A0A077Z6C3_TRITR Loading...

SH3 2 and SH3 9 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6C3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,076 aa.

						>A0A077Z6C3_TRITR|A0A077Z6C3
MCPYPCVDVSNVTVTEVRSDELVRVPCPLQITVEKQLRKSVLVSWLHPSSMLIPVLQYHVCVNGNVRAIVPACYNTKALVEDVDCSKPSRLSVRSVTDSGHSPDAACTITIGKDSSVAPEEVKAFSITPVSAQVSWYPGSSNFEHVILLNGLKVGNCPAGTYHVILKGLIPSTLYRCSVRVKDPRAVLEDKPVEGHYDFKTLSKIGLPDAPNNVQCEIGPQDGTLLVTWQPVMNQPKPPSRAAVSGYLVYADGRKVGEVNTPTGDHALLKWSDLCNDPPLFITVKTKTREGILSTDSNAVRVPNLDRPSTFMYSPRIQSIPAGVIYSHSATSAPMTVPSYYIFHPQLAQVDPGRVPTRPSLLEMETSYLLRQQQKSRASLKKRSASLDEEKSLEMQYRPQARIPQINVIGTHSGEEDVGFSSTRSEDRYAQPRHYQSTYSTRSSRLNRHLRSPSSRAVSEPDLRDDRRFVGGGALGNRPSETRCLVGLFDYNPRHMSPNRNAARDELPFRKGEMIKVLEEKDFDGFYLGELNGRIGLVPSNLVMEINNCPRYLPSVPTQEPMSLPLTKAPWKYAHRSPYSNVYSSSGGPKAPSYEQYRDVHPTSIDRDLWAPSSDPTLSRHFDYDTSSGTPEEKQTRANFRTRRMRLKQKSYSVEQSPVESSYAEHAGPLNVVEDEPPVVYHDYYQQRWPAQNEYDLSADYPEFRGMRQKVEPESRSNSQTYRSQHYATNPRRHRREHEYANQAYSEPSVGEGARIVNERRGAKANTLRHPIYQKHNERRHASKLGSLPVIYADSIHSEANSVENVSYARHGGRSSPYNAEQNYPAPADSDFDARKIVSSTEQMEQVIRHALSTGQIRTAVAEFDYDPKVLSPNVDAEQEELSFLAGDVITLYGDMDEDGFFVGELDGRYGLVPSNFIVINSEDVPPASVSNEEARDTTLPQRKEGVTFAPNSILREKDAPEESRDAETGKQGAGRIQQANSLPEEQSRQSLKANQVSAAGPTLRHAKSDPPRKMAESPAKKGSSGQQVSKKLAINSSNRKQPTGTQQGKSHADKGSHVKRDTGQGIGKMWKKIVE
					

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(Predicted Aligned Error values between residue pairs)

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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	63.2	Low	78.5	Confident	232 Å²	232	86.7 Å²	86.7	100%	1.143	50%	0.502	S	S	*	.				0	154.9	0	-64.7	174.7	71.7	0	0	109.1
2	C	74.6	Confident	79.4	Confident	39 Å²	39	80.5 Å²	80.5	26%	0.264	47%	0.466	S	S	.	.			trans	-77.1	138.8	172.5	-172.1	0	0	0	0	110	Y4	C2-Y4 PolarHBondContact SG-N 3.42Å
3	P	78.7	Confident	80.3	Confident	88 Å²	88	80.2 Å²	80.2	57%	0.571	47%	0.466	S	S	*	.	S	Bend	trans	-83.6	-13.5	174.7	34.2	-36.4	0	0	0	113.6
4	Y	83.3	Confident	81.2	Confident	54 Å²	54	76.8 Å²	76.8	21%	0.212	45%	0.447	C	S	.	.	S	Bend	trans	-90.2	149.4	-179.8	-54.6	-50.1	0	0	0	111.2	C2 L174 R176 D198	C2-Y4 PolarHBondContact SG-N 3.42Å; Y4-L174 HydrophobicContact CD1-CB 4.35Å; Y4-L174 HydrophobicContact CE1-CB 4.37Å; Y4-L174 HydrophobicContact CE1-CD1 4.22Å; Y4-R176 HydrophobicContact CD2-CB 3.85Å; Y4-R176 HydrophobicContact CE2-CB 3.98Å; Y4-D198 HydrophobicContact CE2-CB 4.26Å; Y4-D198 PolarHBondContact OH-OD2 3.13Å
5	P	76.1	Confident	81.8	Confident	101 Å²	101	75 Å²	75	66%	0.656	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-59.8	154.2	172.9	27.3	-35.5	0	0	0	111	V7 N150	P5-V7 PolarHBondContact O-N 2.97Å; P5-V7 VanDerWaalsContact O-N 3.14Å; P5-N150 PolarHBondContact O-ND2 3.42Å
6	C	72.1	Confident	81.9	Confident	102 Å²	102	74.3 Å²	74.3	69%	0.689	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-58.6	119.1	166.4	-64.2	0	0	0	0	108.8	L152	C6-L152 HydrophobicContact CB-CD1 4.37Å
7	V	80.3	Confident	81.4	Confident	22 Å²	22	71.2 Å²	71.2	13%	0.133	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-96.8	147.5	172.3	174.6	0	0	0	0	107	P5 V9 N150 I170 T173 Y175	P5-V7 PolarHBondContact O-N 2.97Å; P5-V7 VanDerWaalsContact O-N 3.14Å; V7-V9 PolarHBondContact O-N 3.3Å; V7-N150 WeakPolarHBondContact CG2-ND2 3.34Å; V7-I170 HydrophobicContact CG1-CD1 3.78Å; V7-I170 HydrophobicContact CG1-CG1 4.32Å; V7-T173 HydrophobicContact CG1-CG2 3.99Å; V7-T173 HydrophobicContact CG2-CG2 3.78Å; V7-Y175 HydrophobicContact CB-CE1 4.17Å; V7-Y175 HydrophobicContact CG1-CE1 3.84Å
8	D	83	Confident	80.3	Confident	92 Å²	92	76.7 Å²	76.7	49%	0.492	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-63.1	119.6	169.6	176.5	28.3	0	0	0	109.8	S10 I170	D8-S10 VanDerWaalsContact CG-OG 3.26Å; D8-S10 WeakPolarHBondContact OD1-CB 3.3Å; D8-S10 PolarHBondContact OD1-N 3.4Å; D8-S10 PolarHBondContact OD1-OG 3.14Å; D8-S10 PolarHBondContact OD2-OG 2.92Å; D8-S10 VanDerWaalsContact OD2-OG 3.13Å; D8-I170 HydrophobicContact CB-CD1 4.45Å
9	V	85	Confident	78.5	Confident	16 Å²	16	75.2 Å²	75.2	10%	0.097	42%	0.42	C	S	.	.			trans	-120.1	11.2	177.4	-61.5	0	0	0	0	112.2	V7 N11 V12 L149 L152 V154 Y175	V7-V9 PolarHBondContact O-N 3.3Å; V9-N11 PolarHBondContact O-N 2.73Å; V9-V12 HydrophobicContact CB-CB 4.24Å; V9-V12 HydrophobicContact CB-CG2 3.87Å; V9-V12 HydrophobicContact CG1-CG2 4.18Å; V9-V12 WeakPolarHBondContact O-CB 3.48Å; V9-V12 PolarHBondContact O-N 3Å; V9-L149 HydrophobicContact CG1-CB 3.99Å; V9-L149 HydrophobicContact CG1-CD1 4.3Å; V9-L152 HydrophobicContact CG2-CB 3.73Å; V9-L152 HydrophobicContact CG2-CD1 3.87Å; V9-L152 HydrophobicContact CG2-CG 4.47Å; V9-V154 HydrophobicContact CB-CG1 3.76Å; V9-V154 HydrophobicContact CG1-CG1 4.4Å; V9-V154 HydrophobicContact CG2-CG1 3.77Å; V9-Y175 HydrophobicContact CG1-CE1 4.22Å
10	S	82.3	Confident	76.7	Confident	93 Å²	93	77.2 Å²	77.2	65%	0.65	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.2	178.6	58.9	0	0	0	0	113.1	D8	D8-S10 VanDerWaalsContact CG-OG 3.26Å; D8-S10 WeakPolarHBondContact OD1-CB 3.3Å; D8-S10 PolarHBondContact OD1-N 3.4Å; D8-S10 PolarHBondContact OD1-OG 3.14Å; D8-S10 PolarHBondContact OD2-OG 2.92Å; D8-S10 VanDerWaalsContact OD2-OG 3.13Å
11	N	84.9	Confident	75	Confident	115 Å²	115	82.5 Å²	82.5	62%	0.615	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-1	178.1	-66.1	-77.2	0	0	0	113.6	V9	V9-N11 PolarHBondContact O-N 2.73Å
12	V	89.9	Confident	74.3	Confident	12 Å²	12	77.7 Å²	77.7	7%	0.073	43%	0.43	C	S	.	.			trans	-83.4	121.1	-176.9	-179.7	0	0	0	0	110.5	V9 L149 V154 K167 L169	V9-V12 HydrophobicContact CB-CB 4.24Å; V9-V12 HydrophobicContact CB-CG2 3.87Å; V9-V12 HydrophobicContact CG1-CG2 4.18Å; V9-V12 WeakPolarHBondContact O-CB 3.48Å; V9-V12 PolarHBondContact O-N 3Å; V12-L149 HydrophobicContact CG1-CD1 3.88Å; V12-L149 HydrophobicContact CG2-CD1 4.31Å; V12-V154 HydrophobicContact CB-CG1 4.14Å; V12-V154 HydrophobicContact CG1-CB 4.23Å; V12-V154 HydrophobicContact CG1-CG1 4.15Å; V12-K167 CarbonylContact C-O 3.47Å; V12-K167 VanDerWaalsContact CA-O 3.3Å; V12-K167 WeakPolarHBondContact CA-O 3.45Å; V12-L169 HydrophobicContact CG1-CD2 4.05Å; V12-L169 HydrophobicContact CG2-CD2 3.95Å
13	T	91.1	Very high	73.2	Confident	76 Å²	76	78.7 Å²	78.7	47%	0.466	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.9	174.8	48.4	0	0	0	0	110.7	L166 K167	T13-L166 WeakPolarHBondContact O-CA 3.37Å; T13-K167 PolarHBondContact N-O 3.16Å; T13-K167 PolarHBondContact O-N 3.08Å; T13-K167 PolarHBondContact OG1-O 3.29Å
14	V	92.6	Very high	72.7	Confident	33 Å²	33	79.2 Å²	79.2	20%	0.2	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116.4	174.5	-174.2	0	0	0	0	108	I147 V154 V164 L166	V14-I147 HydrophobicContact CG1-CG1 4.2Å; V14-I147 HydrophobicContact CG2-CB 4.45Å; V14-V154 HydrophobicContact CG2-CB 4.12Å; V14-V154 HydrophobicContact CG2-CG2 3.71Å; V14-V164 HydrophobicContact CG1-CB 3.81Å; V14-V164 HydrophobicContact CG1-CG1 3.88Å; V14-V164 HydrophobicContact CG1-CG2 3.93Å; V14-L166 HydrophobicContact CB-CD2 4.49Å; V14-L166 HydrophobicContact CG1-CD2 4.36Å; V14-L166 HydrophobicContact CG2-CD2 3.82Å
15	T	89.7	Confident	72.7	Confident	50 Å²	50	77.3 Å²	77.3	31%	0.307	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.3	174	54.7	0	0	0	0	109.7	V164 I165	T15-V164 CarbonylContact O-C 3.56Å; T15-V164 WeakPolarHBondContact O-CA 3.5Å; T15-I165 PolarHBondContact N-O 3.23Å; T15-I165 PolarHBondContact O-N 3.4Å; T15-I165 PolarHBondContact OG1-O 3.15Å
16	E	83.7	Confident	73.2	Confident	64 Å²	64	73.1 Å²	73.1	30%	0.299	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	140.7	169.1	175.7	169.7	-128.7	0	0	110.4	R18 T161	E16-R18 HydrophobicContact CB-CG 4.49Å; E16-R18 HydrophobicContact CG-CG 3.98Å; E16-R18 PolarHBondContact O-N 3.23Å; E16-R18 IonicContact OE2-CZ 3.55Å; E16-R18 VanDerWaalsContact OE2-CZ 3.27Å; E16-R18 IonicContact OE2-NE 2.7Å; E16-R18 PolarHBondContact OE2-NE 2.93Å; E16-R18 IonicContact OE2-NH2 3.47Å; E16-R18 PolarHBondContact OE2-NH2 3.25Å; E16-T161 HydrophobicContact CB-CG2 4.41Å; E16-T161 HydrophobicContact CG-CG2 3.96Å; E16-T161 WeakPolarHBondContact OE1-CB 3.33Å; E16-T161 WeakPolarHBondContact OE1-CG2 3.31Å; E16-T161 PolarHBondContact OE1-OG1 3.04Å
17	V	74	Confident	74	Confident	22 Å²	22	69.4 Å²	69.4	13%	0.133	37%	0.366	C	S	.	.			trans	-81.9	74.5	173.7	-168.4	0	0	0	0	109.9	S19 H163 I165	V17-S19 PolarHBondContact O-N 3.32Å; V17-H163 PolarHBondContact N-O 3.44Å; V17-H163 VanDerWaalsContact N-O 3.15Å; V17-I165 HydrophobicContact CG2-CD1 3.87Å; V17-I165 HydrophobicContact CG2-CG1 3.71Å
18	R	61.1	Low	74.6	Confident	169 Å²	169	68.3 Å²	68.3	64%	0.638	36%	0.36	S	S	*	.			trans	-73.7	105.5	158.1	-60.3	-170.3	179	-147	-12.9	106.8	E16 D20	E16-R18 HydrophobicContact CB-CG 4.49Å; E16-R18 HydrophobicContact CG-CG 3.98Å; E16-R18 PolarHBondContact O-N 3.23Å; E16-R18 IonicContact OE2-CZ 3.55Å; E16-R18 VanDerWaalsContact OE2-CZ 3.27Å; E16-R18 IonicContact OE2-NE 2.7Å; E16-R18 PolarHBondContact OE2-NE 2.93Å; E16-R18 IonicContact OE2-NH2 3.47Å; E16-R18 PolarHBondContact OE2-NH2 3.25Å; R18-D20 PolarHBondContact O-N 3.2Å; R18-D20 VanDerWaalsContact O-N 3.16Å
19	S	46.4	Very low	75	Confident	48 Å²	48	66.6 Å²	66.6	34%	0.336	35%	0.351	S	S	.	.			trans	-86.5	69	179.2	-65.1	0	0	0	0	109.1	V17 E21 L22	V17-S19 PolarHBondContact O-N 3.32Å; S19-E21 PolarHBondContact O-N 3.15Å; S19-E21 VanDerWaalsContact O-N 3.1Å; S19-L22 PolarHBondContact O-N 2.85Å; S19-L22 VanDerWaalsContact O-O 3.07Å
20	D	41.8	Very low	75.3	Confident	116 Å²	116	71.7 Å²	71.7	62%	0.62	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.4	-177.2	-53.1	-33.3	0	0	0	111.8	R18 V838	R18-D20 PolarHBondContact O-N 3.2Å; R18-D20 VanDerWaalsContact O-N 3.16Å; D20-V838 WeakPolarHBondContact O-CG1 3.29Å
21	E	41.2	Very low	76	Confident	189 Å²	189	67.3 Å²	67.3	88%	0.883	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.5	173.2	-59.2	-176.7	142.7	0	0	114.8	S19	S19-E21 PolarHBondContact O-N 3.15Å; S19-E21 VanDerWaalsContact O-N 3.1Å
22	L	48.8	Very low	76.5	Confident	131 Å²	131	64.9 Å²	64.9	69%	0.686	33%	0.332	S	S	*	.	S	Bend	trans	-136.6	110.6	-178	-89.5	164.1	0	0	0	111.4	S19 R24	S19-L22 PolarHBondContact O-N 2.85Å; S19-L22 VanDerWaalsContact O-O 3.07Å; L22-R24 PolarHBondContact O-N 3.17Å
23	V	52.2	Low	76.7	Confident	60 Å²	60	66.3 Å²	66.3	36%	0.364	34%	0.341	S	S	.	.			trans	-48.6	93.3	179.3	-179.2	0	0	0	0	111.4	I53 I837 V838	V23-I53 HydrophobicContact CG1-CD1 3.46Å; V23-I53 VanDerWaalsContact CG1-CD1 3.46Å; V23-I53 HydrophobicContact CG1-CG1 3.88Å; V23-I837 HydrophobicContact CG2-CG2 4.22Å; V23-V838 HydrophobicContact CG2-CG2 4.39Å
24	R	67.1	Low	76.8	Confident	98 Å²	98	66.4 Å²	66.4	37%	0.37	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-93.1	121.7	-169.7	-169.1	-168.6	-138.9	-91.1	4.2	110.7	L22 P26 C27 I53 Y162	L22-R24 PolarHBondContact O-N 3.17Å; R24-P26 VanDerWaalsContact O-N 3.16Å; R24-C27 PolarHBondContact NH1-SG 3.29Å; R24-I53 VanDerWaalsContact O-CD1 3.26Å; R24-I53 WeakPolarHBondContact O-CD1 3.36Å; R24-Y162 PolarHBondContact NH2-OH 2.67Å
25	V	83.8	Confident	76.8	Confident	14 Å²	14	71.4 Å²	71.4	9%	0.085	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-49.3	120.9	175.2	-172.9	0	0	0	0	110.4	C27 T97	V25-C27 PolarHBondContact O-N 3.41Å; V25-C27 PolarHBondContact O-SG 2.73Å; V25-T97 HydrophobicContact CG1-CG2 3.79Å; V25-T97 WeakPolarHBondContact CG2-OG1 3.48Å
26	P	85.9	Confident	76.9	Confident	13 Å²	13	73.7 Å²	73.7	8%	0.084	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-72.2	130	-166	29.4	-35.2	0	0	0	109.8	R24 P48 S50 I53 V55 S95	R24-P26 VanDerWaalsContact O-N 3.16Å; P26-P48 HydrophobicContact CB-CB 3.73Å; P26-P48 HydrophobicContact CB-CG 4.02Å; P26-P48 HydrophobicContact CG-CG 4.34Å; P26-P48 WeakPolarHBondContact O-CG 3.4Å; P26-S50 WeakPolarHBondContact CB-O 3.13Å; P26-I53 HydrophobicContact CG-CB 4.43Å; P26-V55 HydrophobicContact CG-CG2 3.77Å; P26-S95 WeakPolarHBondContact O-CB 3.38Å; P26-S95 PolarHBondContact O-OG 3.02Å
27	C	88.9	Confident	77.1	Confident	24 Å²	24	75.1 Å²	75.1	16%	0.162	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-88.4	136.6	-165.8	-58.7	0	0	0	0	111.7	R24 V25 P48 A106	R24-C27 PolarHBondContact NH1-SG 3.29Å; V25-C27 PolarHBondContact O-N 3.41Å; V25-C27 PolarHBondContact O-SG 2.73Å; C27-P48 WeakPolarHBondContact O-CA 3.17Å; C27-P48 VanDerWaalsContact O-CB 3.29Å; C27-P48 WeakPolarHBondContact O-CB 3.32Å; C27-A106 HydrophobicContact CB-CB 3.7Å
28	P	92.8	Very high	77.7	Confident	0 Å²	0	85.1 Å²	85.1	0%	0	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-64.9	157.5	173	-7.9	22.1	0	0	0	110.5	W45 Y58 V93 S95 C107	P28-W45 HydrophobicContact CB-CG 4.38Å; P28-Y58 HydrophobicContact CB-CD1 4.46Å; P28-Y58 HydrophobicContact CB-CE1 4.27Å; P28-Y58 HydrophobicContact CG-CD1 3.93Å; P28-Y58 HydrophobicContact CG-CE1 4.02Å; P28-V93 HydrophobicContact CB-CG1 4.34Å; P28-V93 HydrophobicContact CG-CB 4.28Å; P28-V93 HydrophobicContact CG-CG1 3.91Å; P28-S95 WeakPolarHBondContact CD-OG 3.31Å; P28-S95 WeakPolarHBondContact CG-OG 3.33Å; P28-C107 HydrophobicContact CB-CB 4.47Å; P28-C107 VanDerWaalsContact O-CB 3.27Å; P28-C107 WeakPolarHBondContact O-CB 3.31Å; P28-C107 PolarHBondContact O-SG 2.92Å
29	L	92	Very high	79.1	Confident	56 Å²	56	83.9 Å²	83.9	29%	0.293	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	162.2	-172.3	-60.5	175.4	0	0	0	112.3	I31 L46 S49	L29-I31 PolarHBondContact O-N 3.22Å; L29-L46 HydrophobicContact CB-CB 4.22Å; L29-L46 PolarHBondContact N-O 3.32Å; L29-L46 PolarHBondContact O-N 2.82Å; L29-S49 WeakPolarHBondContact CD1-OG 3.35Å
30	Q	92	Very high	81.3	Confident	123 Å²	123	82.6 Å²	82.6	58%	0.575	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	46.1	52.7	171.7	-62.1	-168.8	-9.9	0	0	115.5	T32 L46 N142	Q30-T32 PolarHBondContact O-N 3.26Å; Q30-T32 PolarHBondContact O-OG1 3.07Å; Q30-L46 HydrophobicContact CB-CD1 4.13Å; Q30-L46 HydrophobicContact CB-CG 4.23Å; Q30-L46 HydrophobicContact CG-CD1 4.17Å; Q30-L46 VanDerWaalsContact OE1-CD1 3.31Å; Q30-N142 WeakPolarHBondContact CA-OD1 3.46Å
31	I	95.5	Very high	83.8	Confident	1 Å²	1	77.1 Å²	77.1	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	120	175.6	-174.6	174.1	0	0	0	111	L29 V43 S44 L91 V93 I109 N142	L29-I31 PolarHBondContact O-N 3.22Å; I31-V43 HydrophobicContact CD1-CG2 4.19Å; I31-V43 HydrophobicContact CG1-CG2 3.72Å; I31-S44 CarbonylContact C-O 3.6Å; I31-S44 WeakPolarHBondContact CA-O 3.47Å; I31-L91 HydrophobicContact CD1-CB 4.29Å; I31-V93 HydrophobicContact CD1-CG2 3.86Å; I31-V93 HydrophobicContact CG1-CG2 4.37Å; I31-I109 HydrophobicContact CD1-CG2 3.98Å; I31-I109 HydrophobicContact CG1-CG2 4.05Å; I31-I109 HydrophobicContact CG2-CB 4.19Å; I31-I109 HydrophobicContact CG2-CG2 4.26Å; I31-N142 PolarHBondContact N-OD1 3.2Å; I31-N142 PolarHBondContact O-ND2 3.15Å
32	T	95.6	Very high	86.4	Confident	63 Å²	63	70.3 Å²	70.3	39%	0.387	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	137.2	-168.8	-62.2	0	0	0	0	110.2	Q30 V43 S44	Q30-T32 PolarHBondContact O-N 3.26Å; Q30-T32 PolarHBondContact O-OG1 3.07Å; T32-V43 CarbonylContact O-C 3.53Å; T32-V43 WeakPolarHBondContact O-CA 3.3Å; T32-V43 WeakPolarHBondContact O-CG2 3.23Å; T32-S44 PolarHBondContact N-O 2.69Å; T32-S44 PolarHBondContact O-N 3.12Å
33	V	94.2	Very high	88.7	Confident	43 Å²	43	64 Å²	64	26%	0.261	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	107.1	176.4	173.5	0	0	0	0	108.4	Q36 V41 L91 I109 I111	V33-Q36 HydrophobicContact CG1-CB 4.38Å; V33-V41 HydrophobicContact CB-CG1 4.46Å; V33-V41 HydrophobicContact CG1-CG1 3.56Å; V33-V41 HydrophobicContact CG2-CG1 4.22Å; V33-L91 HydrophobicContact CG2-CD1 4.04Å; V33-I109 HydrophobicContact CG2-CG2 4.19Å; V33-I111 HydrophobicContact CG2-CG2 3.88Å
34	E	93.8	Very high	90.8	Very high	77 Å²	77	61.8 Å²	61.8	36%	0.36	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-37.3	-175.4	-57.2	-168.2	166.9	0	0	112.1	L42 S44 K77	E34-L42 HydrophobicContact CB-CD2 4.03Å; E34-L42 HydrophobicContact CB-CG 4.13Å; E34-L42 PolarHBondContact N-O 2.84Å; E34-S44 VanDerWaalsContact CD-OG 3.3Å; E34-S44 WeakPolarHBondContact CG-OG 3.07Å; E34-S44 WeakPolarHBondContact OE1-CB 3.27Å; E34-S44 PolarHBondContact OE1-OG 3.5Å; E34-K77 WeakPolarHBondContact OE1-CE 3.38Å; E34-K77 IonicContact OE1-NZ 2.66Å; E34-K77 PolarHBondContact OE1-NZ 3.41Å; E34-K77 IonicContact OE2-NZ 2.66Å; E34-K77 PolarHBondContact OE2-NZ 3.04Å
35	K	93.1	Very high	92.2	Very high	139 Å²	139	57.4 Å²	57.4	60%	0.604	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.2	131.6	175.5	-61.6	-173.6	-180	-178.8	0	110.5	V41 L42	K35-V41 WeakPolarHBondContact O-CA 3.34Å; K35-L42 HydrophobicContact CB-CB 4.08Å; K35-L42 HydrophobicContact CD-CD2 4.49Å; K35-L42 HydrophobicContact CG-CD2 4.39Å; K35-L42 PolarHBondContact N-O 3.4Å; K35-L42 PolarHBondContact O-N 2.57Å
36	Q	90.8	Very high	92.7	Very high	97 Å²	97	60.9 Å²	60.9	45%	0.453	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.3	172.3	-168.9	172.9	14.8	0	0	109.4	V33 V41 C85	V33-Q36 HydrophobicContact CG1-CB 4.38Å; Q36-V41 HydrophobicContact CG-CG2 4.32Å; Q36-C85 HydrophobicContact CG-CB 4.22Å; Q36-C85 VanDerWaalsContact CG-SG 3.58Å; Q36-C85 VanDerWaalsContact NE2-CB 3.33Å; Q36-C85 PolarHBondContact NE2-SG 3.45Å
37	L	89.3	Confident	93	Very high	94 Å²	94	64 Å²	64	49%	0.492	31%	0.305	S	S	.	.			trans	-112.4	168.9	178.1	-55.5	176.2	0	0	0	109.7	K39 S40 C85	L37-K39 PolarHBondContact O-N 3.08Å; L37-S40 CarbonylContact C-O 3.49Å; L37-S40 WeakPolarHBondContact CA-O 3.38Å; L37-S40 WeakPolarHBondContact CB-O 3.44Å; L37-S40 PolarHBondContact N-O 3.49Å; L37-C85 PolarHBondContact O-SG 3.1Å; L37-C85 VanDerWaalsContact O-SG 3.41Å
38	R	85.9	Confident	92.9	Very high	232 Å²	232	63.3 Å²	63.3	88%	0.875	30%	0.3	S	S	*	.	S	Bend	trans	-58.5	-24.8	-173.3	-171.4	173.9	-179.3	178.8	2	114.8
39	K	89.5	Confident	92.2	Very high	144 Å²	144	68.8 Å²	68.8	63%	0.626	34%	0.339	S	S	*	.	S	Bend	trans	-138.2	4.3	-179	-75.4	-167.7	171.1	-166.6	0	114.2	L37 D82 V83	L37-K39 PolarHBondContact O-N 3.08Å; K39-D82 CarbonylContact O-C 3.28Å; K39-D82 WeakPolarHBondContact O-CA 3.32Å; K39-D82 PolarHBondContact O-N 2.88Å; K39-V83 CarbonylContact C-O 3.59Å; K39-V83 VanDerWaalsContact C-O 3.28Å; K39-V83 WeakPolarHBondContact CA-O 3.49Å; K39-V83 PolarHBondContact O-N 2.99Å
40	S	92.9	Very high	91.1	Very high	21 Å²	21	68.5 Å²	68.5	15%	0.147	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	157.2	-172.4	51.2	0	0	0	0	111.4	L37 V80	L37-S40 CarbonylContact C-O 3.49Å; L37-S40 WeakPolarHBondContact CA-O 3.38Å; L37-S40 WeakPolarHBondContact CB-O 3.44Å; L37-S40 PolarHBondContact N-O 3.49Å; S40-V80 CarbonylContact C-O 3.56Å; S40-V80 WeakPolarHBondContact CA-O 3.41Å; S40-V80 VanDerWaalsContact CB-O 3.25Å; S40-V80 WeakPolarHBondContact CB-O 3.42Å
41	V	95.1	Very high	89.8	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	129	-174.7	-173.3	0	0	0	0	109.8	V33 K35 Q36 V80 V83 L91 I111	V33-V41 HydrophobicContact CB-CG1 4.46Å; V33-V41 HydrophobicContact CG1-CG1 3.56Å; V33-V41 HydrophobicContact CG2-CG1 4.22Å; K35-V41 WeakPolarHBondContact O-CA 3.34Å; Q36-V41 HydrophobicContact CG-CG2 4.32Å; V41-V80 PolarHBondContact N-O 3.39Å; V41-V80 PolarHBondContact O-N 2.68Å; V41-V83 HydrophobicContact CG2-CB 4.01Å; V41-V83 HydrophobicContact CG2-CG1 3.8Å; V41-V83 HydrophobicContact CG2-CG2 4.4Å; V41-L91 HydrophobicContact CG1-CD1 4.11Å; V41-I111 HydrophobicContact CG2-CD1 3.82Å
42	L	96.1	Very high	88.5	Confident	46 Å²	46	67.5 Å²	67.5	24%	0.241	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	113.7	166.5	-178.3	63.9	0	0	0	108	E34 K35	E34-L42 HydrophobicContact CB-CD2 4.03Å; E34-L42 HydrophobicContact CB-CG 4.13Å; E34-L42 PolarHBondContact N-O 2.84Å; K35-L42 HydrophobicContact CB-CB 4.08Å; K35-L42 HydrophobicContact CD-CD2 4.49Å; K35-L42 HydrophobicContact CG-CD2 4.39Å; K35-L42 PolarHBondContact N-O 3.4Å; K35-L42 PolarHBondContact O-N 2.57Å
43	V	96.7	Very high	87.8	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.9	179.4	63.1	0	0	0	0	109.9	I31 T32 W45 V60 K77 A78 V80 L91	I31-V43 HydrophobicContact CD1-CG2 4.19Å; I31-V43 HydrophobicContact CG1-CG2 3.72Å; T32-V43 CarbonylContact O-C 3.53Å; T32-V43 WeakPolarHBondContact O-CA 3.3Å; T32-V43 WeakPolarHBondContact O-CG2 3.23Å; V43-W45 HydrophobicContact CG1-CZ3 4.3Å; V43-V60 HydrophobicContact CG1-CG1 3.9Å; V43-K77 CarbonylContact O-C 3.59Å; V43-K77 VanDerWaalsContact O-CA 3.3Å; V43-K77 WeakPolarHBondContact O-CA 3.21Å; V43-A78 HydrophobicContact CG1-CB 4.28Å; V43-A78 PolarHBondContact N-O 2.79Å; V43-A78 PolarHBondContact O-N 2.66Å; V43-V80 HydrophobicContact CG1-CG2 3.81Å; V43-L91 HydrophobicContact CB-CD1 4.38Å; V43-L91 HydrophobicContact CG2-CD1 4.3Å
44	S	97	Very high	87.2	Confident	12 Å²	12	67.4 Å²	67.4	8%	0.084	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	163.8	173.5	59.8	0	0	0	0	111.4	I31 T32 E34 T76	I31-S44 CarbonylContact C-O 3.6Å; I31-S44 WeakPolarHBondContact CA-O 3.47Å; T32-S44 PolarHBondContact N-O 2.69Å; T32-S44 PolarHBondContact O-N 3.12Å; E34-S44 VanDerWaalsContact CD-OG 3.3Å; E34-S44 WeakPolarHBondContact CG-OG 3.07Å; E34-S44 WeakPolarHBondContact OE1-CB 3.27Å; E34-S44 PolarHBondContact OE1-OG 3.5Å; S44-T76 CarbonylContact C-O 3.58Å; S44-T76 VanDerWaalsContact CA-O 3.23Å; S44-T76 WeakPolarHBondContact CA-O 3.39Å
45	W	96.3	Very high	87	Confident	6 Å²	6	64.3 Å²	64.3	2%	0.023	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	170.6	178	57.3	96.9	0	0	0	110	P28 V43 Y58 V60 V70 T76 A78 V93	P28-W45 HydrophobicContact CB-CG 4.38Å; V43-W45 HydrophobicContact CG1-CZ3 4.3Å; W45-Y58 AromaticContact CE2-CG 3.91Å; W45-Y58 AromaticContact CZ2-CD2 3.93Å; W45-Y58 HydrophobicContact CZ2-CD2 3.93Å; W45-Y58 AromaticContact CZ2-CG 3.86Å; W45-Y58 HydrophobicContact CZ2-CG 3.86Å; W45-Y58 AromaticContact NE1-CD1 3.53Å; W45-Y58 AromaticContact NE1-CD2 3.59Å; W45-Y58 AromaticContact NE1-CE1 3.76Å; W45-Y58 AromaticContact NE1-CE2 3.81Å; W45-Y58 AromaticContact NE1-CG 3.44Å; W45-Y58 AromaticContact NE1-CZ 3.9Å; W45-V60 HydrophobicContact CH2-CG2 3.56Å; W45-V60 HydrophobicContact CZ2-CG2 4.37Å; W45-V60 HydrophobicContact CZ3-CG2 3.75Å; W45-V70 HydrophobicContact CH2-CB 4.25Å; W45-V70 HydrophobicContact CH2-CG2 3.96Å; W45-V70 HydrophobicContact CZ2-CB 4.2Å; W45-V70 HydrophobicContact CZ2-CG1 4.38Å; W45-V70 HydrophobicContact CZ2-CG2 4.42Å; W45-T76 PolarHBondContact N-O 2.64Å; W45-T76 WeakPolarHBondContact O-CB 3.43Å; W45-T76 PolarHBondContact O-OG1 2.94Å; W45-A78 HydrophobicContact CH2-CB 4.08Å; W45-A78 HydrophobicContact CZ3-CB 4.05Å; W45-V93 HydrophobicContact CD2-CB 4.46Å; W45-V93 HydrophobicContact CD2-CG1 3.92Å; W45-V93 HydrophobicContact CD2-CG2 4Å; W45-V93 HydrophobicContact CE3-CG1 4.37Å; W45-V93 HydrophobicContact CE3-CG2 3.77Å; W45-V93 HydrophobicContact CG-CG1 4.23Å; W45-V93 HydrophobicContact CG-CG2 4.42Å; W45-V93 HydrophobicContact CZ2-CG1 4.23Å; W45-V93 HydrophobicContact CZ3-CG2 4.26Å
46	L	94.3	Very high	87	Confident	87 Å²	87	61.8 Å²	61.8	46%	0.455	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	153.6	167.8	-64.2	-178.1	0	0	0	110.7	L29 Q30	L29-L46 HydrophobicContact CB-CB 4.22Å; L29-L46 PolarHBondContact N-O 3.32Å; L29-L46 PolarHBondContact O-N 2.82Å; Q30-L46 HydrophobicContact CB-CD1 4.13Å; Q30-L46 HydrophobicContact CB-CG 4.23Å; Q30-L46 HydrophobicContact CG-CD1 4.17Å; Q30-L46 VanDerWaalsContact OE1-CD1 3.31Å
47	H	90.4	Very high	87.2	Confident	80 Å²	80	60.1 Å²	60.1	37%	0.37	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-58.4	155	168.5	-66.8	-109.6	0	0	0	110.6	Y58 T76	H47-Y58 PolarHBondContact ND1-OH 3.04Å; H47-Y58 VanDerWaalsContact ND1-OH 3.14Å; H47-T76 WeakPolarHBondContact NE2-CG2 3.44Å
48	P	88.3	Confident	87.5	Confident	8 Å²	8	55.6 Å²	55.6	5%	0.052	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-58	142.7	170.6	-19.8	31.2	0	0	0	111.8	P26 C27 S50 V55	P26-P48 HydrophobicContact CB-CB 3.73Å; P26-P48 HydrophobicContact CB-CG 4.02Å; P26-P48 HydrophobicContact CG-CG 4.34Å; P26-P48 WeakPolarHBondContact O-CG 3.4Å; C27-P48 WeakPolarHBondContact O-CA 3.17Å; C27-P48 VanDerWaalsContact O-CB 3.29Å; C27-P48 WeakPolarHBondContact O-CB 3.32Å; P48-S50 PolarHBondContact O-N 2.95Å; P48-V55 HydrophobicContact CG-CG2 4.31Å
49	S	78.2	Confident	88	Confident	116 Å²	116	46 Å²	46	81%	0.811	25%	0.251	S	S	*	.	S	Bend	trans	-68.5	-0.6	174.5	-57.3	0	0	0	0	114.7	L29	L29-S49 WeakPolarHBondContact CD1-OG 3.35Å
50	S	68.6	Low	88.4	Confident	49 Å²	49	39.2 Å²	39.2	34%	0.343	22%	0.221	S	C	.	.			trans	-141.4	111.7	-178.6	178.4	0	0	0	0	107.9	P26 P48 L52	P26-S50 WeakPolarHBondContact CB-O 3.13Å; P48-S50 PolarHBondContact O-N 2.95Å; S50-L52 WeakPolarHBondContact OG-CD1 3.36Å; S50-L52 WeakPolarHBondContact OG-CG 3.16Å
51	M	64.4	Low	88.5	Confident	44 Å²	44	38.2 Å²	38.2	22%	0.217	21%	0.214	C	C	.	.			trans	-98.5	11.5	-176.2	-63.3	-67.8	-80.1	0	0	112.6	I53	M51-I53 CarbonylContact O-C 3.58Å; M51-I53 PolarHBondContact O-N 2.89Å
52	L	68.9	Low	88.5	Confident	59 Å²	59	38.8 Å²	38.8	31%	0.309	22%	0.218	S	C	.	.	S	Bend	trans	-59.3	-11.9	-173.7	-57.8	173	0	0	0	115	S50 T841	S50-L52 WeakPolarHBondContact OG-CD1 3.36Å; S50-L52 WeakPolarHBondContact OG-CG 3.16Å; L52-T841 HydrophobicContact CB-CG2 3.83Å; L52-T841 HydrophobicContact CD1-CG2 3.77Å; L52-T841 HydrophobicContact CD2-CG2 4.1Å; L52-T841 HydrophobicContact CG-CG2 4.1Å
53	I	79.4	Confident	88.3	Confident	31 Å²	31	40.9 Å²	40.9	16%	0.159	23%	0.229	C	C	.	.	S	Bend	trans	-126	117.3	167.6	-52.9	153.3	0	0	0	105.3	V23 R24 P26 M51 V55 T97	V23-I53 HydrophobicContact CG1-CD1 3.46Å; V23-I53 VanDerWaalsContact CG1-CD1 3.46Å; V23-I53 HydrophobicContact CG1-CG1 3.88Å; R24-I53 VanDerWaalsContact O-CD1 3.26Å; R24-I53 WeakPolarHBondContact O-CD1 3.36Å; P26-I53 HydrophobicContact CG-CB 4.43Å; M51-I53 CarbonylContact O-C 3.58Å; M51-I53 PolarHBondContact O-N 2.89Å; I53-V55 PolarHBondContact O-N 2.86Å; I53-V55 VanDerWaalsContact O-N 3.15Å; I53-T97 HydrophobicContact CB-CG2 4.38Å; I53-T97 HydrophobicContact CG2-CG2 3.62Å
54	P	82.9	Confident	88.1	Confident	73 Å²	73	42.5 Å²	42.5	47%	0.474	25%	0.245	S	C	.	.			trans	-65.7	116.8	-171.2	25.2	-34.2	0	0	0	111.2	L56 T97	P54-L56 PolarHBondContact O-N 3.15Å; P54-T97 WeakPolarHBondContact O-CG2 3.35Å
55	V	89.9	Confident	87.9	Confident	13 Å²	13	47.1 Å²	47.1	8%	0.079	27%	0.269	C	S	.	.			trans	-71.6	125.6	173.8	-176.8	0	0	0	0	108.4	P26 P48 I53 Q57 Y58 A72 T97	P26-V55 HydrophobicContact CG-CG2 3.77Å; P48-V55 HydrophobicContact CG-CG2 4.31Å; I53-V55 PolarHBondContact O-N 2.86Å; I53-V55 VanDerWaalsContact O-N 3.15Å; V55-Q57 WeakPolarHBondContact CG1-O 3.48Å; V55-Y58 HydrophobicContact CG1-CD1 4.36Å; V55-Y58 HydrophobicContact CG1-CE1 3.98Å; V55-A72 HydrophobicContact CB-CB 4.29Å; V55-A72 HydrophobicContact CG1-CB 4.16Å; V55-A72 WeakPolarHBondContact O-CB 3.25Å; V55-T97 HydrophobicContact CG2-CG2 4.45Å
56	L	91.4	Very high	87.9	Confident	86 Å²	86	49.8 Å²	49.8	45%	0.45	29%	0.286	S	S	.	.			trans	-84.5	-41.4	178.1	-56	174.2	0	0	0	110.9	P54 A72 V96	P54-L56 PolarHBondContact O-N 3.15Å; L56-A72 WeakPolarHBondContact O-CB 3.13Å; L56-A72 PolarHBondContact O-N 3.22Å; L56-V96 PolarHBondContact N-O 2.93Å
57	Q	94.8	Very high	87.9	Confident	61 Å²	61	51.7 Å²	51.7	29%	0.285	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	160.9	-175.3	60.6	-172.4	-9.6	0	0	111.4	V55 H59 I69 V70 V96	V55-Q57 WeakPolarHBondContact CG1-O 3.48Å; Q57-H59 PolarHBondContact NE2-NE2 2.89Å; Q57-H59 VanDerWaalsContact NE2-NE2 3.17Å; Q57-I69 HydrophobicContact CB-CG2 4.26Å; Q57-I69 HydrophobicContact CG-CG2 4.4Å; Q57-V70 CarbonylContact C-O 3.57Å; Q57-V70 WeakPolarHBondContact CA-O 3.45Å; Q57-V96 HydrophobicContact CG-CB 3.8Å; Q57-V96 HydrophobicContact CG-CG1 4.39Å; Q57-V96 HydrophobicContact CG-CG2 4.18Å; Q57-V96 WeakPolarHBondContact O-CB 3.41Å; Q57-V96 PolarHBondContact O-N 3.34Å
58	Y	96.9	Very high	88.1	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.9	169.5	-59.2	-74.8	0	0	0	110.3	P28 W45 H47 V55 I69 V70 A72 T76 V93 R94	P28-Y58 HydrophobicContact CB-CD1 4.46Å; P28-Y58 HydrophobicContact CB-CE1 4.27Å; P28-Y58 HydrophobicContact CG-CD1 3.93Å; P28-Y58 HydrophobicContact CG-CE1 4.02Å; W45-Y58 AromaticContact CE2-CG 3.91Å; W45-Y58 AromaticContact CZ2-CD2 3.93Å; W45-Y58 HydrophobicContact CZ2-CD2 3.93Å; W45-Y58 AromaticContact CZ2-CG 3.86Å; W45-Y58 HydrophobicContact CZ2-CG 3.86Å; W45-Y58 AromaticContact NE1-CD1 3.53Å; W45-Y58 AromaticContact NE1-CD2 3.59Å; W45-Y58 AromaticContact NE1-CE1 3.76Å; W45-Y58 AromaticContact NE1-CE2 3.81Å; W45-Y58 AromaticContact NE1-CG 3.44Å; W45-Y58 AromaticContact NE1-CZ 3.9Å; H47-Y58 PolarHBondContact ND1-OH 3.04Å; H47-Y58 VanDerWaalsContact ND1-OH 3.14Å; V55-Y58 HydrophobicContact CG1-CD1 4.36Å; V55-Y58 HydrophobicContact CG1-CE1 3.98Å; Y58-I69 WeakPolarHBondContact O-CA 3.28Å; Y58-V70 PolarHBondContact N-O 2.69Å; Y58-V70 PolarHBondContact O-N 2.83Å; Y58-A72 HydrophobicContact CE2-CB 4.4Å; Y58-T76 HydrophobicContact CD2-CG2 4.48Å; Y58-T76 HydrophobicContact CE2-CG2 3.87Å; Y58-V93 HydrophobicContact CD1-CG1 4.21Å; Y58-V93 HydrophobicContact CG-CG1 4.43Å; Y58-R94 CarbonylContact C-O 3.52Å; Y58-R94 VanDerWaalsContact CA-O 3.25Å; Y58-R94 WeakPolarHBondContact CA-O 3.3Å
59	H	97	Very high	88.5	Confident	31 Å²	31	53 Å²	53	14%	0.144	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118	170	-74.8	-168.3	0	0	0	109	Q57 V66 V93 R94 V96	Q57-H59 PolarHBondContact NE2-NE2 2.89Å; Q57-H59 VanDerWaalsContact NE2-NE2 3.17Å; H59-V66 HydrophobicContact CB-CG1 4.08Å; H59-V66 HydrophobicContact CB-CG2 4.18Å; H59-V93 WeakPolarHBondContact O-CA 3.44Å; H59-R94 HydrophobicContact CB-CB 4.42Å; H59-R94 PolarHBondContact N-O 2.97Å; H59-R94 PolarHBondContact O-N 3.19Å; H59-V96 HydrophobicContact CB-CG2 4.3Å
60	V	96.8	Very high	89.3	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	116.2	177	-173	0	0	0	0	108.3	V43 W45 R67 A68 A78 V80 V93	V43-V60 HydrophobicContact CG1-CG1 3.9Å; W45-V60 HydrophobicContact CH2-CG2 3.56Å; W45-V60 HydrophobicContact CZ2-CG2 4.37Å; W45-V60 HydrophobicContact CZ3-CG2 3.75Å; V60-R67 PolarHBondContact O-N 2.83Å; V60-A68 HydrophobicContact CB-CB 4.22Å; V60-A68 PolarHBondContact N-O 2.59Å; V60-A68 PolarHBondContact O-N 3.02Å; V60-A78 HydrophobicContact CG2-CB 3.89Å; V60-V80 HydrophobicContact CG1-CG2 3.65Å; V60-V93 HydrophobicContact CG1-CG2 4.39Å; V60-V93 HydrophobicContact CG2-CG2 4.31Å
61	C	95.8	Very high	90.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	146.4	-170.7	-66.5	0	0	0	0	111.9	N65 L91 S92	C61-N65 CarbonylContact C-O 3.58Å; C61-N65 VanDerWaalsContact CA-O 3.24Å; C61-N65 WeakPolarHBondContact CA-O 3.19Å; C61-L91 WeakPolarHBondContact O-CA 3.49Å; C61-S92 WeakPolarHBondContact CB-OG 3.26Å; C61-S92 PolarHBondContact N-O 2.8Å; C61-S92 PolarHBondContact O-N 2.79Å
62	V	94.7	Very high	91.8	Very high	11 Å²	11	47 Å²	47	7%	0.067	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	119.2	171.6	-174.1	0	0	0	0	108.6	G64 N65 R67 V80 V83 R90 L91	V62-G64 PolarHBondContact O-N 2.98Å; V62-N65 PolarHBondContact N-O 2.84Å; V62-N65 PolarHBondContact O-N 3.17Å; V62-R67 HydrophobicContact CB-CG 3.82Å; V62-R67 HydrophobicContact CG2-CB 4.1Å; V62-R67 HydrophobicContact CG2-CG 3.53Å; V62-V80 HydrophobicContact CG2-CG1 3.65Å; V62-V83 HydrophobicContact CG2-CG2 4.17Å; V62-R90 WeakPolarHBondContact CA-O 3.4Å; V62-L91 HydrophobicContact CG1-CD2 4.38Å; V62-L91 HydrophobicContact CG2-CD2 3.73Å
63	N	91.9	Very high	92.6	Very high	91 Å²	91	49.8 Å²	49.8	49%	0.487	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	41.8	-174.9	-56.8	-30.2	0	0	0	112	N65 R90	N63-N65 VanDerWaalsContact C-N 3.31Å; N63-N65 PolarHBondContact O-N 3.14Å; N63-N65 PolarHBondContact O-ND2 3.42Å; N63-R90 PolarHBondContact N-O 3.34Å; N63-R90 PolarHBondContact OD1-N 3.26Å
64	G	91.3	Very high	93.1	Very high	33 Å²	33	55.6 Å²	55.6	34%	0.34	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	-13	-179	0	0	0	0	0	116.3	V62 R94	V62-G64 PolarHBondContact O-N 2.98Å; G64-R94 PolarHBondContact O-NH2 2.77Å
65	N	94.4	Very high	93.5	Very high	109 Å²	109	58.7 Å²	58.7	58%	0.583	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.7	-179.5	-56.5	-75.8	0	0	0	111	C61 V62 N63 R67	C61-N65 CarbonylContact C-O 3.58Å; C61-N65 VanDerWaalsContact CA-O 3.24Å; C61-N65 WeakPolarHBondContact CA-O 3.19Å; V62-N65 PolarHBondContact N-O 2.84Å; V62-N65 PolarHBondContact O-N 3.17Å; N63-N65 VanDerWaalsContact C-N 3.31Å; N63-N65 PolarHBondContact O-N 3.14Å; N63-N65 PolarHBondContact O-ND2 3.42Å; N65-R67 PolarHBondContact O-N 3.39Å
66	V	95	Very high	93.8	Very high	62 Å²	62	59.1 Å²	59.1	38%	0.376	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	129	174.1	-172.9	0	0	0	0	109.6	H59 I69	H59-V66 HydrophobicContact CB-CG1 4.08Å; H59-V66 HydrophobicContact CB-CG2 4.18Å; V66-I69 HydrophobicContact CG1-CD1 4.4Å; V66-I69 HydrophobicContact CG1-CG1 3.87Å
67	R	94.7	Very high	94	Very high	128 Å²	128	59.8 Å²	59.8	48%	0.483	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	-32.4	177.3	-74.8	-62.3	-139.7	167	7.7	113.3	V60 V62 N65 V80 D82	V60-R67 PolarHBondContact O-N 2.83Å; V62-R67 HydrophobicContact CB-CG 3.82Å; V62-R67 HydrophobicContact CG2-CB 4.1Å; V62-R67 HydrophobicContact CG2-CG 3.53Å; N65-R67 PolarHBondContact O-N 3.39Å; R67-V80 HydrophobicContact CB-CG1 3.66Å; R67-V80 HydrophobicContact CG-CG1 4.17Å; R67-D82 PolarHBondContact NH2-O 3.48Å
68	A	94.7	Very high	94.1	Very high	22 Å²	22	57.2 Å²	57.2	18%	0.182	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	154.1	174.3	0	0	0	0	0	110.6	V60 A78	V60-A68 HydrophobicContact CB-CB 4.22Å; V60-A68 PolarHBondContact N-O 2.59Å; V60-A68 PolarHBondContact O-N 3.02Å; A68-A78 HydrophobicContact CB-CB 4.26Å
69	I	96.2	Very high	94.1	Very high	93 Å²	93	61.6 Å²	61.6	48%	0.477	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.1	176.7	-61.8	179.3	0	0	0	107.2	Q57 Y58 V66	Q57-I69 HydrophobicContact CB-CG2 4.26Å; Q57-I69 HydrophobicContact CG-CG2 4.4Å; Y58-I69 WeakPolarHBondContact O-CA 3.28Å; V66-I69 HydrophobicContact CG1-CD1 4.4Å; V66-I69 HydrophobicContact CG1-CG1 3.87Å
70	V	96.1	Very high	94	Very high	14 Å²	14	60.2 Å²	60.2	9%	0.085	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	114.3	-178.7	177.6	0	0	0	0	108.2	W45 Q57 Y58 A78	W45-V70 HydrophobicContact CH2-CB 4.25Å; W45-V70 HydrophobicContact CH2-CG2 3.96Å; W45-V70 HydrophobicContact CZ2-CB 4.2Å; W45-V70 HydrophobicContact CZ2-CG1 4.38Å; W45-V70 HydrophobicContact CZ2-CG2 4.42Å; Q57-V70 CarbonylContact C-O 3.57Å; Q57-V70 WeakPolarHBondContact CA-O 3.45Å; Y58-V70 PolarHBondContact N-O 2.69Å; Y58-V70 PolarHBondContact O-N 2.83Å; V70-A78 HydrophobicContact CG2-CB 4.1Å
71	P	94.5	Very high	93.8	Very high	50 Å²	50	66.4 Å²	66.4	33%	0.325	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	148.7	177.6	-21.3	32.5	0	0	0	111.4	C73 Y74	P71-C73 PolarHBondContact O-N 2.89Å; P71-C73 VanDerWaalsContact O-N 3.14Å; P71-Y74 HydrophobicContact CB-CD2 3.78Å; P71-Y74 HydrophobicContact CB-CE2 4.12Å; P71-Y74 HydrophobicContact CG-CD2 3.91Å; P71-Y74 HydrophobicContact CG-CE2 3.96Å; P71-Y74 WeakPolarHBondContact O-CB 3.38Å; P71-Y74 PolarHBondContact O-N 2.69Å
72	A	89.7	Confident	93.4	Very high	20 Å²	20	71.4 Å²	71.4	17%	0.165	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.5	-170.3	0	0	0	0	0	114.7	V55 L56 Y58 Y74	V55-A72 HydrophobicContact CB-CB 4.29Å; V55-A72 HydrophobicContact CG1-CB 4.16Å; V55-A72 WeakPolarHBondContact O-CB 3.25Å; L56-A72 WeakPolarHBondContact O-CB 3.13Å; L56-A72 PolarHBondContact O-N 3.22Å; Y58-A72 HydrophobicContact CE2-CB 4.4Å; A72-Y74 VanDerWaalsContact C-N 3.28Å
73	C	87	Confident	93.1	Very high	116 Å²	116	71 Å²	71	78%	0.784	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	4.1	173.6	58	0	0	0	0	114.4	P71	P71-C73 PolarHBondContact O-N 2.89Å; P71-C73 VanDerWaalsContact O-N 3.14Å
74	Y	90.5	Very high	92.8	Very high	153 Å²	153	69.6 Å²	69.6	60%	0.6	37%	0.37	S	S	*	.	S	Bend	trans	-101.3	156	174	-77.1	-124.9	0	0	0	110.3	P71 A72 T76	P71-Y74 HydrophobicContact CB-CD2 3.78Å; P71-Y74 HydrophobicContact CB-CE2 4.12Å; P71-Y74 HydrophobicContact CG-CD2 3.91Å; P71-Y74 HydrophobicContact CG-CE2 3.96Å; P71-Y74 WeakPolarHBondContact O-CB 3.38Å; P71-Y74 PolarHBondContact O-N 2.69Å; A72-Y74 VanDerWaalsContact C-N 3.28Å; Y74-T76 PolarHBondContact O-N 2.75Å
75	N	91	Very high	92.4	Very high	138 Å²	138	68.9 Å²	68.9	74%	0.738	36%	0.36	S	S	*	.			trans	-49.8	136	171.6	-65.7	-9.9	0	0	0	110.9	K77	N75-K77 PolarHBondContact O-N 3.45Å
76	T	95.1	Very high	91.9	Very high	22 Å²	22	67.5 Å²	67.5	14%	0.135	36%	0.359	C	S	.	.	S	Bend	trans	-73.9	56.4	-178.7	48.1	0	0	0	0	113.3	S44 W45 H47 Y58 Y74	S44-T76 CarbonylContact C-O 3.58Å; S44-T76 VanDerWaalsContact CA-O 3.23Å; S44-T76 WeakPolarHBondContact CA-O 3.39Å; W45-T76 PolarHBondContact N-O 2.64Å; W45-T76 WeakPolarHBondContact O-CB 3.43Å; W45-T76 PolarHBondContact O-OG1 2.94Å; H47-T76 WeakPolarHBondContact NE2-CG2 3.44Å; Y58-T76 HydrophobicContact CD2-CG2 4.48Å; Y58-T76 HydrophobicContact CE2-CG2 3.87Å; Y74-T76 PolarHBondContact O-N 2.75Å
77	K	96.7	Very high	91.6	Very high	100 Å²	100	70.2 Å²	70.2	44%	0.435	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.5	177.6	-52.3	-157.9	176.4	-164.2	0	110.8	E34 V43 N75	E34-K77 WeakPolarHBondContact OE1-CE 3.38Å; E34-K77 IonicContact OE1-NZ 2.66Å; E34-K77 PolarHBondContact OE1-NZ 3.41Å; E34-K77 IonicContact OE2-NZ 2.66Å; E34-K77 PolarHBondContact OE2-NZ 3.04Å; V43-K77 CarbonylContact O-C 3.59Å; V43-K77 VanDerWaalsContact O-CA 3.3Å; V43-K77 WeakPolarHBondContact O-CA 3.21Å; N75-K77 PolarHBondContact O-N 3.45Å
78	A	96.3	Very high	91.3	Very high	7 Å²	7	68 Å²	68	6%	0.058	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	138.2	171.6	0	0	0	0	0	111.2	V43 W45 V60 A68 V70 V80	V43-A78 HydrophobicContact CG1-CB 4.28Å; V43-A78 PolarHBondContact N-O 2.79Å; V43-A78 PolarHBondContact O-N 2.66Å; W45-A78 HydrophobicContact CH2-CB 4.08Å; W45-A78 HydrophobicContact CZ3-CB 4.05Å; V60-A78 HydrophobicContact CG2-CB 3.89Å; A68-A78 HydrophobicContact CB-CB 4.26Å; V70-A78 HydrophobicContact CG2-CB 4.1Å; A78-V80 HydrophobicContact CB-CG2 4.3Å
79	L	95.9	Very high	91.2	Very high	93 Å²	93	67.4 Å²	67.4	49%	0.487	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	120.5	157.9	-179.3	63.4	0	0	0	107.8	E81	L79-E81 HydrophobicContact CG-CG 4.45Å
80	V	95.1	Very high	91	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.012	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	116.6	179.5	-170.5	0	0	0	0	108.7	S40 V41 V43 V60 V62 R67 A78 V83	S40-V80 CarbonylContact C-O 3.56Å; S40-V80 WeakPolarHBondContact CA-O 3.41Å; S40-V80 VanDerWaalsContact CB-O 3.25Å; S40-V80 WeakPolarHBondContact CB-O 3.42Å; V41-V80 PolarHBondContact N-O 3.39Å; V41-V80 PolarHBondContact O-N 2.68Å; V43-V80 HydrophobicContact CG1-CG2 3.81Å; V60-V80 HydrophobicContact CG1-CG2 3.65Å; V62-V80 HydrophobicContact CG2-CG1 3.65Å; R67-V80 HydrophobicContact CB-CG1 3.66Å; R67-V80 HydrophobicContact CG-CG1 4.17Å; A78-V80 HydrophobicContact CB-CG2 4.3Å; V80-V83 HydrophobicContact CB-CG2 4.14Å; V80-V83 HydrophobicContact CG1-CG2 3.65Å
81	E	92.7	Very high	91	Very high	131 Å²	131	63.5 Å²	63.5	61%	0.612	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	166.7	-179.7	-58.7	-166.6	148.5	0	0	112.7	L79 V83	L79-E81 HydrophobicContact CG-CG 4.45Å; E81-V83 VanDerWaalsContact C-N 3.35Å; E81-V83 PolarHBondContact O-N 3.36Å
82	D	88	Confident	91.1	Very high	104 Å²	104	61.1 Å²	61.1	56%	0.556	33%	0.325	S	S	*	.	S	Bend	trans	48.4	50.8	-173.6	-74.2	-29.2	0	0	0	114	K39 R67	K39-D82 CarbonylContact O-C 3.28Å; K39-D82 WeakPolarHBondContact O-CA 3.32Å; K39-D82 PolarHBondContact O-N 2.88Å; R67-D82 PolarHBondContact NH2-O 3.48Å
83	V	89	Confident	91.4	Very high	2 Å²	2	60.1 Å²	60.1	1%	0.012	32%	0.317	C	S	.	.			trans	-107.1	104.3	171.3	-174.3	0	0	0	0	109.2	K39 V41 V62 V80 E81 C85 I111	K39-V83 CarbonylContact C-O 3.59Å; K39-V83 VanDerWaalsContact C-O 3.28Å; K39-V83 WeakPolarHBondContact CA-O 3.49Å; K39-V83 PolarHBondContact O-N 2.99Å; V41-V83 HydrophobicContact CG2-CB 4.01Å; V41-V83 HydrophobicContact CG2-CG1 3.8Å; V41-V83 HydrophobicContact CG2-CG2 4.4Å; V62-V83 HydrophobicContact CG2-CG2 4.17Å; V80-V83 HydrophobicContact CB-CG2 4.14Å; V80-V83 HydrophobicContact CG1-CG2 3.65Å; E81-V83 VanDerWaalsContact C-N 3.35Å; E81-V83 PolarHBondContact O-N 3.36Å; V83-C85 PolarHBondContact O-N 2.92Å; V83-C85 PolarHBondContact O-SG 3.19Å; V83-I111 HydrophobicContact CG1-CD1 3.76Å
84	D	85.8	Confident	91.8	Very high	62 Å²	62	56.1 Å²	56.1	33%	0.332	29%	0.285	S	S	.	.			trans	-75.6	89.8	179.3	-176.6	2.2	0	0	0	111.5	S86 K87	D84-S86 PolarHBondContact O-N 3.18Å; D84-S86 VanDerWaalsContact O-N 3.12Å; D84-S86 WeakPolarHBondContact OD1-CB 3.35Å; D84-S86 PolarHBondContact OD1-N 3.41Å; D84-S86 PolarHBondContact OD1-OG 3.06Å; D84-S86 PolarHBondContact OD2-OG 2.97Å; D84-K87 PolarHBondContact O-N 2.97Å; D84-K87 VanDerWaalsContact O-N 3.14Å; D84-K87 IonicContact OD2-NZ 3.42Å; D84-K87 PolarHBondContact OD2-NZ 3.1Å
85	C	81.5	Confident	91.9	Very high	19 Å²	19	48.8 Å²	48.8	13%	0.128	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-6.5	-178.7	-65.7	0	0	0	0	114.3	Q36 L37 V83 K87 G112 K113	Q36-C85 HydrophobicContact CG-CB 4.22Å; Q36-C85 VanDerWaalsContact CG-SG 3.58Å; Q36-C85 VanDerWaalsContact NE2-CB 3.33Å; Q36-C85 PolarHBondContact NE2-SG 3.45Å; L37-C85 PolarHBondContact O-SG 3.1Å; L37-C85 VanDerWaalsContact O-SG 3.41Å; V83-C85 PolarHBondContact O-N 2.92Å; V83-C85 PolarHBondContact O-SG 3.19Å; C85-K87 PolarHBondContact O-N 3.02Å; C85-G112 VanDerWaalsContact O-CA 3.28Å; C85-G112 WeakPolarHBondContact O-CA 3.44Å; C85-K113 PolarHBondContact O-N 2.75Å
86	S	85	Confident	92.1	Very high	80 Å²	80	43.1 Å²	43.1	56%	0.559	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.3	171.7	74.3	0	0	0	0	113.4	D84	D84-S86 PolarHBondContact O-N 3.18Å; D84-S86 VanDerWaalsContact O-N 3.12Å; D84-S86 WeakPolarHBondContact OD1-CB 3.35Å; D84-S86 PolarHBondContact OD1-N 3.41Å; D84-S86 PolarHBondContact OD1-OG 3.06Å; D84-S86 PolarHBondContact OD2-OG 2.97Å
87	K	87.2	Confident	91.9	Very high	119 Å²	119	42.4 Å²	42.4	52%	0.517	22%	0.222	S	C	.	.	S	Bend	trans	-118.2	153.8	179.6	-59.1	-171.5	-178.4	87.5	0	110.6	D84 C85 S89	D84-K87 PolarHBondContact O-N 2.97Å; D84-K87 VanDerWaalsContact O-N 3.14Å; D84-K87 IonicContact OD2-NZ 3.42Å; D84-K87 PolarHBondContact OD2-NZ 3.1Å; C85-K87 PolarHBondContact O-N 3.02Å; K87-S89 PolarHBondContact O-N 3.3Å; K87-S89 VanDerWaalsContact O-N 3.17Å
88	P	89.7	Confident	91.4	Very high	81 Å²	81	44.3 Å²	44.3	53%	0.526	24%	0.237	S	C	.	.			trans	-60.2	120.8	168.7	27.1	-35.1	0	0	0	109.3	I111 K113	P88-I111 WeakPolarHBondContact CA-O 3.45Å; P88-K113 WeakPolarHBondContact CD-O 3.35Å
89	S	91.6	Very high	90.8	Very high	10 Å²	10	47.6 Å²	47.6	7%	0.07	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	142.6	177.4	-65.8	0	0	0	0	109.6	K87 I111	K87-S89 PolarHBondContact O-N 3.3Å; K87-S89 VanDerWaalsContact O-N 3.17Å; S89-I111 PolarHBondContact N-O 3.04Å; S89-I111 WeakPolarHBondContact O-CG1 3.45Å; S89-I111 PolarHBondContact O-N 2.89Å
90	R	93.4	Very high	90.5	Very high	24 Å²	24	44.7 Å²	44.7	9%	0.091	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	117.1	-178.6	179	173.2	-79.3	-74.7	10	109.8	V62 N63 T108 E120 Y137 P138	V62-R90 WeakPolarHBondContact CA-O 3.4Å; N63-R90 PolarHBondContact N-O 3.34Å; N63-R90 PolarHBondContact OD1-N 3.26Å; R90-T108 WeakPolarHBondContact CG-OG1 3.48Å; R90-T108 PolarHBondContact NH1-OG1 3.19Å; R90-E120 IonicContact CZ-OE2 3.4Å; R90-E120 IonicContact NE-OE2 3.03Å; R90-E120 IonicContact NH2-OE2 3.69Å; R90-E120 PolarHBondContact NH2-OE2 2.81Å; R90-Y137 VanDerWaalsContact CD-CE1 3.48Å; R90-Y137 VanDerWaalsContact CZ-CD1 3.49Å; R90-P138 PolarHBondContact NH1-O 3.06Å; R90-P138 PolarHBondContact NH2-O 2.83Å
91	L	95.3	Very high	90.3	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	147.3	169	-56.1	-175.1	0	0	0	109.7	I31 V33 V41 V43 C61 V62 T108 I109 I111	I31-L91 HydrophobicContact CD1-CB 4.29Å; V33-L91 HydrophobicContact CG2-CD1 4.04Å; V41-L91 HydrophobicContact CG1-CD1 4.11Å; V43-L91 HydrophobicContact CB-CD1 4.38Å; V43-L91 HydrophobicContact CG2-CD1 4.3Å; C61-L91 WeakPolarHBondContact O-CA 3.49Å; V62-L91 HydrophobicContact CG1-CD2 4.38Å; V62-L91 HydrophobicContact CG2-CD2 3.73Å; L91-T108 CarbonylContact O-C 3.58Å; L91-T108 WeakPolarHBondContact O-CA 3.27Å; L91-T108 WeakPolarHBondContact O-CB 3.19Å; L91-T108 PolarHBondContact O-OG1 3.32Å; L91-I109 HydrophobicContact CB-CG2 4.04Å; L91-I109 HydrophobicContact CD1-CG2 4.38Å; L91-I109 PolarHBondContact N-O 3.22Å; L91-I109 PolarHBondContact O-N 2.93Å; L91-I111 HydrophobicContact CD1-CD1 3.92Å; L91-I111 HydrophobicContact CD1-CG1 4.47Å; L91-I111 HydrophobicContact CD1-CG2 4.23Å; L91-I111 HydrophobicContact CD2-CD1 4.01Å; L91-I111 HydrophobicContact CG-CD1 3.84Å; L91-I111 HydrophobicContact CG-CG1 4.11Å; L91-I111 HydrophobicContact CG-CG2 4.43Å
92	S	96.1	Very high	90.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	158.2	165.6	51.2	0	0	0	0	111.1	C61 D104 C107	C61-S92 WeakPolarHBondContact CB-OG 3.26Å; C61-S92 PolarHBondContact N-O 2.8Å; C61-S92 PolarHBondContact O-N 2.79Å; S92-D104 WeakPolarHBondContact CB-OD1 3.48Å; S92-D104 VanDerWaalsContact OG-CG 3.23Å; S92-D104 PolarHBondContact OG-OD1 2.91Å; S92-C107 CarbonylContact C-O 3.6Å; S92-C107 WeakPolarHBondContact CA-O 3.39Å; S92-C107 VanDerWaalsContact CB-O 3.25Å; S92-C107 WeakPolarHBondContact CB-O 3.39Å
93	V	96.8	Very high	90.5	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.6	172.8	-174.5	0	0	0	0	108.7	P28 I31 W45 Y58 H59 V60 C107	P28-V93 HydrophobicContact CB-CG1 4.34Å; P28-V93 HydrophobicContact CG-CB 4.28Å; P28-V93 HydrophobicContact CG-CG1 3.91Å; I31-V93 HydrophobicContact CD1-CG2 3.86Å; I31-V93 HydrophobicContact CG1-CG2 4.37Å; W45-V93 HydrophobicContact CD2-CB 4.46Å; W45-V93 HydrophobicContact CD2-CG1 3.92Å; W45-V93 HydrophobicContact CD2-CG2 4Å; W45-V93 HydrophobicContact CE3-CG1 4.37Å; W45-V93 HydrophobicContact CE3-CG2 3.77Å; W45-V93 HydrophobicContact CG-CG1 4.23Å; W45-V93 HydrophobicContact CG-CG2 4.42Å; W45-V93 HydrophobicContact CZ2-CG1 4.23Å; W45-V93 HydrophobicContact CZ3-CG2 4.26Å; Y58-V93 HydrophobicContact CD1-CG1 4.21Å; Y58-V93 HydrophobicContact CG-CG1 4.43Å; H59-V93 WeakPolarHBondContact O-CA 3.44Å; V60-V93 HydrophobicContact CG1-CG2 4.39Å; V60-V93 HydrophobicContact CG2-CG2 4.31Å; V93-C107 PolarHBondContact N-O 2.87Å
94	R	94.6	Very high	90.7	Very high	31 Å²	31	41 Å²	41	12%	0.117	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132	172.8	-50	-175.4	-170.2	151.5	12.7	109.6	Y58 H59 G64 H101 S102 D104	Y58-R94 CarbonylContact C-O 3.52Å; Y58-R94 VanDerWaalsContact CA-O 3.25Å; Y58-R94 WeakPolarHBondContact CA-O 3.3Å; H59-R94 HydrophobicContact CB-CB 4.42Å; H59-R94 PolarHBondContact N-O 2.97Å; H59-R94 PolarHBondContact O-N 3.19Å; G64-R94 PolarHBondContact O-NH2 2.77Å; R94-H101 HydrophobicContact CB-CB 4.32Å; R94-H101 PolarHBondContact NH1-NE2 2.88Å; R94-S102 VanDerWaalsContact CA-OG 3.31Å; R94-S102 WeakPolarHBondContact CA-OG 3.43Å; R94-S102 WeakPolarHBondContact CB-O 3.23Å; R94-S102 WeakPolarHBondContact CD-O 3.39Å; R94-S102 VanDerWaalsContact CG-O 3.23Å; R94-S102 WeakPolarHBondContact CG-O 3.11Å; R94-D104 WeakPolarHBondContact CG-OD1 3.37Å; R94-D104 IonicContact CZ-OD1 3.23Å; R94-D104 IonicContact CZ-OD2 3.64Å; R94-D104 VanDerWaalsContact NE-CG 3.27Å; R94-D104 IonicContact NE-OD1 2.8Å; R94-D104 PolarHBondContact NE-OD1 3.06Å; R94-D104 IonicContact NE-OD2 2.95Å; R94-D104 PolarHBondContact NE-OD2 3.41Å; R94-D104 IonicContact NH2-OD1 2.74Å; R94-D104 PolarHBondContact NH2-OD1 3.48Å; R94-D104 IonicContact NH2-OD2 3.45Å; R94-D104 PolarHBondContact NH2-OD2 2.8Å
95	S	94	Very high	91	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	148.3	156.4	-59.9	0	0	0	0	109.1	P26 P28 H101 S102	P26-S95 WeakPolarHBondContact O-CB 3.38Å; P26-S95 PolarHBondContact O-OG 3.02Å; P28-S95 WeakPolarHBondContact CD-OG 3.31Å; P28-S95 WeakPolarHBondContact CG-OG 3.33Å; S95-H101 CarbonylContact O-C 3.47Å; S95-H101 WeakPolarHBondContact O-CA 3.43Å; S95-H101 WeakPolarHBondContact O-CB 3.16Å; S95-S102 PolarHBondContact N-OG 2.64Å; S95-S102 PolarHBondContact O-N 2.83Å
96	V	93.7	Very high	91.5	Very high	19 Å²	19	38 Å²	38	12%	0.115	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.6	174.6	-172	0	0	0	0	109.4	L56 Q57 H59 G100 H101	L56-V96 PolarHBondContact N-O 2.93Å; Q57-V96 HydrophobicContact CG-CB 3.8Å; Q57-V96 HydrophobicContact CG-CG1 4.39Å; Q57-V96 HydrophobicContact CG-CG2 4.18Å; Q57-V96 WeakPolarHBondContact O-CB 3.41Å; Q57-V96 PolarHBondContact O-N 3.34Å; H59-V96 HydrophobicContact CB-CG2 4.3Å; V96-G100 WeakPolarHBondContact CA-O 3.27Å; V96-H101 HydrophobicContact CG2-CB 4.03Å
97	T	91.1	Very high	91.9	Very high	6 Å²	6	34.1 Å²	34.1	4%	0.037	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	170.2	-178.6	56.1	0	0	0	0	108.5	V25 I53 P54 V55 S99 G100	V25-T97 HydrophobicContact CG1-CG2 3.79Å; V25-T97 WeakPolarHBondContact CG2-OG1 3.48Å; I53-T97 HydrophobicContact CB-CG2 4.38Å; I53-T97 HydrophobicContact CG2-CG2 3.62Å; P54-T97 WeakPolarHBondContact O-CG2 3.35Å; V55-T97 HydrophobicContact CG2-CG2 4.45Å; T97-S99 PolarHBondContact O-N 3.14Å; T97-S99 VanDerWaalsContact O-N 3.16Å; T97-S99 PolarHBondContact OG1-OG 2.95Å; T97-G100 PolarHBondContact N-O 2.76Å; T97-G100 PolarHBondContact O-N 2.86Å; T97-G100 PolarHBondContact OG1-O 2.88Å
98	D	87	Confident	92.3	Very high	141 Å²	141	28.5 Å²	28.5	75%	0.754	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.9	174.7	-59	-74	0	0	0	113.1	G100	D98-G100 VanDerWaalsContact C-N 3.33Å
99	S	84.1	Confident	92.5	Very high	75 Å²	75	25.4 Å²	25.4	52%	0.524	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.9	175.2	55.2	0	0	0	0	115.1	T97	T97-S99 PolarHBondContact O-N 3.14Å; T97-S99 VanDerWaalsContact O-N 3.16Å; T97-S99 PolarHBondContact OG1-OG 2.95Å
100	G	89.1	Confident	92.6	Very high	33 Å²	33	25.4 Å²	25.4	34%	0.34	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	127.6	-146.1	178.2	0	0	0	0	0	113.5	V96 T97 D98	V96-G100 WeakPolarHBondContact CA-O 3.27Å; T97-G100 PolarHBondContact N-O 2.76Å; T97-G100 PolarHBondContact O-N 2.86Å; T97-G100 PolarHBondContact OG1-O 2.88Å; D98-G100 VanDerWaalsContact C-N 3.33Å
101	H	91.5	Very high	92.5	Very high	93 Å²	93	24.7 Å²	24.7	43%	0.431	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150.6	-177.5	65.5	28.1	0	0	0	113.5	R94 S95 V96	R94-H101 HydrophobicContact CB-CB 4.32Å; R94-H101 PolarHBondContact NH1-NE2 2.88Å; S95-H101 CarbonylContact O-C 3.47Å; S95-H101 WeakPolarHBondContact O-CA 3.43Å; S95-H101 WeakPolarHBondContact O-CB 3.16Å; V96-H101 HydrophobicContact CG2-CB 4.03Å
102	S	91.6	Very high	92	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.152	C	C	.	.			trans	-69	143.7	176.5	71.8	0	0	0	0	111.2	R94 S95	R94-S102 VanDerWaalsContact CA-OG 3.31Å; R94-S102 WeakPolarHBondContact CA-OG 3.43Å; R94-S102 WeakPolarHBondContact CB-O 3.23Å; R94-S102 WeakPolarHBondContact CD-O 3.39Å; R94-S102 VanDerWaalsContact CG-O 3.23Å; R94-S102 WeakPolarHBondContact CG-O 3.11Å; S95-S102 PolarHBondContact N-OG 2.64Å; S95-S102 PolarHBondContact O-N 2.83Å
103	P	91.3	Very high	91.3	Very high	45 Å²	45	31.5 Å²	31.5	29%	0.292	18%	0.179	S	C	.	.			trans	-71.5	136.4	-178.4	26.8	-33.4	0	0	0	112.5	A105 A106 Y162	P103-A105 VanDerWaalsContact C-N 3.28Å; P103-A105 PolarHBondContact O-N 3.34Å; P103-A105 VanDerWaalsContact O-N 3.14Å; P103-A106 WeakPolarHBondContact O-CB 3.46Å; P103-A106 PolarHBondContact O-N 3.13Å; P103-A106 VanDerWaalsContact O-N 3.09Å; P103-Y162 HydrophobicContact CG-CE1 4.42Å; P103-Y162 WeakPolarHBondContact CG-OH 3.38Å
104	D	93.4	Very high	90.6	Very high	24 Å²	24	37 Å²	37	13%	0.128	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-52	-39.9	-174.1	-70.7	-52.3	0	0	0	114.5	S92 R94 A106 C107 Y137	S92-D104 WeakPolarHBondContact CB-OD1 3.48Å; S92-D104 VanDerWaalsContact OG-CG 3.23Å; S92-D104 PolarHBondContact OG-OD1 2.91Å; R94-D104 WeakPolarHBondContact CG-OD1 3.37Å; R94-D104 IonicContact CZ-OD1 3.23Å; R94-D104 IonicContact CZ-OD2 3.64Å; R94-D104 VanDerWaalsContact NE-CG 3.27Å; R94-D104 IonicContact NE-OD1 2.8Å; R94-D104 PolarHBondContact NE-OD1 3.06Å; R94-D104 IonicContact NE-OD2 2.95Å; R94-D104 PolarHBondContact NE-OD2 3.41Å; R94-D104 IonicContact NH2-OD1 2.74Å; R94-D104 PolarHBondContact NH2-OD1 3.48Å; R94-D104 IonicContact NH2-OD2 3.45Å; R94-D104 PolarHBondContact NH2-OD2 2.8Å; D104-A106 PolarHBondContact O-N 3.4Å; D104-C107 CarbonylContact O-C 3.56Å; D104-C107 VanDerWaalsContact O-C 3.29Å; D104-C107 PolarHBondContact O-N 3.12Å; D104-Y137 WeakPolarHBondContact CB-OH 3.45Å
105	A	93.1	Very high	90.1	Very high	9 Å²	9	36.2 Å²	36.2	7%	0.074	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-63.7	-14.5	-175.8	0	0	0	0	0	113.9	P103 Y137 P138 Y162	P103-A105 VanDerWaalsContact C-N 3.28Å; P103-A105 PolarHBondContact O-N 3.34Å; P103-A105 VanDerWaalsContact O-N 3.14Å; A105-Y137 HydrophobicContact CB-CD1 4.14Å; A105-Y137 HydrophobicContact CB-CE1 4.28Å; A105-Y137 HydrophobicContact CB-CG 4.29Å; A105-P138 WeakPolarHBondContact O-CG 3.35Å; A105-Y162 HydrophobicContact CB-CD1 3.99Å; A105-Y162 HydrophobicContact CB-CD2 3.51Å; A105-Y162 HydrophobicContact CB-CE1 4.3Å; A105-Y162 HydrophobicContact CB-CE2 3.85Å; A105-Y162 HydrophobicContact CB-CG 3.6Å
106	A	91.5	Very high	89.7	Confident	7 Å²	7	37.8 Å²	37.8	6%	0.058	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-73.3	-29.3	171.9	0	0	0	0	0	113	C27 P103 D104 S141 Y162	C27-A106 HydrophobicContact CB-CB 3.7Å; P103-A106 WeakPolarHBondContact O-CB 3.46Å; P103-A106 PolarHBondContact O-N 3.13Å; P103-A106 VanDerWaalsContact O-N 3.09Å; D104-A106 PolarHBondContact O-N 3.4Å; A106-S141 VanDerWaalsContact O-CB 3.3Å; A106-S141 WeakPolarHBondContact O-CB 3.4Å; A106-Y162 HydrophobicContact CB-CD1 4.37Å; A106-Y162 HydrophobicContact CB-CE1 3.93Å
107	C	94	Very high	89.5	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-147.1	87.3	-173.5	-163.9	0	0	0	0	110.6	P28 S92 V93 D104 S141	P28-C107 HydrophobicContact CB-CB 4.47Å; P28-C107 VanDerWaalsContact O-CB 3.27Å; P28-C107 WeakPolarHBondContact O-CB 3.31Å; P28-C107 PolarHBondContact O-SG 2.92Å; S92-C107 CarbonylContact C-O 3.6Å; S92-C107 WeakPolarHBondContact CA-O 3.39Å; S92-C107 VanDerWaalsContact CB-O 3.25Å; S92-C107 WeakPolarHBondContact CB-O 3.39Å; V93-C107 PolarHBondContact N-O 2.87Å; D104-C107 CarbonylContact O-C 3.56Å; D104-C107 VanDerWaalsContact O-C 3.29Å; D104-C107 PolarHBondContact O-N 3.12Å; C107-S141 WeakPolarHBondContact CA-OG 3.21Å
108	T	95.6	Very high	89.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	151.3	-172.1	-175.6	0	0	0	0	112.7	R90 L91 Y137 P138 S140 S141	R90-T108 WeakPolarHBondContact CG-OG1 3.48Å; R90-T108 PolarHBondContact NH1-OG1 3.19Å; L91-T108 CarbonylContact O-C 3.58Å; L91-T108 WeakPolarHBondContact O-CA 3.27Å; L91-T108 WeakPolarHBondContact O-CB 3.19Å; L91-T108 PolarHBondContact O-OG1 3.32Å; T108-Y137 HydrophobicContact CG2-CD1 4.18Å; T108-Y137 HydrophobicContact CG2-CE1 3.85Å; T108-P138 HydrophobicContact CG2-CG 3.77Å; T108-S140 CarbonylContact O-C 3.56Å; T108-S140 VanDerWaalsContact O-CA 3.31Å; T108-S140 WeakPolarHBondContact O-CA 3.46Å; T108-S141 PolarHBondContact N-OG 3.47Å; T108-S141 PolarHBondContact O-N 2.89Å; T108-S141 PolarHBondContact O-OG 3.22Å
109	I	94.4	Very high	89.9	Confident	16 Å²	16	30.6 Å²	30.6	8%	0.082	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	134.3	170.7	-172.4	164.9	0	0	0	111	I31 V33 L91 I111 G139	I31-I109 HydrophobicContact CD1-CG2 3.98Å; I31-I109 HydrophobicContact CG1-CG2 4.05Å; I31-I109 HydrophobicContact CG2-CB 4.19Å; I31-I109 HydrophobicContact CG2-CG2 4.26Å; V33-I109 HydrophobicContact CG2-CG2 4.19Å; L91-I109 HydrophobicContact CB-CG2 4.04Å; L91-I109 HydrophobicContact CD1-CG2 4.38Å; L91-I109 PolarHBondContact N-O 3.22Å; L91-I109 PolarHBondContact O-N 2.93Å; I109-I111 HydrophobicContact CG1-CG2 4.48Å; I109-I111 HydrophobicContact CG2-CG2 4.29Å; I109-G139 CarbonylContact C-O 3.6Å
110	T	93.4	Very high	90.3	Very high	10 Å²	10	30.5 Å²	30.5	6%	0.061	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	135.9	168.6	54.7	0	0	0	0	110.6	S116 G139	T110-S116 PolarHBondContact OG1-O 3.32Å; T110-G139 PolarHBondContact N-O 2.89Å; T110-G139 PolarHBondContact OG1-O 2.84Å; T110-G139 VanDerWaalsContact OG1-O 3.14Å
111	I	91.5	Very high	90.5	Very high	10 Å²	10	35.1 Å²	35.1	5%	0.051	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	170	-176.4	61.6	157.4	0	0	0	111.1	V33 V41 V83 P88 S89 L91 I109	V33-I111 HydrophobicContact CG2-CG2 3.88Å; V41-I111 HydrophobicContact CG2-CD1 3.82Å; V83-I111 HydrophobicContact CG1-CD1 3.76Å; P88-I111 WeakPolarHBondContact CA-O 3.45Å; S89-I111 PolarHBondContact N-O 3.04Å; S89-I111 WeakPolarHBondContact O-CG1 3.45Å; S89-I111 PolarHBondContact O-N 2.89Å; L91-I111 HydrophobicContact CD1-CD1 3.92Å; L91-I111 HydrophobicContact CD1-CG1 4.47Å; L91-I111 HydrophobicContact CD1-CG2 4.23Å; L91-I111 HydrophobicContact CD2-CD1 4.01Å; L91-I111 HydrophobicContact CG-CD1 3.84Å; L91-I111 HydrophobicContact CG-CG1 4.11Å; L91-I111 HydrophobicContact CG-CG2 4.43Å; I109-I111 HydrophobicContact CG1-CG2 4.48Å; I109-I111 HydrophobicContact CG2-CG2 4.29Å
112	G	85.3	Confident	90.6	Very high	13 Å²	13	31.3 Å²	31.3	13%	0.134	17%	0.168	C	C	.	.	S	Bend	trans	84	172.5	178.2	0	0	0	0	0	112.4	C85 S115	C85-G112 VanDerWaalsContact O-CA 3.28Å; C85-G112 WeakPolarHBondContact O-CA 3.44Å; G112-S115 WeakPolarHBondContact O-CB 3.12Å; G112-S115 PolarHBondContact O-OG 3.25Å
113	K	80.7	Confident	90.8	Very high	130 Å²	130	35.7 Å²	35.7	57%	0.565	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	144.4	-176.2	-154.3	-156.6	164.7	-132.6	0	110.9	C85 P88 S115	C85-K113 PolarHBondContact O-N 2.75Å; P88-K113 WeakPolarHBondContact CD-O 3.35Å; K113-S115 PolarHBondContact O-N 3.47Å; K113-S115 VanDerWaalsContact O-N 3.15Å
114	D	81.1	Confident	90.9	Very high	115 Å²	115	34 Å²	34	62%	0.615	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	26.8	174.8	-48.9	-34.8	0	0	0	113.6
115	S	84.7	Confident	90.8	Very high	14 Å²	14	36.5 Å²	36.5	10%	0.098	19%	0.187	C	C	.	.			trans	-67.4	132.4	175.5	40.9	0	0	0	0	113	G112 K113 K191	G112-S115 WeakPolarHBondContact O-CB 3.12Å; G112-S115 PolarHBondContact O-OG 3.25Å; K113-S115 PolarHBondContact O-N 3.47Å; K113-S115 VanDerWaalsContact O-N 3.15Å; S115-K191 PolarHBondContact O-NZ 2.96Å
116	S	85.2	Confident	90.6	Very high	34 Å²	34	39.5 Å²	39.5	24%	0.238	21%	0.207	C	C	.	.			trans	-69.7	134.4	176	-174.3	0	0	0	0	111.3	T110 E120	T110-S116 PolarHBondContact OG1-O 3.32Å; S116-E120 VanDerWaalsContact CB-OE1 3.27Å; S116-E120 WeakPolarHBondContact CB-OE1 3.44Å
117	V	90.1	Very high	90.4	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.018	22%	0.215	C	C	.	.			trans	-102.5	-25.6	173.3	-180	0	0	0	0	111.1	V181 D183 A186 K191	V117-V181 HydrophobicContact CG1-CG1 3.88Å; V117-V181 WeakPolarHBondContact O-CG1 3.31Å; V117-D183 HydrophobicContact CG1-CB 3.53Å; V117-D183 WeakPolarHBondContact CG1-OD2 3.25Å; V117-A186 HydrophobicContact CB-CB 4.2Å; V117-A186 HydrophobicContact CG1-CB 3.85Å; V117-K191 HydrophobicContact CG2-CD 3.76Å
118	A	91.6	Very high	89.9	Confident	8 Å²	8	43.5 Å²	43.5	7%	0.066	23%	0.229	C	C	.	.	S	Bend	trans	-57.7	145.7	174.3	0	0	0	0	0	112.3	E120 P192	A118-E120 PolarHBondContact O-N 2.83Å; A118-P192 HydrophobicContact CB-CB 4.35Å; A118-P192 WeakPolarHBondContact CB-O 3.43Å; A118-P192 PolarHBondContact N-O 3.14Å
119	P	94.2	Very high	89.3	Confident	4 Å²	4	45 Å²	45	3%	0.026	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-57.9	125.4	166	-27.7	38.6	0	0	0	112.2	V122 W136 V179 V181 V193 G195	P119-V122 HydrophobicContact CB-CG2 4.25Å; P119-W136 HydrophobicContact CB-CB 4.22Å; P119-W136 HydrophobicContact CB-CG 4.18Å; P119-V179 HydrophobicContact CB-CB 4.14Å; P119-V179 HydrophobicContact CB-CG1 4.04Å; P119-V179 HydrophobicContact CG-CB 4.21Å; P119-V179 HydrophobicContact CG-CG1 3.84Å; P119-V179 WeakPolarHBondContact CG-O 3.46Å; P119-V181 HydrophobicContact CG-CB 4.4Å; P119-V193 WeakPolarHBondContact CD-O 3.49Å; P119-G195 WeakPolarHBondContact O-CA 3.34Å
120	E	92.6	Very high	89	Confident	73 Å²	73	47.5 Å²	47.5	34%	0.341	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	167.9	178.6	-66.9	172	158.5	0	0	110.5	R90 S116 A118 V122 Y137	R90-E120 IonicContact CZ-OE2 3.4Å; R90-E120 IonicContact NE-OE2 3.03Å; R90-E120 IonicContact NH2-OE2 3.69Å; R90-E120 PolarHBondContact NH2-OE2 2.81Å; S116-E120 VanDerWaalsContact CB-OE1 3.27Å; S116-E120 WeakPolarHBondContact CB-OE1 3.44Å; A118-E120 PolarHBondContact O-N 2.83Å; E120-V122 PolarHBondContact O-N 3.44Å; E120-Y137 PolarHBondContact N-O 2.65Å; E120-Y137 PolarHBondContact O-N 2.79Å
121	E	92.9	Very high	88.9	Confident	129 Å²	129	48.2 Å²	48.2	60%	0.603	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47.6	30.1	177.2	-58.5	-163.6	176.5	0	0	116.6	K123	E121-K123 PolarHBondContact O-N 3.44Å; E121-K123 IonicContact OE2-NZ 2.68Å
122	V	95.2	Very high	88.9	Confident	13 Å²	13	47.8 Å²	47.8	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	123.1	175	-174.6	0	0	0	0	109.2	P119 E120 V134 S135 W136 V179 Y197	P119-V122 HydrophobicContact CB-CG2 4.25Å; E120-V122 PolarHBondContact O-N 3.44Å; V122-V134 HydrophobicContact CG1-CG1 4.47Å; V122-S135 WeakPolarHBondContact CA-O 3.21Å; V122-W136 HydrophobicContact CG2-CB 3.91Å; V122-V179 HydrophobicContact CG1-CG2 3.77Å; V122-V179 HydrophobicContact CG2-CB 4.24Å; V122-V179 HydrophobicContact CG2-CG2 4.12Å; V122-Y197 WeakPolarHBondContact O-CB 3.43Å; V122-Y197 WeakPolarHBondContact O-CD2 3.36Å
123	K	95.4	Very high	89.3	Confident	93 Å²	93	49.5 Å²	49.5	40%	0.404	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	139.1	-177	62.7	-161.2	170.9	-157.6	0	112	E121 V134 S135 Y197	E121-K123 PolarHBondContact O-N 3.44Å; E121-K123 IonicContact OE2-NZ 2.68Å; K123-V134 WeakPolarHBondContact O-CA 3.4Å; K123-S135 WeakPolarHBondContact CE-OG 3.43Å; K123-S135 VanDerWaalsContact CG-OG 3.32Å; K123-S135 WeakPolarHBondContact CG-OG 3.34Å; K123-S135 PolarHBondContact N-O 3.26Å; K123-S135 PolarHBondContact O-N 2.99Å; K123-Y197 HydrophobicContact CB-CD2 4.5Å; K123-Y197 HydrophobicContact CB-CE2 4.45Å
124	A	93.9	Very high	90	Very high	8 Å²	8	43.3 Å²	43.3	7%	0.066	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136	172.2	0	0	0	0	0	111	I127 Q133 V134 Y197 F199	A124-I127 HydrophobicContact CB-CD1 4.44Å; A124-Q133 CarbonylContact C-O 3.53Å; A124-Q133 VanDerWaalsContact CA-O 3.26Å; A124-Q133 WeakPolarHBondContact CA-O 3.46Å; A124-V134 HydrophobicContact CB-CG2 4.19Å; A124-Y197 HydrophobicContact CB-CD1 3.68Å; A124-Y197 HydrophobicContact CB-CE1 3.86Å; A124-Y197 VanDerWaalsContact N-CD1 3.33Å; A124-F199 HydrophobicContact CB-CB 4Å; A124-F199 HydrophobicContact CB-CD1 3.73Å; A124-F199 HydrophobicContact CB-CD2 4.44Å; A124-F199 HydrophobicContact CB-CE1 4.3Å; A124-F199 HydrophobicContact CB-CG 3.81Å
125	F	91.5	Very high	90.7	Very high	78 Å²	78	38.5 Å²	38.5	34%	0.342	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	179.1	-178.5	65.1	-77.5	0	0	0	110.6	I127 Q133 H163	F125-I127 PolarHBondContact O-N 2.9Å; F125-I127 VanDerWaalsContact O-N 3.09Å; F125-Q133 HydrophobicContact CD1-CB 4.15Å; F125-Q133 HydrophobicContact CD2-CB 4.11Å; F125-Q133 HydrophobicContact CE1-CB 3.9Å; F125-Q133 HydrophobicContact CE2-CB 3.87Å; F125-Q133 HydrophobicContact CG-CB 4.25Å; F125-Q133 HydrophobicContact CZ-CB 3.77Å; F125-Q133 PolarHBondContact N-O 3.32Å; F125-Q133 PolarHBondContact O-N 3.32Å; F125-H163 AromaticContact CE1-NE2 3.93Å; F125-H163 AromaticContact CZ-CE1 3.94Å; F125-H163 AromaticContact CZ-NE2 3.33Å; F125-H163 VanDerWaalsContact CZ-NE2 3.33Å; F125-H163 WeakPolarHBondContact CZ-NE2 3.46Å
126	S	87.8	Confident	91.2	Very high	71 Å²	71	38.2 Å²	38.2	50%	0.497	21%	0.207	S	C	.	.	S	Bend	trans	49.2	38.3	-174.4	-53.1	0	0	0	0	112.9	T128 Q133	S126-T128 PolarHBondContact O-N 2.89Å; S126-Q133 PolarHBondContact OG-OE1 3.3Å
127	I	87.9	Confident	91.6	Very high	46 Å²	46	38.6 Å²	38.6	24%	0.236	20%	0.204	C	C	.	.			trans	-75.5	122.4	-171	-58.3	160.4	0	0	0	109.2	A124 F125 A132 F199 K200 L202	A124-I127 HydrophobicContact CB-CD1 4.44Å; F125-I127 PolarHBondContact O-N 2.9Å; F125-I127 VanDerWaalsContact O-N 3.09Å; I127-A132 HydrophobicContact CG1-CB 4Å; I127-F199 HydrophobicContact CD1-CB 3.91Å; I127-F199 HydrophobicContact CD1-CD2 3.84Å; I127-F199 HydrophobicContact CD1-CG 4.21Å; I127-F199 HydrophobicContact CG1-CD2 4.03Å; I127-F199 HydrophobicContact CG2-CD2 4.01Å; I127-F199 HydrophobicContact CG2-CE2 4.25Å; I127-K200 WeakPolarHBondContact CG2-O 3.04Å; I127-L202 VanDerWaalsContact O-CD1 3.29Å; I127-L202 WeakPolarHBondContact O-CD1 3.48Å
128	T	83.7	Confident	91.8	Very high	45 Å²	45	38.6 Å²	38.6	28%	0.276	20%	0.204	S	C	.	.			trans	-107.4	-172.3	175	84.5	0	0	0	0	109.6	S126 V130 S131 L202	S126-T128 PolarHBondContact O-N 2.89Å; T128-V130 VanDerWaalsContact C-N 3.28Å; T128-V130 PolarHBondContact OG1-N 3.03Å; T128-V130 VanDerWaalsContact OG1-N 3.07Å; T128-S131 VanDerWaalsContact CG2-OG 3.25Å; T128-S131 WeakPolarHBondContact CG2-OG 3.27Å; T128-S131 PolarHBondContact N-O 2.78Å; T128-S131 PolarHBondContact OG1-N 2.76Å; T128-S131 PolarHBondContact OG1-O 2.96Å; T128-S131 PolarHBondContact OG1-OG 2.83Å; T128-L202 PolarHBondContact O-N 3.44Å; T128-L202 VanDerWaalsContact O-N 3.09Å
129	P	83.2	Confident	91.9	Very high	32 Å²	32	38.2 Å²	38.2	21%	0.208	20%	0.201	C	C	.	.	S	Bend	trans	-68	-25.2	169.2	-19	33	0	0	0	113.9	I170 P171 L202 S203	P129-I170 CarbonylContact O-C 3.56Å; P129-P171 HydrophobicContact CB-CB 4.03Å; P129-P171 HydrophobicContact CB-CG 3.97Å; P129-P171 WeakPolarHBondContact O-CA 3.23Å; P129-P171 VanDerWaalsContact O-CG 3.3Å; P129-P171 WeakPolarHBondContact O-CG 3.3Å; P129-L202 WeakPolarHBondContact CA-O 3.42Å; P129-L202 WeakPolarHBondContact CB-O 3.41Å; P129-L202 HydrophobicContact CG-CB 4.01Å; P129-S203 WeakPolarHBondContact CG-O 3.39Å
130	V	88.2	Confident	91.8	Very high	68 Å²	68	38 Å²	38	41%	0.412	20%	0.2	S	C	.	.	S	Bend	trans	-130.8	3.8	-169.8	-63.2	0	0	0	0	114.4	T128 K167 G168 L169 P171	T128-V130 VanDerWaalsContact C-N 3.28Å; T128-V130 PolarHBondContact OG1-N 3.03Å; T128-V130 VanDerWaalsContact OG1-N 3.07Å; V130-K167 CarbonylContact O-C 3.54Å; V130-G168 PolarHBondContact O-N 2.69Å; V130-L169 WeakPolarHBondContact CA-O 3.39Å; V130-L169 PolarHBondContact O-N 3.14Å; V130-P171 HydrophobicContact CG1-CG 4.07Å
131	S	90.3	Very high	91.9	Very high	26 Å²	26	34.8 Å²	34.8	18%	0.182	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	161.8	180	59.2	0	0	0	0	112.4	T128 L166	T128-S131 VanDerWaalsContact CG2-OG 3.25Å; T128-S131 WeakPolarHBondContact CG2-OG 3.27Å; T128-S131 PolarHBondContact N-O 2.78Å; T128-S131 PolarHBondContact OG1-N 2.76Å; T128-S131 PolarHBondContact OG1-O 2.96Å; T128-S131 PolarHBondContact OG1-OG 2.83Å; S131-L166 CarbonylContact C-O 3.52Å; S131-L166 WeakPolarHBondContact CA-O 3.33Å; S131-L166 WeakPolarHBondContact CB-O 3.44Å
132	A	91.8	Very high	91.9	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.008	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	147.3	169.5	0	0	0	0	0	109.8	I127 L166 L169 F199	I127-A132 HydrophobicContact CG1-CB 4Å; A132-L166 PolarHBondContact N-O 2.75Å; A132-L166 PolarHBondContact O-N 3.33Å; A132-L169 HydrophobicContact CB-CD1 3.97Å; A132-F199 HydrophobicContact CB-CD2 4.42Å; A132-F199 HydrophobicContact CB-CE2 3.69Å; A132-F199 HydrophobicContact CB-CZ 3.91Å
133	Q	93.7	Very high	91.8	Very high	48 Å²	48	32.8 Å²	32.8	22%	0.224	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	137	166.4	-79.9	170	-18.7	0	0	109.4	A124 F125 S126 V164 I165	A124-Q133 CarbonylContact C-O 3.53Å; A124-Q133 VanDerWaalsContact CA-O 3.26Å; A124-Q133 WeakPolarHBondContact CA-O 3.46Å; F125-Q133 HydrophobicContact CD1-CB 4.15Å; F125-Q133 HydrophobicContact CD2-CB 4.11Å; F125-Q133 HydrophobicContact CE1-CB 3.9Å; F125-Q133 HydrophobicContact CE2-CB 3.87Å; F125-Q133 HydrophobicContact CG-CB 4.25Å; F125-Q133 HydrophobicContact CZ-CB 3.77Å; F125-Q133 PolarHBondContact N-O 3.32Å; F125-Q133 PolarHBondContact O-N 3.32Å; S126-Q133 PolarHBondContact OG-OE1 3.3Å; Q133-V164 CarbonylContact C-O 3.56Å; Q133-V164 WeakPolarHBondContact CA-O 3.29Å; Q133-I165 HydrophobicContact CG-CG1 3.58Å
134	V	95.3	Very high	91.7	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126.6	179.1	178.7	0	0	0	0	109.2	V122 K123 A124 W136 H163 V164 L166	V122-V134 HydrophobicContact CG1-CG1 4.47Å; K123-V134 WeakPolarHBondContact O-CA 3.4Å; A124-V134 HydrophobicContact CB-CG2 4.19Å; V134-W136 HydrophobicContact CG1-CE3 4.5Å; V134-H163 WeakPolarHBondContact O-CA 3.26Å; V134-H163 PolarHBondContact O-CD2 3.34Å; V134-V164 HydrophobicContact CB-CG2 4.11Å; V134-V164 PolarHBondContact N-O 3.24Å; V134-V164 PolarHBondContact O-N 3.01Å; V134-L166 HydrophobicContact CG2-CD1 3.67Å; V134-L166 HydrophobicContact CG2-CG 4.07Å
135	S	95.2	Very high	91.7	Very high	13 Å²	13	32 Å²	32	9%	0.091	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	155.1	176.5	62.8	0	0	0	0	111.3	V122 K123 Y162	V122-S135 WeakPolarHBondContact CA-O 3.21Å; K123-S135 WeakPolarHBondContact CE-OG 3.43Å; K123-S135 VanDerWaalsContact CG-OG 3.32Å; K123-S135 WeakPolarHBondContact CG-OG 3.34Å; K123-S135 PolarHBondContact N-O 3.26Å; K123-S135 PolarHBondContact O-N 2.99Å; S135-Y162 VanDerWaalsContact CA-O 3.27Å; S135-Y162 WeakPolarHBondContact CA-O 3.43Å
136	W	95.7	Very high	91.9	Very high	8 Å²	8	29.1 Å²	29.1	3%	0.03	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	174.3	178	62.1	94.6	0	0	0	110.7	P119 V122 V134 H145 I147 C157 T161 Y162 V164 V179	P119-W136 HydrophobicContact CB-CB 4.22Å; P119-W136 HydrophobicContact CB-CG 4.18Å; V122-W136 HydrophobicContact CG2-CB 3.91Å; V134-W136 HydrophobicContact CG1-CE3 4.5Å; W136-H145 AromaticContact CD1-CD2 3.99Å; W136-H145 AromaticContact CE2-CD2 3.91Å; W136-H145 HydrophobicContact CZ2-CB 3.76Å; W136-H145 AromaticContact CZ2-CG 3.92Å; W136-H145 AromaticContact NE1-CD2 3.22Å; W136-H145 PolarHBondContact NE1-CD2 2.73Å; W136-H145 AromaticContact NE1-CE1 3.99Å; W136-H145 AromaticContact NE1-CG 3.64Å; W136-H145 AromaticContact NE1-NE2 3.47Å; W136-H145 PolarHBondContact NE1-NE2 2.97Å; W136-I147 HydrophobicContact CH2-CD1 3.78Å; W136-I147 HydrophobicContact CZ3-CD1 3.77Å; W136-C157 HydrophobicContact CH2-CB 4.38Å; W136-T161 HydrophobicContact CH2-CG2 4.33Å; W136-T161 VanDerWaalsContact CZ2-O 3.23Å; W136-T161 WeakPolarHBondContact CZ2-O 3.1Å; W136-Y162 PolarHBondContact N-O 3.23Å; W136-V164 HydrophobicContact CH2-CG1 3.94Å; W136-V164 HydrophobicContact CZ3-CG1 4.13Å; W136-V164 HydrophobicContact CZ3-CG2 4.14Å; W136-V179 HydrophobicContact CD2-CB 4.42Å; W136-V179 HydrophobicContact CD2-CG1 3.66Å; W136-V179 HydrophobicContact CD2-CG2 4.1Å; W136-V179 HydrophobicContact CE3-CG1 4.1Å; W136-V179 HydrophobicContact CE3-CG2 3.87Å; W136-V179 HydrophobicContact CG-CG1 3.95Å; W136-V179 HydrophobicContact CG-CG2 4.42Å; W136-V179 HydrophobicContact CZ2-CG1 4.09Å; W136-V179 HydrophobicContact CZ3-CG2 4.45Å
137	Y	94.3	Very high	92.3	Very high	43 Å²	43	25.8 Å²	25.8	17%	0.169	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	109.1	171.9	-148.7	-49.1	0	0	0	108	R90 D104 A105 T108 E120	R90-Y137 VanDerWaalsContact CD-CE1 3.48Å; R90-Y137 VanDerWaalsContact CZ-CD1 3.49Å; D104-Y137 WeakPolarHBondContact CB-OH 3.45Å; A105-Y137 HydrophobicContact CB-CD1 4.14Å; A105-Y137 HydrophobicContact CB-CE1 4.28Å; A105-Y137 HydrophobicContact CB-CG 4.29Å; T108-Y137 HydrophobicContact CG2-CD1 4.18Å; T108-Y137 HydrophobicContact CG2-CE1 3.85Å; E120-Y137 PolarHBondContact N-O 2.65Å; E120-Y137 PolarHBondContact O-N 2.79Å
138	P	94.2	Very high	92.6	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.013	13%	0.132	C	C	.	.			trans	-71.9	147.8	-170.8	29.3	-35.2	0	0	0	112.1	R90 A105 T108 S140 H145	R90-P138 PolarHBondContact NH1-O 3.06Å; R90-P138 PolarHBondContact NH2-O 2.83Å; A105-P138 WeakPolarHBondContact O-CG 3.35Å; T108-P138 HydrophobicContact CG2-CG 3.77Å; P138-S140 VanDerWaalsContact C-N 3.33Å; P138-H145 WeakPolarHBondContact CB-NE2 3.43Å
139	G	92.1	Very high	93.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-63.4	-40	171.3	0	0	0	0	0	111.8	I109 T110	I109-G139 CarbonylContact C-O 3.6Å; T110-G139 PolarHBondContact N-O 2.89Å; T110-G139 PolarHBondContact OG1-O 2.84Å; T110-G139 VanDerWaalsContact OG1-O 3.14Å
140	S	93.6	Very high	93.6	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.007	11%	0.111	C	C	.	.	B	Isolated β-bridge	trans	-140.5	136.5	158.1	177.1	0	0	0	0	110.3	T108 P138 N142	T108-S140 CarbonylContact O-C 3.56Å; T108-S140 VanDerWaalsContact O-CA 3.31Å; T108-S140 WeakPolarHBondContact O-CA 3.46Å; P138-S140 VanDerWaalsContact C-N 3.33Å; S140-N142 PolarHBondContact O-N 2.93Å; S140-N142 PolarHBondContact OG-N 2.96Å
141	S	93.8	Very high	93.7	Very high	4 Å²	4	20.6 Å²	20.6	3%	0.028	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.3	174.8	50.3	0	0	0	0	113.5	A106 C107 T108 F143 A159 G160	A106-S141 VanDerWaalsContact O-CB 3.3Å; A106-S141 WeakPolarHBondContact O-CB 3.4Å; C107-S141 WeakPolarHBondContact CA-OG 3.21Å; T108-S141 PolarHBondContact N-OG 3.47Å; T108-S141 PolarHBondContact O-N 2.89Å; T108-S141 PolarHBondContact O-OG 3.22Å; S141-F143 VanDerWaalsContact C-N 3.28Å; S141-F143 PolarHBondContact O-N 3.4Å; S141-A159 CarbonylContact O-C 3.51Å; S141-G160 PolarHBondContact O-N 3.37Å
142	N	93.5	Very high	93.8	Very high	48 Å²	48	22.8 Å²	22.8	26%	0.257	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.1	-172	-60.5	-5.8	0	0	0	113.8	Q30 I31 S140 A159	Q30-N142 WeakPolarHBondContact CA-OD1 3.46Å; I31-N142 PolarHBondContact N-OD1 3.2Å; I31-N142 PolarHBondContact O-ND2 3.15Å; S140-N142 PolarHBondContact O-N 2.93Å; S140-N142 PolarHBondContact OG-N 2.96Å; N142-A159 WeakPolarHBondContact O-CB 3.25Å
143	F	92.9	Very high	93.8	Very high	52 Å²	52	28.3 Å²	28.3	23%	0.228	15%	0.149	C	C	.	.	S	Bend	trans	-108.9	150.8	-176.1	-59.9	-68.1	0	0	0	112.7	S141 H145 V181 D183 P184	S141-F143 VanDerWaalsContact C-N 3.28Å; S141-F143 PolarHBondContact O-N 3.4Å; F143-H145 PolarHBondContact O-CE1 2.83Å; F143-H145 PolarHBondContact O-ND1 3.46Å; F143-V181 HydrophobicContact CB-CG2 3.69Å; F143-V181 HydrophobicContact CG-CG2 4.48Å; F143-D183 HydrophobicContact CD2-CB 3.82Å; F143-D183 HydrophobicContact CE2-CB 3.96Å; F143-D183 WeakPolarHBondContact CE2-OD2 3.39Å; F143-D183 HydrophobicContact CG-CB 4.19Å; F143-D183 HydrophobicContact CZ-CB 4.42Å; F143-P184 HydrophobicContact CE1-CG 4.47Å
144	E	93.2	Very high	93.8	Very high	86 Å²	86	27.1 Å²	27.1	40%	0.402	15%	0.145	S	C	.	.			trans	-64.1	147.9	169.8	-63.5	-169.1	136.5	0	0	111.9	C157 K182	E144-C157 WeakPolarHBondContact CA-O 3.15Å; E144-C157 WeakPolarHBondContact CB-O 3.36Å; E144-K182 HydrophobicContact CB-CD 4.13Å; E144-K182 HydrophobicContact CB-CG 4.48Å; E144-K182 PolarHBondContact O-N 3.2Å; E144-K182 WeakPolarHBondContact OE2-CE 3.43Å; E144-K182 IonicContact OE2-NZ 3.1Å; E144-K182 PolarHBondContact OE2-NZ 3.44Å
145	H	94.5	Very high	93.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	151.9	174.7	-67.8	71.4	0	0	0	110.3	W136 P138 F143 N156 C157 V179 R180	W136-H145 AromaticContact CD1-CD2 3.99Å; W136-H145 AromaticContact CE2-CD2 3.91Å; W136-H145 HydrophobicContact CZ2-CB 3.76Å; W136-H145 AromaticContact CZ2-CG 3.92Å; W136-H145 AromaticContact NE1-CD2 3.22Å; W136-H145 PolarHBondContact NE1-CD2 2.73Å; W136-H145 AromaticContact NE1-CE1 3.99Å; W136-H145 AromaticContact NE1-CG 3.64Å; W136-H145 AromaticContact NE1-NE2 3.47Å; W136-H145 PolarHBondContact NE1-NE2 2.97Å; P138-H145 WeakPolarHBondContact CB-NE2 3.43Å; F143-H145 PolarHBondContact O-CE1 2.83Å; F143-H145 PolarHBondContact O-ND1 3.46Å; H145-N156 CarbonylContact O-C 3.43Å; H145-N156 WeakPolarHBondContact O-CA 3.45Å; H145-C157 HydrophobicContact CB-CB 4.33Å; H145-C157 PolarHBondContact N-O 3.23Å; H145-C157 PolarHBondContact O-N 2.75Å; H145-V179 HydrophobicContact CB-CG1 4.17Å; H145-R180 CarbonylContact C-O 3.57Å; H145-R180 WeakPolarHBondContact CA-O 3.37Å
146	V	95	Very high	93.5	Very high	17 Å²	17	31 Å²	31	10%	0.103	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.7	179.4	179.4	0	0	0	0	108.1	L148 K153 R180 K182	V146-L148 HydrophobicContact CG1-CD1 4.18Å; V146-L148 HydrophobicContact CG1-CG 4.42Å; V146-K153 HydrophobicContact CG1-CD 3.88Å; V146-K153 HydrophobicContact CG1-CG 3.83Å; V146-R180 PolarHBondContact N-O 3Å; V146-R180 PolarHBondContact O-N 2.93Å; V146-K182 HydrophobicContact CG2-CD 4.43Å; V146-K182 VanDerWaalsContact CG2-CE 3.46Å; V146-K182 HydrophobicContact CG2-CG 4.17Å
147	I	95.5	Very high	93.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.2	178.4	-49	-59.7	0	0	0	109	V14 W136 V154 G155 L166 V179	V14-I147 HydrophobicContact CG1-CG1 4.2Å; V14-I147 HydrophobicContact CG2-CB 4.45Å; W136-I147 HydrophobicContact CH2-CD1 3.78Å; W136-I147 HydrophobicContact CZ3-CD1 3.77Å; I147-V154 HydrophobicContact CB-CG2 3.97Å; I147-V154 HydrophobicContact CG2-CG2 3.71Å; I147-V154 WeakPolarHBondContact O-CG2 3.24Å; I147-V154 PolarHBondContact O-N 3.25Å; I147-G155 PolarHBondContact N-O 2.82Å; I147-G155 PolarHBondContact O-N 2.81Å; I147-L166 HydrophobicContact CG2-CD2 4.22Å; I147-V179 HydrophobicContact CD1-CB 4.42Å; I147-V179 HydrophobicContact CD1-CG1 4.03Å; I147-V179 HydrophobicContact CD1-CG2 3.93Å
148	L	94.5	Very high	93.3	Very high	25 Å²	25	31.8 Å²	31.8	13%	0.131	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.6	174.7	-48.1	91.1	0	0	0	110.3	V146 L152 C177 S178 R180	V146-L148 HydrophobicContact CG1-CD1 4.18Å; V146-L148 HydrophobicContact CG1-CG 4.42Å; L148-L152 CarbonylContact C-O 3.56Å; L148-L152 WeakPolarHBondContact CA-O 3.22Å; L148-C177 WeakPolarHBondContact O-CA 3.3Å; L148-S178 PolarHBondContact N-O 3.23Å; L148-S178 PolarHBondContact O-N 3.4Å; L148-R180 HydrophobicContact CD1-CB 3.99Å
149	L	94.4	Very high	93.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124	171.3	-68.6	-172.3	0	0	0	109.6	V9 V12 G151 L152 V154 L166 L169 Y175 R176 C177	V9-L149 HydrophobicContact CG1-CB 3.99Å; V9-L149 HydrophobicContact CG1-CD1 4.3Å; V12-L149 HydrophobicContact CG1-CD1 3.88Å; V12-L149 HydrophobicContact CG2-CD1 4.31Å; L149-G151 PolarHBondContact O-N 2.96Å; L149-L152 PolarHBondContact N-O 2.85Å; L149-L152 WeakPolarHBondContact O-CB 3.25Å; L149-L152 PolarHBondContact O-N 2.62Å; L149-V154 HydrophobicContact CB-CG1 4.15Å; L149-V154 HydrophobicContact CD1-CG1 4.19Å; L149-V154 HydrophobicContact CD1-CG2 4.47Å; L149-V154 HydrophobicContact CG-CG1 4.1Å; L149-V154 HydrophobicContact CG-CG2 4.01Å; L149-L166 HydrophobicContact CD1-CD1 4.29Å; L149-L166 HydrophobicContact CD2-CD1 3.94Å; L149-L169 HydrophobicContact CD1-CD2 3.6Å; L149-Y175 HydrophobicContact CB-CD1 4.22Å; L149-Y175 HydrophobicContact CD1-CD1 4.08Å; L149-Y175 HydrophobicContact CD1-CE1 4.21Å; L149-R176 WeakPolarHBondContact CA-O 3.35Å; L149-C177 HydrophobicContact CD2-CB 3.82Å
150	N	93.6	Very high	92.8	Very high	7 Å²	7	35.3 Å²	35.3	4%	0.037	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	26.9	-173.6	-64.9	5.4	0	0	0	114.1	P5 V7 L174 Y175 R176	P5-N150 PolarHBondContact O-ND2 3.42Å; V7-N150 WeakPolarHBondContact CG2-ND2 3.34Å; N150-L174 PolarHBondContact ND2-O 2.72Å; N150-Y175 WeakPolarHBondContact OD1-CA 3.46Å; N150-R176 PolarHBondContact N-O 2.7Å; N150-R176 PolarHBondContact OD1-N 2.72Å
151	G	90.1	Very high	92.7	Very high	50 Å²	50	35.5 Å²	35.5	52%	0.515	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	-6.5	-176.1	0	0	0	0	0	115.2	L149	L149-G151 PolarHBondContact O-N 2.96Å
152	L	92.2	Very high	92.6	Very high	72 Å²	72	37 Å²	37	38%	0.377	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.6	175.2	-60.9	176.7	0	0	0	110.3	C6 V9 L148 L149 V154	C6-L152 HydrophobicContact CB-CD1 4.37Å; V9-L152 HydrophobicContact CG2-CB 3.73Å; V9-L152 HydrophobicContact CG2-CD1 3.87Å; V9-L152 HydrophobicContact CG2-CG 4.47Å; L148-L152 CarbonylContact C-O 3.56Å; L148-L152 WeakPolarHBondContact CA-O 3.22Å; L149-L152 PolarHBondContact N-O 2.85Å; L149-L152 WeakPolarHBondContact O-CB 3.25Å; L149-L152 PolarHBondContact O-N 2.62Å; L152-V154 PolarHBondContact O-N 3.02Å
153	K	93.2	Very high	92.6	Very high	118 Å²	118	36.3 Å²	36.3	51%	0.513	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	126.4	179	177	178.4	177.3	175.7	0	111	V146 N156	V146-K153 HydrophobicContact CG1-CD 3.88Å; V146-K153 HydrophobicContact CG1-CG 3.83Å; K153-N156 WeakPolarHBondContact CE-OD1 3.46Å; K153-N156 PolarHBondContact NZ-OD1 2.86Å
154	V	93.4	Very high	92.7	Very high	23 Å²	23	33.9 Å²	33.9	14%	0.139	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-16.6	177.8	-66	0	0	0	0	114	V9 V12 V14 I147 L149 L152	V9-V154 HydrophobicContact CB-CG1 3.76Å; V9-V154 HydrophobicContact CG1-CG1 4.4Å; V9-V154 HydrophobicContact CG2-CG1 3.77Å; V12-V154 HydrophobicContact CB-CG1 4.14Å; V12-V154 HydrophobicContact CG1-CB 4.23Å; V12-V154 HydrophobicContact CG1-CG1 4.15Å; V14-V154 HydrophobicContact CG2-CB 4.12Å; V14-V154 HydrophobicContact CG2-CG2 3.71Å; I147-V154 HydrophobicContact CB-CG2 3.97Å; I147-V154 HydrophobicContact CG2-CG2 3.71Å; I147-V154 WeakPolarHBondContact O-CG2 3.24Å; I147-V154 PolarHBondContact O-N 3.25Å; L149-V154 HydrophobicContact CB-CG1 4.15Å; L149-V154 HydrophobicContact CD1-CG1 4.19Å; L149-V154 HydrophobicContact CD1-CG2 4.47Å; L149-V154 HydrophobicContact CG-CG1 4.1Å; L149-V154 HydrophobicContact CG-CG2 4.01Å; L152-V154 PolarHBondContact O-N 3.02Å
155	G	91.9	Very high	92.7	Very high	13 Å²	13	31.6 Å²	31.6	13%	0.134	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	168.3	177.1	0	0	0	0	0	114.9	I147	I147-G155 PolarHBondContact N-O 2.82Å; I147-G155 PolarHBondContact O-N 2.81Å
156	N	93	Very high	92.7	Very high	83 Å²	83	31.6 Å²	31.6	44%	0.444	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	152.7	161.6	-40.3	-85.4	0	0	0	108.3	H145 K153	H145-N156 CarbonylContact O-C 3.43Å; H145-N156 WeakPolarHBondContact O-CA 3.45Å; K153-N156 WeakPolarHBondContact CE-OD1 3.46Å; K153-N156 PolarHBondContact NZ-OD1 2.86Å
157	C	92.5	Very high	92.6	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.034	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135	173.7	-53.7	0	0	0	0	108.3	W136 E144 H145 T161	W136-C157 HydrophobicContact CH2-CB 4.38Å; E144-C157 WeakPolarHBondContact CA-O 3.15Å; E144-C157 WeakPolarHBondContact CB-O 3.36Å; H145-C157 HydrophobicContact CB-CB 4.33Å; H145-C157 PolarHBondContact N-O 3.23Å; H145-C157 PolarHBondContact O-N 2.75Å; C157-T161 HydrophobicContact CB-CG2 3.81Å
158	P	91.7	Very high	92.2	Very high	62 Å²	62	37.1 Å²	37.1	40%	0.403	22%	0.224	S	C	.	.			trans	-66.4	172.6	179.8	27.5	-33.2	0	0	0	112.3	T161	P158-T161 VanDerWaalsContact CD-OG1 3.28Å; P158-T161 WeakPolarHBondContact CD-OG1 3.28Å; P158-T161 WeakPolarHBondContact CG-OG1 3.37Å; P158-T161 WeakPolarHBondContact O-CB 3.19Å; P158-T161 PolarHBondContact O-N 3.38Å; P158-T161 PolarHBondContact O-OG1 3.29Å
159	A	90.1	Very high	92.1	Very high	54 Å²	54	36.2 Å²	36.2	45%	0.446	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	146.5	168.9	0	0	0	0	0	110.8	S141 N142 T161	S141-A159 CarbonylContact O-C 3.51Å; N142-A159 WeakPolarHBondContact O-CB 3.25Å; A159-T161 PolarHBondContact O-N 2.81Å
160	G	87.1	Confident	91.8	Very high	22 Å²	22	39.5 Å²	39.5	23%	0.227	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	-21.5	-173.7	0	0	0	0	0	115.1	S141 Y162	S141-G160 PolarHBondContact O-N 3.37Å; G160-Y162 PolarHBondContact O-N 3.22Å
161	T	90.6	Very high	91.4	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.025	24%	0.242	C	C	.	.			trans	-72.9	128	175.8	-50.1	0	0	0	0	111.3	E16 W136 C157 P158 A159 V164	E16-T161 HydrophobicContact CB-CG2 4.41Å; E16-T161 HydrophobicContact CG-CG2 3.96Å; E16-T161 WeakPolarHBondContact OE1-CB 3.33Å; E16-T161 WeakPolarHBondContact OE1-CG2 3.31Å; E16-T161 PolarHBondContact OE1-OG1 3.04Å; W136-T161 HydrophobicContact CH2-CG2 4.33Å; W136-T161 VanDerWaalsContact CZ2-O 3.23Å; W136-T161 WeakPolarHBondContact CZ2-O 3.1Å; C157-T161 HydrophobicContact CB-CG2 3.81Å; P158-T161 VanDerWaalsContact CD-OG1 3.28Å; P158-T161 WeakPolarHBondContact CD-OG1 3.28Å; P158-T161 WeakPolarHBondContact CG-OG1 3.37Å; P158-T161 WeakPolarHBondContact O-CB 3.19Å; P158-T161 PolarHBondContact O-N 3.38Å; P158-T161 PolarHBondContact O-OG1 3.29Å; A159-T161 PolarHBondContact O-N 2.81Å; T161-V164 HydrophobicContact CG2-CG1 4.05Å
162	Y	92.9	Very high	90.9	Very high	35 Å²	35	40.8 Å²	40.8	14%	0.137	24%	0.237	C	C	.	.			trans	-136.4	6.4	173.7	71	-85.6	0	0	0	114	R24 P103 A105 A106 S135 W136 G160	R24-Y162 PolarHBondContact NH2-OH 2.67Å; P103-Y162 HydrophobicContact CG-CE1 4.42Å; P103-Y162 WeakPolarHBondContact CG-OH 3.38Å; A105-Y162 HydrophobicContact CB-CD1 3.99Å; A105-Y162 HydrophobicContact CB-CD2 3.51Å; A105-Y162 HydrophobicContact CB-CE1 4.3Å; A105-Y162 HydrophobicContact CB-CE2 3.85Å; A105-Y162 HydrophobicContact CB-CG 3.6Å; A106-Y162 HydrophobicContact CB-CD1 4.37Å; A106-Y162 HydrophobicContact CB-CE1 3.93Å; S135-Y162 VanDerWaalsContact CA-O 3.27Å; S135-Y162 WeakPolarHBondContact CA-O 3.43Å; W136-Y162 PolarHBondContact N-O 3.23Å; G160-Y162 PolarHBondContact O-N 3.22Å
163	H	92.7	Very high	90.7	Very high	35 Å²	35	38.8 Å²	38.8	16%	0.162	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	127	-178.8	-179.2	-152.3	0	0	0	110.9	V17 F125 V134	V17-H163 PolarHBondContact N-O 3.44Å; V17-H163 VanDerWaalsContact N-O 3.15Å; F125-H163 AromaticContact CE1-NE2 3.93Å; F125-H163 AromaticContact CZ-CE1 3.94Å; F125-H163 AromaticContact CZ-NE2 3.33Å; F125-H163 VanDerWaalsContact CZ-NE2 3.33Å; F125-H163 WeakPolarHBondContact CZ-NE2 3.46Å; V134-H163 WeakPolarHBondContact O-CA 3.26Å; V134-H163 PolarHBondContact O-CD2 3.34Å
164	V	94.5	Very high	90.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155.7	-179.8	-57.5	0	0	0	0	111.8	V14 T15 Q133 V134 W136 T161 L166	V14-V164 HydrophobicContact CG1-CB 3.81Å; V14-V164 HydrophobicContact CG1-CG1 3.88Å; V14-V164 HydrophobicContact CG1-CG2 3.93Å; T15-V164 CarbonylContact O-C 3.56Å; T15-V164 WeakPolarHBondContact O-CA 3.5Å; Q133-V164 CarbonylContact C-O 3.56Å; Q133-V164 WeakPolarHBondContact CA-O 3.29Å; V134-V164 HydrophobicContact CB-CG2 4.11Å; V134-V164 PolarHBondContact N-O 3.24Å; V134-V164 PolarHBondContact O-N 3.01Å; W136-V164 HydrophobicContact CH2-CG1 3.94Å; W136-V164 HydrophobicContact CZ3-CG1 4.13Å; W136-V164 HydrophobicContact CZ3-CG2 4.14Å; T161-V164 HydrophobicContact CG2-CG1 4.05Å; V164-L166 HydrophobicContact CG2-CD2 4.29Å
165	I	93.8	Very high	90.7	Very high	38 Å²	38	36 Å²	36	20%	0.195	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	129.5	161.2	-62.3	146.1	0	0	0	108.1	T15 V17 Q133 K167	T15-I165 PolarHBondContact N-O 3.23Å; T15-I165 PolarHBondContact O-N 3.4Å; T15-I165 PolarHBondContact OG1-O 3.15Å; V17-I165 HydrophobicContact CG2-CD1 3.87Å; V17-I165 HydrophobicContact CG2-CG1 3.71Å; Q133-I165 HydrophobicContact CG-CG1 3.58Å; I165-K167 HydrophobicContact CG2-CD 4.44Å; I165-K167 HydrophobicContact CG2-CG 3.71Å
166	L	94.8	Very high	90.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	130	163.5	-53.5	178.5	0	0	0	108.4	T13 V14 S131 A132 V134 I147 L149 V164 L169 F199	T13-L166 WeakPolarHBondContact O-CA 3.37Å; V14-L166 HydrophobicContact CB-CD2 4.49Å; V14-L166 HydrophobicContact CG1-CD2 4.36Å; V14-L166 HydrophobicContact CG2-CD2 3.82Å; S131-L166 CarbonylContact C-O 3.52Å; S131-L166 WeakPolarHBondContact CA-O 3.33Å; S131-L166 WeakPolarHBondContact CB-O 3.44Å; A132-L166 PolarHBondContact N-O 2.75Å; A132-L166 PolarHBondContact O-N 3.33Å; V134-L166 HydrophobicContact CG2-CD1 3.67Å; V134-L166 HydrophobicContact CG2-CG 4.07Å; I147-L166 HydrophobicContact CG2-CD2 4.22Å; L149-L166 HydrophobicContact CD1-CD1 4.29Å; L149-L166 HydrophobicContact CD2-CD1 3.94Å; V164-L166 HydrophobicContact CG2-CD2 4.29Å; L166-L169 HydrophobicContact CB-CD1 4.4Å; L166-L169 HydrophobicContact CB-CD2 4.29Å; L166-L169 HydrophobicContact CB-CG 4.45Å; L166-F199 HydrophobicContact CD1-CZ 4.44Å
167	K	91.3	Very high	90.9	Very high	99 Å²	99	33.2 Å²	33.2	43%	0.43	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151.9	173.6	-51.2	-179.8	-173.4	177	0	109.7	V12 T13 V130 I165	V12-K167 CarbonylContact C-O 3.47Å; V12-K167 VanDerWaalsContact CA-O 3.3Å; V12-K167 WeakPolarHBondContact CA-O 3.45Å; T13-K167 PolarHBondContact N-O 3.16Å; T13-K167 PolarHBondContact O-N 3.08Å; T13-K167 PolarHBondContact OG1-O 3.29Å; V130-K167 CarbonylContact O-C 3.54Å; I165-K167 HydrophobicContact CG2-CD 4.44Å; I165-K167 HydrophobicContact CG2-CG 3.71Å
168	G	88.8	Confident	91	Very high	35 Å²	35	33.1 Å²	33.1	36%	0.361	20%	0.196	S	C	.	.	S	Bend	trans	87	19.6	-179	0	0	0	0	0	114.6	V130	V130-G168 PolarHBondContact O-N 2.69Å
169	L	91.3	Very high	91.2	Very high	5 Å²	5	30.1 Å²	30.1	3%	0.026	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-68.3	153.8	174.1	-55.7	177.8	0	0	0	111.4	V12 V130 A132 L149 L166 Y175 F199 T201	V12-L169 HydrophobicContact CG1-CD2 4.05Å; V12-L169 HydrophobicContact CG2-CD2 3.95Å; V130-L169 WeakPolarHBondContact CA-O 3.39Å; V130-L169 PolarHBondContact O-N 3.14Å; A132-L169 HydrophobicContact CB-CD1 3.97Å; L149-L169 HydrophobicContact CD1-CD2 3.6Å; L166-L169 HydrophobicContact CB-CD1 4.4Å; L166-L169 HydrophobicContact CB-CD2 4.29Å; L166-L169 HydrophobicContact CB-CG 4.45Å; L169-Y175 HydrophobicContact CB-CE2 4.07Å; L169-Y175 HydrophobicContact CD2-CE1 4.45Å; L169-Y175 HydrophobicContact CD2-CE2 4.26Å; L169-F199 HydrophobicContact CD1-CE2 3.89Å; L169-F199 HydrophobicContact CD1-CZ 3.84Å; L169-T201 HydrophobicContact CB-CG2 3.79Å; L169-T201 HydrophobicContact CD1-CG2 3.67Å; L169-T201 HydrophobicContact CG-CG2 4.39Å
170	I	88.3	Confident	91.4	Very high	69 Å²	69	33.6 Å²	33.6	35%	0.354	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-81.7	132.2	172.4	-54	-172.9	0	0	0	109.1	V7 D8 P129 T173 Y175 T201	V7-I170 HydrophobicContact CG1-CD1 3.78Å; V7-I170 HydrophobicContact CG1-CG1 4.32Å; D8-I170 HydrophobicContact CB-CD1 4.45Å; P129-I170 CarbonylContact O-C 3.56Å; I170-T173 WeakPolarHBondContact O-CB 3.48Å; I170-T173 PolarHBondContact O-OG1 2.87Å; I170-Y175 WeakPolarHBondContact CB-OH 3.27Å; I170-Y175 PolarHBondContact N-OH 2.99Å; I170-T201 PolarHBondContact O-OG1 3.06Å
171	P	84.4	Confident	91.7	Very high	26 Å²	26	32.8 Å²	32.8	17%	0.169	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	158.5	175.1	-27.5	36	0	0	0	115.1	P129 V130 T173 T201 L202 K204	P129-P171 HydrophobicContact CB-CB 4.03Å; P129-P171 HydrophobicContact CB-CG 3.97Å; P129-P171 WeakPolarHBondContact O-CA 3.23Å; P129-P171 VanDerWaalsContact O-CG 3.3Å; P129-P171 WeakPolarHBondContact O-CG 3.3Å; V130-P171 HydrophobicContact CG1-CG 4.07Å; P171-T173 PolarHBondContact O-N 2.9Å; P171-T173 PolarHBondContact O-OG1 2.95Å; P171-T201 VanDerWaalsContact C-OG1 3.29Å; P171-T201 WeakPolarHBondContact CA-OG1 3.45Å; P171-L202 WeakPolarHBondContact CA-O 3.37Å; P171-L202 WeakPolarHBondContact CB-O 3.32Å; P171-K204 HydrophobicContact CB-CB 3.73Å; P171-K204 HydrophobicContact CG-CB 3.62Å; P171-K204 HydrophobicContact CG-CD 4.16Å; P171-K204 HydrophobicContact CG-CG 3.86Å
172	S	80.6	Confident	91.7	Very high	58 Å²	58	37.1 Å²	37.1	41%	0.406	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	15.5	178.1	-58.4	0	0	0	0	116.1	K200 T201 L202 S203	S172-K200 WeakPolarHBondContact O-CE 3.49Å; S172-T201 WeakPolarHBondContact CA-O 3.26Å; S172-T201 PolarHBondContact N-O 2.82Å; S172-T201 PolarHBondContact N-OG1 3.09Å; S172-T201 VanDerWaalsContact N-OG1 3.16Å; S172-L202 PolarHBondContact N-O 2.86Å; S172-S203 WeakPolarHBondContact OG-CA 3.4Å; S172-S203 PolarHBondContact OG-OG 2.94Å
173	T	88.1	Confident	91.4	Very high	31 Å²	31	35.6 Å²	35.6	19%	0.19	18%	0.182	C	C	.	.			trans	-107.8	143.7	-164.8	-62.2	0	0	0	0	111.6	V7 I170 P171 Y175 K200 T201	V7-T173 HydrophobicContact CG1-CG2 3.99Å; V7-T173 HydrophobicContact CG2-CG2 3.78Å; I170-T173 WeakPolarHBondContact O-CB 3.48Å; I170-T173 PolarHBondContact O-OG1 2.87Å; P171-T173 PolarHBondContact O-N 2.9Å; P171-T173 PolarHBondContact O-OG1 2.95Å; T173-Y175 HydrophobicContact CG2-CD2 4.32Å; T173-Y175 HydrophobicContact CG2-CE1 4.49Å; T173-Y175 HydrophobicContact CG2-CE2 3.8Å; T173-K200 VanDerWaalsContact O-CA 3.32Å; T173-K200 WeakPolarHBondContact O-CA 2.95Å; T173-K200 WeakPolarHBondContact O-CG 3.19Å; T173-T201 PolarHBondContact N-OG1 3.14Å; T173-T201 PolarHBondContact O-N 3.11Å; T173-T201 PolarHBondContact O-OG1 2.92Å
174	L	92	Very high	90.9	Very high	82 Å²	82	37.7 Å²	37.7	43%	0.429	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	130.4	176.4	-76.7	165	0	0	0	110.7	Y4 N150 K200	Y4-L174 HydrophobicContact CD1-CB 4.35Å; Y4-L174 HydrophobicContact CE1-CB 4.37Å; Y4-L174 HydrophobicContact CE1-CD1 4.22Å; N150-L174 PolarHBondContact ND2-O 2.72Å; L174-K200 HydrophobicContact CD2-CB 3.81Å; L174-K200 HydrophobicContact CD2-CD 4.25Å; L174-K200 HydrophobicContact CD2-CG 3.94Å; L174-K200 HydrophobicContact CG-CD 4.42Å; L174-K200 HydrophobicContact CG-CG 4.17Å
175	Y	94	Very high	90.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	126.6	179.7	-72.1	-76.4	0	0	0	110.8	V7 V9 L149 N150 L169 I170 T173 D198 F199 T201	V7-Y175 HydrophobicContact CB-CE1 4.17Å; V7-Y175 HydrophobicContact CG1-CE1 3.84Å; V9-Y175 HydrophobicContact CG1-CE1 4.22Å; L149-Y175 HydrophobicContact CB-CD1 4.22Å; L149-Y175 HydrophobicContact CD1-CD1 4.08Å; L149-Y175 HydrophobicContact CD1-CE1 4.21Å; N150-Y175 WeakPolarHBondContact OD1-CA 3.46Å; L169-Y175 HydrophobicContact CB-CE2 4.07Å; L169-Y175 HydrophobicContact CD2-CE1 4.45Å; L169-Y175 HydrophobicContact CD2-CE2 4.26Å; I170-Y175 WeakPolarHBondContact CB-OH 3.27Å; I170-Y175 PolarHBondContact N-OH 2.99Å; T173-Y175 HydrophobicContact CG2-CD2 4.32Å; T173-Y175 HydrophobicContact CG2-CE1 4.49Å; T173-Y175 HydrophobicContact CG2-CE2 3.8Å; Y175-D198 WeakPolarHBondContact O-CA 3.39Å; Y175-F199 HydrophobicContact CD2-CE2 4.26Å; Y175-F199 HydrophobicContact CD2-CZ 4.13Å; Y175-F199 HydrophobicContact CG-CE1 4.42Å; Y175-F199 HydrophobicContact CG-CZ 4.17Å; Y175-F199 PolarHBondContact N-O 3.42Å; Y175-F199 PolarHBondContact O-N 3.46Å; Y175-T201 HydrophobicContact CD2-CG2 4.08Å; Y175-T201 HydrophobicContact CE2-CG2 3.9Å
176	R	94.4	Very high	89.4	Confident	37 Å²	37	40.4 Å²	40.4	14%	0.14	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	111.4	157	178.6	160.3	-67.1	-163.7	-2	108	Y4 L149 N150 H196 D198	Y4-R176 HydrophobicContact CD2-CB 3.85Å; Y4-R176 HydrophobicContact CE2-CB 3.98Å; L149-R176 WeakPolarHBondContact CA-O 3.35Å; N150-R176 PolarHBondContact N-O 2.7Å; N150-R176 PolarHBondContact OD1-N 2.72Å; R176-H196 HydrophobicContact CG-CB 4.18Å; R176-H196 PolarHBondContact NH1-NE2 2.92Å; R176-D198 WeakPolarHBondContact CA-OD1 3.46Å; R176-D198 WeakPolarHBondContact CB-OD1 3.4Å; R176-D198 VanDerWaalsContact CG-OD1 3.26Å; R176-D198 WeakPolarHBondContact CG-OD1 3.23Å; R176-D198 IonicContact CZ-OD1 2.68Å; R176-D198 IonicContact CZ-OD2 3.29Å; R176-D198 IonicContact NE-OD1 2.69Å; R176-D198 PolarHBondContact NE-OD1 3.3Å; R176-D198 IonicContact NE-OD2 2.59Å; R176-D198 IonicContact NH2-OD1 2.69Å; R176-D198 PolarHBondContact NH2-OD1 2.91Å; R176-D198 IonicContact NH2-OD2 2.79Å; R176-D198 PolarHBondContact NH2-OD2 2.64Å
177	C	95.3	Very high	88.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.7	167.8	-169.9	0	0	0	0	109.3	L148 L149 H196 Y197 F199	L148-C177 WeakPolarHBondContact O-CA 3.3Å; L149-C177 HydrophobicContact CD2-CB 3.82Å; C177-H196 CarbonylContact O-C 3.52Å; C177-H196 WeakPolarHBondContact O-CA 3.27Å; C177-Y197 PolarHBondContact N-O 2.95Å; C177-Y197 PolarHBondContact O-N 2.8Å; C177-F199 HydrophobicContact CB-CD1 4.49Å; C177-F199 HydrophobicContact CB-CE1 4.12Å
178	S	94.9	Very high	87.7	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.3	172.2	-71.8	0	0	0	0	110.1	L148 E194 G195	L148-S178 PolarHBondContact N-O 3.23Å; L148-S178 PolarHBondContact O-N 3.4Å; S178-E194 WeakPolarHBondContact CB-OE1 3.17Å; S178-E194 PolarHBondContact OG-OE1 2.88Å; S178-G195 CarbonylContact C-O 3.54Å; S178-G195 WeakPolarHBondContact CA-O 3.36Å
179	V	96	Very high	87.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.4	172.3	-172.6	0	0	0	0	107.6	P119 V122 W136 H145 I147 E194 G195	P119-V179 HydrophobicContact CB-CB 4.14Å; P119-V179 HydrophobicContact CB-CG1 4.04Å; P119-V179 HydrophobicContact CG-CB 4.21Å; P119-V179 HydrophobicContact CG-CG1 3.84Å; P119-V179 WeakPolarHBondContact CG-O 3.46Å; V122-V179 HydrophobicContact CG1-CG2 3.77Å; V122-V179 HydrophobicContact CG2-CB 4.24Å; V122-V179 HydrophobicContact CG2-CG2 4.12Å; W136-V179 HydrophobicContact CD2-CB 4.42Å; W136-V179 HydrophobicContact CD2-CG1 3.66Å; W136-V179 HydrophobicContact CD2-CG2 4.1Å; W136-V179 HydrophobicContact CE3-CG1 4.1Å; W136-V179 HydrophobicContact CE3-CG2 3.87Å; W136-V179 HydrophobicContact CG-CG1 3.95Å; W136-V179 HydrophobicContact CG-CG2 4.42Å; W136-V179 HydrophobicContact CZ2-CG1 4.09Å; W136-V179 HydrophobicContact CZ3-CG2 4.45Å; H145-V179 HydrophobicContact CB-CG1 4.17Å; I147-V179 HydrophobicContact CD1-CB 4.42Å; I147-V179 HydrophobicContact CD1-CG1 4.03Å; I147-V179 HydrophobicContact CD1-CG2 3.93Å; V179-E194 WeakPolarHBondContact O-CA 3.4Å; V179-G195 PolarHBondContact N-O 3.06Å; V179-G195 PolarHBondContact O-N 2.83Å
180	R	94	Very high	86.6	Confident	126 Å²	126	59.8 Å²	59.8	48%	0.475	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.8	-179	-179.4	172.8	174.1	171.4	1.5	111.5	H145 V146 L148 V193 E194	H145-R180 CarbonylContact C-O 3.57Å; H145-R180 WeakPolarHBondContact CA-O 3.37Å; V146-R180 PolarHBondContact N-O 3Å; V146-R180 PolarHBondContact O-N 2.93Å; L148-R180 HydrophobicContact CD1-CB 3.99Å; R180-V193 CarbonylContact C-O 3.56Å; R180-V193 VanDerWaalsContact CA-O 3.26Å; R180-V193 WeakPolarHBondContact CA-O 3.39Å; R180-V193 HydrophobicContact CG-CB 4.19Å; R180-V193 HydrophobicContact CG-CG2 3.91Å; R180-E194 HydrophobicContact CB-CB 4.26Å; R180-E194 HydrophobicContact CB-CG 4.29Å; R180-E194 HydrophobicContact CG-CB 4.44Å
181	V	94.2	Very high	86.3	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.03	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	151.5	177.2	71	0	0	0	0	112	V117 P119 F143 D183 V193	V117-V181 HydrophobicContact CG1-CG1 3.88Å; V117-V181 WeakPolarHBondContact O-CG1 3.31Å; P119-V181 HydrophobicContact CG-CB 4.4Å; F143-V181 HydrophobicContact CB-CG2 3.69Å; F143-V181 HydrophobicContact CG-CG2 4.48Å; V181-D183 HydrophobicContact CG1-CB 4.19Å; V181-D183 HydrophobicContact CG2-CB 4.3Å; V181-V193 HydrophobicContact CG1-CB 4.19Å; V181-V193 HydrophobicContact CG1-CG1 4.31Å; V181-V193 PolarHBondContact N-O 3.05Å
182	K	89.5	Confident	86.3	Confident	95 Å²	95	61.7 Å²	61.7	41%	0.413	32%	0.32	S	S	.	.			trans	-101	52.3	170.7	-58.1	-173	-166.8	169.9	0	112.6	E144 V146 P184	E144-K182 HydrophobicContact CB-CD 4.13Å; E144-K182 HydrophobicContact CB-CG 4.48Å; E144-K182 PolarHBondContact O-N 3.2Å; E144-K182 WeakPolarHBondContact OE2-CE 3.43Å; E144-K182 IonicContact OE2-NZ 3.1Å; E144-K182 PolarHBondContact OE2-NZ 3.44Å; V146-K182 HydrophobicContact CG2-CD 4.43Å; V146-K182 VanDerWaalsContact CG2-CE 3.46Å; V146-K182 HydrophobicContact CG2-CG 4.17Å; K182-P184 WeakPolarHBondContact O-CD 3.42Å
183	D	86.4	Confident	86.7	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.016	31%	0.308	C	S	.	.			trans	-84.2	120.2	176.6	-171.5	-28.2	0	0	0	110.6	V117 F143 V181 R185 A186	V117-D183 HydrophobicContact CG1-CB 3.53Å; V117-D183 WeakPolarHBondContact CG1-OD2 3.25Å; F143-D183 HydrophobicContact CD2-CB 3.82Å; F143-D183 HydrophobicContact CE2-CB 3.96Å; F143-D183 WeakPolarHBondContact CE2-OD2 3.39Å; F143-D183 HydrophobicContact CG-CB 4.19Å; F143-D183 HydrophobicContact CZ-CB 4.42Å; V181-D183 HydrophobicContact CG1-CB 4.19Å; V181-D183 HydrophobicContact CG2-CB 4.3Å; D183-R185 PolarHBondContact O-N 3.28Å; D183-R185 VanDerWaalsContact OD1-CB 3.23Å; D183-R185 WeakPolarHBondContact OD1-CB 3.13Å; D183-R185 VanDerWaalsContact OD1-CG 3.3Å; D183-R185 WeakPolarHBondContact OD1-CG 3.38Å; D183-R185 PolarHBondContact OD1-N 3.18Å; D183-R185 IonicContact OD1-NE 2.67Å; D183-R185 PolarHBondContact OD1-NE 3.14Å; D183-R185 VanDerWaalsContact OD1-NE 3.1Å; D183-R185 IonicContact OD2-CZ 2.87Å; D183-R185 VanDerWaalsContact OD2-CZ 3.29Å; D183-R185 IonicContact OD2-NE 2.92Å; D183-R185 PolarHBondContact OD2-NE 2.81Å; D183-R185 VanDerWaalsContact OD2-NE 3.08Å; D183-R185 IonicContact OD2-NH2 2.75Å; D183-R185 PolarHBondContact OD2-NH2 2.83Å; D183-A186 PolarHBondContact O-N 2.96Å
184	P	82.2	Confident	86.9	Confident	80 Å²	80	62.5 Å²	62.5	52%	0.519	32%	0.317	S	S	.	.	H	α-helix	trans	-59	-30.1	177.6	-24.2	34.9	0	0	0	113.9	F143 K182 A186 V187	F143-P184 HydrophobicContact CE1-CG 4.47Å; K182-P184 WeakPolarHBondContact O-CD 3.42Å; P184-A186 VanDerWaalsContact C-N 3.33Å; P184-A186 PolarHBondContact O-N 3.42Å; P184-V187 WeakPolarHBondContact O-CB 3.43Å; P184-V187 PolarHBondContact O-N 3.14Å
185	R	77.3	Confident	86.9	Confident	91 Å²	91	59.2 Å²	59.2	34%	0.343	30%	0.302	S	S	.	.	H	α-helix	trans	-65.7	-37.1	-177.7	-57	174.6	-63.9	163	5.7	111.6	D183 V187 L188 E189	D183-R185 PolarHBondContact O-N 3.28Å; D183-R185 VanDerWaalsContact OD1-CB 3.23Å; D183-R185 WeakPolarHBondContact OD1-CB 3.13Å; D183-R185 VanDerWaalsContact OD1-CG 3.3Å; D183-R185 WeakPolarHBondContact OD1-CG 3.38Å; D183-R185 PolarHBondContact OD1-N 3.18Å; D183-R185 IonicContact OD1-NE 2.67Å; D183-R185 PolarHBondContact OD1-NE 3.14Å; D183-R185 VanDerWaalsContact OD1-NE 3.1Å; D183-R185 IonicContact OD2-CZ 2.87Å; D183-R185 VanDerWaalsContact OD2-CZ 3.29Å; D183-R185 IonicContact OD2-NE 2.92Å; D183-R185 PolarHBondContact OD2-NE 2.81Å; D183-R185 VanDerWaalsContact OD2-NE 3.08Å; D183-R185 IonicContact OD2-NH2 2.75Å; D183-R185 PolarHBondContact OD2-NH2 2.83Å; R185-V187 PolarHBondContact O-N 2.89Å; R185-L188 WeakPolarHBondContact O-CB 3.38Å; R185-L188 PolarHBondContact O-N 3.02Å; R185-L188 VanDerWaalsContact O-N 3.08Å; R185-E189 WeakPolarHBondContact O-CB 3.44Å; R185-E189 WeakPolarHBondContact O-CG 3.09Å; R185-E189 PolarHBondContact O-N 2.58Å
186	A	79.3	Confident	86.9	Confident	4 Å²	4	63.8 Å²	63.8	3%	0.033	32%	0.324	C	S	.	.	H	α-helix	trans	-68.2	-22.7	179	0	0	0	0	0	113.5	V117 D183 P184 D190 K191 V193	V117-A186 HydrophobicContact CB-CB 4.2Å; V117-A186 HydrophobicContact CG1-CB 3.85Å; D183-A186 PolarHBondContact O-N 2.96Å; P184-A186 VanDerWaalsContact C-N 3.33Å; P184-A186 PolarHBondContact O-N 3.42Å; A186-D190 PolarHBondContact O-N 2.97Å; A186-D190 VanDerWaalsContact O-N 3.17Å; A186-K191 HydrophobicContact CB-CB 4.1Å; A186-K191 PolarHBondContact O-N 2.66Å; A186-V193 HydrophobicContact CB-CG1 3.32Å
187	V	75.2	Confident	87	Confident	127 Å²	127	66.7 Å²	66.7	77%	0.77	34%	0.335	S	S	*	.	H	α-helix	trans	-73	-32.6	172.5	-173.4	0	0	0	0	111.2	P184 R185	P184-V187 WeakPolarHBondContact O-CB 3.43Å; P184-V187 PolarHBondContact O-N 3.14Å; R185-V187 PolarHBondContact O-N 2.89Å
188	L	75.1	Confident	87	Confident	155 Å²	155	68.8 Å²	68.8	81%	0.812	35%	0.346	S	S	*	.	H	α-helix	trans	-80.6	-31.5	177.1	-68.7	160.7	0	0	0	112.7	R185	R185-L188 WeakPolarHBondContact O-CB 3.38Å; R185-L188 PolarHBondContact O-N 3.02Å; R185-L188 VanDerWaalsContact O-N 3.08Å
189	E	77.7	Confident	86.9	Confident	107 Å²	107	69.1 Å²	69.1	50%	0.5	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	3.1	-174	-62.3	-179.3	141	0	0	114.3	R185 K191	R185-E189 WeakPolarHBondContact O-CB 3.44Å; R185-E189 WeakPolarHBondContact O-CG 3.09Å; R185-E189 PolarHBondContact O-N 2.58Å; E189-K191 HydrophobicContact CB-CD 4.11Å; E189-K191 HydrophobicContact CB-CG 3.91Å; E189-K191 PolarHBondContact O-N 2.97Å; E189-K191 VanDerWaalsContact O-N 3.15Å; E189-K191 IonicContact OE1-NZ 3.27Å; E189-K191 VanDerWaalsContact OE2-CD 3.27Å; E189-K191 WeakPolarHBondContact OE2-CD 3.08Å; E189-K191 WeakPolarHBondContact OE2-CE 3.48Å; E189-K191 IonicContact OE2-NZ 2.7Å; E189-K191 PolarHBondContact OE2-NZ 3.48Å
190	D	78.9	Confident	86.6	Confident	157 Å²	157	74.7 Å²	74.7	84%	0.84	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.7	38.5	-172	-161.4	27.4	0	0	0	113.7	A186	A186-D190 PolarHBondContact O-N 2.97Å; A186-D190 VanDerWaalsContact O-N 3.17Å
191	K	82.3	Confident	86.3	Confident	46 Å²	46	68.9 Å²	68.9	20%	0.2	35%	0.35	C	S	.	.			trans	-82.7	150.1	-177.2	-80.6	-177.3	-177.6	165.2	0	111.6	S115 V117 A186 E189 V193	S115-K191 PolarHBondContact O-NZ 2.96Å; V117-K191 HydrophobicContact CG2-CD 3.76Å; A186-K191 HydrophobicContact CB-CB 4.1Å; A186-K191 PolarHBondContact O-N 2.66Å; E189-K191 HydrophobicContact CB-CD 4.11Å; E189-K191 HydrophobicContact CB-CG 3.91Å; E189-K191 PolarHBondContact O-N 2.97Å; E189-K191 VanDerWaalsContact O-N 3.15Å; E189-K191 IonicContact OE1-NZ 3.27Å; E189-K191 VanDerWaalsContact OE2-CD 3.27Å; E189-K191 WeakPolarHBondContact OE2-CD 3.08Å; E189-K191 WeakPolarHBondContact OE2-CE 3.48Å; E189-K191 IonicContact OE2-NZ 2.7Å; E189-K191 PolarHBondContact OE2-NZ 3.48Å; K191-V193 PolarHBondContact O-N 2.85Å
192	P	85	Confident	85.5	Confident	89 Å²	89	73.3 Å²	73.3	58%	0.578	37%	0.373	S	S	*	.			trans	-58.3	132.7	169.7	26.4	-34.4	0	0	0	110.1	A118	A118-P192 HydrophobicContact CB-CB 4.35Å; A118-P192 WeakPolarHBondContact CB-O 3.43Å; A118-P192 PolarHBondContact N-O 3.14Å
193	V	89.2	Confident	84.5	Confident	26 Å²	26	71.6 Å²	71.6	16%	0.158	37%	0.373	C	S	.	.			trans	-113.7	-3.8	-178.8	-72.6	0	0	0	0	113.5	P119 R180 V181 A186 K191	P119-V193 WeakPolarHBondContact CD-O 3.49Å; R180-V193 CarbonylContact C-O 3.56Å; R180-V193 VanDerWaalsContact CA-O 3.26Å; R180-V193 WeakPolarHBondContact CA-O 3.39Å; R180-V193 HydrophobicContact CG-CB 4.19Å; R180-V193 HydrophobicContact CG-CG2 3.91Å; V181-V193 HydrophobicContact CG1-CB 4.19Å; V181-V193 HydrophobicContact CG1-CG1 4.31Å; V181-V193 PolarHBondContact N-O 3.05Å; A186-V193 HydrophobicContact CB-CG1 3.32Å; K191-V193 PolarHBondContact O-N 2.85Å
194	E	91.5	Very high	83.3	Confident	80 Å²	80	79.5 Å²	79.5	37%	0.374	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	120.3	-167.8	-173.6	179	136.1	0	0	112	S178 V179 R180	S178-E194 WeakPolarHBondContact CB-OE1 3.17Å; S178-E194 PolarHBondContact OG-OE1 2.88Å; V179-E194 WeakPolarHBondContact O-CA 3.4Å; R180-E194 HydrophobicContact CB-CB 4.26Å; R180-E194 HydrophobicContact CB-CG 4.29Å; R180-E194 HydrophobicContact CG-CB 4.44Å
195	G	93.3	Very high	82.2	Confident	12 Å²	12	77.2 Å²	77.2	12%	0.124	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	152.5	164.6	0	0	0	0	0	110.5	P119 S178 V179	P119-G195 WeakPolarHBondContact O-CA 3.34Å; S178-G195 CarbonylContact C-O 3.54Å; S178-G195 WeakPolarHBondContact CA-O 3.36Å; V179-G195 PolarHBondContact N-O 3.06Å; V179-G195 PolarHBondContact O-N 2.83Å
196	H	94	Very high	81	Confident	97 Å²	97	75.1 Å²	75.1	45%	0.449	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	155.8	-178.5	68.1	-83.8	0	0	0	114.2	R176 C177	R176-H196 HydrophobicContact CG-CB 4.18Å; R176-H196 PolarHBondContact NH1-NE2 2.92Å; C177-H196 CarbonylContact O-C 3.52Å; C177-H196 WeakPolarHBondContact O-CA 3.27Å
197	Y	95.5	Very high	80.2	Confident	98 Å²	98	80.3 Å²	80.3	38%	0.384	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	134.5	178.6	-169.4	-94.9	0	0	0	111	V122 K123 A124 C177 F199	V122-Y197 WeakPolarHBondContact O-CB 3.43Å; V122-Y197 WeakPolarHBondContact O-CD2 3.36Å; K123-Y197 HydrophobicContact CB-CD2 4.5Å; K123-Y197 HydrophobicContact CB-CE2 4.45Å; A124-Y197 HydrophobicContact CB-CD1 3.68Å; A124-Y197 HydrophobicContact CB-CE1 3.86Å; A124-Y197 VanDerWaalsContact N-CD1 3.33Å; C177-Y197 PolarHBondContact N-O 2.95Å; C177-Y197 PolarHBondContact O-N 2.8Å; Y197-F199 HydrophobicContact CD1-CB 4.32Å; Y197-F199 HydrophobicContact CE1-CB 4.19Å
198	D	95.7	Very high	80.2	Confident	43 Å²	43	74.4 Å²	74.4	23%	0.23	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.6	179.8	-66.5	-21.8	0	0	0	110.8	Y4 Y175 R176	Y4-D198 HydrophobicContact CE2-CB 4.26Å; Y4-D198 PolarHBondContact OH-OD2 3.13Å; Y175-D198 WeakPolarHBondContact O-CA 3.39Å; R176-D198 WeakPolarHBondContact CA-OD1 3.46Å; R176-D198 WeakPolarHBondContact CB-OD1 3.4Å; R176-D198 VanDerWaalsContact CG-OD1 3.26Å; R176-D198 WeakPolarHBondContact CG-OD1 3.23Å; R176-D198 IonicContact CZ-OD1 2.68Å; R176-D198 IonicContact CZ-OD2 3.29Å; R176-D198 IonicContact NE-OD1 2.69Å; R176-D198 PolarHBondContact NE-OD1 3.3Å; R176-D198 IonicContact NE-OD2 2.59Å; R176-D198 IonicContact NH2-OD1 2.69Å; R176-D198 PolarHBondContact NH2-OD1 2.91Å; R176-D198 IonicContact NH2-OD2 2.79Å; R176-D198 PolarHBondContact NH2-OD2 2.64Å
199	F	93.2	Very high	80.4	Confident	11 Å²	11	71 Å²	71	5%	0.048	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	169.1	177.6	77.5	-82.7	0	0	0	112.4	A124 I127 A132 L166 L169 Y175 C177 Y197 T201	A124-F199 HydrophobicContact CB-CB 4Å; A124-F199 HydrophobicContact CB-CD1 3.73Å; A124-F199 HydrophobicContact CB-CD2 4.44Å; A124-F199 HydrophobicContact CB-CE1 4.3Å; A124-F199 HydrophobicContact CB-CG 3.81Å; I127-F199 HydrophobicContact CD1-CB 3.91Å; I127-F199 HydrophobicContact CD1-CD2 3.84Å; I127-F199 HydrophobicContact CD1-CG 4.21Å; I127-F199 HydrophobicContact CG1-CD2 4.03Å; I127-F199 HydrophobicContact CG2-CD2 4.01Å; I127-F199 HydrophobicContact CG2-CE2 4.25Å; A132-F199 HydrophobicContact CB-CD2 4.42Å; A132-F199 HydrophobicContact CB-CE2 3.69Å; A132-F199 HydrophobicContact CB-CZ 3.91Å; L166-F199 HydrophobicContact CD1-CZ 4.44Å; L169-F199 HydrophobicContact CD1-CE2 3.89Å; L169-F199 HydrophobicContact CD1-CZ 3.84Å; Y175-F199 HydrophobicContact CD2-CE2 4.26Å; Y175-F199 HydrophobicContact CD2-CZ 4.13Å; Y175-F199 HydrophobicContact CG-CE1 4.42Å; Y175-F199 HydrophobicContact CG-CZ 4.17Å; Y175-F199 PolarHBondContact N-O 3.42Å; Y175-F199 PolarHBondContact O-N 3.46Å; C177-F199 HydrophobicContact CB-CD1 4.49Å; C177-F199 HydrophobicContact CB-CE1 4.12Å; Y197-F199 HydrophobicContact CD1-CB 4.32Å; Y197-F199 HydrophobicContact CE1-CB 4.19Å; F199-T201 HydrophobicContact CE2-CG2 4.11Å
200	K	89.5	Confident	80.9	Confident	117 Å²	117	66.7 Å²	66.7	51%	0.509	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.8	176.2	-163.1	-176.5	177.6	179.8	0	110.6	I127 S172 T173 L174	I127-K200 WeakPolarHBondContact CG2-O 3.04Å; S172-K200 WeakPolarHBondContact O-CE 3.49Å; T173-K200 VanDerWaalsContact O-CA 3.32Å; T173-K200 WeakPolarHBondContact O-CA 2.95Å; T173-K200 WeakPolarHBondContact O-CG 3.19Å; L174-K200 HydrophobicContact CD2-CB 3.81Å; L174-K200 HydrophobicContact CD2-CD 4.25Å; L174-K200 HydrophobicContact CD2-CG 3.94Å; L174-K200 HydrophobicContact CG-CD 4.42Å; L174-K200 HydrophobicContact CG-CG 4.17Å
201	T	87.9	Confident	81.5	Confident	4 Å²	4	59.3 Å²	59.3	3%	0.025	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-68.1	152.6	171.8	48.5	0	0	0	0	111.8	L169 I170 P171 S172 T173 Y175 F199	L169-T201 HydrophobicContact CB-CG2 3.79Å; L169-T201 HydrophobicContact CD1-CG2 3.67Å; L169-T201 HydrophobicContact CG-CG2 4.39Å; I170-T201 PolarHBondContact O-OG1 3.06Å; P171-T201 VanDerWaalsContact C-OG1 3.29Å; P171-T201 WeakPolarHBondContact CA-OG1 3.45Å; S172-T201 WeakPolarHBondContact CA-O 3.26Å; S172-T201 PolarHBondContact N-O 2.82Å; S172-T201 PolarHBondContact N-OG1 3.09Å; S172-T201 VanDerWaalsContact N-OG1 3.16Å; T173-T201 PolarHBondContact N-OG1 3.14Å; T173-T201 PolarHBondContact O-N 3.11Å; T173-T201 PolarHBondContact O-OG1 2.92Å; Y175-T201 HydrophobicContact CD2-CG2 4.08Å; Y175-T201 HydrophobicContact CE2-CG2 3.9Å; F199-T201 HydrophobicContact CE2-CG2 4.11Å
202	L	77.6	Confident	81.8	Confident	97 Å²	97	62.4 Å²	62.4	51%	0.508	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-72.2	167.3	176.8	-56.3	-175.9	0	0	0	111.6	I127 T128 P129 P171 S172	I127-L202 VanDerWaalsContact O-CD1 3.29Å; I127-L202 WeakPolarHBondContact O-CD1 3.48Å; T128-L202 PolarHBondContact O-N 3.44Å; T128-L202 VanDerWaalsContact O-N 3.09Å; P129-L202 WeakPolarHBondContact CA-O 3.42Å; P129-L202 WeakPolarHBondContact CB-O 3.41Å; P129-L202 HydrophobicContact CG-CB 4.01Å; P171-L202 WeakPolarHBondContact CA-O 3.37Å; P171-L202 WeakPolarHBondContact CB-O 3.32Å; S172-L202 PolarHBondContact N-O 2.86Å
203	S	68.6	Low	82	Confident	59 Å²	59	62.5 Å²	62.5	41%	0.413	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-66.6	139.6	175.1	-63.1	0	0	0	0	111.7	P129 S172 I205	P129-S203 WeakPolarHBondContact CG-O 3.39Å; S172-S203 WeakPolarHBondContact OG-CA 3.4Å; S172-S203 PolarHBondContact OG-OG 2.94Å; S203-I205 WeakPolarHBondContact CB-O 3.25Å; S203-I205 CarbonylContact O-C 3.5Å; S203-I205 PolarHBondContact O-N 2.87Å; S203-I205 VanDerWaalsContact O-N 3.15Å
204	K	61.2	Low	82.1	Confident	169 Å²	169	61.5 Å²	61.5	74%	0.735	32%	0.322	S	S	*	.	S	Bend	trans	-57.2	-34.3	-178.7	-163.6	171.3	-179.1	168.7	0	112.8	P171	P171-K204 HydrophobicContact CB-CB 3.73Å; P171-K204 HydrophobicContact CG-CB 3.62Å; P171-K204 HydrophobicContact CG-CD 4.16Å; P171-K204 HydrophobicContact CG-CG 3.86Å
205	I	57.7	Low	82.2	Confident	33 Å²	33	61.4 Å²	61.4	17%	0.169	32%	0.321	C	S	.	.	S	Bend	trans	-91.5	116.3	173.2	-57	164.6	0	0	0	104.8	S203 R241 A242 E290 I292	S203-I205 WeakPolarHBondContact CB-O 3.25Å; S203-I205 CarbonylContact O-C 3.5Å; S203-I205 PolarHBondContact O-N 2.87Å; S203-I205 VanDerWaalsContact O-N 3.15Å; I205-R241 HydrophobicContact CD1-CB 4.46Å; I205-R241 WeakPolarHBondContact CD1-O 3.21Å; I205-R241 WeakPolarHBondContact CG1-O 3.49Å; I205-R241 WeakPolarHBondContact CG2-O 3.3Å; I205-A242 HydrophobicContact CG2-CB 4.27Å; I205-E290 HydrophobicContact CD1-CB 3.94Å; I205-E290 HydrophobicContact CD1-CG 3.77Å; I205-I292 HydrophobicContact CB-CD1 3.69Å; I205-I292 HydrophobicContact CD1-CD1 3.73Å; I205-I292 HydrophobicContact CG1-CD1 4.29Å; I205-I292 HydrophobicContact CG2-CD1 3.85Å
206	G	52.8	Low	82.1	Confident	46 Å²	46	61.5 Å²	61.5	47%	0.474	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-57.3	148	169	0	0	0	0	0	109.5
207	L	63.3	Low	81.9	Confident	114 Å²	114	62.4 Å²	62.4	60%	0.597	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-57.8	128.1	168.8	-61.4	174.2	0	0	0	107	I292	L207-I292 HydrophobicContact CD2-CG2 3.88Å
208	P	74.9	Confident	81.5	Confident	2 Å²	2	62 Å²	62	1%	0.013	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-63.1	149.8	178	29.8	-36.7	0	0	0	109.1	T286 T288 S294	P208-T286 HydrophobicContact CB-CG2 3.91Å; P208-T286 HydrophobicContact CG-CG2 4.33Å; P208-T288 HydrophobicContact CB-CG2 4Å; P208-T288 HydrophobicContact CG-CG2 3.9Å; P208-S294 VanDerWaalsContact O-CA 3.29Å; P208-S294 WeakPolarHBondContact O-CA 3.49Å; P208-S294 WeakPolarHBondContact O-CB 3.45Å
209	D	79.6	Confident	81	Confident	83 Å²	83	60.4 Å²	60.4	44%	0.444	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-59.9	145.4	175.8	-52.8	-52.1	0	0	0	110.4	V232 Q235 T286	D209-V232 HydrophobicContact CB-CG1 4.04Å; D209-Q235 VanDerWaalsContact CG-NE2 3.3Å; D209-Q235 PolarHBondContact OD2-NE2 3.17Å; D209-T286 WeakPolarHBondContact O-CB 3.49Å; D209-T286 PolarHBondContact O-OG1 3.03Å
210	A	87.2	Confident	80.7	Confident	18 Å²	18	65.3 Å²	65.3	15%	0.149	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-68.3	150.4	168.6	0	0	0	0	0	110.1
211	P	91.1	Very high	80.4	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.006	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-69	142.2	176.6	31	-34.3	0	0	0	110.6	V214 W229 V232 Y247 V284 T286	P211-V214 HydrophobicContact CG-CG2 4.25Å; P211-W229 HydrophobicContact CB-CB 4.14Å; P211-W229 HydrophobicContact CB-CG 4.05Å; P211-W229 HydrophobicContact CG-CG 4.46Å; P211-V232 HydrophobicContact CB-CG2 4.23Å; P211-Y247 HydrophobicContact CB-CD1 4.29Å; P211-Y247 HydrophobicContact CB-CE1 4.18Å; P211-Y247 HydrophobicContact CG-CD1 4.27Å; P211-V284 HydrophobicContact CG-CB 3.73Å; P211-V284 HydrophobicContact CG-CG1 3.73Å; P211-T286 WeakPolarHBondContact CD-OG1 3.43Å
212	N	89.3	Confident	80.1	Confident	111 Å²	111	74.1 Å²	74.1	59%	0.594	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	161.9	-177.6	-76.6	-45.7	0	0	0	111.7	V214 Q230	N212-V214 VanDerWaalsContact C-N 3.3Å; N212-V214 PolarHBondContact O-N 2.82Å; N212-Q230 WeakPolarHBondContact O-CB 3.34Å; N212-Q230 PolarHBondContact O-N 2.98Å
213	N	89	Confident	80.1	Confident	92 Å²	92	71 Å²	71	49%	0.492	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.1	48.6	178	-171.2	50.8	0	0	0	112.8	Q215	N213-Q215 PolarHBondContact ND2-NE2 3.26Å; N213-Q215 VanDerWaalsContact ND2-NE2 3.16Å; N213-Q215 PolarHBondContact O-N 2.92Å; N213-Q215 PolarHBondContact OD1-NE2 2.76Å
214	V	92.3	Very high	81	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.024	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	131.4	171.9	-171.5	0	0	0	0	108.3	P211 N212 V227 T228 W229 V284 S297 N298 V300	P211-V214 HydrophobicContact CG-CG2 4.25Å; N212-V214 VanDerWaalsContact C-N 3.3Å; N212-V214 PolarHBondContact O-N 2.82Å; V214-V227 HydrophobicContact CG1-CG1 4.11Å; V214-T228 CarbonylContact C-O 3.59Å; V214-T228 VanDerWaalsContact CA-O 3.27Å; V214-T228 WeakPolarHBondContact CA-O 3.14Å; V214-W229 HydrophobicContact CB-CB 4.41Å; V214-W229 HydrophobicContact CG2-CB 3.87Å; V214-V284 HydrophobicContact CG1-CG2 3.73Å; V214-V284 HydrophobicContact CG2-CB 4.32Å; V214-V284 HydrophobicContact CG2-CG2 4.29Å; V214-S297 VanDerWaalsContact CG2-CB 3.46Å; V214-S297 WeakPolarHBondContact CG2-OG 3.48Å; V214-N298 WeakPolarHBondContact CB-OD1 3.33Å; V214-N298 PolarHBondContact N-OD1 3.16Å; V214-N298 VanDerWaalsContact N-OD1 3.08Å; V214-N298 PolarHBondContact O-ND2 3.41Å; V214-V300 VanDerWaalsContact C-CG2 3.49Å; V214-V300 HydrophobicContact CB-CG2 3.88Å; V214-V300 HydrophobicContact CG1-CG2 3.71Å; V214-V300 WeakPolarHBondContact O-CG2 2.89Å
215	Q	92	Very high	82.4	Confident	78 Å²	78	60.5 Å²	60.5	36%	0.364	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	164.6	179.1	-59.2	-178.8	-1.5	0	0	110.2	N213 V227 T228	N213-Q215 PolarHBondContact ND2-NE2 3.26Å; N213-Q215 VanDerWaalsContact ND2-NE2 3.16Å; N213-Q215 PolarHBondContact O-N 2.92Å; N213-Q215 PolarHBondContact OD1-NE2 2.76Å; Q215-V227 WeakPolarHBondContact O-CA 3.44Å; Q215-T228 PolarHBondContact N-O 3.03Å; Q215-T228 PolarHBondContact O-N 3.22Å
216	C	91.1	Very high	84	Confident	14 Å²	14	61 Å²	61	10%	0.095	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	118.7	-173.6	-174.5	0	0	0	0	110.8	L226 V300 P303	C216-L226 WeakPolarHBondContact CA-O 3.5Å; C216-V300 HydrophobicContact CB-CB 4.14Å; C216-V300 HydrophobicContact CB-CG1 3.52Å; C216-P303 WeakPolarHBondContact O-CG 3.45Å
217	E	90	Very high	86	Confident	116 Å²	116	58.8 Å²	58.8	54%	0.542	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	166.5	-177.3	-61.5	-169.6	155.2	0	0	111.2	G219 L225 L226	E217-G219 PolarHBondContact O-N 3.18Å; E217-L225 VanDerWaalsContact O-CD1 3.3Å; E217-L225 WeakPolarHBondContact O-CD1 3.35Å; E217-L226 PolarHBondContact N-O 3.37Å; E217-L226 PolarHBondContact O-N 2.96Å
218	I	87	Confident	87.5	Confident	91 Å²	91	55.3 Å²	55.3	47%	0.467	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	130.7	172.7	-57.6	176.1	0	0	0	108	P303 L305	I218-P303 HydrophobicContact CG1-CB 4.37Å; I218-L305 HydrophobicContact CD1-CD1 3.67Å; I218-L305 HydrophobicContact CD1-CG 4.05Å; I218-L305 HydrophobicContact CG1-CD1 3.9Å
219	G	86.7	Confident	88.4	Confident	9 Å²	9	55.6 Å²	55.6	9%	0.093	31%	0.307	C	S	.	.			trans	-74.1	168	-177.4	0	0	0	0	0	113.3	E217 Q221 T224	E217-G219 PolarHBondContact O-N 3.18Å; G219-Q221 PolarHBondContact O-N 3.29Å; G219-T224 VanDerWaalsContact C-OG1 3.31Å; G219-T224 VanDerWaalsContact CA-OG1 3.29Å; G219-T224 WeakPolarHBondContact CA-OG1 3.28Å; G219-T224 PolarHBondContact N-O 2.73Å
220	P	86.5	Confident	89	Confident	114 Å²	114	57.3 Å²	57.3	74%	0.74	31%	0.312	S	S	*	.	S	Bend	trans	-71.2	3.4	-174.4	30.9	-37.8	0	0	0	115
221	Q	83	Confident	89.1	Confident	134 Å²	134	57.8 Å²	57.8	63%	0.626	31%	0.314	S	S	*	.	S	Bend	trans	-130.4	142.7	173.6	-66.4	-179.9	-2.2	0	0	109.6	G219 G223 T224	G219-Q221 PolarHBondContact O-N 3.29Å; Q221-G223 PolarHBondContact O-N 3.34Å; Q221-T224 HydrophobicContact CB-CG2 3.89Å; Q221-T224 PolarHBondContact N-OG1 3.23Å; Q221-T224 WeakPolarHBondContact O-CB 3.3Å; Q221-T224 PolarHBondContact O-N 2.78Å; Q221-T224 PolarHBondContact O-OG1 2.64Å
222	D	80.6	Confident	88.9	Confident	171 Å²	171	58.6 Å²	58.6	91%	0.914	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	131.4	173.4	-67.6	-33.4	0	0	0	110.8	T224	D222-T224 VanDerWaalsContact C-N 3.34Å
223	G	79.3	Confident	88.1	Confident	33 Å²	33	59.5 Å²	59.5	34%	0.34	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	19.1	-174.8	0	0	0	0	0	114.8	Q221 K270 W271	Q221-G223 PolarHBondContact O-N 3.34Å; G223-K270 WeakPolarHBondContact O-CA 3.33Å; G223-W271 PolarHBondContact O-N 2.79Å
224	T	87.7	Confident	86.9	Confident	6 Å²	6	62.4 Å²	62.4	4%	0.037	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	160.8	165.8	66.8	0	0	0	0	113.4	G219 Q221 D222 L269 K270 W271	G219-T224 VanDerWaalsContact C-OG1 3.31Å; G219-T224 VanDerWaalsContact CA-OG1 3.29Å; G219-T224 WeakPolarHBondContact CA-OG1 3.28Å; G219-T224 PolarHBondContact N-O 2.73Å; Q221-T224 HydrophobicContact CB-CG2 3.89Å; Q221-T224 PolarHBondContact N-OG1 3.23Å; Q221-T224 WeakPolarHBondContact O-CB 3.3Å; Q221-T224 PolarHBondContact O-N 2.78Å; Q221-T224 PolarHBondContact O-OG1 2.64Å; D222-T224 VanDerWaalsContact C-N 3.34Å; T224-L269 CarbonylContact C-O 3.49Å; T224-L269 WeakPolarHBondContact CA-O 3.42Å; T224-K270 HydrophobicContact CG2-CG 4.37Å; T224-W271 PolarHBondContact O-NE1 3.45Å
225	L	88.8	Confident	85.5	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	123.6	-176.7	-169.2	76.2	0	0	0	108.4	E217 L269 W271 L274 I282 V302	E217-L225 VanDerWaalsContact O-CD1 3.3Å; E217-L225 WeakPolarHBondContact O-CD1 3.35Å; L225-L269 HydrophobicContact CB-CB 4.43Å; L225-L269 PolarHBondContact N-O 3.33Å; L225-L269 PolarHBondContact O-N 2.95Å; L225-W271 HydrophobicContact CD1-CZ2 3.82Å; L225-L274 HydrophobicContact CD2-CD1 4.18Å; L225-I282 HydrophobicContact CD2-CD1 3.57Å; L225-V302 HydrophobicContact CD1-CG1 3.9Å; L225-V302 HydrophobicContact CD2-CG1 3.94Å; L225-V302 HydrophobicContact CD2-CG2 4.38Å
226	L	92.4	Very high	83.8	Confident	44 Å²	44	63.5 Å²	63.5	23%	0.23	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	114.7	-179.3	-179.8	61.7	0	0	0	109.4	C216 E217 T228 H266 L268	C216-L226 WeakPolarHBondContact CA-O 3.5Å; E217-L226 PolarHBondContact N-O 3.37Å; E217-L226 PolarHBondContact O-N 2.96Å; L226-T228 HydrophobicContact CD1-CG2 4.34Å; L226-T228 HydrophobicContact CD2-CG2 4.26Å; L226-T228 HydrophobicContact CG-CG2 3.96Å; L226-H266 HydrophobicContact CD1-CB 4.17Å; L226-L268 HydrophobicContact CB-CD1 4.28Å; L226-L268 HydrophobicContact CD1-CD1 4.41Å
227	V	93.4	Very high	81.8	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.6	172.6	-173.9	0	0	0	0	107.7	V214 Q215 W229 V249 H266 A267 L269 I282 V284	V214-V227 HydrophobicContact CG1-CG1 4.11Å; Q215-V227 WeakPolarHBondContact O-CA 3.44Å; V227-W229 HydrophobicContact CB-CZ3 4.4Å; V227-W229 HydrophobicContact CG1-CE3 4.1Å; V227-W229 HydrophobicContact CG1-CZ3 4.09Å; V227-V249 HydrophobicContact CG1-CG1 4.46Å; V227-H266 CarbonylContact O-C 3.53Å; V227-H266 WeakPolarHBondContact O-CA 3.4Å; V227-H266 WeakPolarHBondContact O-CB 3.38Å; V227-A267 PolarHBondContact N-O 3.15Å; V227-A267 PolarHBondContact O-N 2.82Å; V227-L269 HydrophobicContact CG2-CD1 3.8Å; V227-L269 HydrophobicContact CG2-CG 4.32Å; V227-I282 HydrophobicContact CG1-CG2 3.9Å; V227-I282 HydrophobicContact CG2-CD1 3.84Å; V227-I282 HydrophobicContact CG2-CG2 4.1Å; V227-V284 HydrophobicContact CG1-CG2 4.19Å
228	T	95.4	Very high	79.5	Confident	40 Å²	40	70.2 Å²	70.2	25%	0.245	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	157.7	179.1	60.2	0	0	0	0	110.8	V214 Q215 L226 D265 H266	V214-T228 CarbonylContact C-O 3.59Å; V214-T228 VanDerWaalsContact CA-O 3.27Å; V214-T228 WeakPolarHBondContact CA-O 3.14Å; Q215-T228 PolarHBondContact N-O 3.03Å; Q215-T228 PolarHBondContact O-N 3.22Å; L226-T228 HydrophobicContact CD1-CG2 4.34Å; L226-T228 HydrophobicContact CD2-CG2 4.26Å; L226-T228 HydrophobicContact CG-CG2 3.96Å; T228-D265 CarbonylContact C-O 3.5Å; T228-D265 VanDerWaalsContact CA-O 3.31Å; T228-D265 WeakPolarHBondContact CA-O 3.41Å; T228-H266 HydrophobicContact CG2-CB 4.03Å
229	W	95.2	Very high	77.6	Confident	9 Å²	9	72.2 Å²	72.2	3%	0.034	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	162.3	176.6	59.5	84.3	0	0	0	111.5	P211 V214 V227 P231 Y247 V249 V259 G264 D265 A267 V284	P211-W229 HydrophobicContact CB-CB 4.14Å; P211-W229 HydrophobicContact CB-CG 4.05Å; P211-W229 HydrophobicContact CG-CG 4.46Å; V214-W229 HydrophobicContact CB-CB 4.41Å; V214-W229 HydrophobicContact CG2-CB 3.87Å; V227-W229 HydrophobicContact CB-CZ3 4.4Å; V227-W229 HydrophobicContact CG1-CE3 4.1Å; V227-W229 HydrophobicContact CG1-CZ3 4.09Å; W229-P231 WeakPolarHBondContact O-CD 3.43Å; W229-Y247 AromaticContact CE2-CG 3.95Å; W229-Y247 AromaticContact CZ2-CD2 3.96Å; W229-Y247 HydrophobicContact CZ2-CD2 3.96Å; W229-Y247 AromaticContact CZ2-CG 3.97Å; W229-Y247 HydrophobicContact CZ2-CG 3.97Å; W229-Y247 AromaticContact NE1-CD1 3.86Å; W229-Y247 AromaticContact NE1-CD2 3.58Å; W229-Y247 AromaticContact NE1-CE2 3.81Å; W229-Y247 AromaticContact NE1-CG 3.62Å; W229-V249 HydrophobicContact CH2-CG2 3.91Å; W229-V249 HydrophobicContact CZ3-CG2 3.9Å; W229-V259 HydrophobicContact CH2-CG2 3.91Å; W229-V259 HydrophobicContact CZ2-CB 4.35Å; W229-V259 HydrophobicContact CZ2-CG2 4.22Å; W229-G264 PolarHBondContact NE1-O 2.93Å; W229-D265 PolarHBondContact N-O 3.32Å; W229-D265 WeakPolarHBondContact O-CA 3.44Å; W229-D265 VanDerWaalsContact O-O 3.13Å; W229-A267 HydrophobicContact CH2-CB 3.86Å; W229-A267 HydrophobicContact CZ3-CB 4Å; W229-V284 HydrophobicContact CD2-CG1 4.11Å; W229-V284 HydrophobicContact CD2-CG2 4.39Å; W229-V284 HydrophobicContact CE3-CG1 4.19Å; W229-V284 HydrophobicContact CE3-CG2 3.82Å; W229-V284 HydrophobicContact CH2-CG1 4.49Å; W229-V284 HydrophobicContact CZ2-CG1 4.45Å; W229-V284 HydrophobicContact CZ3-CG1 4.37Å; W229-V284 HydrophobicContact CZ3-CG2 4.14Å
230	Q	91.4	Very high	75.7	Confident	118 Å²	118	73.5 Å²	73.5	55%	0.551	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	123	171.5	-171.5	175	-0.8	0	0	110.4	N212	N212-Q230 WeakPolarHBondContact O-CB 3.34Å; N212-Q230 PolarHBondContact O-N 2.98Å
231	P	90.1	Very high	73.9	Confident	29 Å²	29	77.2 Å²	77.2	19%	0.188	41%	0.409	C	S	.	.			trans	-60.3	146.6	176.5	-25.5	35.4	0	0	0	113.2	W229 M233 Y247 D265	W229-P231 WeakPolarHBondContact O-CD 3.43Å; P231-M233 HydrophobicContact CB-CG 4.48Å; P231-M233 HydrophobicContact CB-SD 4.21Å; P231-M233 PolarHBondContact O-N 2.92Å; P231-Y247 WeakPolarHBondContact CA-OH 3.47Å; P231-D265 HydrophobicContact CG-CB 3.76Å
232	V	84.9	Confident	72.6	Confident	17 Å²	17	71.6 Å²	71.6	10%	0.103	39%	0.385	C	S	.	.			trans	-82.3	83.3	-178.2	-178.2	0	0	0	0	110.1	D209 P211 Q235 V244 Y247 T286	D209-V232 HydrophobicContact CB-CG1 4.04Å; P211-V232 HydrophobicContact CB-CG2 4.23Å; V232-Q235 HydrophobicContact CG1-CB 4.26Å; V232-Q235 HydrophobicContact CG1-CG 3.52Å; V232-V244 HydrophobicContact CB-CG2 4.44Å; V232-Y247 HydrophobicContact CG2-CE1 4.21Å; V232-Y247 PolarHBondContact N-OH 2.79Å; V232-T286 HydrophobicContact CB-CG2 4.48Å; V232-T286 HydrophobicContact CG2-CG2 4.42Å
233	M	73.3	Confident	72	Confident	131 Å²	131	63.8 Å²	63.8	65%	0.645	35%	0.345	S	S	*	.			trans	-81.8	-12.9	-176.3	-60.4	-60.1	-71.3	0	0	114.6	P231	P231-M233 HydrophobicContact CB-CG 4.48Å; P231-M233 HydrophobicContact CB-SD 4.21Å; P231-M233 PolarHBondContact O-N 2.92Å
234	N	64.4	Low	72	Confident	153 Å²	153	63.2 Å²	63.2	82%	0.818	33%	0.334	S	S	*	.	S	Bend	trans	-90.7	-11.5	-172.7	-65.9	5.3	0	0	0	113.9
235	Q	63.1	Low	72	Confident	36 Å²	36	64.4 Å²	64.4	17%	0.168	34%	0.343	C	S	.	.	S	Bend	trans	-68.3	147.9	173.2	-74.8	-74.8	-36.2	0	0	110	D209 V232 K237 V244	D209-Q235 VanDerWaalsContact CG-NE2 3.3Å; D209-Q235 PolarHBondContact OD2-NE2 3.17Å; V232-Q235 HydrophobicContact CG1-CB 4.26Å; V232-Q235 HydrophobicContact CG1-CG 3.52Å; Q235-K237 PolarHBondContact O-N 3.45Å; Q235-V244 HydrophobicContact CB-CG2 4.2Å; Q235-V244 HydrophobicContact CG-CG2 4.48Å
236	P	55.4	Low	72.1	Confident	69 Å²	69	64.4 Å²	64.4	45%	0.448	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-59.8	137.2	-172	24.2	-34.3	0	0	0	111.7	S240 A242	P236-S240 PolarHBondContact O-OG 2.94Å; P236-A242 HydrophobicContact CG-CB 4.02Å
237	K	48.3	Very low	72.2	Confident	170 Å²	170	62.3 Å²	62.3	74%	0.739	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-63.9	151.3	-177.7	-64.6	179.3	-178.4	176.3	0	111.8	Q235 S240	Q235-K237 PolarHBondContact O-N 3.45Å; K237-S240 WeakPolarHBondContact O-CB 3.44Å; K237-S240 PolarHBondContact O-N 3.01Å; K237-S240 PolarHBondContact O-OG 2.9Å
238	P	43.1	Very low	72.3	Confident	101 Å²	101	62.8 Å²	62.8	66%	0.656	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	143.9	168.7	-23.4	31.2	0	0	0	111.3	A243	P238-A243 HydrophobicContact CB-CB 4.37Å; P238-A243 HydrophobicContact CG-CB 3.85Å
239	P	46.4	Very low	72.2	Confident	132 Å²	132	60.9 Å²	60.9	86%	0.857	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	cis	-90.8	20.3	14.3	37.4	-38.2	0	0	0	115.1
240	S	47.3	Very low	72.1	Confident	37 Å²	37	62.3 Å²	62.3	26%	0.259	33%	0.328	S	S	.	.	S	Bend	trans	-57.6	140.9	177.9	75.5	0	0	0	0	112.5	P236 K237 A242 A243	P236-S240 PolarHBondContact O-OG 2.94Å; K237-S240 WeakPolarHBondContact O-CB 3.44Å; K237-S240 PolarHBondContact O-N 3.01Å; K237-S240 PolarHBondContact O-OG 2.9Å; S240-A242 PolarHBondContact O-N 2.94Å; S240-A243 VanDerWaalsContact O-CB 3.3Å; S240-A243 WeakPolarHBondContact O-CB 3.03Å; S240-A243 PolarHBondContact O-N 3.48Å
241	R	47.6	Very low	72	Confident	192 Å²	192	57 Å²	57	73%	0.725	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	25.8	177.9	-61.1	-168	-171.2	-176.6	1.9	114.3	I205 E290	I205-R241 HydrophobicContact CD1-CB 4.46Å; I205-R241 WeakPolarHBondContact CD1-O 3.21Å; I205-R241 WeakPolarHBondContact CG1-O 3.49Å; I205-R241 WeakPolarHBondContact CG2-O 3.3Å; R241-E290 WeakPolarHBondContact CA-OE1 3.48Å; R241-E290 HydrophobicContact CB-CG 4.47Å; R241-E290 WeakPolarHBondContact CB-OE1 3.41Å; R241-E290 WeakPolarHBondContact CG-OE1 3.32Å
242	A	56.1	Low	71.7	Confident	15 Å²	15	59.7 Å²	59.7	12%	0.124	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	6.1	169	0	0	0	0	0	110.8	I205 P236 S240 V244	I205-A242 HydrophobicContact CG2-CB 4.27Å; P236-A242 HydrophobicContact CG-CB 4.02Å; S240-A242 PolarHBondContact O-N 2.94Å; A242-V244 PolarHBondContact O-N 2.74Å
243	A	67.8	Low	71.7	Confident	8 Å²	8	61.8 Å²	61.8	7%	0.066	34%	0.342	C	S	.	.			trans	-55.2	125.8	175.5	0	0	0	0	0	110.8	P238 S240 S245 T288 R289	P238-A243 HydrophobicContact CB-CB 4.37Å; P238-A243 HydrophobicContact CG-CB 3.85Å; S240-A243 VanDerWaalsContact O-CB 3.3Å; S240-A243 WeakPolarHBondContact O-CB 3.03Å; S240-A243 PolarHBondContact O-N 3.48Å; A243-S245 PolarHBondContact O-N 3.44Å; A243-T288 WeakPolarHBondContact O-CA 3.26Å; A243-R289 PolarHBondContact O-N 3.35Å; A243-R289 VanDerWaalsContact O-N 3.13Å
244	V	81	Confident	72.3	Confident	20 Å²	20	63.5 Å²	63.5	12%	0.121	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	136	171	-175.7	0	0	0	0	108.7	V232 Q235 A242 Y247 P262 T286	V232-V244 HydrophobicContact CB-CG2 4.44Å; Q235-V244 HydrophobicContact CB-CG2 4.2Å; Q235-V244 HydrophobicContact CG-CG2 4.48Å; A242-V244 PolarHBondContact O-N 2.74Å; V244-Y247 HydrophobicContact CG1-CE1 4.39Å; V244-Y247 HydrophobicContact CG1-CE2 4.45Å; V244-P262 HydrophobicContact CB-CB 4.02Å; V244-P262 HydrophobicContact CG1-CB 4.05Å; V244-P262 WeakPolarHBondContact O-CB 3.4Å; V244-T286 HydrophobicContact CB-CG2 4.21Å; V244-T286 HydrophobicContact CG1-CG2 3.61Å; V244-T286 HydrophobicContact CG2-CG2 3.62Å
245	S	86.5	Confident	73.5	Confident	31 Å²	31	61.1 Å²	61.1	22%	0.217	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-20.3	172.5	70	0	0	0	0	112.3	A243 N260 T261 K287 T288	A243-S245 PolarHBondContact O-N 3.44Å; S245-N260 CarbonylContact O-C 3.54Å; S245-T261 PolarHBondContact O-N 2.87Å; S245-K287 PolarHBondContact N-O 3.17Å; S245-K287 PolarHBondContact OG-O 3.43Å; S245-T288 PolarHBondContact OG-O 3.12Å
246	G	91.2	Very high	74.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.2	-165.4	-176.1	0	0	0	0	0	113	V259 K287	G246-V259 CarbonylContact C-O 3.6Å; G246-V259 WeakPolarHBondContact CA-O 3.12Å; G246-K287 PolarHBondContact N-O 3.14Å; G246-K287 WeakPolarHBondContact O-CB 3.32Å; G246-K287 PolarHBondContact O-N 3.45Å
247	Y	95.1	Very high	76.5	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	149	-177.3	-54.1	-86.1	0	0	0	111.2	P211 W229 P231 V232 V244 E258 V259 T261 P262 G264 V284 K285 T286	P211-Y247 HydrophobicContact CB-CD1 4.29Å; P211-Y247 HydrophobicContact CB-CE1 4.18Å; P211-Y247 HydrophobicContact CG-CD1 4.27Å; W229-Y247 AromaticContact CE2-CG 3.95Å; W229-Y247 AromaticContact CZ2-CD2 3.96Å; W229-Y247 HydrophobicContact CZ2-CD2 3.96Å; W229-Y247 AromaticContact CZ2-CG 3.97Å; W229-Y247 HydrophobicContact CZ2-CG 3.97Å; W229-Y247 AromaticContact NE1-CD1 3.86Å; W229-Y247 AromaticContact NE1-CD2 3.58Å; W229-Y247 AromaticContact NE1-CE2 3.81Å; W229-Y247 AromaticContact NE1-CG 3.62Å; P231-Y247 WeakPolarHBondContact CA-OH 3.47Å; V232-Y247 HydrophobicContact CG2-CE1 4.21Å; V232-Y247 PolarHBondContact N-OH 2.79Å; V244-Y247 HydrophobicContact CG1-CE1 4.39Å; V244-Y247 HydrophobicContact CG1-CE2 4.45Å; Y247-E258 WeakPolarHBondContact O-CA 3.35Å; Y247-V259 PolarHBondContact N-O 3.44Å; Y247-V259 PolarHBondContact O-N 3.13Å; Y247-T261 WeakPolarHBondContact CE2-O 3.37Å; Y247-P262 VanDerWaalsContact CE2-O 3.32Å; Y247-P262 WeakPolarHBondContact CE2-O 3.38Å; Y247-P262 PolarHBondContact OH-O 2.93Å; Y247-G264 WeakPolarHBondContact CD2-O 3Å; Y247-G264 WeakPolarHBondContact CE2-O 3.39Å; Y247-V284 HydrophobicContact CD1-CG1 4.48Å; Y247-K285 CarbonylContact C-O 3.44Å; Y247-K285 VanDerWaalsContact CA-O 3.23Å; Y247-K285 WeakPolarHBondContact CA-O 3.33Å; Y247-T286 HydrophobicContact CD1-CG2 4.41Å; Y247-T286 HydrophobicContact CE1-CG2 3.99Å
248	L	94.7	Very high	78.7	Confident	11 Å²	11	54.6 Å²	54.6	6%	0.058	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.5	173.5	-62.8	-172.3	0	0	0	109.5	Y250 K255 E258 V284 K285 K287 L293	L248-Y250 HydrophobicContact CB-CD2 4.26Å; L248-Y250 HydrophobicContact CB-CE2 3.6Å; L248-Y250 HydrophobicContact CD1-CE2 4.23Å; L248-K255 HydrophobicContact CD2-CD 4.39Å; L248-E258 HydrophobicContact CD2-CB 3.77Å; L248-E258 VanDerWaalsContact CD2-CD 3.49Å; L248-E258 HydrophobicContact CD2-CG 3.57Å; L248-E258 VanDerWaalsContact CD2-OE1 3.31Å; L248-E258 WeakPolarHBondContact CD2-OE1 3.48Å; L248-V284 CarbonylContact O-C 3.57Å; L248-V284 WeakPolarHBondContact O-CA 3.21Å; L248-K285 HydrophobicContact CB-CB 4.5Å; L248-K285 PolarHBondContact N-O 2.79Å; L248-K285 PolarHBondContact O-N 3.02Å; L248-K287 HydrophobicContact CD2-CD 4.28Å; L248-K287 HydrophobicContact CG-CD 4.47Å; L248-L293 HydrophobicContact CD1-CD1 3.79Å; L248-L293 HydrophobicContact CD1-CD2 3.58Å; L248-L293 HydrophobicContact CD1-CG 4.36Å; L248-L293 HydrophobicContact CG-CD2 4.25Å
249	V	94.3	Very high	81.1	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.1	178.1	-172	0	0	0	0	109.2	V227 W229 V256 G257 A267 L269 I282 V284	V227-V249 HydrophobicContact CG1-CG1 4.46Å; W229-V249 HydrophobicContact CH2-CG2 3.91Å; W229-V249 HydrophobicContact CZ3-CG2 3.9Å; V249-V256 HydrophobicContact CB-CG2 4.35Å; V249-V256 HydrophobicContact CG1-CG2 4.01Å; V249-V256 PolarHBondContact O-N 2.83Å; V249-G257 PolarHBondContact N-O 3.02Å; V249-G257 PolarHBondContact O-N 3.36Å; V249-G257 VanDerWaalsContact O-N 3.1Å; V249-A267 HydrophobicContact CG2-CB 3.93Å; V249-L269 HydrophobicContact CG1-CD1 4.15Å; V249-I282 HydrophobicContact CG1-CG2 3.84Å; V249-V284 HydrophobicContact CG1-CG2 4.34Å; V249-V284 HydrophobicContact CG2-CG1 4.41Å; V249-V284 HydrophobicContact CG2-CG2 4.26Å
250	Y	91.8	Very high	83.2	Confident	39 Å²	39	49.4 Å²	49.4	15%	0.153	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.7	180	-70.9	-100.8	0	0	0	110.5	L248 R254 K255 I282 T283 K285	L248-Y250 HydrophobicContact CB-CD2 4.26Å; L248-Y250 HydrophobicContact CB-CE2 3.6Å; L248-Y250 HydrophobicContact CD1-CE2 4.23Å; Y250-R254 CarbonylContact C-O 3.6Å; Y250-R254 WeakPolarHBondContact CA-O 3.27Å; Y250-K255 HydrophobicContact CD1-CB 4.11Å; Y250-K255 HydrophobicContact CE1-CB 3.83Å; Y250-I282 CarbonylContact O-C 3.52Å; Y250-I282 VanDerWaalsContact O-CA 3.25Å; Y250-I282 WeakPolarHBondContact O-CA 3.4Å; Y250-T283 PolarHBondContact N-O 2.87Å; Y250-T283 PolarHBondContact O-N 2.82Å; Y250-K285 HydrophobicContact CD2-CD 4.25Å; Y250-K285 HydrophobicContact CD2-CG 4.17Å; Y250-K285 HydrophobicContact CE2-CB 4.37Å; Y250-K285 HydrophobicContact CE2-CD 3.78Å; Y250-K285 HydrophobicContact CE2-CG 4Å
251	A	89.4	Confident	85.2	Confident	6 Å²	6	50.8 Å²	50.8	5%	0.05	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	123.6	171.2	0	0	0	0	0	108.8	G253 R254 V256 L274 P279 F281 I282	A251-G253 PolarHBondContact O-N 3.31Å; A251-G253 VanDerWaalsContact O-N 3.1Å; A251-R254 PolarHBondContact N-O 2.83Å; A251-R254 WeakPolarHBondContact O-CB 3.37Å; A251-R254 PolarHBondContact O-N 2.98Å; A251-V256 HydrophobicContact CB-CG1 3.78Å; A251-V256 HydrophobicContact CB-CG2 3.95Å; A251-L274 HydrophobicContact CB-CD2 4.33Å; A251-P279 HydrophobicContact CB-CB 3.78Å; A251-P279 HydrophobicContact CB-CG 4.03Å; A251-F281 CarbonylContact C-O 3.54Å; A251-F281 WeakPolarHBondContact CA-O 3.47Å; A251-I282 HydrophobicContact CB-CG1 4.1Å
252	D	84.9	Confident	87	Confident	85 Å²	85	44.5 Å²	44.5	46%	0.455	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	42	44	-171.6	-64	-26.2	0	0	0	113.5	R254 P279 L280 F281	D252-R254 VanDerWaalsContact C-N 3.31Å; D252-R254 PolarHBondContact O-N 2.64Å; D252-P279 VanDerWaalsContact OD2-CA 3.23Å; D252-P279 WeakPolarHBondContact OD2-CA 3.43Å; D252-L280 PolarHBondContact OD1-N 3.01Å; D252-L280 PolarHBondContact OD2-N 2.96Å; D252-F281 PolarHBondContact N-O 2.7Å; D252-F281 PolarHBondContact OD1-N 2.96Å
253	G	83.3	Confident	88.6	Confident	61 Å²	61	48.4 Å²	48.4	63%	0.629	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	-2	179.6	0	0	0	0	0	116.1	A251	A251-G253 PolarHBondContact O-N 3.31Å; A251-G253 VanDerWaalsContact O-N 3.1Å
254	R	86.9	Confident	89.7	Confident	167 Å²	167	48.3 Å²	48.3	63%	0.63	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	133	174.2	-60.6	-178.3	179.5	-176.5	0.5	110.3	Y250 A251 D252 V256 C275	Y250-R254 CarbonylContact C-O 3.6Å; Y250-R254 WeakPolarHBondContact CA-O 3.27Å; A251-R254 PolarHBondContact N-O 2.83Å; A251-R254 WeakPolarHBondContact O-CB 3.37Å; A251-R254 PolarHBondContact O-N 2.98Å; D252-R254 VanDerWaalsContact C-N 3.31Å; D252-R254 PolarHBondContact O-N 2.64Å; R254-V256 PolarHBondContact O-N 3.13Å; R254-C275 PolarHBondContact NH1-SG 3.46Å
255	K	90.2	Very high	90.3	Very high	104 Å²	104	51.1 Å²	51.1	45%	0.452	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	124.5	173.3	178.2	-178.2	168.2	177.2	0	109.4	L248 Y250 E258	L248-K255 HydrophobicContact CD2-CD 4.39Å; Y250-K255 HydrophobicContact CD1-CB 4.11Å; Y250-K255 HydrophobicContact CE1-CB 3.83Å; K255-E258 VanDerWaalsContact NZ-CD 3.3Å; K255-E258 IonicContact NZ-OE1 3.16Å; K255-E258 IonicContact NZ-OE2 2.7Å; K255-E258 PolarHBondContact NZ-OE2 3.28Å
256	V	90.2	Very high	90.7	Very high	46 Å²	46	54.4 Å²	54.4	28%	0.279	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	-17.5	179.1	-65.1	0	0	0	0	113.3	V249 A251 R254 L269 L274	V249-V256 HydrophobicContact CB-CG2 4.35Å; V249-V256 HydrophobicContact CG1-CG2 4.01Å; V249-V256 PolarHBondContact O-N 2.83Å; A251-V256 HydrophobicContact CB-CG1 3.78Å; A251-V256 HydrophobicContact CB-CG2 3.95Å; R254-V256 PolarHBondContact O-N 3.13Å; V256-L269 HydrophobicContact CG2-CD1 3.78Å; V256-L269 HydrophobicContact CG2-CD2 4.23Å; V256-L274 HydrophobicContact CB-CD2 3.95Å; V256-L274 HydrophobicContact CG1-CD2 3.69Å; V256-L274 HydrophobicContact CG2-CD2 4.24Å
257	G	90.3	Very high	90.8	Very high	13 Å²	13	54.9 Å²	54.9	13%	0.134	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	163.5	178.9	0	0	0	0	0	113.8	V249	V249-G257 PolarHBondContact N-O 3.02Å; V249-G257 PolarHBondContact O-N 3.36Å; V249-G257 VanDerWaalsContact O-N 3.1Å
258	E	93.9	Very high	90.7	Very high	78 Å²	78	59.1 Å²	59.1	36%	0.364	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	126.7	174.1	174.3	160.7	-140.8	0	0	110	Y247 L248 K255 N260 K287	Y247-E258 WeakPolarHBondContact O-CA 3.35Å; L248-E258 HydrophobicContact CD2-CB 3.77Å; L248-E258 VanDerWaalsContact CD2-CD 3.49Å; L248-E258 HydrophobicContact CD2-CG 3.57Å; L248-E258 VanDerWaalsContact CD2-OE1 3.31Å; L248-E258 WeakPolarHBondContact CD2-OE1 3.48Å; K255-E258 VanDerWaalsContact NZ-CD 3.3Å; K255-E258 IonicContact NZ-OE1 3.16Å; K255-E258 IonicContact NZ-OE2 2.7Å; K255-E258 PolarHBondContact NZ-OE2 3.28Å; E258-N260 PolarHBondContact OE1-OD1 2.85Å; E258-K287 IonicContact OE1-NZ 2.78Å; E258-K287 PolarHBondContact OE1-NZ 3.08Å
259	V	93.9	Very high	90.4	Very high	26 Å²	26	59.2 Å²	59.2	16%	0.158	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	97.8	-178.6	176.6	0	0	0	0	107.2	W229 G246 Y247 T261 A267	W229-V259 HydrophobicContact CH2-CG2 3.91Å; W229-V259 HydrophobicContact CZ2-CB 4.35Å; W229-V259 HydrophobicContact CZ2-CG2 4.22Å; G246-V259 CarbonylContact C-O 3.6Å; G246-V259 WeakPolarHBondContact CA-O 3.12Å; Y247-V259 PolarHBondContact N-O 3.44Å; Y247-V259 PolarHBondContact O-N 3.13Å; V259-T261 WeakPolarHBondContact CG1-OG1 3.2Å; V259-T261 PolarHBondContact O-N 2.75Å; V259-A267 HydrophobicContact CG2-CB 3.98Å
260	N	91.7	Very high	89.9	Confident	99 Å²	99	64.8 Å²	64.8	53%	0.529	35%	0.347	S	S	.	.			trans	-81.1	46.8	-176	-68.4	-62.3	0	0	0	112.8	S245 E258 K287	S245-N260 CarbonylContact O-C 3.54Å; E258-N260 PolarHBondContact OE1-OD1 2.85Å; N260-K287 PolarHBondContact OD1-NZ 3.03Å
261	T	89.1	Confident	89.2	Confident	65 Å²	65	65.6 Å²	65.6	40%	0.399	35%	0.35	S	S	.	.			trans	-136.3	131	174	52.7	0	0	0	0	110.3	S245 Y247 V259 T263 G264	S245-T261 PolarHBondContact O-N 2.87Å; Y247-T261 WeakPolarHBondContact CE2-O 3.37Å; V259-T261 WeakPolarHBondContact CG1-OG1 3.2Å; V259-T261 PolarHBondContact O-N 2.75Å; T261-T263 VanDerWaalsContact C-N 3.27Å; T261-T263 PolarHBondContact O-N 3.1Å; T261-G264 PolarHBondContact O-N 2.64Å; T261-G264 WeakPolarHBondContact OG1-CA 3.46Å; T261-G264 PolarHBondContact OG1-N 2.81Å
262	P	85.8	Confident	88.5	Confident	61 Å²	61	70.3 Å²	70.3	40%	0.396	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-28.4	-179	24.9	-33.2	0	0	0	113.5	V244 Y247 G264	V244-P262 HydrophobicContact CB-CB 4.02Å; V244-P262 HydrophobicContact CG1-CB 4.05Å; V244-P262 WeakPolarHBondContact O-CB 3.4Å; Y247-P262 VanDerWaalsContact CE2-O 3.32Å; Y247-P262 WeakPolarHBondContact CE2-O 3.38Å; Y247-P262 PolarHBondContact OH-O 2.93Å; P262-G264 VanDerWaalsContact C-N 3.32Å
263	T	88.2	Confident	88	Confident	96 Å²	96	72 Å²	72	59%	0.589	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	6.1	174.4	57.5	0	0	0	0	112.9	T261 D265	T261-T263 VanDerWaalsContact C-N 3.27Å; T261-T263 PolarHBondContact O-N 3.1Å; T263-D265 PolarHBondContact O-N 2.8Å
264	G	90.8	Very high	87.3	Confident	6 Å²	6	69.8 Å²	69.8	6%	0.062	37%	0.365	C	S	.	.			trans	-66	125	175.6	0	0	0	0	0	110.8	W229 Y247 T261 P262	W229-G264 PolarHBondContact NE1-O 2.93Å; Y247-G264 WeakPolarHBondContact CD2-O 3Å; Y247-G264 WeakPolarHBondContact CE2-O 3.39Å; T261-G264 PolarHBondContact O-N 2.64Å; T261-G264 WeakPolarHBondContact OG1-CA 3.46Å; T261-G264 PolarHBondContact OG1-N 2.81Å; P262-G264 VanDerWaalsContact C-N 3.32Å
265	D	93.7	Very high	86.1	Confident	79 Å²	79	65 Å²	65	42%	0.422	36%	0.357	S	S	.	.			trans	-117	-3.7	-174	59.5	-14.8	0	0	0	112.9	T228 W229 P231 T263	T228-D265 CarbonylContact C-O 3.5Å; T228-D265 VanDerWaalsContact CA-O 3.31Å; T228-D265 WeakPolarHBondContact CA-O 3.41Å; W229-D265 PolarHBondContact N-O 3.32Å; W229-D265 WeakPolarHBondContact O-CA 3.44Å; W229-D265 VanDerWaalsContact O-O 3.13Å; P231-D265 HydrophobicContact CG-CB 3.76Å; T263-D265 PolarHBondContact O-N 2.8Å
266	H	94.7	Very high	84.4	Confident	100 Å²	100	68.2 Å²	68.2	46%	0.463	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	161.4	180	68.8	-79.3	0	0	0	114	L226 V227 T228	L226-H266 HydrophobicContact CD1-CB 4.17Å; V227-H266 CarbonylContact O-C 3.53Å; V227-H266 WeakPolarHBondContact O-CA 3.4Å; V227-H266 WeakPolarHBondContact O-CB 3.38Å; T228-H266 HydrophobicContact CG2-CB 4.03Å
267	A	94	Very high	83.3	Confident	11 Å²	11	72.1 Å²	72.1	9%	0.091	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	134	164.8	0	0	0	0	0	110.4	V227 W229 V249 V259	V227-A267 PolarHBondContact N-O 3.15Å; V227-A267 PolarHBondContact O-N 2.82Å; W229-A267 HydrophobicContact CH2-CB 3.86Å; W229-A267 HydrophobicContact CZ3-CB 4Å; V249-A267 HydrophobicContact CG2-CB 3.93Å; V259-A267 HydrophobicContact CG2-CB 3.98Å
268	L	92.1	Very high	82.1	Confident	88 Å²	88	75.7 Å²	75.7	46%	0.461	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	112.4	170.2	-171.7	70.8	0	0	0	109.3	L226	L226-L268 HydrophobicContact CB-CD1 4.28Å; L226-L268 HydrophobicContact CD1-CD1 4.41Å
269	L	89.3	Confident	81	Confident	14 Å²	14	72.6 Å²	72.6	7%	0.073	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	151.5	176.3	-55.1	177.1	0	0	0	109.8	T224 L225 V227 V249 V256 L274 I282	T224-L269 CarbonylContact C-O 3.49Å; T224-L269 WeakPolarHBondContact CA-O 3.42Å; L225-L269 HydrophobicContact CB-CB 4.43Å; L225-L269 PolarHBondContact N-O 3.33Å; L225-L269 PolarHBondContact O-N 2.95Å; V227-L269 HydrophobicContact CG2-CD1 3.8Å; V227-L269 HydrophobicContact CG2-CG 4.32Å; V249-L269 HydrophobicContact CG1-CD1 4.15Å; V256-L269 HydrophobicContact CG2-CD1 3.78Å; V256-L269 HydrophobicContact CG2-CD2 4.23Å; L269-L274 HydrophobicContact CD1-CD2 4.39Å; L269-I282 HydrophobicContact CD1-CD1 4.12Å
270	K	84.5	Confident	80.3	Confident	117 Å²	117	76.3 Å²	76.3	51%	0.509	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	138.1	168.5	-60.9	176.6	-179.2	172.8	0	109.6	G223 T224 S272 D273 L274	G223-K270 WeakPolarHBondContact O-CA 3.33Å; T224-K270 HydrophobicContact CG2-CG 4.37Å; K270-S272 PolarHBondContact O-N 2.84Å; K270-S272 VanDerWaalsContact O-N 3.16Å; K270-D273 WeakPolarHBondContact CB-OD2 3.46Å; K270-D273 PolarHBondContact O-N 2.9Å; K270-L274 PolarHBondContact O-N 3.44Å
271	W	76	Confident	80.1	Confident	56 Å²	56	76.1 Å²	76.1	21%	0.212	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.3	174.4	-73.4	77.7	0	0	0	112.4	G223 T224 L225 D273 L274 P278 V302 L305	G223-W271 PolarHBondContact O-N 2.79Å; T224-W271 PolarHBondContact O-NE1 3.45Å; L225-W271 HydrophobicContact CD1-CZ2 3.82Å; W271-D273 VanDerWaalsContact C-N 3.32Å; W271-L274 PolarHBondContact O-N 2.87Å; W271-P278 HydrophobicContact CZ3-CB 3.77Å; W271-V302 HydrophobicContact CH2-CG1 3.5Å; W271-V302 HydrophobicContact CZ2-CG1 3.84Å; W271-V302 HydrophobicContact CZ3-CG1 4.33Å; W271-L305 HydrophobicContact CH2-CD1 4.23Å; W271-L305 HydrophobicContact CZ2-CD1 3.54Å
272	S	74.5	Confident	80.2	Confident	104 Å²	104	73 Å²	73	73%	0.727	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-24.7	173.7	-45.4	0	0	0	0	114.8	K270	K270-S272 PolarHBondContact O-N 2.84Å; K270-S272 VanDerWaalsContact O-N 3.16Å
273	D	74.3	Confident	80.6	Confident	122 Å²	122	70.9 Å²	70.9	65%	0.652	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-13.8	-179.7	-56.8	-33.3	0	0	0	111.2	K270 W271	K270-D273 WeakPolarHBondContact CB-OD2 3.46Å; K270-D273 PolarHBondContact O-N 2.9Å; W271-D273 VanDerWaalsContact C-N 3.32Å
274	L	68.9	Low	80.9	Confident	13 Å²	13	66.3 Å²	66.3	7%	0.068	36%	0.358	C	S	.	.	S	Bend	trans	-77.2	163.7	165	-54.7	177.3	0	0	0	109.4	L225 A251 V256 L269 K270 W271 P279	L225-L274 HydrophobicContact CD2-CD1 4.18Å; A251-L274 HydrophobicContact CB-CD2 4.33Å; V256-L274 HydrophobicContact CB-CD2 3.95Å; V256-L274 HydrophobicContact CG1-CD2 3.69Å; V256-L274 HydrophobicContact CG2-CD2 4.24Å; L269-L274 HydrophobicContact CD1-CD2 4.39Å; K270-L274 PolarHBondContact O-N 3.44Å; W271-L274 PolarHBondContact O-N 2.87Å; L274-P279 HydrophobicContact CB-CG 4.29Å; L274-P279 HydrophobicContact CD1-CG 3.85Å; L274-P279 HydrophobicContact CD2-CG 4.35Å; L274-P279 HydrophobicContact CG-CG 4.38Å
275	C	61.7	Low	81	Confident	66 Å²	66	67.8 Å²	67.8	45%	0.446	36%	0.362	S	S	.	.			trans	-71.9	168	-172.5	-68.1	0	0	0	0	113	R254 D277	R254-C275 PolarHBondContact NH1-SG 3.46Å; C275-D277 CarbonylContact C-O 3.48Å; C275-D277 CarbonylContact O-C 3.58Å; C275-D277 PolarHBondContact O-N 3.27Å; C275-D277 VanDerWaalsContact O-O 3.07Å
276	N	55.2	Low	80.8	Confident	172 Å²	172	64 Å²	64	92%	0.92	34%	0.342	S	S	*	.	S	Bend	trans	-54.2	-24.3	178.6	-66.8	-21.1	0	0	0	114.2
277	D	66.5	Low	80.6	Confident	129 Å²	129	61.2 Å²	61.2	69%	0.69	33%	0.329	S	S	*	.	S	Bend	trans	-103.1	135.1	169.6	-60.4	-68.4	0	0	0	109	C275	C275-D277 CarbonylContact C-O 3.48Å; C275-D277 CarbonylContact O-C 3.58Å; C275-D277 PolarHBondContact O-N 3.27Å; C275-D277 VanDerWaalsContact O-O 3.07Å
278	P	64.7	Low	80	Confident	87 Å²	87	60.8 Å²	60.8	57%	0.565	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-63.8	126.2	-179.3	28.5	-35.6	0	0	0	109.8	W271 L280	W271-P278 HydrophobicContact CZ3-CB 3.77Å; P278-L280 PolarHBondContact O-N 3.43Å
279	P	71.7	Confident	79.2	Confident	13 Å²	13	66.3 Å²	66.3	8%	0.084	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-65.5	139.4	-176.5	24.1	-30.9	0	0	0	110.9	A251 D252 L274 V302	A251-P279 HydrophobicContact CB-CB 3.78Å; A251-P279 HydrophobicContact CB-CG 4.03Å; D252-P279 VanDerWaalsContact OD2-CA 3.23Å; D252-P279 WeakPolarHBondContact OD2-CA 3.43Å; L274-P279 HydrophobicContact CB-CG 4.29Å; L274-P279 HydrophobicContact CD1-CG 3.85Å; L274-P279 HydrophobicContact CD2-CG 4.35Å; L274-P279 HydrophobicContact CG-CG 4.38Å; P279-V302 HydrophobicContact CG-CG2 4.39Å; P279-V302 WeakPolarHBondContact O-CB 3.34Å; P279-V302 VanDerWaalsContact O-CG2 3.23Å; P279-V302 WeakPolarHBondContact O-CG2 3.38Å
280	L	78.4	Confident	78.4	Confident	104 Å²	104	69.4 Å²	69.4	55%	0.545	35%	0.353	S	S	.	.	S	Bend	trans	-75.9	-42.5	-177.7	-66	174.8	0	0	0	111.1	D252 P278 R301 V302	D252-L280 PolarHBondContact OD1-N 3.01Å; D252-L280 PolarHBondContact OD2-N 2.96Å; P278-L280 PolarHBondContact O-N 3.43Å; L280-R301 WeakPolarHBondContact O-CA 3.43Å; L280-V302 PolarHBondContact O-N 2.98Å
281	F	88.1	Confident	78.1	Confident	95 Å²	95	66 Å²	66	42%	0.417	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	145.3	-174.6	-59.2	-81	0	0	0	113.6	A251 D252 A299 V300 R301	A251-F281 CarbonylContact C-O 3.54Å; A251-F281 WeakPolarHBondContact CA-O 3.47Å; D252-F281 PolarHBondContact N-O 2.7Å; D252-F281 PolarHBondContact OD1-N 2.96Å; F281-A299 HydrophobicContact CB-CB 4.39Å; F281-A299 HydrophobicContact CD1-CB 4.32Å; F281-V300 CarbonylContact C-O 3.49Å; F281-V300 VanDerWaalsContact CA-O 3.28Å; F281-V300 WeakPolarHBondContact CA-O 3.49Å; F281-R301 HydrophobicContact CD1-CB 4.29Å; F281-R301 HydrophobicContact CE1-CB 4.13Å; F281-R301 HydrophobicContact CE1-CG 4.47Å
282	I	91.1	Very high	78.2	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137.5	171.5	-68.9	179.8	0	0	0	110	L225 V227 V249 Y250 A251 L269 A299 V300 V302	L225-I282 HydrophobicContact CD2-CD1 3.57Å; V227-I282 HydrophobicContact CG1-CG2 3.9Å; V227-I282 HydrophobicContact CG2-CD1 3.84Å; V227-I282 HydrophobicContact CG2-CG2 4.1Å; V249-I282 HydrophobicContact CG1-CG2 3.84Å; Y250-I282 CarbonylContact O-C 3.52Å; Y250-I282 VanDerWaalsContact O-CA 3.25Å; Y250-I282 WeakPolarHBondContact O-CA 3.4Å; A251-I282 HydrophobicContact CB-CG1 4.1Å; L269-I282 HydrophobicContact CD1-CD1 4.12Å; I282-A299 WeakPolarHBondContact O-CA 3.42Å; I282-V300 PolarHBondContact N-O 3.44Å; I282-V300 PolarHBondContact O-N 3.09Å; I282-V302 HydrophobicContact CD1-CG2 3.81Å; I282-V302 HydrophobicContact CG1-CG2 3.87Å
283	T	93.5	Very high	78.7	Confident	17 Å²	17	63.1 Å²	63.1	10%	0.104	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	158.3	170.5	57.9	0	0	0	0	110.3	Y250 D296 S297 A299	Y250-T283 PolarHBondContact N-O 2.87Å; Y250-T283 PolarHBondContact O-N 2.82Å; T283-D296 WeakPolarHBondContact CB-OD1 3.33Å; T283-D296 HydrophobicContact CG2-CB 4.07Å; T283-D296 PolarHBondContact OG1-OD1 2.71Å; T283-S297 WeakPolarHBondContact CA-OG 3.47Å; T283-A299 HydrophobicContact CG2-CB 3.86Å
284	V	95	Very high	79.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	144.9	177.2	-171.8	0	0	0	0	109.4	P211 V214 V227 W229 Y247 L248 V249 S297	P211-V284 HydrophobicContact CG-CB 3.73Å; P211-V284 HydrophobicContact CG-CG1 3.73Å; V214-V284 HydrophobicContact CG1-CG2 3.73Å; V214-V284 HydrophobicContact CG2-CB 4.32Å; V214-V284 HydrophobicContact CG2-CG2 4.29Å; V227-V284 HydrophobicContact CG1-CG2 4.19Å; W229-V284 HydrophobicContact CD2-CG1 4.11Å; W229-V284 HydrophobicContact CD2-CG2 4.39Å; W229-V284 HydrophobicContact CE3-CG1 4.19Å; W229-V284 HydrophobicContact CE3-CG2 3.82Å; W229-V284 HydrophobicContact CH2-CG1 4.49Å; W229-V284 HydrophobicContact CZ2-CG1 4.45Å; W229-V284 HydrophobicContact CZ3-CG1 4.37Å; W229-V284 HydrophobicContact CZ3-CG2 4.14Å; Y247-V284 HydrophobicContact CD1-CG1 4.48Å; L248-V284 CarbonylContact O-C 3.57Å; L248-V284 WeakPolarHBondContact O-CA 3.21Å; V249-V284 HydrophobicContact CG1-CG2 4.34Å; V249-V284 HydrophobicContact CG2-CG1 4.41Å; V249-V284 HydrophobicContact CG2-CG2 4.26Å; V284-S297 PolarHBondContact N-OG 2.88Å; V284-S297 WeakPolarHBondContact O-CB 3.22Å; V284-S297 PolarHBondContact O-N 3.05Å; V284-S297 VanDerWaalsContact O-N 3.17Å; V284-S297 PolarHBondContact O-OG 2.99Å
285	K	93.3	Very high	80	Confident	37 Å²	37	61.3 Å²	61.3	16%	0.161	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.2	177.5	-58.6	-169	178.3	-168.1	0	111.7	Y247 L248 Y250 S294 D296	Y247-K285 CarbonylContact C-O 3.44Å; Y247-K285 VanDerWaalsContact CA-O 3.23Å; Y247-K285 WeakPolarHBondContact CA-O 3.33Å; L248-K285 HydrophobicContact CB-CB 4.5Å; L248-K285 PolarHBondContact N-O 2.79Å; L248-K285 PolarHBondContact O-N 3.02Å; Y250-K285 HydrophobicContact CD2-CD 4.25Å; Y250-K285 HydrophobicContact CD2-CG 4.17Å; Y250-K285 HydrophobicContact CE2-CB 4.37Å; Y250-K285 HydrophobicContact CE2-CD 3.78Å; Y250-K285 HydrophobicContact CE2-CG 4Å; K285-S294 WeakPolarHBondContact CA-OG 3.17Å; K285-S294 WeakPolarHBondContact CB-OG 3.3Å; K285-D296 WeakPolarHBondContact CE-OD1 3.44Å; K285-D296 WeakPolarHBondContact CE-OD2 3.42Å; K285-D296 VanDerWaalsContact NZ-CG 3.29Å; K285-D296 IonicContact NZ-OD1 2.75Å; K285-D296 PolarHBondContact NZ-OD1 2.84Å; K285-D296 IonicContact NZ-OD2 2.69Å; K285-D296 PolarHBondContact NZ-OD2 2.85Å
286	T	90.3	Very high	81.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	138.7	171.5	-51.7	0	0	0	0	109.7	P208 D209 P211 V232 V244 Y247 L293 S294	P208-T286 HydrophobicContact CB-CG2 3.91Å; P208-T286 HydrophobicContact CG-CG2 4.33Å; D209-T286 WeakPolarHBondContact O-CB 3.49Å; D209-T286 PolarHBondContact O-OG1 3.03Å; P211-T286 WeakPolarHBondContact CD-OG1 3.43Å; V232-T286 HydrophobicContact CB-CG2 4.48Å; V232-T286 HydrophobicContact CG2-CG2 4.42Å; V244-T286 HydrophobicContact CB-CG2 4.21Å; V244-T286 HydrophobicContact CG1-CG2 3.61Å; V244-T286 HydrophobicContact CG2-CG2 3.62Å; Y247-T286 HydrophobicContact CD1-CG2 4.41Å; Y247-T286 HydrophobicContact CE1-CG2 3.99Å; T286-L293 CarbonylContact O-C 3.56Å; T286-L293 VanDerWaalsContact O-CA 3.3Å; T286-L293 WeakPolarHBondContact O-CA 3.26Å; T286-S294 PolarHBondContact N-OG 2.82Å; T286-S294 PolarHBondContact O-N 3.36Å
287	K	88.7	Confident	83	Confident	41 Å²	41	54.4 Å²	54.4	18%	0.178	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.4	-176.9	173.2	-167.6	164.4	-169.6	0	109.8	S245 G246 L248 E258 N260 L293	S245-K287 PolarHBondContact N-O 3.17Å; S245-K287 PolarHBondContact OG-O 3.43Å; G246-K287 PolarHBondContact N-O 3.14Å; G246-K287 WeakPolarHBondContact O-CB 3.32Å; G246-K287 PolarHBondContact O-N 3.45Å; L248-K287 HydrophobicContact CD2-CD 4.28Å; L248-K287 HydrophobicContact CG-CD 4.47Å; E258-K287 IonicContact OE1-NZ 2.78Å; E258-K287 PolarHBondContact OE1-NZ 3.08Å; N260-K287 PolarHBondContact OD1-NZ 3.03Å; K287-L293 HydrophobicContact CB-CD2 3.74Å; K287-L293 HydrophobicContact CG-CD2 3.88Å
288	T	81.6	Confident	84	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	162	172.5	55.7	0	0	0	0	112.4	P208 A243 S245 E290 G291 I292	P208-T288 HydrophobicContact CB-CG2 4Å; P208-T288 HydrophobicContact CG-CG2 3.9Å; A243-T288 WeakPolarHBondContact O-CA 3.26Å; S245-T288 PolarHBondContact OG-O 3.12Å; T288-E290 PolarHBondContact O-N 2.92Å; T288-G291 PolarHBondContact O-N 2.96Å; T288-I292 PolarHBondContact N-O 3.4Å; T288-I292 WeakPolarHBondContact OG1-CA 3.05Å; T288-I292 WeakPolarHBondContact OG1-CB 3.07Å; T288-I292 PolarHBondContact OG1-N 3.39Å; T288-I292 PolarHBondContact OG1-O 2.89Å
289	R	76.4	Confident	85.2	Confident	204 Å²	204	50.6 Å²	50.6	77%	0.77	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-31	174.6	-173.4	179.7	-176.3	179.4	1.9	112.8	A243 G291	A243-R289 PolarHBondContact O-N 3.35Å; A243-R289 VanDerWaalsContact O-N 3.13Å; R289-G291 PolarHBondContact O-N 3.09Å
290	E	71.8	Confident	86	Confident	79 Å²	79	51 Å²	51	37%	0.369	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-1.8	176.7	-68.5	72	-163.2	0	0	113.6	I205 R241 T288	I205-E290 HydrophobicContact CD1-CB 3.94Å; I205-E290 HydrophobicContact CD1-CG 3.77Å; R241-E290 WeakPolarHBondContact CA-OE1 3.48Å; R241-E290 HydrophobicContact CB-CG 4.47Å; R241-E290 WeakPolarHBondContact CB-OE1 3.41Å; R241-E290 WeakPolarHBondContact CG-OE1 3.32Å; T288-E290 PolarHBondContact O-N 2.92Å
291	G	78.3	Confident	86.4	Confident	45 Å²	45	53.7 Å²	53.7	46%	0.464	27%	0.274	S	S	.	.	S	Bend	trans	83.9	3.1	177.6	0	0	0	0	0	115.3	T288 R289	T288-G291 PolarHBondContact O-N 2.96Å; R289-G291 PolarHBondContact O-N 3.09Å
292	I	77	Confident	86.2	Confident	46 Å²	46	49.6 Å²	49.6	24%	0.236	26%	0.257	C	S	.	.			trans	-74.4	135.4	174.1	-63	171.5	0	0	0	109.3	I205 L207 T288	I205-I292 HydrophobicContact CB-CD1 3.69Å; I205-I292 HydrophobicContact CD1-CD1 3.73Å; I205-I292 HydrophobicContact CG1-CD1 4.29Å; I205-I292 HydrophobicContact CG2-CD1 3.85Å; L207-I292 HydrophobicContact CD2-CG2 3.88Å; T288-I292 PolarHBondContact N-O 3.4Å; T288-I292 WeakPolarHBondContact OG1-CA 3.05Å; T288-I292 WeakPolarHBondContact OG1-CB 3.07Å; T288-I292 PolarHBondContact OG1-N 3.39Å; T288-I292 PolarHBondContact OG1-O 2.89Å
293	L	85.6	Confident	85.5	Confident	54 Å²	54	51.5 Å²	51.5	28%	0.283	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-106.5	152.6	-176.6	-55.7	-179.2	0	0	0	111.9	L248 T286 K287	L248-L293 HydrophobicContact CD1-CD1 3.79Å; L248-L293 HydrophobicContact CD1-CD2 3.58Å; L248-L293 HydrophobicContact CD1-CG 4.36Å; L248-L293 HydrophobicContact CG-CD2 4.25Å; T286-L293 CarbonylContact O-C 3.56Å; T286-L293 VanDerWaalsContact O-CA 3.3Å; T286-L293 WeakPolarHBondContact O-CA 3.26Å; K287-L293 HydrophobicContact CB-CD2 3.74Å; K287-L293 HydrophobicContact CG-CD2 3.88Å
294	S	85.8	Confident	84.1	Confident	9 Å²	9	55.9 Å²	55.9	6%	0.063	29%	0.293	C	S	.	.			trans	-70.7	175.4	170.4	67.7	0	0	0	0	112.6	P208 K285 T286	P208-S294 VanDerWaalsContact O-CA 3.29Å; P208-S294 WeakPolarHBondContact O-CA 3.49Å; P208-S294 WeakPolarHBondContact O-CB 3.45Å; K285-S294 WeakPolarHBondContact CA-OG 3.17Å; K285-S294 WeakPolarHBondContact CB-OG 3.3Å; T286-S294 PolarHBondContact N-OG 2.82Å; T286-S294 PolarHBondContact O-N 3.36Å
295	T	86	Confident	82.2	Confident	89 Å²	89	60.2 Å²	60.2	55%	0.546	32%	0.315	S	S	.	.			trans	-60.4	166.9	154.1	53.7	0	0	0	0	110.9
296	D	88.1	Confident	80	Confident	75 Å²	75	64.9 Å²	64.9	40%	0.401	34%	0.342	S	S	.	.			trans	-58.9	146.9	165	-70.8	-85.3	0	0	0	111.4	T283 K285	T283-D296 WeakPolarHBondContact CB-OD1 3.33Å; T283-D296 HydrophobicContact CG2-CB 4.07Å; T283-D296 PolarHBondContact OG1-OD1 2.71Å; K285-D296 WeakPolarHBondContact CE-OD1 3.44Å; K285-D296 WeakPolarHBondContact CE-OD2 3.42Å; K285-D296 VanDerWaalsContact NZ-CG 3.29Å; K285-D296 IonicContact NZ-OD1 2.75Å; K285-D296 PolarHBondContact NZ-OD1 2.84Å; K285-D296 IonicContact NZ-OD2 2.69Å; K285-D296 PolarHBondContact NZ-OD2 2.85Å
297	S	91.4	Very high	77.4	Confident	17 Å²	17	75.9 Å²	75.9	12%	0.119	38%	0.383	C	S	.	.			trans	-69.2	-174.5	168.2	65.1	0	0	0	0	112.5	V214 T283 V284 A299	V214-S297 VanDerWaalsContact CG2-CB 3.46Å; V214-S297 WeakPolarHBondContact CG2-OG 3.48Å; T283-S297 WeakPolarHBondContact CA-OG 3.47Å; V284-S297 PolarHBondContact N-OG 2.88Å; V284-S297 WeakPolarHBondContact O-CB 3.22Å; V284-S297 PolarHBondContact O-N 3.05Å; V284-S297 VanDerWaalsContact O-N 3.17Å; V284-S297 PolarHBondContact O-OG 2.99Å; S297-A299 PolarHBondContact O-N 3.07Å
298	N	87.6	Confident	74.5	Confident	75 Å²	75	80 Å²	80	40%	0.401	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-53.4	135.6	157.3	67	-78.9	0	0	0	110	V214	V214-N298 WeakPolarHBondContact CB-OD1 3.33Å; V214-N298 PolarHBondContact N-OD1 3.16Å; V214-N298 VanDerWaalsContact N-OD1 3.08Å; V214-N298 PolarHBondContact O-ND2 3.41Å
299	A	88.9	Confident	72.1	Confident	61 Å²	61	84.6 Å²	84.6	50%	0.504	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-85.4	121.7	177.8	0	0	0	0	0	109.9	F281 I282 T283 S297	F281-A299 HydrophobicContact CB-CB 4.39Å; F281-A299 HydrophobicContact CD1-CB 4.32Å; I282-A299 WeakPolarHBondContact O-CA 3.42Å; T283-A299 HydrophobicContact CG2-CB 3.86Å; S297-A299 PolarHBondContact O-N 3.07Å
300	V	89.7	Confident	69.8	Low	23 Å²	23	81 Å²	81	14%	0.139	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.9	-178.6	-167.3	0	0	0	0	109.5	V214 C216 F281 I282	V214-V300 VanDerWaalsContact C-CG2 3.49Å; V214-V300 HydrophobicContact CB-CG2 3.88Å; V214-V300 HydrophobicContact CG1-CG2 3.71Å; V214-V300 WeakPolarHBondContact O-CG2 2.89Å; C216-V300 HydrophobicContact CB-CB 4.14Å; C216-V300 HydrophobicContact CB-CG1 3.52Å; F281-V300 CarbonylContact C-O 3.49Å; F281-V300 VanDerWaalsContact CA-O 3.28Å; F281-V300 WeakPolarHBondContact CA-O 3.49Å; I282-V300 PolarHBondContact N-O 3.44Å; I282-V300 PolarHBondContact O-N 3.09Å
301	R	86	Confident	67.9	Low	159 Å²	159	86.7 Å²	86.7	60%	0.6	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.4	173.8	-171.7	-179.1	174.5	-160.1	-6.7	110	L280 F281	L280-R301 WeakPolarHBondContact O-CA 3.43Å; F281-R301 HydrophobicContact CD1-CB 4.29Å; F281-R301 HydrophobicContact CE1-CB 4.13Å; F281-R301 HydrophobicContact CE1-CG 4.47Å
302	V	84.1	Confident	65.7	Low	9 Å²	9	91.9 Å²	91.9	6%	0.055	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-68.4	135.8	177.4	-177.6	0	0	0	0	110.3	L225 W271 P279 L280 I282 N304	L225-V302 HydrophobicContact CD1-CG1 3.9Å; L225-V302 HydrophobicContact CD2-CG1 3.94Å; L225-V302 HydrophobicContact CD2-CG2 4.38Å; W271-V302 HydrophobicContact CH2-CG1 3.5Å; W271-V302 HydrophobicContact CZ2-CG1 3.84Å; W271-V302 HydrophobicContact CZ3-CG1 4.33Å; P279-V302 HydrophobicContact CG-CG2 4.39Å; P279-V302 WeakPolarHBondContact O-CB 3.34Å; P279-V302 VanDerWaalsContact O-CG2 3.23Å; P279-V302 WeakPolarHBondContact O-CG2 3.38Å; L280-V302 PolarHBondContact O-N 2.98Å; I282-V302 HydrophobicContact CD1-CG2 3.81Å; I282-V302 HydrophobicContact CG1-CG2 3.87Å; V302-N304 PolarHBondContact O-N 3.26Å
303	P	75.5	Confident	63.5	Low	41 Å²	41	100 Å²	100	27%	0.266	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-60.5	131.8	174	-24	34.2	0	0	0	112.2	C216 I218 L305	C216-P303 WeakPolarHBondContact O-CG 3.45Å; I218-P303 HydrophobicContact CG1-CB 4.37Å; P303-L305 PolarHBondContact O-N 3.44Å
304	N	64.7	Low	60.8	Low	109 Å²	109	103.1 Å²	103.1	58%	0.583	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-65.5	118.5	167.6	-83.2	19.5	0	0	0	109.2	V302 D306	V302-N304 PolarHBondContact O-N 3.26Å; N304-D306 VanDerWaalsContact C-N 3.26Å; N304-D306 PolarHBondContact O-N 3.07Å; N304-D306 VanDerWaalsContact O-N 3.08Å
305	L	55.2	Low	58.3	Low	91 Å²	91	108 Å²	108	48%	0.476	57%	0.572	S	S	.	*			trans	-73.9	89.8	152	-85.5	79.7	0	0	0	107.7	I218 W271 P303 R307	I218-L305 HydrophobicContact CD1-CD1 3.67Å; I218-L305 HydrophobicContact CD1-CG 4.05Å; I218-L305 HydrophobicContact CG1-CD1 3.9Å; W271-L305 HydrophobicContact CH2-CD1 4.23Å; W271-L305 HydrophobicContact CZ2-CD1 3.54Å; P303-L305 PolarHBondContact O-N 3.44Å; L305-R307 PolarHBondContact O-N 3.29Å; L305-R307 VanDerWaalsContact O-N 3.17Å
306	D	46.8	Very low	55.8	Low	135 Å²	135	115 Å²	115	72%	0.722	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-59.9	119.7	167.1	-77.2	-23.7	0	0	0	108.3	N304	N304-D306 VanDerWaalsContact C-N 3.26Å; N304-D306 PolarHBondContact O-N 3.07Å; N304-D306 VanDerWaalsContact O-N 3.08Å
307	R	35.2	Very low	53.2	Low	230 Å²	230	117.4 Å²	117.4	87%	0.868	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-57	137	-175.6	-65.3	176.3	176.2	179.3	-2	109.7	L305 S309	L305-R307 PolarHBondContact O-N 3.29Å; L305-R307 VanDerWaalsContact O-N 3.17Å; R307-S309 PolarHBondContact O-N 2.84Å
308	P	29	Very low	50.4	Low	128 Å²	128	125.3 Å²	125.3	83%	0.831	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-56.8	117.8	169.9	24.8	-33	0	0	0	108.5	T310	P308-T310 PolarHBondContact O-N 2.94Å
309	S	30.6	Very low	47.8	Very low	98 Å²	98	126.8 Å²	126.8	69%	0.685	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-68.3	130.4	-172.7	41.9	0	0	0	0	110.6	R307 F311	R307-S309 PolarHBondContact O-N 2.84Å; S309-F311 PolarHBondContact O-N 3.39Å
310	T	29.1	Very low	45.3	Very low	128 Å²	128	131.1 Å²	131.1	79%	0.785	67%	0.665	S	S	*	*			trans	-56.8	104.5	-170.7	-51.7	0	0	0	0	112.8	P308	P308-T310 PolarHBondContact O-N 2.94Å
311	F	31.8	Very low	42.7	Very low	198 Å²	198	135.7 Å²	135.7	87%	0.868	70%	0.695	S	S	*	*			trans	-119.4	79.2	165.7	-93.8	-79.2	0	0	0	111.2	S309	S309-F311 PolarHBondContact O-N 3.39Å
312	M	30.8	Very low	40.2	Very low	154 Å²	154	133.2 Å²	133.2	76%	0.759	71%	0.709	S	S	*	*			trans	-84.1	129.7	156.6	-81.5	-144.3	-69.1	0	0	109.8
313	Y	30.7	Very low	37.9	Very low	216 Å²	216	136.2 Å²	136.2	85%	0.847	74%	0.741	S	S	*	*			trans	37.4	102.6	156.7	-65.9	-84.9	0	0	0	119.6
314	S	29.5	Very low	36	Very low	121 Å²	121	140.1 Å²	140.1	85%	0.846	76%	0.764	S	S	*	*			trans	-160.3	124.1	133.9	-167.5	0	0	0	0	112.1
315	P	33.3	Very low	34.4	Very low	110 Å²	110	141.2 Å²	141.2	71%	0.714	77%	0.768	S	S	*	*			trans	-110.9	117.3	178.6	35.6	-26.5	0	0	0	113.9
316	R	32.9	Very low	33.3	Very low	237 Å²	237	147.3 Å²	147.3	89%	0.894	79%	0.787	S	S	*	*			trans	171.3	148.7	153.1	-97.1	150.1	-171.2	-156.8	1.9	108.9
317	I	34.1	Very low	32.4	Very low	126 Å²	126	145 Å²	145	65%	0.646	78%	0.781	S	S	*	*			cis	170.4	138.3	-23	-109.3	169.1	0	0	0	103.3
318	Q	32.9	Very low	32.5	Very low	183 Å²	183	143.2 Å²	143.2	86%	0.855	78%	0.782	S	S	*	*			trans	63.9	145.3	177.1	-65.9	150.4	5.6	0	0	115.6
319	S	33.9	Very low	32.5	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	78%	0.778	S	S	*	*			cis	-163.8	-179.2	-12.8	51.5	0	0	0	0	107.1
320	I	36.6	Very low	32.5	Very low	152 Å²	152	142 Å²	142	78%	0.779	78%	0.783	S	S	*	*			cis	-142	147.1	10.5	-51.9	167.4	0	0	0	107.9
321	P	34.4	Very low	32.7	Very low	118 Å²	118	142.7 Å²	142.7	77%	0.766	79%	0.786	S	S	*	*			trans	-107.8	177.4	-179.3	40.9	-35.2	0	0	0	116.1
322	A	33.2	Very low	32.7	Very low	108 Å²	108	138.6 Å²	138.6	89%	0.893	78%	0.783	S	S	*	*			trans	93.7	144.7	158.4	0	0	0	0	0	120.1
323	G	35.5	Very low	32.6	Very low	71 Å²	71	135.9 Å²	135.9	73%	0.732	78%	0.784	S	S	*	*			trans	131.1	59.5	-176.4	0	0	0	0	0	112.7
324	V	36.1	Very low	32.8	Very low	124 Å²	124	131 Å²	131	75%	0.752	78%	0.779	S	S	*	*				69.8	97	85	-177.2	0	0	0	0	114.6
325	I	30.1	Very low	32.9	Very low	131 Å²	131	133.7 Å²	133.7	67%	0.672	78%	0.781	S	S	*	*			trans	29.4	118.2	133.1	-47.3	168.3	0	0	0	117.7
326	Y	32.5	Very low	32.7	Very low	220 Å²	220	135.3 Å²	135.3	86%	0.863	79%	0.789	S	S	*	*				-169.6	163.4	107.8	-101.8	-67.6	0	0	0	112.7
327	S	28.7	Very low	32.7	Very low	86 Å²	86	130.9 Å²	130.9	60%	0.601	79%	0.787	S	S	*	*			trans	-80.8	154.9	-175.1	52.8	0	0	0	0	114.3
328	H	37	Very low	32.7	Very low	192 Å²	192	130.4 Å²	130.4	89%	0.889	79%	0.793	S	S	*	*				-162.1	171.1	129.4	-95.8	-59.1	0	0	0	110.7
329	S	28.9	Very low	32.4	Very low	108 Å²	108	126.9 Å²	126.9	76%	0.755	79%	0.788	S	S	*	*			trans	-133.4	161.4	-158.1	51.8	0	0	0	0	114.9
330	A	30.9	Very low	32	Very low	94 Å²	94	131.1 Å²	131.1	78%	0.777	79%	0.789	S	S	*	*			trans	70	158.1	174.4	0	0	0	0	0	115.4
331	T	33.5	Very low	31.4	Very low	141 Å²	141	133.6 Å²	133.6	87%	0.865	79%	0.79	S	S	*	*			cis	-138.9	168.4	15.6	-47.7	0	0	0	0	112.2
332	S	31.8	Very low	31.2	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	80%	0.796	S	S	*	*			trans	-109.2	151.9	-159.4	55.5	0	0	0	0	117.7
333	A	29.1	Very low	30.9	Very low	96 Å²	96	139.7 Å²	139.7	79%	0.793	79%	0.791	S	S	*	*			trans	-154.2	153.7	150.7	0	0	0	0	0	107.2
334	P	33.4	Very low	30.5	Very low	114 Å²	114	144.8 Å²	144.8	74%	0.74	80%	0.796	S	S	*	*			cis	-140.7	170.4	32	42.4	-24.3	0	0	0	118
335	M	31.7	Very low	30.5	Very low	178 Å²	178	143.4 Å²	143.4	88%	0.877	79%	0.789	S	S	*	*			trans	39.4	115.5	145.9	-59	-84.9	82.9	0	0	120.9
336	T	30.2	Very low	30.4	Very low	144 Å²	144	146.1 Å²	146.1	88%	0.883	80%	0.799	S	S	*	*			trans	-139.4	149.3	159.1	34.6	0	0	0	0	111.9
337	V	31.7	Very low	30.2	Very low	143 Å²	143	142.1 Å²	142.1	87%	0.867	79%	0.792	S	S	*	*			trans	-134.2	153.1	167.5	-90.4	0	0	0	0	109
338	P	35	Very low	30.2	Very low	116 Å²	116	143.1 Å²	143.1	75%	0.753	81%	0.806	S	S	*	*			trans	-117	155.6	-135.9	39.5	-32.3	0	0	0	116.1
339	S	26.9	Very low	29.8	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	80%	0.8	S	S	*	*			trans	-166.8	120.4	144.1	-86.2	0	0	0	0	114
340	Y	24.9	Very low	30.1	Very low	196 Å²	196	143.6 Å²	143.6	77%	0.769	81%	0.806	S	S	*	*			trans	58.6	145.8	138.2	-86.4	-89	0	0	0	124.6
341	Y	25.1	Very low	30.1	Very low	203 Å²	203	145.9 Å²	145.9	80%	0.796	81%	0.805	S	S	*	*			trans	61.4	104.7	164.7	-62.5	-67.1	0	0	0	120.6
342	I	30	Very low	29.8	Very low	172 Å²	172	145.7 Å²	145.7	88%	0.882	81%	0.806	S	S	*	*			trans	-134.3	145.7	136.9	-62	-173.5	0	0	0	108.9
343	F	25.4	Very low	29.9	Very low	182 Å²	182	143.7 Å²	143.7	80%	0.798	80%	0.803	S	S	*	*			trans	-68.7	157	177	-78.5	-126	0	0	0	112.8
344	H	28.7	Very low	29.9	Very low	179 Å²	179	151 Å²	151	83%	0.829	81%	0.81	S	S	*	*				-170.2	150.4	110.4	-113.9	-106.5	0	0	0	112.2
345	P	35.3	Very low	29.8	Very low	95 Å²	95	151.6 Å²	151.6	62%	0.617	81%	0.812	S	S	*	*			trans	-98.9	153.9	179.5	37.5	-33.1	0	0	0	112.8
346	Q	26.9	Very low	29.9	Very low	188 Å²	188	148.9 Å²	148.9	88%	0.879	81%	0.807	S	S	*	*			trans	-177.5	173.1	145.5	-105.9	162.5	33.5	0	0	112.8
347	L	29.2	Very low	30.5	Very low	136 Å²	136	148.2 Å²	148.2	71%	0.712	80%	0.803	S	S	*	*			trans	65.7	89.3	170.2	-61	177.6	0	0	0	118.2	Q349	L347-Q349 PolarHBondContact O-N 2.8Å
348	A	28.2	Very low	31	Very low	107 Å²	107	151.5 Å²	151.5	88%	0.884	80%	0.8	S	S	*	*			trans	-75.7	98.7	141.6	0	0	0	0	0	109.1
349	Q	28.7	Very low	31.5	Very low	164 Å²	164	148.5 Å²	148.5	77%	0.766	78%	0.78	S	S	*	*			trans	-157.8	119.2	166.7	-115.3	163.4	76	0	0	108.2	L347	L347-Q349 PolarHBondContact O-N 2.8Å
350	V	35.1	Very low	32.6	Very low	146 Å²	146	145.7 Å²	145.7	89%	0.885	76%	0.76	S	S	*	*			trans	-132.3	123.9	174.3	177.1	0	0	0	0	107.5
351	D	30.7	Very low	33.9	Very low	142 Å²	142	140.3 Å²	140.3	76%	0.759	74%	0.744	S	S	*	*			trans	-67.8	151	-173.6	-74.9	-66.4	0	0	0	114.1	G353	D351-G353 VanDerWaalsContact C-N 3.28Å; D351-G353 PolarHBondContact O-N 3.16Å
352	P	28.2	Very low	35.5	Very low	137 Å²	137	136.1 Å²	136.1	89%	0.89	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	78	171.7	32.8	-35.4	0	0	0	110.9
353	G	33	Very low	36.7	Very low	70 Å²	70	133 Å²	133	72%	0.722	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.9	-6.6	-174.3	0	0	0	0	0	118.9	D351	D351-G353 VanDerWaalsContact C-N 3.28Å; D351-G353 PolarHBondContact O-N 3.16Å
354	R	29.1	Very low	38.1	Very low	250 Å²	250	127.3 Å²	127.3	94%	0.943	69%	0.694	S	S	*	*			trans	-111.4	127.9	177.6	-93.3	-171.7	172.1	-147.5	-1.7	113.2
355	V	32.4	Very low	39.3	Very low	127 Å²	127	121.4 Å²	121.4	77%	0.77	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-63.2	132.6	172.2	-178.2	0	0	0	0	109.3	T357	V355-T357 PolarHBondContact O-N 3.35Å
356	P	34.1	Very low	40.3	Very low	120 Å²	120	120.3 Å²	120.3	78%	0.779	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-66	117.9	171.3	27.7	-33.1	0	0	0	109.2
357	T	41.8	Very low	41.7	Very low	130 Å²	130	115 Å²	115	80%	0.798	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-65.1	141.6	-179.8	40.3	0	0	0	0	111.2	V355	V355-T357 PolarHBondContact O-N 3.35Å
358	R	42.2	Very low	42.9	Very low	213 Å²	213	110.5 Å²	110.5	80%	0.804	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-52.8	128.4	166.6	177.7	-176.7	-179.1	177.4	2	108.1	S360	R358-S360 PolarHBondContact O-N 3.47Å
359	P	46.3	Very low	44.5	Very low	53 Å²	53	109.7 Å²	109.7	34%	0.344	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-58.6	133.9	174.1	25.5	-33.5	0	0	0	108.7	E363 M364	P359-E363 HydrophobicContact CB-CB 4.29Å; P359-M364 HydrophobicContact CB-CG 4.33Å; P359-M364 HydrophobicContact CG-CG 4.33Å; P359-M364 HydrophobicContact CG-SD 4.36Å
360	S	49.7	Very low	46	Very low	49 Å²	49	106.6 Å²	106.6	34%	0.343	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-61.5	158.7	176.4	63.4	0	0	0	0	110.7	R358 L362 E363 M364	R358-S360 PolarHBondContact O-N 3.47Å; S360-L362 PolarHBondContact O-N 3.21Å; S360-E363 VanDerWaalsContact CB-OE2 3.25Å; S360-E363 WeakPolarHBondContact CB-OE2 3.29Å; S360-E363 PolarHBondContact N-OE2 2.82Å; S360-E363 PolarHBondContact O-N 3.07Å; S360-E363 VanDerWaalsContact O-N 3.1Å; S360-E363 WeakPolarHBondContact OG-CB 3.27Å; S360-E363 VanDerWaalsContact OG-CG 3.29Å; S360-E363 WeakPolarHBondContact OG-CG 3.44Å; S360-E363 PolarHBondContact OG-N 2.79Å; S360-E363 VanDerWaalsContact OG-N 3.12Å; S360-E363 PolarHBondContact OG-OE2 3.29Å; S360-M364 PolarHBondContact O-N 2.91Å; S360-M364 VanDerWaalsContact O-N 3.09Å
361	L	52.3	Low	47.1	Very low	83 Å²	83	106.9 Å²	106.9	44%	0.435	57%	0.569	S	S	.	*	H	α-helix	trans	-60.2	-34.6	176.5	-170.9	137.2	0	0	0	111.1	M364 E365	L361-M364 HydrophobicContact CB-CE 4.48Å; L361-M364 PolarHBondContact O-N 2.8Å; L361-E365 HydrophobicContact CD2-CG 4.14Å; L361-E365 VanDerWaalsContact CD2-OE1 3.26Å; L361-E365 WeakPolarHBondContact CD2-OE1 3.41Å; L361-E365 WeakPolarHBondContact O-CG 3.41Å; L361-E365 PolarHBondContact O-N 2.91Å
362	L	59	Low	48.4	Very low	116 Å²	116	103.6 Å²	103.6	61%	0.607	55%	0.549	S	S	*	.	H	α-helix	trans	-65	-39.1	173	-173.8	65.4	0	0	0	113.4	S360 M364 E365 T366	S360-L362 PolarHBondContact O-N 3.21Å; L362-M364 VanDerWaalsContact C-N 3.3Å; L362-M364 PolarHBondContact O-N 2.98Å; L362-E365 PolarHBondContact O-N 2.96Å; L362-T366 HydrophobicContact CD1-CG2 4.46Å; L362-T366 WeakPolarHBondContact O-CB 3.45Å; L362-T366 WeakPolarHBondContact O-CG2 3.29Å; L362-T366 PolarHBondContact O-N 3.16Å; L362-T366 PolarHBondContact O-OG1 3.15Å
363	E	54.4	Low	49.9	Very low	105 Å²	105	103 Å²	103	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-66.6	-31.7	173.5	-77.2	162.4	114.6	0	0	112.1	P359 S360 T366 S367	P359-E363 HydrophobicContact CB-CB 4.29Å; S360-E363 VanDerWaalsContact CB-OE2 3.25Å; S360-E363 WeakPolarHBondContact CB-OE2 3.29Å; S360-E363 PolarHBondContact N-OE2 2.82Å; S360-E363 PolarHBondContact O-N 3.07Å; S360-E363 VanDerWaalsContact O-N 3.1Å; S360-E363 WeakPolarHBondContact OG-CB 3.27Å; S360-E363 VanDerWaalsContact OG-CG 3.29Å; S360-E363 WeakPolarHBondContact OG-CG 3.44Å; S360-E363 PolarHBondContact OG-N 2.79Å; S360-E363 VanDerWaalsContact OG-N 3.12Å; S360-E363 PolarHBondContact OG-OE2 3.29Å; E363-T366 WeakPolarHBondContact CA-OG1 3.46Å; E363-T366 PolarHBondContact O-OG1 2.92Å; E363-S367 WeakPolarHBondContact O-CB 3.23Å; E363-S367 PolarHBondContact O-N 3.16Å; E363-S367 VanDerWaalsContact O-N 3.09Å; E363-S367 PolarHBondContact O-OG 2.91Å
364	M	54.3	Low	51.1	Low	63 Å²	63	105.4 Å²	105.4	31%	0.31	53%	0.527	S	S	.	.	H	α-helix	trans	-75	-42	174	-66.1	-174.4	-69.1	0	0	112.1	P359 S360 L361 L362 S367 Y368	P359-M364 HydrophobicContact CB-CG 4.33Å; P359-M364 HydrophobicContact CG-CG 4.33Å; P359-M364 HydrophobicContact CG-SD 4.36Å; S360-M364 PolarHBondContact O-N 2.91Å; S360-M364 VanDerWaalsContact O-N 3.09Å; L361-M364 HydrophobicContact CB-CE 4.48Å; L361-M364 PolarHBondContact O-N 2.8Å; L362-M364 VanDerWaalsContact C-N 3.3Å; L362-M364 PolarHBondContact O-N 2.98Å; M364-S367 PolarHBondContact O-N 2.62Å; M364-Y368 VanDerWaalsContact O-CB 3.31Å; M364-Y368 WeakPolarHBondContact O-CB 3.38Å; M364-Y368 PolarHBondContact O-N 3.29Å
365	E	55.2	Low	52.4	Low	56 Å²	56	98.8 Å²	98.8	26%	0.262	51%	0.505	S	S	.	.	H	α-helix	trans	-60.9	-50.3	174.1	-74.2	171.4	150.9	0	0	111.6	L361 L362 S367 Y368 L369 K511	L361-E365 HydrophobicContact CD2-CG 4.14Å; L361-E365 VanDerWaalsContact CD2-OE1 3.26Å; L361-E365 WeakPolarHBondContact CD2-OE1 3.41Å; L361-E365 WeakPolarHBondContact O-CG 3.41Å; L361-E365 PolarHBondContact O-N 2.91Å; L362-E365 PolarHBondContact O-N 2.96Å; E365-S367 PolarHBondContact O-N 2.86Å; E365-Y368 PolarHBondContact O-N 2.9Å; E365-L369 WeakPolarHBondContact O-CG 3.35Å; E365-L369 PolarHBondContact O-N 2.93Å; E365-K511 WeakPolarHBondContact OE1-CE 3.25Å; E365-K511 IonicContact OE1-NZ 2.71Å; E365-K511 PolarHBondContact OE1-NZ 3.05Å
366	T	55.5	Low	53.3	Low	71 Å²	71	95.4 Å²	95.4	44%	0.436	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-39.4	177.7	49.8	0	0	0	0	112.6	L362 E363 Y368 L370	L362-T366 HydrophobicContact CD1-CG2 4.46Å; L362-T366 WeakPolarHBondContact O-CB 3.45Å; L362-T366 WeakPolarHBondContact O-CG2 3.29Å; L362-T366 PolarHBondContact O-N 3.16Å; L362-T366 PolarHBondContact O-OG1 3.15Å; E363-T366 WeakPolarHBondContact CA-OG1 3.46Å; E363-T366 PolarHBondContact O-OG1 2.92Å; T366-Y368 VanDerWaalsContact C-N 3.34Å; T366-Y368 PolarHBondContact O-N 3.47Å; T366-L370 WeakPolarHBondContact O-CB 3.24Å; T366-L370 PolarHBondContact O-N 2.84Å
367	S	55.7	Low	54.2	Low	77 Å²	77	98.2 Å²	98.2	54%	0.538	48%	0.482	S	S	.	.	H	α-helix	trans	-64	-38.1	173.6	-64.2	0	0	0	0	112.5	E363 M364 E365 R371	E363-S367 WeakPolarHBondContact O-CB 3.23Å; E363-S367 PolarHBondContact O-N 3.16Å; E363-S367 VanDerWaalsContact O-N 3.09Å; E363-S367 PolarHBondContact O-OG 2.91Å; M364-S367 PolarHBondContact O-N 2.62Å; E365-S367 PolarHBondContact O-N 2.86Å; S367-R371 WeakPolarHBondContact O-CB 3.38Å; S367-R371 PolarHBondContact O-N 2.84Å; S367-R371 VanDerWaalsContact O-N 3.07Å
368	Y	55.5	Low	54.6	Low	42 Å²	42	94.6 Å²	94.6	17%	0.165	47%	0.466	C	S	.	.	H	α-helix	trans	-67.9	-48.3	176.9	174	-99.9	0	0	0	111.9	M364 E365 T366 L370 R371 Q372 L488 M544	M364-Y368 VanDerWaalsContact O-CB 3.31Å; M364-Y368 WeakPolarHBondContact O-CB 3.38Å; M364-Y368 PolarHBondContact O-N 3.29Å; E365-Y368 PolarHBondContact O-N 2.9Å; T366-Y368 VanDerWaalsContact C-N 3.34Å; T366-Y368 PolarHBondContact O-N 3.47Å; Y368-L370 PolarHBondContact O-N 2.99Å; Y368-R371 WeakPolarHBondContact O-CB 3.47Å; Y368-R371 PolarHBondContact O-N 2.84Å; Y368-R371 VanDerWaalsContact O-N 3.09Å; Y368-Q372 HydrophobicContact CD1-CG 4.45Å; Y368-Q372 HydrophobicContact CE1-CG 4Å; Y368-Q372 HydrophobicContact CE2-CG 4.13Å; Y368-Q372 PolarHBondContact O-N 3.31Å; Y368-Q372 PolarHBondContact OH-NE2 3.09Å; Y368-L488 HydrophobicContact CE1-CD1 4.14Å; Y368-M544 HydrophobicContact CD2-CE 4Å; Y368-M544 HydrophobicContact CD2-CG 4.02Å; Y368-M544 HydrophobicContact CD2-SD 4.22Å; Y368-M544 HydrophobicContact CE2-CG 4.45Å; Y368-M544 HydrophobicContact CG-CE 3.93Å
369	L	61.4	Low	54.8	Low	90 Å²	90	87.9 Å²	87.9	47%	0.471	45%	0.451	S	S	.	.	H	α-helix	trans	-56.8	-47.3	175.8	-71.9	167.7	0	0	0	111.3	E365 R371 Q372 Q373 V875	E365-L369 WeakPolarHBondContact O-CG 3.35Å; E365-L369 PolarHBondContact O-N 2.93Å; L369-R371 VanDerWaalsContact C-N 3.29Å; L369-R371 PolarHBondContact O-N 3.09Å; L369-Q372 PolarHBondContact O-N 3.42Å; L369-Q373 WeakPolarHBondContact O-CB 3.47Å; L369-Q373 PolarHBondContact O-N 3.41Å; L369-V875 HydrophobicContact CD2-CG1 3.96Å
370	L	61.1	Low	54.9	Low	98 Å²	98	90.8 Å²	90.8	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-61.3	-37.2	176.7	-169.2	69.4	0	0	0	112.1	T366 Y368 Q373 Q374	T366-L370 WeakPolarHBondContact O-CB 3.24Å; T366-L370 PolarHBondContact O-N 2.84Å; Y368-L370 PolarHBondContact O-N 2.99Å; L370-Q373 PolarHBondContact O-N 2.7Å; L370-Q374 VanDerWaalsContact O-CG 3.29Å; L370-Q374 WeakPolarHBondContact O-CG 3.37Å; L370-Q374 PolarHBondContact O-N 2.85Å
371	R	56.6	Low	54.9	Low	153 Å²	153	96 Å²	96	58%	0.577	48%	0.48	S	S	*	.	H	α-helix	trans	-72.1	-34.9	177.8	-165.2	178.1	-174.5	-148.3	1.7	112.6	S367 Y368 L369 K375	S367-R371 WeakPolarHBondContact O-CB 3.38Å; S367-R371 PolarHBondContact O-N 2.84Å; S367-R371 VanDerWaalsContact O-N 3.07Å; Y368-R371 WeakPolarHBondContact O-CB 3.47Å; Y368-R371 PolarHBondContact O-N 2.84Å; Y368-R371 VanDerWaalsContact O-N 3.09Å; L369-R371 VanDerWaalsContact C-N 3.29Å; L369-R371 PolarHBondContact O-N 3.09Å; R371-K375 WeakPolarHBondContact O-CG 3.14Å; R371-K375 PolarHBondContact O-N 3.16Å
372	Q	58.8	Low	54.9	Low	73 Å²	73	100 Å²	100	34%	0.341	49%	0.494	S	S	.	.	H	α-helix	trans	-68.8	-43.1	171.3	-70.1	-70.8	36.9	0	0	111.3	Y368 L369 Q374 K375 S376	Y368-Q372 HydrophobicContact CD1-CG 4.45Å; Y368-Q372 HydrophobicContact CE1-CG 4Å; Y368-Q372 HydrophobicContact CE2-CG 4.13Å; Y368-Q372 PolarHBondContact O-N 3.31Å; Y368-Q372 PolarHBondContact OH-NE2 3.09Å; L369-Q372 PolarHBondContact O-N 3.42Å; Q372-Q374 PolarHBondContact O-N 3Å; Q372-K375 WeakPolarHBondContact O-CA 3.28Å; Q372-K375 WeakPolarHBondContact O-CB 3.48Å; Q372-K375 PolarHBondContact O-N 3.41Å; Q372-S376 PolarHBondContact O-N 3.13Å; Q372-S376 PolarHBondContact O-OG 3.4Å
373	Q	59.8	Low	54	Low	123 Å²	123	103.4 Å²	103.4	58%	0.575	50%	0.498	S	S	*	.	H	α-helix	trans	-64.2	-28.8	176.5	-156.4	-178.3	67.8	0	0	112.7	L369 L370 S376 R377	L369-Q373 WeakPolarHBondContact O-CB 3.47Å; L369-Q373 PolarHBondContact O-N 3.41Å; L370-Q373 PolarHBondContact O-N 2.7Å; Q373-S376 PolarHBondContact O-OG 3.12Å; Q373-R377 WeakPolarHBondContact O-CB 3.45Å; Q373-R377 VanDerWaalsContact O-CD 3.3Å; Q373-R377 WeakPolarHBondContact O-CD 3.33Å; Q373-R377 WeakPolarHBondContact O-CG 3.45Å; Q373-R377 PolarHBondContact O-N 2.69Å
374	Q	58.4	Low	53.6	Low	121 Å²	121	101.4 Å²	101.4	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-72.3	-40	168.8	-74.3	173.8	15.2	0	0	112.7	L370 Q372 A378	L370-Q374 VanDerWaalsContact O-CG 3.29Å; L370-Q374 WeakPolarHBondContact O-CG 3.37Å; L370-Q374 PolarHBondContact O-N 2.85Å; Q372-Q374 PolarHBondContact O-N 3Å; Q374-A378 WeakPolarHBondContact O-CB 3.25Å; Q374-A378 PolarHBondContact O-N 3.2Å
375	K	56.8	Low	53	Low	112 Å²	112	101 Å²	101	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-62.4	-49.3	174.8	-79.9	171.3	167.9	-173.8	0	111.8	R371 Q372 R377 A378 S379	R371-K375 WeakPolarHBondContact O-CG 3.14Å; R371-K375 PolarHBondContact O-N 3.16Å; Q372-K375 WeakPolarHBondContact O-CA 3.28Å; Q372-K375 WeakPolarHBondContact O-CB 3.48Å; Q372-K375 PolarHBondContact O-N 3.41Å; K375-R377 PolarHBondContact O-N 3.16Å; K375-A378 WeakPolarHBondContact O-CB 3.43Å; K375-A378 PolarHBondContact O-N 2.86Å; K375-A378 VanDerWaalsContact O-N 3.1Å; K375-S379 PolarHBondContact O-N 3.14Å; K375-S379 PolarHBondContact O-OG 3.46Å
376	S	51.3	Low	52.5	Low	55 Å²	55	101.1 Å²	101.1	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-60.5	-46.6	179.8	62.7	0	0	0	0	111.2	Q372 Q373 A378 S379 L380	Q372-S376 PolarHBondContact O-N 3.13Å; Q372-S376 PolarHBondContact O-OG 3.4Å; Q373-S376 PolarHBondContact O-OG 3.12Å; S376-A378 VanDerWaalsContact C-N 3.26Å; S376-A378 PolarHBondContact O-N 3.03Å; S376-S379 PolarHBondContact O-N 2.85Å; S376-S379 VanDerWaalsContact O-N 3.11Å; S376-L380 WeakPolarHBondContact O-CD1 3.38Å; S376-L380 PolarHBondContact O-N 2.8Å
377	R	52.8	Low	52	Low	179 Å²	179	101.6 Å²	101.6	68%	0.675	51%	0.509	S	S	*	.	H	α-helix	trans	-61.7	-29.5	174.8	-68.1	171.8	79.6	83.8	-4.3	113.5	Q373 K375 K381	Q373-R377 WeakPolarHBondContact O-CB 3.45Å; Q373-R377 VanDerWaalsContact O-CD 3.3Å; Q373-R377 WeakPolarHBondContact O-CD 3.33Å; Q373-R377 WeakPolarHBondContact O-CG 3.45Å; Q373-R377 PolarHBondContact O-N 2.69Å; K375-R377 PolarHBondContact O-N 3.16Å; R377-K381 WeakPolarHBondContact O-CG 3.29Å; R377-K381 PolarHBondContact O-N 2.93Å
378	A	50	Low	51.6	Low	55 Å²	55	102.8 Å²	102.8	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-75.3	-39.3	172.5	0	0	0	0	0	112.5	Q374 K375 S376 K381 K382	Q374-A378 WeakPolarHBondContact O-CB 3.25Å; Q374-A378 PolarHBondContact O-N 3.2Å; K375-A378 WeakPolarHBondContact O-CB 3.43Å; K375-A378 PolarHBondContact O-N 2.86Å; K375-A378 VanDerWaalsContact O-N 3.1Å; S376-A378 VanDerWaalsContact C-N 3.26Å; S376-A378 PolarHBondContact O-N 3.03Å; A378-K381 PolarHBondContact O-N 2.95Å; A378-K382 PolarHBondContact O-N 3.06Å; A378-K382 VanDerWaalsContact O-N 3.09Å
379	S	47	Very low	51.3	Low	71 Å²	71	107.3 Å²	107.3	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-66.6	-43.3	175.8	-65.7	0	0	0	0	112.3	K375 S376 K381 K382 R383	K375-S379 PolarHBondContact O-N 3.14Å; K375-S379 PolarHBondContact O-OG 3.46Å; S376-S379 PolarHBondContact O-N 2.85Å; S376-S379 VanDerWaalsContact O-N 3.11Å; S379-K381 VanDerWaalsContact C-N 3.34Å; S379-K381 PolarHBondContact O-N 2.95Å; S379-K382 PolarHBondContact O-N 2.96Å; S379-K382 VanDerWaalsContact O-N 3.15Å; S379-R383 PolarHBondContact O-N 3.39Å
380	L	47.5	Very low	50.7	Low	115 Å²	115	108.7 Å²	108.7	60%	0.602	54%	0.536	S	S	*	.	H	α-helix	trans	-59.7	-43.7	173.2	-88.3	93.3	0	0	0	111.5	S376 K382 R383 S384	S376-L380 WeakPolarHBondContact O-CD1 3.38Å; S376-L380 PolarHBondContact O-N 2.8Å; L380-K382 VanDerWaalsContact C-N 3.26Å; L380-K382 PolarHBondContact O-N 3.41Å; L380-R383 PolarHBondContact O-N 3.17Å; L380-S384 PolarHBondContact O-N 2.87Å; L380-S384 PolarHBondContact O-OG 2.91Å
381	K	49.5	Very low	50.2	Low	159 Å²	159	110 Å²	110	69%	0.691	54%	0.538	S	S	*	.	H	α-helix	trans	-63.2	-27.7	175.7	-79.8	-173.6	174	-166.5	0	114	R377 A378 S379 S384 A385	R377-K381 WeakPolarHBondContact O-CG 3.29Å; R377-K381 PolarHBondContact O-N 2.93Å; A378-K381 PolarHBondContact O-N 2.95Å; S379-K381 VanDerWaalsContact C-N 3.34Å; S379-K381 PolarHBondContact O-N 2.95Å; K381-S384 PolarHBondContact O-OG 2.78Å; K381-S384 VanDerWaalsContact O-OG 3.13Å; K381-A385 PolarHBondContact O-N 3.16Å
382	K	51.5	Low	49.9	Very low	166 Å²	166	106.4 Å²	106.4	72%	0.722	54%	0.536	S	S	*	.	H	α-helix	trans	-75.1	-45.5	171.1	-79.7	-170.8	170.9	-170.4	0	112	A378 S379 L380 S384 A385 S386	A378-K382 PolarHBondContact O-N 3.06Å; A378-K382 VanDerWaalsContact O-N 3.09Å; S379-K382 PolarHBondContact O-N 2.96Å; S379-K382 VanDerWaalsContact O-N 3.15Å; L380-K382 VanDerWaalsContact C-N 3.26Å; L380-K382 PolarHBondContact O-N 3.41Å; K382-S384 VanDerWaalsContact C-N 3.33Å; K382-S384 PolarHBondContact O-N 2.78Å; K382-A385 PolarHBondContact O-N 3.45Å; K382-S386 PolarHBondContact O-N 3.37Å; K382-S386 VanDerWaalsContact O-N 3.09Å
383	R	41.6	Very low	49.5	Very low	188 Å²	188	108.3 Å²	108.3	71%	0.709	55%	0.548	S	S	*	.	H	α-helix	trans	-62.1	-38.1	178	-70.6	-179	77.7	172.7	4.7	112.1	S379 L380 S386 L387	S379-R383 PolarHBondContact O-N 3.39Å; L380-R383 PolarHBondContact O-N 3.17Å; R383-S386 PolarHBondContact O-OG 2.94Å; R383-L387 WeakPolarHBondContact O-CB 3.07Å; R383-L387 WeakPolarHBondContact O-CD1 3.41Å; R383-L387 VanDerWaalsContact O-CG 3.25Å; R383-L387 WeakPolarHBondContact O-CG 3.17Å; R383-L387 PolarHBondContact O-N 2.81Å
384	S	45.3	Very low	48.9	Very low	62 Å²	62	109.4 Å²	109.4	43%	0.434	55%	0.553	S	S	.	*	H	α-helix	trans	-64.7	-45	174.8	62.4	0	0	0	0	111.9	L380 K381 K382 S386 L387 D388	L380-S384 PolarHBondContact O-N 2.87Å; L380-S384 PolarHBondContact O-OG 2.91Å; K381-S384 PolarHBondContact O-OG 2.78Å; K381-S384 VanDerWaalsContact O-OG 3.13Å; K382-S384 VanDerWaalsContact C-N 3.33Å; K382-S384 PolarHBondContact O-N 2.78Å; S384-S386 PolarHBondContact O-N 3.1Å; S384-L387 PolarHBondContact O-N 3.17Å; S384-D388 PolarHBondContact O-N 3.15Å
385	A	41.8	Very low	48.2	Very low	54 Å²	54	111.9 Å²	111.9	45%	0.446	57%	0.566	S	S	.	*	H	α-helix	trans	-63.2	-41.9	-179.1	0	0	0	0	0	113	K381 K382 D388 E389	K381-A385 PolarHBondContact O-N 3.16Å; K382-A385 PolarHBondContact O-N 3.45Å; A385-D388 PolarHBondContact O-N 3.07Å; A385-E389 PolarHBondContact O-N 3.49Å
386	S	44.1	Very low	47.5	Very low	60 Å²	60	113.7 Å²	113.7	42%	0.42	58%	0.577	S	S	.	*	H	α-helix	trans	-70.1	-34.3	177.8	64.2	0	0	0	0	112.8	K382 R383 S384 D388 E389 E390	K382-S386 PolarHBondContact O-N 3.37Å; K382-S386 VanDerWaalsContact O-N 3.09Å; R383-S386 PolarHBondContact O-OG 2.94Å; S384-S386 PolarHBondContact O-N 3.1Å; S386-D388 VanDerWaalsContact C-N 3.28Å; S386-D388 PolarHBondContact O-N 2.74Å; S386-E389 PolarHBondContact O-N 3.26Å; S386-E390 VanDerWaalsContact O-CB 3.27Å; S386-E390 WeakPolarHBondContact O-CB 3.48Å; S386-E390 PolarHBondContact O-N 3.44Å
387	L	46.8	Very low	46.7	Very low	80 Å²	80	120.8 Å²	120.8	42%	0.419	60%	0.596	S	S	.	*	H	α-helix	trans	-67.6	-27.1	177.2	-76	169.2	0	0	0	113.2	R383 S384 K391	R383-L387 WeakPolarHBondContact O-CB 3.07Å; R383-L387 WeakPolarHBondContact O-CD1 3.41Å; R383-L387 VanDerWaalsContact O-CG 3.25Å; R383-L387 WeakPolarHBondContact O-CG 3.17Å; R383-L387 PolarHBondContact O-N 2.81Å; S384-L387 PolarHBondContact O-N 3.17Å; L387-K391 WeakPolarHBondContact O-CB 3.3Å; L387-K391 WeakPolarHBondContact O-CD 3.17Å; L387-K391 VanDerWaalsContact O-CG 3.29Å; L387-K391 WeakPolarHBondContact O-CG 3.35Å; L387-K391 PolarHBondContact O-N 3.41Å
388	D	46.2	Very low	45.9	Very low	102 Å²	102	123.3 Å²	123.3	55%	0.545	61%	0.606	S	S	.	*	H	α-helix	trans	-79.5	-35	174.2	-69.5	-29.8	0	0	0	111.9	S384 A385 S386 S392	S384-D388 PolarHBondContact O-N 3.15Å; A385-D388 PolarHBondContact O-N 3.07Å; S386-D388 VanDerWaalsContact C-N 3.28Å; S386-D388 PolarHBondContact O-N 2.74Å; D388-S392 WeakPolarHBondContact O-CB 3.41Å; D388-S392 PolarHBondContact O-N 3.2Å; D388-S392 VanDerWaalsContact O-N 3.16Å; D388-S392 PolarHBondContact O-OG 3.33Å
389	E	50	Low	45.2	Very low	138 Å²	138	126.7 Å²	126.7	65%	0.645	62%	0.623	S	S	*	*	H	α-helix	trans	-67	-44.9	170	-72.2	-171	135.3	0	0	111.9	A385 S386 S392 L393	A385-E389 PolarHBondContact O-N 3.49Å; S386-E389 PolarHBondContact O-N 3.26Å; E389-S392 WeakPolarHBondContact O-CB 3.4Å; E389-S392 PolarHBondContact O-N 3.33Å; E389-S392 VanDerWaalsContact O-N 3.12Å; E389-L393 WeakPolarHBondContact O-CG 3.46Å; E389-L393 PolarHBondContact O-N 3.27Å
390	E	48.6	Very low	44.6	Very low	119 Å²	119	132.5 Å²	132.5	56%	0.556	64%	0.642	S	S	*	*	H	α-helix	trans	-64.9	-43.9	-178.1	-171.6	165	-142.4	0	0	111.9	S386 S392 L393 E394	S386-E390 VanDerWaalsContact O-CB 3.27Å; S386-E390 WeakPolarHBondContact O-CB 3.48Å; S386-E390 PolarHBondContact O-N 3.44Å; E390-S392 VanDerWaalsContact C-N 3.3Å; E390-S392 PolarHBondContact O-N 3.24Å; E390-L393 PolarHBondContact O-N 3.09Å; E390-L393 VanDerWaalsContact O-N 3.13Å; E390-E394 PolarHBondContact O-N 3.25Å
391	K	49.6	Very low	44.1	Very low	126 Å²	126	131.8 Å²	131.8	55%	0.548	65%	0.653	S	S	.	*	H	α-helix	trans	-62.8	-35.3	171.2	-75.8	170.9	-173.9	160	0	112.7	L387 L393 M395	L387-K391 WeakPolarHBondContact O-CB 3.3Å; L387-K391 WeakPolarHBondContact O-CD 3.17Å; L387-K391 VanDerWaalsContact O-CG 3.29Å; L387-K391 WeakPolarHBondContact O-CG 3.35Å; L387-K391 PolarHBondContact O-N 3.41Å; K391-L393 PolarHBondContact O-N 3.47Å; K391-M395 WeakPolarHBondContact O-CB 3.31Å; K391-M395 PolarHBondContact O-N 3.44Å; K391-M395 VanDerWaalsContact O-N 3.09Å
392	S	51	Low	43.3	Very low	77 Å²	77	135.9 Å²	135.9	54%	0.538	67%	0.665	S	S	.	*	H	α-helix	trans	-66.9	-27.4	176.2	-62	0	0	0	0	112.4	D388 E389 E390	D388-S392 WeakPolarHBondContact O-CB 3.41Å; D388-S392 PolarHBondContact O-N 3.2Å; D388-S392 VanDerWaalsContact O-N 3.16Å; D388-S392 PolarHBondContact O-OG 3.33Å; E389-S392 WeakPolarHBondContact O-CB 3.4Å; E389-S392 PolarHBondContact O-N 3.33Å; E389-S392 VanDerWaalsContact O-N 3.12Å; E390-S392 VanDerWaalsContact C-N 3.3Å; E390-S392 PolarHBondContact O-N 3.24Å
393	L	49.2	Very low	42.7	Very low	112 Å²	112	135.3 Å²	135.3	59%	0.586	67%	0.668	S	S	*	*	H	α-helix	trans	-83.7	-42.1	175.8	-71	163.6	0	0	0	112.5	E389 E390 K391 M395 Q396	E389-L393 WeakPolarHBondContact O-CG 3.46Å; E389-L393 PolarHBondContact O-N 3.27Å; E390-L393 PolarHBondContact O-N 3.09Å; E390-L393 VanDerWaalsContact O-N 3.13Å; K391-L393 PolarHBondContact O-N 3.47Å; L393-M395 VanDerWaalsContact C-N 3.26Å; L393-M395 PolarHBondContact O-N 3.13Å; L393-Q396 PolarHBondContact O-N 3.36Å; L393-Q396 VanDerWaalsContact O-N 3.12Å
394	E	48.7	Very low	42.3	Very low	147 Å²	147	132.2 Å²	132.2	69%	0.687	67%	0.672	S	S	*	*	H	α-helix	trans	-58.4	-38.7	172.4	-81.8	-155	114.4	0	0	112.1	E390 Q396 Y397	E390-E394 PolarHBondContact O-N 3.25Å; E394-Q396 PolarHBondContact O-N 3.44Å; E394-Y397 PolarHBondContact O-N 2.91Å; E394-Y397 VanDerWaalsContact O-N 3.08Å
395	M	42.3	Very low	41.8	Very low	172 Å²	172	137.8 Å²	137.8	85%	0.847	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-15.9	178.9	-151.3	74.9	151.2	0	0	113.4	K391 L393	K391-M395 WeakPolarHBondContact O-CB 3.31Å; K391-M395 PolarHBondContact O-N 3.44Å; K391-M395 VanDerWaalsContact O-N 3.09Å; L393-M395 VanDerWaalsContact C-N 3.26Å; L393-M395 PolarHBondContact O-N 3.13Å
396	Q	42.9	Very low	41.5	Very low	150 Å²	150	143.2 Å²	143.2	70%	0.701	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-10.2	178.3	-65	-171.4	-7.3	0	0	114.5	L393 E394	L393-Q396 PolarHBondContact O-N 3.36Å; L393-Q396 VanDerWaalsContact O-N 3.12Å; E394-Q396 PolarHBondContact O-N 3.44Å
397	Y	35.2	Very low	40.9	Very low	204 Å²	204	146.4 Å²	146.4	80%	0.8	72%	0.723	S	S	*	*			trans	-126.9	76.1	-175.5	-82.3	-85.9	0	0	0	113.4	E394	E394-Y397 PolarHBondContact O-N 2.91Å; E394-Y397 VanDerWaalsContact O-N 3.08Å
398	R	34.6	Very low	40.5	Very low	233 Å²	233	149.7 Å²	149.7	88%	0.879	75%	0.746	S	S	*	*			trans	-123.1	116.4	170.6	-148.4	173.3	-164.6	168.8	7.4	112.1
399	P	36.4	Very low	40	Very low	125 Å²	125	152.3 Å²	152.3	81%	0.812	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-75.3	132.4	-173.9	29.2	-34.4	0	0	0	112.5
400	Q	34	Very low	39.2	Very low	193 Å²	193	148.6 Å²	148.6	90%	0.902	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-81.1	118.4	175.6	-69.4	-178.2	-14.5	0	0	111.6
401	A	37.7	Very low	38.7	Very low	101 Å²	101	148.5 Å²	148.5	84%	0.835	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-80.4	131.6	166.3	0	0	0	0	0	110.4
402	R	31.9	Very low	38.1	Very low	245 Å²	245	150.6 Å²	150.6	93%	0.925	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-83.5	137.6	178.1	-66.5	-179.1	177.6	-177.8	-1.6	111.3
403	I	37.9	Very low	37.3	Very low	154 Å²	154	151.9 Å²	151.9	79%	0.79	79%	0.786	S	S	*	*			trans	-125.2	140	161.7	-62.2	178.9	0	0	0	107.2
404	P	35.2	Very low	36.7	Very low	123 Å²	123	149.5 Å²	149.5	80%	0.799	79%	0.788	S	S	*	*			trans	-73	151.4	-171	-16.7	32.2	0	0	0	113.8
405	Q	33.4	Very low	36.1	Very low	178 Å²	178	151.6 Å²	151.6	83%	0.832	80%	0.798	S	S	*	*			trans	-89.8	151.1	172.9	-66.2	-177.5	-55.1	0	0	111.9
406	I	36.6	Very low	35.9	Very low	168 Å²	168	152.4 Å²	152.4	86%	0.862	80%	0.8	S	S	*	*			trans	-120.6	128.5	163	-65	177.2	0	0	0	106.9
407	N	31.5	Very low	35.5	Very low	128 Å²	128	152.6 Å²	152.6	68%	0.684	81%	0.805	S	S	*	*			trans	-87.3	139.9	-176.3	-67.3	-11.2	0	0	0	112
408	V	37.9	Very low	35.6	Very low	148 Å²	148	149.6 Å²	149.6	90%	0.897	81%	0.808	S	S	*	*			trans	-131.3	147.6	154.2	-177.3	0	0	0	0	107.4
409	I	34.5	Very low	35.6	Very low	157 Å²	157	141.3 Å²	141.3	81%	0.805	80%	0.795	S	S	*	*			trans	-119.1	141	-158.3	-63.3	167.9	0	0	0	111.6
410	G	34.5	Very low	35.5	Very low	60 Å²	60	144.8 Å²	144.8	62%	0.619	80%	0.798	S	S	*	*			trans	165.5	105.1	164.5	0	0	0	0	0	111.1
411	T	37.8	Very low	35.5	Very low	118 Å²	118	140.4 Å²	140.4	72%	0.724	79%	0.788	S	S	*	*				59.2	121.5	76.5	67.4	0	0	0	0	112.3
412	H	37.3	Very low	35.3	Very low	170 Å²	170	140.3 Å²	140.3	79%	0.787	78%	0.782	S	S	*	*			cis	-145.3	153.6	19.7	-89.2	-84.8	0	0	0	108.5
413	S	34.4	Very low	35.6	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	77%	0.771	S	S	*	*			cis	105.6	129.1	29.1	81.8	0	0	0	0	114.1
414	G	36	Very low	35.3	Very low	62 Å²	62	136.4 Å²	136.4	64%	0.639	77%	0.77	S	S	*	*			trans	126.3	111.8	-177.3	0	0	0	0	0	110.6
415	E	35.8	Very low	35.3	Very low	191 Å²	191	135.6 Å²	135.6	89%	0.893	77%	0.767	S	S	*	*			cis	75.8	142.3	42.6	-53.7	172.7	141.2	0	0	112.5
416	E	37.9	Very low	35.2	Very low	189 Å²	189	131.6 Å²	131.6	88%	0.883	75%	0.748	S	S	*	*			cis	-116.4	163.1	1.5	-53.9	167	112.2	0	0	109.9
417	D	35.5	Very low	35.3	Very low	153 Å²	153	130.6 Å²	130.6	82%	0.818	75%	0.745	S	S	*	*			cis	96.4	71.1	9.3	-154	17.5	0	0	0	120.2
418	V	37	Very low	35.4	Very low	142 Å²	142	132.2 Å²	132.2	86%	0.861	74%	0.741	S	S	*	*			trans	-154.4	145	157.3	-127	0	0	0	0	109.8
419	G	33.5	Very low	35.4	Very low	58 Å²	58	135.5 Å²	135.5	60%	0.598	74%	0.739	S	S	*	*			cis	160.5	159.8	-9.9	0	0	0	0	0	112.7
420	F	35	Very low	35.5	Very low	199 Å²	199	132.6 Å²	132.6	87%	0.873	74%	0.738	S	S	*	*			trans	70	123.2	-179.8	-65.3	-97.7	0	0	0	116.3
421	S	33.6	Very low	35.4	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	75%	0.75	S	S	*	*			cis	75.1	133.4	46.8	-164.4	0	0	0	0	112.2
422	S	34.7	Very low	35.3	Very low	99 Å²	99	137.3 Å²	137.3	69%	0.692	74%	0.744	S	S	*	*			cis	-152	-174.5	10.3	-123	0	0	0	0	110.1
423	T	37.1	Very low	35.1	Very low	114 Å²	114	140.5 Å²	140.5	70%	0.699	75%	0.749	S	S	*	*			cis	-153.2	158.2	14.1	-2.2	0	0	0	0	108.1
424	R	31.4	Very low	34.8	Very low	203 Å²	203	143.4 Å²	143.4	77%	0.766	75%	0.751	S	S	*	*				47.1	130.8	88.2	-150.5	178.6	-166.8	-177.6	2.9	114.6	E426	R424-E426 IonicContact CZ-OE2 2.94Å; R424-E426 IonicContact NE-OE2 3.95Å; R424-E426 PolarHBondContact NE-OE2 3Å; R424-E426 IonicContact NH2-OE2 3.59Å; R424-E426 PolarHBondContact NH2-OE2 3.46Å
425	S	36	Very low	34.5	Very low	105 Å²	105	151.4 Å²	151.4	73%	0.734	76%	0.764	S	S	*	*			cis	-123.9	147.4	26.3	50.3	0	0	0	0	113.1
426	E	32	Very low	34.2	Very low	94 Å²	94	150 Å²	150	44%	0.439	76%	0.757	S	S	.	*				61.3	91.5	59.6	-69.8	-162.3	89.7	0	0	114.8	R424 R428	R424-E426 IonicContact CZ-OE2 2.94Å; R424-E426 IonicContact NE-OE2 3.95Å; R424-E426 PolarHBondContact NE-OE2 3Å; R424-E426 IonicContact NH2-OE2 3.59Å; R424-E426 PolarHBondContact NH2-OE2 3.46Å; E426-R428 IonicContact OE1-CZ 2.72Å; E426-R428 IonicContact OE1-NE 2.72Å; E426-R428 PolarHBondContact OE1-NE 3.26Å; E426-R428 IonicContact OE1-NH2 3.61Å; E426-R428 PolarHBondContact OE1-NH2 3.42Å
427	D	38.4	Very low	33.7	Very low	148 Å²	148	145.4 Å²	145.4	79%	0.791	75%	0.746	S	S	*	*				-170.9	149.9	120.3	-97.5	-23.3	0	0	0	109
428	R	33.6	Very low	33.4	Very low	161 Å²	161	142.1 Å²	142.1	61%	0.608	73%	0.731	S	S	*	*			cis	161.9	152.8	-32.4	-99.8	-176.3	-166.7	-161.6	4	104.7	E426	E426-R428 IonicContact OE1-CZ 2.72Å; E426-R428 IonicContact OE1-NE 2.72Å; E426-R428 PolarHBondContact OE1-NE 3.26Å; E426-R428 IonicContact OE1-NH2 3.61Å; E426-R428 PolarHBondContact OE1-NH2 3.42Å
429	Y	37.7	Very low	33.1	Very low	217 Å²	217	145.5 Å²	145.5	85%	0.851	73%	0.73	S	S	*	*			trans	68.3	135.8	-178.2	-54.1	-78.8	0	0	0	115.7
430	A	37.1	Very low	33.1	Very low	96 Å²	96	147.2 Å²	147.2	79%	0.793	73%	0.733	S	S	*	*			cis	-141.2	157.3	-9.6	0	0	0	0	0	110.8
431	Q	31.3	Very low	33	Very low	186 Å²	186	143 Å²	143	87%	0.869	72%	0.724	S	S	*	*			trans	-110.5	-167.8	-173	-133	-156.7	36.6	0	0	111
432	P	37.1	Very low	32.8	Very low	92 Å²	92	149.3 Å²	149.3	60%	0.597	73%	0.732	S	S	*	*			trans	-113.3	-169.2	-135.5	41.2	-24	0	0	0	113
433	R	32.2	Very low	32.9	Very low	236 Å²	236	149.1 Å²	149.1	89%	0.891	73%	0.731	S	S	*	*				177	162.6	124.3	-96.7	160.5	-173.5	-144.7	0.3	115.2
434	H	28.3	Very low	32.7	Very low	166 Å²	166	147.4 Å²	147.4	77%	0.769	72%	0.723	S	S	*	*			trans	-60.6	143.8	178.4	-57.3	-89.2	0	0	0	115.7
435	Y	30.3	Very low	32.7	Very low	230 Å²	230	148.8 Å²	148.8	90%	0.902	73%	0.729	S	S	*	*				-127.7	125.6	126.6	-91.9	-106	0	0	0	104
436	Q	28.4	Very low	32.6	Very low	160 Å²	160	152.2 Å²	152.2	75%	0.748	74%	0.738	S	S	*	*			cis	66.3	110.4	24.7	-153.6	-178.1	38.5	0	0	114.5
437	S	28.2	Very low	32.5	Very low	94 Å²	94	154.6 Å²	154.6	66%	0.657	75%	0.753	S	S	*	*			trans	69.9	147.2	161.9	-67	0	0	0	0	115.4
438	T	29.1	Very low	32.1	Very low	84 Å²	84	157.7 Å²	157.7	52%	0.515	75%	0.754	S	S	.	*			cis	-172.6	177.6	7.2	10.4	0	0	0	0	111.2
439	Y	30.6	Very low	31.9	Very low	213 Å²	213	157.5 Å²	157.5	84%	0.835	76%	0.76	S	S	*	*			trans	70.7	151.7	164	-20	-77.6	0	0	0	116.3
440	S	33.7	Very low	31.5	Very low	94 Å²	94	154.3 Å²	154.3	66%	0.657	76%	0.757	S	S	*	*			cis	-152.3	122.4	-3.5	-150.2	0	0	0	0	114.5
441	T	31.7	Very low	31.1	Very low	111 Å²	111	160.6 Å²	160.6	68%	0.681	76%	0.76	S	S	*	*			trans	48.9	139.2	133	62	0	0	0	0	124.2
442	R	30.6	Very low	31.1	Very low	232 Å²	232	156.9 Å²	156.9	88%	0.875	76%	0.755	S	S	*	*			trans	76.1	145.9	149.1	-72.7	167.5	177	-176.7	-2	116.5
443	S	36.4	Very low	31	Very low	96 Å²	96	157.8 Å²	157.8	67%	0.671	76%	0.761	S	S	*	*			cis	-161.2	168.3	1.5	-118.3	0	0	0	0	110.5
444	S	32.3	Very low	30.7	Very low	77 Å²	77	151.5 Å²	151.5	54%	0.538	75%	0.753	S	S	.	*			cis	174.5	134.2	-36.5	56.1	0	0	0	0	109.3
445	R	31	Very low	30.8	Very low	232 Å²	232	148 Å²	148	88%	0.875	75%	0.747	S	S	*	*			trans	68.3	153.8	168.2	-51.2	157	-179.2	176.6	-2.1	112.5
446	L	34.1	Very low	30.7	Very low	177 Å²	177	148.1 Å²	148.1	93%	0.927	75%	0.745	S	S	*	*			cis	-127.7	163.5	23	-82.1	160.8	0	0	0	113.7
447	N	29.5	Very low	30.6	Very low	144 Å²	144	145.3 Å²	145.3	77%	0.77	75%	0.75	S	S	*	*			trans	-123.5	126.6	173.8	170.9	4.3	0	0	0	107.6
448	R	30.3	Very low	30.7	Very low	213 Å²	213	147.8 Å²	147.8	80%	0.804	76%	0.76	S	S	*	*			trans	170.8	136.8	148	-96.3	168.3	-160.8	-177.2	5.2	113.9
449	H	30.1	Very low	30.7	Very low	157 Å²	157	148.2 Å²	148.2	73%	0.727	77%	0.767	S	S	*	*			trans	41.5	113.2	141.4	-50.6	-50.7	0	0	0	121.3
450	L	29.3	Very low	30.9	Very low	151 Å²	151	146.1 Å²	146.1	79%	0.791	77%	0.765	S	S	*	*				166.1	134.2	103.8	-90.8	155.7	0	0	0	113.5
451	R	29.2	Very low	30.7	Very low	227 Å²	227	147.3 Å²	147.3	86%	0.857	77%	0.77	S	S	*	*			trans	30.4	125.2	147.6	-65.9	174.8	179.7	-117.6	-0.9	121.5
452	S	30	Very low	30.5	Very low	109 Å²	109	147.5 Å²	147.5	76%	0.762	77%	0.767	S	S	*	*			trans	-40.6	172.8	148.5	52.6	0	0	0	0	117.2
453	P	35.4	Very low	30.7	Very low	111 Å²	111	144.6 Å²	144.6	72%	0.721	77%	0.768	S	S	*	*			cis	-137.7	178.5	-7.9	30.4	-8.4	0	0	0	117
454	S	27	Very low	30.3	Very low	104 Å²	104	147.8 Å²	147.8	73%	0.727	77%	0.766	S	S	*	*			trans	87.1	136.7	143.9	81.7	0	0	0	0	122.5
455	S	28.8	Very low	30.2	Very low	91 Å²	91	150 Å²	150	64%	0.636	77%	0.772	S	S	*	*			trans	45.6	112.6	149.2	66.1	0	0	0	0	121.5
456	R	28.4	Very low	30.1	Very low	233 Å²	233	144.8 Å²	144.8	88%	0.879	76%	0.761	S	S	*	*				-177	154.3	99.6	-99.3	177.9	174.2	90.1	-3.1	111.4
457	A	27.1	Very low	29.9	Very low	101 Å²	101	146.1 Å²	146.1	84%	0.835	75%	0.754	S	S	*	*			trans	-82.3	146.2	173.6	0	0	0	0	0	112
458	V	29.7	Very low	29.9	Very low	146 Å²	146	149 Å²	149	89%	0.885	75%	0.754	S	S	*	*			trans	-140.6	149.7	163.8	-177.7	0	0	0	0	107.7
459	S	29.6	Very low	29.7	Very low	94 Å²	94	149.2 Å²	149.2	66%	0.657	76%	0.761	S	S	*	*			trans	-105.2	145	-163.3	51.6	0	0	0	0	115.4
460	E	34.4	Very low	29.6	Very low	168 Å²	168	148.3 Å²	148.3	79%	0.785	77%	0.766	S	S	*	*			trans	61.7	157.5	155.8	-64.9	179.3	178.7	0	0	117.8
461	P	31	Very low	29.5	Very low	119 Å²	119	144.5 Å²	144.5	77%	0.773	76%	0.764	S	S	*	*				-131.3	153.1	87.3	38.2	-28.6	0	0	0	115.8
462	D	27.3	Very low	29.3	Very low	116 Å²	116	138 Å²	138	62%	0.62	77%	0.768	S	S	*	*			trans	-44.1	137.5	170.5	-167.2	-11.7	0	0	0	114.6	R464	D462-R464 WeakPolarHBondContact OD1-CB 3.34Å; D462-R464 PolarHBondContact OD1-N 3.2Å
463	L	33.9	Very low	29.2	Very low	171 Å²	171	136.8 Å²	136.8	90%	0.895	77%	0.772	S	S	*	*			trans	-114.7	34.4	175.9	-77.3	-179	0	0	0	113.8	D465	L463-D465 PolarHBondContact O-N 3.31Å
464	R	28.2	Very low	28.8	Very low	162 Å²	162	136 Å²	136	61%	0.611	78%	0.775	S	S	*	*			trans	-91	79.3	163.9	-70.9	178.8	163	137.3	-1.9	111.6	D462 D466 D505	D462-R464 WeakPolarHBondContact OD1-CB 3.34Å; D462-R464 PolarHBondContact OD1-N 3.2Å; R464-D466 PolarHBondContact O-N 3.07Å; R464-D505 IonicContact CZ-OD1 3.29Å; R464-D505 VanDerWaalsContact CZ-OD1 3.23Å; R464-D505 IonicContact NH1-OD1 3.34Å; R464-D505 PolarHBondContact NH1-OD1 2.6Å; R464-D505 IonicContact NH2-OD1 3.5Å; R464-D505 PolarHBondContact NH2-OD1 3.05Å
465	D	29.4	Very low	28.8	Very low	125 Å²	125	139.8 Å²	139.8	67%	0.668	79%	0.786	S	S	*	*			trans	-71.6	117	176.5	-167.8	25.2	0	0	0	111.7	L463 R467	L463-D465 PolarHBondContact O-N 3.31Å; D465-R467 PolarHBondContact O-N 3.35Å; D465-R467 IonicContact OD2-CZ 3.87Å; D465-R467 IonicContact OD2-NE 2.73Å; D465-R467 PolarHBondContact OD2-NE 3.23Å; D465-R467 IonicContact OD2-NH2 3.38Å; D465-R467 PolarHBondContact OD2-NH2 2.81Å
466	D	28.8	Very low	28.8	Very low	122 Å²	122	139 Å²	139	65%	0.652	79%	0.793	S	S	*	*			trans	-88.1	86.1	-162.3	-177.2	14.2	0	0	0	112.7	R464	R464-D466 PolarHBondContact O-N 3.07Å
467	R	31.7	Very low	28.7	Very low	204 Å²	204	136.2 Å²	136.2	77%	0.77	80%	0.795	S	S	*	*			trans	-120.8	64.2	-174.3	-63.2	-162.1	-171.4	-141.4	-0.7	116.7	D465 F469	D465-R467 PolarHBondContact O-N 3.35Å; D465-R467 IonicContact OD2-CZ 3.87Å; D465-R467 IonicContact OD2-NE 2.73Å; D465-R467 PolarHBondContact OD2-NE 3.23Å; D465-R467 IonicContact OD2-NH2 3.38Å; D465-R467 PolarHBondContact OD2-NH2 2.81Å; R467-F469 PolarHBondContact O-N 3.19Å
468	R	27.8	Very low	28.7	Very low	205 Å²	205	142 Å²	142	77%	0.774	80%	0.795	S	S	*	*			trans	22	94.1	132.6	-56.5	-178.5	-170.9	179.5	3.1	118.3	V470	R468-V470 PolarHBondContact O-N 3.08Å
469	F	27.2	Very low	28.9	Very low	217 Å²	217	141.1 Å²	141.1	95%	0.952	79%	0.792	S	S	*	*				11.4	88.6	129.8	-149.5	-83.2	0	0	0	118	R467	R467-F469 PolarHBondContact O-N 3.19Å
470	V	28.4	Very low	29.1	Very low	138 Å²	138	142 Å²	142	84%	0.836	80%	0.798	S	S	*	*			trans	-144.1	123.2	165	-178.2	0	0	0	0	112.4	R468	R468-V470 PolarHBondContact O-N 3.08Å
471	G	26.1	Very low	29.8	Very low	72 Å²	72	140.3 Å²	140.3	74%	0.742	79%	0.791	S	S	*	*			trans	79.6	80.8	136.3	0	0	0	0	0	121
472	G	25.6	Very low	30.9	Very low	91 Å²	91	139 Å²	139	94%	0.938	78%	0.781	S	S	*	*				49.9	109.7	128.9	0	0	0	0	0	121.5
473	G	26.5	Very low	33	Very low	83 Å²	83	137.4 Å²	137.4	86%	0.856	77%	0.766	S	S	*	*			trans	-155.7	123.9	159.6	0	0	0	0	0	109.9
474	A	28.2	Very low	35.3	Very low	95 Å²	95	130.3 Å²	130.3	79%	0.785	73%	0.731	S	S	*	*			trans	-100.1	172.2	-169.6	0	0	0	0	0	113.8
475	L	27.9	Very low	38.1	Very low	183 Å²	183	122.6 Å²	122.6	96%	0.958	70%	0.701	S	S	*	*			trans	92.6	113.8	169	-52.6	167.8	0	0	0	116.3
476	G	27.8	Very low	40.9	Very low	75 Å²	75	118.1 Å²	118.1	77%	0.773	68%	0.679	S	S	*	*			trans	151.1	62.1	169.9	0	0	0	0	0	115.2	R478	G476-R478 PolarHBondContact O-N 3.23Å; G476-R478 VanDerWaalsContact O-N 3.08Å
477	N	26.8	Very low	43.6	Very low	173 Å²	173	112.5 Å²	112.5	93%	0.925	65%	0.649	S	S	*	*			trans	-70.8	104.8	-176	-157.3	15.4	0	0	0	111.9
478	R	27.2	Very low	46.1	Very low	222 Å²	222	103.6 Å²	103.6	84%	0.838	62%	0.617	S	S	*	*			trans	-138.2	138.8	165.4	-76.5	-169.1	174.1	-165.8	-0.5	109.5	G476	G476-R478 PolarHBondContact O-N 3.23Å; G476-R478 VanDerWaalsContact O-N 3.08Å
479	P	32.1	Very low	48.7	Very low	128 Å²	128	98 Å²	98	83%	0.831	60%	0.598	S	S	*	*			trans	-68.1	133.1	176.4	29.1	-33.8	0	0	0	110.2	E481	P479-E481 PolarHBondContact O-N 3.32Å
480	S	33.9	Very low	51.5	Low	112 Å²	112	92.2 Å²	92.2	78%	0.783	58%	0.577	S	S	*	*			trans	-63.5	117.1	-177.7	-51	0	0	0	0	111.3	T482	S480-T482 PolarHBondContact O-N 3.08Å
481	E	49.7	Very low	54.4	Low	134 Å²	134	86.2 Å²	86.2	63%	0.626	54%	0.539	S	S	*	.			trans	-74.3	90.2	179	-166.2	163.2	-110.7	0	0	109.2	P479 R483 N548	P479-E481 PolarHBondContact O-N 3.32Å; E481-R483 PolarHBondContact O-N 2.91Å; E481-N548 HydrophobicContact CG-CB 4.48Å; E481-N548 PolarHBondContact OE1-ND2 2.98Å
482	T	54.3	Low	57.4	Low	92 Å²	92	86.1 Å²	86.1	56%	0.564	52%	0.522	S	S	*	.			trans	-65.7	97.6	-176.2	51.3	0	0	0	0	110.8	S480	S480-T482 PolarHBondContact O-N 3.08Å
483	R	72.3	Confident	60.2	Low	82 Å²	82	82.1 Å²	82.1	31%	0.309	48%	0.479	S	S	.	.			trans	-70.2	136.6	170.6	-73.4	-176.1	-74.4	-165.5	-7.2	110.4	E481 V517 E520 E545	E481-R483 PolarHBondContact O-N 2.91Å; R483-V517 HydrophobicContact CB-CB 3.92Å; R483-V517 HydrophobicContact CB-CG2 3.87Å; R483-V517 WeakPolarHBondContact O-CB 2.92Å; R483-V517 PolarHBondContact O-N 2.84Å; R483-E520 IonicContact CZ-OE1 2.72Å; R483-E520 IonicContact NH1-OE1 2.65Å; R483-E520 PolarHBondContact NH1-OE1 2.97Å; R483-E520 IonicContact NH2-OE1 3.98Å; R483-E520 PolarHBondContact NH2-OE1 2.91Å; R483-E545 WeakPolarHBondContact CD-OE1 3.27Å; R483-E545 IonicContact NH1-OE1 3.13Å
484	C	81.8	Confident	62.8	Low	22 Å²	22	87.4 Å²	87.4	15%	0.149	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141	175.4	-63.2	0	0	0	0	109.6	M514 I515 I546	C484-M514 HydrophobicContact CB-CE 4.21Å; C484-I515 CarbonylContact C-O 3.6Å; C484-I515 WeakPolarHBondContact CA-O 3.34Å; C484-I546 PolarHBondContact O-N 2.89Å
485	L	87.1	Confident	65.3	Low	0 Å²	0	90 Å²	90	0%	0	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	152.5	168.1	-63.1	164.4	0	0	0	108.6	M514 I515 V517 Y527 V538 V543 M544 E545	L485-M514 WeakPolarHBondContact O-CA 3.46Å; L485-I515 HydrophobicContact CB-CB 4.24Å; L485-I515 PolarHBondContact N-O 2.87Å; L485-I515 PolarHBondContact O-N 2.77Å; L485-V517 HydrophobicContact CD1-CG2 3.9Å; L485-V517 HydrophobicContact CD2-CG2 4.4Å; L485-V517 HydrophobicContact CG-CG2 3.67Å; L485-Y527 HydrophobicContact CD1-CD1 4.47Å; L485-Y527 HydrophobicContact CD1-CD2 3.7Å; L485-Y527 HydrophobicContact CD1-CE2 4.26Å; L485-Y527 HydrophobicContact CD1-CG 3.82Å; L485-Y527 HydrophobicContact CD2-CD2 4.12Å; L485-Y527 HydrophobicContact CD2-CE2 3.8Å; L485-V538 HydrophobicContact CD1-CG1 4.15Å; L485-V543 HydrophobicContact CB-CB 4.13Å; L485-V543 HydrophobicContact CB-CG1 4.38Å; L485-V543 HydrophobicContact CD1-CG2 4.23Å; L485-V543 HydrophobicContact CD2-CB 4.25Å; L485-V543 HydrophobicContact CD2-CG2 3.91Å; L485-V543 HydrophobicContact CG-CG2 4.45Å; L485-M544 CarbonylContact C-O 3.52Å; L485-M544 VanDerWaalsContact CA-O 3.31Å; L485-M544 WeakPolarHBondContact CA-O 3.41Å; L485-E545 HydrophobicContact CD2-CB 4.22Å
486	V	87.1	Confident	67.8	Low	31 Å²	31	85.6 Å²	85.6	19%	0.188	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.9	166.6	169.4	0	0	0	0	110	L488 E513 M514 V543 M544 I546	V486-L488 PolarHBondContact O-N 3.29Å; V486-E513 WeakPolarHBondContact CA-O 3.36Å; V486-M514 HydrophobicContact CG2-CG 3.87Å; V486-V543 CarbonylContact O-C 3.49Å; V486-V543 VanDerWaalsContact O-CA 3.3Å; V486-V543 WeakPolarHBondContact O-CA 3.48Å; V486-M544 PolarHBondContact N-O 2.95Å; V486-M544 PolarHBondContact O-N 3.45Å; V486-I546 HydrophobicContact CB-CD1 4.08Å; V486-I546 HydrophobicContact CG2-CD1 3.44Å; V486-I546 VanDerWaalsContact CG2-CD1 3.44Å; V486-I546 HydrophobicContact CG2-CG1 4.27Å
487	G	86.5	Confident	70.3	Confident	3 Å²	3	83 Å²	83	3%	0.031	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	125.7	175.2	0	0	0	0	0	112	G512 E513	G487-G512 PolarHBondContact O-N 3.25Å; G487-E513 PolarHBondContact N-O 3.32Å
488	L	83.1	Confident	72.5	Confident	18 Å²	18	81 Å²	81	9%	0.094	41%	0.411	C	S	.	.	S	Bend	trans	-83.8	-25.1	176.6	-67	176.9	0	0	0	112.6	Y368 V486 K511 L542 M544	Y368-L488 HydrophobicContact CE1-CD1 4.14Å; V486-L488 PolarHBondContact O-N 3.29Å; L488-K511 WeakPolarHBondContact O-CD 3.32Å; L488-K511 WeakPolarHBondContact O-CE 3.35Å; L488-K511 WeakPolarHBondContact O-CG 3.33Å; L488-K511 PolarHBondContact O-NZ 3.14Å; L488-K511 VanDerWaalsContact O-NZ 3.17Å; L488-L542 PolarHBondContact N-O 3.37Å; L488-M544 HydrophobicContact CD2-CB 4.09Å; L488-M544 HydrophobicContact CD2-CE 3.75Å; L488-M544 HydrophobicContact CG-CB 4.42Å
489	F	84	Confident	74.8	Confident	86 Å²	86	73.5 Å²	73.5	38%	0.377	39%	0.388	S	S	.	.	S	Bend	trans	-141.3	167.1	-176.2	-55	-79.1	0	0	0	109.6	R510 K511 L542	F489-R510 CarbonylContact O-C 3.57Å; F489-K511 PolarHBondContact O-N 3.11Å; F489-L542 HydrophobicContact CD2-CD2 3.88Å
490	D	86	Confident	76.7	Confident	96 Å²	96	79.9 Å²	79.9	51%	0.513	40%	0.395	S	S	.	.			trans	-74.9	134.5	167	-72	-8.1	0	0	0	109.3	M496 R510 K511	D490-M496 WeakPolarHBondContact O-CE 3.4Å; D490-R510 WeakPolarHBondContact OD1-CA 3.45Å; D490-R510 WeakPolarHBondContact OD1-CB 3.4Å; D490-K511 PolarHBondContact OD1-N 3.01Å
491	Y	89.1	Confident	78.8	Confident	12 Å²	12	78.1 Å²	78.1	5%	0.047	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-126.2	123.1	-179.4	-174	-124.2	0	0	0	112.3	P493 M496 E506 L507 P508 F509 P539 L542	Y491-P493 HydrophobicContact CD1-CG 4.08Å; Y491-P493 HydrophobicContact CE1-CG 3.72Å; Y491-M496 HydrophobicContact CD2-CB 3.83Å; Y491-M496 HydrophobicContact CD2-CE 4.12Å; Y491-M496 HydrophobicContact CD2-SD 4.02Å; Y491-M496 HydrophobicContact CE2-CB 3.65Å; Y491-E506 PolarHBondContact OH-OE2 3.29Å; Y491-L507 WeakPolarHBondContact CD1-O 3.32Å; Y491-P508 WeakPolarHBondContact O-CA 3.45Å; Y491-F509 HydrophobicContact CD1-CD1 4.05Å; Y491-F509 AromaticContact CD1-CE1 3.53Å; Y491-F509 HydrophobicContact CD1-CE1 3.53Å; Y491-F509 HydrophobicContact CD1-CZ 4.04Å; Y491-F509 HydrophobicContact CE1-CE1 4.45Å; Y491-F509 AromaticContact CG-CE1 3.97Å; Y491-F509 HydrophobicContact CG-CE1 3.97Å; Y491-F509 HydrophobicContact CG-CZ 4.02Å; Y491-F509 PolarHBondContact N-O 3.13Å; Y491-F509 PolarHBondContact O-N 3.05Å; Y491-P539 HydrophobicContact CD1-CG 4.17Å; Y491-P539 HydrophobicContact CE1-CG 3.66Å; Y491-P539 HydrophobicContact CE2-CG 4.16Å; Y491-L542 HydrophobicContact CD2-CD1 3.2Å; Y491-L542 HydrophobicContact CE2-CD1 3.64Å; Y491-L542 HydrophobicContact CG-CD1 3.73Å
492	N	88.1	Confident	80.1	Confident	71 Å²	71	71.8 Å²	71.8	38%	0.38	35%	0.348	S	S	.	.			trans	-125.1	100.2	175.9	-171.6	-13.2	0	0	0	110.7	R494 H495 M496	N492-R494 PolarHBondContact O-N 3.35Å; N492-R494 WeakPolarHBondContact OD1-CB 3.34Å; N492-R494 PolarHBondContact OD1-N 2.95Å; N492-H495 PolarHBondContact O-N 3.47Å; N492-M496 HydrophobicContact CB-SD 4.47Å; N492-M496 PolarHBondContact N-SD 2.66Å; N492-M496 VanDerWaalsContact N-SD 3.4Å; N492-M496 PolarHBondContact O-N 2.66Å
493	P	85.3	Confident	81.3	Confident	6 Å²	6	69.6 Å²	69.6	4%	0.039	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-21.1	177	-33.8	38.4	0	0	0	116	Y491 H495 A502 E506	Y491-P493 HydrophobicContact CD1-CG 4.08Å; Y491-P493 HydrophobicContact CE1-CG 3.72Å; P493-H495 VanDerWaalsContact C-N 3.32Å; P493-H495 PolarHBondContact O-N 3Å; P493-A502 HydrophobicContact CB-CB 3.88Å; P493-A502 WeakPolarHBondContact O-CB 3.49Å; P493-E506 HydrophobicContact CB-CB 4.06Å; P493-E506 WeakPolarHBondContact CB-OE2 3.46Å; P493-E506 HydrophobicContact CG-CB 3.76Å
494	R	80.4	Confident	81.7	Confident	194 Å²	194	74.8 Å²	74.8	73%	0.732	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-19.5	176.7	-71.4	-178.9	173.4	-174.6	-0.5	114.9	N492 A503	N492-R494 PolarHBondContact O-N 3.35Å; N492-R494 WeakPolarHBondContact OD1-CB 3.34Å; N492-R494 PolarHBondContact OD1-N 2.95Å; R494-A503 HydrophobicContact CG-CB 3.63Å
495	H	80.3	Confident	81.8	Confident	151 Å²	151	74.7 Å²	74.7	70%	0.699	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.5	-14.7	-171.6	-58.5	-70.9	0	0	0	113.5	N492 P493	N492-H495 PolarHBondContact O-N 3.47Å; P493-H495 VanDerWaalsContact C-N 3.32Å; P493-H495 PolarHBondContact O-N 3Å
496	M	81.5	Confident	82	Confident	89 Å²	89	74.8 Å²	74.8	44%	0.438	36%	0.357	S	S	.	.	S	Bend	trans	-120	6.7	-173.2	-58.3	176.1	72.3	0	0	113.7	D490 Y491 N492	D490-M496 WeakPolarHBondContact O-CE 3.4Å; Y491-M496 HydrophobicContact CD2-CB 3.83Å; Y491-M496 HydrophobicContact CD2-CE 4.12Å; Y491-M496 HydrophobicContact CD2-SD 4.02Å; Y491-M496 HydrophobicContact CE2-CB 3.65Å; N492-M496 HydrophobicContact CB-SD 4.47Å; N492-M496 PolarHBondContact N-SD 2.66Å; N492-M496 VanDerWaalsContact N-SD 3.4Å; N492-M496 PolarHBondContact O-N 2.66Å
497	S	79.6	Confident	82.1	Confident	21 Å²	21	73.4 Å²	73.4	15%	0.147	35%	0.349	C	S	.	.			trans	-121.2	138.6	175.2	-180	0	0	0	0	110.1	N499 A502 E506	S497-N499 PolarHBondContact O-N 3.28Å; S497-N499 PolarHBondContact OG-N 3.42Å; S497-A502 VanDerWaalsContact CB-CB 3.45Å; S497-A502 WeakPolarHBondContact OG-CB 3.3Å; S497-E506 WeakPolarHBondContact CB-OE2 3.15Å; S497-E506 VanDerWaalsContact OG-CD 3.31Å; S497-E506 PolarHBondContact OG-OE1 3.15Å; S497-E506 PolarHBondContact OG-OE2 3.46Å; S497-E506 VanDerWaalsContact OG-OE2 3.14Å
498	P	74.2	Confident	82.3	Confident	130 Å²	130	76 Å²	76	84%	0.844	37%	0.365	S	S	*	.	S	Bend	trans	-71.5	-15.4	173	31.1	-35.6	0	0	0	112.7	R500	P498-R500 PolarHBondContact O-N 3.03Å
499	N	74	Confident	82.7	Confident	66 Å²	66	75.5 Å²	75.5	35%	0.353	36%	0.362	S	S	.	.			trans	-74.4	123.9	-174.9	-67.1	-37.7	0	0	0	111.8	S497 N501 A502 E506	S497-N499 PolarHBondContact O-N 3.28Å; S497-N499 PolarHBondContact OG-N 3.42Å; N499-N501 PolarHBondContact O-N 2.98Å; N499-N501 VanDerWaalsContact O-N 3.08Å; N499-A502 HydrophobicContact CB-CB 4.02Å; N499-A502 WeakPolarHBondContact O-CB 3.48Å; N499-A502 PolarHBondContact O-N 2.7Å; N499-E506 PolarHBondContact ND2-OE1 3.4Å
500	R	73.4	Confident	82.8	Confident	261 Å²	261	78.9 Å²	78.9	99%	0.985	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.3	177.8	-76	-177.1	167.1	-130.2	-4.1	114	P498	P498-R500 PolarHBondContact O-N 3.03Å
501	N	77.1	Confident	82.6	Confident	75 Å²	75	78.3 Å²	78.3	40%	0.401	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-1.5	178.7	60.8	-52.7	0	0	0	113.7	N499 A503 R504 D505	N499-N501 PolarHBondContact O-N 2.98Å; N499-N501 VanDerWaalsContact O-N 3.08Å; N501-A503 VanDerWaalsContact C-N 3.3Å; N501-A503 PolarHBondContact O-N 2.73Å; N501-A503 VanDerWaalsContact O-N 3.08Å; N501-R504 WeakPolarHBondContact O-CA 3.4Å; N501-R504 VanDerWaalsContact O-CB 3.3Å; N501-R504 WeakPolarHBondContact O-CB 3.3Å; N501-R504 PolarHBondContact O-N 3.18Å; N501-D505 PolarHBondContact ND2-OD2 3.36Å; N501-D505 PolarHBondContact O-N 2.84Å
502	A	77.7	Confident	82.2	Confident	2 Å²	2	79.6 Å²	79.6	2%	0.017	38%	0.382	C	S	.	.	H	α-helix	trans	-38.8	-52.7	-176.8	0	0	0	0	0	114.6	P493 S497 N499 R504 D505 E506	P493-A502 HydrophobicContact CB-CB 3.88Å; P493-A502 WeakPolarHBondContact O-CB 3.49Å; S497-A502 VanDerWaalsContact CB-CB 3.45Å; S497-A502 WeakPolarHBondContact OG-CB 3.3Å; N499-A502 HydrophobicContact CB-CB 4.02Å; N499-A502 WeakPolarHBondContact O-CB 3.48Å; N499-A502 PolarHBondContact O-N 2.7Å; A502-R504 PolarHBondContact O-N 2.84Å; A502-D505 PolarHBondContact O-N 3.21Å; A502-E506 WeakPolarHBondContact CB-OE1 3.43Å; A502-E506 VanDerWaalsContact CB-OE2 3.3Å; A502-E506 WeakPolarHBondContact CB-OE2 3.38Å; A502-E506 WeakPolarHBondContact O-CB 3.42Å; A502-E506 PolarHBondContact O-N 3.32Å
503	A	79.4	Confident	82	Confident	45 Å²	45	79.1 Å²	79.1	37%	0.372	38%	0.377	S	S	.	.	H	α-helix	trans	-57.9	-19	-179.2	0	0	0	0	0	115.4	R494 N501 R534	R494-A503 HydrophobicContact CG-CB 3.63Å; N501-A503 VanDerWaalsContact C-N 3.3Å; N501-A503 PolarHBondContact O-N 2.73Å; N501-A503 VanDerWaalsContact O-N 3.08Å; A503-R534 PolarHBondContact O-NH2 3.08Å
504	R	80.4	Confident	82	Confident	192 Å²	192	83 Å²	83	73%	0.725	40%	0.396	S	S	*	.	H	α-helix	trans	-90.8	-50.1	175	-178.6	-175.2	-178.9	178.1	-2.9	111.8	N501 A502 R534	N501-R504 WeakPolarHBondContact O-CA 3.4Å; N501-R504 VanDerWaalsContact O-CB 3.3Å; N501-R504 WeakPolarHBondContact O-CB 3.3Å; N501-R504 PolarHBondContact O-N 3.18Å; A502-R504 PolarHBondContact O-N 2.84Å; R504-R534 VanDerWaalsContact C-NH2 3.34Å; R504-R534 PolarHBondContact O-NH2 3.08Å
505	D	83.4	Confident	82.3	Confident	20 Å²	20	73.8 Å²	73.8	11%	0.107	36%	0.362	C	S	.	.	H	α-helix	trans	-98.6	-18.6	-164.7	-62.4	-69.2	0	0	0	114.2	R464 N501 A502 G536 L537	R464-D505 IonicContact CZ-OD1 3.29Å; R464-D505 VanDerWaalsContact CZ-OD1 3.23Å; R464-D505 IonicContact NH1-OD1 3.34Å; R464-D505 PolarHBondContact NH1-OD1 2.6Å; R464-D505 IonicContact NH2-OD1 3.5Å; R464-D505 PolarHBondContact NH2-OD1 3.05Å; N501-D505 PolarHBondContact ND2-OD2 3.36Å; N501-D505 PolarHBondContact O-N 2.84Å; A502-D505 PolarHBondContact O-N 3.21Å; D505-G536 CarbonylContact O-C 3.5Å; D505-G536 VanDerWaalsContact O-CA 3.27Å; D505-G536 WeakPolarHBondContact O-CA 3.11Å; D505-L537 PolarHBondContact O-N 2.95Å
506	E	91.1	Very high	82.6	Confident	2 Å²	2	71 Å²	71	1%	0.009	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-100.1	155.6	177.3	-60.2	161.2	-161.7	0	0	111.9	Y491 P493 S497 N499 A502 R534 L537	Y491-E506 PolarHBondContact OH-OE2 3.29Å; P493-E506 HydrophobicContact CB-CB 4.06Å; P493-E506 WeakPolarHBondContact CB-OE2 3.46Å; P493-E506 HydrophobicContact CG-CB 3.76Å; S497-E506 WeakPolarHBondContact CB-OE2 3.15Å; S497-E506 VanDerWaalsContact OG-CD 3.31Å; S497-E506 PolarHBondContact OG-OE1 3.15Å; S497-E506 PolarHBondContact OG-OE2 3.46Å; S497-E506 VanDerWaalsContact OG-OE2 3.14Å; N499-E506 PolarHBondContact ND2-OE1 3.4Å; A502-E506 WeakPolarHBondContact CB-OE1 3.43Å; A502-E506 VanDerWaalsContact CB-OE2 3.3Å; A502-E506 WeakPolarHBondContact CB-OE2 3.38Å; A502-E506 WeakPolarHBondContact O-CB 3.42Å; A502-E506 PolarHBondContact O-N 3.32Å; E506-R534 PolarHBondContact O-NH2 3.09Å; E506-L537 CarbonylContact C-O 3.56Å; E506-L537 WeakPolarHBondContact CA-O 3.39Å; E506-L537 HydrophobicContact CG-CB 4.15Å
507	L	89.4	Confident	83	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-91.2	122.5	176.1	-73	179.6	0	0	0	112	Y491 F509 I515 G529 L531 R534 L537 V538	Y491-L507 WeakPolarHBondContact CD1-O 3.32Å; L507-F509 WeakPolarHBondContact O-CD1 3.49Å; L507-I515 HydrophobicContact CD1-CG2 4.24Å; L507-G529 WeakPolarHBondContact CD1-O 3.09Å; L507-L531 HydrophobicContact CD1-CB 4.04Å; L507-R534 HydrophobicContact CD2-CB 3.79Å; L507-R534 HydrophobicContact CD2-CG 3.56Å; L507-L537 PolarHBondContact N-O 2.98Å; L507-V538 HydrophobicContact CB-CG2 4.21Å; L507-V538 HydrophobicContact CD1-CG2 3.82Å; L507-V538 HydrophobicContact CG-CG2 4.39Å
508	P	90.3	Very high	83.2	Confident	58 Å²	58	70 Å²	70	38%	0.377	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-72.5	139.2	162.3	30.4	-31.8	0	0	0	110.3	Y491 L531	Y491-P508 WeakPolarHBondContact O-CA 3.45Å; P508-L531 WeakPolarHBondContact O-CD2 3.17Å
509	F	91.9	Very high	83.7	Confident	7 Å²	7	69.6 Å²	69.6	3%	0.031	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-150.1	166.4	177.5	57.5	-97.9	0	0	0	111.6	Y491 L507 E513 I515 L531 V538 L542 V543	Y491-F509 HydrophobicContact CD1-CD1 4.05Å; Y491-F509 AromaticContact CD1-CE1 3.53Å; Y491-F509 HydrophobicContact CD1-CE1 3.53Å; Y491-F509 HydrophobicContact CD1-CZ 4.04Å; Y491-F509 HydrophobicContact CE1-CE1 4.45Å; Y491-F509 AromaticContact CG-CE1 3.97Å; Y491-F509 HydrophobicContact CG-CE1 3.97Å; Y491-F509 HydrophobicContact CG-CZ 4.02Å; Y491-F509 PolarHBondContact N-O 3.13Å; Y491-F509 PolarHBondContact O-N 3.05Å; L507-F509 WeakPolarHBondContact O-CD1 3.49Å; F509-E513 VanDerWaalsContact CA-OE2 3.27Å; F509-E513 WeakPolarHBondContact CA-OE2 3.27Å; F509-I515 HydrophobicContact CB-CD1 4.03Å; F509-I515 HydrophobicContact CD1-CD1 3.62Å; F509-I515 HydrophobicContact CD2-CD1 4.35Å; F509-I515 HydrophobicContact CE1-CD1 4.1Å; F509-I515 HydrophobicContact CG-CD1 3.76Å; F509-L531 HydrophobicContact CB-CD2 3.58Å; F509-V538 HydrophobicContact CE1-CG1 3.97Å; F509-L542 HydrophobicContact CE2-CB 4.24Å; F509-L542 HydrophobicContact CZ-CB 3.83Å; F509-V543 HydrophobicContact CE1-CG1 4.42Å; F509-V543 HydrophobicContact CE2-CG1 4.12Å; F509-V543 HydrophobicContact CZ-CG1 3.84Å
510	R	85.4	Confident	84	Confident	157 Å²	157	72.4 Å²	72.4	59%	0.592	34%	0.34	S	S	*	.			trans	-111.7	160.8	176.6	-60.6	-170.4	-172	-145.5	7.2	113.2	F489 D490 G512 E513	F489-R510 CarbonylContact O-C 3.57Å; D490-R510 WeakPolarHBondContact OD1-CA 3.45Å; D490-R510 WeakPolarHBondContact OD1-CB 3.4Å; R510-G512 PolarHBondContact O-N 3.01Å; R510-G512 VanDerWaalsContact O-N 3.16Å; R510-E513 HydrophobicContact CB-CG 4.01Å; R510-E513 PolarHBondContact N-OE2 2.88Å; R510-E513 WeakPolarHBondContact O-CB 3.3Å; R510-E513 PolarHBondContact O-N 2.71Å
511	K	83.3	Confident	84.6	Confident	84 Å²	84	65.4 Å²	65.4	37%	0.365	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	118.1	171.6	-178.2	162.7	-172.8	145.2	0	110.3	E365 L488 F489 D490	E365-K511 WeakPolarHBondContact OE1-CE 3.25Å; E365-K511 IonicContact OE1-NZ 2.71Å; E365-K511 PolarHBondContact OE1-NZ 3.05Å; L488-K511 WeakPolarHBondContact O-CD 3.32Å; L488-K511 WeakPolarHBondContact O-CE 3.35Å; L488-K511 WeakPolarHBondContact O-CG 3.33Å; L488-K511 PolarHBondContact O-NZ 3.14Å; L488-K511 VanDerWaalsContact O-NZ 3.17Å; F489-K511 PolarHBondContact O-N 3.11Å; D490-K511 PolarHBondContact OD1-N 3.01Å
512	G	79.4	Confident	84.8	Confident	39 Å²	39	64.8 Å²	64.8	40%	0.402	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	-3.9	-178.2	0	0	0	0	0	115.9	G487 R510	G487-G512 PolarHBondContact O-N 3.25Å; R510-G512 PolarHBondContact O-N 3.01Å; R510-G512 VanDerWaalsContact O-N 3.16Å
513	E	85.2	Confident	84.7	Confident	60 Å²	60	74.5 Å²	74.5	28%	0.28	36%	0.356	S	S	.	.			trans	-71.6	141.3	174	-74.2	-175.1	152.4	0	0	111.7	V486 G487 F509 R510	V486-E513 WeakPolarHBondContact CA-O 3.36Å; G487-E513 PolarHBondContact N-O 3.32Å; F509-E513 VanDerWaalsContact CA-OE2 3.27Å; F509-E513 WeakPolarHBondContact CA-OE2 3.27Å; R510-E513 HydrophobicContact CB-CG 4.01Å; R510-E513 PolarHBondContact N-OE2 2.88Å; R510-E513 WeakPolarHBondContact O-CB 3.3Å; R510-E513 PolarHBondContact O-N 2.71Å
514	M	83.8	Confident	84.6	Confident	89 Å²	89	78.1 Å²	78.1	44%	0.438	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.6	178.7	-71.8	179.7	66.5	0	0	110.7	C484 L485 V486 L531	C484-M514 HydrophobicContact CB-CE 4.21Å; L485-M514 WeakPolarHBondContact O-CA 3.46Å; V486-M514 HydrophobicContact CG2-CG 3.87Å; M514-L531 WeakPolarHBondContact O-CD1 3.47Å
515	I	88.5	Confident	84.7	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.5	177.8	-49.4	167.6	0	0	0	108.2	C484 L485 L507 F509 L531 V538 V543	C484-I515 CarbonylContact C-O 3.6Å; C484-I515 WeakPolarHBondContact CA-O 3.34Å; L485-I515 HydrophobicContact CB-CB 4.24Å; L485-I515 PolarHBondContact N-O 2.87Å; L485-I515 PolarHBondContact O-N 2.77Å; L507-I515 HydrophobicContact CD1-CG2 4.24Å; F509-I515 HydrophobicContact CB-CD1 4.03Å; F509-I515 HydrophobicContact CD1-CD1 3.62Å; F509-I515 HydrophobicContact CD2-CD1 4.35Å; F509-I515 HydrophobicContact CE1-CD1 4.1Å; F509-I515 HydrophobicContact CG-CD1 3.76Å; I515-L531 HydrophobicContact CG1-CB 4.36Å; I515-L531 HydrophobicContact CG1-CD1 4.36Å; I515-L531 HydrophobicContact CG1-CD2 4.24Å; I515-L531 HydrophobicContact CG2-CB 4.28Å; I515-V538 HydrophobicContact CD1-CG1 3.83Å; I515-V538 HydrophobicContact CD1-CG2 4.32Å; I515-V538 HydrophobicContact CG2-CG2 4.1Å; I515-V543 HydrophobicContact CD1-CG1 4.21Å
516	K	86.2	Confident	85	Confident	93 Å²	93	69.6 Å²	69.6	40%	0.404	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	130.9	178	169.4	-174.8	161.8	-152.7	0	109.3	G529 E530	K516-G529 CarbonylContact O-C 3.53Å; K516-G529 WeakPolarHBondContact O-CA 3.27Å; K516-E530 HydrophobicContact CB-CB 4.3Å; K516-E530 WeakPolarHBondContact CD-OE2 3.44Å; K516-E530 WeakPolarHBondContact CE-OE2 3.3Å; K516-E530 PolarHBondContact N-O 3.26Å; K516-E530 IonicContact NZ-OE2 2.74Å; K516-E530 PolarHBondContact NZ-OE2 3.27Å; K516-E530 PolarHBondContact O-N 3Å
517	V	88.4	Confident	84.9	Confident	19 Å²	19	71.1 Å²	71.1	12%	0.115	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	129.7	177.5	-177.5	0	0	0	0	109.6	R483 L485 E519 Y527	R483-V517 HydrophobicContact CB-CB 3.92Å; R483-V517 HydrophobicContact CB-CG2 3.87Å; R483-V517 WeakPolarHBondContact O-CB 2.92Å; R483-V517 PolarHBondContact O-N 2.84Å; L485-V517 HydrophobicContact CD1-CG2 3.9Å; L485-V517 HydrophobicContact CD2-CG2 4.4Å; L485-V517 HydrophobicContact CG-CG2 3.67Å; V517-E519 WeakPolarHBondContact CG1-O 3.29Å; V517-Y527 HydrophobicContact CG1-CD1 4.5Å
518	L	84.5	Confident	84.9	Confident	68 Å²	68	73 Å²	73	36%	0.356	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-46.3	170.9	-60.5	-178.1	0	0	0	111.3	L528 E530 I535	L518-L528 HydrophobicContact CB-CB 4.44Å; L518-L528 HydrophobicContact CB-CD2 4.23Å; L518-L528 HydrophobicContact CB-CG 4.31Å; L518-L528 WeakPolarHBondContact CB-O 3.5Å; L518-L528 HydrophobicContact CD1-CD2 4.38Å; L518-L528 HydrophobicContact CD1-CG 4.4Å; L518-L528 PolarHBondContact N-O 3Å; L518-E530 HydrophobicContact CD1-CB 4.14Å; L518-E530 HydrophobicContact CD2-CB 4.25Å; L518-E530 HydrophobicContact CG-CB 4.16Å; L518-I535 HydrophobicContact CD1-CB 4.48Å; L518-I535 HydrophobicContact CD1-CD1 3.78Å; L518-I535 HydrophobicContact CD1-CG1 3.86Å; L518-I535 HydrophobicContact CD1-CG2 3.85Å
519	E	84.3	Confident	84.8	Confident	123 Å²	123	70.3 Å²	70.3	58%	0.575	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	163.9	179.2	-58.9	-179.3	170.1	0	0	110.9	V517 L528	V517-E519 WeakPolarHBondContact CG1-O 3.29Å; E519-L528 HydrophobicContact CB-CB 3.83Å; E519-L528 HydrophobicContact CG-CB 4.15Å; E519-L528 HydrophobicContact CG-CD2 3.9Å; E519-L528 PolarHBondContact N-O 3.48Å
520	E	82.1	Confident	84.7	Confident	125 Å²	125	72.7 Å²	72.7	58%	0.584	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	174.4	-178.3	-50.5	-143	123.5	0	0	112.2	R483 D522	R483-E520 IonicContact CZ-OE1 2.72Å; R483-E520 IonicContact NH1-OE1 2.65Å; R483-E520 PolarHBondContact NH1-OE1 2.97Å; R483-E520 IonicContact NH2-OE1 3.98Å; R483-E520 PolarHBondContact NH2-OE1 2.91Å; E520-D522 PolarHBondContact O-N 3.18Å
521	K	84.4	Confident	84.9	Confident	114 Å²	114	65.9 Å²	65.9	50%	0.496	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	125	173.4	-176.7	-178.5	170.9	166.4	0	109.4	F526 Y527 S540	K521-F526 CarbonylContact C-O 3.17Å; K521-F526 WeakPolarHBondContact CA-O 3.33Å; K521-Y527 HydrophobicContact CB-CD1 4.03Å; K521-Y527 HydrophobicContact CB-CE1 3.74Å; K521-S540 WeakPolarHBondContact CE-OG 2.91Å; K521-S540 PolarHBondContact NZ-OG 2.93Å
522	D	82	Confident	84.8	Confident	62 Å²	62	68.7 Å²	68.7	33%	0.332	34%	0.343	S	S	.	.			trans	-76	-176.1	174.1	64.9	30	0	0	0	112.6	E520 D524 G525 F526	E520-D522 PolarHBondContact O-N 3.18Å; D522-D524 PolarHBondContact OD1-N 3.47Å; D522-G525 WeakPolarHBondContact OD1-CA 3.05Å; D522-G525 PolarHBondContact OD1-N 3.23Å; D522-F526 PolarHBondContact N-O 3.18Å; D522-F526 PolarHBondContact OD1-N 2.79Å
523	F	75.6	Confident	84.8	Confident	206 Å²	206	70 Å²	70	90%	0.904	36%	0.355	S	S	*	.	S	Bend	trans	-76	-25.6	-176.4	59.9	-95.5	0	0	0	113.8
524	D	77.1	Confident	84.7	Confident	120 Å²	120	71.7 Å²	71.7	64%	0.642	36%	0.359	S	S	*	.	S	Bend	trans	-84.2	-31.5	-180	-165.3	42.4	0	0	0	110.8	D522 F526	D522-D524 PolarHBondContact OD1-N 3.47Å; D524-F526 HydrophobicContact CB-CD2 4.37Å; D524-F526 WeakPolarHBondContact OD2-CE2 3.32Å
525	G	82.6	Confident	84.9	Confident	9 Å²	9	72.1 Å²	72.1	9%	0.093	36%	0.363	C	S	.	.	S	Bend	trans	125.7	25	159.5	0	0	0	0	0	114.8	D522 S540	D522-G525 WeakPolarHBondContact OD1-CA 3.05Å; D522-G525 PolarHBondContact OD1-N 3.23Å; G525-S540 WeakPolarHBondContact O-CB 3.47Å; G525-S540 PolarHBondContact O-N 2.97Å; G525-S540 PolarHBondContact O-OG 2.92Å
526	F	89	Confident	84.9	Confident	25 Å²	25	72.4 Å²	72.4	11%	0.11	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	151.4	177.9	-62.5	-99.9	0	0	0	110.9	K521 D522 D524 L537 V538 P539	K521-F526 CarbonylContact C-O 3.17Å; K521-F526 WeakPolarHBondContact CA-O 3.33Å; D522-F526 PolarHBondContact N-O 3.18Å; D522-F526 PolarHBondContact OD1-N 2.79Å; D524-F526 HydrophobicContact CB-CD2 4.37Å; D524-F526 WeakPolarHBondContact OD2-CE2 3.32Å; F526-L537 HydrophobicContact CB-CB 4.07Å; F526-L537 HydrophobicContact CB-CD2 4.11Å; F526-L537 HydrophobicContact CD1-CB 3.82Å; F526-L537 HydrophobicContact CG-CB 4.16Å; F526-V538 CarbonylContact C-O 3.4Å; F526-V538 WeakPolarHBondContact CA-O 3.08Å; F526-P539 HydrophobicContact CD1-CB 3.97Å; F526-P539 HydrophobicContact CE1-CB 3.74Å; F526-P539 HydrophobicContact CE1-CG 4.4Å; F526-P539 HydrophobicContact CZ-CB 4.49Å
527	Y	88.7	Confident	85.1	Confident	33 Å²	33	70.6 Å²	70.6	13%	0.129	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	146.6	162.4	-63	-89.3	0	0	0	109.2	L485 V517 K521 G529 L537 V538 S540 V543	L485-Y527 HydrophobicContact CD1-CD1 4.47Å; L485-Y527 HydrophobicContact CD1-CD2 3.7Å; L485-Y527 HydrophobicContact CD1-CE2 4.26Å; L485-Y527 HydrophobicContact CD1-CG 3.82Å; L485-Y527 HydrophobicContact CD2-CD2 4.12Å; L485-Y527 HydrophobicContact CD2-CE2 3.8Å; V517-Y527 HydrophobicContact CG1-CD1 4.5Å; K521-Y527 HydrophobicContact CB-CD1 4.03Å; K521-Y527 HydrophobicContact CB-CE1 3.74Å; Y527-G529 PolarHBondContact O-N 3.07Å; Y527-L537 CarbonylContact O-C 3.56Å; Y527-V538 PolarHBondContact N-O 3.48Å; Y527-V538 PolarHBondContact O-N 3.37Å; Y527-S540 VanDerWaalsContact CE2-CB 3.42Å; Y527-V543 HydrophobicContact CD2-CG2 4.24Å; Y527-V543 HydrophobicContact CE2-CG2 4.1Å
528	L	89.7	Confident	85.3	Confident	43 Å²	43	69.7 Å²	69.7	23%	0.225	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	111.9	161.7	-166.8	68.4	0	0	0	109	L518 E519 I535 L537	L518-L528 HydrophobicContact CB-CB 4.44Å; L518-L528 HydrophobicContact CB-CD2 4.23Å; L518-L528 HydrophobicContact CB-CG 4.31Å; L518-L528 WeakPolarHBondContact CB-O 3.5Å; L518-L528 HydrophobicContact CD1-CD2 4.38Å; L518-L528 HydrophobicContact CD1-CG 4.4Å; L518-L528 PolarHBondContact N-O 3Å; E519-L528 HydrophobicContact CB-CB 3.83Å; E519-L528 HydrophobicContact CG-CB 4.15Å; E519-L528 HydrophobicContact CG-CD2 3.9Å; E519-L528 PolarHBondContact N-O 3.48Å; L528-I535 HydrophobicContact CD1-CG2 3.86Å; L528-I535 HydrophobicContact CD2-CG2 4.37Å; L528-I535 HydrophobicContact CG-CG2 4.07Å; L528-L537 HydrophobicContact CD1-CD2 4.45Å
529	G	89.6	Confident	85.5	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	161.4	-177.7	0	0	0	0	0	113.9	L507 K516 Y527 I535 G536	L507-G529 WeakPolarHBondContact CD1-O 3.09Å; K516-G529 CarbonylContact O-C 3.53Å; K516-G529 WeakPolarHBondContact O-CA 3.27Å; Y527-G529 PolarHBondContact O-N 3.07Å; G529-I535 WeakPolarHBondContact O-CA 3.37Å; G529-G536 PolarHBondContact N-O 3.13Å; G529-G536 PolarHBondContact O-N 3.43Å
530	E	89.8	Confident	85.6	Confident	58 Å²	58	62 Å²	62	27%	0.271	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.7	165.4	-174.1	-170.9	160.7	0	0	109.6	K516 L518 R534 I535	K516-E530 HydrophobicContact CB-CB 4.3Å; K516-E530 WeakPolarHBondContact CD-OE2 3.44Å; K516-E530 WeakPolarHBondContact CE-OE2 3.3Å; K516-E530 PolarHBondContact N-O 3.26Å; K516-E530 IonicContact NZ-OE2 2.74Å; K516-E530 PolarHBondContact NZ-OE2 3.27Å; K516-E530 PolarHBondContact O-N 3Å; L518-E530 HydrophobicContact CD1-CB 4.14Å; L518-E530 HydrophobicContact CD2-CB 4.25Å; L518-E530 HydrophobicContact CG-CB 4.16Å; E530-R534 WeakPolarHBondContact CA-O 3.35Å; E530-I535 HydrophobicContact CB-CG1 4.46Å; E530-I535 HydrophobicContact CG-CG1 4.34Å
531	L	87.9	Confident	85.9	Confident	13 Å²	13	58.7 Å²	58.7	7%	0.068	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	129.3	175.1	178.9	64.1	0	0	0	109.6	L507 P508 F509 M514 I515 G533 R534	L507-L531 HydrophobicContact CD1-CB 4.04Å; P508-L531 WeakPolarHBondContact O-CD2 3.17Å; F509-L531 HydrophobicContact CB-CD2 3.58Å; M514-L531 WeakPolarHBondContact O-CD1 3.47Å; I515-L531 HydrophobicContact CG1-CB 4.36Å; I515-L531 HydrophobicContact CG1-CD1 4.36Å; I515-L531 HydrophobicContact CG1-CD2 4.24Å; I515-L531 HydrophobicContact CG2-CB 4.28Å; L531-G533 PolarHBondContact O-N 2.68Å; L531-G533 VanDerWaalsContact O-N 3.08Å; L531-R534 PolarHBondContact N-O 3.24Å; L531-R534 PolarHBondContact O-N 2.81Å
532	N	82.5	Confident	86	Confident	144 Å²	144	54.1 Å²	54.1	77%	0.77	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	33.1	178.5	-61.6	-32.3	0	0	0	114	R534	N532-R534 PolarHBondContact O-N 3.41Å
533	G	79	Confident	86.2	Confident	65 Å²	65	51.5 Å²	51.5	67%	0.67	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	0.4	-177.3	0	0	0	0	0	115.4	L531	L531-G533 PolarHBondContact O-N 2.68Å; L531-G533 VanDerWaalsContact O-N 3.08Å
534	R	83.6	Confident	86.6	Confident	96 Å²	96	43.7 Å²	43.7	36%	0.362	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	139.4	168.2	-170.6	-178.3	174.1	179.1	-0	109.3	A503 R504 E506 L507 E530 L531 N532	A503-R534 PolarHBondContact O-NH2 3.08Å; R504-R534 VanDerWaalsContact C-NH2 3.34Å; R504-R534 PolarHBondContact O-NH2 3.08Å; E506-R534 PolarHBondContact O-NH2 3.09Å; L507-R534 HydrophobicContact CD2-CB 3.79Å; L507-R534 HydrophobicContact CD2-CG 3.56Å; E530-R534 WeakPolarHBondContact CA-O 3.35Å; L531-R534 PolarHBondContact N-O 3.24Å; L531-R534 PolarHBondContact O-N 2.81Å; N532-R534 PolarHBondContact O-N 3.41Å
535	I	87.2	Confident	86.9	Confident	99 Å²	99	41 Å²	41	51%	0.508	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	144	170.9	-61.9	175	0	0	0	108.7	L518 L528 G529 E530	L518-I535 HydrophobicContact CD1-CB 4.48Å; L518-I535 HydrophobicContact CD1-CD1 3.78Å; L518-I535 HydrophobicContact CD1-CG1 3.86Å; L518-I535 HydrophobicContact CD1-CG2 3.85Å; L528-I535 HydrophobicContact CD1-CG2 3.86Å; L528-I535 HydrophobicContact CD2-CG2 4.37Å; L528-I535 HydrophobicContact CG-CG2 4.07Å; G529-I535 WeakPolarHBondContact O-CA 3.37Å; E530-I535 HydrophobicContact CB-CG1 4.46Å; E530-I535 HydrophobicContact CG-CG1 4.34Å
536	G	89.4	Confident	86.5	Confident	6 Å²	6	43.7 Å²	43.7	6%	0.062	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.5	178.4	175.1	0	0	0	0	0	112.8	D505 G529	D505-G536 CarbonylContact O-C 3.5Å; D505-G536 VanDerWaalsContact O-CA 3.27Å; D505-G536 WeakPolarHBondContact O-CA 3.11Å; G529-G536 PolarHBondContact N-O 3.13Å; G529-G536 PolarHBondContact O-N 3.43Å
537	L	90.3	Very high	84.9	Confident	54 Å²	54	47.3 Å²	47.3	28%	0.283	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	143.4	179.4	-61.7	176.5	0	0	0	111.7	D505 E506 L507 F526 Y527 L528	D505-L537 PolarHBondContact O-N 2.95Å; E506-L537 CarbonylContact C-O 3.56Å; E506-L537 WeakPolarHBondContact CA-O 3.39Å; E506-L537 HydrophobicContact CG-CB 4.15Å; L507-L537 PolarHBondContact N-O 2.98Å; F526-L537 HydrophobicContact CB-CB 4.07Å; F526-L537 HydrophobicContact CB-CD2 4.11Å; F526-L537 HydrophobicContact CD1-CB 3.82Å; F526-L537 HydrophobicContact CG-CB 4.16Å; Y527-L537 CarbonylContact O-C 3.56Å; L528-L537 HydrophobicContact CD1-CD2 4.45Å
538	V	91.5	Very high	82.8	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	110.1	-177.3	-179	0	0	0	0	109.2	L485 L507 F509 I515 F526 Y527 S540 V543	L485-V538 HydrophobicContact CD1-CG1 4.15Å; L507-V538 HydrophobicContact CB-CG2 4.21Å; L507-V538 HydrophobicContact CD1-CG2 3.82Å; L507-V538 HydrophobicContact CG-CG2 4.39Å; F509-V538 HydrophobicContact CE1-CG1 3.97Å; I515-V538 HydrophobicContact CD1-CG1 3.83Å; I515-V538 HydrophobicContact CD1-CG2 4.32Å; I515-V538 HydrophobicContact CG2-CG2 4.1Å; F526-V538 CarbonylContact C-O 3.4Å; F526-V538 WeakPolarHBondContact CA-O 3.08Å; Y527-V538 PolarHBondContact N-O 3.48Å; Y527-V538 PolarHBondContact O-N 3.37Å; V538-S540 PolarHBondContact O-N 3.18Å; V538-V543 HydrophobicContact CG1-CG1 3.68Å; V538-V543 HydrophobicContact CG1-CG2 4.25Å
539	P	88.6	Confident	80.2	Confident	8 Å²	8	50.6 Å²	50.6	5%	0.052	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	124.3	-176.2	27.7	-37.1	0	0	0	111.7	Y491 F526 N541 L542	Y491-P539 HydrophobicContact CD1-CG 4.17Å; Y491-P539 HydrophobicContact CE1-CG 3.66Å; Y491-P539 HydrophobicContact CE2-CG 4.16Å; F526-P539 HydrophobicContact CD1-CB 3.97Å; F526-P539 HydrophobicContact CE1-CB 3.74Å; F526-P539 HydrophobicContact CE1-CG 4.4Å; F526-P539 HydrophobicContact CZ-CB 4.49Å; P539-N541 VanDerWaalsContact C-N 3.27Å; P539-N541 PolarHBondContact O-N 2.93Å; P539-L542 HydrophobicContact CG-CB 4.42Å; P539-L542 HydrophobicContact CG-CD1 3.95Å; P539-L542 HydrophobicContact CG-CG 4.31Å; P539-L542 PolarHBondContact O-N 2.68Å
540	S	88	Confident	77.6	Confident	22 Å²	22	55.4 Å²	55.4	15%	0.154	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.8	-167.8	61.3	0	0	0	0	116.1	K521 G525 Y527 V538	K521-S540 WeakPolarHBondContact CE-OG 2.91Å; K521-S540 PolarHBondContact NZ-OG 2.93Å; G525-S540 WeakPolarHBondContact O-CB 3.47Å; G525-S540 PolarHBondContact O-N 2.97Å; G525-S540 PolarHBondContact O-OG 2.92Å; Y527-S540 VanDerWaalsContact CE2-CB 3.42Å; V538-S540 PolarHBondContact O-N 3.18Å
541	N	86.5	Confident	75.1	Confident	55 Å²	55	63.4 Å²	63.4	29%	0.294	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-27	175.6	64.1	-51.7	0	0	0	112.8	P539 P873	P539-N541 VanDerWaalsContact C-N 3.27Å; P539-N541 PolarHBondContact O-N 2.93Å; N541-P873 WeakPolarHBondContact ND2-CA 3.4Å; N541-P873 VanDerWaalsContact ND2-CB 3.27Å; N541-P873 WeakPolarHBondContact ND2-CB 3.09Å; N541-P873 PolarHBondContact ND2-O 3.4Å
542	L	86.5	Confident	72.5	Confident	19 Å²	19	69.9 Å²	69.9	10%	0.099	36%	0.363	C	S	.	.	S	Bend	trans	-91.8	6.9	-176.6	-60.5	-175.8	0	0	0	113.7	L488 F489 Y491 F509 P539	L488-L542 PolarHBondContact N-O 3.37Å; F489-L542 HydrophobicContact CD2-CD2 3.88Å; Y491-L542 HydrophobicContact CD2-CD1 3.2Å; Y491-L542 HydrophobicContact CE2-CD1 3.64Å; Y491-L542 HydrophobicContact CG-CD1 3.73Å; F509-L542 HydrophobicContact CE2-CB 4.24Å; F509-L542 HydrophobicContact CZ-CB 3.83Å; P539-L542 HydrophobicContact CG-CB 4.42Å; P539-L542 HydrophobicContact CG-CD1 3.95Å; P539-L542 HydrophobicContact CG-CG 4.31Å; P539-L542 PolarHBondContact O-N 2.68Å
543	V	87.2	Confident	70.1	Confident	6 Å²	6	67.6 Å²	67.6	4%	0.036	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	152	-174	-69.4	0	0	0	0	113.1	L485 V486 F509 I515 Y527 V538	L485-V543 HydrophobicContact CB-CB 4.13Å; L485-V543 HydrophobicContact CB-CG1 4.38Å; L485-V543 HydrophobicContact CD1-CG2 4.23Å; L485-V543 HydrophobicContact CD2-CB 4.25Å; L485-V543 HydrophobicContact CD2-CG2 3.91Å; L485-V543 HydrophobicContact CG-CG2 4.45Å; V486-V543 CarbonylContact O-C 3.49Å; V486-V543 VanDerWaalsContact O-CA 3.3Å; V486-V543 WeakPolarHBondContact O-CA 3.48Å; F509-V543 HydrophobicContact CE1-CG1 4.42Å; F509-V543 HydrophobicContact CE2-CG1 4.12Å; F509-V543 HydrophobicContact CZ-CG1 3.84Å; I515-V543 HydrophobicContact CD1-CG1 4.21Å; Y527-V543 HydrophobicContact CD2-CG2 4.24Å; Y527-V543 HydrophobicContact CE2-CG2 4.1Å; V538-V543 HydrophobicContact CG1-CG1 3.68Å; V538-V543 HydrophobicContact CG1-CG2 4.25Å
544	M	84.8	Confident	67.8	Low	42 Å²	42	69.1 Å²	69.1	21%	0.207	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.2	171.3	-165	-170.7	-45.4	0	0	111.4	Y368 L485 V486 L488 I546	Y368-M544 HydrophobicContact CD2-CE 4Å; Y368-M544 HydrophobicContact CD2-CG 4.02Å; Y368-M544 HydrophobicContact CD2-SD 4.22Å; Y368-M544 HydrophobicContact CE2-CG 4.45Å; Y368-M544 HydrophobicContact CG-CE 3.93Å; L485-M544 CarbonylContact C-O 3.52Å; L485-M544 VanDerWaalsContact CA-O 3.31Å; L485-M544 WeakPolarHBondContact CA-O 3.41Å; V486-M544 PolarHBondContact N-O 2.95Å; V486-M544 PolarHBondContact O-N 3.45Å; L488-M544 HydrophobicContact CD2-CB 4.09Å; L488-M544 HydrophobicContact CD2-CE 3.75Å; L488-M544 HydrophobicContact CG-CB 4.42Å; M544-I546 PolarHBondContact O-N 3.35Å
545	E	82.8	Confident	65.2	Low	64 Å²	64	70.2 Å²	70.2	30%	0.299	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	122.1	170.8	-167.7	-172.7	-158.3	0	0	110.8	R483 L485 N547	R483-E545 WeakPolarHBondContact CD-OE1 3.27Å; R483-E545 IonicContact NH1-OE1 3.13Å; L485-E545 HydrophobicContact CD2-CB 4.22Å; E545-N547 WeakPolarHBondContact CG-OD1 3.36Å
546	I	73.8	Confident	62.5	Low	65 Å²	65	71.2 Å²	71.2	33%	0.333	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	101.3	176	-58.4	-169.9	0	0	0	109.2	C484 V486 M544 N548	C484-I546 PolarHBondContact O-N 2.89Å; V486-I546 HydrophobicContact CB-CD1 4.08Å; V486-I546 HydrophobicContact CG2-CD1 3.44Å; V486-I546 VanDerWaalsContact CG2-CD1 3.44Å; V486-I546 HydrophobicContact CG2-CG1 4.27Å; M544-I546 PolarHBondContact O-N 3.35Å; I546-N548 PolarHBondContact O-N 3.2Å
547	N	56.2	Low	59.6	Low	101 Å²	101	76 Å²	76	54%	0.54	41%	0.411	S	S	.	.			trans	-74	118.1	-178.3	-64.4	33.8	0	0	0	111.2	E545	E545-N547 WeakPolarHBondContact CG-OD1 3.36Å
548	N	44.4	Very low	56.5	Low	91 Å²	91	79.8 Å²	79.8	49%	0.487	44%	0.437	S	S	.	.	S	Bend	trans	58.9	66.3	146.7	-159.5	7.4	0	0	0	116.9	E481 I546	E481-N548 HydrophobicContact CG-CB 4.48Å; E481-N548 PolarHBondContact OE1-ND2 2.98Å; I546-N548 PolarHBondContact O-N 3.2Å
549	C	33.9	Very low	53.5	Low	54 Å²	54	87.2 Å²	87.2	37%	0.365	47%	0.471	S	S	.	.			trans	-140.5	90.1	170.6	-133.6	0	0	0	0	113	R551 Y552	C549-R551 PolarHBondContact O-N 3.47Å; C549-Y552 HydrophobicContact CB-CD2 3.6Å; C549-Y552 HydrophobicContact CB-CE2 3.85Å; C549-Y552 PolarHBondContact O-N 2.74Å
550	P	35.1	Very low	50.5	Low	101 Å²	101	94.5 Å²	94.5	66%	0.656	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-0.6	173.8	-24.9	35.2	0	0	0	115.6
551	R	37	Very low	47.5	Very low	226 Å²	226	99.8 Å²	99.8	85%	0.853	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-8.8	178.6	-58	-173.5	-171.7	179.7	4	114.4	C549	C549-R551 PolarHBondContact O-N 3.47Å
552	Y	34.3	Very low	44.7	Very low	149 Å²	149	104 Å²	104	58%	0.584	56%	0.558	S	S	*	*	S	Bend	trans	-105.9	2.9	176.6	-59.1	-52.5	0	0	0	113.5	C549	C549-Y552 HydrophobicContact CB-CD2 3.6Å; C549-Y552 HydrophobicContact CB-CE2 3.85Å; C549-Y552 PolarHBondContact O-N 2.74Å
553	L	32.1	Very low	41.9	Very low	96 Å²	96	108.5 Å²	108.5	50%	0.503	59%	0.591	S	S	.	*	S	Bend	trans	-63.7	130.2	164.2	-59.9	175.6	0	0	0	108.1	S555	L553-S555 PolarHBondContact O-N 2.8Å
554	P	30.7	Very low	39	Very low	98 Å²	98	115.9 Å²	115.9	64%	0.636	63%	0.629	S	S	*	*			trans	-60.2	132.6	161.8	27.7	-32.2	0	0	0	107.4	V556	P554-V556 VanDerWaalsContact C-N 3.28Å; P554-V556 PolarHBondContact O-N 2.89Å
555	S	29.6	Very low	36.3	Very low	119 Å²	119	119.6 Å²	119.6	83%	0.832	66%	0.656	S	S	*	*			trans	-62.4	94.8	170	-60.4	0	0	0	0	108.2	L553 P557	L553-S555 PolarHBondContact O-N 2.8Å; S555-P557 WeakPolarHBondContact O-CD 3.3Å; S555-P557 VanDerWaalsContact O-N 3.1Å
556	V	30.8	Very low	33.7	Very low	119 Å²	119	123.9 Å²	123.9	72%	0.721	68%	0.681	S	S	*	*			trans	-51.4	119.7	169.1	178.2	0	0	0	0	105.8	P554 T558	P554-V556 VanDerWaalsContact C-N 3.28Å; P554-V556 PolarHBondContact O-N 2.89Å; V556-T558 PolarHBondContact O-N 3.35Å; V556-T558 VanDerWaalsContact O-N 3.08Å
557	P	27.7	Very low	31.6	Very low	106 Å²	106	125.9 Å²	125.9	69%	0.688	70%	0.696	S	S	*	*			trans	-57.6	122.8	176.1	-22.2	33	0	0	0	107.3	S555 Q559	S555-P557 WeakPolarHBondContact O-CD 3.3Å; S555-P557 VanDerWaalsContact O-N 3.1Å; P557-Q559 PolarHBondContact O-N 2.87Å
558	T	26	Very low	30.4	Very low	135 Å²	135	130 Å²	130	83%	0.828	71%	0.709	S	S	*	*			trans	-69.3	75.8	174.3	-46.7	0	0	0	0	108.3	V556 E560	V556-T558 PolarHBondContact O-N 3.35Å; V556-T558 VanDerWaalsContact O-N 3.08Å; T558-E560 PolarHBondContact O-N 2.9Å; T558-E560 VanDerWaalsContact O-N 3.13Å
559	Q	26.8	Very low	29.8	Very low	155 Å²	155	130.1 Å²	130.1	72%	0.724	72%	0.723	S	S	*	*			trans	-59.4	116.6	158.6	-77.8	-168.6	-21.4	0	0	106	P557	P557-Q559 PolarHBondContact O-N 2.87Å
560	E	25.7	Very low	29.8	Very low	161 Å²	161	132.8 Å²	132.8	75%	0.752	74%	0.739	S	S	*	*			trans	-49.3	151.4	168.8	-60.3	-174.8	138.9	0	0	109.4	T558 M562	T558-E560 PolarHBondContact O-N 2.9Å; T558-E560 VanDerWaalsContact O-N 3.13Å; E560-M562 VanDerWaalsContact C-N 3.26Å; E560-M562 PolarHBondContact O-N 3.18Å
561	P	25.7	Very low	29.4	Very low	133 Å²	133	138.6 Å²	138.6	86%	0.864	75%	0.748	S	S	*	*			trans	-66.3	84.1	-174.9	27.8	-36	0	0	0	111.4	S563	P561-S563 PolarHBondContact O-N 3.42Å
562	M	27.3	Very low	29.4	Very low	145 Å²	145	138 Å²	138	71%	0.714	75%	0.752	S	S	*	*			trans	-63.9	100.7	171.5	-85.6	-161.9	-73.3	0	0	108.1	E560 L564	E560-M562 VanDerWaalsContact C-N 3.26Å; E560-M562 PolarHBondContact O-N 3.18Å; M562-L564 PolarHBondContact O-N 2.78Å
563	S	27.9	Very low	29.3	Very low	112 Å²	112	140.4 Å²	140.4	78%	0.783	76%	0.762	S	S	*	*			trans	-57.7	99.4	179.1	53.6	0	0	0	0	110.5	P561 P565	P561-S563 PolarHBondContact O-N 3.42Å; S563-P565 WeakPolarHBondContact O-CD 3.17Å
564	L	26.7	Very low	29.4	Very low	161 Å²	161	140.4 Å²	140.4	84%	0.843	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-69.8	118.7	168.7	-72.9	175.8	0	0	0	108.9	M562	M562-L564 PolarHBondContact O-N 2.78Å
565	P	27.3	Very low	29.5	Very low	120 Å²	120	143.8 Å²	143.8	78%	0.779	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.5	141.8	176.8	29	-34.1	0	0	0	110.3	S563	S563-P565 WeakPolarHBondContact O-CD 3.17Å
566	L	28.7	Very low	29.5	Very low	155 Å²	155	149.7 Å²	149.7	81%	0.812	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-73.1	137	-177.2	-129.7	76.6	0	0	0	111.6
567	T	30.6	Very low	29.6	Very low	107 Å²	107	149.2 Å²	149.2	66%	0.656	79%	0.788	S	S	*	*			trans	74.5	152.9	166.2	80.3	0	0	0	0	116.4
568	K	30.5	Very low	30.6	Very low	187 Å²	187	148.7 Å²	148.7	81%	0.813	79%	0.785	S	S	*	*			cis	-163.7	151.2	8.9	-132.5	154.7	-160.9	170.2	0	112.3
569	A	32.1	Very low	31	Very low	93 Å²	93	152.7 Å²	152.7	77%	0.769	79%	0.786	S	S	*	*			trans	80.8	169.1	147.9	0	0	0	0	0	119.9
570	P	34	Very low	31.6	Very low	110 Å²	110	151 Å²	151	71%	0.714	79%	0.791	S	S	*	*				-139.2	166.8	-123.4	24.1	3.4	0	0	0	120.9
571	W	27.1	Very low	32	Very low	223 Å²	223	150.9 Å²	150.9	85%	0.845	80%	0.796	S	S	*	*			trans	32.9	131.7	148.4	-64.9	104.9	0	0	0	123.9
572	K	35.1	Very low	32.5	Very low	215 Å²	215	150.5 Å²	150.5	94%	0.935	79%	0.791	S	S	*	*			trans	-167.1	170.6	135.2	-111.3	164	-173.8	177.5	0	115.6
573	Y	32.8	Very low	32.9	Very low	199 Å²	199	153.8 Å²	153.8	78%	0.78	80%	0.797	S	S	*	*			trans	-121.6	149	-162.4	-104.8	-105.6	0	0	0	114.7
574	A	34.9	Very low	33.3	Very low	96 Å²	96	152.7 Å²	152.7	79%	0.793	79%	0.789	S	S	*	*			trans	172.3	142.5	138.1	0	0	0	0	0	110.4
575	H	32	Very low	33.8	Very low	169 Å²	169	150.1 Å²	150.1	78%	0.782	79%	0.785	S	S	*	*			cis	104.2	97.3	25.5	-107.3	-66.6	0	0	0	116.4
576	R	30.7	Very low	34.2	Very low	242 Å²	242	150 Å²	150	91%	0.913	79%	0.787	S	S	*	*			trans	161.4	170.3	134.3	-89.9	178.2	178.2	-94.2	-0	114.9
577	S	32.8	Very low	34.7	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	79%	0.79	S	S	*	*			trans	-166.9	-168.7	-166.5	59	0	0	0	0	110.3
578	P	47.7	Very low	35.2	Very low	95 Å²	95	145.3 Å²	145.3	62%	0.617	80%	0.797	S	S	*	*				-132.8	-148.2	-50	36.4	-15.7	0	0	0	113.9
579	Y	34.3	Very low	35.8	Very low	220 Å²	220	142.3 Å²	142.3	86%	0.863	80%	0.797	S	S	*	*			trans	91	151.9	172.9	-58.7	-72.6	0	0	0	117.4
580	S	38.7	Very low	36.1	Very low	118 Å²	118	148.2 Å²	148.2	83%	0.825	81%	0.805	S	S	*	*			cis	-146.6	-172.8	13.7	60.9	0	0	0	0	115.5
581	N	35.2	Very low	36	Very low	159 Å²	159	147.4 Å²	147.4	85%	0.85	81%	0.808	S	S	*	*			trans	-107.2	175	-167.4	-93	-18.2	0	0	0	116.1
582	V	35.9	Very low	36.6	Very low	126 Å²	126	142.3 Å²	142.3	76%	0.764	80%	0.804	S	S	*	*				167.5	123.5	128.8	152.8	0	0	0	0	116.2
583	Y	35.5	Very low	36.7	Very low	213 Å²	213	138.2 Å²	138.2	84%	0.835	80%	0.802	S	S	*	*			trans	27.9	162.7	143.9	-62.9	-93.6	0	0	0	124.5
584	S	36.9	Very low	36.5	Very low	89 Å²	89	138.9 Å²	138.9	62%	0.622	80%	0.804	S	S	*	*			cis	-164.9	158	0.4	-139.6	0	0	0	0	115
585	S	36.4	Very low	36.5	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	80%	0.799	S	S	*	*			trans	58.5	154.4	141.2	-57.4	0	0	0	0	122.7
586	S	37.2	Very low	36.6	Very low	119 Å²	119	140.3 Å²	140.3	83%	0.832	80%	0.795	S	S	*	*			cis	-178.1	147	-18.9	54.8	0	0	0	0	113.3
587	G	39.3	Very low	36.6	Very low	85 Å²	85	138.9 Å²	138.9	88%	0.876	79%	0.791	S	S	*	*			trans	125.4	134	141.2	0	0	0	0	0	121.9
588	G	40.2	Very low	36.6	Very low	78 Å²	78	145.4 Å²	145.4	80%	0.804	80%	0.799	S	S	*	*			trans	110.5	117.7	149.8	0	0	0	0	0	119.2
589	P	42.8	Very low	35.7	Very low	124 Å²	124	147.3 Å²	147.3	81%	0.805	80%	0.804	S	S	*	*			trans	-123.2	162.7	-175.9	41.6	-31.4	0	0	0	117.1
590	K	37.8	Very low	35.7	Very low	216 Å²	216	143.3 Å²	143.3	94%	0.939	80%	0.802	S	S	*	*			trans	-168.7	153.7	147.5	-106.9	160.8	-173.1	176.4	0	111.8
591	A	33.8	Very low	35.2	Very low	93 Å²	93	146.4 Å²	146.4	77%	0.769	80%	0.803	S	S	*	*			trans	-116.3	-172.2	-178.3	0	0	0	0	0	110
592	P	39.6	Very low	35.3	Very low	117 Å²	117	144.1 Å²	144.1	76%	0.76	80%	0.797	S	S	*	*			cis	-136.5	-177.6	-2.9	43.6	-27	0	0	0	115
593	S	36.5	Very low	35	Very low	128 Å²	128	144.4 Å²	144.4	90%	0.895	80%	0.799	S	S	*	*			trans	154.1	166.2	131.2	57.8	0	0	0	0	113.7
594	Y	28.3	Very low	34.8	Very low	213 Å²	213	139.6 Å²	139.6	84%	0.835	80%	0.797	S	S	*	*			trans	-95	139	-160.8	170	-97.4	0	0	0	112.2
595	E	34.6	Very low	34.7	Very low	144 Å²	144	142.9 Å²	142.9	67%	0.673	81%	0.806	S	S	*	*				-178.5	147.4	129	-101.6	-165.8	152.4	0	0	116.3
596	Q	35.4	Very low	34.4	Very low	151 Å²	151	144.1 Å²	144.1	71%	0.706	80%	0.804	S	S	*	*			trans	58.8	101.2	147.6	-62.7	179.5	24.6	0	0	122.8
597	Y	29	Very low	34.1	Very low	212 Å²	212	149.9 Å²	149.9	83%	0.831	81%	0.808	S	S	*	*			trans	8.3	129.5	130.9	-90.1	-92.1	0	0	0	120
598	R	33.4	Very low	33.8	Very low	247 Å²	247	153.2 Å²	153.2	93%	0.932	81%	0.805	S	S	*	*				-166.7	124.2	123.3	-114.4	172.2	-177.4	168.5	3.1	114.2
599	D	29.4	Very low	33.4	Very low	134 Å²	134	157.7 Å²	157.7	72%	0.717	81%	0.81	S	S	*	*			trans	-81.6	133.4	175.4	-47.9	-93.5	0	0	0	112.9
600	V	33.1	Very low	32.7	Very low	137 Å²	137	163.9 Å²	163.9	83%	0.83	82%	0.817	S	S	*	*			trans	-148.6	109.8	151.7	-173.6	0	0	0	0	109.8
601	H	29.1	Very low	32.6	Very low	183 Å²	183	158.3 Å²	158.3	85%	0.847	81%	0.811	S	S	*	*			trans	-87	148.3	157.7	-88.6	-74.4	0	0	0	109.6
602	P	37	Very low	32.8	Very low	110 Å²	110	160 Å²	160	71%	0.714	82%	0.815	S	S	*	*				-146.9	134.5	107.7	34.5	-17.4	0	0	0	116.6
603	T	30	Very low	32.6	Very low	133 Å²	133	160.2 Å²	160.2	82%	0.816	82%	0.819	S	S	*	*			trans	15.2	125.2	141.5	58	0	0	0	0	121.4
604	S	32	Very low	32.5	Very low	111 Å²	111	159.2 Å²	159.2	78%	0.776	81%	0.812	S	S	*	*			trans	-168.6	104.7	142.8	175.4	0	0	0	0	114.7
605	I	34.1	Very low	32.7	Very low	159 Å²	159	156.7 Å²	156.7	82%	0.815	81%	0.813	S	S	*	*			trans	58	145.3	142.4	-70.2	171.7	0	0	0	121.5
606	D	30.2	Very low	32.5	Very low	133 Å²	133	154.4 Å²	154.4	71%	0.711	81%	0.81	S	S	*	*			trans	-40	137.5	-176.2	-58.2	-79.1	0	0	0	119.1
607	R	31.7	Very low	32.2	Very low	240 Å²	240	153.6 Å²	153.6	91%	0.906	82%	0.816	S	S	*	*				-165.3	152.6	104.3	-115.8	175.6	157.5	178.4	-7.1	114.6
608	D	31.2	Very low	32.1	Very low	154 Å²	154	152 Å²	152	82%	0.824	82%	0.821	S	S	*	*			trans	-64.2	131.3	172.2	-48.4	-84.5	0	0	0	112.3
609	L	33	Very low	32	Very low	172 Å²	172	145.6 Å²	145.6	90%	0.901	81%	0.814	S	S	*	*			trans	-168.3	139.7	143.2	-105.9	163.3	0	0	0	109.8
610	W	28.4	Very low	32.1	Very low	255 Å²	255	151 Å²	151	97%	0.966	82%	0.824	S	S	*	*			trans	-90.4	174.4	-179.4	-76.2	-20.5	0	0	0	113.1
611	A	35.3	Very low	32.1	Very low	98 Å²	98	153.1 Å²	153.1	81%	0.81	83%	0.825	S	S	*	*			trans	92.5	149.6	158.9	0	0	0	0	0	116.7
612	P	37.1	Very low	32.4	Very low	130 Å²	130	153.8 Å²	153.8	84%	0.844	83%	0.826	S	S	*	*				-133.7	176.6	-129.6	41.8	-26.1	0	0	0	116.2
613	S	35.9	Very low	32.3	Very low	121 Å²	121	155.8 Å²	155.8	85%	0.846	83%	0.83	S	S	*	*			trans	-138.8	115.8	163.3	61	0	0	0	0	111.7
614	S	33.5	Very low	32.2	Very low	107 Å²	107	159.5 Å²	159.5	75%	0.748	83%	0.831	S	S	*	*			trans	-74	156.6	-176.8	53.6	0	0	0	0	115.4
615	D	33.6	Very low	32.5	Very low	159 Å²	159	161.1 Å²	161.1	85%	0.85	83%	0.831	S	S	*	*			trans	-120.1	123.3	139.7	-166	5.4	0	0	0	108.5
616	P	30.3	Very low	32.7	Very low	97 Å²	97	159 Å²	159	63%	0.63	83%	0.826	S	S	*	*			trans	-114.9	104.9	-163.8	38	-28.2	0	0	0	115.6
617	T	28.3	Very low	32.9	Very low	134 Å²	134	158.1 Å²	158.1	82%	0.822	83%	0.83	S	S	*	*			trans	-149.7	154.4	150.4	40.4	0	0	0	0	112.1
618	L	28.5	Very low	33.1	Very low	177 Å²	177	152.2 Å²	152.2	93%	0.927	83%	0.825	S	S	*	*	S	Bend	trans	65	48.9	167	-56.4	-179	0	0	0	119.8
619	S	29.5	Very low	33.8	Very low	114 Å²	114	146.4 Å²	146.4	80%	0.797	80%	0.802	S	S	*	*			trans	-165.9	144.2	131.1	-169.2	0	0	0	0	110.9
620	R	31.6	Very low	35	Very low	246 Å²	246	141.4 Å²	141.4	93%	0.928	78%	0.779	S	S	*	*			trans	-120.6	94.6	167.9	-89.8	-170.7	172.8	175.3	-2	109.8
621	H	33.6	Very low	35.9	Very low	182 Å²	182	134.5 Å²	134.5	84%	0.843	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-61.4	158.1	155.6	-112.7	-19.8	0	0	0	110
622	F	34.8	Very low	36.8	Very low	198 Å²	198	137.4 Å²	137.4	87%	0.868	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-91.5	147.5	168	-105	-93.8	0	0	0	110
623	D	35.2	Very low	37.4	Very low	151 Å²	151	136.5 Å²	136.5	81%	0.807	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-71.5	136.1	-172.9	-55.5	-81.4	0	0	0	113.8	D625	D623-D625 PolarHBondContact O-N 2.82Å
624	Y	28.9	Very low	38.3	Very low	211 Å²	211	137 Å²	137	83%	0.827	74%	0.735	S	S	*	*			trans	-76	92.2	164.5	-102.8	-92.1	0	0	0	109.6	T626	Y624-T626 PolarHBondContact O-N 2.64Å
625	D	37.8	Very low	39.5	Very low	146 Å²	146	137.6 Å²	137.6	78%	0.781	73%	0.726	S	S	*	*			trans	-76.8	115	178.5	-163	16.5	0	0	0	110.9	D623	D623-D625 PolarHBondContact O-N 2.82Å
626	T	38.5	Very low	41	Very low	114 Å²	114	133.4 Å²	133.4	70%	0.699	71%	0.706	S	S	*	*			trans	-80.2	149.5	-167.9	47.2	0	0	0	0	113.2	Y624 S628	Y624-T626 PolarHBondContact O-N 2.64Å; T626-S628 PolarHBondContact O-N 3.33Å
627	S	34	Very low	42	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	71%	0.711	S	S	*	*			trans	-81.2	83.6	-162.8	59.8	0	0	0	0	114.9
628	S	36.7	Very low	43	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	69%	0.69	S	S	*	*			trans	-122.5	38.7	171.8	61.2	0	0	0	0	114.5	T626	T626-S628 PolarHBondContact O-N 3.33Å
629	G	45.8	Very low	44.5	Very low	33 Å²	33	129.8 Å²	129.8	34%	0.34	67%	0.669	S	S	.	*			trans	-94.1	141.3	172	0	0	0	0	0	113.9	K634	G629-K634 WeakPolarHBondContact O-CE 3.42Å
630	T	57.5	Low	45.5	Very low	67 Å²	67	131.1 Å²	131.1	41%	0.411	66%	0.661	S	S	.	*			trans	-64.4	163.7	179.4	62.3	0	0	0	0	113.1	E632 E633 K634	T630-E632 VanDerWaalsContact C-N 3.25Å; T630-E632 PolarHBondContact O-N 2.9Å; T630-E633 VanDerWaalsContact CB-OE2 3.3Å; T630-E633 WeakPolarHBondContact CB-OE2 3.43Å; T630-E633 WeakPolarHBondContact CG2-OE2 3.33Å; T630-E633 PolarHBondContact N-OE2 2.86Å; T630-E633 PolarHBondContact O-N 2.99Å; T630-E633 VanDerWaalsContact OG1-CG 3.28Å; T630-E633 WeakPolarHBondContact OG1-CG 3.41Å; T630-E633 PolarHBondContact OG1-N 2.97Å; T630-E633 PolarHBondContact OG1-OE2 3.1Å; T630-K634 WeakPolarHBondContact O-CG 3.46Å; T630-K634 PolarHBondContact O-N 2.89Å
631	P	47.1	Very low	46.2	Very low	110 Å²	110	129 Å²	129	71%	0.714	65%	0.653	S	S	*	*	H	α-helix	trans	-56.4	-37.4	175.2	-26.3	36.1	0	0	0	113.4	K634 Q635	P631-K634 PolarHBondContact O-N 3.36Å; P631-Q635 WeakPolarHBondContact O-CB 3.48Å; P631-Q635 PolarHBondContact O-N 3.46Å
632	E	53.9	Low	47.2	Very low	158 Å²	158	123.9 Å²	123.9	74%	0.738	63%	0.634	S	S	*	*	H	α-helix	trans	-73.6	-35	-179.9	-67.1	-180	108	0	0	112.5	T630 Q635 T636	T630-E632 VanDerWaalsContact C-N 3.25Å; T630-E632 PolarHBondContact O-N 2.9Å; E632-Q635 PolarHBondContact O-N 3.32Å; E632-T636 VanDerWaalsContact O-CB 3.27Å; E632-T636 WeakPolarHBondContact O-CB 3.31Å; E632-T636 PolarHBondContact O-N 3.06Å; E632-T636 PolarHBondContact O-OG1 3.23Å
633	E	51.5	Low	47.9	Very low	112 Å²	112	122.9 Å²	122.9	52%	0.523	63%	0.625	S	S	.	*	H	α-helix	trans	-67.7	-39.5	172.1	-72	166.5	116.7	0	0	111.7	T630 T636 R637	T630-E633 VanDerWaalsContact CB-OE2 3.3Å; T630-E633 WeakPolarHBondContact CB-OE2 3.43Å; T630-E633 WeakPolarHBondContact CG2-OE2 3.33Å; T630-E633 PolarHBondContact N-OE2 2.86Å; T630-E633 PolarHBondContact O-N 2.99Å; T630-E633 VanDerWaalsContact OG1-CG 3.28Å; T630-E633 WeakPolarHBondContact OG1-CG 3.41Å; T630-E633 PolarHBondContact OG1-N 2.97Å; T630-E633 PolarHBondContact OG1-OE2 3.1Å; E633-T636 PolarHBondContact O-N 3.02Å; E633-R637 VanDerWaalsContact O-CB 3.31Å; E633-R637 WeakPolarHBondContact O-CB 3.23Å; E633-R637 PolarHBondContact O-N 3.18Å
634	K	53.5	Low	48.4	Very low	130 Å²	130	125.2 Å²	125.2	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-61	-46.6	172.3	-72.5	178.3	-179.8	-179.8	0	111	G629 T630 P631 T636 R637 A638	G629-K634 WeakPolarHBondContact O-CE 3.42Å; T630-K634 WeakPolarHBondContact O-CG 3.46Å; T630-K634 PolarHBondContact O-N 2.89Å; P631-K634 PolarHBondContact O-N 3.36Å; K634-T636 VanDerWaalsContact C-N 3.33Å; K634-T636 PolarHBondContact O-N 2.88Å; K634-R637 PolarHBondContact O-N 3.02Å; K634-A638 WeakPolarHBondContact O-CB 3.44Å; K634-A638 PolarHBondContact O-N 2.94Å
635	Q	58	Low	49.1	Very low	120 Å²	120	121.2 Å²	121.2	56%	0.561	61%	0.613	S	S	*	*	H	α-helix	trans	-62.5	-38.9	176	-166	67.5	4.1	0	0	112.2	P631 E632 N639	P631-Q635 WeakPolarHBondContact O-CB 3.48Å; P631-Q635 PolarHBondContact O-N 3.46Å; E632-Q635 PolarHBondContact O-N 3.32Å; Q635-N639 WeakPolarHBondContact O-CB 3.2Å; Q635-N639 VanDerWaalsContact O-CG 3.25Å; Q635-N639 PolarHBondContact O-N 3.28Å; Q635-N639 PolarHBondContact O-ND2 3.5Å
636	T	66	Low	49.5	Very low	72 Å²	72	122.6 Å²	122.6	44%	0.442	61%	0.607	S	S	.	*	H	α-helix	trans	-70.2	-43.8	178.8	-59.8	0	0	0	0	111.7	E632 E633 K634 A638 N639 F640	E632-T636 VanDerWaalsContact O-CB 3.27Å; E632-T636 WeakPolarHBondContact O-CB 3.31Å; E632-T636 PolarHBondContact O-N 3.06Å; E632-T636 PolarHBondContact O-OG1 3.23Å; E633-T636 PolarHBondContact O-N 3.02Å; K634-T636 VanDerWaalsContact C-N 3.33Å; K634-T636 PolarHBondContact O-N 2.88Å; T636-A638 VanDerWaalsContact C-N 3.33Å; T636-A638 PolarHBondContact O-N 2.97Å; T636-N639 PolarHBondContact O-N 2.9Å; T636-F640 HydrophobicContact CG2-CD2 3.98Å; T636-F640 HydrophobicContact CG2-CE2 3.99Å; T636-F640 WeakPolarHBondContact O-CD2 3.14Å; T636-F640 PolarHBondContact O-N 3.25Å
637	R	52.1	Low	49.7	Very low	195 Å²	195	123.2 Å²	123.2	74%	0.736	61%	0.605	S	S	*	*	H	α-helix	trans	-64.7	-37	175.6	-165.5	169.3	-179.9	170.2	-2.5	111.3	E633 K634 R641	E633-R637 VanDerWaalsContact O-CB 3.31Å; E633-R637 WeakPolarHBondContact O-CB 3.23Å; E633-R637 PolarHBondContact O-N 3.18Å; K634-R637 PolarHBondContact O-N 3.02Å; R637-R641 PolarHBondContact O-N 3.21Å
638	A	49.6	Very low	50.2	Low	44 Å²	44	125.4 Å²	125.4	36%	0.364	60%	0.6	S	S	.	*	H	α-helix	trans	-62.5	-49.6	169.9	0	0	0	0	0	111.7	K634 T636 F640 R641 T642	K634-A638 WeakPolarHBondContact O-CB 3.44Å; K634-A638 PolarHBondContact O-N 2.94Å; T636-A638 VanDerWaalsContact C-N 3.33Å; T636-A638 PolarHBondContact O-N 2.97Å; A638-F640 VanDerWaalsContact C-N 3.31Å; A638-F640 PolarHBondContact O-N 3.35Å; A638-R641 WeakPolarHBondContact O-CB 3.33Å; A638-R641 PolarHBondContact O-N 2.99Å; A638-T642 PolarHBondContact O-N 3.02Å; A638-T642 PolarHBondContact O-OG1 3.43Å; A638-T642 VanDerWaalsContact O-OG1 3.12Å
639	N	58.7	Low	50.5	Low	93 Å²	93	127.3 Å²	127.3	50%	0.497	60%	0.596	S	S	.	*	H	α-helix	trans	-57	-41	176.9	-78.4	-29.6	0	0	0	112.6	Q635 T636 R643	Q635-N639 WeakPolarHBondContact O-CB 3.2Å; Q635-N639 VanDerWaalsContact O-CG 3.25Å; Q635-N639 PolarHBondContact O-N 3.28Å; Q635-N639 PolarHBondContact O-ND2 3.5Å; T636-N639 PolarHBondContact O-N 2.9Å; N639-R643 VanDerWaalsContact O-CB 3.31Å; N639-R643 WeakPolarHBondContact O-CB 3.45Å; N639-R643 PolarHBondContact O-N 3.23Å
640	F	49.8	Very low	50	Low	141 Å²	141	134.3 Å²	134.3	62%	0.618	62%	0.618	S	S	*	*	H	α-helix	trans	-65.7	-39.8	173.2	-88.6	-76.3	0	0	0	113	T636 A638 R643 R644	T636-F640 HydrophobicContact CG2-CD2 3.98Å; T636-F640 HydrophobicContact CG2-CE2 3.99Å; T636-F640 WeakPolarHBondContact O-CD2 3.14Å; T636-F640 PolarHBondContact O-N 3.25Å; A638-F640 VanDerWaalsContact C-N 3.31Å; A638-F640 PolarHBondContact O-N 3.35Å; F640-R643 PolarHBondContact O-N 3.45Å; F640-R644 WeakPolarHBondContact O-CB 3.18Å; F640-R644 PolarHBondContact O-N 2.67Å
641	R	47.9	Very low	49	Very low	203 Å²	203	135.1 Å²	135.1	77%	0.766	63%	0.626	S	S	*	*	H	α-helix	trans	-61.7	-47.7	174.5	-129	173.8	178.1	170.6	-3.1	110.7	R637 A638 R643 R644 M645	R637-R641 PolarHBondContact O-N 3.21Å; A638-R641 WeakPolarHBondContact O-CB 3.33Å; A638-R641 PolarHBondContact O-N 2.99Å; R641-R643 PolarHBondContact O-N 2.85Å; R641-R644 PolarHBondContact O-N 3.4Å; R641-M645 PolarHBondContact O-N 2.8Å
642	T	53.8	Low	48.4	Very low	74 Å²	74	139.8 Å²	139.8	45%	0.454	63%	0.631	S	S	.	*	H	α-helix	trans	-64.1	-36.7	176.8	-53.9	0	0	0	0	112.6	A638 M645 R646	A638-T642 PolarHBondContact O-N 3.02Å; A638-T642 PolarHBondContact O-OG1 3.43Å; A638-T642 VanDerWaalsContact O-OG1 3.12Å; T642-M645 PolarHBondContact O-N 2.82Å; T642-R646 WeakPolarHBondContact O-CB 3.37Å; T642-R646 PolarHBondContact O-N 2.77Å
643	R	50	Low	47.3	Very low	177 Å²	177	137.3 Å²	137.3	67%	0.668	63%	0.63	S	S	*	*	H	α-helix	trans	-67.8	-36.4	174.6	-153.2	174.7	-155.3	175.1	6.4	111.7	N639 F640 R641 L647	N639-R643 VanDerWaalsContact O-CB 3.31Å; N639-R643 WeakPolarHBondContact O-CB 3.45Å; N639-R643 PolarHBondContact O-N 3.23Å; F640-R643 PolarHBondContact O-N 3.45Å; R641-R643 PolarHBondContact O-N 2.85Å; R643-L647 WeakPolarHBondContact O-CG 3.33Å; R643-L647 PolarHBondContact O-N 2.78Å
644	R	45.6	Very low	46.3	Very low	200 Å²	200	138.3 Å²	138.3	76%	0.755	64%	0.644	S	S	*	*	H	α-helix	trans	-71.7	-36.5	175.6	-162.9	170.5	-175.1	169.1	-0.6	112.5	F640 R641 L647 K648	F640-R644 WeakPolarHBondContact O-CB 3.18Å; F640-R644 PolarHBondContact O-N 2.67Å; R641-R644 PolarHBondContact O-N 3.4Å; R644-L647 PolarHBondContact O-N 3.46Å; R644-K648 PolarHBondContact O-N 2.84Å
645	M	42.5	Very low	45.3	Very low	127 Å²	127	141.6 Å²	141.6	63%	0.626	66%	0.661	S	S	*	*	H	α-helix	trans	-62.7	-49.7	169.1	-71.9	-60.9	-139.5	0	0	111.5	R641 T642 L647 K648 Q649	R641-M645 PolarHBondContact O-N 2.8Å; T642-M645 PolarHBondContact O-N 2.82Å; M645-L647 PolarHBondContact O-N 3.3Å; M645-K648 PolarHBondContact O-N 2.74Å; M645-Q649 PolarHBondContact O-N 2.8Å
646	R	46.2	Very low	44	Very low	175 Å²	175	144.5 Å²	144.5	66%	0.66	68%	0.675	S	S	*	*	H	α-helix	trans	-62.9	-20.6	177.1	-83	-178.9	157	168.9	-6	114.4	T642 K650	T642-R646 WeakPolarHBondContact O-CB 3.37Å; T642-R646 PolarHBondContact O-N 2.77Å; R646-K650 WeakPolarHBondContact O-CB 3.5Å; R646-K650 WeakPolarHBondContact O-CG 3.33Å; R646-K650 PolarHBondContact O-N 2.89Å
647	L	44.4	Very low	42.5	Very low	126 Å²	126	146.3 Å²	146.3	66%	0.66	69%	0.691	S	S	*	*	H	α-helix	trans	-81.3	-33.2	170.8	-82.7	161.6	0	0	0	112.9	R643 R644 M645	R643-L647 WeakPolarHBondContact O-CG 3.33Å; R643-L647 PolarHBondContact O-N 2.78Å; R644-L647 PolarHBondContact O-N 3.46Å; M645-L647 PolarHBondContact O-N 3.3Å
648	K	43.3	Very low	41.5	Very low	162 Å²	162	142.9 Å²	142.9	70%	0.704	69%	0.694	S	S	*	*	H	α-helix	trans	-73.5	-33.2	171.1	-82.1	-165.5	168.5	-166.7	0	113.4	R644 M645 K650 S651	R644-K648 PolarHBondContact O-N 2.84Å; M645-K648 PolarHBondContact O-N 2.74Å; K648-K650 VanDerWaalsContact C-N 3.29Å; K648-K650 PolarHBondContact O-N 2.62Å; K648-S651 PolarHBondContact O-OG 2.65Å; K648-S651 VanDerWaalsContact O-OG 3.1Å
649	Q	43.2	Very low	40.9	Very low	154 Å²	154	147.4 Å²	147.4	72%	0.72	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-10.5	175.3	-74.9	-179.4	-43	0	0	113.9	M645	M645-Q649 PolarHBondContact O-N 2.8Å
650	K	36.1	Very low	39.7	Very low	181 Å²	181	151.7 Å²	151.7	79%	0.787	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	2	176.1	-85	-163.9	167.7	-158.7	0	115	R646 K648	R646-K650 WeakPolarHBondContact O-CB 3.5Å; R646-K650 WeakPolarHBondContact O-CG 3.33Å; R646-K650 PolarHBondContact O-N 2.89Å; K648-K650 VanDerWaalsContact C-N 3.29Å; K648-K650 PolarHBondContact O-N 2.62Å
651	S	36.5	Very low	38.7	Very low	83 Å²	83	149.5 Å²	149.5	58%	0.58	74%	0.735	S	S	*	*	S	Bend	trans	-105.3	20.7	176.7	57	0	0	0	0	113.7	K648	K648-S651 PolarHBondContact O-OG 2.65Å; K648-S651 VanDerWaalsContact O-OG 3.1Å
652	Y	33	Very low	38.1	Very low	209 Å²	209	145.4 Å²	145.4	82%	0.82	74%	0.738	S	S	*	*	S	Bend	trans	-138.6	59.1	174.5	-94.2	-83.8	0	0	0	110.8
653	S	30.8	Very low	36.9	Very low	105 Å²	105	152.4 Å²	152.4	73%	0.734	76%	0.758	S	S	*	*	S	Bend	trans	-165.2	145.9	167.5	-80.3	0	0	0	0	110.6
654	V	31	Very low	36.1	Very low	133 Å²	133	148.3 Å²	148.3	81%	0.806	76%	0.762	S	S	*	*			trans	65.4	89	174.2	-165.7	0	0	0	0	116.2
655	E	33.1	Very low	35.5	Very low	199 Å²	199	147.2 Å²	147.2	93%	0.93	77%	0.765	S	S	*	*				-126.6	82.5	129.9	-79.8	-160.4	158.3	0	0	108.9
656	Q	30.5	Very low	35.4	Very low	182 Å²	182	150.9 Å²	150.9	85%	0.85	78%	0.781	S	S	*	*			trans	-113.4	110.6	154.2	-81.3	-174.7	-17.7	0	0	106.4	P658	Q656-P658 WeakPolarHBondContact O-CD 3.23Å
657	S	34.6	Very low	34.9	Very low	110 Å²	110	147.7 Å²	147.7	77%	0.769	79%	0.792	S	S	*	*			trans	-102.5	109.4	178.1	40.8	0	0	0	0	110.3
658	P	31	Very low	34.4	Very low	123 Å²	123	145.2 Å²	145.2	80%	0.799	80%	0.797	S	S	*	*			trans	-75.7	134.6	163.4	31.8	-31.3	0	0	0	109	Q656	Q656-P658 WeakPolarHBondContact O-CD 3.23Å
659	V	36.2	Very low	34.1	Very low	139 Å²	139	143.1 Å²	143.1	84%	0.842	80%	0.8	S	S	*	*			trans	-131.7	134.3	164.7	-179.4	0	0	0	0	107.3
660	E	33.4	Very low	33.8	Very low	182 Å²	182	142.9 Å²	142.9	85%	0.85	80%	0.803	S	S	*	*			trans	-86.8	162.4	-159.5	-66.2	167.8	113	0	0	114.3
661	S	29.8	Very low	33.8	Very low	95 Å²	95	141.3 Å²	141.3	66%	0.664	80%	0.803	S	S	*	*			trans	-49.7	134.1	170.9	139.5	0	0	0	0	113	Y663	S661-Y663 WeakPolarHBondContact OG-CD2 3.3Å
662	S	34.3	Very low	33.7	Very low	118 Å²	118	142.7 Å²	142.7	83%	0.825	81%	0.807	S	S	*	*			trans	-134.5	130.5	141.8	44.2	0	0	0	0	109.8
663	Y	30.3	Very low	33.9	Very low	220 Å²	220	139 Å²	139	86%	0.863	81%	0.806	S	S	*	*			trans	-87.3	145	177.5	-74.7	-120.1	0	0	0	109.8	S661	S661-Y663 WeakPolarHBondContact OG-CD2 3.3Å
664	A	32.6	Very low	34.2	Very low	92 Å²	92	141.4 Å²	141.4	76%	0.76	81%	0.806	S	S	*	*				-177.2	125.9	125	0	0	0	0	0	112.6
665	E	33.3	Very low	34.5	Very low	176 Å²	176	142.1 Å²	142.1	82%	0.822	81%	0.805	S	S	*	*			trans	32.9	115.3	138	-53.4	-172.8	150	0	0	120.9
666	H	39.9	Very low	34.7	Very low	205 Å²	205	140.9 Å²	140.9	95%	0.949	80%	0.8	S	S	*	*				-150.4	136.6	105.5	-95.8	-52.8	0	0	0	110.3
667	A	34.6	Very low	35.1	Very low	108 Å²	108	137 Å²	137	89%	0.893	79%	0.79	S	S	*	*			trans	-110.3	150.5	-170.3	0	0	0	0	0	113.4
668	G	34	Very low	35.3	Very low	74 Å²	74	137.8 Å²	137.8	76%	0.763	79%	0.793	S	S	*	*			trans	-179.7	96.5	176.5	0	0	0	0	0	110.9
669	P	38.9	Very low	35.5	Very low	118 Å²	118	138.1 Å²	138.1	77%	0.766	79%	0.792	S	S	*	*			trans	-104.4	-165.6	-161.2	40.1	-37	0	0	0	115.1
670	L	36.3	Very low	35.3	Very low	149 Å²	149	137.1 Å²	137.1	78%	0.78	79%	0.786	S	S	*	*			trans	89.7	128	177.3	-48.6	172.7	0	0	0	114.1
671	N	36.2	Very low	35.2	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	79%	0.787	S	S	*	*			cis	-151.1	166.9	0.1	-113.2	-13.3	0	0	0	113
672	V	33	Very low	35.4	Very low	112 Å²	112	141.6 Å²	141.6	68%	0.679	79%	0.788	S	S	*	*			trans	-107.5	140.6	-166.2	174.1	0	0	0	0	113.9	E674	V672-E674 HydrophobicContact CG1-CG 4.2Å
673	V	38.7	Very low	35.3	Very low	131 Å²	131	141.7 Å²	141.7	79%	0.794	78%	0.779	S	S	*	*			trans	-161.4	113.9	137.8	-161.1	0	0	0	0	104.4
674	E	36.7	Very low	35.4	Very low	155 Å²	155	140.2 Å²	140.2	72%	0.724	77%	0.773	S	S	*	*				58.3	131.6	76.8	-65.7	168.6	177.4	0	0	112.4	V672	V672-E674 HydrophobicContact CG1-CG 4.2Å
675	D	37.9	Very low	35.6	Very low	148 Å²	148	143.9 Å²	143.9	79%	0.791	77%	0.769	S	S	*	*			cis	-158.2	-176.3	15.2	-140.9	-21.1	0	0	0	113.7
676	E	37.3	Very low	35.4	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.813	76%	0.762	S	S	*	*			trans	79.3	133	167.2	-75.9	-84.9	92.8	0	0	121.5
677	P	38.1	Very low	35	Very low	99 Å²	99	140.1 Å²	140.1	64%	0.643	75%	0.752	S	S	*	*			trans	-111.7	170.5	-176.5	42.6	-35.9	0	0	0	116.5
678	P	37.9	Very low	34.8	Very low	128 Å²	128	146.4 Å²	146.4	83%	0.831	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-87.4	147.2	-179.7	34.5	-35.5	0	0	0	115.1
679	V	35.8	Very low	34.4	Very low	129 Å²	129	154.2 Å²	154.2	78%	0.782	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-101.4	139.8	-179.8	176.2	0	0	0	0	112.4	Y681	V679-Y681 HydrophobicContact CG1-CD2 4.16Å
680	V	31.7	Very low	34.3	Very low	118 Å²	118	154 Å²	154	72%	0.715	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-100.4	145.1	172.5	176	0	0	0	0	110
681	Y	32.5	Very low	34.1	Very low	225 Å²	225	150.4 Å²	150.4	88%	0.882	75%	0.749	S	S	*	*			trans	-139.9	141.5	162.4	-110.2	-83.9	0	0	0	112.1	V679	V679-Y681 HydrophobicContact CG1-CD2 4.16Å
682	H	33.4	Very low	33.8	Very low	147 Å²	147	149 Å²	149	68%	0.681	74%	0.738	S	S	*	*			trans	-113.1	141.8	179.3	-114.3	-87	0	0	0	110.4
683	D	32.4	Very low	33.7	Very low	120 Å²	120	150 Å²	150	64%	0.642	74%	0.739	S	S	*	*			trans	45.6	157.6	148.7	-62.6	-38.6	0	0	0	124.6
684	Y	32.4	Very low	33.3	Very low	188 Å²	188	150.3 Å²	150.3	74%	0.737	73%	0.732	S	S	*	*			trans	114.6	138.2	138.2	-83.8	-65.9	0	0	0	122.3
685	Y	35.8	Very low	33.1	Very low	169 Å²	169	154 Å²	154	66%	0.663	74%	0.741	S	S	*	*			trans	60	98.9	156.6	-70.9	-64.5	0	0	0	122.8
686	Q	30.8	Very low	32.8	Very low	145 Å²	145	154 Å²	154	68%	0.678	74%	0.741	S	S	*	*				52	130.2	113.5	-69.8	-173.5	8.8	0	0	122.7
687	Q	30.9	Very low	32.7	Very low	158 Å²	158	153.1 Å²	153.1	74%	0.738	74%	0.741	S	S	*	*			trans	58.5	105.4	139.5	-60.9	-177	33.7	0	0	120.5
688	R	30.4	Very low	32.3	Very low	240 Å²	240	153.2 Å²	153.2	91%	0.906	75%	0.745	S	S	*	*				-174.7	149	104.1	-101.1	169.8	173.2	-170.9	-3.3	113.9
689	W	26.4	Very low	32.2	Very low	238 Å²	238	151 Å²	151	90%	0.902	74%	0.737	S	S	*	*			trans	-86.6	173.7	164.1	-86.8	66.1	0	0	0	109.6
690	P	35.1	Very low	32.3	Very low	112 Å²	112	152.4 Å²	152.4	73%	0.727	74%	0.74	S	S	*	*			cis	-146.4	-172.7	21.1	44.9	-25.1	0	0	0	118.5
691	A	33.2	Very low	32.5	Very low	75 Å²	75	157.6 Å²	157.6	62%	0.62	75%	0.748	S	S	*	*			trans	84.6	109	139.7	0	0	0	0	0	123.1
692	Q	29.4	Very low	32.9	Very low	117 Å²	117	152.7 Å²	152.7	55%	0.547	74%	0.744	S	S	.	*				44.3	108.8	126.9	-60.7	-177.5	2	0	0	121.4
693	N	32.1	Very low	33	Very low	133 Å²	133	152 Å²	152	71%	0.711	74%	0.741	S	S	*	*				178.9	128.6	110	-82.4	-13.7	0	0	0	107.3
694	E	28.5	Very low	33.2	Very low	138 Å²	138	155.6 Å²	155.6	65%	0.645	75%	0.752	S	S	*	*				73.7	97.7	58.1	-164.7	162.7	-97.8	0	0	112.6	R810	E694-R810 IonicContact OE1-CZ 2.7Å; E694-R810 IonicContact OE1-NH2 3.08Å; E694-R810 PolarHBondContact OE1-NH2 2.82Å; E694-R810 IonicContact OE2-NH2 3.66Å; E694-R810 PolarHBondContact OE2-NH2 2.69Å
695	Y	34	Very low	33.4	Very low	232 Å²	232	155.4 Å²	155.4	91%	0.91	75%	0.75	S	S	*	*			trans	-168.4	158.6	147.8	-101.6	-61.4	0	0	0	111.8
696	D	30.8	Very low	33.3	Very low	148 Å²	148	150.7 Å²	150.7	79%	0.791	75%	0.752	S	S	*	*			trans	-89.8	-170.7	-170.9	-85.7	-64.7	0	0	0	115.1
697	L	35.2	Very low	33.7	Very low	156 Å²	156	151.2 Å²	151.2	82%	0.817	76%	0.757	S	S	*	*			trans	86.7	120.8	167.3	-50.1	165.2	0	0	0	113.7
698	S	30.7	Very low	33.9	Very low	102 Å²	102	147.3 Å²	147.3	71%	0.713	74%	0.735	S	S	*	*			cis	83.1	148.4	37	88.7	0	0	0	0	115
699	A	35.7	Very low	34.3	Very low	82 Å²	82	140.4 Å²	140.4	68%	0.678	71%	0.713	S	S	*	*			trans	84.8	108.2	174.7	0	0	0	0	0	118.3
700	D	36.4	Very low	34.7	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	70%	0.704	S	S	*	*				68.5	144.9	122.9	-55.7	-30.8	0	0	0	124.5
701	Y	36.8	Very low	34.7	Very low	227 Å²	227	136.9 Å²	136.9	89%	0.89	70%	0.702	S	S	*	*			trans	-67.9	167.4	166.6	-76.3	-105.3	0	0	0	111.9
702	P	40.1	Very low	34.8	Very low	123 Å²	123	142 Å²	142	80%	0.799	71%	0.713	S	S	*	*				-136.9	165.5	114.4	34.7	-23.2	0	0	0	116.6
703	E	36.3	Very low	35.3	Very low	131 Å²	131	140.8 Å²	140.8	61%	0.612	72%	0.715	S	S	*	*			trans	-61.8	161.9	172.9	-38.8	178.6	146.1	0	0	113.4	R705	E703-R705 IonicContact OE2-CZ 3.42Å; E703-R705 IonicContact OE2-NE 3.41Å; E703-R705 PolarHBondContact OE2-NE 2.84Å; E703-R705 IonicContact OE2-NH2 3Å; E703-R705 PolarHBondContact OE2-NH2 3.1Å
704	F	36.3	Very low	35.2	Very low	197 Å²	197	142.4 Å²	142.4	86%	0.864	72%	0.719	S	S	*	*				-162.9	106.7	121	-111.8	-81.6	0	0	0	108.4
705	R	36.3	Very low	35.3	Very low	184 Å²	184	139.7 Å²	139.7	69%	0.694	72%	0.715	S	S	*	*			cis	93.9	106.3	46.5	-178.8	-168.6	-83.6	-143.7	-2.2	113	E703	E703-R705 IonicContact OE2-CZ 3.42Å; E703-R705 IonicContact OE2-NE 3.41Å; E703-R705 PolarHBondContact OE2-NE 2.84Å; E703-R705 IonicContact OE2-NH2 3Å; E703-R705 PolarHBondContact OE2-NH2 3.1Å
706	G	34.1	Very low	35.2	Very low	69 Å²	69	139.4 Å²	139.4	71%	0.711	71%	0.712	S	S	*	*			trans	162.6	91.6	164.9	0	0	0	0	0	114
707	M	38.9	Very low	35.3	Very low	157 Å²	157	136.5 Å²	136.5	77%	0.773	70%	0.703	S	S	*	*				71.3	129.7	79.5	-71.8	-80.5	174.8	0	0	114.2
708	R	34.8	Very low	35.2	Very low	76 Å²	76	136.2 Å²	136.2	29%	0.287	70%	0.703	S	S	.	*			cis	-173.6	122.3	5.5	177.9	176.9	169.9	170.2	-0.6	113.8	H1006 A1007 S1009 D1010	R708-H1006 PolarHBondContact N-NE2 2.83Å; R708-H1006 VanDerWaalsContact N-NE2 3.13Å; R708-H1006 VanDerWaalsContact O-CG 3.3Å; R708-H1006 PolarHBondContact O-ND1 3.17Å; R708-A1007 PolarHBondContact O-N 3.08Å; R708-S1009 VanDerWaalsContact NH2-N 3.11Å; R708-D1010 IonicContact NH2-OD2 3.31Å; R708-D1010 PolarHBondContact NH2-OD2 2.79Å
709	Q	38.4	Very low	35.4	Very low	94 Å²	94	135.6 Å²	135.6	44%	0.439	70%	0.698	S	S	.	*			trans	65	167.8	149.5	-72.8	175.8	-21.1	0	0	118.3	H1006 A1007	Q709-H1006 CarbonylContact O-C 3.53Å; Q709-H1006 VanDerWaalsContact O-CA 3.3Å; Q709-H1006 WeakPolarHBondContact O-CA 3.32Å; Q709-H1006 PolarHBondContact O-ND1 3.45Å; Q709-A1007 PolarHBondContact O-N 3.35Å; Q709-A1007 VanDerWaalsContact O-N 3.14Å
710	K	36.6	Very low	35.5	Very low	163 Å²	163	139.8 Å²	139.8	71%	0.709	70%	0.704	S	S	*	*			cis	-178.4	148.9	-21.6	-176.8	-170.9	-179.5	-167.4	0	103.3
711	V	34.5	Very low	35.2	Very low	114 Å²	114	137.7 Å²	137.7	69%	0.691	70%	0.697	S	S	*	*				168.3	115.5	96.3	163	0	0	0	0	106.1
712	E	35.9	Very low	35.1	Very low	181 Å²	181	136 Å²	136	85%	0.846	69%	0.69	S	S	*	*			trans	-77.4	154.9	151.7	-149.5	-172.3	-165.2	0	0	107.1
713	P	38.4	Very low	34.7	Very low	92 Å²	92	139.2 Å²	139.2	60%	0.597	69%	0.686	S	S	*	*				-157.3	167.5	93.8	42.4	-24.5	0	0	0	116.6
714	E	31.6	Very low	34.5	Very low	168 Å²	168	137.4 Å²	137.4	79%	0.785	69%	0.688	S	S	*	*			trans	54.1	157	135.4	-73	175.1	-132	0	0	122.5
715	S	30	Very low	34.5	Very low	80 Å²	80	135.9 Å²	135.9	56%	0.559	68%	0.684	S	S	*	*			cis	-178.5	-169.8	-27.9	63.1	0	0	0	0	106.9
716	R	32.2	Very low	34.3	Very low	227 Å²	227	133.8 Å²	133.8	86%	0.857	68%	0.682	S	S	*	*			trans	78.8	145.4	173.2	-56.6	178.3	179.8	-167.8	-1.6	115.6
717	S	31.6	Very low	34.3	Very low	86 Å²	86	140.8 Å²	140.8	60%	0.601	69%	0.688	S	S	*	*			cis	-170.3	171.5	-13.1	46.8	0	0	0	0	111
718	N	34.5	Very low	33.9	Very low	151 Å²	151	136.9 Å²	136.9	81%	0.807	68%	0.681	S	S	*	*			trans	75.8	148.1	166.8	-50.9	-27.6	0	0	0	114.8
719	S	34.6	Very low	33.9	Very low	89 Å²	89	140.5 Å²	140.5	62%	0.622	71%	0.711	S	S	*	*			cis	-161.6	169.6	-18	48.4	0	0	0	0	107.1
720	Q	36.8	Very low	33.5	Very low	170 Å²	170	143.2 Å²	143.2	79%	0.794	73%	0.729	S	S	*	*			cis	-154.9	148.5	22.5	-135.7	129.2	-6.3	0	0	111.9
721	T	31.5	Very low	33.7	Very low	113 Å²	113	139.6 Å²	139.6	69%	0.693	72%	0.722	S	S	*	*			trans	-33.3	146.1	164.4	46.9	0	0	0	0	118.9
722	Y	33.5	Very low	33.5	Very low	192 Å²	192	144.4 Å²	144.4	75%	0.753	73%	0.728	S	S	*	*				-159.5	109.3	106.2	-121.5	-112.4	0	0	0	109.1
723	R	31.7	Very low	33.4	Very low	189 Å²	189	145 Å²	145	71%	0.713	72%	0.722	S	S	*	*				89.8	87	76.5	-168.5	179.2	-165	166.3	4.4	112.4
724	S	32.7	Very low	33.3	Very low	93 Å²	93	146.7 Å²	146.7	65%	0.65	72%	0.722	S	S	*	*				96.1	154.7	102.3	-145.9	0	0	0	0	111.8
725	Q	36.3	Very low	33.3	Very low	166 Å²	166	150 Å²	150	78%	0.776	73%	0.727	S	S	*	*			cis	-140.3	167.7	22.9	-74.4	177.6	-6.9	0	0	114.6
726	H	31.4	Very low	33.4	Very low	140 Å²	140	155.3 Å²	155.3	65%	0.648	74%	0.735	S	S	*	*			trans	-19.3	156.8	156.1	-47.3	-82.5	0	0	0	117.6
727	Y	34.2	Very low	33.4	Very low	216 Å²	216	150.7 Å²	150.7	85%	0.847	72%	0.723	S	S	*	*			cis	-136.7	153.6	31.5	-62.3	-103.1	0	0	0	110.7
728	A	31.7	Very low	33.6	Very low	75 Å²	75	154.6 Å²	154.6	62%	0.62	73%	0.731	S	S	*	*			cis	78.3	76.1	33.9	0	0	0	0	0	115.8
729	T	34	Very low	33.3	Very low	151 Å²	151	155.7 Å²	155.7	93%	0.926	73%	0.732	S	S	*	*				-169.6	135	128.2	17.5	0	0	0	0	113.1
730	N	30.6	Very low	33.1	Very low	152 Å²	152	162.3 Å²	162.3	81%	0.813	75%	0.745	S	S	*	*			trans	-113.5	179.7	160.3	-142.4	-13	0	0	0	104.6
731	P	39.8	Very low	33	Very low	86 Å²	86	158.2 Å²	158.2	56%	0.558	74%	0.74	S	S	*	*			cis	-139.2	-164.4	-10.6	35.3	-12.2	0	0	0	114.4
732	R	30.2	Very low	32.9	Very low	215 Å²	215	160 Å²	160	81%	0.811	75%	0.745	S	S	*	*			trans	81.7	151.2	160.1	-62.2	163.4	178.8	176.3	0.6	115.7
733	R	33.9	Very low	32.9	Very low	193 Å²	193	159.9 Å²	159.9	73%	0.728	75%	0.752	S	S	*	*			cis	-157.2	160.1	10.6	-142.3	170	-172.5	-163	5.8	115.2
734	H	36.9	Very low	32.8	Very low	128 Å²	128	155.1 Å²	155.1	59%	0.593	75%	0.753	S	S	*	*			trans	77.1	147.9	171.6	-63.3	-70	0	0	0	116.5
735	R	31.1	Very low	32.8	Very low	239 Å²	239	160.8 Å²	160.8	90%	0.902	76%	0.761	S	S	*	*			cis	56.5	99.7	-9.7	-168.1	-179.3	177.8	176.4	0.1	120.5
736	R	32.1	Very low	32.6	Very low	190 Å²	190	157.6 Å²	157.6	72%	0.717	76%	0.757	S	S	*	*			trans	-179	151.3	142.9	-97.5	176.2	169.1	-118.8	-3.5	106.5
737	E	32.1	Very low	32.6	Very low	131 Å²	131	159.1 Å²	159.1	61%	0.612	77%	0.765	S	S	*	*			cis	-145.9	164.4	2.5	-148.6	105.2	-132.4	0	0	109.6
738	H	35	Very low	33	Very low	167 Å²	167	155 Å²	155	77%	0.773	77%	0.765	S	S	*	*			trans	-96	-179.8	161.9	-107.1	-122.3	0	0	0	108.7
739	E	28.7	Very low	32.9	Very low	175 Å²	175	156.3 Å²	156.3	82%	0.818	77%	0.769	S	S	*	*			trans	75.8	158.5	162	-68.1	158.9	161.1	0	0	118.8
740	Y	31.7	Very low	33	Very low	228 Å²	228	155.7 Å²	155.7	89%	0.894	76%	0.764	S	S	*	*			trans	87.9	90.7	-162	-59	-62.7	0	0	0	113.9
741	A	33.6	Very low	33.2	Very low	83 Å²	83	151.9 Å²	151.9	69%	0.686	76%	0.762	S	S	*	*			cis	64.2	104.1	22.7	0	0	0	0	0	114.4
742	N	29.8	Very low	32.9	Very low	152 Å²	152	157.3 Å²	157.3	81%	0.813	78%	0.779	S	S	*	*			trans	32.9	109.7	161	-59.1	-7.6	0	0	0	119.4
743	Q	33.6	Very low	33	Very low	189 Å²	189	150.1 Å²	150.1	88%	0.883	77%	0.772	S	S	*	*				-168	156.7	121.6	-102.5	147.1	33.3	0	0	112.2
744	A	28.8	Very low	33	Very low	89 Å²	89	145.4 Å²	145.4	74%	0.736	78%	0.775	S	S	*	*			trans	-100	144.5	-174.7	0	0	0	0	0	112.4
745	Y	34.3	Very low	32.9	Very low	212 Å²	212	150 Å²	150	83%	0.831	79%	0.787	S	S	*	*			trans	-140.1	95.6	159.9	-77	-83.9	0	0	0	106.2
746	S	31.6	Very low	33	Very low	99 Å²	99	145.8 Å²	145.8	69%	0.692	78%	0.781	S	S	*	*				84.6	114.6	73.1	69.2	0	0	0	0	112.2
747	E	30.7	Very low	33.1	Very low	172 Å²	172	143 Å²	143	80%	0.804	78%	0.784	S	S	*	*			trans	-66.6	155.3	176.9	-55.7	179.2	132.2	0	0	112.7	S749	E747-S749 PolarHBondContact O-N 3.48Å
748	P	42.4	Very low	33.1	Very low	130 Å²	130	144.1 Å²	144.1	84%	0.844	80%	0.795	S	S	*	*			trans	-84.5	86.2	158.9	34	-30.2	0	0	0	110.4	V750	P748-V750 PolarHBondContact O-N 3.33Å
749	S	29.9	Very low	33.2	Very low	102 Å²	102	143.5 Å²	143.5	71%	0.713	79%	0.792	S	S	*	*			trans	-83.3	103.7	175.9	62	0	0	0	0	112.4	E747	E747-S749 PolarHBondContact O-N 3.48Å
750	V	37	Very low	33.5	Very low	137 Å²	137	145.1 Å²	145.1	83%	0.83	79%	0.791	S	S	*	*			trans	-142.6	114.9	161.4	-170.8	0	0	0	0	104.1	P748	P748-V750 PolarHBondContact O-N 3.33Å
751	G	34.8	Very low	33.4	Very low	73 Å²	73	146.4 Å²	146.4	75%	0.753	79%	0.794	S	S	*	*			cis	89.7	133.5	49.5	0	0	0	0	0	108.5
752	E	32.5	Very low	33.5	Very low	199 Å²	199	146 Å²	146	93%	0.93	80%	0.798	S	S	*	*			cis	-164.7	157.6	-5.9	-174.6	176.4	-164.5	0	0	106.9
753	G	32.9	Very low	33.6	Very low	65 Å²	65	143.5 Å²	143.5	67%	0.67	80%	0.798	S	S	*	*			trans	89.7	130.5	178.8	0	0	0	0	0	114.5
754	A	34.2	Very low	33.5	Very low	94 Å²	94	144.2 Å²	144.2	78%	0.777	80%	0.798	S	S	*	*				83.3	129.2	74.5	0	0	0	0	0	112.6
755	R	34.6	Very low	33.7	Very low	224 Å²	224	144 Å²	144	85%	0.845	80%	0.797	S	S	*	*			cis	-156.1	146.3	2.6	-110.6	166.7	-177.5	167.1	0.1	110.7
756	I	31.7	Very low	33.7	Very low	150 Å²	150	140.9 Å²	140.9	77%	0.769	79%	0.794	S	S	*	*			trans	15.6	124.1	135.3	-40.2	169.6	0	0	0	117.6
757	V	36	Very low	33.9	Very low	132 Å²	132	141 Å²	141	80%	0.8	79%	0.791	S	S	*	*				179.7	137.5	117.5	150.3	0	0	0	0	110.6
758	N	30.5	Very low	34.2	Very low	154 Å²	154	139.4 Å²	139.4	82%	0.824	79%	0.787	S	S	*	*			trans	-92.4	141.1	171.1	-62.5	-67.7	0	0	0	110.7
759	E	37.5	Very low	33.8	Very low	154 Å²	154	144.1 Å²	144.1	72%	0.72	79%	0.788	S	S	*	*			trans	-169.9	157.9	145.4	-88.5	-151.7	136	0	0	108.6
760	R	35.3	Very low	34.1	Very low	209 Å²	209	146.7 Å²	146.7	79%	0.789	79%	0.789	S	S	*	*			cis	-175.4	127.7	-31.4	-111.7	-179.3	-178.1	160.9	-11.3	104.9
761	R	30.4	Very low	34.1	Very low	255 Å²	255	145.9 Å²	145.9	96%	0.962	79%	0.786	S	S	*	*			trans	19.4	122.2	156.1	-63.4	-179.8	175.9	-174.4	-1.5	120.8
762	G	35	Very low	33.9	Very low	74 Å²	74	147.3 Å²	147.3	76%	0.763	78%	0.776	S	S	*	*			trans	172.4	101.6	153.5	0	0	0	0	0	110.6
763	A	31.3	Very low	33.9	Very low	100 Å²	100	149.1 Å²	149.1	83%	0.826	78%	0.776	S	S	*	*				81	117.8	51.5	0	0	0	0	0	114.7
764	K	32.2	Very low	33.9	Very low	204 Å²	204	153.7 Å²	153.7	89%	0.887	78%	0.78	S	S	*	*			trans	83.4	99	164.7	-61.1	-176.8	177.7	179.8	0	120.6
765	A	33.7	Very low	34	Very low	85 Å²	85	158 Å²	158	70%	0.702	78%	0.781	S	S	*	*				99.1	152.2	104.8	0	0	0	0	0	121.9
766	N	34.2	Very low	34.1	Very low	146 Å²	146	155 Å²	155	78%	0.781	78%	0.776	S	S	*	*			trans	74.8	140.8	148.1	-89.6	17.9	0	0	0	119.1
767	T	35.1	Very low	33.9	Very low	103 Å²	103	154.6 Å²	154.6	63%	0.632	78%	0.775	S	S	*	*			cis	-161.1	-174.2	-4.8	-10.3	0	0	0	0	111.7
768	L	36.5	Very low	33.8	Very low	137 Å²	137	157.2 Å²	157.2	72%	0.717	78%	0.779	S	S	*	*			trans	86.2	131.8	160.3	-56.6	119.8	0	0	0	116.7
769	R	34.7	Very low	33.8	Very low	229 Å²	229	160.7 Å²	160.7	86%	0.864	78%	0.781	S	S	*	*			cis	-154.6	148.2	-8.4	-135.8	177.9	-165	175.8	4.1	113.4
770	H	35.3	Very low	33.5	Very low	157 Å²	157	163.8 Å²	163.8	73%	0.727	79%	0.785	S	S	*	*			trans	-84	-178.9	168.2	-82.5	-60.2	0	0	0	111.5	I772	H770-I772 HydrophobicContact CB-CD1 4.08Å
771	P	36.9	Very low	33.4	Very low	119 Å²	119	162.3 Å²	162.3	77%	0.773	79%	0.787	S	S	*	*			cis	-127	169.7	21.2	25.3	0.8	0	0	0	115.7
772	I	32.1	Very low	33.3	Very low	103 Å²	103	155 Å²	155	53%	0.528	78%	0.781	S	S	.	*			cis	83.6	120.8	34.8	-56.1	165.7	0	0	0	115.1	H770 Q774	H770-I772 HydrophobicContact CB-CD1 4.08Å; I772-Q774 HydrophobicContact CG2-CB 4.45Å
773	Y	31.8	Very low	33.1	Very low	238 Å²	238	157 Å²	157	93%	0.933	78%	0.783	S	S	*	*			trans	-133.6	164	142.2	-113.7	-89.1	0	0	0	109.5
774	Q	33.2	Very low	33.1	Very low	161 Å²	161	161.5 Å²	161.5	75%	0.752	78%	0.784	S	S	*	*			trans	-152.7	174.5	-149.7	-153.6	-175.8	27.4	0	0	112.9	I772	I772-Q774 HydrophobicContact CG2-CB 4.45Å
775	K	36.2	Very low	33	Very low	183 Å²	183	160.1 Å²	160.1	80%	0.796	79%	0.786	S	S	*	*			trans	92.3	142	172.1	-62.5	-172.4	176.6	-176.7	0	115.8
776	H	37.1	Very low	32.7	Very low	162 Å²	162	159.8 Å²	159.8	75%	0.75	79%	0.79	S	S	*	*			cis	-152.5	166.8	-14	-152	-108.7	0	0	0	111.2
777	N	27.8	Very low	32.6	Very low	141 Å²	141	158.3 Å²	158.3	75%	0.754	79%	0.791	S	S	*	*			trans	-75.6	151.4	168.9	-73.7	-51.6	0	0	0	111.9
778	E	33.9	Very low	32.1	Very low	187 Å²	187	161.6 Å²	161.6	87%	0.874	81%	0.805	S	S	*	*				-161.7	163.1	114.6	-112.4	169.7	-141.1	0	0	116.4
779	R	29.1	Very low	31.8	Very low	228 Å²	228	160 Å²	160	86%	0.86	80%	0.802	S	S	*	*			trans	-87.5	144.9	-162.1	-55.6	151.8	159.7	175.8	-9	113.1
780	R	31.5	Very low	31.4	Very low	218 Å²	218	155.6 Å²	155.6	82%	0.823	80%	0.801	S	S	*	*				168.5	153.4	110.3	-97.8	173.7	174	167.7	-1	117
781	H	33.1	Very low	31.2	Very low	179 Å²	179	154.9 Å²	154.9	83%	0.829	80%	0.8	S	S	*	*			trans	59.3	124.9	157.7	-66.8	-62.3	0	0	0	122.4
782	A	27.7	Very low	30.7	Very low	100 Å²	100	159.8 Å²	159.8	83%	0.826	81%	0.805	S	S	*	*			trans	-101.1	149.5	-167.3	0	0	0	0	0	115.9
783	S	32.8	Very low	30.6	Very low	116 Å²	116	158.3 Å²	158.3	81%	0.811	81%	0.808	S	S	*	*			trans	-157	121.2	140	48	0	0	0	0	106.6
784	K	29.7	Very low	30.5	Very low	196 Å²	196	154.3 Å²	154.3	85%	0.852	80%	0.803	S	S	*	*			cis	84.7	81	48.8	-166.8	-178.3	-178.6	-179.8	0	113.5
785	L	30	Very low	30.3	Very low	174 Å²	174	151.5 Å²	151.5	91%	0.911	80%	0.801	S	S	*	*			trans	179.4	136.7	130.3	-97.5	163.2	0	0	0	112.9
786	G	28.7	Very low	30.1	Very low	78 Å²	78	149.8 Å²	149.8	80%	0.804	80%	0.799	S	S	*	*			trans	87	26.5	140.2	0	0	0	0	0	122.4
787	S	30.7	Very low	29.9	Very low	115 Å²	115	149.3 Å²	149.3	80%	0.804	80%	0.797	S	S	*	*			trans	-76.3	123.1	177.8	57.7	0	0	0	0	114.5
788	L	25.7	Very low	29.9	Very low	173 Å²	173	147.3 Å²	147.3	91%	0.906	79%	0.794	S	S	*	*			trans	-69.9	139.4	165	-67.8	164.8	0	0	0	111.6
789	P	29.7	Very low	29.8	Very low	103 Å²	103	145.1 Å²	145.1	67%	0.669	78%	0.784	S	S	*	*			trans	-113.2	129.8	162	34.9	-24.6	0	0	0	112.3
790	V	27.3	Very low	29.8	Very low	137 Å²	137	137.9 Å²	137.9	83%	0.83	77%	0.773	S	S	*	*			trans	-75.1	133.6	158.9	173.8	0	0	0	0	107.9
791	I	30	Very low	29.7	Very low	141 Å²	141	135.1 Å²	135.1	72%	0.723	78%	0.775	S	S	*	*			trans	-126.5	123.3	171.7	-60.4	-177.6	0	0	0	109.3
792	Y	26.7	Very low	29.5	Very low	223 Å²	223	131.3 Å²	131.3	88%	0.875	77%	0.768	S	S	*	*			trans	-135.9	102.9	173.2	-125.8	-73.8	0	0	0	106.8
793	A	30.5	Very low	29.6	Very low	72 Å²	72	132.7 Å²	132.7	60%	0.595	77%	0.766	S	S	*	*			trans	-167.1	119.3	172.8	0	0	0	0	0	105.9
794	D	29.1	Very low	29.5	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	77%	0.765	S	S	*	*				60.9	106.5	91.2	-65.2	-39.5	0	0	0	112.2
795	S	29.1	Very low	29.5	Very low	103 Å²	103	133.1 Å²	133.1	72%	0.72	76%	0.763	S	S	*	*				84.7	134	65.7	-176.8	0	0	0	0	112.6
796	I	33	Very low	29.6	Very low	146 Å²	146	131.4 Å²	131.4	75%	0.749	76%	0.759	S	S	*	*			trans	160.9	121.2	149.4	-87	155.8	0	0	0	109.1
797	H	31.2	Very low	29.7	Very low	152 Å²	152	131.2 Å²	131.2	70%	0.704	75%	0.746	S	S	*	*			trans	37.7	157.9	140.7	-66.1	-80.1	0	0	0	121.5	E799	H797-E799 IonicContact CE1-OE2 2.67Å; H797-E799 IonicContact CG-OE2 3.77Å; H797-E799 IonicContact ND1-OE2 2.65Å; H797-E799 PolarHBondContact ND1-OE2 2.82Å
798	S	29.5	Very low	29.6	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	75%	0.748	S	S	*	*			cis	-174.8	157.1	2.7	38.4	0	0	0	0	108.5
799	E	30.9	Very low	29.8	Very low	142 Å²	142	132 Å²	132	66%	0.664	74%	0.738	S	S	*	*			cis	-164.5	155.3	-12.9	-127.4	56.9	-81.1	0	0	108.9	H797	H797-E799 IonicContact CE1-OE2 2.67Å; H797-E799 IonicContact CG-OE2 3.77Å; H797-E799 IonicContact ND1-OE2 2.65Å; H797-E799 PolarHBondContact ND1-OE2 2.82Å
800	A	28.7	Very low	29.8	Very low	76 Å²	76	133 Å²	133	63%	0.628	73%	0.729	S	S	*	*			trans	50.7	137.1	142.2	0	0	0	0	0	124.8
801	N	29.2	Very low	30	Very low	160 Å²	160	134.6 Å²	134.6	86%	0.856	73%	0.727	S	S	*	*			trans	69.9	152	154.5	-56.8	-18.8	0	0	0	117.7
802	S	29.8	Very low	29.9	Very low	98 Å²	98	131.5 Å²	131.5	69%	0.685	73%	0.73	S	S	*	*			cis	-152.3	130.5	-9.1	37.3	0	0	0	0	109.7
803	V	29.9	Very low	29.9	Very low	130 Å²	130	124.2 Å²	124.2	79%	0.788	72%	0.723	S	S	*	*				63.6	138.1	105.4	-154.6	0	0	0	0	116.2
804	E	31	Very low	29.8	Very low	169 Å²	169	132.6 Å²	132.6	79%	0.79	74%	0.739	S	S	*	*			trans	78.6	110.8	175.4	-48.3	-156.7	154	0	0	115.2
805	N	28.5	Very low	29.7	Very low	151 Å²	151	130.6 Å²	130.6	81%	0.807	74%	0.737	S	S	*	*				84.2	111.8	58.5	-75	-21	0	0	0	113.8
806	V	33.2	Very low	29.9	Very low	139 Å²	139	130.9 Å²	130.9	84%	0.842	74%	0.739	S	S	*	*				-170.6	153.3	109.9	147.1	0	0	0	0	109.1
807	S	29	Very low	30	Very low	74 Å²	74	128 Å²	128	52%	0.517	73%	0.729	S	S	.	*			trans	-84.5	165.1	-174.6	51.4	0	0	0	0	114.4
808	Y	28.8	Very low	29.9	Very low	219 Å²	219	129.5 Å²	129.5	86%	0.859	73%	0.73	S	S	*	*				178.2	157.4	104.6	-92.3	-63.1	0	0	0	115.3
809	A	31.6	Very low	29.9	Very low	84 Å²	84	131.1 Å²	131.1	69%	0.694	73%	0.731	S	S	*	*			trans	75.4	101.1	151.2	0	0	0	0	0	122.9
810	R	29.2	Very low	29.9	Very low	124 Å²	124	128.1 Å²	128.1	47%	0.468	73%	0.73	S	S	.	*			trans	63	142.5	133.4	-59.4	-175.7	179.4	175.8	3.1	121.3	E694	E694-R810 IonicContact OE1-CZ 2.7Å; E694-R810 IonicContact OE1-NH2 3.08Å; E694-R810 PolarHBondContact OE1-NH2 2.82Å; E694-R810 IonicContact OE2-NH2 3.66Å; E694-R810 PolarHBondContact OE2-NH2 2.69Å
811	H	32	Very low	30	Very low	171 Å²	171	131.7 Å²	131.7	79%	0.792	73%	0.734	S	S	*	*			trans	70.6	144.8	173.1	-53.4	-78.9	0	0	0	116.4
812	G	26.8	Very low	30.3	Very low	77 Å²	77	132 Å²	132	79%	0.794	73%	0.731	S	S	*	*			cis	176	66	-3.6	0	0	0	0	0	116.7
813	G	26.9	Very low	30.5	Very low	69 Å²	69	132.9 Å²	132.9	71%	0.711	73%	0.728	S	S	*	*			trans	82.6	168.3	166.6	0	0	0	0	0	116.5
814	R	27.7	Very low	30.6	Very low	249 Å²	249	135.6 Å²	135.6	94%	0.94	73%	0.725	S	S	*	*			trans	62.4	142.1	-175.4	-54.1	-177.8	-179.1	-148.7	-1	115.2
815	S	28	Very low	31	Very low	111 Å²	111	132.9 Å²	132.9	78%	0.776	72%	0.722	S	S	*	*			cis	-168.2	168.1	-24.4	47.1	0	0	0	0	108.7
816	S	33.2	Very low	31.2	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	72%	0.721	S	S	*	*			trans	-51.1	174.9	153.4	-117.2	0	0	0	0	112.3
817	P	34.9	Very low	31.3	Very low	85 Å²	85	130 Å²	130	55%	0.552	72%	0.722	S	S	*	*			cis	-139.1	-160	13.4	21.4	7.2	0	0	0	115.5
818	Y	28.8	Very low	31.4	Very low	185 Å²	185	130.7 Å²	130.7	73%	0.725	73%	0.732	S	S	*	*			trans	82.9	144.9	158.8	-59.3	-54.2	0	0	0	119.2
819	N	29.5	Very low	31.7	Very low	133 Å²	133	128.3 Å²	128.3	71%	0.711	74%	0.735	S	S	*	*			cis	-164.6	-177	-33	-140.9	16.2	0	0	0	111.4
820	A	31.2	Very low	32.2	Very low	78 Å²	78	129.6 Å²	129.6	65%	0.645	74%	0.739	S	S	*	*			trans	74.2	146.7	144.4	0	0	0	0	0	119.8
821	E	29.8	Very low	32.7	Very low	152 Å²	152	127.8 Å²	127.8	71%	0.71	74%	0.738	S	S	*	*			cis	-173.5	-176.8	-27.9	-123.1	177.5	115.8	0	0	109.5
822	Q	35.6	Very low	32.9	Very low	167 Å²	167	128.5 Å²	128.5	78%	0.78	74%	0.739	S	S	*	*			trans	81.4	148.1	161.1	-44.2	-176.8	12.9	0	0	119.9
823	N	34.3	Very low	33.5	Very low	116 Å²	116	130.1 Å²	130.1	62%	0.62	73%	0.73	S	S	*	*			cis	-168.5	169.6	-47.9	-130.5	-31.5	0	0	0	113.7
824	Y	32.2	Very low	34	Very low	186 Å²	186	128.7 Å²	128.7	73%	0.729	71%	0.711	S	S	*	*			trans	107.2	148.1	145.2	-62.5	-53.5	0	0	0	120.4
825	P	39.7	Very low	34.4	Very low	113 Å²	113	124.9 Å²	124.9	73%	0.734	70%	0.697	S	S	*	*			cis	-142.5	173.5	-26.4	37.8	-19.6	0	0	0	117.6
826	A	32.9	Very low	34.9	Very low	94 Å²	94	125.2 Å²	125.2	78%	0.777	68%	0.684	S	S	*	*			trans	77.9	156.7	150.9	0	0	0	0	0	120.7
827	P	35.8	Very low	35.2	Very low	134 Å²	134	123.7 Å²	123.7	87%	0.87	67%	0.667	S	S	*	*			cis	-104.2	-177.8	-8.6	40.1	-30.8	0	0	0	113.4
828	A	31.5	Very low	35.4	Very low	89 Å²	89	121.7 Å²	121.7	74%	0.736	65%	0.653	S	S	*	*			trans	-124	155.6	-169.2	0	0	0	0	0	114.4
829	D	33.2	Very low	35.8	Very low	170 Å²	170	115.8 Å²	115.8	91%	0.909	64%	0.639	S	S	*	*	S	Bend	trans	178	-9.5	135.9	-95	-8.4	0	0	0	113.8
830	S	42.3	Very low	36.7	Very low	111 Å²	111	112.1 Å²	112.1	78%	0.776	62%	0.624	S	S	*	*	S	Bend	trans	-110.1	-6	-173.9	56	0	0	0	0	117.2	F832	S830-F832 PolarHBondContact O-N 3.39Å
831	D	40.8	Very low	37.7	Very low	85 Å²	85	109.9 Å²	109.9	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-88.1	1.6	-164	-165	47	0	0	0	115.2	R835	D831-R835 IonicContact OD2-CZ 3.67Å; D831-R835 IonicContact OD2-NE 3.18Å; D831-R835 PolarHBondContact OD2-NE 2.89Å; D831-R835 IonicContact OD2-NH2 3.63Å; D831-R835 PolarHBondContact OD2-NH2 3.1Å
832	F	34.9	Very low	39	Very low	186 Å²	186	108.1 Å²	108.1	82%	0.816	59%	0.594	S	S	*	*	H	α-helix	trans	-80.9	-35.3	-175.2	-147.9	-93.2	0	0	0	113.1	S830	S830-F832 PolarHBondContact O-N 3.39Å
833	D	40.1	Very low	40.1	Very low	111 Å²	111	105.6 Å²	105.6	59%	0.594	58%	0.582	S	S	*	*	H	α-helix	trans	-74.7	-40.5	178.9	-79	-41.5	0	0	0	112.8	R835 K836 I837	D833-R835 VanDerWaalsContact C-N 3.3Å; D833-R835 PolarHBondContact O-N 3.16Å; D833-K836 WeakPolarHBondContact O-CA 3.27Å; D833-K836 WeakPolarHBondContact O-CB 3.42Å; D833-K836 PolarHBondContact O-N 2.9Å; D833-I837 WeakPolarHBondContact O-CG1 3.34Å; D833-I837 PolarHBondContact O-N 2.89Å
834	A	37.2	Very low	41.4	Very low	39 Å²	39	101.8 Å²	101.8	32%	0.322	56%	0.561	S	S	.	*	H	α-helix	trans	-57	-43.5	-178	0	0	0	0	0	112.1	K836 I837 V838	A834-K836 VanDerWaalsContact C-N 3.33Å; A834-K836 PolarHBondContact O-N 3.37Å; A834-I837 PolarHBondContact O-N 2.83Å; A834-V838 WeakPolarHBondContact O-CG2 3.33Å; A834-V838 PolarHBondContact O-N 2.87Å
835	R	36.8	Very low	43	Very low	169 Å²	169	97.1 Å²	97.1	64%	0.638	55%	0.546	S	S	*	.	H	α-helix	trans	-68	-31.5	177.1	-60.6	177.3	-171.9	-123.5	1.7	112.5	D831 D833 S839	D831-R835 IonicContact OD2-CZ 3.67Å; D831-R835 IonicContact OD2-NE 3.18Å; D831-R835 PolarHBondContact OD2-NE 2.89Å; D831-R835 IonicContact OD2-NH2 3.63Å; D831-R835 PolarHBondContact OD2-NH2 3.1Å; D833-R835 VanDerWaalsContact C-N 3.3Å; D833-R835 PolarHBondContact O-N 3.16Å; R835-S839 PolarHBondContact O-N 2.94Å; R835-S839 VanDerWaalsContact O-N 3.13Å; R835-S839 PolarHBondContact O-OG 3.19Å
836	K	38.1	Very low	44.4	Very low	119 Å²	119	97.6 Å²	97.6	52%	0.517	54%	0.538	S	S	.	.	H	α-helix	trans	-67.8	-44.3	174.8	-160.3	-178.3	-180	-168.9	0	110.7	D833 A834 S839 S840	D833-K836 WeakPolarHBondContact O-CA 3.27Å; D833-K836 WeakPolarHBondContact O-CB 3.42Å; D833-K836 PolarHBondContact O-N 2.9Å; A834-K836 VanDerWaalsContact C-N 3.33Å; A834-K836 PolarHBondContact O-N 3.37Å; K836-S839 PolarHBondContact O-N 3.35Å; K836-S839 PolarHBondContact O-OG 2.89Å; K836-S840 PolarHBondContact O-N 2.85Å; K836-S840 VanDerWaalsContact O-N 3.07Å; K836-S840 PolarHBondContact O-OG 2.88Å
837	I	39.2	Very low	46.2	Very low	75 Å²	75	96.1 Å²	96.1	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-41	177.6	-64.8	161.9	0	0	0	112	V23 D833 A834 S840 T841	V23-I837 HydrophobicContact CG2-CG2 4.22Å; D833-I837 WeakPolarHBondContact O-CG1 3.34Å; D833-I837 PolarHBondContact O-N 2.89Å; A834-I837 PolarHBondContact O-N 2.83Å; I837-S840 PolarHBondContact O-OG 3.41Å; I837-T841 VanDerWaalsContact O-CG2 3.28Å; I837-T841 WeakPolarHBondContact O-CG2 3.5Å; I837-T841 PolarHBondContact O-N 3.07Å; I837-T841 PolarHBondContact O-OG1 2.92Å
838	V	39.3	Very low	48	Very low	44 Å²	44	91 Å²	91	27%	0.267	48%	0.484	S	S	.	.	H	α-helix	trans	-68.4	-35.2	175.2	176.2	0	0	0	0	111.4	D20 V23 A834 T841	D20-V838 WeakPolarHBondContact O-CG1 3.29Å; V23-V838 HydrophobicContact CG2-CG2 4.39Å; A834-V838 WeakPolarHBondContact O-CG2 3.33Å; A834-V838 PolarHBondContact O-N 2.87Å; V838-T841 WeakPolarHBondContact CA-OG1 3.31Å; V838-T841 PolarHBondContact O-OG1 3.19Å
839	S	38.1	Very low	50.1	Low	60 Å²	60	93.9 Å²	93.9	42%	0.42	48%	0.476	S	S	.	.	H	α-helix	trans	-70	-38.3	178	64	0	0	0	0	114.2	R835 K836 T841 Q843	R835-S839 PolarHBondContact O-N 2.94Å; R835-S839 VanDerWaalsContact O-N 3.13Å; R835-S839 PolarHBondContact O-OG 3.19Å; K836-S839 PolarHBondContact O-N 3.35Å; K836-S839 PolarHBondContact O-OG 2.89Å; S839-T841 VanDerWaalsContact C-N 3.28Å; S839-T841 PolarHBondContact O-N 3.09Å; S839-Q843 VanDerWaalsContact O-CG 3.29Å; S839-Q843 WeakPolarHBondContact O-CG 3.33Å; S839-Q843 PolarHBondContact O-OE1 2.85Å
840	S	48.4	Very low	52.1	Low	57 Å²	57	92 Å²	92	40%	0.399	46%	0.462	S	S	.	.	H	α-helix	trans	-71.5	-23.2	178.7	59	0	0	0	0	113.2	K836 I837 M844	K836-S840 PolarHBondContact O-N 2.85Å; K836-S840 VanDerWaalsContact O-N 3.07Å; K836-S840 PolarHBondContact O-OG 2.88Å; I837-S840 PolarHBondContact O-OG 3.41Å; S840-M844 WeakPolarHBondContact O-CB 3.35Å; S840-M844 PolarHBondContact O-N 3.3Å
841	T	52.4	Low	53.6	Low	30 Å²	30	87 Å²	87	18%	0.184	43%	0.427	C	S	.	.	H	α-helix	trans	-81.4	-39.9	-175	40.7	0	0	0	0	113.4	L52 I837 V838 S839 Q843 M844 E845	L52-T841 HydrophobicContact CB-CG2 3.83Å; L52-T841 HydrophobicContact CD1-CG2 3.77Å; L52-T841 HydrophobicContact CD2-CG2 4.1Å; L52-T841 HydrophobicContact CG-CG2 4.1Å; I837-T841 VanDerWaalsContact O-CG2 3.28Å; I837-T841 WeakPolarHBondContact O-CG2 3.5Å; I837-T841 PolarHBondContact O-N 3.07Å; I837-T841 PolarHBondContact O-OG1 2.92Å; V838-T841 WeakPolarHBondContact CA-OG1 3.31Å; V838-T841 PolarHBondContact O-OG1 3.19Å; S839-T841 VanDerWaalsContact C-N 3.28Å; S839-T841 PolarHBondContact O-N 3.09Å; T841-Q843 VanDerWaalsContact C-N 3.28Å; T841-Q843 PolarHBondContact O-N 2.9Å; T841-M844 PolarHBondContact O-N 3.44Å; T841-E845 PolarHBondContact O-N 2.76Å; T841-E845 VanDerWaalsContact O-N 3.16Å
842	E	56	Low	55.4	Low	115 Å²	115	87 Å²	87	54%	0.537	43%	0.426	S	S	.	.	H	α-helix	trans	-64.5	-33.4	168.1	-71.5	-163.3	137.2	0	0	112.3	Q846	E842-Q846 WeakPolarHBondContact O-CG 3.48Å; E842-Q846 PolarHBondContact O-N 2.77Å; E842-Q846 PolarHBondContact O-NE2 3.46Å
843	Q	58	Low	57.4	Low	114 Å²	114	82.4 Å²	82.4	53%	0.533	42%	0.418	S	S	.	.	H	α-helix	trans	-65.6	-46.2	174	-71.1	174.8	-53.9	0	0	110.8	S839 T841 E845 Q846 V847	S839-Q843 VanDerWaalsContact O-CG 3.29Å; S839-Q843 WeakPolarHBondContact O-CG 3.33Å; S839-Q843 PolarHBondContact O-OE1 2.85Å; T841-Q843 VanDerWaalsContact C-N 3.28Å; T841-Q843 PolarHBondContact O-N 2.9Å; Q843-E845 PolarHBondContact O-N 3.49Å; Q843-Q846 WeakPolarHBondContact O-CB 3.26Å; Q843-Q846 PolarHBondContact O-N 2.99Å; Q843-V847 WeakPolarHBondContact O-CG2 3.2Å; Q843-V847 PolarHBondContact O-N 2.7Å
844	M	62.3	Low	59.1	Low	37 Å²	37	80.4 Å²	80.4	18%	0.182	41%	0.41	C	S	.	.	H	α-helix	trans	-64.2	-40.3	-178.5	-164.1	58.7	71.1	0	0	113	S840 T841 Q846 V847 I848 Y910	S840-M844 WeakPolarHBondContact O-CB 3.35Å; S840-M844 PolarHBondContact O-N 3.3Å; T841-M844 PolarHBondContact O-N 3.44Å; M844-Q846 PolarHBondContact O-N 2.91Å; M844-V847 PolarHBondContact O-N 3.17Å; M844-V847 HydrophobicContact SD-CB 4.5Å; M844-I848 HydrophobicContact CG-CD1 3.96Å; M844-I848 HydrophobicContact CG-CG1 4.45Å; M844-I848 WeakPolarHBondContact O-CG1 3.35Å; M844-I848 PolarHBondContact O-N 3.07Å; M844-Y910 HydrophobicContact CG-CD2 4.16Å; M844-Y910 HydrophobicContact CG-CG 4.07Å; M844-Y910 WeakPolarHBondContact SD-CB 3.4Å; M844-Y910 HydrophobicContact SD-CG 4.25Å
845	E	66.7	Low	61	Low	88 Å²	88	79.5 Å²	79.5	41%	0.411	40%	0.404	S	S	.	.	H	α-helix	trans	-60.2	-33.5	172.7	-78.5	-151.5	147.3	0	0	113	T841 Q843 R849	T841-E845 PolarHBondContact O-N 2.76Å; T841-E845 VanDerWaalsContact O-N 3.16Å; Q843-E845 PolarHBondContact O-N 3.49Å; E845-R849 WeakPolarHBondContact O-CB 3.19Å; E845-R849 WeakPolarHBondContact O-CD 3.34Å; E845-R849 WeakPolarHBondContact O-CG 3.14Å; E845-R849 PolarHBondContact O-N 3.36Å; E845-R849 VanDerWaalsContact O-N 3.14Å; E845-R849 IonicContact OE1-NH2 3.76Å; E845-R849 PolarHBondContact OE1-NH2 2.96Å; E845-R849 IonicContact OE2-CZ 2.89Å; E845-R849 IonicContact OE2-NH1 2.69Å; E845-R849 PolarHBondContact OE2-NH1 2.76Å; E845-R849 IonicContact OE2-NH2 2.64Å; E845-R849 PolarHBondContact OE2-NH2 3.01Å
846	Q	68.2	Low	63	Low	123 Å²	123	78 Å²	78	58%	0.575	40%	0.404	S	S	*	.	H	α-helix	trans	-73.5	-41.1	177.6	-70.9	170.4	64.6	0	0	111.3	E842 Q843 M844 R849 H850	E842-Q846 WeakPolarHBondContact O-CG 3.48Å; E842-Q846 PolarHBondContact O-N 2.77Å; E842-Q846 PolarHBondContact O-NE2 3.46Å; Q843-Q846 WeakPolarHBondContact O-CB 3.26Å; Q843-Q846 PolarHBondContact O-N 2.99Å; M844-Q846 PolarHBondContact O-N 2.91Å; Q846-R849 PolarHBondContact O-N 3.29Å; Q846-H850 WeakPolarHBondContact O-CB 3.35Å; Q846-H850 PolarHBondContact O-N 2.84Å
847	V	70.3	Confident	65.3	Low	62 Å²	62	76.9 Å²	76.9	38%	0.376	40%	0.403	S	S	.	.	H	α-helix	trans	-61.5	-48.5	175.2	172.1	0	0	0	0	111.2	Q843 M844 R849 H850 A851 V903	Q843-V847 WeakPolarHBondContact O-CG2 3.2Å; Q843-V847 PolarHBondContact O-N 2.7Å; M844-V847 PolarHBondContact O-N 3.17Å; M844-V847 HydrophobicContact SD-CB 4.5Å; V847-R849 PolarHBondContact O-N 2.97Å; V847-H850 WeakPolarHBondContact O-CB 3.45Å; V847-H850 PolarHBondContact O-N 2.84Å; V847-A851 WeakPolarHBondContact O-CB 2.97Å; V847-A851 PolarHBondContact O-N 2.9Å; V847-V903 HydrophobicContact CG1-CB 4.45Å; V847-V903 HydrophobicContact CG1-CG1 3.94Å; V847-V903 HydrophobicContact CG1-CG2 3.58Å
848	I	73.6	Confident	67.6	Low	28 Å²	28	77 Å²	77	14%	0.144	40%	0.399	C	S	.	.	H	α-helix	trans	-63.7	-41.4	178.6	-63.8	165.8	0	0	0	111.2	M844 H850 A851 L852 Y893 V903 Y910	M844-I848 HydrophobicContact CG-CD1 3.96Å; M844-I848 HydrophobicContact CG-CG1 4.45Å; M844-I848 WeakPolarHBondContact O-CG1 3.35Å; M844-I848 PolarHBondContact O-N 3.07Å; I848-H850 VanDerWaalsContact C-N 3.32Å; I848-H850 PolarHBondContact O-N 2.95Å; I848-A851 PolarHBondContact O-N 3.08Å; I848-L852 HydrophobicContact CG2-CD1 3.91Å; I848-L852 HydrophobicContact CG2-CG 4.42Å; I848-L852 WeakPolarHBondContact O-CB 3.05Å; I848-L852 WeakPolarHBondContact O-CG 3.41Å; I848-L852 PolarHBondContact O-N 2.92Å; I848-Y893 HydrophobicContact CG2-CD1 4.1Å; I848-Y893 HydrophobicContact CG2-CE1 4.46Å; I848-V903 HydrophobicContact CG1-CG1 4.41Å; I848-Y910 HydrophobicContact CD1-CD1 3.67Å; I848-Y910 HydrophobicContact CD1-CD2 4.33Å; I848-Y910 HydrophobicContact CD1-CE1 3.69Å; I848-Y910 HydrophobicContact CD1-CE2 4.35Å; I848-Y910 HydrophobicContact CD1-CG 4.01Å; I848-Y910 HydrophobicContact CG1-CD1 4.31Å
849	R	76.3	Confident	69.9	Low	148 Å²	148	78.1 Å²	78.1	56%	0.558	41%	0.405	S	S	*	.	H	α-helix	trans	-65.2	-33.2	175.1	-75.1	171.8	-174.1	130.7	11	112.9	E845 Q846 V847	E845-R849 WeakPolarHBondContact O-CB 3.19Å; E845-R849 WeakPolarHBondContact O-CD 3.34Å; E845-R849 WeakPolarHBondContact O-CG 3.14Å; E845-R849 PolarHBondContact O-N 3.36Å; E845-R849 VanDerWaalsContact O-N 3.14Å; E845-R849 IonicContact OE1-NH2 3.76Å; E845-R849 PolarHBondContact OE1-NH2 2.96Å; E845-R849 IonicContact OE2-CZ 2.89Å; E845-R849 IonicContact OE2-NH1 2.69Å; E845-R849 PolarHBondContact OE2-NH1 2.76Å; E845-R849 IonicContact OE2-NH2 2.64Å; E845-R849 PolarHBondContact OE2-NH2 3.01Å; Q846-R849 PolarHBondContact O-N 3.29Å; V847-R849 PolarHBondContact O-N 2.97Å
850	H	74.9	Confident	72.4	Confident	131 Å²	131	75.3 Å²	75.3	61%	0.606	39%	0.385	S	S	*	.	H	α-helix	trans	-70.6	-47.4	175.5	-172.5	-93.8	0	0	0	111.1	Q846 V847 I848 L852 S853 T854	Q846-H850 WeakPolarHBondContact O-CB 3.35Å; Q846-H850 PolarHBondContact O-N 2.84Å; V847-H850 WeakPolarHBondContact O-CB 3.45Å; V847-H850 PolarHBondContact O-N 2.84Å; I848-H850 VanDerWaalsContact C-N 3.32Å; I848-H850 PolarHBondContact O-N 2.95Å; H850-L852 PolarHBondContact O-N 2.88Å; H850-S853 WeakPolarHBondContact O-CA 3.35Å; H850-S853 WeakPolarHBondContact O-CB 3.47Å; H850-S853 PolarHBondContact O-N 2.92Å; H850-S853 PolarHBondContact O-OG 3.36Å; H850-T854 PolarHBondContact O-N 2.86Å
851	A	74.5	Confident	74.4	Confident	7 Å²	7	74.7 Å²	74.7	6%	0.058	38%	0.379	C	S	.	.	H	α-helix	trans	-62.9	-41.6	177.9	0	0	0	0	0	112.6	V847 I848 S853 T854 G855 Y893 G894 V903	V847-A851 WeakPolarHBondContact O-CB 2.97Å; V847-A851 PolarHBondContact O-N 2.9Å; I848-A851 PolarHBondContact O-N 3.08Å; A851-S853 PolarHBondContact O-N 3.46Å; A851-T854 PolarHBondContact O-N 3.02Å; A851-T854 PolarHBondContact O-OG1 3.49Å; A851-G855 PolarHBondContact O-N 2.71Å; A851-Y893 WeakPolarHBondContact CB-O 3.32Å; A851-G894 WeakPolarHBondContact O-CA 3.42Å; A851-V903 HydrophobicContact CB-CB 3.85Å; A851-V903 HydrophobicContact CB-CG1 4.35Å; A851-V903 HydrophobicContact CB-CG2 3.81Å
852	L	78.1	Confident	76.3	Confident	83 Å²	83	73.4 Å²	73.4	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-64.8	-3.6	170.8	-73	173.5	0	0	0	114.5	I848 H850 I857 Y893	I848-L852 HydrophobicContact CG2-CD1 3.91Å; I848-L852 HydrophobicContact CG2-CG 4.42Å; I848-L852 WeakPolarHBondContact O-CB 3.05Å; I848-L852 WeakPolarHBondContact O-CG 3.41Å; I848-L852 PolarHBondContact O-N 2.92Å; H850-L852 PolarHBondContact O-N 2.88Å; L852-I857 HydrophobicContact CD2-CD1 4.01Å; L852-I857 HydrophobicContact CD2-CG1 3.63Å; L852-Y893 HydrophobicContact CD1-CD1 4.39Å; L852-Y893 HydrophobicContact CD2-CD1 3.98Å; L852-Y893 HydrophobicContact CG-CD1 4.15Å
853	S	76.3	Confident	77.8	Confident	91 Å²	91	73.4 Å²	73.4	64%	0.636	37%	0.372	S	S	*	.	H	α-helix	trans	-101.3	-14.2	169.1	79.2	0	0	0	0	114	H850 A851	H850-S853 WeakPolarHBondContact O-CA 3.35Å; H850-S853 WeakPolarHBondContact O-CB 3.47Å; H850-S853 PolarHBondContact O-N 2.92Å; H850-S853 PolarHBondContact O-OG 3.36Å; A851-S853 PolarHBondContact O-N 3.46Å
854	T	75.8	Confident	79.2	Confident	69 Å²	69	73 Å²	73	42%	0.423	37%	0.368	S	S	.	.	H	α-helix	trans	-86.2	-38.8	174.5	66.9	0	0	0	0	112.2	H850 A851 D895	H850-T854 PolarHBondContact O-N 2.86Å; A851-T854 PolarHBondContact O-N 3.02Å; A851-T854 PolarHBondContact O-OG1 3.49Å; T854-D895 PolarHBondContact OG1-N 3.21Å; T854-D895 PolarHBondContact OG1-O 3.01Å
855	G	77.7	Confident	80.4	Confident	19 Å²	19	74.9 Å²	74.9	20%	0.196	38%	0.379	C	S	.	.	S	Bend	trans	-161.7	-168.1	-175.1	0	0	0	0	0	115.3	A851 D895	A851-G855 PolarHBondContact O-N 2.71Å; G855-D895 VanDerWaalsContact CA-OD2 3.3Å; G855-D895 WeakPolarHBondContact CA-OD2 3.4Å
856	Q	79	Confident	81.6	Confident	137 Å²	137	71 Å²	71	64%	0.64	36%	0.361	S	S	*	.			trans	-87.2	165.8	-179.4	-60.9	-171.6	24.9	0	0	112.5	G894	Q856-G894 PolarHBondContact O-N 2.72Å; Q856-G894 VanDerWaalsContact O-N 3.14Å
857	I	85.9	Confident	82.5	Confident	96 Å²	96	68 Å²	68	49%	0.492	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	131.7	168.1	-57	175.7	0	0	0	108.5	L852 T891 L892 Y893	L852-I857 HydrophobicContact CD2-CD1 4.01Å; L852-I857 HydrophobicContact CD2-CG1 3.63Å; I857-T891 HydrophobicContact CG2-CG2 3.68Å; I857-L892 CarbonylContact C-O 3.55Å; I857-L892 VanDerWaalsContact CA-O 3.25Å; I857-L892 WeakPolarHBondContact CA-O 3.31Å; I857-L892 WeakPolarHBondContact CG2-O 3.48Å; I857-Y893 HydrophobicContact CD1-CD1 4.19Å; I857-Y893 HydrophobicContact CD1-CE1 3.97Å; I857-Y893 HydrophobicContact CG1-CD1 4.05Å; I857-Y893 HydrophobicContact CG1-CE1 4.28Å
858	R	87.5	Confident	83.3	Confident	79 Å²	79	65.2 Å²	65.2	30%	0.298	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	163.3	176.7	-58.2	-168.3	-172.6	107	0.5	110.9	L892 D895 I920	R858-L892 PolarHBondContact N-O 2.92Å; R858-L892 PolarHBondContact O-N 3.38Å; R858-D895 IonicContact CZ-OD1 2.68Å; R858-D895 IonicContact NH1-OD1 3.4Å; R858-D895 PolarHBondContact NH1-OD1 2.86Å; R858-D895 IonicContact NH2-OD1 2.81Å; R858-D895 PolarHBondContact NH2-OD1 3.44Å; R858-D895 IonicContact NH2-OD2 3.16Å; R858-I920 HydrophobicContact CB-CG2 4.15Å
859	T	88.3	Confident	83.7	Confident	67 Å²	67	70.1 Å²	70.1	41%	0.411	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	139.1	167.4	61.8	0	0	0	0	110.1	N921	T859-N921 PolarHBondContact O-N 3.21Å; T859-N921 PolarHBondContact OG1-ND2 2.7Å
860	A	90.7	Very high	84.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	159.5	173.1	0	0	0	0	0	110.6	V889 I890 L892 I918 V919 I920	A860-V889 WeakPolarHBondContact O-CA 3.45Å; A860-I890 PolarHBondContact N-O 2.88Å; A860-I890 PolarHBondContact O-N 2.84Å; A860-L892 HydrophobicContact CB-CD1 3.68Å; A860-L892 HydrophobicContact CB-CD2 4.46Å; A860-L892 HydrophobicContact CB-CG 3.98Å; A860-I918 HydrophobicContact CB-CB 4.22Å; A860-I918 HydrophobicContact CB-CD1 4.12Å; A860-V919 CarbonylContact C-O 3.46Å; A860-V919 WeakPolarHBondContact CA-O 3.44Å; A860-V919 WeakPolarHBondContact CB-O 3.3Å; A860-I920 HydrophobicContact CB-CG1 4.17Å
861	V	90.1	Very high	84.6	Confident	45 Å²	45	65.6 Å²	65.6	27%	0.273	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.3	175.1	-175.6	0	0	0	0	108.2	E863 D888 I918 V919	V861-E863 PolarHBondContact O-N 2.88Å; V861-D888 WeakPolarHBondContact CA-O 3.46Å; V861-I918 CarbonylContact O-C 3.6Å; V861-I918 WeakPolarHBondContact O-CA 3.29Å; V861-V919 PolarHBondContact N-O 3.17Å; V861-V919 PolarHBondContact O-N 3.08Å
862	A	91.7	Very high	84.9	Confident	3 Å²	3	66.2 Å²	66.2	3%	0.025	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	124.4	173.2	0	0	0	0	0	110.8	F884 L885 G887 D888	A862-F884 HydrophobicContact CB-CD2 3.49Å; A862-F884 VanDerWaalsContact CB-CD2 3.49Å; A862-F884 HydrophobicContact CB-CE2 3.86Å; A862-F884 HydrophobicContact CB-CG 4.47Å; A862-L885 VanDerWaalsContact CB-O 3.25Å; A862-L885 WeakPolarHBondContact CB-O 3.48Å; A862-G887 PolarHBondContact O-N 3.42Å; A862-D888 PolarHBondContact N-O 2.79Å
863	E	87.1	Confident	84.9	Confident	114 Å²	114	66.2 Å²	66.2	53%	0.533	36%	0.355	S	S	.	.	S	Bend	trans	-86.1	-29.7	174.3	-170.3	172.9	-178.8	0	0	111.4	V861 F917 V919	V861-E863 PolarHBondContact O-N 2.88Å; E863-F917 PolarHBondContact N-O 3.03Å; E863-V919 HydrophobicContact CB-CG2 4.25Å; E863-V919 WeakPolarHBondContact OE2-CG2 3.44Å
864	F	87.6	Confident	84.8	Confident	105 Å²	105	65.2 Å²	65.2	46%	0.461	34%	0.343	S	S	.	.	S	Bend	trans	-132.6	155.3	-178.1	-54.2	-72.1	0	0	0	111	F917	F864-F917 HydrophobicContact CB-CD1 3.85Å; F864-F917 HydrophobicContact CB-CE1 4.37Å
865	D	88.4	Confident	84.6	Confident	77 Å²	77	65.2 Å²	65.2	41%	0.412	34%	0.343	S	S	.	.			trans	-68.2	139.1	172.7	-53.8	-47.1	0	0	0	110.4	L885 A886	D865-L885 HydrophobicContact CB-CD2 4.26Å; D865-L885 WeakPolarHBondContact OD1-CA 3.39Å; D865-A886 PolarHBondContact OD1-N 3.12Å
866	Y	91	Very high	84.5	Confident	8 Å²	8	67.8 Å²	67.8	3%	0.031	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-129.7	117	176.1	-163.7	-114.7	0	0	0	112.3	P868 L871 E881 L882 S883 F884 P914 F917	Y866-P868 HydrophobicContact CD1-CG 4.13Å; Y866-P868 HydrophobicContact CE1-CG 3.95Å; Y866-L871 HydrophobicContact CD2-CB 3.87Å; Y866-L871 HydrophobicContact CD2-CD1 3.83Å; Y866-L871 HydrophobicContact CE2-CB 3.53Å; Y866-L871 HydrophobicContact CE2-CD1 4.35Å; Y866-E881 PolarHBondContact OH-OE2 2.95Å; Y866-E881 VanDerWaalsContact OH-OE2 3.06Å; Y866-L882 WeakPolarHBondContact CD1-O 3.41Å; Y866-S883 VanDerWaalsContact O-CA 3.24Å; Y866-S883 WeakPolarHBondContact O-CA 3.47Å; Y866-S883 WeakPolarHBondContact O-CB 3.25Å; Y866-S883 PolarHBondContact O-OG 2.81Å; Y866-F884 VanDerWaalsContact CB-CE2 3.49Å; Y866-F884 VanDerWaalsContact CB-CZ 3.43Å; Y866-F884 AromaticContact CD1-CE1 3.85Å; Y866-F884 HydrophobicContact CD1-CE1 3.85Å; Y866-F884 HydrophobicContact CD1-CZ 4.12Å; Y866-F884 HydrophobicContact CG-CE1 4.12Å; Y866-F884 HydrophobicContact CG-CE2 4.46Å; Y866-F884 AromaticContact CG-CZ 3.95Å; Y866-F884 HydrophobicContact CG-CZ 3.95Å; Y866-F884 PolarHBondContact N-O 3.46Å; Y866-F884 PolarHBondContact O-N 2.88Å; Y866-P914 HydrophobicContact CD1-CG 4.12Å; Y866-P914 HydrophobicContact CD2-CG 4.21Å; Y866-P914 HydrophobicContact CE1-CG 3.78Å; Y866-P914 HydrophobicContact CE2-CG 3.89Å; Y866-P914 HydrophobicContact CG-CG 4.32Å; Y866-F917 AromaticContact CD2-CD1 3.68Å; Y866-F917 HydrophobicContact CD2-CD1 3.68Å; Y866-F917 HydrophobicContact CD2-CD2 4.08Å; Y866-F917 AromaticContact CD2-CE1 3.54Å; Y866-F917 HydrophobicContact CD2-CE1 3.54Å; Y866-F917 AromaticContact CD2-CE2 3.92Å; Y866-F917 HydrophobicContact CD2-CE2 3.92Å; Y866-F917 AromaticContact CD2-CG 3.98Å; Y866-F917 HydrophobicContact CD2-CG 3.98Å; Y866-F917 AromaticContact CD2-CZ 3.66Å; Y866-F917 HydrophobicContact CD2-CZ 3.66Å; Y866-F917 HydrophobicContact CE2-CD2 4.27Å; Y866-F917 HydrophobicContact CE2-CE1 4.22Å; Y866-F917 AromaticContact CE2-CE2 3.86Å; Y866-F917 HydrophobicContact CE2-CE2 3.86Å; Y866-F917 AromaticContact CE2-CZ 3.84Å; Y866-F917 HydrophobicContact CE2-CZ 3.84Å; Y866-F917 HydrophobicContact CG-CD1 4.27Å; Y866-F917 HydrophobicContact CG-CE1 4.5Å; Y866-F917 HydrophobicContact CG-CG 4.48Å
867	D	88.5	Confident	84.5	Confident	58 Å²	58	61.4 Å²	61.4	31%	0.31	32%	0.323	S	S	.	.			trans	-114.5	108	167.5	-177.5	-2.6	0	0	0	109	K869 V870 L871	D867-K869 PolarHBondContact O-N 3.08Å; D867-K869 VanDerWaalsContact O-N 3.08Å; D867-K869 VanDerWaalsContact OD1-CB 3.27Å; D867-K869 WeakPolarHBondContact OD1-CB 3.46Å; D867-K869 WeakPolarHBondContact OD1-CG 3.28Å; D867-K869 PolarHBondContact OD1-N 2.89Å; D867-V870 HydrophobicContact CB-CB 4.41Å; D867-V870 HydrophobicContact CB-CG2 4.4Å; D867-V870 PolarHBondContact O-N 3.48Å; D867-L871 PolarHBondContact O-N 2.95Å
868	P	86.6	Confident	84.2	Confident	5 Å²	5	62 Å²	62	3%	0.032	32%	0.323	C	S	.	.	H	α-helix	trans	-52	-27.9	175.3	-28.7	36.1	0	0	0	113.9	Y866 V870 S872 A877 E881	Y866-P868 HydrophobicContact CD1-CG 4.13Å; Y866-P868 HydrophobicContact CE1-CG 3.95Å; P868-V870 PolarHBondContact O-N 2.92Å; P868-S872 WeakPolarHBondContact O-CB 3.2Å; P868-S872 PolarHBondContact O-N 3.42Å; P868-A877 HydrophobicContact CB-CB 3.81Å; P868-E881 HydrophobicContact CB-CB 4.14Å; P868-E881 HydrophobicContact CG-CB 3.88Å
869	K	81.8	Confident	83.8	Confident	131 Å²	131	63.6 Å²	63.6	57%	0.57	33%	0.334	S	S	*	.	H	α-helix	trans	-69.4	-19.9	178.2	-58	166.4	-174.6	-88.1	0	113.8	D867 E878	D867-K869 PolarHBondContact O-N 3.08Å; D867-K869 VanDerWaalsContact O-N 3.08Å; D867-K869 VanDerWaalsContact OD1-CB 3.27Å; D867-K869 WeakPolarHBondContact OD1-CB 3.46Å; D867-K869 WeakPolarHBondContact OD1-CG 3.28Å; D867-K869 PolarHBondContact OD1-N 2.89Å; K869-E878 VanDerWaalsContact CE-OE1 3.31Å; K869-E878 WeakPolarHBondContact CE-OE1 3.35Å; K869-E878 HydrophobicContact CG-CB 4.42Å; K869-E878 IonicContact NZ-OE1 3.84Å; K869-E878 PolarHBondContact NZ-OE1 2.67Å; K869-E878 IonicContact NZ-OE2 3.42Å; K869-E878 PolarHBondContact NZ-OE2 3.35Å
870	V	84.2	Confident	83.6	Confident	101 Å²	101	65.3 Å²	65.3	61%	0.612	34%	0.337	S	S	*	.	H	α-helix	trans	-120.7	-30.9	-170.7	-177.5	0	0	0	0	111.7	D867 P868	D867-V870 HydrophobicContact CB-CB 4.41Å; D867-V870 HydrophobicContact CB-CG2 4.4Å; D867-V870 PolarHBondContact O-N 3.48Å; P868-V870 PolarHBondContact O-N 2.92Å
871	L	85.2	Confident	83.6	Confident	82 Å²	82	66.1 Å²	66.1	43%	0.429	34%	0.341	S	S	.	.	H	α-helix	trans	-115.7	-8.7	-171.4	-59.6	179.2	0	0	0	114.4	Y866 D867 F917	Y866-L871 HydrophobicContact CD2-CB 3.87Å; Y866-L871 HydrophobicContact CD2-CD1 3.83Å; Y866-L871 HydrophobicContact CE2-CB 3.53Å; Y866-L871 HydrophobicContact CE2-CD1 4.35Å; D867-L871 PolarHBondContact O-N 2.95Å; L871-F917 HydrophobicContact CD1-CE1 3.97Å; L871-F917 HydrophobicContact CD1-CZ 4.3Å
872	S	81.7	Confident	83.6	Confident	21 Å²	21	64.2 Å²	64.2	15%	0.147	33%	0.329	C	S	.	.			trans	-86.7	141.9	172	-173.9	0	0	0	0	112	P868 N874 A877 E881	P868-S872 WeakPolarHBondContact O-CB 3.2Å; P868-S872 PolarHBondContact O-N 3.42Å; S872-N874 PolarHBondContact O-N 3.03Å; S872-N874 PolarHBondContact OG-N 2.88Å; S872-A877 VanDerWaalsContact OG-CB 3.3Å; S872-A877 WeakPolarHBondContact OG-CB 3.5Å; S872-E881 WeakPolarHBondContact CB-OE1 3.39Å; S872-E881 WeakPolarHBondContact CB-OE2 3.34Å; S872-E881 VanDerWaalsContact OG-CD 3.29Å; S872-E881 PolarHBondContact OG-OE1 3.09Å; S872-E881 PolarHBondContact OG-OE2 3.24Å
873	P	76.9	Confident	83.6	Confident	82 Å²	82	67 Å²	67	53%	0.532	35%	0.349	S	S	.	.	S	Bend	trans	-73.4	-9.6	166.5	31.7	-36	0	0	0	113.8	N541	N541-P873 WeakPolarHBondContact ND2-CA 3.4Å; N541-P873 VanDerWaalsContact ND2-CB 3.27Å; N541-P873 WeakPolarHBondContact ND2-CB 3.09Å; N541-P873 PolarHBondContact ND2-O 3.4Å
874	N	74.7	Confident	83.9	Confident	70 Å²	70	61.7 Å²	61.7	37%	0.374	32%	0.324	S	S	.	.			trans	-98.5	150.6	-171.8	-164.5	26.7	0	0	0	113.7	S872 D876 A877	S872-N874 PolarHBondContact O-N 3.03Å; S872-N874 PolarHBondContact OG-N 2.88Å; N874-D876 VanDerWaalsContact CG-OD1 3.27Å; N874-D876 PolarHBondContact ND2-OD1 3.01Å; N874-D876 PolarHBondContact OD1-OD1 3.16Å; N874-A877 HydrophobicContact CB-CB 4.3Å; N874-A877 WeakPolarHBondContact O-CB 3.44Å
875	V	73.2	Confident	84	Confident	70 Å²	70	61.7 Å²	61.7	42%	0.424	33%	0.328	S	S	.	.	S	Bend	trans	-85.3	-30	-171.8	-176.8	0	0	0	0	112.4	L369	L369-V875 HydrophobicContact CD2-CG1 3.96Å
876	D	74.2	Confident	84	Confident	73 Å²	73	60.6 Å²	60.6	39%	0.39	33%	0.33	S	S	.	.	S	Bend	trans	-96.7	15.8	173.6	26.9	20.8	0	0	0	113	N874 E878 Q879 E880	N874-D876 VanDerWaalsContact CG-OD1 3.27Å; N874-D876 PolarHBondContact ND2-OD1 3.01Å; N874-D876 PolarHBondContact OD1-OD1 3.16Å; D876-E878 VanDerWaalsContact C-N 3.33Å; D876-E878 PolarHBondContact O-N 2.82Å; D876-Q879 WeakPolarHBondContact O-CA 3.39Å; D876-Q879 WeakPolarHBondContact O-CB 3.47Å; D876-Q879 PolarHBondContact O-N 3.47Å; D876-E880 PolarHBondContact O-N 3.25Å
877	A	78.8	Confident	83.8	Confident	2 Å²	2	62.5 Å²	62.5	2%	0.017	35%	0.352	C	S	.	.	H	α-helix	trans	-53.4	-40.7	-179.1	0	0	0	0	0	114.4	P868 S872 N874 Q879 E880 E881	P868-A877 HydrophobicContact CB-CB 3.81Å; S872-A877 VanDerWaalsContact OG-CB 3.3Å; S872-A877 WeakPolarHBondContact OG-CB 3.5Å; N874-A877 HydrophobicContact CB-CB 4.3Å; N874-A877 WeakPolarHBondContact O-CB 3.44Å; A877-Q879 PolarHBondContact O-N 3.09Å; A877-Q879 VanDerWaalsContact O-N 3.08Å; A877-E880 PolarHBondContact O-N 2.72Å; A877-E881 HydrophobicContact CB-CG 4.49Å; A877-E881 WeakPolarHBondContact CB-OE1 3.31Å; A877-E881 WeakPolarHBondContact O-CB 3.42Å; A877-E881 PolarHBondContact O-N 3.49Å
878	E	80.6	Confident	83.8	Confident	109 Å²	109	62.5 Å²	62.5	51%	0.509	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-15.6	174.2	167.5	173.8	-152.5	0	0	113.6	K869 D876	K869-E878 VanDerWaalsContact CE-OE1 3.31Å; K869-E878 WeakPolarHBondContact CE-OE1 3.35Å; K869-E878 HydrophobicContact CG-CB 4.42Å; K869-E878 IonicContact NZ-OE1 3.84Å; K869-E878 PolarHBondContact NZ-OE1 2.67Å; K869-E878 IonicContact NZ-OE2 3.42Å; K869-E878 PolarHBondContact NZ-OE2 3.35Å; D876-E878 VanDerWaalsContact C-N 3.33Å; D876-E878 PolarHBondContact O-N 2.82Å
879	Q	79.5	Confident	84	Confident	112 Å²	112	66.4 Å²	66.4	52%	0.523	38%	0.376	S	S	.	.	H	α-helix	trans	-102.2	-21.3	177.2	-68.6	89.8	85.1	0	0	114.1	D876 A877	D876-Q879 WeakPolarHBondContact O-CA 3.39Å; D876-Q879 WeakPolarHBondContact O-CB 3.47Å; D876-Q879 PolarHBondContact O-N 3.47Å; A877-Q879 PolarHBondContact O-N 3.09Å; A877-Q879 VanDerWaalsContact O-N 3.08Å
880	E	83	Confident	84.5	Confident	103 Å²	103	60.2 Å²	60.2	48%	0.481	35%	0.349	S	S	.	.	H	α-helix	trans	-114.1	-19.5	-176.5	-60.5	-162	150.8	0	0	114.3	D876 A877 G911 L912	D876-E880 PolarHBondContact O-N 3.25Å; A877-E880 PolarHBondContact O-N 2.72Å; E880-G911 CarbonylContact O-C 3.57Å; E880-G911 VanDerWaalsContact O-CA 3.23Å; E880-G911 WeakPolarHBondContact O-CA 3.43Å; E880-L912 PolarHBondContact O-N 2.65Å
881	E	90.9	Very high	84.8	Confident	18 Å²	18	57.6 Å²	57.6	8%	0.084	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-114.2	152.5	-176.2	-59.9	165.5	-153.3	0	0	112.4	Y866 P868 S872 A877 L912	Y866-E881 PolarHBondContact OH-OE2 2.95Å; Y866-E881 VanDerWaalsContact OH-OE2 3.06Å; P868-E881 HydrophobicContact CB-CB 4.14Å; P868-E881 HydrophobicContact CG-CB 3.88Å; S872-E881 WeakPolarHBondContact CB-OE1 3.39Å; S872-E881 WeakPolarHBondContact CB-OE2 3.34Å; S872-E881 VanDerWaalsContact OG-CD 3.29Å; S872-E881 PolarHBondContact OG-OE1 3.09Å; S872-E881 PolarHBondContact OG-OE2 3.24Å; A877-E881 HydrophobicContact CB-CG 4.49Å; A877-E881 WeakPolarHBondContact CB-OE1 3.31Å; A877-E881 WeakPolarHBondContact O-CB 3.42Å; A877-E881 PolarHBondContact O-N 3.49Å; E881-L912 WeakPolarHBondContact CA-O 3.48Å; E881-L912 HydrophobicContact CG-CB 4.19Å
882	L	90	Very high	85.2	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.021	31%	0.312	C	S	.	.			trans	-87.2	130.7	175.9	-76	175.5	0	0	0	112.2	Y866 F884 G904 L906 R909 L912 V913	Y866-L882 WeakPolarHBondContact CD1-O 3.41Å; L882-F884 HydrophobicContact CB-CD1 4.24Å; L882-F884 WeakPolarHBondContact O-CD1 3.18Å; L882-F884 WeakPolarHBondContact O-CE1 3.39Å; L882-G904 WeakPolarHBondContact CD1-O 3.43Å; L882-L906 HydrophobicContact CD1-CB 4.35Å; L882-R909 HydrophobicContact CD2-CB 3.5Å; L882-R909 WeakPolarHBondContact CD2-O 3.4Å; L882-L912 PolarHBondContact N-O 2.83Å; L882-V913 HydrophobicContact CB-CG2 4.16Å; L882-V913 HydrophobicContact CD1-CG2 3.77Å; L882-V913 HydrophobicContact CG-CG2 4.39Å
883	S	91.5	Very high	85.5	Confident	61 Å²	61	54.2 Å²	54.2	43%	0.427	31%	0.312	S	S	.	.			trans	-86.8	138.1	162.5	-172.6	0	0	0	0	110.4	Y866	Y866-S883 VanDerWaalsContact O-CA 3.24Å; Y866-S883 WeakPolarHBondContact O-CA 3.47Å; Y866-S883 WeakPolarHBondContact O-CB 3.25Å; Y866-S883 PolarHBondContact O-OG 2.81Å
884	F	93.1	Very high	86.1	Confident	3 Å²	3	50.3 Å²	50.3	1%	0.013	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-155.4	161.1	-176.2	52	-98.8	0	0	0	111.4	A862 Y866 L882 I890 L906 V913 F917 I918	A862-F884 HydrophobicContact CB-CD2 3.49Å; A862-F884 VanDerWaalsContact CB-CD2 3.49Å; A862-F884 HydrophobicContact CB-CE2 3.86Å; A862-F884 HydrophobicContact CB-CG 4.47Å; Y866-F884 VanDerWaalsContact CB-CE2 3.49Å; Y866-F884 VanDerWaalsContact CB-CZ 3.43Å; Y866-F884 AromaticContact CD1-CE1 3.85Å; Y866-F884 HydrophobicContact CD1-CE1 3.85Å; Y866-F884 HydrophobicContact CD1-CZ 4.12Å; Y866-F884 HydrophobicContact CG-CE1 4.12Å; Y866-F884 HydrophobicContact CG-CE2 4.46Å; Y866-F884 AromaticContact CG-CZ 3.95Å; Y866-F884 HydrophobicContact CG-CZ 3.95Å; Y866-F884 PolarHBondContact N-O 3.46Å; Y866-F884 PolarHBondContact O-N 2.88Å; L882-F884 HydrophobicContact CB-CD1 4.24Å; L882-F884 WeakPolarHBondContact O-CD1 3.18Å; L882-F884 WeakPolarHBondContact O-CE1 3.39Å; F884-I890 HydrophobicContact CB-CD1 4.02Å; F884-I890 HydrophobicContact CD1-CD1 3.67Å; F884-I890 HydrophobicContact CD2-CD1 4Å; F884-I890 HydrophobicContact CE1-CD1 4.05Å; F884-I890 HydrophobicContact CE2-CD1 4.32Å; F884-I890 HydrophobicContact CG-CD1 3.63Å; F884-I890 HydrophobicContact CZ-CD1 4.35Å; F884-L906 HydrophobicContact CB-CD2 3.45Å; F884-L906 VanDerWaalsContact CB-CD2 3.45Å; F884-V913 HydrophobicContact CE1-CG1 3.93Å; F884-V913 HydrophobicContact CZ-CG1 4.17Å; F884-F917 HydrophobicContact CE2-CB 3.82Å; F884-F917 HydrophobicContact CZ-CB 3.75Å; F884-I918 HydrophobicContact CE2-CG2 4.3Å; F884-I918 HydrophobicContact CZ-CG2 4.25Å
885	L	90.5	Very high	86.6	Confident	105 Å²	105	50.3 Å²	50.3	55%	0.55	29%	0.286	S	S	.	.			trans	-112.9	155.2	179.8	-61.3	177.8	0	0	0	111.7	A862 D865 G887 D888	A862-L885 VanDerWaalsContact CB-O 3.25Å; A862-L885 WeakPolarHBondContact CB-O 3.48Å; D865-L885 HydrophobicContact CB-CD2 4.26Å; D865-L885 WeakPolarHBondContact OD1-CA 3.39Å; L885-G887 PolarHBondContact O-N 3.39Å; L885-G887 VanDerWaalsContact O-N 3.13Å; L885-D888 PolarHBondContact N-OD2 2.84Å; L885-D888 WeakPolarHBondContact O-CB 3.4Å; L885-D888 PolarHBondContact O-N 2.82Å
886	A	88.3	Confident	87.3	Confident	54 Å²	54	51.4 Å²	51.4	45%	0.446	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	115.2	-179	0	0	0	0	0	111.9	D865	D865-A886 PolarHBondContact OD1-N 3.12Å
887	G	86.1	Confident	87.9	Confident	48 Å²	48	50.7 Å²	50.7	50%	0.495	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.3	-5.5	-174.7	0	0	0	0	0	115.3	A862 L885	A862-G887 PolarHBondContact O-N 3.42Å; L885-G887 PolarHBondContact O-N 3.39Å; L885-G887 VanDerWaalsContact O-N 3.13Å
888	D	89.8	Confident	87.8	Confident	58 Å²	58	60.3 Å²	60.3	31%	0.31	33%	0.329	S	S	.	.			trans	-66.8	146.8	171.9	-70.4	-19.1	0	0	0	111.2	V861 A862 L885 L906	V861-D888 WeakPolarHBondContact CA-O 3.46Å; A862-D888 PolarHBondContact N-O 2.79Å; L885-D888 PolarHBondContact N-OD2 2.84Å; L885-D888 WeakPolarHBondContact O-CB 3.4Å; L885-D888 PolarHBondContact O-N 2.82Å; D888-L906 HydrophobicContact CB-CD1 4.19Å; D888-L906 HydrophobicContact CB-CD2 4.06Å
889	V	90	Very high	87.8	Confident	88 Å²	88	62 Å²	62	53%	0.533	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	112	-178.5	-177.9	0	0	0	0	109.2	A860 L906	A860-V889 WeakPolarHBondContact O-CA 3.45Å; V889-L906 WeakPolarHBondContact O-CD1 3.16Å
890	I	91.7	Very high	88.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.7	-173.6	-51.5	178.9	0	0	0	108.8	A860 F884 L892 E905 L906 V913 I918	A860-I890 PolarHBondContact N-O 2.88Å; A860-I890 PolarHBondContact O-N 2.84Å; F884-I890 HydrophobicContact CB-CD1 4.02Å; F884-I890 HydrophobicContact CD1-CD1 3.67Å; F884-I890 HydrophobicContact CD2-CD1 4Å; F884-I890 HydrophobicContact CE1-CD1 4.05Å; F884-I890 HydrophobicContact CE2-CD1 4.32Å; F884-I890 HydrophobicContact CG-CD1 3.63Å; F884-I890 HydrophobicContact CZ-CD1 4.35Å; I890-L892 HydrophobicContact CG2-CD2 3.91Å; I890-E905 WeakPolarHBondContact CG2-O 3.08Å; I890-L906 HydrophobicContact CG1-CD2 4.49Å; I890-V913 HydrophobicContact CD1-CG1 4.21Å; I890-V913 HydrophobicContact CG2-CG2 4.1Å; I890-I918 HydrophobicContact CD1-CG2 3.98Å
891	T	91.4	Very high	88.5	Confident	46 Å²	46	54.6 Å²	54.6	28%	0.282	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	117.2	173.5	-58.6	0	0	0	0	108.6	I857 Y893 G904 E905	I857-T891 HydrophobicContact CG2-CG2 3.68Å; T891-Y893 HydrophobicContact CG2-CE2 3.82Å; T891-G904 CarbonylContact O-C 3.56Å; T891-G904 VanDerWaalsContact O-CA 3.27Å; T891-G904 WeakPolarHBondContact O-CA 3.32Å; T891-E905 PolarHBondContact N-O 3.3Å; T891-E905 PolarHBondContact O-N 3.29Å
892	L	92.9	Very high	88.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.8	179.1	-54	-176.2	0	0	0	110.4	I857 R858 A860 I890 F902 V913 I918 I920	I857-L892 CarbonylContact C-O 3.55Å; I857-L892 VanDerWaalsContact CA-O 3.25Å; I857-L892 WeakPolarHBondContact CA-O 3.31Å; I857-L892 WeakPolarHBondContact CG2-O 3.48Å; R858-L892 PolarHBondContact N-O 2.92Å; R858-L892 PolarHBondContact O-N 3.38Å; A860-L892 HydrophobicContact CB-CD1 3.68Å; A860-L892 HydrophobicContact CB-CD2 4.46Å; A860-L892 HydrophobicContact CB-CG 3.98Å; I890-L892 HydrophobicContact CG2-CD2 3.91Å; L892-F902 HydrophobicContact CD1-CB 4.27Å; L892-F902 HydrophobicContact CD1-CD1 3.98Å; L892-F902 HydrophobicContact CD1-CD2 4.24Å; L892-F902 HydrophobicContact CD1-CE1 4.35Å; L892-F902 HydrophobicContact CD1-CG 3.92Å; L892-F902 HydrophobicContact CD2-CB 3.93Å; L892-F902 HydrophobicContact CD2-CG 4.47Å; L892-F902 HydrophobicContact CG-CB 4.48Å; L892-V913 HydrophobicContact CD2-CB 4.46Å; L892-V913 HydrophobicContact CD2-CG1 4.41Å; L892-I918 HydrophobicContact CD1-CD1 3.76Å; L892-I918 HydrophobicContact CD2-CD1 4.21Å; L892-I920 HydrophobicContact CD1-CD1 4Å; L892-I920 HydrophobicContact CD1-CG1 3.96Å
893	Y	89.6	Confident	88.6	Confident	33 Å²	33	54.9 Å²	54.9	13%	0.129	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.8	174.6	-63.9	-96.2	0	0	0	108.4	I848 A851 L852 I857 T891 V903 E905 Y910	I848-Y893 HydrophobicContact CG2-CD1 4.1Å; I848-Y893 HydrophobicContact CG2-CE1 4.46Å; A851-Y893 WeakPolarHBondContact CB-O 3.32Å; L852-Y893 HydrophobicContact CD1-CD1 4.39Å; L852-Y893 HydrophobicContact CD2-CD1 3.98Å; L852-Y893 HydrophobicContact CG-CD1 4.15Å; I857-Y893 HydrophobicContact CD1-CD1 4.19Å; I857-Y893 HydrophobicContact CD1-CE1 3.97Å; I857-Y893 HydrophobicContact CG1-CD1 4.05Å; I857-Y893 HydrophobicContact CG1-CE1 4.28Å; T891-Y893 HydrophobicContact CG2-CE2 3.82Å; Y893-V903 PolarHBondContact N-O 2.91Å; Y893-E905 HydrophobicContact CE2-CB 3.82Å; Y893-E905 PolarHBondContact OH-OE2 2.83Å; Y893-E905 VanDerWaalsContact OH-OE2 3.11Å; Y893-Y910 HydrophobicContact CE2-CE1 4.16Å
894	G	87.8	Confident	88.6	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	85.9	-176.6	174.7	0	0	0	0	0	115.2	A851 Q856	A851-G894 WeakPolarHBondContact O-CA 3.42Å; Q856-G894 PolarHBondContact O-N 2.72Å; Q856-G894 VanDerWaalsContact O-N 3.14Å
895	D	86.5	Confident	88.5	Confident	69 Å²	69	53.6 Å²	53.6	37%	0.369	30%	0.299	S	S	.	.	S	Bend	trans	-90.2	158.3	165.3	-82.6	-55.3	0	0	0	110.6	T854 G855 R858	T854-D895 PolarHBondContact OG1-N 3.21Å; T854-D895 PolarHBondContact OG1-O 3.01Å; G855-D895 VanDerWaalsContact CA-OD2 3.3Å; G855-D895 WeakPolarHBondContact CA-OD2 3.4Å; R858-D895 IonicContact CZ-OD1 2.68Å; R858-D895 IonicContact NH1-OD1 3.4Å; R858-D895 PolarHBondContact NH1-OD1 2.86Å; R858-D895 IonicContact NH2-OD1 2.81Å; R858-D895 PolarHBondContact NH2-OD1 3.44Å; R858-D895 IonicContact NH2-OD2 3.16Å
896	M	87.7	Confident	88.5	Confident	94 Å²	94	49.5 Å²	49.5	46%	0.463	28%	0.278	S	S	.	.			trans	-56.2	143.6	-177.5	-159.6	178.8	73.4	0	0	111.8	F901 F902	M896-F901 WeakPolarHBondContact CA-O 3.41Å; M896-F901 VanDerWaalsContact CG-O 3.27Å; M896-F901 WeakPolarHBondContact CG-O 3.27Å; M896-F902 HydrophobicContact CB-CD1 4.27Å; M896-F902 HydrophobicContact CB-CD2 4.49Å; M896-F902 HydrophobicContact CB-CE1 3.75Å; M896-F902 HydrophobicContact CB-CE2 3.99Å; M896-F902 HydrophobicContact CB-CZ 3.59Å; M896-F902 HydrophobicContact CG-CD2 4.14Å; M896-F902 HydrophobicContact CG-CE1 4.41Å; M896-F902 HydrophobicContact CG-CE2 3.79Å; M896-F902 HydrophobicContact CG-CZ 3.93Å; M896-F902 HydrophobicContact SD-CE2 4.03Å; M896-F902 HydrophobicContact SD-CZ 4.31Å
897	D	85.4	Confident	88.3	Confident	57 Å²	57	54.2 Å²	54.2	31%	0.305	30%	0.296	S	S	.	.			trans	-80.2	178	174.1	61.4	36.1	0	0	0	113.4	D899 G900 F901	D897-D899 PolarHBondContact O-N 2.83Å; D897-D899 PolarHBondContact OD1-N 3.16Å; D897-D899 VanDerWaalsContact OD1-N 3.14Å; D897-G900 PolarHBondContact O-N 2.84Å; D897-G900 PolarHBondContact OD1-N 2.88Å; D897-F901 PolarHBondContact N-O 2.84Å; D897-F901 PolarHBondContact OD1-N 3.01Å
898	E	78.5	Confident	87.9	Confident	205 Å²	205	52.7 Å²	52.7	96%	0.958	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-20.8	-178.2	-61	-176.2	168.8	0	0	112.9
899	D	79.6	Confident	87.5	Confident	144 Å²	144	58.5 Å²	58.5	77%	0.77	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-7.7	-180	-67	-57.4	0	0	0	112.7	D897 F901	D897-D899 PolarHBondContact O-N 2.83Å; D897-D899 PolarHBondContact OD1-N 3.16Å; D897-D899 VanDerWaalsContact OD1-N 3.14Å; D899-F901 HydrophobicContact CB-CD2 4.11Å; D899-F901 HydrophobicContact CB-CE2 4.42Å
900	G	86	Confident	87.4	Confident	15 Å²	15	56.6 Å²	56.6	16%	0.155	28%	0.281	C	S	.	.	S	Bend	trans	96.2	18.5	174.3	0	0	0	0	0	115.4	D897 S915	D897-G900 PolarHBondContact O-N 2.84Å; D897-G900 PolarHBondContact OD1-N 2.88Å; G900-S915 WeakPolarHBondContact O-CB 3.46Å; G900-S915 PolarHBondContact O-N 3.18Å; G900-S915 PolarHBondContact O-OG 3.45Å
901	F	90.5	Very high	87.3	Confident	45 Å²	45	56.9 Å²	56.9	20%	0.197	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	161.5	178.1	-63.7	-103.9	0	0	0	111.9	M896 D897 D899 L912 V913 P914	M896-F901 WeakPolarHBondContact CA-O 3.41Å; M896-F901 VanDerWaalsContact CG-O 3.27Å; M896-F901 WeakPolarHBondContact CG-O 3.27Å; D897-F901 PolarHBondContact N-O 2.84Å; D897-F901 PolarHBondContact OD1-N 3.01Å; D899-F901 HydrophobicContact CB-CD2 4.11Å; D899-F901 HydrophobicContact CB-CE2 4.42Å; F901-L912 HydrophobicContact CB-CB 4.2Å; F901-L912 HydrophobicContact CB-CD2 4.26Å; F901-L912 HydrophobicContact CD1-CB 3.85Å; F901-L912 HydrophobicContact CG-CB 4.29Å; F901-V913 CarbonylContact C-O 3.29Å; F901-V913 WeakPolarHBondContact CA-O 3.25Å; F901-P914 HydrophobicContact CD1-CB 3.95Å; F901-P914 HydrophobicContact CE1-CB 3.75Å; F901-P914 HydrophobicContact CE1-CG 4.36Å; F901-P914 HydrophobicContact CZ-CB 4.44Å
902	F	92.1	Very high	87.3	Confident	13 Å²	13	57 Å²	57	6%	0.057	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.7	166.5	-69.4	-92.3	0	0	0	109.6	L892 M896 G904 L912 V913 I918 I920	L892-F902 HydrophobicContact CD1-CB 4.27Å; L892-F902 HydrophobicContact CD1-CD1 3.98Å; L892-F902 HydrophobicContact CD1-CD2 4.24Å; L892-F902 HydrophobicContact CD1-CE1 4.35Å; L892-F902 HydrophobicContact CD1-CG 3.92Å; L892-F902 HydrophobicContact CD2-CB 3.93Å; L892-F902 HydrophobicContact CD2-CG 4.47Å; L892-F902 HydrophobicContact CG-CB 4.48Å; M896-F902 HydrophobicContact CB-CD1 4.27Å; M896-F902 HydrophobicContact CB-CD2 4.49Å; M896-F902 HydrophobicContact CB-CE1 3.75Å; M896-F902 HydrophobicContact CB-CE2 3.99Å; M896-F902 HydrophobicContact CB-CZ 3.59Å; M896-F902 HydrophobicContact CG-CD2 4.14Å; M896-F902 HydrophobicContact CG-CE1 4.41Å; M896-F902 HydrophobicContact CG-CE2 3.79Å; M896-F902 HydrophobicContact CG-CZ 3.93Å; M896-F902 HydrophobicContact SD-CE2 4.03Å; M896-F902 HydrophobicContact SD-CZ 4.31Å; F902-G904 PolarHBondContact O-N 2.65Å; F902-L912 CarbonylContact O-C 3.5Å; F902-L912 WeakPolarHBondContact O-CA 3.49Å; F902-V913 PolarHBondContact N-O 3.5Å; F902-V913 PolarHBondContact O-N 3.03Å; F902-I918 HydrophobicContact CD2-CD1 3.89Å; F902-I918 HydrophobicContact CE2-CD1 4.23Å; F902-I920 HydrophobicContact CE1-CD1 4.01Å; F902-I920 HydrophobicContact CE2-CD1 3.94Å; F902-I920 HydrophobicContact CZ-CD1 3.45Å; F902-I920 VanDerWaalsContact CZ-CD1 3.45Å
903	V	91.4	Very high	87.3	Confident	15 Å²	15	57 Å²	57	9%	0.091	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	116	165.2	176.3	0	0	0	0	108	V847 I848 A851 Y893 L912	V847-V903 HydrophobicContact CG1-CB 4.45Å; V847-V903 HydrophobicContact CG1-CG1 3.94Å; V847-V903 HydrophobicContact CG1-CG2 3.58Å; I848-V903 HydrophobicContact CG1-CG1 4.41Å; A851-V903 HydrophobicContact CB-CB 3.85Å; A851-V903 HydrophobicContact CB-CG1 4.35Å; A851-V903 HydrophobicContact CB-CG2 3.81Å; Y893-V903 PolarHBondContact N-O 2.91Å; V903-L912 HydrophobicContact CG2-CD2 4.27Å
904	G	91.3	Very high	87.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	164.4	-177.2	0	0	0	0	0	114.4	L882 T891 F902 Y910 G911	L882-G904 WeakPolarHBondContact CD1-O 3.43Å; T891-G904 CarbonylContact O-C 3.56Å; T891-G904 VanDerWaalsContact O-CA 3.27Å; T891-G904 WeakPolarHBondContact O-CA 3.32Å; F902-G904 PolarHBondContact O-N 2.65Å; G904-Y910 WeakPolarHBondContact O-CA 3.41Å; G904-G911 PolarHBondContact N-O 3.24Å; G904-G911 PolarHBondContact O-N 3.16Å
905	E	92	Very high	87.6	Confident	36 Å²	36	57.2 Å²	57.2	17%	0.168	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.3	161.6	-171.3	-174.9	154.4	0	0	110.3	I890 T891 Y893 G908 R909 Y910	I890-E905 WeakPolarHBondContact CG2-O 3.08Å; T891-E905 PolarHBondContact N-O 3.3Å; T891-E905 PolarHBondContact O-N 3.29Å; Y893-E905 HydrophobicContact CE2-CB 3.82Å; Y893-E905 PolarHBondContact OH-OE2 2.83Å; Y893-E905 VanDerWaalsContact OH-OE2 3.11Å; E905-G908 WeakPolarHBondContact OE1-CA 3.42Å; E905-R909 VanDerWaalsContact CA-O 3.26Å; E905-R909 WeakPolarHBondContact CA-O 3.43Å; E905-R909 WeakPolarHBondContact CG-O 3.23Å; E905-Y910 HydrophobicContact CB-CD1 3.75Å; E905-Y910 HydrophobicContact CB-CE1 3.59Å; E905-Y910 VanDerWaalsContact CD-OH 3.24Å; E905-Y910 HydrophobicContact CG-CD1 3.96Å; E905-Y910 HydrophobicContact CG-CE1 3.59Å; E905-Y910 WeakPolarHBondContact OE2-CE1 3.46Å; E905-Y910 PolarHBondContact OE2-OH 3.34Å
906	L	89.8	Confident	87.8	Confident	20 Å²	20	60.4 Å²	60.4	11%	0.105	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	129.8	165.9	180	64	0	0	0	109.1	L882 F884 D888 V889 I890 G908 R909	L882-L906 HydrophobicContact CD1-CB 4.35Å; F884-L906 HydrophobicContact CB-CD2 3.45Å; F884-L906 VanDerWaalsContact CB-CD2 3.45Å; D888-L906 HydrophobicContact CB-CD1 4.19Å; D888-L906 HydrophobicContact CB-CD2 4.06Å; V889-L906 WeakPolarHBondContact O-CD1 3.16Å; I890-L906 HydrophobicContact CG1-CD2 4.49Å; L906-G908 PolarHBondContact O-N 3.1Å; L906-G908 VanDerWaalsContact O-N 3.1Å; L906-R909 PolarHBondContact N-O 3.29Å; L906-R909 WeakPolarHBondContact O-CB 3.33Å; L906-R909 PolarHBondContact O-N 2.63Å
907	D	83.6	Confident	87.9	Confident	153 Å²	153	58.1 Å²	58.1	82%	0.818	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	37.7	-178.9	-72	-13.6	0	0	0	114.8	R909	D907-R909 PolarHBondContact O-N 2.77Å
908	G	77.6	Confident	88.2	Confident	15 Å²	15	56.1 Å²	56.1	16%	0.155	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	1.3	-179.3	0	0	0	0	0	115.1	E905 L906	E905-G908 WeakPolarHBondContact OE1-CA 3.42Å; L906-G908 PolarHBondContact O-N 3.1Å; L906-G908 VanDerWaalsContact O-N 3.1Å
909	R	83.1	Confident	88.7	Confident	181 Å²	181	49.8 Å²	49.8	68%	0.683	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	140.8	164.1	-63.9	-175.7	174.7	-157.7	-2.1	109	L882 E905 L906 D907	L882-R909 HydrophobicContact CD2-CB 3.5Å; L882-R909 WeakPolarHBondContact CD2-O 3.4Å; E905-R909 VanDerWaalsContact CA-O 3.26Å; E905-R909 WeakPolarHBondContact CA-O 3.43Å; E905-R909 WeakPolarHBondContact CG-O 3.23Å; L906-R909 PolarHBondContact N-O 3.29Å; L906-R909 WeakPolarHBondContact O-CB 3.33Å; L906-R909 PolarHBondContact O-N 2.63Å; D907-R909 PolarHBondContact O-N 2.77Å
910	Y	87.3	Confident	89.1	Confident	48 Å²	48	45.2 Å²	45.2	19%	0.188	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	149.4	171.1	-62.7	-82.6	0	0	0	110.4	M844 I848 Y893 G904 E905	M844-Y910 HydrophobicContact CG-CD2 4.16Å; M844-Y910 HydrophobicContact CG-CG 4.07Å; M844-Y910 WeakPolarHBondContact SD-CB 3.4Å; M844-Y910 HydrophobicContact SD-CG 4.25Å; I848-Y910 HydrophobicContact CD1-CD1 3.67Å; I848-Y910 HydrophobicContact CD1-CD2 4.33Å; I848-Y910 HydrophobicContact CD1-CE1 3.69Å; I848-Y910 HydrophobicContact CD1-CE2 4.35Å; I848-Y910 HydrophobicContact CD1-CG 4.01Å; I848-Y910 HydrophobicContact CG1-CD1 4.31Å; Y893-Y910 HydrophobicContact CE2-CE1 4.16Å; G904-Y910 WeakPolarHBondContact O-CA 3.41Å; E905-Y910 HydrophobicContact CB-CD1 3.75Å; E905-Y910 HydrophobicContact CB-CE1 3.59Å; E905-Y910 VanDerWaalsContact CD-OH 3.24Å; E905-Y910 HydrophobicContact CG-CD1 3.96Å; E905-Y910 HydrophobicContact CG-CE1 3.59Å; E905-Y910 WeakPolarHBondContact OE2-CE1 3.46Å; E905-Y910 PolarHBondContact OE2-OH 3.34Å
911	G	89.1	Confident	88.7	Confident	5 Å²	5	48.8 Å²	48.8	5%	0.052	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.2	179.9	175.6	0	0	0	0	0	112	E880 G904	E880-G911 CarbonylContact O-C 3.57Å; E880-G911 VanDerWaalsContact O-CA 3.23Å; E880-G911 WeakPolarHBondContact O-CA 3.43Å; G904-G911 PolarHBondContact N-O 3.24Å; G904-G911 PolarHBondContact O-N 3.16Å
912	L	92	Very high	86.8	Confident	48 Å²	48	51.2 Å²	51.2	25%	0.251	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	143.3	174	-62.3	176.5	0	0	0	111.2	E880 E881 L882 F901 F902 V903	E880-L912 PolarHBondContact O-N 2.65Å; E881-L912 WeakPolarHBondContact CA-O 3.48Å; E881-L912 HydrophobicContact CG-CB 4.19Å; L882-L912 PolarHBondContact N-O 2.83Å; F901-L912 HydrophobicContact CB-CB 4.2Å; F901-L912 HydrophobicContact CB-CD2 4.26Å; F901-L912 HydrophobicContact CD1-CB 3.85Å; F901-L912 HydrophobicContact CG-CB 4.29Å; F902-L912 CarbonylContact O-C 3.5Å; F902-L912 WeakPolarHBondContact O-CA 3.49Å; V903-L912 HydrophobicContact CG2-CD2 4.27Å
913	V	93.5	Very high	84.4	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	113.3	-178.3	178.5	0	0	0	0	108.3	L882 F884 I890 L892 F901 F902 S915 I918	L882-V913 HydrophobicContact CB-CG2 4.16Å; L882-V913 HydrophobicContact CD1-CG2 3.77Å; L882-V913 HydrophobicContact CG-CG2 4.39Å; F884-V913 HydrophobicContact CE1-CG1 3.93Å; F884-V913 HydrophobicContact CZ-CG1 4.17Å; I890-V913 HydrophobicContact CD1-CG1 4.21Å; I890-V913 HydrophobicContact CG2-CG2 4.1Å; L892-V913 HydrophobicContact CD2-CB 4.46Å; L892-V913 HydrophobicContact CD2-CG1 4.41Å; F901-V913 CarbonylContact C-O 3.29Å; F901-V913 WeakPolarHBondContact CA-O 3.25Å; F902-V913 PolarHBondContact N-O 3.5Å; F902-V913 PolarHBondContact O-N 3.03Å; V913-S915 PolarHBondContact O-N 2.86Å; V913-I918 HydrophobicContact CG1-CD1 3.92Å; V913-I918 HydrophobicContact CG1-CG1 4.28Å; V913-I918 HydrophobicContact CG1-CG2 3.78Å
914	P	91.8	Very high	81.7	Confident	9 Å²	9	65.3 Å²	65.3	6%	0.058	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	125.5	-178.6	27	-34.4	0	0	0	111.1	Y866 F901 N916 F917	Y866-P914 HydrophobicContact CD1-CG 4.12Å; Y866-P914 HydrophobicContact CD2-CG 4.21Å; Y866-P914 HydrophobicContact CE1-CG 3.78Å; Y866-P914 HydrophobicContact CE2-CG 3.89Å; Y866-P914 HydrophobicContact CG-CG 4.32Å; F901-P914 HydrophobicContact CD1-CB 3.95Å; F901-P914 HydrophobicContact CE1-CB 3.75Å; F901-P914 HydrophobicContact CE1-CG 4.36Å; F901-P914 HydrophobicContact CZ-CB 4.44Å; P914-N916 PolarHBondContact O-N 3.26Å; P914-N916 VanDerWaalsContact O-N 3.07Å; P914-F917 HydrophobicContact CB-CD2 3.97Å; P914-F917 HydrophobicContact CG-CB 4.33Å; P914-F917 HydrophobicContact CG-CD2 3.6Å; P914-F917 HydrophobicContact CG-CE2 4.26Å; P914-F917 HydrophobicContact CG-CG 4.18Å; P914-F917 PolarHBondContact O-N 2.93Å; P914-F917 VanDerWaalsContact O-N 3.09Å
915	S	91	Very high	78.9	Confident	30 Å²	30	71.3 Å²	71.3	21%	0.21	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-53.7	-31.6	-177.9	55.4	0	0	0	0	114.3	G900 V913 F917 I918	G900-S915 WeakPolarHBondContact O-CB 3.46Å; G900-S915 PolarHBondContact O-N 3.18Å; G900-S915 PolarHBondContact O-OG 3.45Å; V913-S915 PolarHBondContact O-N 2.86Å; S915-F917 PolarHBondContact O-N 3.33Å; S915-F917 VanDerWaalsContact O-N 3.16Å; S915-I918 WeakPolarHBondContact O-CG1 3.29Å; S915-I918 PolarHBondContact O-N 3.22Å
916	N	90.4	Very high	76.2	Confident	135 Å²	135	74.5 Å²	74.5	72%	0.722	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-66.8	-10.7	-179.4	-66.7	-54.1	0	0	0	115	P914	P914-N916 PolarHBondContact O-N 3.26Å; P914-N916 VanDerWaalsContact O-N 3.07Å
917	F	90.2	Very high	73.4	Confident	47 Å²	47	80.2 Å²	80.2	21%	0.206	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-108.5	-0.4	-176.4	-72.2	-103.1	0	0	0	113.5	E863 F864 Y866 L871 F884 P914 S915	E863-F917 PolarHBondContact N-O 3.03Å; F864-F917 HydrophobicContact CB-CD1 3.85Å; F864-F917 HydrophobicContact CB-CE1 4.37Å; Y866-F917 AromaticContact CD2-CD1 3.68Å; Y866-F917 HydrophobicContact CD2-CD1 3.68Å; Y866-F917 HydrophobicContact CD2-CD2 4.08Å; Y866-F917 AromaticContact CD2-CE1 3.54Å; Y866-F917 HydrophobicContact CD2-CE1 3.54Å; Y866-F917 AromaticContact CD2-CE2 3.92Å; Y866-F917 HydrophobicContact CD2-CE2 3.92Å; Y866-F917 AromaticContact CD2-CG 3.98Å; Y866-F917 HydrophobicContact CD2-CG 3.98Å; Y866-F917 AromaticContact CD2-CZ 3.66Å; Y866-F917 HydrophobicContact CD2-CZ 3.66Å; Y866-F917 HydrophobicContact CE2-CD2 4.27Å; Y866-F917 HydrophobicContact CE2-CE1 4.22Å; Y866-F917 AromaticContact CE2-CE2 3.86Å; Y866-F917 HydrophobicContact CE2-CE2 3.86Å; Y866-F917 AromaticContact CE2-CZ 3.84Å; Y866-F917 HydrophobicContact CE2-CZ 3.84Å; Y866-F917 HydrophobicContact CG-CD1 4.27Å; Y866-F917 HydrophobicContact CG-CE1 4.5Å; Y866-F917 HydrophobicContact CG-CG 4.48Å; L871-F917 HydrophobicContact CD1-CE1 3.97Å; L871-F917 HydrophobicContact CD1-CZ 4.3Å; F884-F917 HydrophobicContact CE2-CB 3.82Å; F884-F917 HydrophobicContact CZ-CB 3.75Å; P914-F917 HydrophobicContact CB-CD2 3.97Å; P914-F917 HydrophobicContact CG-CB 4.33Å; P914-F917 HydrophobicContact CG-CD2 3.6Å; P914-F917 HydrophobicContact CG-CE2 4.26Å; P914-F917 HydrophobicContact CG-CG 4.18Å; P914-F917 PolarHBondContact O-N 2.93Å; P914-F917 VanDerWaalsContact O-N 3.09Å; S915-F917 PolarHBondContact O-N 3.33Å; S915-F917 VanDerWaalsContact O-N 3.16Å
918	I	91.7	Very high	71.1	Confident	15 Å²	15	76.9 Å²	76.9	8%	0.077	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	149	-170.1	52.2	154.9	0	0	0	113.3	A860 V861 F884 I890 L892 F902 V913 S915	A860-I918 HydrophobicContact CB-CB 4.22Å; A860-I918 HydrophobicContact CB-CD1 4.12Å; V861-I918 CarbonylContact O-C 3.6Å; V861-I918 WeakPolarHBondContact O-CA 3.29Å; F884-I918 HydrophobicContact CE2-CG2 4.3Å; F884-I918 HydrophobicContact CZ-CG2 4.25Å; I890-I918 HydrophobicContact CD1-CG2 3.98Å; L892-I918 HydrophobicContact CD1-CD1 3.76Å; L892-I918 HydrophobicContact CD2-CD1 4.21Å; F902-I918 HydrophobicContact CD2-CD1 3.89Å; F902-I918 HydrophobicContact CE2-CD1 4.23Å; V913-I918 HydrophobicContact CG1-CD1 3.92Å; V913-I918 HydrophobicContact CG1-CG1 4.28Å; V913-I918 HydrophobicContact CG1-CG2 3.78Å; S915-I918 WeakPolarHBondContact O-CG1 3.29Å; S915-I918 PolarHBondContact O-N 3.22Å
919	V	89.9	Confident	69	Low	71 Å²	71	81.5 Å²	81.5	43%	0.43	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.6	172	176.8	0	0	0	0	109.4	A860 V861 E863	A860-V919 CarbonylContact C-O 3.46Å; A860-V919 WeakPolarHBondContact CA-O 3.44Å; A860-V919 WeakPolarHBondContact CB-O 3.3Å; V861-V919 PolarHBondContact N-O 3.17Å; V861-V919 PolarHBondContact O-N 3.08Å; E863-V919 HydrophobicContact CB-CG2 4.25Å; E863-V919 WeakPolarHBondContact OE2-CG2 3.44Å
920	I	87.4	Confident	66.8	Low	49 Å²	49	79.9 Å²	79.9	25%	0.251	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	130.7	-179.4	-56.1	177.5	0	0	0	110.2	R858 A860 L892 F902 S922	R858-I920 HydrophobicContact CB-CG2 4.15Å; A860-I920 HydrophobicContact CB-CG1 4.17Å; L892-I920 HydrophobicContact CD1-CD1 4Å; L892-I920 HydrophobicContact CD1-CG1 3.96Å; F902-I920 HydrophobicContact CE1-CD1 4.01Å; F902-I920 HydrophobicContact CE2-CD1 3.94Å; F902-I920 HydrophobicContact CZ-CD1 3.45Å; F902-I920 VanDerWaalsContact CZ-CD1 3.45Å; I920-S922 PolarHBondContact O-N 2.99Å; I920-S922 VanDerWaalsContact O-N 3.13Å
921	N	77	Confident	64.3	Low	90 Å²	90	82.7 Å²	82.7	48%	0.481	50%	0.498	S	S	.	.			trans	-81	88.9	179.1	-66.3	-39.8	0	0	0	111.2	T859 E923	T859-N921 PolarHBondContact O-N 3.21Å; T859-N921 PolarHBondContact OG1-ND2 2.7Å; N921-E923 PolarHBondContact O-N 3.2Å
922	S	51.9	Low	61.5	Low	96 Å²	96	89.8 Å²	89.8	67%	0.671	54%	0.535	S	S	*	.			trans	-90.5	83.2	-179.3	-59.4	0	0	0	0	113.3	I920	I920-S922 PolarHBondContact O-N 2.99Å; I920-S922 VanDerWaalsContact O-N 3.13Å
923	E	41.3	Very low	59	Low	180 Å²	180	97 Å²	97	84%	0.841	57%	0.568	S	S	*	*			trans	-121	76.6	163.9	-72.1	-161.3	158.2	0	0	111.4	N921 V925	N921-E923 PolarHBondContact O-N 3.2Å; E923-V925 PolarHBondContact O-N 2.86Å
924	D	34.4	Very low	56.2	Low	143 Å²	143	105.8 Å²	105.8	77%	0.765	61%	0.609	S	S	*	*			trans	-69.7	106.1	169.7	-77	-55.9	0	0	0	111
925	V	33.2	Very low	53.5	Low	127 Å²	127	109.2 Å²	109.2	77%	0.77	64%	0.638	S	S	*	*			trans	-119.2	101.8	171.3	-175.3	0	0	0	0	110	E923	E923-V925 PolarHBondContact O-N 2.86Å
926	P	33.9	Very low	50.9	Low	102 Å²	102	119.4 Å²	119.4	66%	0.662	67%	0.672	S	S	*	*			trans	-72.8	147.4	178.6	29.6	-34.3	0	0	0	111.6	A928	P926-A928 PolarHBondContact O-N 3.01Å; P926-A928 VanDerWaalsContact O-N 3.16Å
927	P	31.5	Very low	48.1	Very low	141 Å²	141	120 Å²	120	92%	0.916	68%	0.675	S	S	*	*			trans	-73.7	108.7	-176.2	29	-34.4	0	0	0	111.6
928	A	35.2	Very low	45.3	Very low	83 Å²	83	123.8 Å²	123.8	69%	0.686	70%	0.702	S	S	*	*			trans	-119	110.2	178.7	0	0	0	0	0	111.9	P926	P926-A928 PolarHBondContact O-N 3.01Å; P926-A928 VanDerWaalsContact O-N 3.16Å
929	S	33.2	Very low	42.7	Very low	111 Å²	111	129.3 Å²	129.3	78%	0.776	74%	0.737	S	S	*	*			trans	23.4	99.5	153.5	57.6	0	0	0	0	118.1	S931	S929-S931 PolarHBondContact O-N 3.02Å
930	V	36.7	Very low	39.9	Very low	147 Å²	147	133.3 Å²	133.3	89%	0.891	76%	0.755	S	S	*	*			trans	-73.9	115.6	158.8	-80.5	0	0	0	0	110.5
931	S	34.6	Very low	37.4	Very low	107 Å²	107	137 Å²	137	75%	0.748	78%	0.782	S	S	*	*			trans	-123.9	113.7	161.5	56.5	0	0	0	0	108	S929	S929-S931 PolarHBondContact O-N 3.02Å
932	N	31.6	Very low	35.4	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	80%	0.801	S	S	*	*			trans	-67.9	134.3	175.1	-65.7	-14.9	0	0	0	110.1
933	E	38.1	Very low	34.6	Very low	200 Å²	200	149.2 Å²	149.2	94%	0.935	82%	0.815	S	S	*	*			trans	-140.6	158.2	130.8	-81.5	-143.9	139.4	0	0	108.8
934	E	34.3	Very low	34.4	Very low	184 Å²	184	149 Å²	149	86%	0.86	81%	0.811	S	S	*	*			trans	-98.4	168.8	-161.9	-60.9	177.3	93	0	0	113.9
935	A	36.5	Very low	34.3	Very low	82 Å²	82	151 Å²	151	68%	0.678	82%	0.816	S	S	*	*			trans	56.7	102.1	146.7	0	0	0	0	0	118.7
936	R	35.4	Very low	34.3	Very low	243 Å²	243	148.2 Å²	148.2	92%	0.917	81%	0.813	S	S	*	*				-175	143.8	91.8	-98.8	156.3	-172.9	165.2	5.2	116.6
937	D	33.1	Very low	34.3	Very low	148 Å²	148	149.9 Å²	149.9	79%	0.791	82%	0.821	S	S	*	*			trans	71.5	146.7	149.5	-141.3	-11.5	0	0	0	119.6
938	T	31.2	Very low	34.3	Very low	126 Å²	126	148.7 Å²	148.7	77%	0.773	81%	0.812	S	S	*	*			trans	-140.2	106.7	-171.1	-57.7	0	0	0	0	109.9
939	T	35.9	Very low	34.3	Very low	131 Å²	131	155.3 Å²	155.3	80%	0.804	83%	0.825	S	S	*	*			trans	-127.6	130	170.1	49.3	0	0	0	0	112.2
940	L	32.4	Very low	34.4	Very low	155 Å²	155	154.5 Å²	154.5	81%	0.812	83%	0.825	S	S	*	*			trans	-87.3	148.4	-175	-66.5	161.9	0	0	0	111.8
941	P	33.6	Very low	34.6	Very low	127 Å²	127	153 Å²	153	83%	0.825	82%	0.819	S	S	*	*			trans	-106.9	108.5	156	33.5	-24.5	0	0	0	111
942	Q	35.4	Very low	34.7	Very low	189 Å²	189	155.2 Å²	155.2	88%	0.883	82%	0.822	S	S	*	*			trans	-106.7	156.4	161.4	-80.3	-163	-20.4	0	0	111.4
943	R	35.1	Very low	35	Very low	254 Å²	254	152.5 Å²	152.5	96%	0.958	82%	0.815	S	S	*	*			trans	-79.9	163.1	-169.7	-96	175.6	161.7	160.9	-7.3	113.6
944	K	36.1	Very low	34.9	Very low	176 Å²	176	149.7 Å²	149.7	77%	0.765	81%	0.805	S	S	*	*			trans	-76.1	170.4	-179.9	-68.5	-178.4	171	-176.3	0	113.9
945	E	33.9	Very low	34.9	Very low	183 Å²	183	147.4 Å²	147.4	86%	0.855	80%	0.798	S	S	*	*			trans	67.5	135.6	167.2	-64.1	130.4	-122.5	0	0	114
946	G	32.7	Very low	34.7	Very low	70 Å²	70	152.8 Å²	152.8	72%	0.722	80%	0.801	S	S	*	*			cis	158.9	152.1	5	0	0	0	0	0	106
947	V	34.1	Very low	34.8	Very low	136 Å²	136	146.9 Å²	146.9	82%	0.824	78%	0.784	S	S	*	*			cis	-154.5	155.6	23.4	158.6	0	0	0	0	109.7
948	T	30.3	Very low	34.8	Very low	117 Å²	117	147.3 Å²	147.3	72%	0.718	78%	0.779	S	S	*	*			trans	-10.8	141.1	174.3	60.3	0	0	0	0	122.6
949	F	35.9	Very low	35.2	Very low	221 Å²	221	147.7 Å²	147.7	97%	0.969	78%	0.776	S	S	*	*				-149.9	164.9	122.2	-107.4	-76.1	0	0	0	110.5
950	A	36.1	Very low	35.2	Very low	94 Å²	94	145.8 Å²	145.8	78%	0.777	77%	0.774	S	S	*	*			trans	-117	165.2	-159.4	0	0	0	0	0	115.6
951	P	40.1	Very low	35.6	Very low	117 Å²	117	143.3 Å²	143.3	76%	0.76	77%	0.767	S	S	*	*			trans	-113.5	174.9	-162.1	42.7	-35.3	0	0	0	116.4
952	N	36.7	Very low	35.5	Very low	152 Å²	152	145.4 Å²	145.4	81%	0.813	77%	0.765	S	S	*	*			trans	-167.4	125.3	153.9	-99.5	-33	0	0	0	109.2
953	S	37.9	Very low	35.3	Very low	97 Å²	97	143.6 Å²	143.6	68%	0.678	76%	0.757	S	S	*	*				85.8	146.8	91.6	92.8	0	0	0	0	113.4
954	I	35.3	Very low	35.2	Very low	141 Å²	141	136.2 Å²	136.2	72%	0.723	74%	0.744	S	S	*	*			cis	-166.8	158.3	6	-140.6	171.3	0	0	0	112.6
955	L	35.5	Very low	35.2	Very low	137 Å²	137	138 Å²	138	72%	0.717	75%	0.746	S	S	*	*			trans	65.6	139.5	162.4	-63.1	174.3	0	0	0	119.4
956	R	32.2	Very low	35.3	Very low	194 Å²	194	136.7 Å²	136.7	73%	0.732	75%	0.745	S	S	*	*			cis	87.5	143.2	47.7	-98.9	-173.6	143	-164.9	-18.2	113.2
957	E	36.4	Very low	35.2	Very low	119 Å²	119	137.3 Å²	137.3	56%	0.556	74%	0.744	S	S	*	*			cis	-165.5	151.6	-3.4	-146.6	173.4	-160.5	0	0	112.9
958	K	35	Very low	35.2	Very low	158 Å²	158	139.2 Å²	139.2	69%	0.687	74%	0.743	S	S	*	*			trans	70.7	155.1	135.3	-104	179.9	158.6	-148.2	0	128.4
959	D	39.3	Very low	35.1	Very low	133 Å²	133	140 Å²	140	71%	0.711	75%	0.748	S	S	*	*			trans	87.6	148.4	146.1	-62.7	-25	0	0	0	122.8
960	A	35.2	Very low	34.8	Very low	92 Å²	92	133 Å²	133	76%	0.76	74%	0.738	S	S	*	*			trans	-142.2	-158.5	-176.4	0	0	0	0	0	107.1
961	P	40	Very low	34.7	Very low	102 Å²	102	138.6 Å²	138.6	66%	0.662	75%	0.745	S	S	*	*			cis	-140.8	-164.5	-1.2	44.4	-23.7	0	0	0	115
962	E	33.1	Very low	34.1	Very low	171 Å²	171	142.5 Å²	142.5	80%	0.799	75%	0.753	S	S	*	*			trans	57.3	165.7	150.9	-76.5	176.8	-175.2	0	0	120.2
963	E	31	Very low	34	Very low	152 Å²	152	138.9 Å²	138.9	71%	0.71	75%	0.752	S	S	*	*			cis	-153.4	151	-17.5	-135.5	-150.6	141.7	0	0	109.8
964	S	33.1	Very low	33.6	Very low	98 Å²	98	139.5 Å²	139.5	69%	0.685	76%	0.763	S	S	*	*			trans	62.1	174.9	154	87.2	0	0	0	0	117.7
965	R	34.7	Very low	33.6	Very low	213 Å²	213	136.4 Å²	136.4	80%	0.804	77%	0.766	S	S	*	*			cis	-157.3	-178.6	-34.2	-114.4	179.8	-170.7	170.7	6.8	108.6
966	D	36.8	Very low	33.4	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	77%	0.767	S	S	*	*			trans	67.9	165.7	166.9	-51.5	-29.9	0	0	0	117.3
967	A	31.6	Very low	33.6	Very low	84 Å²	84	137.7 Å²	137.7	69%	0.694	77%	0.772	S	S	*	*			cis	-176.1	-175.2	-42.3	0	0	0	0	0	108.1
968	E	33.3	Very low	33.4	Very low	175 Å²	175	137.9 Å²	137.9	82%	0.818	77%	0.773	S	S	*	*			trans	69	92.1	164.4	-61.2	-148.4	122.3	0	0	121.4
969	T	27.5	Very low	33.5	Very low	134 Å²	134	139.6 Å²	139.6	82%	0.822	78%	0.783	S	S	*	*				35.7	124	117.3	57.1	0	0	0	0	122.6
970	G	30.6	Very low	33.1	Very low	74 Å²	74	137.1 Å²	137.1	76%	0.763	78%	0.781	S	S	*	*			trans	132.6	151.4	156.8	0	0	0	0	0	113.6
971	K	33.4	Very low	33.1	Very low	211 Å²	211	140.2 Å²	140.2	92%	0.917	79%	0.785	S	S	*	*			cis	-148.4	169.7	-1.4	-101	175.6	-175.7	167.8	0	111.3
972	Q	28.5	Very low	32.9	Very low	199 Å²	199	139.8 Å²	139.8	93%	0.93	78%	0.784	S	S	*	*			trans	-61.7	158.4	179.9	-58.8	156.4	-10.7	0	0	115.1
973	G	34.1	Very low	33	Very low	76 Å²	76	139.5 Å²	139.5	78%	0.784	79%	0.787	S	S	*	*			trans	159.5	92.4	169	0	0	0	0	0	110.8
974	A	30.1	Very low	33.4	Very low	110 Å²	110	137.5 Å²	137.5	91%	0.909	79%	0.787	S	S	*	*			cis	82.5	105.1	40.5	0	0	0	0	0	114
975	G	35.4	Very low	33.2	Very low	76 Å²	76	140.3 Å²	140.3	78%	0.784	79%	0.79	S	S	*	*			trans	138.7	94.6	-178	0	0	0	0	0	110.5
976	R	30.5	Very low	33.2	Very low	196 Å²	196	139.4 Å²	139.4	74%	0.74	80%	0.795	S	S	*	*			cis	80.7	89.5	39.9	-165.3	-168.5	177.6	166.9	4.9	114.8	Q978	R976-Q978 HydrophobicContact CG-CG 4.23Å
977	I	36.9	Very low	33	Very low	163 Å²	163	139.4 Å²	139.4	84%	0.836	79%	0.79	S	S	*	*			trans	-157.2	118.3	141.8	-85	128.4	0	0	0	103.5
978	Q	32.3	Very low	33.3	Very low	123 Å²	123	140.9 Å²	140.9	58%	0.575	80%	0.795	S	S	*	*			cis	78.4	89.7	39.9	-64	-172.8	125.2	0	0	116	R976	R976-Q978 HydrophobicContact CG-CG 4.23Å
979	Q	36.7	Very low	33.5	Very low	193 Å²	193	143 Å²	143	90%	0.902	80%	0.795	S	S	*	*				-176.1	128.2	125.9	-96	160.5	27.6	0	0	107.3
980	A	31.5	Very low	34.1	Very low	82 Å²	82	143.7 Å²	143.7	68%	0.678	79%	0.789	S	S	*	*			cis	106.5	148.6	19.9	0	0	0	0	0	113.5
981	N	35.2	Very low	34.4	Very low	157 Å²	157	145.1 Å²	145.1	84%	0.84	79%	0.788	S	S	*	*			trans	82.2	143.7	-178.9	-52.4	-12.1	0	0	0	115.6
982	S	35	Very low	34.8	Very low	92 Å²	92	141.8 Å²	141.8	64%	0.643	78%	0.779	S	S	*	*			cis	176.3	127.1	-24.7	48.2	0	0	0	0	106.5
983	L	34.1	Very low	35.1	Very low	165 Å²	165	141.4 Å²	141.4	86%	0.864	78%	0.775	S	S	*	*				56.8	153.2	98.9	-68.1	166.2	0	0	0	116.4
984	P	39.8	Very low	35.3	Very low	110 Å²	110	141.3 Å²	141.3	71%	0.714	77%	0.766	S	S	*	*			cis	-135.4	-160.4	-5	38.7	-17.3	0	0	0	114.9
985	E	30	Very low	35.5	Very low	157 Å²	157	142.6 Å²	142.6	73%	0.734	76%	0.758	S	S	*	*			trans	-54.9	159.9	175.2	-52.3	153.3	90.5	0	0	117.5
986	E	35.1	Very low	35.4	Very low	195 Å²	195	146.6 Å²	146.6	91%	0.911	76%	0.756	S	S	*	*				-149	171.3	126.6	-136.9	-168.6	161.4	0	0	111.8
987	Q	32.3	Very low	35.6	Very low	156 Å²	156	143.1 Å²	143.1	73%	0.729	76%	0.757	S	S	*	*			trans	-128	141	-163.1	-53.1	173.5	7.3	0	0	113.1
988	S	36.9	Very low	35.3	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	75%	0.753	S	S	*	*			trans	-176.4	130.1	138	33.5	0	0	0	0	116
989	R	38.7	Very low	35.3	Very low	218 Å²	218	139.1 Å²	139.1	82%	0.823	76%	0.762	S	S	*	*				31.9	142	127.1	-58.6	-175.4	-179.7	-165.5	1.8	120.2
990	Q	39.4	Very low	35.3	Very low	149 Å²	149	135 Å²	135	70%	0.696	76%	0.761	S	S	*	*			cis	-170.9	137.5	0.6	-118.7	166.3	-22.8	0	0	112.2
991	S	37.3	Very low	35.3	Very low	105 Å²	105	134.4 Å²	134.4	73%	0.734	76%	0.763	S	S	*	*			trans	66.4	159.1	144.6	83.4	0	0	0	0	118.9
992	L	40.3	Very low	35.5	Very low	140 Å²	140	133.3 Å²	133.3	73%	0.733	77%	0.765	S	S	*	*			cis	-132.4	133	-2.2	-80.5	175.5	0	0	0	108.1
993	K	36.7	Very low	35.5	Very low	192 Å²	192	134.7 Å²	134.7	84%	0.835	77%	0.769	S	S	*	*				55.5	138.8	94.6	-67.1	-169	-179.5	-179.3	0	116.8
994	A	37.2	Very low	35.6	Very low	74 Å²	74	133.2 Å²	133.2	61%	0.612	76%	0.761	S	S	*	*			cis	-171.9	156.7	-13.7	0	0	0	0	0	111.8
995	N	33.7	Very low	35.3	Very low	137 Å²	137	137.7 Å²	137.7	73%	0.733	76%	0.764	S	S	*	*			trans	61.6	157.2	141.7	-73.8	16.7	0	0	0	122
996	Q	33.1	Very low	35.7	Very low	159 Å²	159	135.6 Å²	135.6	74%	0.743	75%	0.754	S	S	*	*			cis	179.8	-175.1	-36	-115.8	-175.7	29.9	0	0	107.9
997	V	36.1	Very low	35.9	Very low	124 Å²	124	128.4 Å²	128.4	75%	0.752	73%	0.728	S	S	*	*			trans	78.5	87	160.6	-158.1	0	0	0	0	118.1
998	S	30.7	Very low	36.1	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	73%	0.726	S	S	*	*			trans	-28.8	153.2	144.1	53.2	0	0	0	0	119.7
999	A	32.2	Very low	36.2	Very low	93 Å²	93	127.3 Å²	127.3	77%	0.769	72%	0.718	S	S	*	*				139.9	151.2	116	0	0	0	0	0	116.9
1000	A	36.4	Very low	36.5	Very low	107 Å²	107	123.1 Å²	123.1	88%	0.884	71%	0.712	S	S	*	*			trans	71	146.7	161.6	0	0	0	0	0	121.2
1001	G	30.5	Very low	37.2	Very low	70 Å²	70	121.2 Å²	121.2	72%	0.722	71%	0.712	S	S	*	*			trans	-106.7	-150.2	167.4	0	0	0	0	0	111.7
1002	P	40.9	Very low	37.6	Very low	134 Å²	134	121.5 Å²	121.5	87%	0.87	71%	0.711	S	S	*	*			cis	-132.7	-111.5	17	39.4	-17.5	0	0	0	115.7
1003	T	34.9	Very low	37.6	Very low	120 Å²	120	125.6 Å²	125.6	74%	0.736	72%	0.717	S	S	*	*			trans	-131.8	157.3	-142.1	8.7	0	0	0	0	120.2
1004	L	35.1	Very low	37.7	Very low	134 Å²	134	124 Å²	124	70%	0.702	71%	0.71	S	S	*	*			trans	85.9	138.7	142.6	-76.8	164.7	0	0	0	125
1005	R	34.6	Very low	37.8	Very low	205 Å²	205	128.4 Å²	128.4	77%	0.774	72%	0.72	S	S	*	*			trans	74.6	153.9	146.3	-72.7	167.3	-172.9	-148	1.4	120.3
1006	H	38.6	Very low	38	Very low	113 Å²	113	125.8 Å²	125.8	52%	0.523	72%	0.717	S	S	.	*			cis	-170.1	177	-26.8	-114	-2.8	0	0	0	112.7	R708 Q709	R708-H1006 PolarHBondContact N-NE2 2.83Å; R708-H1006 VanDerWaalsContact N-NE2 3.13Å; R708-H1006 VanDerWaalsContact O-CG 3.3Å; R708-H1006 PolarHBondContact O-ND1 3.17Å; Q709-H1006 CarbonylContact O-C 3.53Å; Q709-H1006 VanDerWaalsContact O-CA 3.3Å; Q709-H1006 WeakPolarHBondContact O-CA 3.32Å; Q709-H1006 PolarHBondContact O-ND1 3.45Å
1007	A	38	Very low	38.2	Very low	44 Å²	44	126.9 Å²	126.9	36%	0.364	72%	0.723	S	S	.	*			trans	79.3	173.9	162.9	0	0	0	0	0	118.1	R708 Q709	R708-A1007 PolarHBondContact O-N 3.08Å; Q709-A1007 PolarHBondContact O-N 3.35Å; Q709-A1007 VanDerWaalsContact O-N 3.14Å
1008	K	36.2	Very low	38.1	Very low	157 Å²	157	126 Å²	126	68%	0.683	72%	0.722	S	S	*	*			cis	-161.8	166.9	-15.9	-126.3	171.7	-165.7	179.2	0	112.2
1009	S	39.9	Very low	38.8	Very low	91 Å²	91	126.7 Å²	126.7	64%	0.636	72%	0.724	S	S	*	*			trans	49.1	159.6	155	51.9	0	0	0	0	126.1	R708	R708-S1009 VanDerWaalsContact NH2-N 3.11Å
1010	D	45.5	Very low	39.1	Very low	130 Å²	130	126.2 Å²	126.2	70%	0.695	72%	0.72	S	S	*	*			cis	-168.8	165.4	-44.8	-95.9	-49.4	0	0	0	110.7	R708	R708-D1010 IonicContact NH2-OD2 3.31Å; R708-D1010 PolarHBondContact NH2-OD2 2.79Å
1011	P	53.9	Low	39.2	Very low	109 Å²	109	130.2 Å²	130.2	71%	0.708	72%	0.717	S	S	*	*			trans	-108.4	-178.3	-163.3	42.3	-37.6	0	0	0	116.6
1012	P	45.2	Very low	39.5	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	73%	0.726	S	S	*	*				-164.2	164.3	106.2	42.8	-23	0	0	0	121.1
1013	R	40.5	Very low	39.3	Very low	226 Å²	226	133.7 Å²	133.7	85%	0.853	72%	0.719	S	S	*	*			trans	63.5	155.5	137.9	-80.7	-176.7	176.9	-165.6	1.4	122.5
1014	K	39.2	Very low	39.5	Very low	158 Å²	158	133.8 Å²	133.8	69%	0.687	72%	0.724	S	S	*	*			cis	-172.8	162.4	-15.1	-159.9	-171.4	-177	-162	0	111.2
1015	M	38.6	Very low	39.6	Very low	168 Å²	168	132.8 Å²	132.8	83%	0.828	73%	0.729	S	S	*	*			trans	72	162.6	164.7	-44.3	-163.3	-52.2	0	0	116.8
1016	A	38.4	Very low	39.6	Very low	81 Å²	81	126.2 Å²	126.2	67%	0.669	73%	0.725	S	S	*	*			cis	-171.8	176.4	-37.8	0	0	0	0	0	108.1
1017	E	36.8	Very low	39.7	Very low	182 Å²	182	129.4 Å²	129.4	85%	0.85	74%	0.74	S	S	*	*			cis	-150.4	-121.4	-2.3	-153.6	146.6	99	0	0	114.2
1018	S	33.9	Very low	39.6	Very low	107 Å²	107	134.6 Å²	134.6	75%	0.748	76%	0.756	S	S	*	*			trans	-161.4	-167.3	-178.1	-51.9	0	0	0	0	111.4
1019	P	46.6	Very low	39.5	Very low	122 Å²	122	132.3 Å²	132.3	79%	0.792	76%	0.756	S	S	*	*			cis	-137.8	-175.6	-21	39.2	-19.7	0	0	0	116.6
1020	A	36.6	Very low	39.4	Very low	83 Å²	83	132.4 Å²	132.4	69%	0.686	76%	0.756	S	S	*	*			trans	98.2	135.7	132.9	0	0	0	0	0	126.8
1021	K	39.3	Very low	39.1	Very low	190 Å²	190	135.6 Å²	135.6	83%	0.826	76%	0.764	S	S	*	*			trans	98.6	133.2	130.7	-90.7	165.9	-177.9	172.6	0	124.7
1022	K	37.4	Very low	38.3	Very low	208 Å²	208	138.8 Å²	138.8	90%	0.904	77%	0.766	S	S	*	*			trans	71.4	149	158.5	-61.7	172.3	177.8	-177	0	118.6
1023	G	36.6	Very low	37.7	Very low	69 Å²	69	140.9 Å²	140.9	71%	0.711	77%	0.771	S	S	*	*			cis	164.8	161.4	-12.1	0	0	0	0	0	114.8
1024	S	38	Very low	37.4	Very low	123 Å²	123	134.2 Å²	134.2	86%	0.86	76%	0.764	S	S	*	*			trans	67.8	160.4	169.7	-105.2	0	0	0	0	119.3
1025	S	37.3	Very low	37.3	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	77%	0.773	S	S	*	*			cis	-177.1	156.9	-27.5	45	0	0	0	0	112.3
1026	G	35.9	Very low	37.2	Very low	67 Å²	67	133.9 Å²	133.9	69%	0.691	77%	0.771	S	S	*	*			trans	113.9	124.2	169.2	0	0	0	0	0	114.8
1027	Q	39.8	Very low	37.1	Very low	180 Å²	180	135 Å²	135	84%	0.841	78%	0.775	S	S	*	*				71	136.4	73.5	-83.9	-171.9	-75.2	0	0	115.1
1028	Q	36.8	Very low	37.2	Very low	152 Å²	152	130.8 Å²	130.8	71%	0.71	77%	0.765	S	S	*	*			cis	-170.3	173.7	-14.6	-139.6	-175.8	-27.1	0	0	111.1
1029	V	34.2	Very low	37.3	Very low	110 Å²	110	133.2 Å²	133.2	67%	0.667	77%	0.77	S	S	*	*			trans	74.4	97.6	147.6	169.2	0	0	0	0	121.1
1030	S	36.3	Very low	36.8	Very low	92 Å²	92	137.5 Å²	137.5	64%	0.643	77%	0.77	S	S	*	*				78.5	148.7	115.1	-59.1	0	0	0	0	125.8
1031	K	39.6	Very low	36.9	Very low	198 Å²	198	142.4 Å²	142.4	86%	0.861	78%	0.776	S	S	*	*			trans	73.3	152.1	149	-75	160.1	-174.2	177.4	0	118.1
1032	K	36.9	Very low	36.7	Very low	175 Å²	175	141.2 Å²	141.2	76%	0.761	77%	0.773	S	S	*	*			cis	-169.9	160.9	-26.4	-148.7	-168.5	172.8	-172.5	0	109
1033	L	32.6	Very low	37	Very low	154 Å²	154	137.5 Å²	137.5	81%	0.806	77%	0.77	S	S	*	*			trans	72.3	142.2	156.6	-72.1	165	0	0	0	121.4
1034	A	34.2	Very low	36.8	Very low	87 Å²	87	140 Å²	140	72%	0.719	77%	0.772	S	S	*	*			trans	-81.3	179.1	-179.1	0	0	0	0	0	115.4
1035	I	38.4	Very low	36.8	Very low	170 Å²	170	137.8 Å²	137.8	87%	0.872	77%	0.769	S	S	*	*			trans	-167.4	156.4	137	-100.7	152.8	0	0	0	111.4
1036	N	34.9	Very low	36.6	Very low	148 Å²	148	138.5 Å²	138.5	79%	0.791	77%	0.769	S	S	*	*			trans	-77.8	166.3	-179	-60	-34.8	0	0	0	112.4
1037	S	36.3	Very low	36.7	Very low	105 Å²	105	143 Å²	143	73%	0.734	77%	0.772	S	S	*	*				162.6	155.3	71.7	50	0	0	0	0	115.7
1038	S	40.4	Very low	36.6	Very low	93 Å²	93	142.5 Å²	142.5	65%	0.65	77%	0.769	S	S	*	*			trans	83.2	121.4	140.2	76.3	0	0	0	0	124.5
1039	N	35.1	Very low	36.4	Very low	158 Å²	158	138.7 Å²	138.7	85%	0.845	77%	0.77	S	S	*	*			trans	64.3	152.3	135.1	-58.3	-28.3	0	0	0	120.2
1040	R	36.4	Very low	36.6	Very low	213 Å²	213	143.4 Å²	143.4	80%	0.804	78%	0.782	S	S	*	*			cis	-169.3	128.7	40.3	-167.2	-179.4	-158.6	-157.3	7.7	115.3
1041	K	38.6	Very low	36.5	Very low	185 Å²	185	143.4 Å²	143.4	80%	0.804	78%	0.782	S	S	*	*			trans	62.9	142.1	149.8	-70.5	-175.4	174.9	-164.7	0	123.5
1042	Q	35.5	Very low	36.4	Very low	165 Å²	165	142.1 Å²	142.1	77%	0.771	78%	0.779	S	S	*	*			trans	-89.8	-177.7	156	-62	178.5	-11.8	0	0	111.5
1043	P	42.2	Very low	36.4	Very low	130 Å²	130	137.8 Å²	137.8	84%	0.844	78%	0.776	S	S	*	*				-143.2	-172.5	99.8	40.7	-26.3	0	0	0	115.9
1044	T	33.8	Very low	36.5	Very low	122 Å²	122	137.3 Å²	137.3	75%	0.748	77%	0.774	S	S	*	*			trans	-105.9	167.2	-162.4	49.6	0	0	0	0	115.9
1045	G	37.5	Very low	36.6	Very low	77 Å²	77	141.9 Å²	141.9	79%	0.794	78%	0.778	S	S	*	*			trans	-152.9	147.8	164.5	0	0	0	0	0	111
1046	T	33.2	Very low	36.3	Very low	128 Å²	128	137.1 Å²	137.1	79%	0.785	77%	0.77	S	S	*	*			trans	-142.2	176.4	-160.8	-34.5	0	0	0	0	112.2
1047	Q	39	Very low	36.2	Very low	161 Å²	161	135.7 Å²	135.7	75%	0.752	77%	0.772	S	S	*	*			trans	91.5	148.2	172.9	-53.8	-175.3	45.9	0	0	115.1
1048	Q	37.3	Very low	36.1	Very low	170 Å²	170	139.4 Å²	139.4	79%	0.794	78%	0.777	S	S	*	*			cis	-155.9	159.5	-15.4	-114.6	174.9	27.8	0	0	108.2
1049	G	31.7	Very low	35.9	Very low	71 Å²	71	141.1 Å²	141.1	73%	0.732	78%	0.783	S	S	*	*			trans	-116.2	163.2	178.6	0	0	0	0	0	114.2
1050	K	38.2	Very low	36	Very low	209 Å²	209	142.5 Å²	142.5	91%	0.909	78%	0.782	S	S	*	*			trans	-154.7	152.8	167.5	-110	166.8	-174.4	175.4	0	112.5
1051	S	35.4	Very low	36.1	Very low	92 Å²	92	143.1 Å²	143.1	64%	0.643	78%	0.784	S	S	*	*			trans	-72.4	163.2	-177.1	42.1	0	0	0	0	113.2
1052	H	37.7	Very low	36	Very low	172 Å²	172	141.4 Å²	141.4	80%	0.796	78%	0.784	S	S	*	*				-165.9	149.9	60.2	-107.7	-86.5	0	0	0	116.3
1053	A	36.9	Very low	36.1	Very low	84 Å²	84	140.5 Å²	140.5	69%	0.694	79%	0.79	S	S	*	*			trans	48.9	106.4	138.3	0	0	0	0	0	123.7
1054	D	33.7	Very low	35.8	Very low	143 Å²	143	137.9 Å²	137.9	77%	0.765	79%	0.786	S	S	*	*				85.3	152.9	115.3	-160.8	32.6	0	0	0	122.1
1055	K	37	Very low	36.1	Very low	184 Å²	184	141.2 Å²	141.2	80%	0.8	79%	0.793	S	S	*	*			trans	79	92	167.8	-51.5	-171.1	-177.9	174.5	0	120.4
1056	G	32.6	Very low	36.4	Very low	69 Å²	69	140.5 Å²	140.5	71%	0.711	79%	0.786	S	S	*	*				102.9	122.1	108.8	0	0	0	0	0	121.1
1057	S	31.6	Very low	36.9	Very low	118 Å²	118	140.6 Å²	140.6	83%	0.825	78%	0.781	S	S	*	*			trans	81.7	147.4	151.7	81.3	0	0	0	0	121.3
1058	H	34.5	Very low	37.3	Very low	183 Å²	183	135.9 Å²	135.9	85%	0.847	78%	0.775	S	S	*	*			trans	37	111.2	166.1	-86.6	-72.4	0	0	0	121.5
1059	V	37.1	Very low	37.7	Very low	129 Å²	129	136.6 Å²	136.6	78%	0.782	78%	0.776	S	S	*	*			trans	-109.7	115.3	158.3	176.3	0	0	0	0	109.8	R1061	V1059-R1061 HydrophobicContact CG1-CG 4.49Å
1060	K	36.7	Very low	38.2	Very low	187 Å²	187	139.8 Å²	139.8	81%	0.813	77%	0.773	S	S	*	*			trans	-81.6	148.8	157.2	-76.6	-175.3	175.2	-177.5	0	109.1
1061	R	37.8	Very low	38.5	Very low	227 Å²	227	137 Å²	137	86%	0.857	76%	0.757	S	S	*	*			trans	-114.7	99.4	167.8	-73.5	-175.7	-179.4	159.5	0.7	110.3	V1059	V1059-R1061 HydrophobicContact CG1-CG 4.49Å
1062	D	36.1	Very low	39.3	Very low	148 Å²	148	139.2 Å²	139.2	79%	0.791	76%	0.755	S	S	*	*			trans	-86.9	124.8	159.9	-77.5	-60	0	0	0	109.4
1063	T	37.5	Very low	40.5	Very low	146 Å²	146	139 Å²	139	90%	0.896	75%	0.752	S	S	*	*			trans	-163.1	85.9	166	-9.2	0	0	0	0	110.9
1064	G	36.2	Very low	41.6	Very low	75 Å²	75	141 Å²	141	77%	0.773	75%	0.75	S	S	*	*			trans	-144.2	4.4	-171.7	0	0	0	0	0	118.1
1065	Q	41.1	Very low	42.9	Very low	192 Å²	192	140.3 Å²	140.3	90%	0.897	75%	0.75	S	S	*	*			trans	-97.4	3.2	-171.8	-70.4	-171.9	-12.4	0	0	116
1066	G	42.3	Very low	43.7	Very low	63 Å²	63	139.6 Å²	139.6	65%	0.649	75%	0.75	S	S	*	*	S	Bend	trans	-78.5	-34.2	-173.8	0	0	0	0	0	116
1067	I	45.2	Very low	44.3	Very low	130 Å²	130	143.2 Å²	143.2	67%	0.667	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-34.4	-161	-65	171	0	0	0	113	K1069 M1070	I1067-K1069 PolarHBondContact O-N 3.21Å; I1067-K1069 VanDerWaalsContact O-N 3.15Å; I1067-M1070 PolarHBondContact O-N 2.97Å
1068	G	46.3	Very low	44.9	Very low	62 Å²	62	144.5 Å²	144.5	64%	0.639	75%	0.748	S	S	*	*	H	α-helix	trans	-63.7	-21.9	-173.8	0	0	0	0	0	115.6
1069	K	45.8	Very low	45.5	Very low	184 Å²	184	142.3 Å²	142.3	80%	0.8	74%	0.742	S	S	*	*	H	α-helix	trans	-83	-15.5	-179.6	-69.9	-175.8	179	177.8	0	114.2	I1067	I1067-K1069 PolarHBondContact O-N 3.21Å; I1067-K1069 VanDerWaalsContact O-N 3.15Å
1070	M	43	Very low	46	Very low	138 Å²	138	143.1 Å²	143.1	68%	0.68	74%	0.74	S	S	*	*	H	α-helix	trans	-82.1	-41.4	-178.4	-162.8	174	-67	0	0	111.8	I1067 K1072 K1073	I1067-M1070 PolarHBondContact O-N 2.97Å; M1070-K1072 PolarHBondContact O-N 2.91Å; M1070-K1073 PolarHBondContact O-N 2.67Å
1071	W	43.2	Very low	46.6	Very low	151 Å²	151	140.4 Å²	140.4	57%	0.572	74%	0.735	S	S	*	*	H	α-helix	trans	-62.6	-36.9	-178.1	-80.4	86.4	0	0	0	114	K1073 I1074	W1071-K1073 PolarHBondContact O-N 3.08Å; W1071-I1074 PolarHBondContact O-N 2.7Å
1072	K	53.1	Low	47.2	Very low	138 Å²	138	134.6 Å²	134.6	60%	0.6	73%	0.727	S	S	*	*	H	α-helix	trans	-61.7	-30.7	179.5	-160.1	-179.7	-171.9	-125.8	0	112.5	M1070 I1074 V1075 E1076	M1070-K1072 PolarHBondContact O-N 2.91Å; K1072-I1074 VanDerWaalsContact C-N 3.3Å; K1072-I1074 PolarHBondContact O-N 2.93Å; K1072-V1075 PolarHBondContact O-N 3.35Å; K1072-E1076 WeakPolarHBondContact CE-OE1 3.35Å; K1072-E1076 IonicContact NZ-OE1 3.45Å; K1072-E1076 PolarHBondContact NZ-OE1 2.87Å; K1072-E1076 PolarHBondContact O-N 3.13Å
1073	K	62.3	Low	48	Very low	168 Å²	168	133.6 Å²	133.6	73%	0.73	72%	0.723	S	S	*	*	H	α-helix	trans	-92	18.3	-177.5	-148.8	-176.1	-178.8	-177.4	0	114.3	M1070 W1071	M1070-K1073 PolarHBondContact O-N 2.67Å; W1071-K1073 PolarHBondContact O-N 3.08Å
1074	I	59.9	Low	48.8	Very low	126 Å²	126	132.7 Å²	132.7	65%	0.646	71%	0.71	S	S	*	*	H	α-helix	trans	-122.8	-8.9	171.8	-61.2	171.9	0	0	0	109.8	W1071 K1072	W1071-I1074 PolarHBondContact O-N 2.7Å; K1072-I1074 VanDerWaalsContact C-N 3.3Å; K1072-I1074 PolarHBondContact O-N 2.93Å
1075	V	61.5	Low	49.8	Very low	128 Å²	128	137.5 Å²	137.5	78%	0.776	70%	0.704	S	S	*	*	H	α-helix	trans	-109.9	-28.2	176.9	-179	0	0	0	0	111	K1072	K1072-V1075 PolarHBondContact O-N 3.35Å
1076	E	54.3	Low	50.6	Low	170 Å²	170	132.5 Å²	132.5	79%	0.794	69%	0.687	S	S	*	*			trans	-76.6	0	151.9	-67	172	-174.3	0	0	110.9	K1072	K1072-E1076 WeakPolarHBondContact CE-OE1 3.35Å; K1072-E1076 IonicContact NZ-OE1 3.45Å; K1072-E1076 PolarHBondContact NZ-OE1 2.87Å; K1072-E1076 PolarHBondContact O-N 3.13Å

Retrieved 1,076 of 1,076 residues in 456.4 ms (Link to these results)

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