.6	-178	171	60.4	0	0	0	0	110.7
796	C	26.4	Very low	28.5	Very low	97 Å²	97	135.9 Å²	135.9	66%	0.655	76%	0.764	S	S	*	*			cis	-167.2	160.6	19.6	54.5	0	0	0	0	113.9
797	N	26.4	Very low	28.7	Very low	141 Å²	141	131.6 Å²	131.6	75%	0.754	76%	0.759	S	S	*	*			trans	64.5	136.1	140.6	-68.7	-21.2	0	0	0	124.3
798	R	26.2	Very low	28.8	Very low	240 Å²	240	134.3 Å²	134.3	91%	0.906	76%	0.762	S	S	*	*			trans	73.3	151.6	155.8	-70.1	177.3	-179.1	-166	-1	117.1
799	S	31.8	Very low	28.7	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	76%	0.763	S	S	*	*			cis	-158.3	159.7	3	19.4	0	0	0	0	112.3
800	D	27.6	Very low	28.7	Very low	156 Å²	156	134.2 Å²	134.2	83%	0.834	77%	0.767	S	S	*	*			trans	46	142.3	147.8	-68	-56.2	0	0	0	122.3
801	S	33.9	Very low	28.6	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	77%	0.77	S	S	*	*			cis	-161	-171.1	-3.6	60.4	0	0	0	0	107.9
802	G	31.1	Very low	28.4	Very low	58 Å²	58	130.9 Å²	130.9	60%	0.598	77%	0.768	S	S	*	*			cis	168.8	-176.8	5.7	0	0	0	0	0	110.8
803	I	32.3	Very low	28.4	Very low	187 Å²	187	129.7 Å²	129.7	96%	0.959	77%	0.77	S	S	*	*			trans	66	120.5	174	-52.2	170	0	0	0	114.6
804	G	32.1	Very low	28.6	Very low	66 Å²	66	129.5 Å²	129.5	68%	0.68	77%	0.774	S	S	*	*			cis	160.9	169.4	1	0	0	0	0	0	109.4
805	D	31.1	Very low	28.4	Very low	140 Å²	140	127.5 Å²	127.5	75%	0.749	77%	0.766	S	S	*	*			cis	-163.1	-175.6	-11.3	-152.2	-87.4	0	0	0	110
806	C	31	Very low	28.6	Very low	100 Å²	100	128.5 Å²	128.5	68%	0.676	77%	0.768	S	S	*	*			trans	53.7	115.3	167.9	68.4	0	0	0	0	119.9
807	N	28.3	Very low	28.8	Very low	140 Å²	140	130 Å²	130	75%	0.749	77%	0.774	S	S	*	*				75.1	139.3	66.2	-62.8	-34.2	0	0	0	113.2
808	Q	31.3	Very low	28.9	Very low	192 Å²	192	127.5 Å²	127.5	90%	0.897	77%	0.768	S	S	*	*			cis	-145.2	-168.6	49	-65.7	-178.6	-13.7	0	0	115.4
809	T	25.1	Very low	29	Very low	116 Å²	116	126.5 Å²	126.5	71%	0.712	76%	0.764	S	S	*	*			trans	-131.9	154.8	-157.8	48.9	0	0	0	0	115.6
810	L	24.8	Very low	28.9	Very low	154 Å²	154	128.7 Å²	128.7	81%	0.806	77%	0.768	S	S	*	*			trans	19.9	141.2	153.5	-60.9	88.5	0	0	0	120.1
811	S	24.5	Very low	28.9	Very low	100 Å²	100	132.4 Å²	132.4	70%	0.699	77%	0.772	S	S	*	*				-179.2	158.8	72.5	-62.5	0	0	0	0	116.4
812	T	25.8	Very low	28.5	Very low	128 Å²	128	132.8 Å²	132.8	79%	0.785	77%	0.77	S	S	*	*			trans	66.3	128.7	143.1	45.2	0	0	0	0	125.7
813	S	25.5	Very low	28.2	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	78%	0.779	S	S	*	*			trans	64.1	148.8	147.6	46	0	0	0	0	120.7
814	S	29.4	Very low	28.4	Very low	121 Å²	121	131.7 Å²	131.7	85%	0.846	77%	0.767	S	S	*	*			cis	-152.3	172.3	-2.2	45.9	0	0	0	0	111.9
815	S	25.3	Very low	28.1	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	78%	0.775	S	S	*	*			trans	-96.6	148	-170.6	56.3	0	0	0	0	116.5
816	T	29.8	Very low	27.9	Very low	131 Å²	131	131.8 Å²	131.8	80%	0.804	77%	0.774	S	S	*	*				-170.3	143.8	129.4	23	0	0	0	0	114.9
817	T	32.2	Very low	27.6	Very low	128 Å²	128	136.4 Å²	136.4	79%	0.785	78%	0.783	S	S	*	*			trans	58.7	110.8	150.3	54.9	0	0	0	0	123.8
818	S	26.9	Very low	27.4	Very low	89 Å²	89	139.2 Å²	139.2	62%	0.622	79%	0.788	S	S	*	*				79.1	114.2	123.8	179.6	0	0	0	0	122.5
819	R	29	Very low	27.3	Very low	219 Å²	219	138.8 Å²	138.8	83%	0.826	79%	0.786	S	S	*	*			trans	67.4	136.8	149.7	-69.9	178.7	179.8	131.7	-2.3	116.9
820	D	29.1	Very low	27.3	Very low	141 Å²	141	144.8 Å²	144.8	75%	0.754	80%	0.796	S	S	*	*			cis	-135	163.2	4.4	-82.5	-48.8	0	0	0	112.3
821	Y	27.3	Very low	27.4	Very low	234 Å²	234	142 Å²	142	92%	0.918	79%	0.789	S	S	*	*			trans	-83.5	116.2	-165.8	-77.5	-93.5	0	0	0	115.3
822	T	26.2	Very low	27.5	Very low	125 Å²	125	147 Å²	147	77%	0.767	79%	0.793	S	S	*	*			trans	-145.2	163.3	150.9	55.3	0	0	0	0	109.9
823	S	24.1	Very low	27.5	Very low	112 Å²	112	147.2 Å²	147.2	78%	0.783	79%	0.788	S	S	*	*			trans	79.8	158.9	170.2	-49.3	0	0	0	0	115.6
824	P	37.5	Very low	27.5	Very low	109 Å²	109	151.2 Å²	151.2	71%	0.708	79%	0.787	S	S	*	*			trans	-130.3	-169.9	-134	44.3	-30.9	0	0	0	116.9
825	T	26.8	Very low	27.3	Very low	139 Å²	139	149.6 Å²	149.6	85%	0.853	78%	0.775	S	S	*	*			trans	64.9	102.3	160.7	46	0	0	0	0	119.2
826	G	25.7	Very low	27.2	Very low	70 Å²	70	152.7 Å²	152.7	72%	0.722	78%	0.783	S	S	*	*			trans	113	100.8	134.7	0	0	0	0	0	117.7
827	F	24.6	Very low	27.1	Very low	196 Å²	196	152.1 Å²	152.1	86%	0.86	78%	0.779	S	S	*	*				176.2	137.8	118.8	-105.7	-70.9	0	0	0	111.1
828	K	24.8	Very low	26.9	Very low	199 Å²	199	152.3 Å²	152.3	87%	0.865	78%	0.775	S	S	*	*			trans	65.6	139.6	177.3	-51.8	159.1	-173.3	175.9	0	111.7
829	Q	28.4	Very low	27.1	Very low	183 Å²	183	154.8 Å²	154.8	86%	0.855	79%	0.789	S	S	*	*			cis	-139	110.6	20	-178.7	168.7	-15.8	0	0	109.3	S831	Q829-S831 PolarHBondContact O-N 2.99Å
830	R	25.1	Very low	27	Very low	242 Å²	242	148.2 Å²	148.2	91%	0.913	78%	0.782	S	S	*	*			trans	-85.3	96.2	176	-83.8	-176.5	170.3	174.5	-4	109.7	R832	R830-R832 PolarHBondContact O-N 3.23Å
831	S	28.1	Very low	26.9	Very low	96 Å²	96	146.6 Å²	146.6	67%	0.671	78%	0.777	S	S	*	*			trans	-69.2	74.4	169.5	39.8	0	0	0	0	111.5	Q829 I833	Q829-S831 PolarHBondContact O-N 2.99Å; S831-I833 PolarHBondContact O-N 3.06Å
832	R	25.2	Very low	26.8	Very low	206 Å²	206	144.8 Å²	144.8	78%	0.777	78%	0.777	S	S	*	*			trans	-65.2	98.3	156.8	-80.3	179.5	169	167.3	-5.5	107.6	R830 Y834	R830-R832 PolarHBondContact O-N 3.23Å; R832-Y834 HydrophobicContact CB-CD2 4.36Å; R832-Y834 PolarHBondContact O-N 3.42Å
833	I	26.5	Very low	27.1	Very low	132 Å²	132	143.7 Å²	143.7	68%	0.677	77%	0.774	S	S	*	*			trans	-75.8	78.2	167.1	-57.5	-178	0	0	0	108	S831 S835	S831-I833 PolarHBondContact O-N 3.06Å; I833-S835 PolarHBondContact O-N 3.31Å
834	Y	24.7	Very low	27.3	Very low	200 Å²	200	147 Å²	147	78%	0.784	78%	0.775	S	S	*	*			trans	-74.8	83.6	148.2	-88	-81.4	0	0	0	106.6	R832 L836	R832-Y834 HydrophobicContact CB-CD2 4.36Å; R832-Y834 PolarHBondContact O-N 3.42Å; Y834-L836 PolarHBondContact O-N 2.7Å
835	S	25.6	Very low	27.1	Very low	87 Å²	87	146.6 Å²	146.6	61%	0.608	78%	0.775	S	S	*	*			trans	-76.8	117.1	166.2	-169.7	0	0	0	0	107.9	I833 T837	I833-S835 PolarHBondContact O-N 3.31Å; S835-T837 PolarHBondContact O-N 3.36Å
836	L	24	Very low	27.5	Very low	168 Å²	168	145.6 Å²	145.6	88%	0.88	76%	0.759	S	S	*	*			trans	-69.2	119.5	173	-68.2	91.6	0	0	0	108.6	Y834	Y834-L836 PolarHBondContact O-N 2.7Å
837	T	27.4	Very low	28.1	Very low	119 Å²	119	145 Å²	145	73%	0.73	74%	0.742	S	S	*	*			trans	-130.7	144	167.1	44.9	0	0	0	0	109	S835	S835-T837 PolarHBondContact O-N 3.36Å
838	N	28.1	Very low	28.6	Very low	133 Å²	133	139.6 Å²	139.6	71%	0.711	73%	0.725	S	S	*	*			trans	-68.4	147.4	-177.8	-87.4	-30.1	0	0	0	111.3	A840	N838-A840 HydrophobicContact CB-CB 4.12Å; N838-A840 PolarHBondContact O-N 3.46Å
839	P	30	Very low	29.2	Very low	140 Å²	140	134.4 Å²	134.4	91%	0.909	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	50.5	169.5	35.9	-37.2	0	0	0	111.2
840	A	27.6	Very low	29.5	Very low	81 Å²	81	131.8 Å²	131.8	67%	0.669	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147	-2.5	-170	0	0	0	0	0	115.1	N838	N838-A840 HydrophobicContact CB-CB 4.12Å; N838-A840 PolarHBondContact O-N 3.46Å
841	T	26.7	Very low	30.1	Very low	108 Å²	108	123.7 Å²	123.7	66%	0.663	68%	0.677	S	S	*	*			trans	-141.1	80.6	178.4	53.5	0	0	0	0	110.6
842	E	26.7	Very low	30.1	Very low	196 Å²	196	130.4 Å²	130.4	92%	0.916	69%	0.687	S	S	*	*			trans	-72.4	137.8	164.6	-65.5	-172.7	145.3	0	0	109.4
843	S	30.7	Very low	30.4	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	67%	0.672	S	S	*	*			trans	-151.7	96.4	-179.5	-69	0	0	0	0	110.6	S845	S843-S845 PolarHBondContact O-N 2.84Å
844	F	28.2	Very low	30.6	Very low	182 Å²	182	123.6 Å²	123.6	80%	0.798	68%	0.675	S	S	*	*			trans	8.6	74.5	165.4	-56.3	-83.5	0	0	0	118.5	F846	F844-F846 HydrophobicContact CB-CE2 4.23Å
845	S	34.1	Very low	30.9	Very low	100 Å²	100	120.2 Å²	120.2	70%	0.699	67%	0.667	S	S	*	*			trans	-94.5	101	164.6	63.3	0	0	0	0	110.8	S843	S843-S845 PolarHBondContact O-N 2.84Å
846	F	34.3	Very low	30.9	Very low	118 Å²	118	120.6 Å²	120.6	52%	0.518	69%	0.685	S	S	.	*			trans	-71.5	125.6	177.5	-65.7	-87.2	0	0	0	111.5	N746 F844 V848	N746-F846 WeakPolarHBondContact O-CE1 3.41Å; F844-F846 HydrophobicContact CB-CE2 4.23Å; F846-V848 PolarHBondContact O-N 3.46Å; F846-V848 VanDerWaalsContact O-N 3.15Å
847	P	38.6	Very low	31	Very low	58 Å²	58	115.3 Å²	115.3	38%	0.377	67%	0.671	S	S	.	*			trans	-76.6	102.9	-179.9	28.8	-32.7	0	0	0	111.8	Y748 M849	Y748-P847 HydrophobicContact CD2-CB 4.28Å; Y748-P847 HydrophobicContact CD2-CG 3.52Å; Y748-P847 HydrophobicContact CE2-CG 4.28Å; Y748-P847 HydrophobicContact CG-CG 3.79Å; P847-M849 PolarHBondContact O-N 3.25Å
848	V	36	Very low	31	Very low	82 Å²	82	120.2 Å²	120.2	50%	0.497	68%	0.682	S	S	.	*			trans	-78	98.9	176.9	-175.8	0	0	0	0	110.7	L744 F846 L850	L744-V848 HydrophobicContact CD2-CG1 4.04Å; L744-V848 HydrophobicContact CD2-CG2 4.03Å; F846-V848 PolarHBondContact O-N 3.46Å; F846-V848 VanDerWaalsContact O-N 3.15Å; V848-L850 HydrophobicContact CG1-CD2 4.12Å; V848-L850 HydrophobicContact CG1-CG 4.29Å; V848-L850 PolarHBondContact O-N 3.33Å; V848-L850 VanDerWaalsContact O-N 3.13Å
849	M	38.1	Very low	31	Very low	90 Å²	90	121.8 Å²	121.8	44%	0.443	69%	0.689	S	S	.	*			trans	-76	96.9	170.5	-84.7	-147.5	-69	0	0	111.6	F745 P847 S851	F745-M849 HydrophobicContact CE2-CE 4.3Å; P847-M849 PolarHBondContact O-N 3.25Å; M849-S851 PolarHBondContact O-N 3.36Å
850	L	34.5	Very low	30.9	Very low	128 Å²	128	123.5 Å²	123.5	67%	0.67	68%	0.684	S	S	*	*			trans	-73.4	91.2	168.4	-66.4	177.6	0	0	0	110.7	V848 R852	V848-L850 HydrophobicContact CG1-CD2 4.12Å; V848-L850 HydrophobicContact CG1-CG 4.29Å; V848-L850 PolarHBondContact O-N 3.33Å; V848-L850 VanDerWaalsContact O-N 3.13Å; L850-R852 VanDerWaalsContact C-N 3.31Å; L850-R852 PolarHBondContact O-N 3.47Å
851	S	36.9	Very low	30.8	Very low	73 Å²	73	128.9 Å²	128.9	51%	0.51	69%	0.693	S	S	.	*			trans	-67.4	81.2	177.9	58.1	0	0	0	0	112.5	M849 I853	M849-S851 PolarHBondContact O-N 3.36Å; S851-I853 VanDerWaalsContact C-N 3.31Å; S851-I853 PolarHBondContact O-N 3.2Å
852	R	27.8	Very low	30.7	Very low	236 Å²	236	129.1 Å²	129.1	89%	0.891	70%	0.699	S	S	*	*			trans	-69.7	85.5	169.3	-75.2	-170.2	177.1	-172.3	1.3	110.4	L850 S854	L850-R852 VanDerWaalsContact C-N 3.31Å; L850-R852 PolarHBondContact O-N 3.47Å; R852-S854 PolarHBondContact O-N 3.17Å
853	I	32.2	Very low	30.7	Very low	89 Å²	89	127 Å²	127	46%	0.456	69%	0.692	S	S	.	*			trans	-60.9	105.5	165.1	-56.5	174.7	0	0	0	107.5	S851 I880	S851-I853 VanDerWaalsContact C-N 3.31Å; S851-I853 PolarHBondContact O-N 3.2Å; I853-I880 HydrophobicContact CD1-CD1 4.41Å
854	S	29.9	Very low	30.6	Very low	107 Å²	107	128 Å²	128	75%	0.748	70%	0.699	S	S	*	*			trans	-72.6	125.5	178.4	54.1	0	0	0	0	110.5	R852 G856	R852-S854 PolarHBondContact O-N 3.17Å; S854-G856 PolarHBondContact O-N 3Å
855	E	31	Very low	30.6	Very low	128 Å²	128	126 Å²	126	60%	0.598	70%	0.696	S	S	*	*			trans	-69	129.5	176.9	-60.2	-161.3	148.6	0	0	110.3	K737 G857 R883	K737-E855 IonicContact NZ-OE1 2.72Å; E855-G857 VanDerWaalsContact C-N 3.26Å; E855-G857 PolarHBondContact O-N 3.22Å; E855-R883 IonicContact OE1-CZ 3.86Å; E855-R883 IonicContact OE1-NE 3.05Å; E855-R883 IonicContact OE1-NH2 3.85Å; E855-R883 PolarHBondContact OE1-NH2 3.16Å
856	G	26.4	Very low	30.2	Very low	96 Å²	96	127.9 Å²	127.9	99%	0.99	70%	0.699	S	S	*	*			trans	-69	70.9	-174.4	0	0	0	0	0	114.3	S854	S854-G856 PolarHBondContact O-N 3Å
857	G	26	Very low	30	Very low	57 Å²	57	126.8 Å²	126.8	59%	0.588	70%	0.701	S	S	*	*			trans	-129.4	104.1	-175.5	0	0	0	0	0	112.8	E855 I859	E855-G857 VanDerWaalsContact C-N 3.26Å; E855-G857 PolarHBondContact O-N 3.22Å; G857-I859 PolarHBondContact O-N 2.92Å
858	K	27.4	Very low	29.6	Very low	221 Å²	221	132.3 Å²	132.3	96%	0.961	72%	0.722	S	S	*	*			trans	-38.3	98.9	-177.4	-63.2	170.2	-178.6	170.1	0	115.5
859	I	28.6	Very low	29.3	Very low	167 Å²	167	136.4 Å²	136.4	86%	0.856	73%	0.734	S	S	*	*			trans	-130.5	148.2	160	-61.8	-176.9	0	0	0	108.5	G857	G857-I859 PolarHBondContact O-N 2.92Å
860	Q	26.5	Very low	29	Very low	175 Å²	175	136 Å²	136	82%	0.818	74%	0.74	S	S	*	*			trans	-91.5	137.8	-170.5	-68.1	-178.4	-17.9	0	0	113.8
861	K	26.7	Very low	28.7	Very low	195 Å²	195	135.4 Å²	135.4	85%	0.848	74%	0.737	S	S	*	*			trans	41.9	109.4	143.5	-61.7	-176.8	175.9	-173	0	118.8
862	S	23.4	Very low	28.5	Very low	113 Å²	113	135.6 Å²	135.6	79%	0.79	74%	0.739	S	S	*	*				-166.8	161.9	118.5	45	0	0	0	0	111.2
863	I	28	Very low	28.7	Very low	150 Å²	150	128.3 Å²	128.3	77%	0.769	72%	0.717	S	S	*	*			trans	67.2	103.3	-179.7	-52.6	174.2	0	0	0	114	L865	I863-L865 HydrophobicContact CG2-CD1 4.4Å
864	S	28.4	Very low	28.7	Very low	123 Å²	123	127.3 Å²	127.3	86%	0.86	72%	0.718	S	S	*	*			trans	-93.1	128.6	162.1	-63.3	0	0	0	0	109.3
865	L	26.7	Very low	28.8	Very low	141 Å²	141	127.9 Å²	127.9	74%	0.738	70%	0.704	S	S	*	*			trans	-144.9	112.3	164.1	-93.4	163.8	0	0	0	107.2	I863	I863-L865 HydrophobicContact CG2-CD1 4.4Å
866	D	27.6	Very low	28.9	Very low	139 Å²	139	125.7 Å²	125.7	74%	0.743	70%	0.696	S	S	*	*			trans	37.5	77.8	162.5	-50.7	-17.4	0	0	0	117.7	E868	D866-E868 VanDerWaalsContact C-N 3.27Å; D866-E868 PolarHBondContact O-N 3.37Å
867	T	28.9	Very low	29.4	Very low	94 Å²	94	127.1 Å²	127.1	58%	0.577	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-15.7	-175.6	-26.9	0	0	0	0	115.2
868	E	30	Very low	29.8	Very low	175 Å²	175	127.1 Å²	127.1	82%	0.818	66%	0.663	S	S	*	*	H	α-helix	trans	-79.3	-24.5	-166.1	-60.6	-173.1	162	0	0	114.6	D866 S872	D866-E868 VanDerWaalsContact C-N 3.27Å; D866-E868 PolarHBondContact O-N 3.37Å; E868-S872 PolarHBondContact O-OG 3.04Å
869	F	30.5	Very low	30.2	Very low	167 Å²	167	123 Å²	123	73%	0.732	65%	0.652	S	S	*	*	H	α-helix	trans	-89.7	-17.5	177	-107.2	-83.2	0	0	0	114.3	S872	F869-S872 PolarHBondContact O-OG 2.96Å
870	S	31.7	Very low	30.5	Very low	83 Å²	83	118 Å²	118	58%	0.58	63%	0.626	S	S	*	*	H	α-helix	trans	-80	-43	175.8	-66.9	0	0	0	0	111.5	S872 I873 S874	S870-S872 VanDerWaalsContact C-N 3.27Å; S870-S872 PolarHBondContact O-N 3.44Å; S870-I873 CarbonylContact O-C 3.58Å; S870-I873 PolarHBondContact O-N 2.94Å; S870-S874 PolarHBondContact O-N 3.29Å
871	D	28.8	Very low	31	Very low	114 Å²	114	117.1 Å²	117.1	61%	0.61	62%	0.622	S	S	*	*	H	α-helix	trans	-67.7	-27.5	-176.8	-71.6	0.9	0	0	0	112.5	S874	D871-S874 VanDerWaalsContact O-CB 3.28Å; D871-S874 WeakPolarHBondContact O-CB 3.36Å; D871-S874 PolarHBondContact O-N 3.34Å
872	S	32.2	Very low	31.8	Very low	77 Å²	77	114.9 Å²	114.9	54%	0.538	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-17.5	176.4	44.7	0	0	0	0	114.4	E868 F869 S870	E868-S872 PolarHBondContact O-OG 3.04Å; F869-S872 PolarHBondContact O-OG 2.96Å; S870-S872 VanDerWaalsContact C-N 3.27Å; S870-S872 PolarHBondContact O-N 3.44Å
873	I	31.6	Very low	33	Very low	84 Å²	84	113.5 Å²	113.5	43%	0.431	59%	0.586	S	S	.	*	S	Bend	trans	-102.9	3.6	170.4	-58.9	176.9	0	0	0	110.7	S870 Y875	S870-I873 CarbonylContact O-C 3.58Å; S870-I873 PolarHBondContact O-N 2.94Å; I873-Y875 PolarHBondContact O-N 3.45Å
874	S	32.2	Very low	34.6	Very low	68 Å²	68	112.1 Å²	112.1	48%	0.476	57%	0.571	S	S	.	*			trans	-73.2	74.6	170.6	-157.5	0	0	0	0	111.2	R766 S870 D871	R766-S874 PolarHBondContact NH1-O 3.1Å; S870-S874 PolarHBondContact O-N 3.29Å; D871-S874 VanDerWaalsContact O-CB 3.28Å; D871-S874 WeakPolarHBondContact O-CB 3.36Å; D871-S874 PolarHBondContact O-N 3.34Å
875	Y	32.2	Very low	36.5	Very low	118 Å²	118	109.6 Å²	109.6	46%	0.463	55%	0.551	S	S	.	*			trans	-44.5	147.3	157.5	-85.2	-94.1	0	0	0	110.1	I873 W877	I873-Y875 PolarHBondContact O-N 3.45Å; Y875-W877 HydrophobicContact CD1-CH2 4.49Å; Y875-W877 HydrophobicContact CD1-CZ2 4.37Å; Y875-W877 HydrophobicContact CD2-CZ2 4.3Å; Y875-W877 HydrophobicContact CG-CD2 4.42Å; Y875-W877 AromaticContact CG-CE2 3.95Å; Y875-W877 HydrophobicContact CG-CZ2 4.09Å; Y875-W877 PolarHBondContact O-N 3.4Å
876	D	34	Very low	38.9	Very low	82 Å²	82	105.6 Å²	105.6	44%	0.439	53%	0.53	S	S	.	.			trans	-74.7	61.6	172.4	-134.2	-41.6	0	0	0	111	R766 S878 D879	R766-D876 IonicContact CZ-OD2 3.76Å; R766-D876 IonicContact NE-OD2 3.38Å; R766-D876 PolarHBondContact NE-OD2 2.85Å; R766-D876 IonicContact NH2-OD2 2.81Å; R766-D876 PolarHBondContact NH2-OD2 3.01Å; D876-S878 PolarHBondContact O-N 3.15Å; D876-S878 VanDerWaalsContact OD1-CB 3.31Å; D876-S878 WeakPolarHBondContact OD1-CB 3.34Å; D876-S878 PolarHBondContact OD1-OG 3.02Å; D876-D879 PolarHBondContact O-N 2.68Å
877	W	37.1	Very low	41.3	Very low	127 Å²	127	100.7 Å²	100.7	48%	0.481	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-68.1	11.2	176.6	-65.9	137	0	0	0	113.3	Y875 D879 I880	Y875-W877 HydrophobicContact CD1-CH2 4.49Å; Y875-W877 HydrophobicContact CD1-CZ2 4.37Å; Y875-W877 HydrophobicContact CD2-CZ2 4.3Å; Y875-W877 HydrophobicContact CG-CD2 4.42Å; Y875-W877 AromaticContact CG-CE2 3.95Å; Y875-W877 HydrophobicContact CG-CZ2 4.09Å; Y875-W877 PolarHBondContact O-N 3.4Å; W877-D879 PolarHBondContact O-N 3.15Å; W877-I880 HydrophobicContact CB-CD1 4.03Å; W877-I880 HydrophobicContact CB-CG1 4Å; W877-I880 HydrophobicContact CD2-CD1 3.51Å; W877-I880 HydrophobicContact CD2-CG1 3.99Å; W877-I880 HydrophobicContact CE3-CD1 3.37Å; W877-I880 HydrophobicContact CE3-CG1 3.51Å; W877-I880 HydrophobicContact CG-CD1 3.87Å; W877-I880 HydrophobicContact CG-CG1 4.26Å; W877-I880 HydrophobicContact CH2-CD1 4.48Å; W877-I880 HydrophobicContact CZ3-CD1 3.88Å; W877-I880 HydrophobicContact CZ3-CG1 4.19Å; W877-I880 WeakPolarHBondContact O-CA 3.4Å; W877-I880 PolarHBondContact O-N 3.45Å
878	S	33.6	Very low	44.1	Very low	57 Å²	57	97.1 Å²	97.1	40%	0.399	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-47.6	-33.5	158.3	-52.9	0	0	0	0	111.7	D876 I880 H881	D876-S878 PolarHBondContact O-N 3.15Å; D876-S878 VanDerWaalsContact OD1-CB 3.31Å; D876-S878 WeakPolarHBondContact OD1-CB 3.34Å; D876-S878 PolarHBondContact OD1-OG 3.02Å; S878-I880 VanDerWaalsContact C-N 3.33Å; S878-I880 PolarHBondContact O-N 3.03Å; S878-H881 WeakPolarHBondContact O-CB 3.42Å; S878-H881 PolarHBondContact O-CD2 3.05Å; S878-H881 PolarHBondContact O-N 3.37Å
879	D	35.4	Very low	46.9	Very low	135 Å²	135	90 Å²	90	72%	0.722	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-75.4	-17.4	175.4	-65.3	-27.3	0	0	0	113.5	D876 W877 H881 Y882	D876-D879 PolarHBondContact O-N 2.68Å; W877-D879 PolarHBondContact O-N 3.15Å; D879-H881 PolarHBondContact O-N 3.46Å; D879-Y882 PolarHBondContact O-N 2.95Å
880	I	35.8	Very low	49.9	Very low	62 Å²	62	83.5 Å²	83.5	32%	0.318	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-80.2	24	161.3	-31.1	-178.9	0	0	0	111.7	I853 W877 S878 Y882 R883	I853-I880 HydrophobicContact CD1-CD1 4.41Å; W877-I880 HydrophobicContact CB-CD1 4.03Å; W877-I880 HydrophobicContact CB-CG1 4Å; W877-I880 HydrophobicContact CD2-CD1 3.51Å; W877-I880 HydrophobicContact CD2-CG1 3.99Å; W877-I880 HydrophobicContact CE3-CD1 3.37Å; W877-I880 HydrophobicContact CE3-CG1 3.51Å; W877-I880 HydrophobicContact CG-CD1 3.87Å; W877-I880 HydrophobicContact CG-CG1 4.26Å; W877-I880 HydrophobicContact CH2-CD1 4.48Å; W877-I880 HydrophobicContact CZ3-CD1 3.88Å; W877-I880 HydrophobicContact CZ3-CG1 4.19Å; W877-I880 WeakPolarHBondContact O-CA 3.4Å; W877-I880 PolarHBondContact O-N 3.45Å; S878-I880 VanDerWaalsContact C-N 3.33Å; S878-I880 PolarHBondContact O-N 3.03Å; I880-Y882 CarbonylContact O-C 3.57Å; I880-Y882 PolarHBondContact O-N 2.95Å; I880-R883 PolarHBondContact O-N 3.47Å; I880-R883 VanDerWaalsContact O-N 3.09Å
881	H	37.2	Very low	52.7	Low	156 Å²	156	83.3 Å²	83.3	72%	0.722	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-64.5	-18.3	152.6	-72.1	-5.9	0	0	0	111.7	S878 D879 R883	S878-H881 WeakPolarHBondContact O-CB 3.42Å; S878-H881 PolarHBondContact O-CD2 3.05Å; S878-H881 PolarHBondContact O-N 3.37Å; D879-H881 PolarHBondContact O-N 3.46Å; H881-R883 PolarHBondContact O-N 3.24Å
882	Y	41.8	Very low	55.8	Low	148 Å²	148	79.9 Å²	79.9	58%	0.58	39%	0.392	S	S	*	.			trans	-68.9	57.3	148.7	-64.7	-65.9	0	0	0	112.4	D879 I880 R884	D879-Y882 PolarHBondContact O-N 2.95Å; I880-Y882 CarbonylContact O-C 3.57Å; I880-Y882 PolarHBondContact O-N 2.95Å; Y882-R884 PolarHBondContact O-N 3.15Å; Y882-R884 VanDerWaalsContact O-N 3.15Å
883	R	49	Very low	58.7	Low	84 Å²	84	78 Å²	78	32%	0.317	39%	0.385	S	S	.	.			trans	-52.7	124.2	150.9	-94	-161.2	-169.2	-105.1	15.4	105.1	E855 I880 H881 T885	E855-R883 IonicContact OE1-CZ 3.86Å; E855-R883 IonicContact OE1-NE 3.05Å; E855-R883 IonicContact OE1-NH2 3.85Å; E855-R883 PolarHBondContact OE1-NH2 3.16Å; I880-R883 PolarHBondContact O-N 3.47Å; I880-R883 VanDerWaalsContact O-N 3.09Å; H881-R883 PolarHBondContact O-N 3.24Å; R883-T885 VanDerWaalsContact O-CG2 3.32Å; R883-T885 WeakPolarHBondContact O-CG2 3.42Å; R883-T885 PolarHBondContact O-N 3.41Å; R883-T885 VanDerWaalsContact O-N 3.1Å
884	R	62.5	Low	61.6	Low	120 Å²	120	75 Å²	75	45%	0.453	37%	0.374	S	S	.	.			trans	-55.8	124.7	176.2	-65.5	-177.2	-173.6	152.9	-2.3	108.3	L738 Y882 E998	L738-R884 HydrophobicContact CB-CB 4.25Å; L738-R884 WeakPolarHBondContact CB-O 3.5Å; L738-R884 HydrophobicContact CD1-CB 3.99Å; L738-R884 HydrophobicContact CG-CB 4.29Å; L738-R884 WeakPolarHBondContact CG-O 3.37Å; L738-R884 PolarHBondContact N-O 2.75Å; Y882-R884 PolarHBondContact O-N 3.15Å; Y882-R884 VanDerWaalsContact O-N 3.15Å; R884-E998 IonicContact CZ-OE2 3.16Å; R884-E998 IonicContact NH1-OE1 3.34Å; R884-E998 IonicContact NH1-OE2 2.73Å; R884-E998 PolarHBondContact NH1-OE2 3.35Å; R884-E998 IonicContact NH2-OE2 2.77Å; R884-E998 PolarHBondContact NH2-OE2 2.93Å
885	T	67.8	Low	64.5	Low	71 Å²	71	76.1 Å²	76.1	44%	0.436	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.9	174.9	71.5	0	0	0	0	110.3	P735 I736 K737 R883	P735-T885 HydrophobicContact CG-CG2 4.38Å; I736-T885 CarbonylContact O-C 3.53Å; I736-T885 WeakPolarHBondContact O-CA 3.42Å; I736-T885 VanDerWaalsContact O-CB 3.26Å; I736-T885 WeakPolarHBondContact O-CB 3.41Å; K737-T885 HydrophobicContact CG-CG2 4.38Å; R883-T885 VanDerWaalsContact O-CG2 3.32Å; R883-T885 WeakPolarHBondContact O-CG2 3.42Å; R883-T885 PolarHBondContact O-N 3.41Å; R883-T885 VanDerWaalsContact O-N 3.1Å
886	I	77.1	Confident	67.4	Low	57 Å²	57	70.7 Å²	70.7	29%	0.292	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.2	174.8	-72.7	177.9	0	0	0	108.1	P735 I736 L738 R888 L994	P735-I886 CarbonylContact C-O 3.6Å; I736-I886 PolarHBondContact N-O 2.93Å; I736-I886 PolarHBondContact O-N 3.38Å; L738-I886 HydrophobicContact CD1-CD1 3.85Å; L738-I886 HydrophobicContact CD1-CG1 4.07Å; L738-I886 HydrophobicContact CD2-CB 4.4Å; L738-I886 HydrophobicContact CD2-CD1 4.07Å; L738-I886 HydrophobicContact CD2-CG1 4.2Å; L738-I886 HydrophobicContact CG-CD1 4.47Å; L738-I886 HydrophobicContact CG-CG1 4.41Å; I886-R888 PolarHBondContact O-N 2.85Å; I886-L994 HydrophobicContact CD1-CD1 3.89Å; I886-L994 HydrophobicContact CD1-CD2 3.47Å; I886-L994 VanDerWaalsContact CD1-CD2 3.47Å; I886-L994 HydrophobicContact CD1-CG 4.17Å; I886-L994 HydrophobicContact CG2-CD1 4.41Å
887	Q	77.4	Confident	70.2	Confident	36 Å²	36	73.7 Å²	73.7	17%	0.168	36%	0.359	C	S	.	.			trans	-65.1	128.3	179.2	-168.9	174.3	12.4	0	0	110.2	R603 W695	R603-Q887 VanDerWaalsContact CZ-NE2 3.28Å; R603-Q887 VanDerWaalsContact CZ-OE1 3.25Å; R603-Q887 VanDerWaalsContact NH2-NE2 3.15Å; W695-Q887 HydrophobicContact CE3-CG 4.49Å
888	R	88	Confident	72.8	Confident	18 Å²	18	67.9 Å²	67.9	7%	0.068	34%	0.337	C	S	.	.			trans	-64.9	137.1	172.3	-170.5	176.4	-69.3	106.2	3.5	109.3	L698 S731 I732 S734 I736 I886 L913 T914 D915	L698-R888 HydrophobicContact CD1-CG 4.36Å; L698-R888 HydrophobicContact CD2-CB 4.4Å; L698-R888 WeakPolarHBondContact CD2-O 3.44Å; S731-R888 PolarHBondContact O-NH1 2.79Å; I732-R888 PolarHBondContact O-NH1 3.04Å; S734-R888 PolarHBondContact O-NH1 2.85Å; I736-R888 HydrophobicContact CD1-CB 4.28Å; I736-R888 HydrophobicContact CD1-CG 4.46Å; I736-R888 HydrophobicContact CG1-CB 4.26Å; I886-R888 PolarHBondContact O-N 2.85Å; R888-L913 HydrophobicContact CG-CB 4.21Å; R888-L913 HydrophobicContact CG-CD2 4.03Å; R888-T914 WeakPolarHBondContact CA-OG1 3.45Å; R888-D915 VanDerWaalsContact CD-OD1 3.31Å; R888-D915 WeakPolarHBondContact CD-OD1 3.33Å; R888-D915 IonicContact CZ-OD1 3.52Å; R888-D915 IonicContact CZ-OD2 2.65Å; R888-D915 VanDerWaalsContact CZ-OD2 3.31Å; R888-D915 VanDerWaalsContact NE-CG 3.29Å; R888-D915 IonicContact NE-OD1 3.44Å; R888-D915 PolarHBondContact NE-OD1 3.22Å; R888-D915 IonicContact NE-OD2 3.68Å; R888-D915 PolarHBondContact NE-OD2 3.3Å; R888-D915 VanDerWaalsContact NE-OD2 3.09Å; R888-D915 IonicContact NH2-OD1 3.52Å; R888-D915 IonicContact NH2-OD2 2.88Å; R888-D915 PolarHBondContact NH2-OD2 3.12Å
889	T	90.1	Very high	75.5	Confident	26 Å²	26	69.5 Å²	69.5	16%	0.16	34%	0.337	C	S	.	.			trans	-133.2	164	174.2	65.4	0	0	0	0	110.5	T694 L913 T914	T694-T889 HydrophobicContact CG2-CG2 4.31Å; T889-L913 WeakPolarHBondContact O-CA 3.34Å; T889-L913 VanDerWaalsContact O-CB 3.29Å; T889-L913 WeakPolarHBondContact O-CB 3.21Å; T889-T914 PolarHBondContact N-OG1 3.2Å; T889-T914 PolarHBondContact O-N 3.49Å; T889-T914 VanDerWaalsContact OG1-CG2 3.3Å; T889-T914 WeakPolarHBondContact OG1-CG2 3.43Å
890	V	91.8	Very high	78	Confident	31 Å²	31	65.1 Å²	65.1	19%	0.188	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.6	170.9	-172.6	0	0	0	0	107.7	L698 L701 L913	L698-V890 HydrophobicContact CB-CG2 4.48Å; L698-V890 HydrophobicContact CD1-CG2 3.9Å; L701-V890 HydrophobicContact CD2-CG2 3.73Å; V890-L913 HydrophobicContact CG2-CG 4.31Å
891	L	92	Very high	80.1	Confident	78 Å²	78	65.4 Å²	65.4	41%	0.408	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-42.2	-178.3	-63.1	179.2	0	0	0	111.8	I912 T914 A987	L891-I912 HydrophobicContact CB-CG2 4.48Å; L891-I912 HydrophobicContact CD1-CG2 4.45Å; L891-I912 PolarHBondContact N-O 3.17Å; L891-T914 HydrophobicContact CD1-CG2 4.11Å; L891-T914 HydrophobicContact CD2-CG2 3.81Å; L891-T914 HydrophobicContact CG-CG2 4Å; L891-A987 HydrophobicContact CD1-CB 3.71Å
892	Y	93.9	Very high	81.9	Confident	42 Å²	42	64.2 Å²	64.2	17%	0.165	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	157.3	-176.5	-169.1	-97.4	0	0	0	110.8	H911 I912 K976 E979 W980 Q983	Y892-H911 WeakPolarHBondContact O-CA 3.3Å; Y892-I912 HydrophobicContact CD1-CD1 4.19Å; Y892-I912 HydrophobicContact CG-CD1 4.44Å; Y892-I912 PolarHBondContact N-O 3.49Å; Y892-I912 PolarHBondContact O-N 3.44Å; Y892-K976 PolarHBondContact OH-NZ 3.45Å; Y892-E979 VanDerWaalsContact OH-CD 3.26Å; Y892-E979 PolarHBondContact OH-OE1 3.05Å; Y892-W980 HydrophobicContact CD1-CD2 4.26Å; Y892-W980 AromaticContact CD1-CE3 3.97Å; Y892-W980 HydrophobicContact CD1-CE3 3.97Å; Y892-W980 AromaticContact CD1-CH2 3.86Å; Y892-W980 HydrophobicContact CD1-CH2 3.86Å; Y892-W980 HydrophobicContact CD1-CZ2 4.14Å; Y892-W980 AromaticContact CD1-CZ3 3.76Å; Y892-W980 HydrophobicContact CD1-CZ3 3.76Å; Y892-W980 AromaticContact CE1-CD2 3.78Å; Y892-W980 HydrophobicContact CE1-CD2 3.78Å; Y892-W980 AromaticContact CE1-CE2 3.6Å; Y892-W980 AromaticContact CE1-CE3 3.98Å; Y892-W980 HydrophobicContact CE1-CE3 3.98Å; Y892-W980 HydrophobicContact CE1-CG 4.43Å; Y892-W980 AromaticContact CE1-CH2 3.9Å; Y892-W980 HydrophobicContact CE1-CH2 3.9Å; Y892-W980 AromaticContact CE1-CZ2 3.69Å; Y892-W980 HydrophobicContact CE1-CZ2 3.69Å; Y892-W980 HydrophobicContact CE1-CZ3 4.04Å; Y892-Q983 HydrophobicContact CD2-CG 4.05Å; Y892-Q983 HydrophobicContact CE2-CG 4.35Å; Y892-Q983 HydrophobicContact CG-CB 4.44Å; Y892-Q983 HydrophobicContact CG-CG 4.2Å
893	G	92.1	Very high	83.6	Confident	39 Å²	39	61.4 Å²	61.4	40%	0.402	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	155.6	174	0	0	0	0	0	113.6	C910	G893-C910 CarbonylContact C-O 3.54Å; G893-C910 WeakPolarHBondContact CA-O 3.32Å
894	G	92.6	Very high	85.2	Confident	20 Å²	20	68.4 Å²	68.4	21%	0.206	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.6	178.9	-179.8	0	0	0	0	0	114.2	V909 C910	G894-V909 WeakPolarHBondContact O-CA 3.49Å; G894-C910 PolarHBondContact N-O 2.84Å; G894-C910 PolarHBondContact O-N 2.84Å
895	N	92.7	Very high	86.2	Confident	91 Å²	91	66.1 Å²	66.1	49%	0.487	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	136.5	-178.4	-65.5	39.1	0	0	0	111.8	E907 T908 V909	N895-E907 PolarHBondContact ND2-OE1 3.23Å; N895-E907 VanDerWaalsContact ND2-OE1 3.09Å; N895-T908 CarbonylContact C-O 3.52Å; N895-T908 VanDerWaalsContact CA-O 3.3Å; N895-T908 WeakPolarHBondContact CA-O 3.28Å; N895-V909 WeakPolarHBondContact OD1-CG2 3.45Å
896	L	93.5	Very high	87.3	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	152.8	170.2	-72.8	179.8	0	0	0	109.6	T908 C910 F954 F971 A973 W980	L896-T908 PolarHBondContact N-O 2.85Å; L896-T908 PolarHBondContact O-N 2.97Å; L896-T908 VanDerWaalsContact O-O 3.04Å; L896-T908 PolarHBondContact O-OG1 3.34Å; L896-C910 HydrophobicContact CD1-CB 3.96Å; L896-F954 HydrophobicContact CD1-CE1 4.42Å; L896-F954 HydrophobicContact CD1-CZ 4.06Å; L896-F954 HydrophobicContact CD2-CE1 4.39Å; L896-F971 HydrophobicContact CB-CD1 4.02Å; L896-F971 HydrophobicContact CD1-CB 4.37Å; L896-F971 HydrophobicContact CD1-CD1 3.7Å; L896-F971 HydrophobicContact CD1-CE1 4.26Å; L896-F971 HydrophobicContact CD1-CG 4.23Å; L896-F971 HydrophobicContact CG-CD1 4.47Å; L896-A973 HydrophobicContact CD2-CB 3.46Å; L896-A973 VanDerWaalsContact CD2-CB 3.46Å; L896-W980 HydrophobicContact CD1-CD2 3.99Å; L896-W980 HydrophobicContact CD1-CE3 4.1Å; L896-W980 HydrophobicContact CD1-CH2 4.07Å; L896-W980 HydrophobicContact CD1-CZ2 3.94Å; L896-W980 HydrophobicContact CD1-CZ3 4.15Å; L896-W980 HydrophobicContact CD2-CD2 4.13Å; L896-W980 HydrophobicContact CD2-CG 4.16Å; L896-W980 HydrophobicContact CD2-CZ2 4.19Å; L896-W980 HydrophobicContact CG-CD2 4.3Å; L896-W980 HydrophobicContact CG-CH2 4.33Å; L896-W980 HydrophobicContact CG-CZ2 3.76Å
897	R	92.3	Very high	88	Confident	146 Å²	146	68.6 Å²	68.6	55%	0.551	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	101.5	165	-88.7	-173.1	-72.9	-131.2	1.2	109.8	I906 F971 S972	R897-I906 CarbonylContact C-O 3.46Å; R897-I906 WeakPolarHBondContact CA-O 3.13Å; R897-F971 WeakPolarHBondContact O-CA 3.45Å; R897-S972 PolarHBondContact N-O 3.32Å; R897-S972 PolarHBondContact O-N 3.33Å
898	F	92.4	Very high	88.7	Confident	5 Å²	5	67 Å²	67	2%	0.022	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	138.6	177.1	164.7	-101	0	0	0	111.4	E900 S905 I906 T908 I919 K935 Y969 I970 F971	F898-E900 HydrophobicContact CE1-CB 4.14Å; F898-E900 HydrophobicContact CZ-CB 3.77Å; F898-S905 CarbonylContact O-C 3.58Å; F898-S905 VanDerWaalsContact O-CA 3.28Å; F898-S905 WeakPolarHBondContact O-CA 3.15Å; F898-I906 PolarHBondContact N-O 2.8Å; F898-I906 PolarHBondContact O-N 2.93Å; F898-T908 HydrophobicContact CB-CG2 3.59Å; F898-T908 HydrophobicContact CD1-CG2 4.33Å; F898-T908 HydrophobicContact CG-CG2 4.28Å; F898-I919 HydrophobicContact CD2-CD1 4.35Å; F898-I919 HydrophobicContact CD2-CG2 4.22Å; F898-I919 HydrophobicContact CE2-CD1 4.11Å; F898-I919 HydrophobicContact CG-CG2 4.26Å; F898-K935 HydrophobicContact CZ-CG 4.39Å; F898-Y969 HydrophobicContact CD2-CG 4.47Å; F898-Y969 AromaticContact CE2-CD1 3.75Å; F898-Y969 HydrophobicContact CE2-CD1 3.75Å; F898-Y969 AromaticContact CE2-CD2 3.86Å; F898-Y969 HydrophobicContact CE2-CD2 3.86Å; F898-Y969 HydrophobicContact CE2-CE1 4.26Å; F898-Y969 HydrophobicContact CE2-CE2 4.32Å; F898-Y969 AromaticContact CE2-CG 3.56Å; F898-Y969 HydrophobicContact CE2-CG 3.56Å; F898-Y969 HydrophobicContact CZ-CD1 4.07Å; F898-Y969 HydrophobicContact CZ-CE1 4.26Å; F898-Y969 HydrophobicContact CZ-CG 4.33Å; F898-I970 CarbonylContact C-O 3.52Å; F898-F971 HydrophobicContact CB-CD1 4.13Å; F898-F971 HydrophobicContact CB-CE1 3.9Å; F898-F971 HydrophobicContact CD2-CD1 4.36Å; F898-F971 AromaticContact CD2-CE1 3.66Å; F898-F971 HydrophobicContact CD2-CE1 3.66Å; F898-F971 HydrophobicContact CD2-CE2 4.43Å; F898-F971 AromaticContact CD2-CZ 3.7Å; F898-F971 HydrophobicContact CD2-CZ 3.7Å; F898-F971 HydrophobicContact CE2-CZ 4.37Å; F898-F971 HydrophobicContact CG-CE1 4.25Å
899	K	90.6	Very high	89	Confident	91 Å²	91	66.5 Å²	66.5	40%	0.396	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	128.3	174.8	-177.4	-174.5	177.4	-174.6	0	109.7	N903 I970	K899-N903 WeakPolarHBondContact CG-O 3.46Å; K899-I970 HydrophobicContact CB-CB 4.33Å; K899-I970 PolarHBondContact N-O 3.04Å; K899-I970 PolarHBondContact O-N 3.28Å
900	E	87.6	Confident	89.2	Confident	42 Å²	42	65.3 Å²	65.3	20%	0.196	34%	0.339	C	S	.	.			trans	-115.3	105.1	172.8	173.1	176.9	-134.3	0	0	107.4	F898 N903 K935 Y969	F898-E900 HydrophobicContact CE1-CB 4.14Å; F898-E900 HydrophobicContact CZ-CB 3.77Å; E900-N903 WeakPolarHBondContact O-CA 3.35Å; E900-N903 WeakPolarHBondContact O-CB 3.16Å; E900-N903 PolarHBondContact O-N 2.75Å; E900-N903 PolarHBondContact O-ND2 2.85Å; E900-K935 IonicContact OE1-NZ 2.66Å; E900-K935 PolarHBondContact OE1-NZ 2.83Å; E900-K935 WeakPolarHBondContact OE2-CE 3.41Å; E900-K935 IonicContact OE2-NZ 3.93Å; E900-K935 PolarHBondContact OE2-NZ 3.44Å; E900-Y969 HydrophobicContact CB-CD1 4.2Å; E900-Y969 HydrophobicContact CB-CE1 4.46Å; E900-Y969 HydrophobicContact CG-CD1 4.22Å; E900-Y969 HydrophobicContact CG-CE1 4.15Å; E900-Y969 WeakPolarHBondContact OE1-CE1 3.21Å
901	P	79.2	Confident	89.3	Confident	69 Å²	69	64.8 Å²	64.8	45%	0.448	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	138	-176.5	-25.1	34.9	0	0	0	112.2	I970	P901-I970 HydrophobicContact CG-CD1 4.04Å
902	P	75.9	Confident	89.5	Confident	130 Å²	130	61.1 Å²	61.1	84%	0.844	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.5	7.6	4.7	36.8	-37.2	0	0	0	114.9
903	N	76.9	Confident	89.5	Confident	89 Å²	89	59.1 Å²	59.1	48%	0.476	31%	0.308	S	S	.	.	S	Bend	trans	-64.1	157	-173.2	-60.3	-47.2	0	0	0	113.3	K899 E900	K899-N903 WeakPolarHBondContact CG-O 3.46Å; E900-N903 WeakPolarHBondContact O-CA 3.35Å; E900-N903 WeakPolarHBondContact O-CB 3.16Å; E900-N903 PolarHBondContact O-N 2.75Å; E900-N903 PolarHBondContact O-ND2 2.85Å
904	R	81.9	Confident	89.6	Confident	231 Å²	231	58.2 Å²	58.2	87%	0.872	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-66	150.5	171.9	-64.8	-176.8	178.7	-173.5	-0.9	110.5	I906	R904-I906 PolarHBondContact O-N 3.36Å
905	S	85	Confident	89.6	Confident	72 Å²	72	57.8 Å²	57.8	50%	0.503	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-63.5	132.6	173.1	55.4	0	0	0	0	111.4	F898	F898-S905 CarbonylContact O-C 3.58Å; F898-S905 VanDerWaalsContact O-CA 3.28Å; F898-S905 WeakPolarHBondContact O-CA 3.15Å
906	I	90.5	Very high	89.6	Confident	56 Å²	56	54.4 Å²	54.4	29%	0.287	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.4	177.7	-53.5	178.5	0	0	0	107.8	R897 F898 R904 T908 K921	R897-I906 CarbonylContact C-O 3.46Å; R897-I906 WeakPolarHBondContact CA-O 3.13Å; F898-I906 PolarHBondContact N-O 2.8Å; F898-I906 PolarHBondContact O-N 2.93Å; R904-I906 PolarHBondContact O-N 3.36Å; I906-T908 HydrophobicContact CB-CG2 4.37Å; I906-T908 HydrophobicContact CG2-CG2 4.21Å; I906-K921 HydrophobicContact CG2-CD 4.07Å
907	E	91.6	Very high	89.6	Confident	125 Å²	125	54.2 Å²	54.2	58%	0.584	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.3	168.1	-171.9	170.1	-168.9	0	0	110.1	N895	N895-E907 PolarHBondContact ND2-OE1 3.23Å; N895-E907 VanDerWaalsContact ND2-OE1 3.09Å
908	T	93.1	Very high	89.6	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	158.4	-173.4	61.9	0	0	0	0	110.2	N895 L896 F898 I906 I919 T920 I934	N895-T908 CarbonylContact C-O 3.52Å; N895-T908 VanDerWaalsContact CA-O 3.3Å; N895-T908 WeakPolarHBondContact CA-O 3.28Å; L896-T908 PolarHBondContact N-O 2.85Å; L896-T908 PolarHBondContact O-N 2.97Å; L896-T908 VanDerWaalsContact O-O 3.04Å; L896-T908 PolarHBondContact O-OG1 3.34Å; F898-T908 HydrophobicContact CB-CG2 3.59Å; F898-T908 HydrophobicContact CD1-CG2 4.33Å; F898-T908 HydrophobicContact CG-CG2 4.28Å; I906-T908 HydrophobicContact CB-CG2 4.37Å; I906-T908 HydrophobicContact CG2-CG2 4.21Å; T908-I919 HydrophobicContact CG2-CG2 4.3Å; T908-T920 CarbonylContact C-O 3.54Å; T908-T920 WeakPolarHBondContact CA-O 3.41Å; T908-T920 WeakPolarHBondContact CB-O 3.41Å; T908-I934 HydrophobicContact CG2-CD1 3.38Å
909	V	93.5	Very high	89.6	Confident	9 Å²	9	47.1 Å²	47.1	6%	0.055	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	115.9	168.3	-179	0	0	0	0	107.1	G894 N895 T920 W931	G894-V909 WeakPolarHBondContact O-CA 3.49Å; N895-V909 WeakPolarHBondContact OD1-CG2 3.45Å; V909-T920 PolarHBondContact N-O 2.86Å; V909-T920 WeakPolarHBondContact O-CB 3.28Å; V909-T920 PolarHBondContact O-N 3.05Å; V909-T920 VanDerWaalsContact O-N 3.1Å; V909-T920 PolarHBondContact O-OG1 2.85Å; V909-W931 HydrophobicContact CB-CE3 4.02Å; V909-W931 HydrophobicContact CB-CH2 3.98Å; V909-W931 HydrophobicContact CB-CZ3 3.57Å; V909-W931 HydrophobicContact CG1-CH2 4.06Å; V909-W931 HydrophobicContact CG1-CZ2 4.43Å; V909-W931 HydrophobicContact CG1-CZ3 4.14Å; V909-W931 HydrophobicContact CG2-CE3 4.25Å; V909-W931 HydrophobicContact CG2-CH2 3.65Å; V909-W931 HydrophobicContact CG2-CZ3 3.34Å
910	C	94.7	Very high	89.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	150.2	-177.6	-60.9	0	0	0	0	109.8	G893 G894 L896 F917 L918 W980	G893-C910 CarbonylContact C-O 3.54Å; G893-C910 WeakPolarHBondContact CA-O 3.32Å; G894-C910 PolarHBondContact N-O 2.84Å; G894-C910 PolarHBondContact O-N 2.84Å; L896-C910 HydrophobicContact CD1-CB 3.96Å; C910-F917 HydrophobicContact CB-CE2 3.79Å; C910-F917 HydrophobicContact CB-CZ 3.76Å; C910-L918 CarbonylContact C-O 3.5Å; C910-L918 WeakPolarHBondContact CA-O 3.42Å; C910-W980 HydrophobicContact CB-CH2 3.91Å; C910-W980 HydrophobicContact CB-CZ3 4.28Å
911	H	94.2	Very high	89.7	Confident	21 Å²	21	45.7 Å²	45.7	10%	0.097	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129.7	179.5	-55.7	84.3	0	0	0	109	Y892 L913 L918	Y892-H911 WeakPolarHBondContact O-CA 3.3Å; H911-L913 HydrophobicContact CB-CD1 3.87Å; H911-L918 HydrophobicContact CB-CB 4.38Å; H911-L918 PolarHBondContact N-O 2.87Å; H911-L918 PolarHBondContact O-N 3.13Å
912	I	95.3	Very high	90.1	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	120.7	169.6	-45.4	179.1	0	0	0	106.7	L891 Y892 F917 W980 Q983 I984 A987	L891-I912 HydrophobicContact CB-CG2 4.48Å; L891-I912 HydrophobicContact CD1-CG2 4.45Å; L891-I912 PolarHBondContact N-O 3.17Å; Y892-I912 HydrophobicContact CD1-CD1 4.19Å; Y892-I912 HydrophobicContact CG-CD1 4.44Å; Y892-I912 PolarHBondContact N-O 3.49Å; Y892-I912 PolarHBondContact O-N 3.44Å; I912-F917 HydrophobicContact CG1-CD2 4.14Å; I912-F917 HydrophobicContact CG1-CE2 4.3Å; I912-W980 HydrophobicContact CD1-CE3 4.16Å; I912-W980 HydrophobicContact CD1-CZ3 4.08Å; I912-W980 HydrophobicContact CG1-CE3 4.48Å; I912-W980 HydrophobicContact CG1-CZ3 3.93Å; I912-Q983 HydrophobicContact CD1-CB 3.8Å; I912-I984 HydrophobicContact CD1-CB 4.3Å; I912-I984 HydrophobicContact CD1-CD1 4.45Å; I912-I984 HydrophobicContact CD1-CG1 3.35Å; I912-I984 HydrophobicContact CG1-CG1 4.03Å; I912-A987 HydrophobicContact CG2-CB 3.58Å
913	L	94.7	Very high	90.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	171.7	168.9	-66.7	72.4	0	0	0	108.2	L698 L701 R888 T889 V890 H911 D915 L916 L918 L940	L698-L913 HydrophobicContact CD1-CD2 3.7Å; L701-L913 HydrophobicContact CD2-CD1 4.12Å; L701-L913 HydrophobicContact CD2-CD2 4.15Å; L701-L913 HydrophobicContact CD2-CG 4.47Å; R888-L913 HydrophobicContact CG-CB 4.21Å; R888-L913 HydrophobicContact CG-CD2 4.03Å; T889-L913 WeakPolarHBondContact O-CA 3.34Å; T889-L913 VanDerWaalsContact O-CB 3.29Å; T889-L913 WeakPolarHBondContact O-CB 3.21Å; V890-L913 HydrophobicContact CG2-CG 4.31Å; H911-L913 HydrophobicContact CB-CD1 3.87Å; L913-D915 PolarHBondContact O-N 3.29Å; L913-D915 VanDerWaalsContact O-N 3.08Å; L913-L916 HydrophobicContact CB-CB 4.39Å; L913-L916 WeakPolarHBondContact CB-O 3.42Å; L913-L916 PolarHBondContact N-O 3.15Å; L913-L918 HydrophobicContact CD1-CD1 3.75Å; L913-L918 HydrophobicContact CD1-CG 3.83Å; L913-L918 HydrophobicContact CD2-CD1 4.4Å; L913-L940 WeakPolarHBondContact O-CD1 3.38Å
914	T	92.9	Very high	90.6	Very high	19 Å²	19	46.4 Å²	46.4	12%	0.117	22%	0.215	C	C	.	.	S	Bend	trans	-60.2	-17	-177	38.6	0	0	0	0	116	I736 R888 T889 L891 Y991	I736-T914 VanDerWaalsContact CD1-OG1 3.27Å; I736-T914 WeakPolarHBondContact CD1-OG1 3.36Å; R888-T914 WeakPolarHBondContact CA-OG1 3.45Å; T889-T914 PolarHBondContact N-OG1 3.2Å; T889-T914 PolarHBondContact O-N 3.49Å; T889-T914 VanDerWaalsContact OG1-CG2 3.3Å; T889-T914 WeakPolarHBondContact OG1-CG2 3.43Å; L891-T914 HydrophobicContact CD1-CG2 4.11Å; L891-T914 HydrophobicContact CD2-CG2 3.81Å; L891-T914 HydrophobicContact CG-CG2 4Å; T914-Y991 WeakPolarHBondContact O-CD2 3.5Å
915	D	92.6	Very high	90.3	Very high	11 Å²	11	40 Å²	40	6%	0.059	19%	0.194	C	C	.	.	S	Bend	trans	-138.1	-13.1	179.2	63.2	-28.8	0	0	0	114.1	I736 R888 L913 R939 L940 Y991	I736-D915 HydrophobicContact CD1-CB 3.75Å; I736-D915 HydrophobicContact CG1-CB 4.2Å; R888-D915 VanDerWaalsContact CD-OD1 3.31Å; R888-D915 WeakPolarHBondContact CD-OD1 3.33Å; R888-D915 IonicContact CZ-OD1 3.52Å; R888-D915 IonicContact CZ-OD2 2.65Å; R888-D915 VanDerWaalsContact CZ-OD2 3.31Å; R888-D915 VanDerWaalsContact NE-CG 3.29Å; R888-D915 IonicContact NE-OD1 3.44Å; R888-D915 PolarHBondContact NE-OD1 3.22Å; R888-D915 IonicContact NE-OD2 3.68Å; R888-D915 PolarHBondContact NE-OD2 3.3Å; R888-D915 VanDerWaalsContact NE-OD2 3.09Å; R888-D915 IonicContact NH2-OD1 3.52Å; R888-D915 IonicContact NH2-OD2 2.88Å; R888-D915 PolarHBondContact NH2-OD2 3.12Å; L913-D915 PolarHBondContact O-N 3.29Å; L913-D915 VanDerWaalsContact O-N 3.08Å; D915-R939 WeakPolarHBondContact O-CA 3.3Å; D915-L940 PolarHBondContact O-N 3.21Å; D915-Y991 HydrophobicContact CB-CD2 3.69Å; D915-Y991 HydrophobicContact CB-CE2 3.33Å
916	L	92.9	Very high	89.7	Confident	20 Å²	20	40.1 Å²	40.1	11%	0.105	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	138.6	-169.1	-68.5	172	0	0	0	112.9	L913 L918 P937 I938 R939	L913-L916 HydrophobicContact CB-CB 4.39Å; L913-L916 WeakPolarHBondContact CB-O 3.42Å; L913-L916 PolarHBondContact N-O 3.15Å; L916-L918 HydrophobicContact CB-CD2 4.35Å; L916-P937 HydrophobicContact CD1-CB 4.1Å; L916-P937 HydrophobicContact CD2-CB 3.85Å; L916-P937 HydrophobicContact CG-CB 4.42Å; L916-I938 CarbonylContact C-O 3.58Å; L916-I938 WeakPolarHBondContact CA-O 3.17Å; L916-R939 HydrophobicContact CD2-CG 4.16Å
917	F	93.5	Very high	89	Confident	1 Å²	1	40.9 Å²	40.9	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	124.4	165.5	-174.8	-120.2	0	0	0	110.1	C910 I912 I919 I938 L940 L943 F971 W980 I984	C910-F917 HydrophobicContact CB-CE2 3.79Å; C910-F917 HydrophobicContact CB-CZ 3.76Å; I912-F917 HydrophobicContact CG1-CD2 4.14Å; I912-F917 HydrophobicContact CG1-CE2 4.3Å; F917-I919 HydrophobicContact CD1-CG1 4.25Å; F917-I919 HydrophobicContact CE1-CD1 4.36Å; F917-I919 HydrophobicContact CE1-CG1 3.93Å; F917-I938 HydrophobicContact CB-CB 4.45Å; F917-I938 HydrophobicContact CD1-CD1 4.02Å; F917-I938 PolarHBondContact N-O 3.43Å; F917-I938 PolarHBondContact O-N 3.3Å; F917-L940 HydrophobicContact CB-CD2 4.23Å; F917-L943 HydrophobicContact CB-CD1 3.71Å; F917-L943 HydrophobicContact CD1-CD1 3.75Å; F917-L943 HydrophobicContact CG-CD1 3.96Å; F917-F971 HydrophobicContact CE1-CE1 4.4Å; F917-F971 HydrophobicContact CE1-CE2 4.11Å; F917-F971 AromaticContact CE1-CZ 3.72Å; F917-F971 HydrophobicContact CE1-CZ 3.72Å; F917-F971 HydrophobicContact CZ-CE1 4.43Å; F917-F971 HydrophobicContact CZ-CZ 4.15Å; F917-W980 HydrophobicContact CE2-CZ3 4.13Å; F917-I984 HydrophobicContact CE2-CD1 4.21Å; F917-I984 HydrophobicContact CZ-CD1 4.46Å
918	L	92.7	Very high	88.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.3	-178	-52.2	-176.6	0	0	0	111.1	L701 L705 I732 C910 H911 L913 L916 T920 L933 P937	L701-L918 HydrophobicContact CD2-CD1 4.12Å; L705-L918 HydrophobicContact CD1-CD1 4.05Å; I732-L918 HydrophobicContact CD1-CD1 4.42Å; C910-L918 CarbonylContact C-O 3.5Å; C910-L918 WeakPolarHBondContact CA-O 3.42Å; H911-L918 HydrophobicContact CB-CB 4.38Å; H911-L918 PolarHBondContact N-O 2.87Å; H911-L918 PolarHBondContact O-N 3.13Å; L913-L918 HydrophobicContact CD1-CD1 3.75Å; L913-L918 HydrophobicContact CD1-CG 3.83Å; L913-L918 HydrophobicContact CD2-CD1 4.4Å; L916-L918 HydrophobicContact CB-CD2 4.35Å; L918-T920 HydrophobicContact CB-CG2 4.43Å; L918-L933 HydrophobicContact CB-CD1 4.25Å; L918-L933 HydrophobicContact CD2-CD1 4.23Å; L918-P937 HydrophobicContact CD2-CB 3.56Å; L918-P937 HydrophobicContact CD2-CG 3.88Å
919	I	92.3	Very high	87.6	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	113.4	176.3	-53.9	168.1	0	0	0	108.5	F898 T908 F917 I934 K935 I938 Y969 F971	F898-I919 HydrophobicContact CD2-CD1 4.35Å; F898-I919 HydrophobicContact CD2-CG2 4.22Å; F898-I919 HydrophobicContact CE2-CD1 4.11Å; F898-I919 HydrophobicContact CG-CG2 4.26Å; T908-I919 HydrophobicContact CG2-CG2 4.3Å; F917-I919 HydrophobicContact CD1-CG1 4.25Å; F917-I919 HydrophobicContact CE1-CD1 4.36Å; F917-I919 HydrophobicContact CE1-CG1 3.93Å; I919-I934 HydrophobicContact CG2-CB 4.43Å; I919-I934 HydrophobicContact CG2-CD1 4.34Å; I919-I934 PolarHBondContact O-N 3.47Å; I919-K935 HydrophobicContact CD1-CB 4.22Å; I919-K935 HydrophobicContact CD1-CG 4.17Å; I919-I938 HydrophobicContact CD1-CD1 3.71Å; I919-I938 HydrophobicContact CG1-CD1 4.32Å; I919-Y969 HydrophobicContact CD1-CD2 3.91Å; I919-Y969 HydrophobicContact CD1-CE2 3.9Å; I919-F971 HydrophobicContact CD1-CE1 4.49Å; I919-F971 HydrophobicContact CD1-CZ 3.74Å; I919-F971 HydrophobicContact CG1-CE1 4.47Å; I919-F971 HydrophobicContact CG1-CZ 4.05Å
920	T	91.2	Very high	87.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	156.6	-174.3	83.5	0	0	0	0	113.1	L705 T908 V909 L918 W931 K932 L933	L705-T920 HydrophobicContact CD2-CG2 3.72Å; T908-T920 CarbonylContact C-O 3.54Å; T908-T920 WeakPolarHBondContact CA-O 3.41Å; T908-T920 WeakPolarHBondContact CB-O 3.41Å; V909-T920 PolarHBondContact N-O 2.86Å; V909-T920 WeakPolarHBondContact O-CB 3.28Å; V909-T920 PolarHBondContact O-N 3.05Å; V909-T920 VanDerWaalsContact O-N 3.1Å; V909-T920 PolarHBondContact O-OG1 2.85Å; L918-T920 HydrophobicContact CB-CG2 4.43Å; T920-W931 HydrophobicContact CG2-CB 4.21Å; T920-K932 CarbonylContact C-O 3.6Å; T920-K932 WeakPolarHBondContact CA-O 3.33Å; T920-L933 HydrophobicContact CG2-CD1 4.29Å
921	K	89.6	Confident	86.7	Confident	103 Å²	103	45.5 Å²	45.5	45%	0.448	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	136.3	169.5	-156.2	175.9	-177.2	177.3	0	110.1	I906 H923 W931 K932 I934	I906-K921 HydrophobicContact CG2-CD 4.07Å; K921-H923 PolarHBondContact O-N 3.41Å; K921-W931 CarbonylContact O-C 3.09Å; K921-W931 WeakPolarHBondContact O-CA 3.37Å; K921-K932 PolarHBondContact N-O 3.42Å; K921-K932 PolarHBondContact O-N 3.49Å; K921-I934 HydrophobicContact CB-CD1 3.78Å; K921-I934 HydrophobicContact CB-CG1 3.93Å; K921-I934 HydrophobicContact CG-CD1 4.46Å
922	Q	87	Confident	86.3	Confident	88 Å²	88	46.4 Å²	46.4	41%	0.411	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	130.1	169	-159.3	169.1	-8	0	0	109.9	D929 W931	Q922-D929 VanDerWaalsContact NE2-CG 3.33Å; Q922-D929 PolarHBondContact NE2-OD1 2.92Å; Q922-W931 HydrophobicContact CB-CE3 4.09Å; Q922-W931 HydrophobicContact CB-CH2 4.47Å; Q922-W931 HydrophobicContact CB-CZ3 3.58Å; Q922-W931 HydrophobicContact CG-CE3 4.31Å; Q922-W931 HydrophobicContact CG-CH2 4.19Å; Q922-W931 HydrophobicContact CG-CZ3 3.71Å
923	H	82.9	Confident	85.8	Confident	65 Å²	65	46.4 Å²	46.4	30%	0.301	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	104.1	-179.2	-177.3	-69.9	0	0	0	109.8	K921 Y930 K932	K921-H923 PolarHBondContact O-N 3.41Å; H923-Y930 PolarHBondContact N-O 3.09Å; H923-Y930 WeakPolarHBondContact O-CB 3.09Å; H923-Y930 PolarHBondContact O-N 3.06Å; H923-Y930 VanDerWaalsContact O-N 3.08Å; H923-K932 HydrophobicContact CB-CB 4.29Å
924	K	81.6	Confident	85.4	Confident	151 Å²	151	48.6 Å²	48.6	66%	0.657	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	126.4	177.2	-75.4	178.9	175.8	179.9	0	110.8	N928 D929	K924-N928 WeakPolarHBondContact CA-O 3.47Å; K924-D929 WeakPolarHBondContact CE-OD1 3.48Å; K924-D929 WeakPolarHBondContact CG-OD1 3.15Å
925	K	74	Confident	85	Confident	97 Å²	97	49.8 Å²	49.8	42%	0.422	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	130.1	174.9	-170.3	173.1	179.9	173.6	0	110.1	G927 N928 Y930	K925-G927 PolarHBondContact O-N 2.99Å; K925-G927 VanDerWaalsContact O-N 3.11Å; K925-N928 PolarHBondContact N-O 2.61Å; K925-N928 PolarHBondContact O-N 3.12Å; K925-Y930 HydrophobicContact CB-CD2 3.97Å; K925-Y930 HydrophobicContact CB-CE2 3.95Å; K925-Y930 WeakPolarHBondContact O-CE2 3.48Å
926	D	72.7	Confident	84.5	Confident	74 Å²	74	55.5 Å²	55.5	40%	0.396	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	27	179.1	-43.7	-39.8	0	0	0	114.7	K14	K14-D926 VanDerWaalsContact CE-CB 3.49Å; K14-D926 WeakPolarHBondContact CE-OD2 3.07Å; K14-D926 IonicContact NZ-OD2 2.65Å; K14-D926 PolarHBondContact NZ-OD2 3.43Å
927	G	75.5	Confident	84.2	Confident	72 Å²	72	56.7 Å²	56.7	74%	0.742	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-11.4	-176	0	0	0	0	0	115.5	K925	K925-G927 PolarHBondContact O-N 2.99Å; K925-G927 VanDerWaalsContact O-N 3.11Å
928	N	74.5	Confident	84	Confident	90 Å²	90	57.2 Å²	57.2	48%	0.481	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	147.7	177.4	-74.1	6.1	0	0	0	111.9	K924 K925 Y930	K924-N928 WeakPolarHBondContact CA-O 3.47Å; K925-N928 PolarHBondContact N-O 2.61Å; K925-N928 PolarHBondContact O-N 3.12Å; N928-Y930 HydrophobicContact CB-CD2 4.29Å; N928-Y930 HydrophobicContact CB-CE2 3.56Å; N928-Y930 WeakPolarHBondContact O-CD2 3.46Å
929	D	81	Confident	83.9	Confident	59 Å²	59	62.6 Å²	62.6	32%	0.316	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	121.3	171.1	-79.6	-59.6	0	0	0	111.7	Q922 K924	Q922-D929 VanDerWaalsContact NE2-CG 3.33Å; Q922-D929 PolarHBondContact NE2-OD1 2.92Å; K924-D929 WeakPolarHBondContact CE-OD1 3.48Å; K924-D929 WeakPolarHBondContact CG-OD1 3.15Å
930	Y	85.5	Confident	83.9	Confident	44 Å²	44	62.5 Å²	62.5	17%	0.173	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	167	172.9	-60.4	-91.8	0	0	0	110.8	K704 I706 H923 K925 N928	K704-Y930 CarbonylContact O-C 3.55Å; K704-Y930 WeakPolarHBondContact O-CA 2.85Å; K704-Y930 WeakPolarHBondContact O-CB 3.41Å; I706-Y930 HydrophobicContact CD1-CD1 4.02Å; I706-Y930 HydrophobicContact CD1-CD2 4.49Å; I706-Y930 HydrophobicContact CD1-CG 3.79Å; I706-Y930 HydrophobicContact CG1-CD1 4.27Å; I706-Y930 HydrophobicContact CG1-CG 4.41Å; H923-Y930 PolarHBondContact N-O 3.09Å; H923-Y930 WeakPolarHBondContact O-CB 3.09Å; H923-Y930 PolarHBondContact O-N 3.06Å; H923-Y930 VanDerWaalsContact O-N 3.08Å; K925-Y930 HydrophobicContact CB-CD2 3.97Å; K925-Y930 HydrophobicContact CB-CE2 3.95Å; K925-Y930 WeakPolarHBondContact O-CE2 3.48Å; N928-Y930 HydrophobicContact CB-CD2 4.29Å; N928-Y930 HydrophobicContact CB-CE2 3.56Å; N928-Y930 WeakPolarHBondContact O-CD2 3.46Å
931	W	85.1	Confident	83.9	Confident	39 Å²	39	66.1 Å²	66.1	15%	0.148	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	98.1	-177.8	-59.4	125.8	0	0	0	110.2	K704 L705 I706 V909 T920 K921 Q922 L933	K704-W931 HydrophobicContact CB-CG 4.49Å; K704-W931 PolarHBondContact O-N 2.8Å; L705-W931 CarbonylContact C-O 3.51Å; L705-W931 WeakPolarHBondContact CA-O 3.47Å; L705-W931 HydrophobicContact CD2-CB 3.96Å; I706-W931 PolarHBondContact N-O 3.48Å; V909-W931 HydrophobicContact CB-CE3 4.02Å; V909-W931 HydrophobicContact CB-CH2 3.98Å; V909-W931 HydrophobicContact CB-CZ3 3.57Å; V909-W931 HydrophobicContact CG1-CH2 4.06Å; V909-W931 HydrophobicContact CG1-CZ2 4.43Å; V909-W931 HydrophobicContact CG1-CZ3 4.14Å; V909-W931 HydrophobicContact CG2-CE3 4.25Å; V909-W931 HydrophobicContact CG2-CH2 3.65Å; V909-W931 HydrophobicContact CG2-CZ3 3.34Å; T920-W931 HydrophobicContact CG2-CB 4.21Å; K921-W931 CarbonylContact O-C 3.09Å; K921-W931 WeakPolarHBondContact O-CA 3.37Å; Q922-W931 HydrophobicContact CB-CE3 4.09Å; Q922-W931 HydrophobicContact CB-CH2 4.47Å; Q922-W931 HydrophobicContact CB-CZ3 3.58Å; Q922-W931 HydrophobicContact CG-CE3 4.31Å; Q922-W931 HydrophobicContact CG-CH2 4.19Å; Q922-W931 HydrophobicContact CG-CZ3 3.71Å; W931-L933 PolarHBondContact O-N 3.08Å
932	K	85	Confident	83.9	Confident	39 Å²	39	62.5 Å²	62.5	17%	0.17	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	115.4	174.9	-176.7	171.6	-178.8	175.7	0	108.5	I706 C708 L711 D712 T920 K921 H923 I934	I706-K932 CarbonylContact O-C 3.59Å; I706-K932 WeakPolarHBondContact O-CA 3.43Å; C708-K932 WeakPolarHBondContact SG-CE 3.35Å; C708-K932 WeakPolarHBondContact SG-CG 3.5Å; L711-K932 HydrophobicContact CD1-CD 4Å; D712-K932 IonicContact OD1-NZ 2.63Å; D712-K932 IonicContact OD2-NZ 3Å; D712-K932 PolarHBondContact OD2-NZ 2.73Å; T920-K932 CarbonylContact C-O 3.6Å; T920-K932 WeakPolarHBondContact CA-O 3.33Å; K921-K932 PolarHBondContact N-O 3.42Å; K921-K932 PolarHBondContact O-N 3.49Å; H923-K932 HydrophobicContact CB-CB 4.29Å; K932-I934 PolarHBondContact O-N 2.76Å
933	L	85.8	Confident	84.2	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	102	-173.3	-172.3	102.9	0	0	0	110.8	L705 I706 C708 F728 L918 T920 W931 K935 P937	L705-L933 HydrophobicContact CD2-CD1 3.91Å; I706-L933 PolarHBondContact O-N 2.8Å; C708-L933 VanDerWaalsContact CB-O 3.28Å; C708-L933 WeakPolarHBondContact CB-O 3.42Å; C708-L933 PolarHBondContact SG-O 2.95Å; F728-L933 HydrophobicContact CE2-CD2 4.19Å; F728-L933 HydrophobicContact CZ-CD1 4.2Å; F728-L933 HydrophobicContact CZ-CD2 3.89Å; L918-L933 HydrophobicContact CB-CD1 4.25Å; L918-L933 HydrophobicContact CD2-CD1 4.23Å; T920-L933 HydrophobicContact CG2-CD1 4.29Å; W931-L933 PolarHBondContact O-N 3.08Å; L933-K935 WeakPolarHBondContact CD2-O 3.49Å; L933-K935 VanDerWaalsContact CG-O 3.3Å; L933-K935 WeakPolarHBondContact CG-O 3.43Å; L933-K935 PolarHBondContact O-N 3.49Å; L933-P937 HydrophobicContact CD2-CG 4.37Å
934	I	84.5	Confident	84.7	Confident	45 Å²	45	59.1 Å²	59.1	23%	0.231	30%	0.303	C	S	.	.			trans	-71.3	-32.6	-166.8	-51.6	176.9	0	0	0	112.6	T908 I919 K921 K932	T908-I934 HydrophobicContact CG2-CD1 3.38Å; I919-I934 HydrophobicContact CG2-CB 4.43Å; I919-I934 HydrophobicContact CG2-CD1 4.34Å; I919-I934 PolarHBondContact O-N 3.47Å; K921-I934 HydrophobicContact CB-CD1 3.78Å; K921-I934 HydrophobicContact CB-CG1 3.93Å; K921-I934 HydrophobicContact CG-CD1 4.46Å; K932-I934 PolarHBondContact O-N 2.76Å
935	K	85.5	Confident	85.3	Confident	44 Å²	44	52.7 Å²	52.7	19%	0.191	28%	0.276	C	S	.	.	S	Bend	trans	-131.6	152.3	179.3	-63.5	-63.8	-175.5	172.9	0	108.8	F898 E900 I919 L933 Y969	F898-K935 HydrophobicContact CZ-CG 4.39Å; E900-K935 IonicContact OE1-NZ 2.66Å; E900-K935 PolarHBondContact OE1-NZ 2.83Å; E900-K935 WeakPolarHBondContact OE2-CE 3.41Å; E900-K935 IonicContact OE2-NZ 3.93Å; E900-K935 PolarHBondContact OE2-NZ 3.44Å; I919-K935 HydrophobicContact CD1-CB 4.22Å; I919-K935 HydrophobicContact CD1-CG 4.17Å; L933-K935 WeakPolarHBondContact CD2-O 3.49Å; L933-K935 VanDerWaalsContact CG-O 3.3Å; L933-K935 WeakPolarHBondContact CG-O 3.43Å; L933-K935 PolarHBondContact O-N 3.49Å; K935-Y969 WeakPolarHBondContact CD-OH 3.41Å; K935-Y969 WeakPolarHBondContact CE-OH 3.26Å; K935-Y969 HydrophobicContact CG-CE2 4.26Å
936	N	81.9	Confident	86.1	Confident	132 Å²	132	54.8 Å²	54.8	71%	0.706	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-54.3	150.4	174.1	-66.8	-8	0	0	0	110.8	I938	N936-I938 WeakPolarHBondContact O-CG1 3.23Å; N936-I938 PolarHBondContact O-N 2.98Å
937	P	87.5	Confident	87	Confident	45 Å²	45	58.6 Å²	58.6	29%	0.292	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-56.5	126.2	176.2	-24.5	36.5	0	0	0	111.1	F728 L916 L918 L933	F728-P937 HydrophobicContact CE2-CG 4.03Å; F728-P937 HydrophobicContact CZ-CG 4.4Å; L916-P937 HydrophobicContact CD1-CB 4.1Å; L916-P937 HydrophobicContact CD2-CB 3.85Å; L916-P937 HydrophobicContact CG-CB 4.42Å; L918-P937 HydrophobicContact CD2-CB 3.56Å; L918-P937 HydrophobicContact CD2-CG 3.88Å; L933-P937 HydrophobicContact CD2-CG 4.37Å
938	I	89.5	Confident	87.5	Confident	11 Å²	11	56.6 Å²	56.6	6%	0.056	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.6	-175.4	-51.4	159.2	0	0	0	107.7	L916 F917 I919 N936 L943 I958 Y969	L916-I938 CarbonylContact C-O 3.58Å; L916-I938 WeakPolarHBondContact CA-O 3.17Å; F917-I938 HydrophobicContact CB-CB 4.45Å; F917-I938 HydrophobicContact CD1-CD1 4.02Å; F917-I938 PolarHBondContact N-O 3.43Å; F917-I938 PolarHBondContact O-N 3.3Å; I919-I938 HydrophobicContact CD1-CD1 3.71Å; I919-I938 HydrophobicContact CG1-CD1 4.32Å; N936-I938 WeakPolarHBondContact O-CG1 3.23Å; N936-I938 PolarHBondContact O-N 2.98Å; I938-L943 HydrophobicContact CG2-CD1 4.07Å; I938-L943 HydrophobicContact CG2-CG 4.49Å; I938-I958 HydrophobicContact CB-CD1 4.49Å; I938-I958 HydrophobicContact CD1-CD1 3.61Å; I938-I958 HydrophobicContact CD1-CG1 4.45Å; I938-I958 HydrophobicContact CG1-CD1 3.74Å; I938-I958 HydrophobicContact CG2-CD1 3.89Å; I938-I958 HydrophobicContact CG2-CG1 3.99Å; I938-I958 HydrophobicContact CG2-CG2 4.24Å; I938-Y969 HydrophobicContact CD1-CE2 4.19Å
939	R	89.8	Confident	88	Confident	113 Å²	113	64.9 Å²	64.9	43%	0.426	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	141.6	173.5	-70	167.7	46.9	161.2	-5.9	111.2	D915 L916 D941 K942	D915-R939 WeakPolarHBondContact O-CA 3.3Å; L916-R939 HydrophobicContact CD2-CG 4.16Å; R939-D941 WeakPolarHBondContact CB-OD1 2.97Å; R939-D941 IonicContact CZ-OD1 3.6Å; R939-D941 IonicContact CZ-OD2 2.71Å; R939-D941 IonicContact NE-OD1 3.19Å; R939-D941 PolarHBondContact NE-OD1 3.48Å; R939-D941 IonicContact NE-OD2 2.65Å; R939-D941 VanDerWaalsContact NH2-CG 3.26Å; R939-D941 IonicContact NH2-OD1 3.71Å; R939-D941 PolarHBondContact NH2-OD1 2.91Å; R939-D941 VanDerWaalsContact NH2-OD1 3.16Å; R939-D941 IonicContact NH2-OD2 2.84Å; R939-D941 PolarHBondContact NH2-OD2 3.22Å; R939-D941 PolarHBondContact O-N 3.3Å; R939-K942 HydrophobicContact CB-CG 4.25Å; R939-K942 PolarHBondContact O-N 3.24Å
940	L	92.6	Very high	88.1	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-63.8	-35.8	-178.3	-69.3	178	0	0	0	113.3	L913 D915 F917 K942 L943 I984 A987 K988 Y991	L913-L940 WeakPolarHBondContact O-CD1 3.38Å; D915-L940 PolarHBondContact O-N 3.21Å; F917-L940 HydrophobicContact CB-CD2 4.23Å; L940-K942 PolarHBondContact O-N 2.71Å; L940-L943 WeakPolarHBondContact O-CB 3.32Å; L940-L943 PolarHBondContact O-N 3.19Å; L940-L943 VanDerWaalsContact O-N 3.12Å; L940-I984 HydrophobicContact CD2-CG2 4.24Å; L940-A987 HydrophobicContact CD1-CB 3.79Å; L940-K988 HydrophobicContact CB-CG 3.97Å; L940-K988 HydrophobicContact CD2-CG 4.4Å; L940-Y991 HydrophobicContact CB-CD1 4.04Å; L940-Y991 HydrophobicContact CB-CG 4.41Å
941	D	89.6	Confident	88	Confident	75 Å²	75	73.8 Å²	73.8	40%	0.401	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-66.1	-19.5	177.1	68.8	-58.4	0	0	0	113.7	R939 Y991	R939-D941 WeakPolarHBondContact CB-OD1 2.97Å; R939-D941 IonicContact CZ-OD1 3.6Å; R939-D941 IonicContact CZ-OD2 2.71Å; R939-D941 IonicContact NE-OD1 3.19Å; R939-D941 PolarHBondContact NE-OD1 3.48Å; R939-D941 IonicContact NE-OD2 2.65Å; R939-D941 VanDerWaalsContact NH2-CG 3.26Å; R939-D941 IonicContact NH2-OD1 3.71Å; R939-D941 PolarHBondContact NH2-OD1 2.91Å; R939-D941 VanDerWaalsContact NH2-OD1 3.16Å; R939-D941 IonicContact NH2-OD2 2.84Å; R939-D941 PolarHBondContact NH2-OD2 3.22Å; R939-D941 PolarHBondContact O-N 3.3Å; D941-Y991 HydrophobicContact CB-CD1 4.16Å; D941-Y991 HydrophobicContact CB-CE1 3.92Å
942	K	91.1	Very high	88.2	Confident	27 Å²	27	72.6 Å²	72.6	12%	0.117	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-91.7	5.5	176.3	-60.1	-60	-170.5	169.6	0	113.4	R939 L940 I958 L959 D960 D961	R939-K942 HydrophobicContact CB-CG 4.25Å; R939-K942 PolarHBondContact O-N 3.24Å; L940-K942 PolarHBondContact O-N 2.71Å; K942-I958 CarbonylContact O-C 3.58Å; K942-I958 WeakPolarHBondContact O-CA 3.26Å; K942-L959 HydrophobicContact CD-CB 4.31Å; K942-L959 PolarHBondContact O-N 3.15Å; K942-D960 PolarHBondContact NZ-O 3.14Å; K942-D961 VanDerWaalsContact CE-OD1 3.26Å; K942-D961 WeakPolarHBondContact CE-OD1 3.4Å; K942-D961 IonicContact NZ-OD1 2.83Å; K942-D961 PolarHBondContact NZ-OD1 2.87Å
943	L	92.6	Very high	88.6	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	105.4	-165.4	-160.5	162.9	0	0	0	111.6	F917 I938 L940 I945 C956 I984 K988	F917-L943 HydrophobicContact CB-CD1 3.71Å; F917-L943 HydrophobicContact CD1-CD1 3.75Å; F917-L943 HydrophobicContact CG-CD1 3.96Å; I938-L943 HydrophobicContact CG2-CD1 4.07Å; I938-L943 HydrophobicContact CG2-CG 4.49Å; L940-L943 WeakPolarHBondContact O-CB 3.32Å; L940-L943 PolarHBondContact O-N 3.19Å; L940-L943 VanDerWaalsContact O-N 3.12Å; L943-I945 HydrophobicContact CD2-CD1 3.8Å; L943-I945 HydrophobicContact CD2-CG1 3.39Å; L943-C956 VanDerWaalsContact CD2-SG 3.58Å; L943-I984 HydrophobicContact CD2-CG2 4.22Å; L943-K988 WeakPolarHBondContact O-CD 3.18Å; L943-K988 WeakPolarHBondContact O-CE 3.31Å; L943-K988 PolarHBondContact O-NZ 3.31Å
944	I	93.3	Very high	89	Confident	81 Å²	81	71.4 Å²	71.4	42%	0.415	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	134	171.5	-64.1	-178.2	0	0	0	109.2	C956 A957 L959	I944-C956 CarbonylContact O-C 3.58Å; I944-C956 WeakPolarHBondContact O-CA 3.24Å; I944-A957 HydrophobicContact CB-CB 4.35Å; I944-A957 PolarHBondContact N-O 2.98Å; I944-A957 PolarHBondContact O-N 3.26Å; I944-L959 HydrophobicContact CD1-CD1 4.04Å; I944-L959 HydrophobicContact CD1-CD2 3.96Å; I944-L959 HydrophobicContact CD1-CG 4.23Å; I944-L959 HydrophobicContact CG1-CD1 4.3Å; I944-L959 HydrophobicContact CG1-CG 4.38Å
945	I	94	Very high	89.4	Confident	16 Å²	16	70.1 Å²	70.1	8%	0.082	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	140.6	173.1	-62.4	-173.9	0	0	0	110	L943 F954 G955 I981 I984	L943-I945 HydrophobicContact CD2-CD1 3.8Å; L943-I945 HydrophobicContact CD2-CG1 3.39Å; I945-F954 HydrophobicContact CD1-CE2 4.47Å; I945-F954 HydrophobicContact CG2-CB 4.36Å; I945-F954 HydrophobicContact CG2-CD2 3.99Å; I945-G955 WeakPolarHBondContact CA-O 3.41Å; I945-I981 HydrophobicContact CG2-CG1 4.03Å; I945-I981 HydrophobicContact CG2-CG2 4.29Å; I945-I984 HydrophobicContact CD1-CB 3.52Å; I945-I984 HydrophobicContact CD1-CD1 3.5Å; I945-I984 VanDerWaalsContact CD1-CD1 3.5Å; I945-I984 HydrophobicContact CD1-CG1 4.09Å; I945-I984 HydrophobicContact CD1-CG2 3.47Å; I945-I984 VanDerWaalsContact CD1-CG2 3.47Å
946	Q	91.4	Very high	89.8	Confident	140 Å²	140	68.1 Å²	68.1	65%	0.654	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	130	170.6	-170.9	62.1	43.6	0	0	109.7	G948 F954 G955	Q946-G948 PolarHBondContact O-N 3.18Å; Q946-F954 WeakPolarHBondContact O-CA 3.28Å; Q946-G955 PolarHBondContact N-O 3.43Å; Q946-G955 PolarHBondContact O-N 2.76Å
947	R	91.9	Very high	90.3	Very high	154 Å²	154	62.3 Å²	62.3	58%	0.581	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	132.2	173.1	-161.1	176.4	-166.7	-143.9	2.9	109.5	D978 I981	R947-D978 IonicContact CZ-OD1 3.69Å; R947-D978 IonicContact CZ-OD2 2.7Å; R947-D978 IonicContact NE-OD1 3.62Å; R947-D978 PolarHBondContact NE-OD1 3.49Å; R947-D978 IonicContact NH2-OD1 2.76Å; R947-D978 PolarHBondContact NH2-OD1 3.31Å; R947-D978 IonicContact NH2-OD2 2.75Å; R947-D978 PolarHBondContact NH2-OD2 3.26Å; R947-I981 HydrophobicContact CB-CD1 4.08Å; R947-I981 HydrophobicContact CG-CD1 3.87Å
948	G	85.8	Confident	90.5	Very high	30 Å²	30	61.1 Å²	61.1	31%	0.309	30%	0.297	S	S	.	.			trans	-72.2	163.5	-179.4	0	0	0	0	0	112.6	Q946 E950 V953	Q946-G948 PolarHBondContact O-N 3.18Å; G948-E950 VanDerWaalsContact C-N 3.28Å; G948-V953 WeakPolarHBondContact CA-O 3.45Å; G948-V953 PolarHBondContact N-O 3.46Å
949	R	83.7	Confident	90.6	Very high	265 Å²	265	61.7 Å²	61.7	100%	1	30%	0.3	S	S	*	.	S	Bend	trans	-71.2	-26.4	169	-65.8	-177.5	-178.6	172.1	0.2	112.3
950	E	83.5	Confident	90.6	Very high	143 Å²	143	58.7 Å²	58.7	67%	0.668	29%	0.293	S	S	*	.	S	Bend	trans	-82.9	130.5	174.6	-68.7	174.2	-166.6	0	0	110.3	G948 G952 V953	G948-E950 VanDerWaalsContact C-N 3.28Å; E950-G952 PolarHBondContact O-N 3.05Å; E950-V953 HydrophobicContact CB-CB 4.1Å; E950-V953 HydrophobicContact CB-CG2 3.82Å; E950-V953 PolarHBondContact O-N 3.32Å
951	T	84.2	Confident	90.2	Very high	147 Å²	147	64.7 Å²	64.7	90%	0.902	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	122.3	178.4	51.3	0	0	0	0	111
952	G	89.8	Confident	90.2	Very high	13 Å²	13	69.2 Å²	69.2	13%	0.134	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	14.6	-180	0	0	0	0	0	115.2	E950 A973 G974	E950-G952 PolarHBondContact O-N 3.05Å; G952-A973 PolarHBondContact O-N 2.85Å; G952-G974 WeakPolarHBondContact CA-O 3.33Å; G952-G974 PolarHBondContact O-N 2.77Å
953	V	92.7	Very high	89.9	Confident	17 Å²	17	74.6 Å²	74.6	10%	0.103	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	141.7	178.5	-177.2	0	0	0	0	110.6	G948 E950 I970 F971	G948-V953 WeakPolarHBondContact CA-O 3.45Å; G948-V953 PolarHBondContact N-O 3.46Å; E950-V953 HydrophobicContact CB-CB 4.1Å; E950-V953 HydrophobicContact CB-CG2 3.82Å; E950-V953 PolarHBondContact O-N 3.32Å; V953-I970 HydrophobicContact CG1-CG2 3.51Å; V953-F971 CarbonylContact C-O 3.55Å; V953-F971 WeakPolarHBondContact CA-O 3.47Å
954	F	94.8	Very high	89.8	Confident	0 Å²	0	79 Å²	79	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.9	170.1	67	-90.2	0	0	0	112.2	L896 I945 Q946 F971 A973 W980 I981 I984	L896-F954 HydrophobicContact CD1-CE1 4.42Å; L896-F954 HydrophobicContact CD1-CZ 4.06Å; L896-F954 HydrophobicContact CD2-CE1 4.39Å; I945-F954 HydrophobicContact CD1-CE2 4.47Å; I945-F954 HydrophobicContact CG2-CB 4.36Å; I945-F954 HydrophobicContact CG2-CD2 3.99Å; Q946-F954 WeakPolarHBondContact O-CA 3.28Å; F954-F971 HydrophobicContact CD1-CB 3.99Å; F954-F971 HydrophobicContact CD2-CB 4.13Å; F954-F971 HydrophobicContact CD2-CD2 4.23Å; F954-F971 HydrophobicContact CE1-CB 3.6Å; F954-F971 HydrophobicContact CE1-CG 4.45Å; F954-F971 HydrophobicContact CE2-CB 3.76Å; F954-F971 AromaticContact CE2-CD2 3.63Å; F954-F971 HydrophobicContact CE2-CD2 3.63Å; F954-F971 AromaticContact CE2-CG 3.93Å; F954-F971 HydrophobicContact CE2-CG 3.93Å; F954-F971 HydrophobicContact CG-CB 4.25Å; F954-F971 HydrophobicContact CZ-CB 3.48Å; F954-F971 VanDerWaalsContact CZ-CB 3.48Å; F954-F971 HydrophobicContact CZ-CD2 4.04Å; F954-F971 AromaticContact CZ-CG 3.85Å; F954-F971 HydrophobicContact CZ-CG 3.85Å; F954-F971 PolarHBondContact N-O 2.97Å; F954-F971 PolarHBondContact O-N 3.43Å; F954-A973 HydrophobicContact CE1-CB 4.26Å; F954-W980 HydrophobicContact CE1-CB 3.95Å; F954-W980 HydrophobicContact CE1-CG 4.46Å; F954-W980 HydrophobicContact CZ-CB 4.34Å; F954-I981 HydrophobicContact CB-CD1 4.11Å; F954-I981 HydrophobicContact CB-CG1 4.14Å; F954-I981 HydrophobicContact CD1-CG1 4.47Å; F954-I981 HydrophobicContact CG-CG1 4.29Å; F954-I984 HydrophobicContact CE2-CD1 4.24Å; F954-I984 HydrophobicContact CZ-CD1 4.25Å
955	G	91.9	Very high	89.7	Confident	18 Å²	18	80.5 Å²	80.5	19%	0.186	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	147.8	168.8	0	0	0	0	0	110.8	I945 Q946 Y969	I945-G955 WeakPolarHBondContact CA-O 3.41Å; Q946-G955 PolarHBondContact N-O 3.43Å; Q946-G955 PolarHBondContact O-N 2.76Å; G955-Y969 WeakPolarHBondContact CA-O 3.31Å
956	C	93.4	Very high	89.5	Confident	1 Å²	1	82.6 Å²	82.6	1%	0.007	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	112.1	179.2	171.4	0	0	0	0	108.3	L943 I944 Y969 F971	L943-C956 VanDerWaalsContact CD2-SG 3.58Å; I944-C956 CarbonylContact O-C 3.58Å; I944-C956 WeakPolarHBondContact O-CA 3.24Å; C956-Y969 PolarHBondContact N-O 3.11Å; C956-Y969 PolarHBondContact O-N 2.66Å; C956-F971 HydrophobicContact CB-CD2 3.87Å; C956-F971 HydrophobicContact CB-CE2 3.7Å
957	A	92.9	Very high	89.4	Confident	10 Å²	10	79 Å²	79	8%	0.083	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136.6	178.1	0	0	0	0	0	110.1	I944 I965 N967 L968	I944-A957 HydrophobicContact CB-CB 4.35Å; I944-A957 PolarHBondContact N-O 2.98Å; I944-A957 PolarHBondContact O-N 3.26Å; A957-I965 HydrophobicContact CB-CD1 4.35Å; A957-I965 HydrophobicContact CB-CG1 4.4Å; A957-I965 HydrophobicContact CB-CG2 4.09Å; A957-N967 WeakPolarHBondContact CA-O 3.4Å; A957-L968 HydrophobicContact CB-CD1 4Å
958	I	92.3	Very high	89.4	Confident	21 Å²	21	76.3 Å²	76.3	11%	0.108	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.3	176.8	-57.1	179.7	0	0	0	108.8	I938 K942 I965 A966 N967 Y969	I938-I958 HydrophobicContact CB-CD1 4.49Å; I938-I958 HydrophobicContact CD1-CD1 3.61Å; I938-I958 HydrophobicContact CD1-CG1 4.45Å; I938-I958 HydrophobicContact CG1-CD1 3.74Å; I938-I958 HydrophobicContact CG2-CD1 3.89Å; I938-I958 HydrophobicContact CG2-CG1 3.99Å; I938-I958 HydrophobicContact CG2-CG2 4.24Å; K942-I958 CarbonylContact O-C 3.58Å; K942-I958 WeakPolarHBondContact O-CA 3.26Å; I958-I965 CarbonylContact O-C 3.6Å; I958-I965 WeakPolarHBondContact O-CA 3.35Å; I958-A966 PolarHBondContact O-N 2.91Å; I958-N967 HydrophobicContact CB-CB 4.29Å; I958-N967 HydrophobicContact CD1-CB 4.22Å; I958-N967 HydrophobicContact CG1-CB 4.45Å; I958-N967 PolarHBondContact N-O 2.98Å; I958-Y969 HydrophobicContact CD1-CD2 4.11Å; I958-Y969 HydrophobicContact CD1-CE2 3.43Å; I958-Y969 VanDerWaalsContact CD1-CE2 3.43Å; I958-Y969 HydrophobicContact CG1-CE2 4.37Å
959	L	91.7	Very high	89.7	Confident	23 Å²	23	75.3 Å²	75.3	12%	0.12	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	146.5	173.9	-57	-173.9	0	0	0	112	K942 I944 H963 N964 I965	K942-L959 HydrophobicContact CD-CB 4.31Å; K942-L959 PolarHBondContact O-N 3.15Å; I944-L959 HydrophobicContact CD1-CD1 4.04Å; I944-L959 HydrophobicContact CD1-CD2 3.96Å; I944-L959 HydrophobicContact CD1-CG 4.23Å; I944-L959 HydrophobicContact CG1-CD1 4.3Å; I944-L959 HydrophobicContact CG1-CG 4.38Å; L959-H963 HydrophobicContact CD1-CB 4.47Å; L959-N964 CarbonylContact C-O 3.52Å; L959-N964 VanDerWaalsContact CA-O 3.28Å; L959-N964 WeakPolarHBondContact CA-O 3.33Å; L959-I965 HydrophobicContact CD2-CG1 4.21Å
960	D	89.3	Confident	90.2	Very high	49 Å²	49	65.2 Å²	65.2	26%	0.262	35%	0.352	S	S	.	.			trans	-82	-165.7	164.2	70.6	3.2	0	0	0	111.9	K942 F962 H963 N964 A966	K942-D960 PolarHBondContact NZ-O 3.14Å; D960-F962 VanDerWaalsContact C-N 3.29Å; D960-F962 VanDerWaalsContact OD1-CA 3.3Å; D960-F962 WeakPolarHBondContact OD1-CA 3.34Å; D960-F962 PolarHBondContact OD1-N 3.13Å; D960-H963 PolarHBondContact OD1-N 3.42Å; D960-N964 PolarHBondContact N-O 2.86Å; D960-N964 PolarHBondContact OD1-N 2.87Å; D960-N964 PolarHBondContact OD2-ND2 3.27Å; D960-A966 HydrophobicContact CB-CB 4.45Å
961	D	85	Confident	90.7	Very high	127 Å²	127	58.4 Å²	58.4	68%	0.679	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.3	175.3	-68.4	-44.6	0	0	0	114.5	K942	K942-D961 VanDerWaalsContact CE-OD1 3.26Å; K942-D961 WeakPolarHBondContact CE-OD1 3.4Å; K942-D961 IonicContact NZ-OD1 2.83Å; K942-D961 PolarHBondContact NZ-OD1 2.87Å
962	F	89.2	Confident	91.1	Very high	169 Å²	169	53.3 Å²	53.3	74%	0.741	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	9.4	173	-57.1	-75.6	0	0	0	112.3	D960 N964	D960-F962 VanDerWaalsContact C-N 3.29Å; D960-F962 VanDerWaalsContact OD1-CA 3.3Å; D960-F962 WeakPolarHBondContact OD1-CA 3.34Å; D960-F962 PolarHBondContact OD1-N 3.13Å; F962-N964 VanDerWaalsContact C-N 3.25Å; F962-N964 WeakPolarHBondContact CB-ND2 3.33Å; F962-N964 PolarHBondContact O-N 3.44Å
963	H	85.2	Confident	91.2	Very high	141 Å²	141	53.6 Å²	53.6	65%	0.653	29%	0.291	S	S	*	.	S	Bend	trans	62.2	20.7	-175.6	-58.8	-92.3	0	0	0	115.5	L959 D960	L959-H963 HydrophobicContact CD1-CB 4.47Å; D960-H963 PolarHBondContact OD1-N 3.42Å
964	N	90.5	Very high	91.1	Very high	95 Å²	95	54.1 Å²	54.1	51%	0.508	30%	0.3	S	S	.	.			trans	-82.8	151.1	169.2	-56.8	-67.1	0	0	0	111.1	L959 D960 F962 A966	L959-N964 CarbonylContact C-O 3.52Å; L959-N964 VanDerWaalsContact CA-O 3.28Å; L959-N964 WeakPolarHBondContact CA-O 3.33Å; D960-N964 PolarHBondContact N-O 2.86Å; D960-N964 PolarHBondContact OD1-N 2.87Å; D960-N964 PolarHBondContact OD2-ND2 3.27Å; F962-N964 VanDerWaalsContact C-N 3.25Å; F962-N964 WeakPolarHBondContact CB-ND2 3.33Å; F962-N964 PolarHBondContact O-N 3.44Å; N964-A966 PolarHBondContact O-N 3.41Å; N964-A966 VanDerWaalsContact O-N 3.17Å
965	I	91.3	Very high	90.8	Very high	112 Å²	112	60.6 Å²	60.6	57%	0.574	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	105.3	175.5	-58.8	174.1	0	0	0	109.6	A957 I958 L959 N967	A957-I965 HydrophobicContact CB-CD1 4.35Å; A957-I965 HydrophobicContact CB-CG1 4.4Å; A957-I965 HydrophobicContact CB-CG2 4.09Å; I958-I965 CarbonylContact O-C 3.6Å; I958-I965 WeakPolarHBondContact O-CA 3.35Å; L959-I965 HydrophobicContact CD2-CG1 4.21Å; I965-N967 WeakPolarHBondContact CG2-O 3.43Å
966	A	88.7	Confident	90.8	Very high	59 Å²	59	64.4 Å²	64.4	49%	0.488	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-37.5	176.2	0	0	0	0	0	112.6	I958 D960 N964	I958-A966 PolarHBondContact O-N 2.91Å; D960-A966 HydrophobicContact CB-CB 4.45Å; N964-A966 PolarHBondContact O-N 3.41Å; N964-A966 VanDerWaalsContact O-N 3.17Å
967	N	90	Very high	90.8	Very high	64 Å²	64	64.5 Å²	64.5	34%	0.342	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	146.9	178.7	-67.5	100.1	0	0	0	111.1	A957 I958 I965 Y969	A957-N967 WeakPolarHBondContact CA-O 3.4Å; I958-N967 HydrophobicContact CB-CB 4.29Å; I958-N967 HydrophobicContact CD1-CB 4.22Å; I958-N967 HydrophobicContact CG1-CB 4.45Å; I958-N967 PolarHBondContact N-O 2.98Å; I965-N967 WeakPolarHBondContact CG2-O 3.43Å; N967-Y969 HydrophobicContact CB-CE1 3.88Å
968	L	91.3	Very high	90.8	Very high	99 Å²	99	67.4 Å²	67.4	52%	0.518	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.2	172.4	-179.6	65.9	0	0	0	110.4	A957	A957-L968 HydrophobicContact CB-CD1 4Å
969	Y	93	Very high	90.9	Very high	8 Å²	8	69.8 Å²	69.8	3%	0.031	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	153.8	179.4	-56.8	-30.6	0	0	0	111	F898 E900 I919 K935 I938 G955 C956 I958 N967	F898-Y969 HydrophobicContact CD2-CG 4.47Å; F898-Y969 AromaticContact CE2-CD1 3.75Å; F898-Y969 HydrophobicContact CE2-CD1 3.75Å; F898-Y969 AromaticContact CE2-CD2 3.86Å; F898-Y969 HydrophobicContact CE2-CD2 3.86Å; F898-Y969 HydrophobicContact CE2-CE1 4.26Å; F898-Y969 HydrophobicContact CE2-CE2 4.32Å; F898-Y969 AromaticContact CE2-CG 3.56Å; F898-Y969 HydrophobicContact CE2-CG 3.56Å; F898-Y969 HydrophobicContact CZ-CD1 4.07Å; F898-Y969 HydrophobicContact CZ-CE1 4.26Å; F898-Y969 HydrophobicContact CZ-CG 4.33Å; E900-Y969 HydrophobicContact CB-CD1 4.2Å; E900-Y969 HydrophobicContact CB-CE1 4.46Å; E900-Y969 HydrophobicContact CG-CD1 4.22Å; E900-Y969 HydrophobicContact CG-CE1 4.15Å; E900-Y969 WeakPolarHBondContact OE1-CE1 3.21Å; I919-Y969 HydrophobicContact CD1-CD2 3.91Å; I919-Y969 HydrophobicContact CD1-CE2 3.9Å; K935-Y969 WeakPolarHBondContact CD-OH 3.41Å; K935-Y969 WeakPolarHBondContact CE-OH 3.26Å; K935-Y969 HydrophobicContact CG-CE2 4.26Å; I938-Y969 HydrophobicContact CD1-CE2 4.19Å; G955-Y969 WeakPolarHBondContact CA-O 3.31Å; C956-Y969 PolarHBondContact N-O 3.11Å; C956-Y969 PolarHBondContact O-N 2.66Å; I958-Y969 HydrophobicContact CD1-CD2 4.11Å; I958-Y969 HydrophobicContact CD1-CE2 3.43Å; I958-Y969 VanDerWaalsContact CD1-CE2 3.43Å; I958-Y969 HydrophobicContact CG1-CE2 4.37Å; N967-Y969 HydrophobicContact CB-CE1 3.88Å
970	I	93.2	Very high	91.1	Very high	54 Å²	54	68.9 Å²	68.9	28%	0.277	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.9	177	-58.2	173.5	0	0	0	108.1	F898 K899 P901 V953	F898-I970 CarbonylContact C-O 3.52Å; K899-I970 HydrophobicContact CB-CB 4.33Å; K899-I970 PolarHBondContact N-O 3.04Å; K899-I970 PolarHBondContact O-N 3.28Å; P901-I970 HydrophobicContact CG-CD1 4.04Å; V953-I970 HydrophobicContact CG1-CG2 3.51Å
971	F	94.4	Very high	91.4	Very high	0 Å²	0	68 Å²	68	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.6	178.9	-68.9	-85.5	0	0	0	110.6	L896 R897 F898 F917 I919 V953 F954 C956	L896-F971 HydrophobicContact CB-CD1 4.02Å; L896-F971 HydrophobicContact CD1-CB 4.37Å; L896-F971 HydrophobicContact CD1-CD1 3.7Å; L896-F971 HydrophobicContact CD1-CE1 4.26Å; L896-F971 HydrophobicContact CD1-CG 4.23Å; L896-F971 HydrophobicContact CG-CD1 4.47Å; R897-F971 WeakPolarHBondContact O-CA 3.45Å; F898-F971 HydrophobicContact CB-CD1 4.13Å; F898-F971 HydrophobicContact CB-CE1 3.9Å; F898-F971 HydrophobicContact CD2-CD1 4.36Å; F898-F971 AromaticContact CD2-CE1 3.66Å; F898-F971 HydrophobicContact CD2-CE1 3.66Å; F898-F971 HydrophobicContact CD2-CE2 4.43Å; F898-F971 AromaticContact CD2-CZ 3.7Å; F898-F971 HydrophobicContact CD2-CZ 3.7Å; F898-F971 HydrophobicContact CE2-CZ 4.37Å; F898-F971 HydrophobicContact CG-CE1 4.25Å; F917-F971 HydrophobicContact CE1-CE1 4.4Å; F917-F971 HydrophobicContact CE1-CE2 4.11Å; F917-F971 AromaticContact CE1-CZ 3.72Å; F917-F971 HydrophobicContact CE1-CZ 3.72Å; F917-F971 HydrophobicContact CZ-CE1 4.43Å; F917-F971 HydrophobicContact CZ-CZ 4.15Å; I919-F971 HydrophobicContact CD1-CE1 4.49Å; I919-F971 HydrophobicContact CD1-CZ 3.74Å; I919-F971 HydrophobicContact CG1-CE1 4.47Å; I919-F971 HydrophobicContact CG1-CZ 4.05Å; V953-F971 CarbonylContact C-O 3.55Å; V953-F971 WeakPolarHBondContact CA-O 3.47Å; F954-F971 HydrophobicContact CD1-CB 3.99Å; F954-F971 HydrophobicContact CD2-CB 4.13Å; F954-F971 HydrophobicContact CD2-CD2 4.23Å; F954-F971 HydrophobicContact CE1-CB 3.6Å; F954-F971 HydrophobicContact CE1-CG 4.45Å; F954-F971 HydrophobicContact CE2-CB 3.76Å; F954-F971 AromaticContact CE2-CD2 3.63Å; F954-F971 HydrophobicContact CE2-CD2 3.63Å; F954-F971 AromaticContact CE2-CG 3.93Å; F954-F971 HydrophobicContact CE2-CG 3.93Å; F954-F971 HydrophobicContact CG-CB 4.25Å; F954-F971 HydrophobicContact CZ-CB 3.48Å; F954-F971 VanDerWaalsContact CZ-CB 3.48Å; F954-F971 HydrophobicContact CZ-CD2 4.04Å; F954-F971 AromaticContact CZ-CG 3.85Å; F954-F971 HydrophobicContact CZ-CG 3.85Å; F954-F971 PolarHBondContact N-O 2.97Å; F954-F971 PolarHBondContact O-N 3.43Å; C956-F971 HydrophobicContact CB-CD2 3.87Å; C956-F971 HydrophobicContact CB-CE2 3.7Å
972	S	93.1	Very high	91.8	Very high	39 Å²	39	66.5 Å²	66.5	27%	0.273	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.7	169	177.9	0	0	0	0	109.4	R897	R897-S972 PolarHBondContact N-O 3.32Å; R897-S972 PolarHBondContact O-N 3.33Å
973	A	92	Very high	92.2	Very high	19 Å²	19	62 Å²	62	16%	0.157	35%	0.346	C	S	.	.			trans	-114.4	-9.9	-177.6	0	0	0	0	0	113	L896 G952 F954 K976 C977	L896-A973 HydrophobicContact CD2-CB 3.46Å; L896-A973 VanDerWaalsContact CD2-CB 3.46Å; G952-A973 PolarHBondContact O-N 2.85Å; F954-A973 HydrophobicContact CE1-CB 4.26Å; A973-K976 PolarHBondContact O-N 3.15Å; A973-C977 HydrophobicContact CB-CB 4.02Å
974	G	89.7	Confident	92.7	Very high	29 Å²	29	55.3 Å²	55.3	30%	0.299	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	60.6	-133.9	-174.5	0	0	0	0	0	111.1	G952 K976 C977	G952-G974 WeakPolarHBondContact CA-O 3.33Å; G952-G974 PolarHBondContact O-N 2.77Å; G974-K976 PolarHBondContact O-N 3.48Å; G974-C977 WeakPolarHBondContact O-CB 3.29Å; G974-C977 PolarHBondContact O-N 3.42Å
975	P	89.4	Confident	92.9	Very high	136 Å²	136	54 Å²	54	88%	0.883	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-64.2	-22.2	-176.3	28	-35.4	0	0	0	113.6	C977	P975-C977 VanDerWaalsContact C-N 3.26Å; P975-C977 PolarHBondContact O-N 2.9Å
976	K	91.8	Very high	93.2	Very high	97 Å²	97	51.2 Å²	51.2	42%	0.422	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-81.6	6.2	178.2	-67.9	-170.8	153.3	-88.1	0	114.1	Y892 A973 G974 D978 E979 W980	Y892-K976 PolarHBondContact OH-NZ 3.45Å; A973-K976 PolarHBondContact O-N 3.15Å; G974-K976 PolarHBondContact O-N 3.48Å; K976-D978 PolarHBondContact O-N 2.77Å; K976-E979 WeakPolarHBondContact CD-OE2 3.48Å; K976-E979 WeakPolarHBondContact CE-OE2 3.4Å; K976-E979 VanDerWaalsContact CG-OE2 3.22Å; K976-E979 WeakPolarHBondContact CG-OE2 3.4Å; K976-E979 IonicContact NZ-OE1 3.36Å; K976-E979 PolarHBondContact NZ-OE1 2.96Å; K976-E979 IonicContact NZ-OE2 3.88Å; K976-E979 PolarHBondContact NZ-OE2 3.42Å; K976-E979 WeakPolarHBondContact O-CB 3.24Å; K976-E979 PolarHBondContact O-N 3.46Å; K976-W980 VanDerWaalsContact O-CD1 3.28Å; K976-W980 PolarHBondContact O-N 3.49Å
977	C	92.6	Very high	93.5	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.02	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-45.3	-175.9	-173.9	0	0	0	0	113.1	A973 G974 P975 W980 I981	A973-C977 HydrophobicContact CB-CB 4.02Å; G974-C977 WeakPolarHBondContact O-CB 3.29Å; G974-C977 PolarHBondContact O-N 3.42Å; P975-C977 VanDerWaalsContact C-N 3.26Å; P975-C977 PolarHBondContact O-N 2.9Å; C977-W980 PolarHBondContact O-N 2.8Å; C977-I981 VanDerWaalsContact O-CG1 3.28Å; C977-I981 WeakPolarHBondContact O-CG1 3.21Å; C977-I981 PolarHBondContact O-N 2.83Å
978	D	92.6	Very high	93.8	Very high	71 Å²	71	47.4 Å²	47.4	38%	0.38	27%	0.266	S	S	.	.	H	α-helix	trans	-74.5	-30.3	-177.3	-55.4	-26.3	0	0	0	111.7	R947 K976 T982	R947-D978 IonicContact CZ-OD1 3.69Å; R947-D978 IonicContact CZ-OD2 2.7Å; R947-D978 IonicContact NE-OD1 3.62Å; R947-D978 PolarHBondContact NE-OD1 3.49Å; R947-D978 IonicContact NH2-OD1 2.76Å; R947-D978 PolarHBondContact NH2-OD1 3.31Å; R947-D978 IonicContact NH2-OD2 2.75Å; R947-D978 PolarHBondContact NH2-OD2 3.26Å; K976-D978 PolarHBondContact O-N 2.77Å; D978-T982 VanDerWaalsContact O-CB 3.31Å; D978-T982 WeakPolarHBondContact O-CB 3.18Å; D978-T982 PolarHBondContact O-N 3.37Å; D978-T982 PolarHBondContact O-OG1 3.5Å
979	E	94.7	Very high	93.9	Very high	72 Å²	72	46 Å²	46	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-49.3	169	-176	-173.7	-178.1	0	0	110.6	Y892 K976 T982 Q983	Y892-E979 VanDerWaalsContact OH-CD 3.26Å; Y892-E979 PolarHBondContact OH-OE1 3.05Å; K976-E979 WeakPolarHBondContact CD-OE2 3.48Å; K976-E979 WeakPolarHBondContact CE-OE2 3.4Å; K976-E979 VanDerWaalsContact CG-OE2 3.22Å; K976-E979 WeakPolarHBondContact CG-OE2 3.4Å; K976-E979 IonicContact NZ-OE1 3.36Å; K976-E979 PolarHBondContact NZ-OE1 2.96Å; K976-E979 IonicContact NZ-OE2 3.88Å; K976-E979 PolarHBondContact NZ-OE2 3.42Å; K976-E979 WeakPolarHBondContact O-CB 3.24Å; K976-E979 PolarHBondContact O-N 3.46Å; E979-T982 PolarHBondContact O-N 2.98Å; E979-Q983 WeakPolarHBondContact O-CB 3.45Å; E979-Q983 VanDerWaalsContact O-CG 3.23Å; E979-Q983 WeakPolarHBondContact O-CG 3.41Å; E979-Q983 PolarHBondContact O-N 3.32Å
980	W	95.9	Very high	94	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.015	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-44.5	176.8	-87.2	102.8	0	0	0	113	Y892 L896 C910 I912 F917 F954 K976 C977 Q983 I984	Y892-W980 HydrophobicContact CD1-CD2 4.26Å; Y892-W980 AromaticContact CD1-CE3 3.97Å; Y892-W980 HydrophobicContact CD1-CE3 3.97Å; Y892-W980 AromaticContact CD1-CH2 3.86Å; Y892-W980 HydrophobicContact CD1-CH2 3.86Å; Y892-W980 HydrophobicContact CD1-CZ2 4.14Å; Y892-W980 AromaticContact CD1-CZ3 3.76Å; Y892-W980 HydrophobicContact CD1-CZ3 3.76Å; Y892-W980 AromaticContact CE1-CD2 3.78Å; Y892-W980 HydrophobicContact CE1-CD2 3.78Å; Y892-W980 AromaticContact CE1-CE2 3.6Å; Y892-W980 AromaticContact CE1-CE3 3.98Å; Y892-W980 HydrophobicContact CE1-CE3 3.98Å; Y892-W980 HydrophobicContact CE1-CG 4.43Å; Y892-W980 AromaticContact CE1-CH2 3.9Å; Y892-W980 HydrophobicContact CE1-CH2 3.9Å; Y892-W980 AromaticContact CE1-CZ2 3.69Å; Y892-W980 HydrophobicContact CE1-CZ2 3.69Å; Y892-W980 HydrophobicContact CE1-CZ3 4.04Å; L896-W980 HydrophobicContact CD1-CD2 3.99Å; L896-W980 HydrophobicContact CD1-CE3 4.1Å; L896-W980 HydrophobicContact CD1-CH2 4.07Å; L896-W980 HydrophobicContact CD1-CZ2 3.94Å; L896-W980 HydrophobicContact CD1-CZ3 4.15Å; L896-W980 HydrophobicContact CD2-CD2 4.13Å; L896-W980 HydrophobicContact CD2-CG 4.16Å; L896-W980 HydrophobicContact CD2-CZ2 4.19Å; L896-W980 HydrophobicContact CG-CD2 4.3Å; L896-W980 HydrophobicContact CG-CH2 4.33Å; L896-W980 HydrophobicContact CG-CZ2 3.76Å; C910-W980 HydrophobicContact CB-CH2 3.91Å; C910-W980 HydrophobicContact CB-CZ3 4.28Å; I912-W980 HydrophobicContact CD1-CE3 4.16Å; I912-W980 HydrophobicContact CD1-CZ3 4.08Å; I912-W980 HydrophobicContact CG1-CE3 4.48Å; I912-W980 HydrophobicContact CG1-CZ3 3.93Å; F917-W980 HydrophobicContact CE2-CZ3 4.13Å; F954-W980 HydrophobicContact CE1-CB 3.95Å; F954-W980 HydrophobicContact CE1-CG 4.46Å; F954-W980 HydrophobicContact CZ-CB 4.34Å; K976-W980 VanDerWaalsContact O-CD1 3.28Å; K976-W980 PolarHBondContact O-N 3.49Å; C977-W980 PolarHBondContact O-N 2.8Å; W980-Q983 PolarHBondContact O-N 3.11Å; W980-I984 HydrophobicContact CE3-CD1 4.23Å; W980-I984 VanDerWaalsContact O-CG1 3.31Å; W980-I984 WeakPolarHBondContact O-CG1 3.49Å; W980-I984 PolarHBondContact O-N 3.3Å
981	I	94.9	Very high	94	Very high	30 Å²	30	47.8 Å²	47.8	15%	0.154	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-49	176.4	-65.6	163.7	0	0	0	109.8	I945 R947 F954 C977 Q983 I984 E985	I945-I981 HydrophobicContact CG2-CG1 4.03Å; I945-I981 HydrophobicContact CG2-CG2 4.29Å; R947-I981 HydrophobicContact CB-CD1 4.08Å; R947-I981 HydrophobicContact CG-CD1 3.87Å; F954-I981 HydrophobicContact CB-CD1 4.11Å; F954-I981 HydrophobicContact CB-CG1 4.14Å; F954-I981 HydrophobicContact CD1-CG1 4.47Å; F954-I981 HydrophobicContact CG-CG1 4.29Å; C977-I981 VanDerWaalsContact O-CG1 3.28Å; C977-I981 WeakPolarHBondContact O-CG1 3.21Å; C977-I981 PolarHBondContact O-N 2.83Å; I981-Q983 VanDerWaalsContact C-N 3.35Å; I981-Q983 PolarHBondContact O-N 3.38Å; I981-I984 PolarHBondContact O-N 2.94Å; I981-E985 HydrophobicContact CG2-CG 4.38Å; I981-E985 WeakPolarHBondContact O-CG 3.32Å; I981-E985 PolarHBondContact O-N 3.1Å
982	T	95.5	Very high	93.8	Very high	95 Å²	95	53.5 Å²	53.5	58%	0.583	29%	0.288	S	S	*	.	H	α-helix	trans	-61.5	-41.7	-179.5	-53.9	0	0	0	0	111.9	D978 E979 S986	D978-T982 VanDerWaalsContact O-CB 3.31Å; D978-T982 WeakPolarHBondContact O-CB 3.18Å; D978-T982 PolarHBondContact O-N 3.37Å; D978-T982 PolarHBondContact O-OG1 3.5Å; E979-T982 PolarHBondContact O-N 2.98Å; T982-S986 WeakPolarHBondContact O-CB 3.49Å; T982-S986 PolarHBondContact O-N 3.26Å
983	Q	96.6	Very high	93.7	Very high	74 Å²	74	57.4 Å²	57.4	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-67.1	-40	178.2	-71	-68	-8.9	0	0	112.5	Y892 I912 E979 W980 I981 A987	Y892-Q983 HydrophobicContact CD2-CG 4.05Å; Y892-Q983 HydrophobicContact CE2-CG 4.35Å; Y892-Q983 HydrophobicContact CG-CB 4.44Å; Y892-Q983 HydrophobicContact CG-CG 4.2Å; I912-Q983 HydrophobicContact CD1-CB 3.8Å; E979-Q983 WeakPolarHBondContact O-CB 3.45Å; E979-Q983 VanDerWaalsContact O-CG 3.23Å; E979-Q983 WeakPolarHBondContact O-CG 3.41Å; E979-Q983 PolarHBondContact O-N 3.32Å; W980-Q983 PolarHBondContact O-N 3.11Å; I981-Q983 VanDerWaalsContact C-N 3.35Å; I981-Q983 PolarHBondContact O-N 3.38Å; Q983-A987 VanDerWaalsContact O-CB 3.29Å; Q983-A987 WeakPolarHBondContact O-CB 3.44Å; Q983-A987 PolarHBondContact O-N 3.04Å
984	I	95.8	Very high	93.4	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-73.9	-40.9	178.8	-56.8	162	0	0	0	111.2	I912 F917 L940 L943 I945 F954 W980 I981 A987 K988	I912-I984 HydrophobicContact CD1-CB 4.3Å; I912-I984 HydrophobicContact CD1-CD1 4.45Å; I912-I984 HydrophobicContact CD1-CG1 3.35Å; I912-I984 HydrophobicContact CG1-CG1 4.03Å; F917-I984 HydrophobicContact CE2-CD1 4.21Å; F917-I984 HydrophobicContact CZ-CD1 4.46Å; L940-I984 HydrophobicContact CD2-CG2 4.24Å; L943-I984 HydrophobicContact CD2-CG2 4.22Å; I945-I984 HydrophobicContact CD1-CB 3.52Å; I945-I984 HydrophobicContact CD1-CD1 3.5Å; I945-I984 VanDerWaalsContact CD1-CD1 3.5Å; I945-I984 HydrophobicContact CD1-CG1 4.09Å; I945-I984 HydrophobicContact CD1-CG2 3.47Å; I945-I984 VanDerWaalsContact CD1-CG2 3.47Å; F954-I984 HydrophobicContact CE2-CD1 4.24Å; F954-I984 HydrophobicContact CZ-CD1 4.25Å; W980-I984 HydrophobicContact CE3-CD1 4.23Å; W980-I984 VanDerWaalsContact O-CG1 3.31Å; W980-I984 WeakPolarHBondContact O-CG1 3.49Å; W980-I984 PolarHBondContact O-N 3.3Å; I981-I984 PolarHBondContact O-N 2.94Å; I984-A987 PolarHBondContact O-N 3.13Å; I984-K988 HydrophobicContact CG2-CD 4.09Å; I984-K988 HydrophobicContact CG2-CG 4.32Å; I984-K988 WeakPolarHBondContact O-CB 3.37Å; I984-K988 VanDerWaalsContact O-CG 3.28Å; I984-K988 WeakPolarHBondContact O-CG 3.35Å; I984-K988 PolarHBondContact O-N 2.84Å
985	E	95.6	Very high	93.3	Very high	68 Å²	68	60.9 Å²	60.9	32%	0.318	31%	0.308	S	S	.	.	H	α-helix	trans	-67.2	-37.5	176.2	-66.6	-56.3	148.2	0	0	112.1	I981 K988 E989	I981-E985 HydrophobicContact CG2-CG 4.38Å; I981-E985 WeakPolarHBondContact O-CG 3.32Å; I981-E985 PolarHBondContact O-N 3.1Å; E985-K988 PolarHBondContact O-N 2.89Å; E985-K988 IonicContact OE1-NZ 2.75Å; E985-K988 PolarHBondContact OE1-NZ 3.26Å; E985-K988 WeakPolarHBondContact OE2-CE 3.45Å; E985-K988 IonicContact OE2-NZ 2.8Å; E985-K988 PolarHBondContact OE2-NZ 2.99Å; E985-E989 WeakPolarHBondContact O-CB 3.47Å; E985-E989 PolarHBondContact O-N 2.84Å
986	S	96.5	Very high	93.1	Very high	54 Å²	54	58.7 Å²	58.7	38%	0.378	29%	0.285	S	S	.	.	H	α-helix	trans	-61.1	-45.4	169.7	179.8	0	0	0	0	111.9	T982 K988 E989 N990	T982-S986 WeakPolarHBondContact O-CB 3.49Å; T982-S986 PolarHBondContact O-N 3.26Å; S986-K988 VanDerWaalsContact C-N 3.35Å; S986-K988 PolarHBondContact O-N 3.28Å; S986-E989 PolarHBondContact O-N 3.02Å; S986-N990 WeakPolarHBondContact O-CB 3.27Å; S986-N990 PolarHBondContact O-N 3.43Å; S986-N990 PolarHBondContact O-ND2 2.87Å; S986-N990 PolarHBondContact OG-ND2 3.38Å
987	A	95.7	Very high	92.4	Very high	2 Å²	2	57.2 Å²	57.2	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-39.3	176.3	0	0	0	0	0	112.3	L891 I912 L940 Q983 I984 Y991	L891-A987 HydrophobicContact CD1-CB 3.71Å; I912-A987 HydrophobicContact CG2-CB 3.58Å; L940-A987 HydrophobicContact CD1-CB 3.79Å; Q983-A987 VanDerWaalsContact O-CB 3.29Å; Q983-A987 WeakPolarHBondContact O-CB 3.44Å; Q983-A987 PolarHBondContact O-N 3.04Å; I984-A987 PolarHBondContact O-N 3.13Å; A987-Y991 VanDerWaalsContact O-CB 3.3Å; A987-Y991 WeakPolarHBondContact O-CB 3.26Å; A987-Y991 PolarHBondContact O-N 2.83Å
988	K	95.1	Very high	91.5	Very high	41 Å²	41	59 Å²	59	18%	0.178	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-47.4	174.8	-77.6	168.9	53.5	-177.1	0	112.3	L940 L943 I984 E985 S986 Y991 R992	L940-K988 HydrophobicContact CB-CG 3.97Å; L940-K988 HydrophobicContact CD2-CG 4.4Å; L943-K988 WeakPolarHBondContact O-CD 3.18Å; L943-K988 WeakPolarHBondContact O-CE 3.31Å; L943-K988 PolarHBondContact O-NZ 3.31Å; I984-K988 HydrophobicContact CG2-CD 4.09Å; I984-K988 HydrophobicContact CG2-CG 4.32Å; I984-K988 WeakPolarHBondContact O-CB 3.37Å; I984-K988 VanDerWaalsContact O-CG 3.28Å; I984-K988 WeakPolarHBondContact O-CG 3.35Å; I984-K988 PolarHBondContact O-N 2.84Å; E985-K988 PolarHBondContact O-N 2.89Å; E985-K988 IonicContact OE1-NZ 2.75Å; E985-K988 PolarHBondContact OE1-NZ 3.26Å; E985-K988 WeakPolarHBondContact OE2-CE 3.45Å; E985-K988 IonicContact OE2-NZ 2.8Å; E985-K988 PolarHBondContact OE2-NZ 2.99Å; S986-K988 VanDerWaalsContact C-N 3.35Å; S986-K988 PolarHBondContact O-N 3.28Å; K988-Y991 PolarHBondContact O-N 2.86Å; K988-R992 WeakPolarHBondContact O-CB 3.27Å; K988-R992 PolarHBondContact O-N 3.28Å
989	E	94.5	Very high	90.7	Very high	70 Å²	70	58 Å²	58	33%	0.327	29%	0.291	S	S	.	.	H	α-helix	trans	-67.2	-39.9	-179.6	178.7	56.7	-164.2	0	0	111.5	E985 S986 R992 K993	E985-E989 WeakPolarHBondContact O-CB 3.47Å; E985-E989 PolarHBondContact O-N 2.84Å; S986-E989 PolarHBondContact O-N 3.02Å; E989-R992 WeakPolarHBondContact O-CB 3.24Å; E989-R992 PolarHBondContact O-N 2.65Å; E989-R992 IonicContact OE1-CZ 2.77Å; E989-R992 IonicContact OE1-NE 2.62Å; E989-R992 IonicContact OE1-NH2 3.42Å; E989-R992 PolarHBondContact OE1-NH2 3.28Å; E989-R992 IonicContact OE2-CZ 2.86Å; E989-R992 IonicContact OE2-NE 2.69Å; E989-R992 PolarHBondContact OE2-NE 3.43Å; E989-R992 IonicContact OE2-NH2 2.69Å; E989-R992 PolarHBondContact OE2-NH2 2.83Å; E989-K993 WeakPolarHBondContact O-CG 3.45Å; E989-K993 PolarHBondContact O-N 2.85Å; E989-K993 WeakPolarHBondContact OE1-CE 3.46Å; E989-K993 IonicContact OE1-NZ 3.16Å
990	N	93.6	Very high	89.6	Confident	83 Å²	83	55.7 Å²	55.7	44%	0.444	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-45.8	171.4	-72.9	-50.9	0	0	0	111.4	S986 R992 K993 L994	S986-N990 WeakPolarHBondContact O-CB 3.27Å; S986-N990 PolarHBondContact O-N 3.43Å; S986-N990 PolarHBondContact O-ND2 2.87Å; S986-N990 PolarHBondContact OG-ND2 3.38Å; N990-R992 VanDerWaalsContact C-N 3.31Å; N990-R992 PolarHBondContact O-N 3.24Å; N990-K993 PolarHBondContact O-N 3.5Å; N990-L994 WeakPolarHBondContact O-CG 3.46Å; N990-L994 PolarHBondContact O-N 2.82Å
991	Y	93.5	Very high	88.3	Confident	15 Å²	15	57.3 Å²	57.3	6%	0.059	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-39.9	175.1	-175.9	-117.2	0	0	0	112.1	I736 T914 D915 L940 D941 A987 K988 L994 M995	I736-Y991 HydrophobicContact CG2-CE2 4.49Å; T914-Y991 WeakPolarHBondContact O-CD2 3.5Å; D915-Y991 HydrophobicContact CB-CD2 3.69Å; D915-Y991 HydrophobicContact CB-CE2 3.33Å; L940-Y991 HydrophobicContact CB-CD1 4.04Å; L940-Y991 HydrophobicContact CB-CG 4.41Å; D941-Y991 HydrophobicContact CB-CD1 4.16Å; D941-Y991 HydrophobicContact CB-CE1 3.92Å; A987-Y991 VanDerWaalsContact O-CB 3.3Å; A987-Y991 WeakPolarHBondContact O-CB 3.26Å; A987-Y991 PolarHBondContact O-N 2.83Å; K988-Y991 PolarHBondContact O-N 2.86Å; Y991-L994 PolarHBondContact O-N 3.28Å; Y991-M995 HydrophobicContact CD1-CG 4.41Å; Y991-M995 HydrophobicContact CD2-CG 3.97Å; Y991-M995 HydrophobicContact CE1-CG 4.06Å; Y991-M995 HydrophobicContact CE2-CG 3.55Å; Y991-M995 HydrophobicContact CE2-SD 3.92Å; Y991-M995 HydrophobicContact CG-CG 4.38Å; Y991-M995 WeakPolarHBondContact O-CB 3.27Å; Y991-M995 VanDerWaalsContact O-CG 3.22Å; Y991-M995 WeakPolarHBondContact O-CG 3.42Å; Y991-M995 PolarHBondContact O-N 2.97Å
992	R	91.5	Very high	86.6	Confident	120 Å²	120	56.1 Å²	56.1	45%	0.453	28%	0.283	S	S	.	.	H	α-helix	trans	-59.2	-51.6	175.7	-164.1	-176.7	70.9	69	11.9	110.9	K988 E989 N990 L994 M995 E996	K988-R992 WeakPolarHBondContact O-CB 3.27Å; K988-R992 PolarHBondContact O-N 3.28Å; E989-R992 WeakPolarHBondContact O-CB 3.24Å; E989-R992 PolarHBondContact O-N 2.65Å; E989-R992 IonicContact OE1-CZ 2.77Å; E989-R992 IonicContact OE1-NE 2.62Å; E989-R992 IonicContact OE1-NH2 3.42Å; E989-R992 PolarHBondContact OE1-NH2 3.28Å; E989-R992 IonicContact OE2-CZ 2.86Å; E989-R992 IonicContact OE2-NE 2.69Å; E989-R992 PolarHBondContact OE2-NE 3.43Å; E989-R992 IonicContact OE2-NH2 2.69Å; E989-R992 PolarHBondContact OE2-NH2 2.83Å; N990-R992 VanDerWaalsContact C-N 3.31Å; N990-R992 PolarHBondContact O-N 3.24Å; R992-L994 VanDerWaalsContact C-N 3.31Å; R992-L994 PolarHBondContact O-N 3.19Å; R992-M995 CarbonylContact O-C 3.55Å; R992-M995 PolarHBondContact O-N 2.98Å; R992-E996 IonicContact CZ-OE1 2.69Å; R992-E996 IonicContact NH1-OE1 2.71Å; R992-E996 PolarHBondContact NH1-OE1 3.15Å; R992-E996 IonicContact NH2-OE1 3.57Å; R992-E996 PolarHBondContact O-N 3.38Å
993	K	90.5	Very high	84.6	Confident	121 Å²	121	54.8 Å²	54.8	53%	0.526	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-36.2	176.1	-68.9	-179.4	-174.6	-170.9	0	113.2	E989 N990 M995	E989-K993 WeakPolarHBondContact O-CG 3.45Å; E989-K993 PolarHBondContact O-N 2.85Å; E989-K993 WeakPolarHBondContact OE1-CE 3.46Å; E989-K993 IonicContact OE1-NZ 3.16Å; N990-K993 PolarHBondContact O-N 3.5Å; K993-M995 VanDerWaalsContact C-N 3.3Å; K993-M995 PolarHBondContact O-N 2.86Å
994	L	85.9	Confident	82.1	Confident	61 Å²	61	52.7 Å²	52.7	32%	0.319	26%	0.263	S	S	.	.	H	α-helix	trans	-72	-22.9	175.1	-67.1	-175.3	0	0	0	113.5	I886 N990 Y991 R992	I886-L994 HydrophobicContact CD1-CD1 3.89Å; I886-L994 HydrophobicContact CD1-CD2 3.47Å; I886-L994 VanDerWaalsContact CD1-CD2 3.47Å; I886-L994 HydrophobicContact CD1-CG 4.17Å; I886-L994 HydrophobicContact CG2-CD1 4.41Å; N990-L994 WeakPolarHBondContact O-CG 3.46Å; N990-L994 PolarHBondContact O-N 2.82Å; Y991-L994 PolarHBondContact O-N 3.28Å; R992-L994 VanDerWaalsContact C-N 3.31Å; R992-L994 PolarHBondContact O-N 3.19Å
995	M	87.2	Confident	79.5	Confident	60 Å²	60	57.4 Å²	57.4	30%	0.296	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	7.6	-179.5	-61.7	-64.9	-69.1	0	0	113.2	P739 Y991 R992 K993	P739-M995 VanDerWaalsContact CG-O 3.3Å; P739-M995 WeakPolarHBondContact CG-O 3.26Å; Y991-M995 HydrophobicContact CD1-CG 4.41Å; Y991-M995 HydrophobicContact CD2-CG 3.97Å; Y991-M995 HydrophobicContact CE1-CG 4.06Å; Y991-M995 HydrophobicContact CE2-CG 3.55Å; Y991-M995 HydrophobicContact CE2-SD 3.92Å; Y991-M995 HydrophobicContact CG-CG 4.38Å; Y991-M995 WeakPolarHBondContact O-CB 3.27Å; Y991-M995 VanDerWaalsContact O-CG 3.22Å; Y991-M995 WeakPolarHBondContact O-CG 3.42Å; Y991-M995 PolarHBondContact O-N 2.97Å; R992-M995 CarbonylContact O-C 3.55Å; R992-M995 PolarHBondContact O-N 2.98Å; K993-M995 VanDerWaalsContact C-N 3.3Å; K993-M995 PolarHBondContact O-N 2.86Å
996	E	84.5	Confident	76.7	Confident	90 Å²	90	60.2 Å²	60.2	42%	0.421	30%	0.302	S	S	.	.	S	Bend	trans	-73.6	129.2	165.4	-78.5	173.7	177.3	0	0	109.5	R992 E998	R992-E996 IonicContact CZ-OE1 2.69Å; R992-E996 IonicContact NH1-OE1 2.71Å; R992-E996 PolarHBondContact NH1-OE1 3.15Å; R992-E996 IonicContact NH2-OE1 3.57Å; R992-E996 PolarHBondContact O-N 3.38Å; E996-E998 PolarHBondContact O-N 3.38Å
997	P	78.2	Confident	73.7	Confident	67 Å²	67	66.8 Å²	66.8	44%	0.435	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-72.7	125.1	178.8	29.3	-33.2	0	0	0	110.4	P739 V742 V999	P739-P997 HydrophobicContact CB-CB 4.15Å; V742-P997 HydrophobicContact CG2-CB 4.13Å; P997-V999 PolarHBondContact O-N 2.9Å
998	E	74.2	Confident	70.6	Confident	40 Å²	40	77 Å²	77	19%	0.187	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-65.1	120.7	176.3	-176.7	179.4	-99.5	0	0	110.5	P741 V742 R884 E996 L1000 K1289	P741-E998 CarbonylContact C-O 3.55Å; P741-E998 VanDerWaalsContact CA-O 3.24Å; P741-E998 WeakPolarHBondContact CA-O 3.15Å; P741-E998 HydrophobicContact CB-CB 4.39Å; P741-E998 WeakPolarHBondContact CB-O 3.24Å; V742-E998 PolarHBondContact N-O 3.23Å; R884-E998 IonicContact CZ-OE2 3.16Å; R884-E998 IonicContact NH1-OE1 3.34Å; R884-E998 IonicContact NH1-OE2 2.73Å; R884-E998 PolarHBondContact NH1-OE2 3.35Å; R884-E998 IonicContact NH2-OE2 2.77Å; R884-E998 PolarHBondContact NH2-OE2 2.93Å; E996-E998 PolarHBondContact O-N 3.38Å; E998-L1000 HydrophobicContact CG-CD2 3.92Å; E998-L1000 HydrophobicContact CG-CG 4.26Å; E998-L1000 WeakPolarHBondContact OE2-CD2 3.26Å; E998-K1289 HydrophobicContact CG-CG 4.48Å; E998-K1289 WeakPolarHBondContact OE1-CD 3.48Å; E998-K1289 WeakPolarHBondContact OE1-CE 3.07Å; E998-K1289 IonicContact OE1-NZ 3.7Å; E998-K1289 PolarHBondContact OE1-NZ 3.49Å
999	V	75.8	Confident	67.4	Low	51 Å²	51	82 Å²	82	31%	0.309	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	121.7	174.3	-176.9	0	0	0	0	109.4	V742 L744 P997 V1290	V742-V999 WeakPolarHBondContact O-CA 3.38Å; L744-V999 HydrophobicContact CD1-CG1 3.57Å; L744-V999 HydrophobicContact CG-CG1 3.97Å; P997-V999 PolarHBondContact O-N 2.9Å; V999-V1290 HydrophobicContact CG1-CG2 4.5Å; V999-V1290 PolarHBondContact O-N 3.43Å
1000	L	70.9	Confident	64.2	Low	22 Å²	22	90.3 Å²	90.3	12%	0.115	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.3	179.3	-64.5	-179.7	0	0	0	108.7	P741 V742 I743 L744 E998 I1287 K1289	P741-L1000 HydrophobicContact CB-CD1 3.84Å; P741-L1000 HydrophobicContact CB-CG 4.26Å; P741-L1000 HydrophobicContact CG-CD1 4.31Å; V742-L1000 PolarHBondContact O-N 3.4Å; I743-L1000 WeakPolarHBondContact CA-O 3.35Å; I743-L1000 HydrophobicContact CG1-CB 4.5Å; L744-L1000 PolarHBondContact N-O 2.65Å; E998-L1000 HydrophobicContact CG-CD2 3.92Å; E998-L1000 HydrophobicContact CG-CG 4.26Å; E998-L1000 WeakPolarHBondContact OE2-CD2 3.26Å; L1000-I1287 HydrophobicContact CB-CG2 3.83Å; L1000-I1287 HydrophobicContact CD1-CG2 4.08Å; L1000-I1287 HydrophobicContact CD2-CG2 4.04Å; L1000-I1287 HydrophobicContact CG-CG2 4.2Å; L1000-K1289 HydrophobicContact CD2-CB 4.19Å
1001	I	68	Low	61	Low	39 Å²	39	91.4 Å²	91.4	20%	0.2	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117	177.2	-55.9	179.2	0	0	0	108.6	N746 Q1003 C1288 V1290	N746-I1001 VanDerWaalsContact OD1-CG2 3.27Å; N746-I1001 WeakPolarHBondContact OD1-CG2 3.31Å; I1001-Q1003 HydrophobicContact CG2-CG 4.03Å; I1001-C1288 HydrophobicContact CB-CB 4.5Å; I1001-C1288 PolarHBondContact N-O 2.86Å; I1001-C1288 PolarHBondContact O-N 3.22Å; I1001-V1290 HydrophobicContact CD1-CG2 3.72Å; I1001-V1290 HydrophobicContact CG1-CG2 3.98Å
1002	V	59.2	Low	57.8	Low	5 Å²	5	98.2 Å²	98.2	3%	0.03	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	118	169.9	165.3	0	0	0	0	109.1	I743 L744 F745 N746 I751 I1285 V1286 I1287	I743-V1002 HydrophobicContact CG2-CB 4.42Å; I743-V1002 HydrophobicContact CG2-CG2 3.63Å; L744-V1002 PolarHBondContact O-N 2.86Å; F745-V1002 HydrophobicContact CD1-CB 3.57Å; F745-V1002 HydrophobicContact CD1-CG1 3.46Å; F745-V1002 VanDerWaalsContact CD1-CG1 3.46Å; F745-V1002 HydrophobicContact CD1-CG2 4.15Å; F745-V1002 HydrophobicContact CE1-CB 3.85Å; F745-V1002 HydrophobicContact CE1-CG1 3.75Å; F745-V1002 HydrophobicContact CE1-CG2 3.91Å; F745-V1002 HydrophobicContact CG-CB 4.43Å; N746-V1002 PolarHBondContact N-O 2.96Å; I751-V1002 HydrophobicContact CD1-CG1 4.38Å; V1002-I1285 HydrophobicContact CB-CG2 4.32Å; V1002-I1285 HydrophobicContact CG1-CD1 4.44Å; V1002-I1285 HydrophobicContact CG1-CG1 4.21Å; V1002-I1285 HydrophobicContact CG1-CG2 3.64Å; V1002-I1285 HydrophobicContact CG2-CG2 3.92Å; V1002-V1286 WeakPolarHBondContact CA-O 3.32Å; V1002-I1287 HydrophobicContact CG2-CG1 4.29Å
1003	Q	53.1	Low	54.9	Low	66 Å²	66	101 Å²	101	31%	0.308	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130.5	170.2	-63.2	-169.1	-28.4	0	0	109.8	N746 I1001 L1005 V1286	N746-Q1003 HydrophobicContact CB-CG 4.45Å; N746-Q1003 PolarHBondContact ND2-NE2 3.31Å; N746-Q1003 VanDerWaalsContact ND2-NE2 3.19Å; I1001-Q1003 HydrophobicContact CG2-CG 4.03Å; Q1003-L1005 PolarHBondContact O-N 2.87Å; Q1003-V1286 PolarHBondContact N-O 3.45Å; Q1003-V1286 VanDerWaalsContact N-O 3.11Å; Q1003-V1286 PolarHBondContact O-N 3.47Å
1004	P	45.5	Very low	51.8	Low	31 Å²	31	99.5 Å²	99.5	20%	0.201	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	128.1	168.2	-12.5	27	0	0	0	109.2	D747 I751 M1006	D747-P1004 HydrophobicContact CB-CG 4.27Å; I751-P1004 HydrophobicContact CD1-CG 4.4Å; I751-P1004 HydrophobicContact CG1-CG 4.15Å; P1004-M1006 HydrophobicContact CB-CG 4.42Å; P1004-M1006 PolarHBondContact O-N 2.95Å
1005	L	40.3	Very low	48.8	Very low	99 Å²	99	102.8 Å²	102.8	52%	0.518	51%	0.51	S	S	.	.			trans	-75	76	172.1	-166.3	79	0	0	0	110	Q1003 K1007 V1280 S1284 V1286	Q1003-L1005 PolarHBondContact O-N 2.87Å; L1005-K1007 PolarHBondContact O-N 2.67Å; L1005-V1280 HydrophobicContact CD2-CG1 4.19Å; L1005-S1284 VanDerWaalsContact CB-O 3.23Å; L1005-S1284 WeakPolarHBondContact CB-O 3.44Å; L1005-S1284 PolarHBondContact N-O 3.13Å; L1005-V1286 HydrophobicContact CD1-CG2 4.18Å
1006	M	37.4	Very low	46	Very low	127 Å²	127	107.7 Å²	107.7	63%	0.626	54%	0.536	S	S	*	.			trans	-62.6	126.7	175.2	-68.4	-166.4	72.7	0	0	110	P1004 Y1008	P1004-M1006 HydrophobicContact CB-CG 4.42Å; P1004-M1006 PolarHBondContact O-N 2.95Å; M1006-Y1008 PolarHBondContact O-N 3.43Å
1007	K	32	Very low	43.1	Very low	192 Å²	192	110 Å²	110	84%	0.835	55%	0.549	S	S	*	.			trans	-64.8	104	168.5	-76.6	-174.2	175.1	-175.7	0	108.8	L1005 Q1009	L1005-K1007 PolarHBondContact O-N 2.67Å; K1007-Q1009 VanDerWaalsContact C-N 3.3Å; K1007-Q1009 PolarHBondContact O-N 2.75Å
1008	Y	31.4	Very low	40.6	Very low	216 Å²	216	115.2 Å²	115.2	85%	0.847	57%	0.57	S	S	*	*			trans	-69.4	95.8	151.7	-85.8	-85.2	0	0	0	108	M1006 R1010	M1006-Y1008 PolarHBondContact O-N 3.43Å; Y1008-R1010 PolarHBondContact O-N 3.31Å
1009	Q	28.3	Very low	38.4	Very low	147 Å²	147	118.5 Å²	118.5	69%	0.687	60%	0.598	S	S	*	*			trans	-56.3	122.7	154.6	-100.4	170.1	-103.7	0	0	107.5	K1007 D1011	K1007-Q1009 VanDerWaalsContact C-N 3.3Å; K1007-Q1009 PolarHBondContact O-N 2.75Å; Q1009-D1011 WeakPolarHBondContact CB-OD2 3.38Å; Q1009-D1011 WeakPolarHBondContact CG-OD2 3.34Å; Q1009-D1011 PolarHBondContact NE2-OD2 3.4Å; Q1009-D1011 PolarHBondContact O-N 3.46Å
1010	R	27.7	Very low	36.2	Very low	244 Å²	244	121.4 Å²	121.4	92%	0.921	62%	0.618	S	S	*	*			trans	-87.1	65.3	168	-85.4	-172.7	171.4	168.4	-3.3	108.7	Y1008	Y1008-R1010 PolarHBondContact O-N 3.31Å
1011	D	25.8	Very low	34	Very low	106 Å²	106	128 Å²	128	57%	0.567	65%	0.653	S	S	*	*			trans	-103.6	143.2	165.9	-59.2	-51.3	0	0	0	107.7	Q1009	Q1009-D1011 WeakPolarHBondContact CB-OD2 3.38Å; Q1009-D1011 WeakPolarHBondContact CG-OD2 3.34Å; Q1009-D1011 PolarHBondContact NE2-OD2 3.4Å; Q1009-D1011 PolarHBondContact O-N 3.46Å
1012	D	26.8	Very low	32.1	Very low	159 Å²	159	132 Å²	132	85%	0.85	68%	0.684	S	S	*	*			trans	56.7	64.7	178	-60.6	-23.2	0	0	0	118
1013	L	29.4	Very low	30.5	Very low	178 Å²	178	139.9 Å²	139.9	93%	0.932	72%	0.723	S	S	*	*				-98.4	107.1	129	-105.1	173.4	0	0	0	108.3	T1015	L1013-T1015 PolarHBondContact O-N 2.88Å
1014	S	25.6	Very low	29.2	Very low	90 Å²	90	142.5 Å²	142.5	63%	0.629	75%	0.747	S	S	*	*			trans	-65.7	126.9	-167.4	57	0	0	0	0	114.2	I1016	S1014-I1016 PolarHBondContact O-N 2.97Å
1015	T	24.6	Very low	28.3	Very low	130 Å²	130	147 Å²	147	80%	0.798	78%	0.779	S	S	*	*			trans	31.6	76.7	131.8	-41.6	0	0	0	0	116.9	L1013	L1013-T1015 PolarHBondContact O-N 2.88Å
1016	I	27.4	Very low	27.6	Very low	163 Å²	163	147.6 Å²	147.6	84%	0.836	79%	0.792	S	S	*	*			trans	-111.4	98.7	150.2	-63.1	-176.6	0	0	0	108.2	S1014	S1014-I1016 PolarHBondContact O-N 2.97Å
1017	I	24.4	Very low	27.1	Very low	138 Å²	138	148.7 Å²	148.7	71%	0.708	80%	0.8	S	S	*	*			trans	-26.7	133.2	154.3	-17.2	-178.9	0	0	0	109.3
1018	M	25	Very low	27	Very low	176 Å²	176	145.8 Å²	145.8	87%	0.867	79%	0.794	S	S	*	*				-153.3	162.2	56.9	-65.9	173.9	68.8	0	0	114.6
1019	S	28.5	Very low	26.8	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	79%	0.788	S	S	*	*			trans	-66	153	179.2	-45.2	0	0	0	0	113.9
1020	P	29.5	Very low	26.8	Very low	112 Å²	112	140.1 Å²	140.1	73%	0.727	79%	0.789	S	S	*	*			trans	-73.9	155.6	161.3	33.2	-33.6	0	0	0	111.9
1021	D	25.2	Very low	26.8	Very low	161 Å²	161	136.3 Å²	136.3	86%	0.861	78%	0.782	S	S	*	*			trans	97.8	87	164.8	-59.4	-8.5	0	0	0	118.7
1022	S	27.1	Very low	27	Very low	122 Å²	122	138 Å²	138	85%	0.853	79%	0.79	S	S	*	*				-158.9	139.2	108.1	-171.7	0	0	0	0	110.5
1023	M	26.4	Very low	27.2	Very low	171 Å²	171	138 Å²	138	84%	0.842	79%	0.785	S	S	*	*			trans	-84.1	150	168.2	-59.4	-163.6	78.4	0	0	110
1024	C	24.5	Very low	27.3	Very low	120 Å²	120	135.4 Å²	135.4	81%	0.811	77%	0.772	S	S	*	*				-178.1	147.7	105.3	-97.3	0	0	0	0	111.5
1025	S	26.6	Very low	27.5	Very low	126 Å²	126	139.7 Å²	139.7	88%	0.881	78%	0.782	S	S	*	*			trans	-66	134.9	157.6	-53.6	0	0	0	0	108.7
1026	S	26.6	Very low	27.9	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	78%	0.779	S	S	*	*			trans	-122	99.4	170.5	63.7	0	0	0	0	110.6
1027	D	26.7	Very low	28	Very low	150 Å²	150	142.8 Å²	142.8	80%	0.802	79%	0.785	S	S	*	*			trans	-121.7	125.1	138.8	-97.1	-42.7	0	0	0	107.4
1028	N	28.8	Very low	28	Very low	131 Å²	131	139.2 Å²	139.2	70%	0.701	78%	0.782	S	S	*	*	S	Bend	trans	78.2	94.1	167.5	-57.3	-53.8	0	0	0	121.1
1029	I	27.8	Very low	28.2	Very low	142 Å²	142	139 Å²	139	73%	0.728	78%	0.779	S	S	*	*				83.1	108.6	120.7	-65.4	158.5	0	0	0	120.1
1030	S	27.9	Very low	28.1	Very low	101 Å²	101	142 Å²	142	71%	0.706	78%	0.778	S	S	*	*			trans	66	153.4	146.8	73	0	0	0	0	120.4
1031	E	29.2	Very low	28.1	Very low	165 Å²	165	141.7 Å²	141.7	77%	0.771	77%	0.774	S	S	*	*			cis	-167.9	150.5	-18	-110.8	-179.4	161.6	0	0	109.1
1032	L	29	Very low	28	Very low	141 Å²	141	140.5 Å²	140.5	74%	0.738	77%	0.768	S	S	*	*			trans	60.4	153.7	151.1	-72.3	161.8	0	0	0	119.3
1033	H	31.4	Very low	28.3	Very low	159 Å²	159	140.7 Å²	140.7	74%	0.736	76%	0.764	S	S	*	*			cis	-149.8	-165.7	-10.3	-156	3.3	0	0	0	111.5
1034	N	30.9	Very low	28.3	Very low	124 Å²	124	138.2 Å²	138.2	66%	0.663	76%	0.758	S	S	*	*			trans	-98.3	152.4	-157.7	-76.7	-26.3	0	0	0	118.2
1035	Q	30.4	Very low	28.7	Very low	180 Å²	180	138.6 Å²	138.6	84%	0.841	76%	0.759	S	S	*	*			trans	72.3	151.9	140.4	-78.8	-178.3	3	0	0	122.7
1036	P	32.8	Very low	28.9	Very low	112 Å²	112	138.5 Å²	138.5	73%	0.727	75%	0.754	S	S	*	*			trans	-108.2	162.2	-177.9	41.6	-34.1	0	0	0	115.1
1037	Y	29.5	Very low	28.9	Very low	245 Å²	245	138.2 Å²	138.2	96%	0.961	75%	0.752	S	S	*	*			trans	-140	163.8	158.4	-94.7	-92.9	0	0	0	108.6
1038	G	24.2	Very low	29.1	Very low	64 Å²	64	134.9 Å²	134.9	66%	0.66	75%	0.753	S	S	*	*			trans	-165.1	160.6	174.3	0	0	0	0	0	114.1
1039	H	29.3	Very low	29.2	Very low	171 Å²	171	135.8 Å²	135.8	79%	0.792	76%	0.758	S	S	*	*			trans	-173.4	160.6	164.4	-105.8	-30.1	0	0	0	111.8
1040	F	26.9	Very low	29.4	Very low	172 Å²	172	133.4 Å²	133.4	75%	0.754	75%	0.754	S	S	*	*			trans	26.2	145.1	148.4	-65.5	-66	0	0	0	122.2
1041	V	29.4	Very low	29.7	Very low	106 Å²	106	135.1 Å²	135.1	64%	0.642	75%	0.753	S	S	*	*			cis	-172.3	160.4	-15.3	82.2	0	0	0	0	111.7
1042	D	23.6	Very low	29.8	Very low	137 Å²	137	134 Å²	134	73%	0.733	75%	0.753	S	S	*	*			trans	58.5	167.4	155.4	-65.1	-24.5	0	0	0	124.8
1043	T	31.5	Very low	29.8	Very low	125 Å²	125	132.3 Å²	132.3	77%	0.767	75%	0.753	S	S	*	*			trans	79.2	85.7	163.7	49.1	0	0	0	0	120.8
1044	T	27.7	Very low	29.6	Very low	119 Å²	119	128.4 Å²	128.4	73%	0.73	76%	0.755	S	S	*	*				37.7	132.4	123	54.9	0	0	0	0	121.7
1045	P	33.6	Very low	29.7	Very low	128 Å²	128	132 Å²	132	83%	0.831	77%	0.765	S	S	*	*			trans	-84.6	154.1	178.4	36.1	-36.4	0	0	0	114.1
1046	T	29.1	Very low	29.5	Very low	125 Å²	125	130.4 Å²	130.4	77%	0.767	76%	0.762	S	S	*	*			trans	-148.3	127.1	170.3	-41.9	0	0	0	0	114
1047	S	27.2	Very low	29.4	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	76%	0.761	S	S	*	*			trans	45.9	113.9	156.7	65.1	0	0	0	0	121.5
1048	G	30.5	Very low	29.3	Very low	80 Å²	80	126.3 Å²	126.3	83%	0.825	75%	0.749	S	S	*	*			trans	-135.6	105.7	154.1	0	0	0	0	0	110.8
1049	N	31.7	Very low	29.7	Very low	150 Å²	150	131 Å²	131	80%	0.802	76%	0.758	S	S	*	*			trans	-55.2	163	177.5	-56.8	-40.6	0	0	0	112.9
1050	S	31.1	Very low	29.7	Very low	93 Å²	93	130.6 Å²	130.6	65%	0.65	76%	0.756	S	S	*	*			cis	-170.3	164.7	18.3	-138	0	0	0	0	114.6
1051	I	34	Very low	29.8	Very low	136 Å²	136	125.3 Å²	125.3	70%	0.697	75%	0.75	S	S	*	*			trans	69.5	114	141.9	-72.7	160	0	0	0	121.1
1052	N	31.2	Very low	29.8	Very low	143 Å²	143	127.3 Å²	127.3	77%	0.765	76%	0.757	S	S	*	*			trans	51.5	162.3	133.9	-58.1	-3.1	0	0	0	123.3
1053	S	30.3	Very low	30.2	Very low	105 Å²	105	127.7 Å²	127.7	73%	0.734	75%	0.752	S	S	*	*			cis	-176.9	120.5	-41.6	58.9	0	0	0	0	111.2
1054	G	26.9	Very low	30.1	Very low	76 Å²	76	131.5 Å²	131.5	78%	0.784	75%	0.753	S	S	*	*			trans	74.2	131.8	145.8	0	0	0	0	0	123.2
1055	K	32.1	Very low	30.2	Very low	201 Å²	201	133 Å²	133	87%	0.874	76%	0.756	S	S	*	*			trans	81.8	109.1	150.1	-59.9	-179.9	180	177.5	0	121.3
1056	N	26.8	Very low	29.9	Very low	145 Å²	145	130.7 Å²	130.7	78%	0.775	74%	0.74	S	S	*	*				41.8	133.6	103.6	-70.8	23.4	0	0	0	119.9
1057	I	30.4	Very low	29.8	Very low	138 Å²	138	133.3 Å²	133.3	71%	0.708	74%	0.741	S	S	*	*			cis	-159.6	148.3	-7.5	-31.9	175.2	0	0	0	108.4
1058	N	27.5	Very low	29.6	Very low	133 Å²	133	136.1 Å²	136.1	71%	0.711	74%	0.74	S	S	*	*			trans	163.6	169.7	132.3	-85.7	-20.9	0	0	0	113.6
1059	I	34.1	Very low	29.3	Very low	163 Å²	163	139.6 Å²	139.6	84%	0.836	74%	0.735	S	S	*	*			trans	-134.3	125.8	-167.9	-60.2	171	0	0	0	112.4
1060	E	27.6	Very low	29	Very low	163 Å²	163	137.2 Å²	137.2	76%	0.762	73%	0.729	S	S	*	*			trans	-176.9	148.4	146.7	-104.8	-176.1	160.1	0	0	107.6
1061	G	29.6	Very low	28.9	Very low	60 Å²	60	141.9 Å²	141.9	62%	0.619	74%	0.741	S	S	*	*			cis	166.5	144.2	-11.6	0	0	0	0	0	112.2
1062	N	30.2	Very low	28.4	Very low	148 Å²	148	141.2 Å²	141.2	79%	0.791	75%	0.748	S	S	*	*			trans	68.5	151.5	171.8	-73	-67.2	0	0	0	117.5
1063	K	32	Very low	28.5	Very low	146 Å²	146	139.6 Å²	139.6	64%	0.635	75%	0.746	S	S	*	*			cis	-159.2	132.8	10.9	-124.4	153.9	-163.9	169.4	0	112
1064	R	28	Very low	28.1	Very low	205 Å²	205	142.2 Å²	142.2	77%	0.774	75%	0.751	S	S	*	*			trans	57.4	147.9	143.6	-61.9	173	-175.7	165.3	-2.4	119.6
1065	N	30	Very low	27.9	Very low	149 Å²	149	146.8 Å²	146.8	80%	0.797	75%	0.749	S	S	*	*			cis	-109.3	136.6	5.6	-65.3	-41	0	0	0	109.9
1066	V	27.1	Very low	27.4	Very low	81 Å²	81	145.2 Å²	145.2	49%	0.491	75%	0.745	S	S	.	*				75.9	120.7	59.1	176	0	0	0	0	111.7
1067	F	26.8	Very low	27.3	Very low	180 Å²	180	143 Å²	143	79%	0.789	74%	0.741	S	S	*	*			cis	-116.2	168.7	5.5	-42.3	-105.9	0	0	0	110.7
1068	F	24.7	Very low	26.9	Very low	164 Å²	164	144.3 Å²	144.3	72%	0.719	75%	0.748	S	S	*	*			cis	71.2	164.3	9.8	-60.6	-90.1	0	0	0	116.5
1069	E	23.8	Very low	26.6	Very low	153 Å²	153	144.6 Å²	144.6	72%	0.715	75%	0.749	S	S	*	*			cis	-114	156.7	-20.9	-84.3	86.1	-157.1	0	0	107.8
1070	S	25.2	Very low	26	Very low	99 Å²	99	141.2 Å²	141.2	69%	0.692	74%	0.739	S	S	*	*			cis	88.3	128.7	23.8	77.6	0	0	0	0	117.5
1071	Q	28.5	Very low	25.7	Very low	191 Å²	191	140.1 Å²	140.1	89%	0.893	74%	0.739	S	S	*	*			trans	-62.5	137	-178.3	-64.1	179.6	-6.5	0	0	113.8
1072	S	23.5	Very low	25.7	Very low	122 Å²	122	145.5 Å²	145.5	85%	0.853	75%	0.747	S	S	*	*			trans	-179.2	169.1	149.1	-87	0	0	0	0	114.1
1073	P	34.5	Very low	25.4	Very low	110 Å²	110	143.4 Å²	143.4	71%	0.714	74%	0.74	S	S	*	*			trans	-125	155.9	-176	40.8	-27.4	0	0	0	118
1074	L	21	Very low	25.2	Very low	159 Å²	159	142.4 Å²	142.4	83%	0.832	74%	0.741	S	S	*	*			trans	63	151.9	152.3	-78.4	171.8	0	0	0	123.6
1075	F	22.7	Very low	25.3	Very low	172 Å²	172	139.7 Å²	139.7	75%	0.754	74%	0.737	S	S	*	*			trans	66.2	111.2	-178.2	-71.4	-88.6	0	0	0	115.8
1076	E	22.2	Very low	25.2	Very low	169 Å²	169	138 Å²	138	79%	0.79	73%	0.728	S	S	*	*				72.3	136.3	72.5	-75.8	-165.4	157.4	0	0	114.5
1077	S	23.7	Very low	25.4	Very low	98 Å²	98	140.2 Å²	140.2	69%	0.685	74%	0.737	S	S	*	*			cis	-162.8	-156.3	-6.7	59.6	0	0	0	0	110
1078	I	22.2	Very low	25.6	Very low	165 Å²	165	138.9 Å²	138.9	85%	0.846	73%	0.734	S	S	*	*			trans	90.2	129.4	-179.4	-58	171	0	0	0	114.1
1079	N	21.6	Very low	25.9	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	73%	0.727	S	S	*	*			cis	-169.5	177	-14.6	-170.5	14.9	0	0	0	110.2
1080	C	21.8	Very low	26.2	Very low	93 Å²	93	135 Å²	135	63%	0.628	73%	0.729	S	S	*	*			trans	83.2	98.4	158.5	-53	0	0	0	0	121.2
1081	N	21.6	Very low	26.5	Very low	140 Å²	140	135.4 Å²	135.4	75%	0.749	73%	0.731	S	S	*	*				35.5	127.9	123.5	-51.4	-13	0	0	0	121.7
1082	H	28.7	Very low	26.5	Very low	172 Å²	172	134.3 Å²	134.3	80%	0.796	73%	0.728	S	S	*	*				-170.3	114.5	111.8	-110.1	-76.3	0	0	0	116
1083	T	24.5	Very low	26.8	Very low	105 Å²	105	133.8 Å²	133.8	64%	0.644	72%	0.723	S	S	*	*			trans	42.1	132.7	134.6	55.4	0	0	0	0	125.4
1084	N	26.8	Very low	26.4	Very low	124 Å²	124	135.2 Å²	135.2	66%	0.663	72%	0.724	S	S	*	*			trans	102.7	123.8	132.1	-75.5	7.3	0	0	0	123.2
1085	H	29.7	Very low	26.6	Very low	149 Å²	149	135.4 Å²	135.4	69%	0.69	72%	0.724	S	S	*	*			trans	63.3	150.7	143.6	-61.7	-43.4	0	0	0	120.1
1086	N	29.6	Very low	26.7	Very low	114 Å²	114	134.2 Å²	134.2	61%	0.61	73%	0.725	S	S	*	*			cis	-164.2	146	-16.5	-110.9	1.5	0	0	0	109.3
1087	N	30.5	Very low	26.8	Very low	126 Å²	126	134.7 Å²	134.7	67%	0.674	73%	0.725	S	S	*	*			trans	61.3	165.9	151.7	-62.1	13.5	0	0	0	116.7
1088	Q	31.4	Very low	26.8	Very low	153 Å²	153	140.6 Å²	140.6	72%	0.715	73%	0.732	S	S	*	*			cis	-165.7	155.4	-25.4	-101	-178.1	-99.3	0	0	105
1089	T	31.6	Very low	27	Very low	96 Å²	96	140.2 Å²	140.2	59%	0.589	73%	0.73	S	S	*	*			cis	-155.2	165.5	1.9	-4.1	0	0	0	0	109
1090	D	29.6	Very low	27.2	Very low	140 Å²	140	144.6 Å²	144.6	75%	0.749	74%	0.736	S	S	*	*			trans	37.3	138.9	137.8	-54.8	-15.5	0	0	0	122.2
1091	S	31.1	Very low	27.4	Very low	106 Å²	106	144.9 Å²	144.9	74%	0.741	74%	0.739	S	S	*	*			cis	-177.5	-177.4	-2.9	53	0	0	0	0	109
1092	M	29.1	Very low	27.5	Very low	168 Å²	168	145.1 Å²	145.1	83%	0.828	74%	0.741	S	S	*	*			cis	-166.5	153.6	-46.3	-94.5	-174.3	64.8	0	0	106.5
1093	C	28.7	Very low	27.4	Very low	111 Å²	111	143.6 Å²	143.6	75%	0.75	74%	0.738	S	S	*	*			cis	-148.1	-120.9	-30.4	-158.8	0	0	0	0	106
1094	I	27.5	Very low	27.4	Very low	141 Å²	141	144.4 Å²	144.4	72%	0.723	75%	0.748	S	S	*	*			cis	-139.8	138.6	-6.3	-57.5	164.4	0	0	0	106.9
1095	I	23.9	Very low	27.7	Very low	162 Å²	162	144.5 Å²	144.5	83%	0.831	76%	0.756	S	S	*	*			trans	-124.8	143.8	154.7	-65.5	173.4	0	0	0	105.8
1096	D	24.2	Very low	27.4	Very low	147 Å²	147	143.1 Å²	143.1	79%	0.786	76%	0.758	S	S	*	*			trans	-123	140.2	178.7	-151	-23.6	0	0	0	112.9
1097	K	25.8	Very low	27.3	Very low	180 Å²	180	145.7 Å²	145.7	78%	0.783	77%	0.77	S	S	*	*			trans	-167.7	126.1	-178.3	-111.5	174.3	-174.9	172	0	111.8
1098	R	23.7	Very low	26.9	Very low	222 Å²	222	147.1 Å²	147.1	84%	0.838	78%	0.775	S	S	*	*			trans	78.5	110.5	161.6	-55.5	176.2	174.7	173.5	-1.5	118.8
1099	I	25.9	Very low	26.8	Very low	157 Å²	157	146 Å²	146	81%	0.805	78%	0.778	S	S	*	*				31.5	122.4	100.2	-54	174.1	0	0	0	114.1
1100	R	25.2	Very low	26.7	Very low	230 Å²	230	148 Å²	148	87%	0.868	79%	0.785	S	S	*	*			cis	-151.5	-164.4	36.3	-134.4	174	-173.3	174.1	2.4	108.3
1101	S	26.1	Very low	26.5	Very low	99 Å²	99	149 Å²	149	69%	0.692	79%	0.785	S	S	*	*			cis	-167.3	168.4	2	26.3	0	0	0	0	108.8
1102	N	24.2	Very low	26.4	Very low	146 Å²	146	151.7 Å²	151.7	78%	0.781	79%	0.786	S	S	*	*			trans	-138.3	128.7	162.7	-117.2	-6.1	0	0	0	112.9
1103	N	26.8	Very low	26.3	Very low	139 Å²	139	153.9 Å²	153.9	74%	0.743	79%	0.785	S	S	*	*			trans	50.1	112.4	152.2	-57.9	-13.5	0	0	0	123.1
1104	S	23.7	Very low	26.3	Very low	123 Å²	123	153.3 Å²	153.3	86%	0.86	78%	0.782	S	S	*	*				-174.4	128.9	121.5	-78.3	0	0	0	0	111.4
1105	P	32.7	Very low	26.2	Very low	126 Å²	126	152 Å²	152	82%	0.818	79%	0.786	S	S	*	*			trans	-115.1	156.6	-171.7	40.5	-33.3	0	0	0	118.1
1106	T	23.7	Very low	26.4	Very low	120 Å²	120	150.3 Å²	150.3	74%	0.736	79%	0.788	S	S	*	*			trans	-8.9	138.3	158.5	-45.6	0	0	0	0	122.3	M1108	T1106-M1108 HydrophobicContact CG2-CG 4.43Å
1107	I	27.5	Very low	26.5	Very low	168 Å²	168	154.9 Å²	154.9	86%	0.862	80%	0.795	S	S	*	*			trans	-135	149.7	140.8	-67.6	-173.4	0	0	0	109.1
1108	M	22.6	Very low	26.4	Very low	156 Å²	156	150.7 Å²	150.7	77%	0.768	79%	0.788	S	S	*	*			trans	-112.7	154.5	177.9	-66.2	170.9	55.5	0	0	112.8	T1106	T1106-M1108 HydrophobicContact CG2-CG 4.43Å
1109	T	30	Very low	26.4	Very low	130 Å²	130	144.7 Å²	144.7	80%	0.798	78%	0.779	S	S	*	*			trans	-155.3	131.2	145.5	22.4	0	0	0	0	113.1
1110	N	28.4	Very low	26.2	Very low	137 Å²	137	144 Å²	144	73%	0.733	78%	0.776	S	S	*	*			trans	21	156.1	131.3	-65.7	-7.8	0	0	0	121.9
1111	H	26.6	Very low	26.2	Very low	161 Å²	161	141.2 Å²	141.2	75%	0.745	77%	0.767	S	S	*	*			cis	175.6	153.4	-27.7	-134.5	-57.8	0	0	0	106.7
1112	Q	27.3	Very low	26	Very low	162 Å²	162	141.9 Å²	141.9	76%	0.757	77%	0.767	S	S	*	*			trans	70.1	154.3	175	-49.5	-176	17.2	0	0	114.1
1113	R	27.6	Very low	26	Very low	215 Å²	215	138.6 Å²	138.6	81%	0.811	76%	0.756	S	S	*	*			cis	-146	155.6	18.3	-145.7	176	-150.7	-178.9	3.2	111.1
1114	S	29.1	Very low	25.9	Very low	99 Å²	99	139.3 Å²	139.3	69%	0.692	76%	0.758	S	S	*	*			trans	27.8	133.5	154.7	54.9	0	0	0	0	121.4
1115	S	24.7	Very low	25.9	Very low	113 Å²	113	139.3 Å²	139.3	79%	0.79	74%	0.744	S	S	*	*			cis	140.2	106.1	-8.1	52.8	0	0	0	0	109.2
1116	S	28.2	Very low	25.6	Very low	127 Å²	127	142 Å²	142	89%	0.888	74%	0.738	S	S	*	*			trans	-151.9	87.6	165.3	40.1	0	0	0	0	111.4
1117	R	26.2	Very low	25.7	Very low	243 Å²	243	142.7 Å²	142.7	92%	0.917	74%	0.738	S	S	*	*			trans	-89.8	161.5	165.2	-85.8	179.7	175.7	173.5	-3.2	108.5
1118	S	24.4	Very low	25.7	Very low	91 Å²	91	138.9 Å²	138.9	64%	0.636	73%	0.726	S	S	*	*			cis	-173.3	179.1	-7.4	45.1	0	0	0	0	110.9
1119	C	23.6	Very low	25.9	Very low	97 Å²	97	137.4 Å²	137.4	66%	0.655	73%	0.726	S	S	*	*			trans	68.1	123.8	141.2	68.4	0	0	0	0	123.6
1120	N	22.6	Very low	26	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	72%	0.723	S	S	*	*				85.2	114.2	129.8	-67.1	17.7	0	0	0	123.6
1121	Y	23.4	Very low	26	Very low	172 Å²	172	140.6 Å²	140.6	68%	0.675	73%	0.727	S	S	*	*			trans	80	151.1	131.1	-96.3	-91	0	0	0	124.2
1122	T	22.8	Very low	26.4	Very low	113 Å²	113	139.8 Å²	139.8	69%	0.693	73%	0.726	S	S	*	*			trans	61.3	106.9	163.5	47.4	0	0	0	0	121.2
1123	S	23.2	Very low	26.5	Very low	77 Å²	77	139.9 Å²	139.9	54%	0.538	73%	0.726	S	S	.	*				75.7	127.3	115.9	-56.4	0	0	0	0	122.3
1124	I	24.5	Very low	26.2	Very low	154 Å²	154	134.3 Å²	134.3	79%	0.79	72%	0.72	S	S	*	*			trans	70.8	147.6	143.1	-66	166.7	0	0	0	116.7
1125	E	24	Very low	26.1	Very low	123 Å²	123	135.9 Å²	135.9	58%	0.575	73%	0.726	S	S	*	*			cis	-179.2	150.6	-33.3	-157.5	-173	170.5	0	0	104.9
1126	R	27.2	Very low	26	Very low	183 Å²	183	135.5 Å²	135.5	69%	0.691	72%	0.723	S	S	*	*			trans	70.1	146.1	171.4	-57.9	-171.5	-169.8	69.6	20.1	115.8
1127	D	24.7	Very low	25.9	Very low	135 Å²	135	135.1 Å²	135.1	72%	0.722	72%	0.715	S	S	*	*			cis	-158.4	178.1	-7.2	-128.6	-47.8	0	0	0	114.8
1128	S	28.1	Very low	25.9	Very low	87 Å²	87	134.7 Å²	134.7	61%	0.608	71%	0.714	S	S	*	*			trans	83.8	88.4	147	-70.3	0	0	0	0	122.7
1129	T	28.2	Very low	25.9	Very low	125 Å²	125	136.5 Å²	136.5	77%	0.767	72%	0.716	S	S	*	*			trans	72.4	156.7	130.3	78.4	0	0	0	0	119.4
1130	K	31.9	Very low	25.9	Very low	169 Å²	169	139.1 Å²	139.1	74%	0.735	72%	0.723	S	S	*	*			cis	-140.4	137.1	12.7	-76.9	-178.3	179.3	176.2	0	112.8
1131	M	28.5	Very low	26	Very low	166 Å²	166	136.3 Å²	136.3	82%	0.818	72%	0.715	S	S	*	*			trans	55.9	148.4	145.5	-50.4	-173.1	-58.6	0	0	118.9
1132	I	33.4	Very low	26	Very low	143 Å²	143	136.2 Å²	136.2	73%	0.733	72%	0.724	S	S	*	*			cis	-139.5	132.5	24.8	-74.7	175.7	0	0	0	110.6
1133	H	29.6	Very low	26.1	Very low	164 Å²	164	134.8 Å²	134.8	76%	0.759	72%	0.719	S	S	*	*			trans	28.9	131.2	147.3	-65.7	-83.6	0	0	0	121.7
1134	S	22.9	Very low	26.2	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	73%	0.732	S	S	*	*			cis	62.2	130	14.9	-54.9	0	0	0	0	116.9
1135	T	25	Very low	26.4	Very low	131 Å²	131	137.3 Å²	137.3	80%	0.804	73%	0.732	S	S	*	*			cis	-169.6	156.4	4.6	12	0	0	0	0	112.4
1136	S	23.5	Very low	26.5	Very low	106 Å²	106	136.1 Å²	136.1	74%	0.741	74%	0.738	S	S	*	*			trans	30.5	126.6	142.3	-125.9	0	0	0	0	125
1137	V	26.2	Very low	26.5	Very low	118 Å²	118	133.3 Å²	133.3	72%	0.715	74%	0.737	S	S	*	*			trans	59.8	120.9	131.1	176.3	0	0	0	0	122.8
1138	R	26.4	Very low	26.7	Very low	234 Å²	234	136 Å²	136	88%	0.883	74%	0.736	S	S	*	*				-171.3	121.1	128.6	-98.8	163.1	-176.1	164.1	1.9	108.3
1139	N	24.8	Very low	26.7	Very low	130 Å²	130	138.9 Å²	138.9	70%	0.695	74%	0.74	S	S	*	*				69.5	115.9	84.8	-84.6	14.7	0	0	0	116.5
1140	L	23.9	Very low	26.6	Very low	151 Å²	151	139.3 Å²	139.3	79%	0.791	74%	0.737	S	S	*	*			trans	57.6	146.2	137.9	-58.7	168.2	0	0	0	119.6
1141	S	24.2	Very low	26.2	Very low	83 Å²	83	137.5 Å²	137.5	58%	0.58	73%	0.734	S	S	*	*			cis	-178.4	144.9	-13.4	49.8	0	0	0	0	110.6
1142	I	23.9	Very low	26.2	Very low	169 Å²	169	137.5 Å²	137.5	87%	0.867	73%	0.732	S	S	*	*			trans	67.7	144.5	152.7	-66.8	163.9	0	0	0	114.7
1143	S	25	Very low	25.7	Very low	84 Å²	84	138.5 Å²	138.5	59%	0.587	74%	0.738	S	S	*	*			cis	-149.8	153.9	16.8	56.4	0	0	0	0	113.5
1144	N	24.1	Very low	25.6	Very low	153 Å²	153	135.5 Å²	135.5	82%	0.818	74%	0.735	S	S	*	*			trans	62	151.3	147.9	-54.9	-15.8	0	0	0	118.5
1145	T	28.5	Very low	25.8	Very low	130 Å²	130	135.5 Å²	135.5	80%	0.798	74%	0.735	S	S	*	*			cis	-134	174.1	12.2	49.3	0	0	0	0	113.7
1146	S	26.4	Very low	26	Very low	98 Å²	98	135.5 Å²	135.5	69%	0.685	73%	0.731	S	S	*	*			trans	-33.9	162.9	161.9	58.5	0	0	0	0	118.5
1147	D	28.1	Very low	26.3	Very low	125 Å²	125	137.3 Å²	137.3	67%	0.668	73%	0.731	S	S	*	*			cis	-159	164.8	13.1	-141.4	-11.4	0	0	0	116.5
1148	R	28	Very low	26.4	Very low	191 Å²	191	136.7 Å²	136.7	72%	0.721	73%	0.728	S	S	*	*			trans	29.5	133.6	146.8	-82.2	162.2	-163.6	-164.7	-0.8	126.3
1149	H	29	Very low	26.5	Very low	148 Å²	148	134.3 Å²	134.3	69%	0.685	73%	0.727	S	S	*	*			trans	82.6	115.5	134.2	-72	-50.6	0	0	0	123.8
1150	L	25	Very low	26.6	Very low	134 Å²	134	132.4 Å²	132.4	70%	0.702	73%	0.729	S	S	*	*				36.6	136.6	112.8	-54.4	-176.2	0	0	0	119.7
1151	L	24.9	Very low	26.8	Very low	130 Å²	130	129.7 Å²	129.7	68%	0.681	72%	0.723	S	S	*	*			cis	-165.6	157.8	1	-101.6	171.1	0	0	0	112
1152	H	27	Very low	27	Very low	166 Å²	166	134.6 Å²	134.6	77%	0.769	73%	0.734	S	S	*	*			trans	40	135.2	150.4	-79.6	-53.3	0	0	0	124.8
1153	L	24.4	Very low	27.1	Very low	165 Å²	165	131.4 Å²	131.4	86%	0.864	73%	0.726	S	S	*	*				-178.5	173	117.4	-93.4	162.8	0	0	0	107
1154	S	25.9	Very low	27.2	Very low	100 Å²	100	132.8 Å²	132.8	70%	0.699	73%	0.731	S	S	*	*			cis	-170.8	155.8	-9.3	41	0	0	0	0	106.8
1155	S	27.3	Very low	27.3	Very low	99 Å²	99	131.5 Å²	131.5	69%	0.692	73%	0.73	S	S	*	*			cis	-170.8	-141.4	-8.4	46.7	0	0	0	0	107.9
1156	N	29.5	Very low	27.1	Very low	132 Å²	132	129.6 Å²	129.6	71%	0.706	72%	0.722	S	S	*	*			trans	83.6	136.7	160	-59.7	9.7	0	0	0	117.9
1157	L	30.2	Very low	27.1	Very low	143 Å²	143	133.9 Å²	133.9	75%	0.749	73%	0.73	S	S	*	*			cis	-149.7	175.9	-1.8	-110.8	163	0	0	0	112.5
1158	T	28.2	Very low	26.9	Very low	106 Å²	106	133 Å²	133	65%	0.65	73%	0.733	S	S	*	*			trans	-58.4	-179.8	-170.4	45.4	0	0	0	0	117.3
1159	E	27.9	Very low	27.4	Very low	183 Å²	183	129.3 Å²	129.3	86%	0.855	73%	0.734	S	S	*	*			cis	-159.6	-168.9	30.5	-149.8	141.4	-104.3	0	0	116.7
1160	A	27.4	Very low	27.2	Very low	91 Å²	91	130.6 Å²	130.6	75%	0.752	75%	0.745	S	S	*	*			trans	-92.8	-173.1	-161.6	0	0	0	0	0	115.2
1161	S	28.6	Very low	27.2	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	75%	0.748	S	S	*	*			cis	-170.6	167.4	25.6	67.8	0	0	0	0	115.7
1162	K	28.4	Very low	27.3	Very low	186 Å²	186	136.7 Å²	136.7	81%	0.809	75%	0.75	S	S	*	*			trans	58.5	118.4	155.7	-65.7	163.6	-178	174.7	0	119.4
1163	S	24.5	Very low	27.1	Very low	102 Å²	102	135 Å²	135	71%	0.713	75%	0.747	S	S	*	*			cis	80.6	137.9	48.3	78.3	0	0	0	0	114.5
1164	T	27	Very low	27.3	Very low	113 Å²	113	134.3 Å²	134.3	69%	0.693	75%	0.749	S	S	*	*			cis	-152.2	-177.7	29	56.9	0	0	0	0	114.7
1165	T	27.5	Very low	27.3	Very low	127 Å²	127	134.2 Å²	134.2	78%	0.779	75%	0.754	S	S	*	*			trans	62.8	147.4	153.3	43	0	0	0	0	120.8
1166	S	22.9	Very low	27.2	Very low	90 Å²	90	139 Å²	139	63%	0.629	76%	0.763	S	S	*	*			cis	-169.5	171.4	-22.8	50.2	0	0	0	0	110.7
1167	H	28.2	Very low	27	Very low	188 Å²	188	140.8 Å²	140.8	87%	0.87	76%	0.764	S	S	*	*			trans	76	154.7	171.1	-64.7	-77.2	0	0	0	121.2
1168	S	22.7	Very low	26.8	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	76%	0.759	S	S	*	*			trans	-161.3	177.5	176.5	67.3	0	0	0	0	107.3
1169	P	38.4	Very low	26.7	Very low	114 Å²	114	143.3 Å²	143.3	74%	0.74	76%	0.761	S	S	*	*			cis	-124.5	175.2	-29.9	38.9	-26.4	0	0	0	111.6
1170	L	26	Very low	26.6	Very low	175 Å²	175	141.1 Å²	141.1	92%	0.916	75%	0.754	S	S	*	*			trans	-165.4	-176.1	146	-112.6	168.4	0	0	0	112.7
1171	R	24.9	Very low	26.5	Very low	203 Å²	203	142.4 Å²	142.4	77%	0.766	76%	0.757	S	S	*	*			trans	-144.2	126.7	-155.1	-178.9	-165.4	-166.1	-171.4	7	112.6
1172	R	26.4	Very low	26.4	Very low	189 Å²	189	141.5 Å²	141.5	71%	0.713	75%	0.751	S	S	*	*			trans	164.1	139.9	133.2	-92.5	-178.1	-167	87.1	-8.3	114.7
1173	D	23.5	Very low	26.2	Very low	132 Å²	132	140 Å²	140	71%	0.706	75%	0.752	S	S	*	*			trans	41.8	125.2	131.3	-36.4	-21.7	0	0	0	121.4
1174	V	27.2	Very low	26.3	Very low	150 Å²	150	141.9 Å²	141.9	91%	0.909	75%	0.75	S	S	*	*				-173.7	124.2	115.8	146.8	0	0	0	0	110.9
1175	A	27	Very low	26.3	Very low	98 Å²	98	143.4 Å²	143.4	81%	0.81	75%	0.754	S	S	*	*			trans	-162.5	139.5	153.7	0	0	0	0	0	108.9
1176	K	25	Very low	26.2	Very low	200 Å²	200	140.4 Å²	140.4	87%	0.87	75%	0.748	S	S	*	*			trans	-165.1	149.6	-175.4	-148.1	171.1	-175	172.4	0	111.1
1177	K	25.9	Very low	26.4	Very low	169 Å²	169	143.9 Å²	143.9	74%	0.735	75%	0.754	S	S	*	*			trans	73.1	154	174.6	-58.2	-179.5	169.8	-176.8	0	114.9
1178	F	25.1	Very low	26.3	Very low	144 Å²	144	142.4 Å²	142.4	63%	0.632	75%	0.745	S	S	*	*			cis	-171.7	159.5	-14	-94.9	-19.7	0	0	0	105.8
1179	F	26.5	Very low	26.5	Very low	158 Å²	158	147.6 Å²	147.6	69%	0.693	75%	0.75	S	S	*	*			cis	-142.5	163.8	-5.1	-79.5	-59.2	0	0	0	106.5
1180	L	25.3	Very low	25.7	Very low	136 Å²	136	151.6 Å²	151.6	71%	0.712	76%	0.756	S	S	*	*			cis	87.1	101.9	17.5	-148.7	-176.9	0	0	0	116.3
1181	S	25	Very low	25.7	Very low	118 Å²	118	149 Å²	149	83%	0.825	75%	0.753	S	S	*	*			trans	-158	150.6	157.6	-83.3	0	0	0	0	113.1
1182	S	26.3	Very low	25.6	Very low	75 Å²	75	147.1 Å²	147.1	52%	0.524	76%	0.755	S	S	.	*			cis	-173.9	123.7	-31	-108.8	0	0	0	0	111
1183	N	24.2	Very low	25.4	Very low	155 Å²	155	145.9 Å²	145.9	83%	0.829	76%	0.762	S	S	*	*			trans	-177.3	111.4	144.8	-93.5	-18.3	0	0	0	106.2
1184	Q	27.5	Very low	25.4	Very low	141 Å²	141	149.5 Å²	149.5	66%	0.659	77%	0.768	S	S	*	*				59.6	124.4	55	-61.4	-155.9	44.8	0	0	112.8
1185	N	26.6	Very low	25.3	Very low	145 Å²	145	151.2 Å²	151.2	78%	0.775	77%	0.765	S	S	*	*			cis	-149.3	166.3	-8.8	-77.2	-45.5	0	0	0	106.7
1186	G	26.1	Very low	25.1	Very low	64 Å²	64	154.6 Å²	154.6	66%	0.66	77%	0.77	S	S	*	*			cis	162.9	148	-5.3	0	0	0	0	0	111.4
1187	Q	27.1	Very low	25.1	Very low	163 Å²	163	152.8 Å²	152.8	76%	0.762	77%	0.765	S	S	*	*			trans	70.3	115.5	169.3	-62	-164.3	51.9	0	0	121.3
1188	K	26.1	Very low	25	Very low	157 Å²	157	149.5 Å²	149.5	68%	0.683	76%	0.761	S	S	*	*				89.5	111.1	125.8	-74.9	176	180	156.1	0	122.4
1189	Y	26	Very low	24.9	Very low	214 Å²	214	153.7 Å²	153.7	84%	0.839	77%	0.772	S	S	*	*			trans	71.8	110.3	140.8	-64.2	-59.3	0	0	0	120.9
1190	F	22.4	Very low	24.8	Very low	197 Å²	197	155.5 Å²	155.5	86%	0.864	78%	0.78	S	S	*	*			trans	-58.9	136.9	148.8	-91.3	-102.4	0	0	0	111.6
1191	S	24.9	Very low	24.8	Very low	120 Å²	120	154.8 Å²	154.8	84%	0.839	78%	0.783	S	S	*	*			trans	-157.1	133.8	131.2	-80	0	0	0	0	107.9
1192	M	22.6	Very low	24.8	Very low	164 Å²	164	160 Å²	160	81%	0.808	79%	0.785	S	S	*	*			trans	-67.3	144.1	179.4	-66.1	-144.7	-59.7	0	0	111.1
1193	N	23.3	Very low	24.7	Very low	164 Å²	164	163.6 Å²	163.6	88%	0.877	80%	0.798	S	S	*	*			trans	-142.6	137.6	147.8	-103.4	-32.3	0	0	0	110.7
1194	Y	23.8	Very low	24.8	Very low	208 Å²	208	164 Å²	164	82%	0.816	80%	0.8	S	S	*	*			trans	-71.1	159.3	163.5	-102.7	-111.4	0	0	0	109.8
1195	Q	24.3	Very low	24.8	Very low	185 Å²	185	161.6 Å²	161.6	86%	0.864	80%	0.798	S	S	*	*			trans	64.9	95.5	168.7	-65.5	179.6	-31.5	0	0	116.4
1196	N	23.8	Very low	24.7	Very low	169 Å²	169	162 Å²	162	90%	0.904	80%	0.8	S	S	*	*			trans	-67.2	128.3	151.5	-70.7	-35.2	0	0	0	110
1197	E	23.5	Very low	24.8	Very low	162 Å²	162	168.6 Å²	168.6	76%	0.757	81%	0.814	S	S	*	*			trans	-151.1	114	143.4	-120.1	-61.9	108.4	0	0	106.5
1198	P	25.1	Very low	24.5	Very low	100 Å²	100	171.7 Å²	171.7	65%	0.649	82%	0.819	S	S	*	*			trans	-92	135.9	-165.8	33.7	-33.4	0	0	0	112.9
1199	R	22.4	Very low	24.6	Very low	232 Å²	232	171.3 Å²	171.3	88%	0.875	82%	0.824	S	S	*	*			trans	-154.9	149.1	156	-127.6	160	-99.8	-130.2	0.7	114.5
1200	F	24.7	Very low	24.6	Very low	197 Å²	197	169.6 Å²	169.6	86%	0.864	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-75.3	160.1	-173.3	-80.9	-104.7	0	0	0	113.1
1201	P	25.2	Very low	24.6	Very low	120 Å²	120	165.8 Å²	165.8	78%	0.779	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-66.9	148.4	176.5	29.2	-36.3	0	0	0	112.7
1202	R	26	Very low	24.6	Very low	229 Å²	229	163.5 Å²	163.5	86%	0.864	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-94.1	142.4	154.5	-68.5	-178.4	173.8	176.7	-2.6	106.8
1203	D	24.1	Very low	24.7	Very low	149 Å²	149	161.2 Å²	161.2	80%	0.797	81%	0.814	S	S	*	*				-145.7	143.5	61.7	-77	-39.8	0	0	0	114.1
1204	L	26.1	Very low	24.9	Very low	164 Å²	164	158.8 Å²	158.8	86%	0.859	81%	0.81	S	S	*	*			trans	-174.7	113.8	135	-102.7	164.3	0	0	0	110.8
1205	S	26	Very low	25	Very low	90 Å²	90	156 Å²	156	63%	0.629	81%	0.809	S	S	*	*			trans	31.2	111.4	151.4	58.8	0	0	0	0	121.3
1206	D	25.5	Very low	25.2	Very low	153 Å²	153	154.3 Å²	154.3	82%	0.818	81%	0.805	S	S	*	*				45	116	124.4	-56.3	-53.8	0	0	0	121.8
1207	Q	27	Very low	25.3	Very low	203 Å²	203	152.6 Å²	152.6	95%	0.949	80%	0.796	S	S	*	*				-154.7	164.6	109.9	-108.9	168.2	56.6	0	0	111.6
1208	R	22.4	Very low	25.4	Very low	229 Å²	229	151.7 Å²	151.7	86%	0.864	80%	0.796	S	S	*	*			trans	-146.7	160.8	-166.5	-168.2	-178.8	-172	-168.8	4.3	109.7
1209	L	27.7	Very low	25.4	Very low	149 Å²	149	152.5 Å²	152.5	78%	0.78	79%	0.794	S	S	*	*			trans	87.9	150.3	177.7	-53.1	167.1	0	0	0	114.6
1210	K	25.9	Very low	25.7	Very low	178 Å²	178	149.3 Å²	149.3	77%	0.774	79%	0.787	S	S	*	*			cis	-168.1	142	-38.3	-132.4	-173.2	-174.9	-175.1	0	110.1
1211	S	22.7	Very low	25.6	Very low	116 Å²	116	146.2 Å²	146.2	81%	0.811	78%	0.784	S	S	*	*			trans	47.9	125.2	150	56.1	0	0	0	0	122.6
1212	G	24.9	Very low	25.5	Very low	72 Å²	72	145.1 Å²	145.1	74%	0.742	78%	0.779	S	S	*	*			trans	136.8	148.4	147.5	0	0	0	0	0	116.8
1213	S	23.2	Very low	25.5	Very low	116 Å²	116	142.8 Å²	142.8	81%	0.811	78%	0.777	S	S	*	*				-179.1	110.1	-85	54.6	0	0	0	0	112.5
1214	S	28.4	Very low	25.5	Very low	114 Å²	114	141 Å²	141	80%	0.797	77%	0.772	S	S	*	*			trans	173.9	151.1	168.9	49.7	0	0	0	0	111.7
1215	N	26.1	Very low	25.5	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	77%	0.765	S	S	*	*			cis	-171.2	174.1	-31.3	-114.4	14.6	0	0	0	109.4
1216	L	29.2	Very low	25.7	Very low	150 Å²	150	140.2 Å²	140.2	79%	0.785	77%	0.766	S	S	*	*			trans	77.3	120.6	177.2	-51.4	168	0	0	0	114.3
1217	D	24.9	Very low	25.8	Very low	133 Å²	133	140 Å²	140	71%	0.711	76%	0.762	S	S	*	*			cis	85.3	137.4	43.6	-63.6	-41.6	0	0	0	112.7
1218	L	25.9	Very low	25.7	Very low	144 Å²	144	140.1 Å²	140.1	75%	0.754	75%	0.754	S	S	*	*			cis	-159.3	155	3.5	-125.7	164.4	0	0	0	112
1219	D	24.6	Very low	26	Very low	116 Å²	116	136.1 Å²	136.1	62%	0.62	75%	0.746	S	S	*	*			trans	82.5	135.5	146.5	-125.5	8.3	0	0	0	125.3
1220	K	28	Very low	25.8	Very low	166 Å²	166	133.8 Å²	133.8	72%	0.722	74%	0.742	S	S	*	*			trans	70.6	101.5	150.4	-77.6	164.3	-175.8	124.1	0	126.3
1221	V	23.2	Very low	25.6	Very low	132 Å²	132	130.6 Å²	130.6	80%	0.8	74%	0.742	S	S	*	*				59.1	115.5	119.6	179.6	0	0	0	0	121.6
1222	S	23.8	Very low	25.6	Very low	97 Å²	97	136 Å²	136	68%	0.678	74%	0.744	S	S	*	*				170.4	141.2	110.7	45.5	0	0	0	0	115
1223	H	24.7	Very low	25.5	Very low	180 Å²	180	140.7 Å²	140.7	83%	0.833	75%	0.745	S	S	*	*			trans	52.7	157.3	145.6	-69.1	-49.6	0	0	0	121.1
1224	T	24.4	Very low	25.4	Very low	110 Å²	110	140.8 Å²	140.8	68%	0.675	74%	0.74	S	S	*	*			cis	178.8	155	-4.1	-97.5	0	0	0	0	105.3
1225	I	25.9	Very low	25	Very low	141 Å²	141	140.2 Å²	140.2	72%	0.723	74%	0.736	S	S	*	*			cis	-176.4	-175.4	-17.1	-154.4	151.8	0	0	0	104.3
1226	P	30.7	Very low	25	Very low	98 Å²	98	139.4 Å²	139.4	64%	0.636	74%	0.742	S	S	*	*			cis	-99.2	-140.4	-20.9	19.8	5.5	0	0	0	110.1
1227	I	27.2	Very low	24.6	Very low	147 Å²	147	136.4 Å²	136.4	75%	0.754	74%	0.739	S	S	*	*			cis	-141.2	118	7.9	-61.7	174	0	0	0	105.3
1228	R	26.2	Very low	24.5	Very low	206 Å²	206	136.2 Å²	136.2	78%	0.777	74%	0.743	S	S	*	*				69.2	138.9	73.3	-72.6	-162.4	167.5	-168.6	-4.1	115.7
1229	Q	27.6	Very low	24.6	Very low	146 Å²	146	136.5 Å²	136.5	68%	0.682	74%	0.743	S	S	*	*			cis	-175.1	176.5	-19.3	-111.2	179	-35.8	0	0	106.4
1230	S	25	Very low	24.6	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	75%	0.746	S	S	*	*				-177.4	150.2	-60.4	60.5	0	0	0	0	109.4
1231	S	20.5	Very low	24.5	Very low	111 Å²	111	135.7 Å²	135.7	78%	0.776	75%	0.747	S	S	*	*			trans	-150.5	142.4	156.7	61.8	0	0	0	0	110.8
1232	R	22.8	Very low	24.7	Very low	228 Å²	228	135.3 Å²	135.3	86%	0.86	74%	0.74	S	S	*	*			trans	169.8	140.8	153.8	-98.8	173.9	-176.5	-174.2	2	113.8
1233	F	23.8	Very low	25	Very low	172 Å²	172	137.2 Å²	137.2	75%	0.754	74%	0.743	S	S	*	*			trans	43.1	122.6	146.6	-60.5	-58.3	0	0	0	123.5
1234	T	20.6	Very low	25.2	Very low	117 Å²	117	135.5 Å²	135.5	72%	0.718	74%	0.74	S	S	*	*				3.7	154.6	116.8	51.3	0	0	0	0	119.8
1235	S	20.4	Very low	25.3	Very low	102 Å²	102	135.1 Å²	135.1	71%	0.713	74%	0.741	S	S	*	*			cis	177.1	140.5	-18.7	52.5	0	0	0	0	109.4
1236	S	24.5	Very low	25.2	Very low	131 Å²	131	135 Å²	135	92%	0.916	74%	0.741	S	S	*	*			trans	-174.9	163.5	157.7	-84.2	0	0	0	0	111.1
1237	A	22.2	Very low	25.1	Very low	87 Å²	87	137.1 Å²	137.1	72%	0.719	75%	0.746	S	S	*	*			trans	-152.6	-178.4	-172.5	0	0	0	0	0	113.3
1238	V	23.2	Very low	24.9	Very low	130 Å²	130	136.1 Å²	136.1	79%	0.788	74%	0.742	S	S	*	*			trans	69.9	137.7	171.8	-131.7	0	0	0	0	112.5
1239	I	27.4	Very low	24.8	Very low	149 Å²	149	134.3 Å²	134.3	76%	0.764	74%	0.743	S	S	*	*			cis	-152.8	127.5	47.3	-73.3	172.6	0	0	0	113.8
1240	N	24.1	Very low	24.7	Very low	125 Å²	125	136 Å²	136	67%	0.668	75%	0.751	S	S	*	*			trans	47.3	163.9	138.2	-52.8	7.6	0	0	0	125.8
1241	N	27.2	Very low	24.8	Very low	140 Å²	140	137.4 Å²	137.4	75%	0.749	75%	0.75	S	S	*	*			trans	84.2	130.7	163.2	-60.8	1.3	0	0	0	116.1
1242	N	26	Very low	25.2	Very low	124 Å²	124	139.9 Å²	139.9	66%	0.663	75%	0.749	S	S	*	*			cis	-164.6	178	-11.6	-132.7	42.4	0	0	0	110.4
1243	D	30.8	Very low	25.2	Very low	138 Å²	138	132.8 Å²	132.8	74%	0.738	73%	0.734	S	S	*	*			trans	68.3	141	161.6	-46.3	-20.5	0	0	0	117.9
1244	D	29.2	Very low	25.3	Very low	143 Å²	143	132.7 Å²	132.7	77%	0.765	74%	0.736	S	S	*	*			cis	-158.9	175.4	-27.3	-148.2	-14.3	0	0	0	111.8
1245	C	26	Very low	25.4	Very low	103 Å²	103	132.1 Å²	132.1	70%	0.696	74%	0.737	S	S	*	*			trans	-12.9	161.3	160.6	-74.5	0	0	0	0	121.9
1246	N	23.5	Very low	25.6	Very low	137 Å²	137	132.1 Å²	132.1	73%	0.733	74%	0.736	S	S	*	*			cis	179.5	-176.9	-14.1	-171.8	1.7	0	0	0	108.6
1247	I	28	Very low	25.5	Very low	143 Å²	143	133.1 Å²	133.1	73%	0.733	73%	0.731	S	S	*	*			trans	85.9	88.5	160.3	-47.9	175.2	0	0	0	119.3
1248	N	23.8	Very low	25.5	Very low	126 Å²	126	134 Å²	134	67%	0.674	73%	0.733	S	S	*	*				28.1	123.2	122	-76	-20.3	0	0	0	124.4
1249	Q	23.5	Very low	25.6	Very low	169 Å²	169	134.1 Å²	134.1	79%	0.79	73%	0.734	S	S	*	*				80.1	166.7	121	-65.4	-178.8	12.6	0	0	122.5
1250	Q	26.1	Very low	25.4	Very low	182 Å²	182	134.8 Å²	134.8	85%	0.85	74%	0.738	S	S	*	*			trans	78.2	120.4	-176.1	-52.8	-170	-34.1	0	0	115.3
1251	D	27.2	Very low	25.4	Very low	128 Å²	128	134 Å²	134	68%	0.684	74%	0.742	S	S	*	*			cis	-150.4	-161.5	-8.5	-131	-122	0	0	0	107.9
1252	H	28.3	Very low	25.2	Very low	163 Å²	163	132 Å²	132	76%	0.755	74%	0.74	S	S	*	*			cis	-154.1	-160.8	19.3	-157.6	34.2	0	0	0	113.4
1253	C	24.5	Very low	25.1	Very low	80 Å²	80	132 Å²	132	54%	0.541	75%	0.749	S	S	.	*			trans	-69.1	137.7	-164.9	-75.4	0	0	0	0	121
1254	Q	24.4	Very low	24.9	Very low	169 Å²	169	130.2 Å²	130.2	79%	0.79	75%	0.748	S	S	*	*				67.6	108.1	124.2	-62.1	-176.5	-8.9	0	0	123.9
1255	S	22.8	Very low	24.8	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	75%	0.745	S	S	*	*				88.6	144.7	116.6	74.4	0	0	0	0	124.5
1256	S	24.7	Very low	24.6	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	75%	0.751	S	S	*	*			trans	70.5	100	151.8	42.8	0	0	0	0	123.1
1257	N	22.6	Very low	24.7	Very low	152 Å²	152	128.5 Å²	128.5	81%	0.813	76%	0.759	S	S	*	*				55.1	126.5	116.8	-64.7	-1.2	0	0	0	124.2
1258	S	22	Very low	24.5	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	76%	0.759	S	S	*	*			trans	72.4	113.2	132	66.3	0	0	0	0	122.5
1259	T	25.5	Very low	24.4	Very low	132 Å²	132	129.4 Å²	129.4	81%	0.81	77%	0.772	S	S	*	*				172.2	118	125.9	35	0	0	0	0	107.2
1260	L	22.4	Very low	24.5	Very low	162 Å²	162	126.7 Å²	126.7	85%	0.848	77%	0.767	S	S	*	*				96.2	143.1	65.2	-100	169.2	0	0	0	113.8
1261	S	25.7	Very low	24.4	Very low	109 Å²	109	123.3 Å²	123.3	76%	0.762	76%	0.764	S	S	*	*			trans	72	146.8	-177.2	79.3	0	0	0	0	117.6
1262	S	23.3	Very low	24.2	Very low	99 Å²	99	124.3 Å²	124.3	69%	0.692	77%	0.768	S	S	*	*			cis	-171	146.4	-27.2	49.9	0	0	0	0	111.9
1263	S	23.3	Very low	23.8	Very low	123 Å²	123	125.6 Å²	125.6	86%	0.86	77%	0.772	S	S	*	*			trans	67	154.3	171.2	78.3	0	0	0	0	116.6
1264	S	26.8	Very low	23.8	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	78%	0.782	S	S	*	*			cis	-142.6	161.1	15.4	56.5	0	0	0	0	114.9
1265	S	26.5	Very low	23.7	Very low	101 Å²	101	126.5 Å²	126.5	71%	0.706	78%	0.777	S	S	*	*			trans	25	115.9	161.3	55.6	0	0	0	0	120.5
1266	S	22.5	Very low	23.7	Very low	117 Å²	117	129.8 Å²	129.8	82%	0.818	78%	0.782	S	S	*	*			cis	82.7	98.1	46.3	81.6	0	0	0	0	116.6
1267	S	25	Very low	23.7	Very low	129 Å²	129	132.3 Å²	132.3	90%	0.902	78%	0.78	S	S	*	*			trans	-144.7	116.1	149.2	53.6	0	0	0	0	109.6
1268	S	23.6	Very low	23.9	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	77%	0.769	S	S	*	*			trans	-106.9	113.2	-166.9	53.1	0	0	0	0	112.9	T1270	S1268-T1270 PolarHBondContact O-N 2.79Å
1269	L	22.6	Very low	24.1	Very low	181 Å²	181	127.4 Å²	127.4	95%	0.948	75%	0.752	S	S	*	*			trans	-79.7	92.7	167.4	-92.1	157.9	0	0	0	109.8	S1271	L1269-S1271 PolarHBondContact O-N 2.85Å; L1269-S1271 VanDerWaalsContact O-N 3.09Å
1270	T	25.5	Very low	24.3	Very low	113 Å²	113	125 Å²	125	69%	0.693	74%	0.737	S	S	*	*			trans	-73.4	97.2	177.8	48.8	0	0	0	0	111	S1268 L1272	S1268-T1270 PolarHBondContact O-N 2.79Å; T1270-L1272 PolarHBondContact O-N 3.36Å
1271	S	22.5	Very low	24.6	Very low	110 Å²	110	122.9 Å²	122.9	77%	0.769	73%	0.727	S	S	*	*			trans	-69.5	95.5	167.5	-175.5	0	0	0	0	109.8	L1269 K1273	L1269-S1271 PolarHBondContact O-N 2.85Å; L1269-S1271 VanDerWaalsContact O-N 3.09Å; S1271-K1273 PolarHBondContact O-N 3.47Å
1272	L	23.2	Very low	24.7	Very low	150 Å²	150	124.5 Å²	124.5	79%	0.785	72%	0.717	S	S	*	*			trans	-72	94.4	173.3	-84.6	167.3	0	0	0	110.2	T1270 T1274	T1270-L1272 PolarHBondContact O-N 3.36Å; L1272-T1274 PolarHBondContact O-N 3.26Å; L1272-T1274 VanDerWaalsContact O-N 3.1Å
1273	K	21.4	Very low	25.1	Very low	190 Å²	190	123.8 Å²	123.8	83%	0.826	71%	0.71	S	S	*	*			trans	-72.2	90	162.6	-73.5	-175	175	-176	0	109.5	S1271 E1275	S1271-K1273 PolarHBondContact O-N 3.47Å; K1273-E1275 PolarHBondContact O-N 2.76Å
1274	T	23.5	Very low	25.5	Very low	122 Å²	122	120.1 Å²	120.1	75%	0.748	69%	0.685	S	S	*	*			trans	-76.3	106	171.8	-50.7	0	0	0	0	109.8	L1272 M1276	L1272-T1274 PolarHBondContact O-N 3.26Å; L1272-T1274 VanDerWaalsContact O-N 3.1Å; T1274-M1276 PolarHBondContact O-N 2.85Å; T1274-M1276 VanDerWaalsContact O-N 3.12Å
1275	E	22.8	Very low	26	Very low	146 Å²	146	119.8 Å²	119.8	68%	0.682	67%	0.674	S	S	*	*			trans	-64.6	108.6	169.9	-70.4	-169.7	153.8	0	0	110.4	K1273 K1277	K1273-E1275 PolarHBondContact O-N 2.76Å; E1275-K1277 VanDerWaalsContact C-N 3.29Å; E1275-K1277 PolarHBondContact O-N 3.18Å; E1275-K1277 VanDerWaalsContact OE2-CE 3.26Å; E1275-K1277 WeakPolarHBondContact OE2-CE 3.48Å; E1275-K1277 IonicContact OE2-NZ 3.7Å
1276	M	22.6	Very low	26.7	Very low	175 Å²	175	117.9 Å²	117.9	86%	0.862	66%	0.658	S	S	*	*			trans	-69.7	87.6	166	-99.1	-168.9	149	0	0	110.2	T1274 V1278	T1274-M1276 PolarHBondContact O-N 2.85Å; T1274-M1276 VanDerWaalsContact O-N 3.12Å; M1276-V1278 PolarHBondContact O-N 3.44Å
1277	K	24.5	Very low	27.8	Very low	153 Å²	153	117.2 Å²	117.2	67%	0.665	64%	0.644	S	S	*	*			trans	-71.5	81.3	165.6	-76.1	179.7	177.8	166.9	0	110.1	E1275	E1275-K1277 VanDerWaalsContact C-N 3.29Å; E1275-K1277 PolarHBondContact O-N 3.18Å; E1275-K1277 VanDerWaalsContact OE2-CE 3.26Å; E1275-K1277 WeakPolarHBondContact OE2-CE 3.48Å; E1275-K1277 IonicContact OE2-NZ 3.7Å
1278	V	27.1	Very low	28.7	Very low	94 Å²	94	113.6 Å²	113.6	57%	0.57	62%	0.618	S	S	*	*			trans	-63.1	133.3	169.6	179.7	0	0	0	0	109.2	M1276 V1280	M1276-V1278 PolarHBondContact O-N 3.44Å; V1278-V1280 HydrophobicContact CB-CG2 4.5Å; V1278-V1280 HydrophobicContact CG1-CG2 4.39Å; V1278-V1280 PolarHBondContact O-N 3.48Å
1279	P	26.4	Very low	29.6	Very low	62 Å²	62	114.6 Å²	114.6	40%	0.403	61%	0.609	S	S	.	*			trans	-76.8	87.9	176.6	31.7	-35.6	0	0	0	111.5	P407 N1281	P407-P1279 VanDerWaalsContact CD-CB 3.44Å; P407-P1279 HydrophobicContact CG-CB 3.7Å; P407-P1279 HydrophobicContact CG-CG 4.45Å; P1279-N1281 PolarHBondContact O-N 2.86Å
1280	V	30	Very low	31	Very low	81 Å²	81	109.5 Å²	109.5	49%	0.491	59%	0.585	S	S	.	*			trans	-77.2	87.9	-176.8	-172.1	0	0	0	0	111.6	L1005 V1278	L1005-V1280 HydrophobicContact CD2-CG1 4.19Å; V1278-V1280 HydrophobicContact CB-CG2 4.5Å; V1278-V1280 HydrophobicContact CG1-CG2 4.39Å; V1278-V1280 PolarHBondContact O-N 3.48Å
1281	N	27	Very low	31.7	Very low	118 Å²	118	110.9 Å²	110.9	63%	0.631	58%	0.584	S	S	*	*			trans	-121.5	11.5	173.6	-106.3	-7.6	0	0	0	114.3	P1279	P1279-N1281 PolarHBondContact O-N 2.86Å
1282	Y	28.5	Very low	32.2	Very low	143 Å²	143	109.5 Å²	109.5	56%	0.561	57%	0.574	S	S	*	*	S	Bend	trans	-134.8	157.1	175	-67.6	-74.6	0	0	0	109.9	N462 S1284	N462-Y1282 PolarHBondContact ND2-OH 3.13Å; Y1282-S1284 PolarHBondContact O-N 2.89Å; Y1282-S1284 PolarHBondContact O-OG 3.3Å
1283	P	31.3	Very low	32.7	Very low	84 Å²	84	107.8 Å²	107.8	55%	0.545	57%	0.566	S	S	.	*			trans	-68.5	90.3	175.5	28.3	-34.6	0	0	0	110.6	I1285	P1283-I1285 PolarHBondContact O-N 3.35Å
1284	S	32.4	Very low	32.9	Very low	46 Å²	46	103.2 Å²	103.2	32%	0.322	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-72.6	118	-179.7	-58.2	0	0	0	0	111.4	L1005 Y1282	L1005-S1284 VanDerWaalsContact CB-O 3.23Å; L1005-S1284 WeakPolarHBondContact CB-O 3.44Å; L1005-S1284 PolarHBondContact N-O 3.13Å; Y1282-S1284 PolarHBondContact O-N 2.89Å; Y1282-S1284 PolarHBondContact O-OG 3.3Å
1285	I	38.3	Very low	33	Very low	94 Å²	94	105.3 Å²	105.3	48%	0.482	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77	122.8	159.9	-80.8	166.5	0	0	0	107.8	V1002 P1283 I1287	V1002-I1285 HydrophobicContact CB-CG2 4.32Å; V1002-I1285 HydrophobicContact CG1-CD1 4.44Å; V1002-I1285 HydrophobicContact CG1-CG1 4.21Å; V1002-I1285 HydrophobicContact CG1-CG2 3.64Å; V1002-I1285 HydrophobicContact CG2-CG2 3.92Å; P1283-I1285 PolarHBondContact O-N 3.35Å; I1285-I1287 HydrophobicContact CG2-CD1 4.47Å; I1285-I1287 HydrophobicContact CG2-CG1 3.77Å
1286	V	41.2	Very low	33.1	Very low	62 Å²	62	107.6 Å²	107.6	38%	0.376	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.4	123.9	169.1	-176	0	0	0	0	108	V1002 Q1003 L1005	V1002-V1286 WeakPolarHBondContact CA-O 3.32Å; Q1003-V1286 PolarHBondContact N-O 3.45Å; Q1003-V1286 VanDerWaalsContact N-O 3.11Å; Q1003-V1286 PolarHBondContact O-N 3.47Å; L1005-V1286 HydrophobicContact CD1-CG2 4.18Å
1287	I	45.2	Very low	33.2	Very low	103 Å²	103	107.4 Å²	107.4	53%	0.528	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103	97.6	176.9	-51.6	-175.6	0	0	0	108.2	L1000 V1002 I1285	L1000-I1287 HydrophobicContact CB-CG2 3.83Å; L1000-I1287 HydrophobicContact CD1-CG2 4.08Å; L1000-I1287 HydrophobicContact CD2-CG2 4.04Å; L1000-I1287 HydrophobicContact CG-CG2 4.2Å; V1002-I1287 HydrophobicContact CG2-CG1 4.29Å; I1285-I1287 HydrophobicContact CG2-CD1 4.47Å; I1285-I1287 HydrophobicContact CG2-CG1 3.77Å
1288	C	42.6	Very low	33.3	Very low	53 Å²	53	107.5 Å²	107.5	36%	0.358	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.8	117.9	176.7	-68.3	0	0	0	0	110.2	I1001	I1001-C1288 HydrophobicContact CB-CB 4.5Å; I1001-C1288 PolarHBondContact N-O 2.86Å; I1001-C1288 PolarHBondContact O-N 3.22Å
1289	K	43.7	Very low	33.1	Very low	126 Å²	126	110.4 Å²	110.4	55%	0.548	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74	125.7	164.1	175	170.7	-180	151.8	0	109.1	E998 L1000 Q1291	E998-K1289 HydrophobicContact CG-CG 4.48Å; E998-K1289 WeakPolarHBondContact OE1-CD 3.48Å; E998-K1289 WeakPolarHBondContact OE1-CE 3.07Å; E998-K1289 IonicContact OE1-NZ 3.7Å; E998-K1289 PolarHBondContact OE1-NZ 3.49Å; L1000-K1289 HydrophobicContact CD2-CB 4.19Å; K1289-Q1291 PolarHBondContact O-N 2.81Å
1290	V	50.6	Low	33.2	Very low	74 Å²	74	112.7 Å²	112.7	45%	0.448	61%	0.612	S	S	.	*			trans	-74.3	110.4	170.9	-175.2	0	0	0	0	108.5	V999 I1001	V999-V1290 HydrophobicContact CG1-CG2 4.5Å; V999-V1290 PolarHBondContact O-N 3.43Å; I1001-V1290 HydrophobicContact CD1-CG2 3.72Å; I1001-V1290 HydrophobicContact CG1-CG2 3.98Å
1291	Q	40.1	Very low	32.9	Very low	142 Å²	142	116.2 Å²	116.2	66%	0.664	63%	0.628	S	S	*	*			trans	-74.8	129.7	170.8	-80.4	-177.5	-110.2	0	0	110.3	K1289 D1293	K1289-Q1291 PolarHBondContact O-N 2.81Å; Q1291-D1293 VanDerWaalsContact C-N 3.31Å; Q1291-D1293 PolarHBondContact O-N 3.44Å
1292	S	34.8	Very low	33.1	Very low	81 Å²	81	118.4 Å²	118.4	57%	0.566	64%	0.64	S	S	*	*			trans	-91.1	61.3	-177.4	55.8	0	0	0	0	110.8	S1294	S1292-S1294 PolarHBondContact O-N 3.23Å
1293	D	31.9	Very low	32.9	Very low	114 Å²	114	118.7 Å²	118.7	61%	0.61	65%	0.651	S	S	*	*			trans	-65.2	121.5	-177.6	-63.1	-19.3	0	0	0	110.3	Q1291 R1314	Q1291-D1293 VanDerWaalsContact C-N 3.31Å; Q1291-D1293 PolarHBondContact O-N 3.44Å; D1293-R1314 PolarHBondContact O-NH1 2.65Å
1294	S	26.5	Very low	32.6	Very low	94 Å²	94	122.1 Å²	122.1	66%	0.657	67%	0.665	S	S	*	*			trans	-158.1	78.2	174.7	60.8	0	0	0	0	108.5	S1292	S1292-S1294 PolarHBondContact O-N 3.23Å
1295	D	24.9	Very low	32.4	Very low	166 Å²	166	131.1 Å²	131.1	89%	0.888	69%	0.692	S	S	*	*	S	Bend	trans	174	53.2	153.2	-87.8	-19.2	0	0	0	112.1
1296	E	25	Very low	31.7	Very low	195 Å²	195	138.1 Å²	138.1	91%	0.911	71%	0.714	S	S	*	*			trans	-160.5	93.2	165.8	-127.4	172.2	-133.4	0	0	113.6
1297	I	25.1	Very low	30.9	Very low	170 Å²	170	142.3 Å²	142.3	87%	0.872	73%	0.733	S	S	*	*			trans	-146.9	90	167.4	-51.5	179	0	0	0	111.2
1298	I	26.6	Very low	29.9	Very low	155 Å²	155	146 Å²	146	80%	0.795	75%	0.753	S	S	*	*			trans	-146.5	127	151.4	-60.4	-173.9	0	0	0	108.1
1299	N	24	Very low	29.1	Very low	155 Å²	155	148.2 Å²	148.2	83%	0.829	77%	0.77	S	S	*	*			trans	16.9	141.8	157.5	-53.7	-14.3	0	0	0	120.2
1300	S	26.5	Very low	28.4	Very low	111 Å²	111	147.9 Å²	147.9	78%	0.776	78%	0.778	S	S	*	*			cis	-157.3	164.9	25.1	54	0	0	0	0	113.9
1301	N	24.8	Very low	27.2	Very low	155 Å²	155	148.1 Å²	148.1	83%	0.829	80%	0.796	S	S	*	*			trans	-13.8	125.5	164.9	-58.6	-6.9	0	0	0	117.5
1302	D	30.3	Very low	26.7	Very low	164 Å²	164	147.3 Å²	147.3	88%	0.877	80%	0.795	S	S	*	*			trans	-152.6	129.2	133.5	-133.3	-18.8	0	0	0	111.5
1303	N	25.8	Very low	26.3	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	80%	0.801	S	S	*	*			trans	-92.8	103.9	-174.7	-81.6	-34.6	0	0	0	110.6
1304	N	24.8	Very low	26.4	Very low	156 Å²	156	150.7 Å²	150.7	83%	0.834	79%	0.793	S	S	*	*			trans	167.5	79.7	142.8	-89.6	-40.3	0	0	0	113.1
1305	R	26.8	Very low	26.6	Very low	235 Å²	235	149.5 Å²	149.5	89%	0.887	79%	0.785	S	S	*	*			trans	-140.9	123.5	159.2	-70.6	-169.1	178.5	162.2	4	111.3	L1307	R1305-L1307 PolarHBondContact O-N 3.4Å; R1305-L1307 VanDerWaalsContact O-N 3.17Å
1306	Y	23.8	Very low	27	Very low	241 Å²	241	145.6 Å²	145.6	95%	0.945	77%	0.771	S	S	*	*			trans	-63.4	111.8	170.5	-72.6	-94.1	0	0	0	109.9
1307	L	25.8	Very low	27.3	Very low	149 Å²	149	140 Å²	140	78%	0.78	75%	0.749	S	S	*	*			trans	-99	133.5	169.5	-80.1	165.9	0	0	0	109.5	R1305 S1309	R1305-L1307 PolarHBondContact O-N 3.4Å; R1305-L1307 VanDerWaalsContact O-N 3.17Å; L1307-S1309 PolarHBondContact O-N 2.78Å
1308	L	24	Very low	27.5	Very low	181 Å²	181	137 Å²	137	95%	0.948	73%	0.732	S	S	*	*			trans	-76.1	76.3	158.6	-85.9	164.3	0	0	0	108.2	T1310	L1308-T1310 PolarHBondContact O-N 2.9Å; L1308-T1310 VanDerWaalsContact O-N 3.1Å
1309	S	24.5	Very low	27.7	Very low	100 Å²	100	135.8 Å²	135.8	70%	0.699	72%	0.722	S	S	*	*			trans	-76.7	92.5	178.9	58.1	0	0	0	0	110.9	L1307 G1311	L1307-S1309 PolarHBondContact O-N 2.78Å; S1309-G1311 PolarHBondContact O-N 3.31Å; S1309-G1311 VanDerWaalsContact O-N 3.08Å
1310	T	30.7	Very low	28.1	Very low	119 Å²	119	131 Å²	131	73%	0.73	70%	0.701	S	S	*	*			trans	-65.4	103.7	157.5	38.5	0	0	0	0	108	L1308 L1312	L1308-T1310 PolarHBondContact O-N 2.9Å; L1308-T1310 VanDerWaalsContact O-N 3.1Å; T1310-L1312 PolarHBondContact O-N 2.78Å
1311	G	25.2	Very low	28.2	Very low	79 Å²	79	132.1 Å²	132.1	81%	0.814	70%	0.698	S	S	*	*			trans	-72.8	55.4	-165.9	0	0	0	0	0	116.1	S1309	S1309-G1311 PolarHBondContact O-N 3.31Å; S1309-G1311 VanDerWaalsContact O-N 3.08Å
1312	L	29.5	Very low	28.3	Very low	125 Å²	125	130.4 Å²	130.4	65%	0.654	69%	0.688	S	S	*	*			trans	-100.7	92.3	173.8	-86.3	160.9	0	0	0	110.2	T1310 R1314	T1310-L1312 PolarHBondContact O-N 2.78Å; L1312-R1314 PolarHBondContact O-N 3.14Å
1313	Q	27	Very low	28.1	Very low	149 Å²	149	127.8 Å²	127.8	70%	0.696	67%	0.674	S	S	*	*			trans	-65.1	128.8	169.4	-70.2	-164.8	-5.1	0	0	110.3	S1315 S1316	Q1313-S1315 VanDerWaalsContact CB-OG 3.24Å; Q1313-S1315 WeakPolarHBondContact CB-OG 3.31Å; Q1313-S1315 PolarHBondContact O-N 3.44Å; Q1313-S1315 VanDerWaalsContact O-N 3.08Å; Q1313-S1315 PolarHBondContact OE1-OG 3Å; Q1313-S1316 PolarHBondContact O-N 3.37Å
1314	R	33	Very low	28.2	Very low	117 Å²	117	128 Å²	128	44%	0.442	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.4	-20.6	-179.5	-162.3	166.3	173	-167.1	-7.9	113.4	D1293 L1312 S1316 V1317 H1318	D1293-R1314 PolarHBondContact O-NH1 2.65Å; L1312-R1314 PolarHBondContact O-N 3.14Å; R1314-S1316 VanDerWaalsContact C-N 3.29Å; R1314-S1316 PolarHBondContact O-N 2.9Å; R1314-V1317 PolarHBondContact O-N 3.03Å; R1314-H1318 PolarHBondContact O-N 2.67Å; R1314-H1318 VanDerWaalsContact O-N 3.12Å
1315	S	31.6	Very low	28.2	Very low	68 Å²	68	128.6 Å²	128.6	48%	0.476	67%	0.671	S	S	.	*	H	α-helix	trans	-53.8	-40.6	169.7	49.1	0	0	0	0	112.9	Q1313 V1317	Q1313-S1315 VanDerWaalsContact CB-OG 3.24Å; Q1313-S1315 WeakPolarHBondContact CB-OG 3.31Å; Q1313-S1315 PolarHBondContact O-N 3.44Å; Q1313-S1315 VanDerWaalsContact O-N 3.08Å; Q1313-S1315 PolarHBondContact OE1-OG 3Å; S1315-V1317 VanDerWaalsContact C-N 3.33Å; S1315-V1317 PolarHBondContact O-N 3.05Å
1316	S	32.6	Very low	28.2	Very low	85 Å²	85	128.3 Å²	128.3	59%	0.594	67%	0.67	S	S	*	*	H	α-helix	trans	-76.3	-16	-177.7	-169.4	0	0	0	0	114.3	Q1313 R1314	Q1313-S1316 PolarHBondContact O-N 3.37Å; R1314-S1316 VanDerWaalsContact C-N 3.29Å; R1314-S1316 PolarHBondContact O-N 2.9Å
1317	V	31.2	Very low	28.4	Very low	76 Å²	76	121.5 Å²	121.5	46%	0.461	66%	0.658	S	S	.	*	H	α-helix	trans	-104.5	-36.7	-175.4	-175.5	0	0	0	0	111.5	R1314 S1315 L1321	R1314-V1317 PolarHBondContact O-N 3.03Å; S1315-V1317 VanDerWaalsContact C-N 3.33Å; S1315-V1317 PolarHBondContact O-N 3.05Å; V1317-L1321 HydrophobicContact CG1-CD1 4.4Å
1318	H	29.8	Very low	28.6	Very low	108 Å²	108	122.2 Å²	122.2	50%	0.5	66%	0.662	S	S	.	*	H	α-helix	trans	-75.3	-32.3	178.9	-111.1	-89.2	0	0	0	113.6	R1314	R1314-H1318 PolarHBondContact O-N 2.67Å; R1314-H1318 VanDerWaalsContact O-N 3.12Å
1319	H	30.2	Very low	28.9	Very low	129 Å²	129	117.6 Å²	117.6	60%	0.597	65%	0.645	S	S	*	*	H	α-helix	trans	-72.9	-34.9	-177.4	-124.2	-59.6	0	0	0	113	L1321	H1319-L1321 VanDerWaalsContact C-N 3.26Å; H1319-L1321 PolarHBondContact O-N 3.11Å
1320	S	31.4	Very low	29.2	Very low	56 Å²	56	118.5 Å²	118.5	39%	0.392	65%	0.651	S	S	.	*	H	α-helix	trans	-79.6	0.5	179.6	-53.1	0	0	0	0	114.6
1321	L	29.9	Very low	29.2	Very low	133 Å²	133	121.8 Å²	121.8	70%	0.696	66%	0.658	S	S	*	*	H	α-helix	trans	-118.6	-7.7	-177.1	-82.8	171.1	0	0	0	115.2	V1317 H1319	V1317-L1321 HydrophobicContact CG1-CD1 4.4Å; H1319-L1321 VanDerWaalsContact C-N 3.26Å; H1319-L1321 PolarHBondContact O-N 3.11Å
1322	L	26.2	Very low	29.4	Very low	119 Å²	119	125.3 Å²	125.3	62%	0.623	66%	0.659	S	S	*	*	H	α-helix	trans	-132.2	-3.9	-172.1	-78	172.3	0	0	0	116.9	I1324	L1322-I1324 VanDerWaalsContact C-N 3.31Å; L1322-I1324 PolarHBondContact O-N 3.42Å
1323	N	26.4	Very low	29.4	Very low	109 Å²	109	126.4 Å²	126.4	58%	0.583	66%	0.661	S	S	*	*			trans	-80.5	75.3	171.6	-86	26.2	0	0	0	111.8	E1325	N1323-E1325 VanDerWaalsContact C-N 3.32Å; N1323-E1325 PolarHBondContact O-N 3.39Å
1324	I	28.4	Very low	29.5	Very low	154 Å²	154	127.3 Å²	127.3	79%	0.79	67%	0.668	S	S	*	*			trans	-85	77	165.8	-52.2	179	0	0	0	108.7	L1322	L1322-I1324 VanDerWaalsContact C-N 3.31Å; L1322-I1324 PolarHBondContact O-N 3.42Å
1325	E	25.4	Very low	29.1	Very low	169 Å²	169	126.8 Å²	126.8	79%	0.79	68%	0.678	S	S	*	*			trans	-75.1	123.6	167.7	-68.6	-168.9	155.8	0	0	109.8	N1323 S1327	N1323-E1325 VanDerWaalsContact C-N 3.32Å; N1323-E1325 PolarHBondContact O-N 3.39Å; E1325-S1327 PolarHBondContact O-N 3.47Å
1326	R	25.8	Very low	28.9	Very low	229 Å²	229	130.3 Å²	130.3	86%	0.864	69%	0.69	S	S	*	*			trans	-76.7	108.7	168	-85.1	-178.3	165.8	147.8	-5.1	108.9
1327	S	28.1	Very low	28.4	Very low	98 Å²	98	135 Å²	135	69%	0.685	70%	0.7	S	S	*	*			trans	-78.6	115.4	163.4	55.1	0	0	0	0	109.7	E1325 S1329	E1325-S1327 PolarHBondContact O-N 3.47Å; S1327-S1329 PolarHBondContact O-N 2.8Å
1328	D	29.2	Very low	28.3	Very low	164 Å²	164	139.6 Å²	139.6	88%	0.877	72%	0.721	S	S	*	*	S	Bend	trans	-74.2	61.4	-179.4	-72.6	-34.3	0	0	0	113
1329	S	30.4	Very low	28.2	Very low	84 Å²	84	141.2 Å²	141.2	59%	0.587	73%	0.732	S	S	*	*	S	Bend	trans	-157.5	130.3	169.4	63.5	0	0	0	0	112.2	S1327	S1327-S1329 PolarHBondContact O-N 2.8Å
1330	S	30.9	Very low	28.1	Very low	118 Å²	118	141.8 Å²	141.8	83%	0.825	74%	0.739	S	S	*	*			trans	58.6	120.4	179.9	53.5	0	0	0	0	117
1331	E	31.3	Very low	27.9	Very low	188 Å²	188	146.6 Å²	146.6	88%	0.879	76%	0.759	S	S	*	*	S	Bend	trans	-70.2	167.1	164.6	-61.5	173	129.4	0	0	110.5
1332	D	29.8	Very low	27.8	Very low	154 Å²	154	147.4 Å²	147.4	82%	0.824	76%	0.762	S	S	*	*	S	Bend	trans	67.9	39.6	176.2	-65.6	-14	0	0	0	118.9
1333	Q	28.2	Very low	27.9	Very low	148 Å²	148	149.2 Å²	149.2	69%	0.692	77%	0.771	S	S	*	*			trans	-158.9	116.2	149.1	-114.6	138.5	112	0	0	114.6
1334	I	29.6	Very low	28	Very low	167 Å²	167	151.9 Å²	151.9	86%	0.856	78%	0.783	S	S	*	*			trans	-89.9	105.5	164.4	-59.8	176.5	0	0	0	107.8
1335	T	24.3	Very low	28	Very low	106 Å²	106	151.7 Å²	151.7	65%	0.65	78%	0.783	S	S	*	*			trans	-101.1	106.7	176.4	-54.7	0	0	0	0	109.6	K1337	T1335-K1337 PolarHBondContact O-N 3.48Å
1336	I	27.3	Very low	28.2	Very low	142 Å²	142	150.4 Å²	150.4	73%	0.728	78%	0.782	S	S	*	*			trans	-79.4	116.5	169.9	-56.1	175.6	0	0	0	107.6
1337	K	24	Very low	28.4	Very low	185 Å²	185	143.8 Å²	143.8	80%	0.804	78%	0.776	S	S	*	*			trans	-98.5	136.8	160.7	-74.6	-174.7	174.8	-178.6	0	108.7	T1335	T1335-K1337 PolarHBondContact O-N 3.48Å
1338	L	28	Very low	28.4	Very low	172 Å²	172	148 Å²	148	90%	0.901	78%	0.784	S	S	*	*			trans	-95.6	0	161.6	-71	169.4	0	0	0	108.7

Retrieved 1,338 of 1,338 residues in 308 ms (Link to these results)

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