A0A5K4F378_SCHMA Loading...

LLGL domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F378, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,303 aa.

						>A0A5K4F378_SCHMA|A0A5K4F378
MAQKIFQSFRRIPGHFPAFRKKEEPCDVQGSRYRVAVCSDYGFPSKPTSVAYDPVIDMLAVLTRDGNIYIYGKPGISFSAVHETNAQYIQVVFLTGSRKLVTLTDSDDMYLWELTSVSQTSSQLTQRSCLKRITSQLKSLPSGVPSSSNNNEETSHVTALCYASDGRSILIGTDNGWVASVRLNTNTATDDFTKFWCLPSADDAINPSRILDGISPDRRQRLRADAVVVLSERPGFPGQLLIGYNSGLSLLFDLRSDRVMALLPWQHGLEAAAWCGGSGQPNRSNQTPHQPQLGMRLLTAHSDGSLGVWSLREIGFGTTTISPIQPPLLQMEEAPSMPYGPFPCKLISKVFWLPSALGGITVFVGGMPRATYGERHTVSILRGSNIDQAANASVVAARLAVAAEAEDDDEIPEESSLSAPPIHVFDSDAPEHVCLDLPSSLVDLVPVGSVDGPVQILVLLCEEEMVVIDLITSGWPFMRPPYLTCLHTTSLTTYNLITQVSSTLLSNLEAAGAYYGPEGRFGRGGAIADNPSGGGWSSLPWPIQGGHALINGSRLSTSSLGGNILYTDDLLLTGHEDGSVAFWRLSAGGCLRRIYTLYTAILFEDVSQLDHPNGVDDDGDAWPPFRQAGVFDPFMDDSRVAIQFIYLVDNTLVVGGAAGQVIVYQFLNFTPCIEPAIVTIKKSMPGFQWKGHAPLTLRKCFSDKFTANPEQTTPLPAQLQATGVIFVQPPARITSLLLSEFELTHLKEFSQNQTNNISGDGGGLQILLALGTPHGFGVVFVPKPLPNNDSNTKKPLPPQPLLAVSTIPDNIDALQEAAAGEGWARRRTRELKKSLRDSFRRLKRVRSTKSNFQPVVSASTANVSRAGIRRTVTQSNRAAPNQTDVAPLDEAERRSGRVPDENILLISQYNVEREICDRVQDTANVAIISCFAFGPPLFKSSPSNARPTLHPVATLFIGTKAGTVKLYSIFVDKTTLNSSVLPKLQLYYSRELILQHRAPVLSLRLIDAKSNMPYSLSDYKHYISDSGKSHNLPVLSVVSEEQIRLFNLPNLHLKFKARITAIDGYRIKSASVVGFRIHGKTSSSLSKESTVDSACGDLERSNTSGISVTSQTNQNCEYSFVFTNVGGQAVLLSMPQLRRMDTLHLLDSHDVVAVSSVVFSQPGSTNVNNSCYVHGPALGLYQLAPGQLTLFDVVRTGQKASLLGVSYRPIYRLSLIGNTNANMKTLSEKTNSIGDSRISNRSVLSTSQLHNISQTSSVLSSSVQNQSNSMSSHNLSDSIRNGLVSPSSVSCTSDRNNHRDRVS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31	Very low	32	Very low	198 Å²	198	121.2 Å²	121.2	98%	0.975	57%	0.566	S	S	*	*				0	-47	0	-110.8	157.7	179.4	0	0	111.9	Q3 K4	M1-Q3 PolarHBondContact O-N 3.19Å; M1-K4 PolarHBondContact O-N 2.84Å
2	A	30.4	Very low	31.4	Very low	29 Å²	29	124 Å²	124	24%	0.24	59%	0.585	C	S	.	*	H	α-helix	trans	-43.3	-40.6	174.8	0	0	0	0	0	115.6	K4 I5 F6 A226	A2-K4 PolarHBondContact O-N 3.15Å; A2-I5 PolarHBondContact O-N 3.43Å; A2-F6 PolarHBondContact O-N 2.63Å; A2-F6 VanDerWaalsContact O-N 3.14Å; A2-A226 HydrophobicContact CB-CB 4.46Å
3	Q	28	Very low	31.2	Very low	176 Å²	176	122.9 Å²	122.9	82%	0.822	60%	0.595	S	S	*	*	H	α-helix	trans	-56.6	-20.4	173.4	-86	-175.4	-18.4	0	0	115.7	M1	M1-Q3 PolarHBondContact O-N 3.19Å
4	K	31.3	Very low	30.8	Very low	162 Å²	162	119.3 Å²	119.3	70%	0.704	61%	0.605	S	S	*	*	H	α-helix	trans	-89.2	-30.7	172.3	-83.2	-169	170.9	-175.2	0	113.2	M1 A2 F6 Q7	M1-K4 PolarHBondContact O-N 2.84Å; A2-K4 PolarHBondContact O-N 3.15Å; K4-F6 VanDerWaalsContact C-N 3.32Å; K4-Q7 WeakPolarHBondContact O-CB 3.48Å; K4-Q7 PolarHBondContact O-N 2.92Å; K4-Q7 VanDerWaalsContact O-N 3.1Å
5	I	40.6	Very low	30.6	Very low	47 Å²	47	122.9 Å²	122.9	24%	0.241	62%	0.618	C	S	.	*	H	α-helix	trans	-68.8	-36.6	176.5	-68.6	160.3	0	0	0	109.9	A2 Q7 S8 N245	A2-I5 PolarHBondContact O-N 3.43Å; I5-Q7 PolarHBondContact O-N 3.45Å; I5-S8 VanDerWaalsContact O-CB 3.28Å; I5-S8 WeakPolarHBondContact O-CB 3.48Å; I5-S8 PolarHBondContact O-N 3.04Å; I5-S8 PolarHBondContact O-OG 3.2Å; I5-N245 WeakPolarHBondContact CD1-OD1 3.23Å
6	F	36.5	Very low	30.2	Very low	71 Å²	71	127.2 Å²	127.2	31%	0.311	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.7	-9.1	170.2	-81.5	-71	0	0	0	115.4	A2 K4 S8 T158 D174	A2-F6 PolarHBondContact O-N 2.63Å; A2-F6 VanDerWaalsContact O-N 3.14Å; K4-F6 VanDerWaalsContact C-N 3.32Å; F6-S8 VanDerWaalsContact C-N 3.3Å; F6-T158 HydrophobicContact CE2-CG2 3.76Å; F6-T158 HydrophobicContact CZ-CG2 3.5Å; F6-D174 HydrophobicContact CE2-CB 4.4Å
7	Q	29.3	Very low	30.4	Very low	121 Å²	121	123.9 Å²	123.9	57%	0.565	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-19.5	170.2	-77.3	-177.5	-24	0	0	112.7	K4 I5 F9 R10 R11	K4-Q7 WeakPolarHBondContact O-CB 3.48Å; K4-Q7 PolarHBondContact O-N 2.92Å; K4-Q7 VanDerWaalsContact O-N 3.1Å; I5-Q7 PolarHBondContact O-N 3.45Å; Q7-F9 PolarHBondContact O-N 3.27Å; Q7-R10 CarbonylContact O-C 3.54Å; Q7-R10 PolarHBondContact O-N 2.96Å; Q7-R11 PolarHBondContact O-N 3.44Å
8	S	32.6	Very low	30.3	Very low	89 Å²	89	119.2 Å²	119.2	62%	0.622	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-36.7	171.3	-49	0	0	0	0	111.9	I5 F6	I5-S8 VanDerWaalsContact O-CB 3.28Å; I5-S8 WeakPolarHBondContact O-CB 3.48Å; I5-S8 PolarHBondContact O-N 3.04Å; I5-S8 PolarHBondContact O-OG 3.2Å; F6-S8 VanDerWaalsContact C-N 3.3Å
9	F	35.5	Very low	30.6	Very low	128 Å²	128	119.4 Å²	119.4	56%	0.561	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-2.4	174.4	-69.2	-80.4	0	0	0	114	Q7 R64	Q7-F9 PolarHBondContact O-N 3.27Å; F9-R64 PolarHBondContact O-NH2 2.84Å
10	R	29	Very low	31.2	Very low	159 Å²	159	115.5 Å²	115.5	60%	0.6	58%	0.58	S	S	*	*			trans	-123	42.7	-178.7	-64.1	-172.4	-180	-168.3	2.9	113	Q7	Q7-R10 CarbonylContact O-C 3.54Å; Q7-R10 PolarHBondContact O-N 2.96Å
11	R	27.9	Very low	31.5	Very low	153 Å²	153	116.4 Å²	116.4	58%	0.577	58%	0.58	S	S	*	*			trans	-67.8	129.8	152.5	-76.3	-175.5	172.3	-174.8	-4.3	108.8	Q7 P13	Q7-R11 PolarHBondContact O-N 3.44Å; R11-P13 WeakPolarHBondContact O-CD 3.31Å
12	I	25	Very low	32	Very low	155 Å²	155	110.7 Å²	110.7	80%	0.795	55%	0.55	S	S	*	*			trans	-104.5	108.7	177.6	-62.5	165.8	0	0	0	108
13	P	28.9	Very low	32.3	Very low	110 Å²	110	113.4 Å²	113.4	71%	0.714	56%	0.558	S	S	*	*			trans	-86.6	112.3	155.4	-2.3	21.5	0	0	0	108	R11 H15	R11-P13 WeakPolarHBondContact O-CD 3.31Å; P13-H15 VanDerWaalsContact C-N 3.33Å; P13-H15 PolarHBondContact O-N 2.94Å
14	G	25.3	Very low	32.8	Very low	72 Å²	72	112.7 Å²	112.7	74%	0.742	55%	0.554	S	S	*	*			trans	-73.9	79.1	178.6	0	0	0	0	0	112.9
15	H	27.1	Very low	33.2	Very low	173 Å²	173	108.8 Å²	108.8	80%	0.801	55%	0.546	S	S	*	.			trans	-156.3	113.1	156	-125.1	-63.1	0	0	0	110.3	P13 P17	P13-H15 VanDerWaalsContact C-N 3.33Å; P13-H15 PolarHBondContact O-N 2.94Å; H15-P17 VanDerWaalsContact O-CD 3.22Å; H15-P17 WeakPolarHBondContact O-CD 3.42Å
16	F	25.4	Very low	33.1	Very low	192 Å²	192	111.9 Å²	111.9	84%	0.842	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-65.8	119.1	170.1	-73.4	-92.4	0	0	0	109.4
17	P	32.5	Very low	33.3	Very low	72 Å²	72	112.9 Å²	112.9	47%	0.468	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-73.9	146.5	153.6	1	19.5	0	0	0	107.8	H15	H15-P17 VanDerWaalsContact O-CD 3.22Å; H15-P17 WeakPolarHBondContact O-CD 3.42Å
18	A	30	Very low	34	Very low	39 Å²	39	112.1 Å²	112.1	32%	0.322	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-65.8	153.7	171.8	0	0	0	0	0	110.8	R20 H1149	A18-R20 PolarHBondContact O-N 3.36Å; A18-H1149 HydrophobicContact CB-CB 3.64Å; A18-H1149 WeakPolarHBondContact CB-O 3.1Å
19	F	35.7	Very low	34.7	Very low	123 Å²	123	117.5 Å²	117.5	54%	0.539	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-61.5	129.3	-172.2	-84.9	-89.4	0	0	0	113.2	K21 N85	F19-K21 VanDerWaalsContact C-N 3.3Å; F19-K21 PolarHBondContact O-N 2.89Å; F19-N85 HydrophobicContact CE1-CB 3.88Å; F19-N85 VanDerWaalsContact CE1-OD1 3.22Å; F19-N85 WeakPolarHBondContact CE1-OD1 3.36Å; F19-N85 HydrophobicContact CZ-CB 4.29Å; F19-N85 VanDerWaalsContact CZ-ND2 3.28Å; F19-N85 WeakPolarHBondContact CZ-ND2 3.41Å; F19-N85 VanDerWaalsContact CZ-OD1 3.22Å; F19-N85 WeakPolarHBondContact CZ-OD1 3.17Å
20	R	41.4	Very low	35.8	Very low	41 Å²	41	115 Å²	115	16%	0.155	61%	0.608	C	S	.	*			trans	-76.5	80.6	165.9	-70.4	-172.6	-174.4	177.5	3.4	110.4	A18 K22 S45 L1183	A18-R20 PolarHBondContact O-N 3.36Å; R20-K22 VanDerWaalsContact C-N 3.33Å; R20-K22 PolarHBondContact O-N 3.23Å; R20-K22 VanDerWaalsContact O-N 3.15Å; R20-S45 PolarHBondContact NH2-OG 3.37Å; R20-L1183 VanDerWaalsContact NH2-C 3.27Å; R20-L1183 PolarHBondContact NH2-O 3.24Å
21	K	38.3	Very low	38	Very low	135 Å²	135	108.5 Å²	108.5	59%	0.587	59%	0.587	S	S	*	*			trans	-79.4	88.9	158.3	-156.1	-176	-179	-161.7	0	108	F19 E23	F19-K21 VanDerWaalsContact C-N 3.3Å; F19-K21 PolarHBondContact O-N 2.89Å; K21-E23 HydrophobicContact CB-CG 4.38Å; K21-E23 HydrophobicContact CD-CG 3.54Å; K21-E23 WeakPolarHBondContact CD-OE1 3.3Å; K21-E23 VanDerWaalsContact CE-OE1 3.32Å; K21-E23 WeakPolarHBondContact CE-OE1 3.34Å; K21-E23 HydrophobicContact CG-CG 3.66Å; K21-E23 IonicContact NZ-OE1 3.15Å; K21-E23 PolarHBondContact NZ-OE1 3.14Å; K21-E23 PolarHBondContact O-N 2.84Å
22	K	41	Very low	40.8	Very low	78 Å²	78	107.1 Å²	107.1	34%	0.339	58%	0.582	S	S	.	*			trans	-72.7	71.5	164.3	-158.1	174.7	-165.7	174.6	0	106.5	R20 E24 D40 V81	R20-K22 VanDerWaalsContact C-N 3.33Å; R20-K22 PolarHBondContact O-N 3.23Å; R20-K22 VanDerWaalsContact O-N 3.15Å; K22-E24 PolarHBondContact O-N 2.89Å; K22-E24 VanDerWaalsContact O-N 3.16Å; K22-D40 IonicContact NZ-OD1 3.85Å; K22-D40 PolarHBondContact NZ-OD1 2.95Å; K22-D40 IonicContact NZ-OD2 2.81Å; K22-D40 PolarHBondContact NZ-OD2 3.41Å; K22-V81 HydrophobicContact CB-CG2 4.09Å
23	E	36.8	Very low	43.9	Very low	85 Å²	85	99.9 Å²	99.9	40%	0.397	54%	0.544	S	S	.	.			trans	-52.8	123.7	170.3	-67.8	-169.2	148.1	0	0	106.7	K21 H1144	K21-E23 HydrophobicContact CB-CG 4.38Å; K21-E23 HydrophobicContact CD-CG 3.54Å; K21-E23 WeakPolarHBondContact CD-OE1 3.3Å; K21-E23 VanDerWaalsContact CE-OE1 3.32Å; K21-E23 WeakPolarHBondContact CE-OE1 3.34Å; K21-E23 HydrophobicContact CG-CG 3.66Å; K21-E23 IonicContact NZ-OE1 3.15Å; K21-E23 PolarHBondContact NZ-OE1 3.14Å; K21-E23 PolarHBondContact O-N 2.84Å; E23-H1144 IonicContact OE2-CE1 3.97Å; E23-H1144 PolarHBondContact OE2-CE1 3.1Å; E23-H1144 VanDerWaalsContact OE2-CE1 3.23Å; E23-H1144 IonicContact OE2-ND1 3.69Å; E23-H1144 PolarHBondContact OE2-ND1 3.3Å
24	E	37.9	Very low	46.8	Very low	162 Å²	162	97.2 Å²	97.2	76%	0.757	52%	0.52	S	S	*	.			trans	-49.3	136.2	159.6	-71.3	-157.3	133.1	0	0	106.8	K22 C26	K22-E24 PolarHBondContact O-N 2.89Å; K22-E24 VanDerWaalsContact O-N 3.16Å; E24-C26 VanDerWaalsContact C-N 3.3Å; E24-C26 PolarHBondContact O-N 3.23Å
25	P	41.3	Very low	49.9	Very low	80 Å²	80	94.3 Å²	94.3	52%	0.519	49%	0.488	S	S	.	.			trans	-61.5	101.7	178.8	25.3	-32.5	0	0	0	106.7	D27	P25-D27 VanDerWaalsContact C-N 3.28Å; P25-D27 PolarHBondContact O-N 3.41Å
26	C	36.9	Very low	52.8	Low	112 Å²	112	86.2 Å²	86.2	76%	0.757	45%	0.451	S	S	*	.			trans	-55	103.4	165.3	-83.4	0	0	0	0	105.2	E24 V28	E24-C26 VanDerWaalsContact C-N 3.3Å; E24-C26 PolarHBondContact O-N 3.23Å; C26-V28 WeakPolarHBondContact O-CG2 3.3Å; C26-V28 PolarHBondContact O-N 3.22Å
27	D	41.8	Very low	55.8	Low	91 Å²	91	79.3 Å²	79.3	49%	0.487	43%	0.425	S	S	.	.			trans	-60.4	92.8	170.1	-86.1	-34.4	0	0	0	105.6	P25 Q29 R34	P25-D27 VanDerWaalsContact C-N 3.28Å; P25-D27 PolarHBondContact O-N 3.41Å; D27-Q29 PolarHBondContact O-N 3.3Å; D27-R34 IonicContact OD2-NH1 2.68Å
28	V	44.1	Very low	58.3	Low	105 Å²	105	76.3 Å²	76.3	64%	0.636	41%	0.405	S	S	*	.			trans	-60	104.4	179.8	178.2	0	0	0	0	105.7	C26 G30 S31	C26-V28 WeakPolarHBondContact O-CG2 3.3Å; C26-V28 PolarHBondContact O-N 3.22Å; V28-G30 PolarHBondContact O-N 3.39Å; V28-S31 WeakPolarHBondContact O-CB 3.28Å; V28-S31 PolarHBondContact O-N 2.96Å
29	Q	46.6	Very low	61.1	Low	202 Å²	202	74.8 Å²	74.8	94%	0.944	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	107.7	-174	-84.6	-178.5	-25.7	0	0	109.9	D27	D27-Q29 PolarHBondContact O-N 3.3Å
30	G	58.8	Low	63.8	Low	77 Å²	77	69.7 Å²	69.7	79%	0.794	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.2	-14.8	-175.6	0	0	0	0	0	115.9	V28	V28-G30 PolarHBondContact O-N 3.39Å
31	S	75.1	Confident	66.4	Low	22 Å²	22	67.8 Å²	67.8	15%	0.154	36%	0.363	C	S	.	.			trans	-67.9	139.6	173.2	-175.6	0	0	0	0	111.2	V28 Y33 D1141 L1143 T1196	V28-S31 WeakPolarHBondContact O-CB 3.28Å; V28-S31 PolarHBondContact O-N 2.96Å; S31-Y33 PolarHBondContact OG-O 2.88Å; S31-D1141 PolarHBondContact OG-OD1 2.79Å; S31-D1141 PolarHBondContact OG-OD2 2.97Å; S31-L1143 WeakPolarHBondContact OG-CD2 3.37Å; S31-T1196 PolarHBondContact O-OG1 3.37Å
32	R	86.3	Confident	69.1	Low	124 Å²	124	61.5 Å²	61.5	47%	0.468	34%	0.336	S	S	.	.	S	Bend	trans	-91.8	-5.3	-179.2	-72.9	-171.7	-66	156.4	0.1	112.9	D1141 R1195 T1196	R32-D1141 PolarHBondContact N-OD2 3.02Å; R32-R1195 WeakPolarHBondContact O-CA 3.2Å; R32-T1196 PolarHBondContact O-N 2.86Å; R32-T1196 PolarHBondContact O-OG1 3.35Å
33	Y	90.5	Very high	71.7	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.008	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	162.5	-177.6	-57.3	-92.8	0	0	0	110.2	S31 F1075 L1131 M1140 D1141 L1143 V1194 R1195 T1196	S31-Y33 PolarHBondContact OG-O 2.88Å; Y33-F1075 AromaticContact CD1-CD1 3.89Å; Y33-F1075 HydrophobicContact CD1-CD1 3.89Å; Y33-F1075 AromaticContact CD1-CE1 3.61Å; Y33-F1075 HydrophobicContact CD1-CE1 3.61Å; Y33-F1075 HydrophobicContact CD1-CZ 4.14Å; Y33-F1075 AromaticContact CE1-CD1 3.67Å; Y33-F1075 HydrophobicContact CE1-CD1 3.67Å; Y33-F1075 HydrophobicContact CE1-CD2 4.28Å; Y33-F1075 AromaticContact CE1-CE1 3.74Å; Y33-F1075 HydrophobicContact CE1-CE1 3.74Å; Y33-F1075 HydrophobicContact CE1-CE2 4.38Å; Y33-F1075 AromaticContact CE1-CG 3.93Å; Y33-F1075 HydrophobicContact CE1-CG 3.93Å; Y33-F1075 HydrophobicContact CE1-CZ 4.12Å; Y33-L1131 HydrophobicContact CD1-CD2 3.46Å; Y33-L1131 VanDerWaalsContact CD1-CD2 3.46Å; Y33-L1131 HydrophobicContact CD2-CD2 3.76Å; Y33-L1131 HydrophobicContact CE1-CD2 3.78Å; Y33-L1131 HydrophobicContact CE2-CD2 4.08Å; Y33-L1131 HydrophobicContact CG-CD2 3.45Å; Y33-L1131 VanDerWaalsContact CG-CD2 3.45Å; Y33-M1140 HydrophobicContact CE2-CE 4.15Å; Y33-M1140 WeakPolarHBondContact OH-CE 3.39Å; Y33-D1141 HydrophobicContact CD2-CB 3.95Å; Y33-L1143 VanDerWaalsContact O-CD2 3.3Å; Y33-L1143 WeakPolarHBondContact O-CD2 3.49Å; Y33-V1194 CarbonylContact C-O 3.53Å; Y33-V1194 WeakPolarHBondContact CA-O 3.39Å; Y33-V1194 WeakPolarHBondContact CB-O 3.5Å; Y33-R1195 HydrophobicContact CD1-CG 3.95Å; Y33-R1195 HydrophobicContact CE1-CG 3.75Å; Y33-T1196 PolarHBondContact N-OG1 2.94Å; Y33-T1196 VanDerWaalsContact N-OG1 3.13Å
34	R	90.3	Very high	74.5	Confident	54 Å²	54	53.9 Å²	53.9	20%	0.204	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	157.3	172.2	63.9	179.3	-172.3	157.7	1.7	111.3	D27 V1194 Q1198	D27-R34 IonicContact OD2-NH1 2.68Å; R34-V1194 HydrophobicContact CG-CG2 3.76Å; R34-V1194 PolarHBondContact N-O 3.12Å; R34-V1194 PolarHBondContact O-N 2.86Å; R34-Q1198 PolarHBondContact NE-O 2.94Å; R34-Q1198 PolarHBondContact NH2-O 3.49Å
35	V	90.2	Very high	77.1	Confident	12 Å²	12	47.6 Å²	47.6	7%	0.073	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	130.3	166.8	173.7	0	0	0	0	107.9	A1129 L1143 L1145 F1191 D1192	V35-A1129 HydrophobicContact CG2-CB 4.31Å; V35-L1143 HydrophobicContact CG2-CB 3.97Å; V35-L1143 HydrophobicContact CG2-CD1 4.05Å; V35-L1145 HydrophobicContact CB-CD1 4.48Å; V35-L1145 HydrophobicContact CG1-CD1 3.55Å; V35-L1145 HydrophobicContact CG2-CB 4.34Å; V35-L1145 HydrophobicContact CG2-CD1 4.14Å; V35-F1191 HydrophobicContact CG1-CB 4.32Å; V35-F1191 HydrophobicContact CG1-CD2 4.44Å; V35-D1192 WeakPolarHBondContact CA-O 3.25Å
36	A	87.9	Confident	79.6	Confident	3 Å²	3	47.5 Å²	47.5	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	105.6	174.6	0	0	0	0	0	108.7	C38 D1192 V1194	A36-C38 PolarHBondContact O-N 2.88Å; A36-D1192 HydrophobicContact CB-CB 4.34Å; A36-D1192 PolarHBondContact N-O 2.82Å; A36-D1192 PolarHBondContact O-N 3.3Å; A36-V1194 HydrophobicContact CB-CG2 4.14Å
37	V	87.5	Confident	82.5	Confident	47 Å²	47	42.5 Å²	42.5	29%	0.285	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	133.9	168.3	179.4	0	0	0	0	108.5	T1189 R1208	V37-T1189 HydrophobicContact CG1-CG2 3.63Å; V37-R1208 PolarHBondContact O-NE 2.54Å; V37-R1208 PolarHBondContact O-NH2 2.84Å
38	C	86.4	Confident	85.1	Confident	8 Å²	8	39.3 Å²	39.3	5%	0.054	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-57.6	-175.8	-76.6	0	0	0	0	112.2	A36 L1190 R1208	A36-C38 PolarHBondContact O-N 2.88Å; C38-L1190 HydrophobicContact CB-CB 4.16Å; C38-L1190 HydrophobicContact CB-CD2 3.89Å; C38-L1190 HydrophobicContact CB-CG 4.01Å; C38-L1190 PolarHBondContact N-O 3.34Å; C38-R1208 HydrophobicContact CB-CG 4.41Å
39	S	88.3	Confident	87.7	Confident	8 Å²	8	34.5 Å²	34.5	6%	0.056	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	152.4	179.3	-83.6	0	0	0	0	109.7	Y41 G588 G589 L1190 Y1207	S39-Y41 WeakPolarHBondContact CB-OH 3.36Å; S39-G588 PolarHBondContact OG-N 3.2Å; S39-G589 PolarHBondContact OG-N 3.49Å; S39-L1190 PolarHBondContact O-N 3.06Å; S39-Y1207 PolarHBondContact OG-O 3.4Å
40	D	92.7	Very high	90.1	Very high	16 Å²	16	25.2 Å²	25.2	9%	0.086	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.1	167.1	-60.3	-29.3	0	0	0	107.9	K22 G589 T1189	K22-D40 IonicContact NZ-OD1 3.85Å; K22-D40 PolarHBondContact NZ-OD1 2.95Å; K22-D40 IonicContact NZ-OD2 2.81Å; K22-D40 PolarHBondContact NZ-OD2 3.41Å; D40-G589 WeakPolarHBondContact O-CA 3.47Å; D40-T1189 WeakPolarHBondContact OD1-CB 3.46Å; D40-T1189 WeakPolarHBondContact OD1-CG2 3.14Å; D40-T1189 PolarHBondContact OD1-OG1 2.8Å
41	Y	95.3	Very high	91.9	Very high	1 Å²	1	22 Å²	22	0%	0.004	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	145.8	-176.9	-66.4	-81.4	0	0	0	111.3	S39 L585 S586 G589 C590 L591 Q1187 L1188 L1190 Y1207	S39-Y41 WeakPolarHBondContact CB-OH 3.36Å; Y41-L585 HydrophobicContact CD1-CD2 4.26Å; Y41-L585 HydrophobicContact CD2-CD2 4.13Å; Y41-L585 HydrophobicContact CE1-CB 4.29Å; Y41-L585 HydrophobicContact CE1-CD2 4.06Å; Y41-L585 HydrophobicContact CE2-CD2 3.9Å; Y41-L585 HydrophobicContact CG-CD2 4.32Å; Y41-S586 VanDerWaalsContact CE1-O 3.27Å; Y41-S586 WeakPolarHBondContact CE1-O 3.33Å; Y41-S586 PolarHBondContact OH-O 3.44Å; Y41-G589 VanDerWaalsContact CD1-C 3.47Å; Y41-G589 WeakPolarHBondContact CD1-O 3.35Å; Y41-C590 WeakPolarHBondContact CE1-O 3.47Å; Y41-L591 HydrophobicContact CD1-CB 4.38Å; Y41-L591 HydrophobicContact CD1-CD1 4.12Å; Y41-Q1187 WeakPolarHBondContact O-CA 3.33Å; Y41-L1188 PolarHBondContact N-O 3.12Å; Y41-L1188 PolarHBondContact O-N 2.69Å; Y41-L1190 HydrophobicContact CD2-CB 4.35Å; Y41-L1190 HydrophobicContact CE2-CB 3.91Å; Y41-L1190 HydrophobicContact CE2-CD2 4.26Å; Y41-Y1207 VanDerWaalsContact OH-CD1 3.31Å; Y41-Y1207 WeakPolarHBondContact OH-CD1 3.49Å
42	G	95.7	Very high	92.9	Very high	2 Å²	2	22.4 Å²	22.4	2%	0.021	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.4	-157.4	179.7	0	0	0	0	0	113.8	T484 G1186	G42-T484 CarbonylContact C-O 3.56Å; G42-T484 WeakPolarHBondContact CA-O 3.28Å; G42-G1186 CarbonylContact C-O 3.52Å; G42-G1186 WeakPolarHBondContact CA-O 3.39Å
43	F	96.2	Very high	93.3	Very high	3 Å²	3	16.5 Å²	16.5	1%	0.013	9%	0.088	C	C	.	.			trans	-105.9	129.6	-170.7	-169	-102.3	0	0	0	112.1	P47 L460 C461 E463 E464 M465 L483 T484 G1186 Q1187	F43-P47 HydrophobicContact CE1-CG 3.89Å; F43-P47 HydrophobicContact CZ-CB 4.34Å; F43-P47 HydrophobicContact CZ-CG 3.81Å; F43-L460 HydrophobicContact CE2-CD1 3.86Å; F43-L460 HydrophobicContact CZ-CD1 3.72Å; F43-C461 WeakPolarHBondContact CZ-O 3.24Å; F43-E463 VanDerWaalsContact CD1-C 3.48Å; F43-E463 VanDerWaalsContact CD1-O 3.28Å; F43-E463 WeakPolarHBondContact CD1-O 3.47Å; F43-E464 VanDerWaalsContact CE2-C 3.45Å; F43-E464 VanDerWaalsContact CZ-C 3.5Å; F43-M465 HydrophobicContact CD2-CB 4.42Å; F43-M465 HydrophobicContact CE2-CB 3.95Å; F43-L483 HydrophobicContact CD2-CB 4.27Å; F43-L483 WeakPolarHBondContact CD2-O 3.22Å; F43-T484 PolarHBondContact N-O 3.42Å; F43-G1186 PolarHBondContact N-O 2.99Å; F43-G1186 CarbonylContact O-C 3.55Å; F43-G1186 VanDerWaalsContact O-C 3.29Å; F43-Q1187 WeakPolarHBondContact O-CB 3.38Å
44	P	95	Very high	93.4	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.			trans	-74.9	145.7	-178.2	31.5	-35.5	0	0	0	112.5	T63 Y69 L483	P44-T63 HydrophobicContact CB-CG2 3.88Å; P44-T63 HydrophobicContact CG-CG2 4.18Å; P44-Y69 HydrophobicContact CB-CD2 4.44Å; P44-Y69 HydrophobicContact CB-CE2 3.74Å; P44-Y69 HydrophobicContact CG-CD2 4.3Å; P44-Y69 HydrophobicContact CG-CE2 4.09Å; P44-L483 HydrophobicContact CG-CD2 4.13Å
45	S	92.1	Very high	93.5	Very high	31 Å²	31	19.5 Å²	19.5	22%	0.217	11%	0.113	C	C	.	.	S	Bend	trans	-70.1	145.5	173.6	54	0	0	0	0	112.9	R20	R20-S45 PolarHBondContact NH2-OG 3.37Å
46	K	94.6	Very high	93.5	Very high	78 Å²	78	20 Å²	20	34%	0.339	11%	0.114	S	C	.	.	S	Bend	trans	54.2	53.5	176.7	-48.9	172.9	-172.1	160.7	0	113.4	T63 R64 D65	K46-T63 CarbonylContact O-C 3.55Å; K46-T63 WeakPolarHBondContact O-CA 3.35Å; K46-T63 WeakPolarHBondContact O-CB 3.28Å; K46-R64 HydrophobicContact CB-CB 4Å; K46-R64 HydrophobicContact CD-CB 4.32Å; K46-R64 PolarHBondContact O-N 2.99Å; K46-D65 WeakPolarHBondContact CD-OD1 3.46Å; K46-D65 WeakPolarHBondContact CD-OD2 3.19Å; K46-D65 IonicContact NZ-OD1 2.77Å; K46-D65 PolarHBondContact NZ-OD1 3Å; K46-D65 IonicContact NZ-OD2 3.99Å; K46-D65 PolarHBondContact NZ-OD2 3.26Å
47	P	97.3	Very high	93.8	Very high	7 Å²	7	21.4 Å²	21.4	5%	0.045	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	148.3	165.7	30.8	-36.2	0	0	0	109.6	F43 V61 L62 V442 L460 C461	F43-P47 HydrophobicContact CE1-CG 3.89Å; F43-P47 HydrophobicContact CZ-CB 4.34Å; F43-P47 HydrophobicContact CZ-CG 3.81Å; P47-V61 HydrophobicContact CB-CG1 4.43Å; P47-L62 WeakPolarHBondContact CA-O 3.48Å; P47-V442 HydrophobicContact CG-CG2 4.39Å; P47-V442 WeakPolarHBondContact O-CG1 3.49Å; P47-L460 HydrophobicContact CB-CD1 3.79Å; P47-L460 HydrophobicContact CB-CD2 3.91Å; P47-L460 HydrophobicContact CB-CG 3.97Å; P47-L460 HydrophobicContact CG-CD1 4.22Å; P47-L460 HydrophobicContact CG-CG 4.41Å; P47-C461 VanDerWaalsContact CG-O 3.3Å; P47-C461 WeakPolarHBondContact CG-O 3.16Å
48	T	97.2	Very high	94.2	Very high	23 Å²	23	19.3 Å²	19.3	14%	0.141	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	-27.8	178.9	43.6	0	0	0	0	114.6	L62 R64 Y88 V442	T48-L62 PolarHBondContact N-O 2.65Å; T48-L62 PolarHBondContact OG1-O 3.18Å; T48-R64 HydrophobicContact CG2-CB 3.51Å; T48-R64 HydrophobicContact CG2-CG 3.97Å; T48-R64 PolarHBondContact OG1-N 3.29Å; T48-Y88 WeakPolarHBondContact CB-O 3.28Å; T48-Y88 WeakPolarHBondContact CG2-O 3.45Å; T48-Y88 PolarHBondContact OG1-O 3.4Å; T48-V442 VanDerWaalsContact C-CG1 3.48Å; T48-V442 WeakPolarHBondContact O-CG1 3.18Å
49	S	97.5	Very high	94.7	Very high	4 Å²	4	19 Å²	19	3%	0.028	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	152.2	176.2	178.1	0	0	0	0	111.6	L62 V91 D443	S49-L62 PolarHBondContact O-N 2.96Å; S49-V91 PolarHBondContact OG-N 3.36Å; S49-D443 VanDerWaalsContact CA-OD2 3.24Å; S49-D443 WeakPolarHBondContact CA-OD2 3.48Å; S49-D443 WeakPolarHBondContact CB-OD2 3.46Å; S49-D443 PolarHBondContact OG-OD2 3.05Å
50	V	97.7	Very high	95.1	Very high	8 Å²	8	18.6 Å²	18.6	5%	0.048	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.8	174.2	67	0	0	0	0	110	L59 A60 V61 D443 V445 L460	V50-L59 HydrophobicContact CG2-CD1 3.59Å; V50-L59 HydrophobicContact CG2-CD2 4.49Å; V50-L59 HydrophobicContact CG2-CG 4.02Å; V50-A60 CarbonylContact C-O 3.57Å; V50-A60 VanDerWaalsContact CA-O 3.3Å; V50-A60 WeakPolarHBondContact CA-O 3.29Å; V50-A60 WeakPolarHBondContact CG2-O 2.85Å; V50-V61 HydrophobicContact CG2-CG2 4.11Å; V50-D443 HydrophobicContact CG1-CB 3.97Å; V50-D443 PolarHBondContact N-OD2 2.79Å; V50-V445 HydrophobicContact CB-CG1 4.38Å; V50-V445 HydrophobicContact CG1-CB 3.96Å; V50-V445 HydrophobicContact CG1-CG1 3.66Å; V50-V445 HydrophobicContact CG2-CG1 3.83Å; V50-L460 HydrophobicContact CB-CB 4.36Å; V50-L460 HydrophobicContact CB-CD2 3.77Å; V50-L460 HydrophobicContact CG1-CB 4.21Å; V50-L460 HydrophobicContact CG1-CD2 4.32Å
51	A	96.4	Very high	95.4	Very high	9 Å²	9	17.8 Å²	17.8	7%	0.074	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	152.7	173.4	0	0	0	0	0	110.6	L59 A60 V91 F93	A51-L59 CarbonylContact O-C 3.59Å; A51-L59 WeakPolarHBondContact O-CA 3.4Å; A51-A60 PolarHBondContact N-O 3.38Å; A51-A60 PolarHBondContact O-N 3.31Å; A51-V91 HydrophobicContact CB-CG1 4.03Å; A51-V91 HydrophobicContact CB-CG2 4.39Å; A51-F93 HydrophobicContact CB-CD2 3.74Å; A51-F93 HydrophobicContact CB-CE2 4.22Å
52	Y	96.2	Very high	95.5	Very high	31 Å²	31	17.8 Å²	17.8	12%	0.122	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	136.9	174.8	171.8	-111.8	0	0	0	109.6	P54 D57 M58 V447 G448 I543	Y52-P54 HydrophobicContact CD1-CB 4.43Å; Y52-P54 HydrophobicContact CE1-CB 3.7Å; Y52-D57 PolarHBondContact OH-OD1 2.94Å; Y52-M58 WeakPolarHBondContact CA-O 3.31Å; Y52-M58 VanDerWaalsContact CD2-O 3.31Å; Y52-M58 WeakPolarHBondContact CD2-O 3.49Å; Y52-V447 HydrophobicContact CD1-CB 4.33Å; Y52-V447 HydrophobicContact CD1-CG1 4.45Å; Y52-V447 HydrophobicContact CD1-CG2 4Å; Y52-V447 HydrophobicContact CD2-CG1 4.35Å; Y52-V447 HydrophobicContact CD2-CG2 4.07Å; Y52-V447 HydrophobicContact CE1-CB 4.27Å; Y52-V447 HydrophobicContact CE1-CG1 4.02Å; Y52-V447 HydrophobicContact CE1-CG2 4.39Å; Y52-V447 HydrophobicContact CE2-CG1 3.91Å; Y52-V447 HydrophobicContact CE2-CG2 4.47Å; Y52-V447 HydrophobicContact CG-CG2 3.84Å; Y52-G448 WeakPolarHBondContact CE1-O 3.35Å; Y52-G448 PolarHBondContact OH-O 2.98Å; Y52-I543 HydrophobicContact CE2-CG1 4.25Å
53	D	94.2	Very high	95.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	108	173	179.4	-18.2	0	0	0	109.1	V55 I56 D57 M58 F93 G96	D53-V55 PolarHBondContact O-N 2.68Å; D53-V55 WeakPolarHBondContact OD1-CB 3.15Å; D53-V55 PolarHBondContact OD1-N 3.43Å; D53-I56 HydrophobicContact CB-CD1 4.11Å; D53-I56 HydrophobicContact CB-CG1 3.78Å; D53-I56 PolarHBondContact OD1-N 3.45Å; D53-I56 WeakPolarHBondContact OD2-CD1 3.41Å; D53-D57 WeakPolarHBondContact O-CA 3.32Å; D53-D57 PolarHBondContact O-N 3.14Å; D53-M58 PolarHBondContact N-O 2.65Å; D53-M58 PolarHBondContact O-N 3.06Å; D53-F93 HydrophobicContact CB-CB 3.81Å; D53-F93 HydrophobicContact CB-CD1 4.04Å; D53-F93 HydrophobicContact CB-CD2 3.81Å; D53-F93 HydrophobicContact CB-CE2 4.31Å; D53-F93 HydrophobicContact CB-CG 3.65Å; D53-G96 PolarHBondContact OD1-N 3.31Å; D53-G96 PolarHBondContact OD2-N 3.15Å
54	P	92	Very high	95.6	Very high	41 Å²	41	20.7 Å²	20.7	27%	0.266	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-10.3	-177.7	29.1	-36	0	0	0	114.6	Y52 T95 V450	Y52-P54 HydrophobicContact CD1-CB 4.43Å; Y52-P54 HydrophobicContact CE1-CB 3.7Å; P54-T95 HydrophobicContact CG-CG2 4.45Å; P54-V450 HydrophobicContact CB-CG2 3.82Å; P54-V450 HydrophobicContact CG-CG2 4.09Å; P54-V450 WeakPolarHBondContact O-CG2 3.38Å
55	V	92.2	Very high	95.5	Very high	78 Å²	78	23.8 Å²	23.8	47%	0.473	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-41.9	179.8	176.4	0	0	0	0	111.4	D53 T95 V450	D53-V55 PolarHBondContact O-N 2.68Å; D53-V55 WeakPolarHBondContact OD1-CB 3.15Å; D53-V55 PolarHBondContact OD1-N 3.43Å; V55-T95 HydrophobicContact CB-CG2 4.33Å; V55-T95 HydrophobicContact CG2-CG2 3.65Å; V55-V450 HydrophobicContact CG2-CG2 3.67Å
56	I	92.1	Very high	95.6	Very high	21 Å²	21	22.3 Å²	22.3	11%	0.108	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-10	174.1	76.3	-175.2	0	0	0	112.8	D53 M58 F93 R98 G545	D53-I56 HydrophobicContact CB-CD1 4.11Å; D53-I56 HydrophobicContact CB-CG1 3.78Å; D53-I56 PolarHBondContact OD1-N 3.45Å; D53-I56 WeakPolarHBondContact OD2-CD1 3.41Å; I56-M58 HydrophobicContact CD1-CB 4.18Å; I56-M58 HydrophobicContact CD1-CG 4.34Å; I56-M58 HydrophobicContact CD1-SD 4.26Å; I56-M58 HydrophobicContact CG1-CB 3.96Å; I56-M58 HydrophobicContact CG1-CG 4.02Å; I56-M58 HydrophobicContact CG1-SD 4.46Å; I56-F93 HydrophobicContact CD1-CE1 4.19Å; I56-R98 HydrophobicContact CG2-CG 4.19Å; I56-G545 VanDerWaalsContact O-CA 3.27Å; I56-G545 WeakPolarHBondContact O-CA 3.4Å
57	D	93.7	Very high	95.6	Very high	33 Å²	33	19 Å²	19	18%	0.176	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	56.7	179.2	-173.4	15.8	0	0	0	112.6	Y52 D53 I543 Q544 G545	Y52-D57 PolarHBondContact OH-OD1 2.94Å; D53-D57 WeakPolarHBondContact O-CA 3.32Å; D53-D57 PolarHBondContact O-N 3.14Å; D57-I543 WeakPolarHBondContact O-CG2 3.46Å; D57-I543 WeakPolarHBondContact OD1-CA 3.37Å; D57-I543 WeakPolarHBondContact OD1-CG2 3.42Å; D57-Q544 WeakPolarHBondContact OD2-CA 3.23Å; D57-Q544 PolarHBondContact OD2-N 2.93Å; D57-G545 WeakPolarHBondContact O-CA 3.42Å; D57-G545 PolarHBondContact O-N 3.05Å; D57-G545 PolarHBondContact OD2-N 2.68Å
58	M	94.8	Very high	95.6	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.02	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.6	-179.6	-67.5	-171	172.7	0	0	112.6	Y52 D53 I56 I70 Y71 I76 F78 F93 L114	Y52-M58 WeakPolarHBondContact CA-O 3.31Å; Y52-M58 VanDerWaalsContact CD2-O 3.31Å; Y52-M58 WeakPolarHBondContact CD2-O 3.49Å; D53-M58 PolarHBondContact N-O 2.65Å; D53-M58 PolarHBondContact O-N 3.06Å; I56-M58 HydrophobicContact CD1-CB 4.18Å; I56-M58 HydrophobicContact CD1-CG 4.34Å; I56-M58 HydrophobicContact CD1-SD 4.26Å; I56-M58 HydrophobicContact CG1-CB 3.96Å; I56-M58 HydrophobicContact CG1-CG 4.02Å; I56-M58 HydrophobicContact CG1-SD 4.46Å; M58-I70 HydrophobicContact CB-CG2 4.01Å; M58-I70 HydrophobicContact CG-CG2 4.49Å; M58-I70 HydrophobicContact SD-CG2 3.97Å; M58-Y71 CarbonylContact C-O 3.56Å; M58-Y71 VanDerWaalsContact CA-O 3.32Å; M58-Y71 WeakPolarHBondContact CA-O 3.43Å; M58-Y71 WeakPolarHBondContact CB-O 3.26Å; M58-I76 HydrophobicContact CE-CG2 3.95Å; M58-F78 HydrophobicContact CE-CE2 4.2Å; M58-F78 HydrophobicContact SD-CE2 4.34Å; M58-F93 HydrophobicContact CB-CZ 4.36Å; M58-F93 WeakPolarHBondContact O-CE2 3.33Å; M58-L114 HydrophobicContact SD-CD2 4.1Å
59	L	97	Very high	95.5	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	137.7	175.4	-169.3	76.4	0	0	0	109.5	V50 A51 I70 Y71 V445 M465 Y482 L483 I543	V50-L59 HydrophobicContact CG2-CD1 3.59Å; V50-L59 HydrophobicContact CG2-CD2 4.49Å; V50-L59 HydrophobicContact CG2-CG 4.02Å; A51-L59 CarbonylContact O-C 3.59Å; A51-L59 WeakPolarHBondContact O-CA 3.4Å; L59-I70 CarbonylContact O-C 3.59Å; L59-I70 VanDerWaalsContact O-CA 3.28Å; L59-I70 WeakPolarHBondContact O-CA 3.13Å; L59-Y71 PolarHBondContact N-O 2.83Å; L59-Y71 PolarHBondContact O-N 2.89Å; L59-V445 HydrophobicContact CD1-CG1 4.03Å; L59-M465 HydrophobicContact CD2-SD 4.07Å; L59-Y482 HydrophobicContact CD2-CE2 4.46Å; L59-L483 HydrophobicContact CD2-CD1 4.45Å; L59-I543 HydrophobicContact CB-CD1 4.11Å
60	A	97.8	Very high	95.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	139.2	170.4	0	0	0	0	0	110.5	V50 A51 Y69 I70 V91 F93 L100	V50-A60 CarbonylContact C-O 3.57Å; V50-A60 VanDerWaalsContact CA-O 3.3Å; V50-A60 WeakPolarHBondContact CA-O 3.29Å; V50-A60 WeakPolarHBondContact CG2-O 2.85Å; A51-A60 PolarHBondContact N-O 3.38Å; A51-A60 PolarHBondContact O-N 3.31Å; A60-Y69 CarbonylContact C-O 3.58Å; A60-Y69 VanDerWaalsContact CA-O 3.26Å; A60-Y69 WeakPolarHBondContact CA-O 3.28Å; A60-I70 HydrophobicContact CB-CG1 4.26Å; A60-V91 HydrophobicContact CB-CG2 4.26Å; A60-F93 HydrophobicContact CB-CD2 4.44Å; A60-F93 HydrophobicContact CB-CE2 3.51Å; A60-F93 HydrophobicContact CB-CZ 3.58Å; A60-L100 HydrophobicContact CB-CD2 4.3Å
61	V	98.1	Very high	95.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.7	172.1	175.3	0	0	0	0	108.9	P47 V50 Y69 L460 L483	P47-V61 HydrophobicContact CB-CG1 4.43Å; V50-V61 HydrophobicContact CG2-CG2 4.11Å; V61-Y69 PolarHBondContact N-O 2.86Å; V61-Y69 PolarHBondContact O-N 3.08Å; V61-L460 HydrophobicContact CG1-CD1 4.44Å; V61-L460 HydrophobicContact CG1-CD2 4.38Å; V61-L483 HydrophobicContact CG2-CD1 3.7Å
62	L	98.2	Very high	95	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	142.4	174.2	-179.2	65.6	0	0	0	109.6	P47 T48 S49 I68 Q90 V91 T102	P47-L62 WeakPolarHBondContact CA-O 3.48Å; T48-L62 PolarHBondContact N-O 2.65Å; T48-L62 PolarHBondContact OG1-O 3.18Å; S49-L62 PolarHBondContact O-N 2.96Å; L62-I68 HydrophobicContact CD1-CG1 3.79Å; L62-Q90 VanDerWaalsContact CD2-O 3.24Å; L62-Q90 WeakPolarHBondContact CD2-O 3.44Å; L62-V91 HydrophobicContact CB-CB 3.97Å; L62-V91 HydrophobicContact CB-CG1 3.77Å; L62-V91 HydrophobicContact CD2-CB 4.08Å; L62-T102 HydrophobicContact CD1-CG2 4.03Å; L62-T102 HydrophobicContact CD2-CG2 4.25Å
63	T	97.5	Very high	94.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	150.9	171.2	59.9	0	0	0	0	111.1	P44 K46 D65 G66 N67 Y69	P44-T63 HydrophobicContact CB-CG2 3.88Å; P44-T63 HydrophobicContact CG-CG2 4.18Å; K46-T63 CarbonylContact O-C 3.55Å; K46-T63 WeakPolarHBondContact O-CA 3.35Å; K46-T63 WeakPolarHBondContact O-CB 3.28Å; T63-D65 PolarHBondContact O-N 2.85Å; T63-D65 VanDerWaalsContact O-N 3.09Å; T63-G66 PolarHBondContact O-N 2.99Å; T63-N67 HydrophobicContact CG2-CB 4.47Å; T63-N67 PolarHBondContact N-O 3.13Å; T63-N67 WeakPolarHBondContact OG1-CA 3.35Å; T63-N67 VanDerWaalsContact OG1-CB 3.22Å; T63-N67 WeakPolarHBondContact OG1-CB 3.49Å; T63-N67 PolarHBondContact OG1-N 2.91Å; T63-N67 PolarHBondContact OG1-ND2 3.16Å; T63-N67 VanDerWaalsContact OG1-ND2 3.09Å; T63-N67 PolarHBondContact OG1-O 2.83Å; T63-Y69 HydrophobicContact CG2-CE2 4.15Å
64	R	96.4	Very high	94.3	Very high	67 Å²	67	19.3 Å²	19.3	25%	0.253	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-34.4	179.9	-161	172.8	-173.6	155.2	7	113.4	F9 K46 T48 G66 Q87 Y88	F9-R64 PolarHBondContact O-NH2 2.84Å; K46-R64 HydrophobicContact CB-CB 4Å; K46-R64 HydrophobicContact CD-CB 4.32Å; K46-R64 PolarHBondContact O-N 2.99Å; T48-R64 HydrophobicContact CG2-CB 3.51Å; T48-R64 HydrophobicContact CG2-CG 3.97Å; T48-R64 PolarHBondContact OG1-N 3.29Å; R64-G66 VanDerWaalsContact C-N 3.27Å; R64-G66 PolarHBondContact O-N 3.24Å; R64-Q87 HydrophobicContact CG-CB 4.26Å; R64-Y88 PolarHBondContact O-N 3.09Å
65	D	92.4	Very high	93.8	Very high	65 Å²	65	17.8 Å²	17.8	35%	0.348	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	10	-178	-58.7	-14.3	0	0	0	112.9	K46 T63	K46-D65 WeakPolarHBondContact CD-OD1 3.46Å; K46-D65 WeakPolarHBondContact CD-OD2 3.19Å; K46-D65 IonicContact NZ-OD1 2.77Å; K46-D65 PolarHBondContact NZ-OD1 3Å; K46-D65 IonicContact NZ-OD2 3.99Å; K46-D65 PolarHBondContact NZ-OD2 3.26Å; T63-D65 PolarHBondContact O-N 2.85Å; T63-D65 VanDerWaalsContact O-N 3.09Å
66	G	94.3	Very high	93.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.069	C	C	.	.	S	Bend	trans	87.6	15.8	169.4	0	0	0	0	0	116.5	T63 R64 V81 H82	T63-G66 PolarHBondContact O-N 2.99Å; R64-G66 VanDerWaalsContact C-N 3.27Å; R64-G66 PolarHBondContact O-N 3.24Å; G66-V81 CarbonylContact O-C 3.6Å; G66-V81 WeakPolarHBondContact O-CA 3.38Å; G66-H82 PolarHBondContact O-CD2 3.42Å; G66-H82 PolarHBondContact O-N 3.27Å
67	N	94.9	Very high	93.3	Very high	7 Å²	7	14 Å²	14	4%	0.037	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133.4	169.4	-44.9	-100	0	0	0	109.2	T63 Y69	T63-N67 HydrophobicContact CG2-CB 4.47Å; T63-N67 PolarHBondContact N-O 3.13Å; T63-N67 WeakPolarHBondContact OG1-CA 3.35Å; T63-N67 VanDerWaalsContact OG1-CB 3.22Å; T63-N67 WeakPolarHBondContact OG1-CB 3.49Å; T63-N67 PolarHBondContact OG1-N 2.91Å; T63-N67 PolarHBondContact OG1-ND2 3.16Å; T63-N67 VanDerWaalsContact OG1-ND2 3.09Å; T63-N67 PolarHBondContact OG1-O 2.83Å; N67-Y69 HydrophobicContact CB-CE2 3.76Å
68	I	96.7	Very high	93.1	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.4	174.5	-55.2	167.6	0	0	0	108	L62 I70 S79 A80 L100 T102 W112 L124	L62-I68 HydrophobicContact CD1-CG1 3.79Å; I68-I70 HydrophobicContact CG2-CG1 4.43Å; I68-S79 CarbonylContact O-C 3.53Å; I68-S79 VanDerWaalsContact O-CA 3.28Å; I68-S79 WeakPolarHBondContact O-CA 3.45Å; I68-A80 PolarHBondContact N-O 3Å; I68-A80 PolarHBondContact O-N 2.75Å; I68-L100 HydrophobicContact CD1-CD1 4.38Å; I68-L100 HydrophobicContact CG2-CD2 4.37Å; I68-T102 HydrophobicContact CD1-CG2 3.9Å; I68-T102 HydrophobicContact CG1-CG2 4.37Å; I68-W112 HydrophobicContact CD1-CD2 3.78Å; I68-W112 HydrophobicContact CD1-CE3 4.47Å; I68-W112 HydrophobicContact CD1-CG 4.09Å; I68-W112 HydrophobicContact CD1-CH2 4.34Å; I68-W112 HydrophobicContact CD1-CZ2 3.61Å; I68-W112 VanDerWaalsContact CD1-NE1 3.29Å; I68-L124 HydrophobicContact CB-CD2 4.19Å; I68-L124 HydrophobicContact CD1-CD2 4.46Å; I68-L124 HydrophobicContact CG2-CD2 3.73Å
69	Y	95.6	Very high	92.9	Very high	9 Å²	9	15.6 Å²	15.6	4%	0.035	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.7	172.4	-57	-84.9	0	0	0	109.1	P44 A60 V61 T63 N67 Y71 F78 Q1187	P44-Y69 HydrophobicContact CB-CD2 4.44Å; P44-Y69 HydrophobicContact CB-CE2 3.74Å; P44-Y69 HydrophobicContact CG-CD2 4.3Å; P44-Y69 HydrophobicContact CG-CE2 4.09Å; A60-Y69 CarbonylContact C-O 3.58Å; A60-Y69 VanDerWaalsContact CA-O 3.26Å; A60-Y69 WeakPolarHBondContact CA-O 3.28Å; V61-Y69 PolarHBondContact N-O 2.86Å; V61-Y69 PolarHBondContact O-N 3.08Å; T63-Y69 HydrophobicContact CG2-CE2 4.15Å; N67-Y69 HydrophobicContact CB-CE2 3.76Å; Y69-Y71 VanDerWaalsContact CB-CE2 3.48Å; Y69-Y71 HydrophobicContact CG-CE2 4.43Å; Y69-F78 CarbonylContact C-O 3.57Å; Y69-F78 WeakPolarHBondContact CA-O 3.5Å; Y69-Q1187 PolarHBondContact OH-NE2 3.37Å
70	I	95.4	Very high	92.7	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.01	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.4	171.4	-53.6	174.9	0	0	0	108.1	M58 L59 A60 I68 S77 F78 F93 L100 L124	M58-I70 HydrophobicContact CB-CG2 4.01Å; M58-I70 HydrophobicContact CG-CG2 4.49Å; M58-I70 HydrophobicContact SD-CG2 3.97Å; L59-I70 CarbonylContact O-C 3.59Å; L59-I70 VanDerWaalsContact O-CA 3.28Å; L59-I70 WeakPolarHBondContact O-CA 3.13Å; A60-I70 HydrophobicContact CB-CG1 4.26Å; I68-I70 HydrophobicContact CG2-CG1 4.43Å; I70-S77 CarbonylContact O-C 3.6Å; I70-S77 VanDerWaalsContact O-CA 3.24Å; I70-S77 WeakPolarHBondContact O-CA 3.03Å; I70-F78 HydrophobicContact CB-CB 4.19Å; I70-F78 HydrophobicContact CB-CD2 4.11Å; I70-F78 HydrophobicContact CG2-CD2 4.24Å; I70-F78 PolarHBondContact N-O 2.82Å; I70-F78 PolarHBondContact O-N 3.21Å; I70-F93 HydrophobicContact CG2-CZ 4.27Å; I70-L100 HydrophobicContact CD1-CD2 3.56Å; I70-L100 HydrophobicContact CG1-CD2 3.99Å; I70-L124 HydrophobicContact CD1-CD1 3.72Å; I70-L124 HydrophobicContact CD1-CD2 3.71Å; I70-L124 HydrophobicContact CD1-CG 4.24Å; I70-L124 HydrophobicContact CG1-CD2 4.19Å
71	Y	93.9	Very high	92.4	Very high	6 Å²	6	18 Å²	18	2%	0.024	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.7	176.2	-58	-86.5	0	0	0	110.4	M58 L59 Y69 I76 Y482 L483	M58-Y71 CarbonylContact C-O 3.56Å; M58-Y71 VanDerWaalsContact CA-O 3.32Å; M58-Y71 WeakPolarHBondContact CA-O 3.43Å; M58-Y71 WeakPolarHBondContact CB-O 3.26Å; L59-Y71 PolarHBondContact N-O 2.83Å; L59-Y71 PolarHBondContact O-N 2.89Å; Y69-Y71 VanDerWaalsContact CB-CE2 3.48Å; Y69-Y71 HydrophobicContact CG-CE2 4.43Å; Y71-I76 WeakPolarHBondContact CA-O 3.49Å; Y71-Y482 VanDerWaalsContact CB-CE2 3.49Å; Y71-Y482 VanDerWaalsContact CB-CZ 3.42Å; Y71-Y482 AromaticContact CD1-CD1 3.81Å; Y71-Y482 HydrophobicContact CD1-CD1 3.81Å; Y71-Y482 AromaticContact CD1-CD2 3.83Å; Y71-Y482 HydrophobicContact CD1-CD2 3.83Å; Y71-Y482 HydrophobicContact CD1-CE1 4.37Å; Y71-Y482 HydrophobicContact CD1-CE2 4.38Å; Y71-Y482 AromaticContact CD1-CG 3.51Å; Y71-Y482 HydrophobicContact CD1-CG 3.51Å; Y71-Y482 HydrophobicContact CD2-CD2 4.18Å; Y71-Y482 HydrophobicContact CD2-CE2 4.41Å; Y71-Y482 HydrophobicContact CE1-CD2 4.44Å; Y71-Y482 HydrophobicContact CE1-CG 4.07Å; Y71-Y482 HydrophobicContact CG-CD1 4.2Å; Y71-Y482 AromaticContact CG-CD2 3.68Å; Y71-Y482 HydrophobicContact CG-CD2 3.68Å; Y71-Y482 HydrophobicContact CG-CE1 4.37Å; Y71-Y482 AromaticContact CG-CE2 3.87Å; Y71-Y482 HydrophobicContact CG-CE2 3.87Å; Y71-Y482 AromaticContact CG-CG 3.85Å; Y71-Y482 HydrophobicContact CG-CG 3.85Å; Y71-L483 HydrophobicContact CD2-CD1 3.89Å; Y71-L483 HydrophobicContact CD2-CG 4.2Å; Y71-L483 HydrophobicContact CE2-CD1 3.63Å; Y71-L483 HydrophobicContact CE2-CD2 3.71Å; Y71-L483 HydrophobicContact CE2-CG 3.57Å
72	G	91.4	Very high	92.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.103	C	C	.	.			trans	-123.4	-129.6	173.7	0	0	0	0	0	110.4	I76 Y482 G545	G72-I76 PolarHBondContact N-O 3.23Å; G72-Y482 VanDerWaalsContact O-CE1 3.25Å; G72-Y482 WeakPolarHBondContact O-CE1 3.44Å; G72-Y482 PolarHBondContact O-OH 3.19Å; G72-G545 CarbonylContact C-O 3.59Å; G72-G545 WeakPolarHBondContact CA-O 3.49Å
73	K	89.1	Confident	91.6	Very high	58 Å²	58	27.2 Å²	27.2	25%	0.252	14%	0.143	S	C	.	.	S	Bend	trans	-50.4	142.2	161.4	-171.3	166.3	-176.1	161.2	0	110.5	G75 I76 I543 G545	K73-G75 PolarHBondContact O-N 2.84Å; K73-I76 HydrophobicContact CB-CG1 3.96Å; K73-I76 WeakPolarHBondContact O-CA 3.33Å; K73-I76 WeakPolarHBondContact O-CB 3.35Å; K73-I76 WeakPolarHBondContact O-CG1 3.43Å; K73-I76 PolarHBondContact O-N 2.77Å; K73-I543 WeakPolarHBondContact CA-O 3.42Å; K73-G545 PolarHBondContact N-O 2.92Å
74	P	86.6	Confident	91.1	Very high	14 Å²	14	29.5 Å²	29.5	9%	0.091	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	133.5	175.6	-27.9	37.8	0	0	0	111.9	P481 I564	P74-P481 HydrophobicContact CB-CB 4.16Å; P74-P481 HydrophobicContact CB-CG 4.22Å; P74-P481 HydrophobicContact CG-CB 3.97Å; P74-P481 HydrophobicContact CG-CG 3.57Å; P74-I564 HydrophobicContact CB-CD1 3.51Å; P74-I564 HydrophobicContact CB-CG1 3.76Å; P74-I564 HydrophobicContact CB-CG2 4.31Å; P74-I564 HydrophobicContact CG-CD1 3.69Å; P74-I564 HydrophobicContact CG-CG1 4.12Å
75	G	81.4	Confident	90.6	Very high	9 Å²	9	32.3 Å²	32.3	9%	0.093	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.2	-14.6	-166	0	0	0	0	0	114.8	K73 A587 C590 P1209	K73-G75 PolarHBondContact O-N 2.84Å; G75-A587 WeakPolarHBondContact CA-O 3.17Å; G75-C590 PolarHBondContact N-SG 2.96Å; G75-P1209 WeakPolarHBondContact O-CB 3.24Å
76	I	85.2	Confident	90.6	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	17%	0.169	C	C	.	.			trans	-98.7	111.5	172.9	-51.8	-62	0	0	0	109.3	M58 Y71 G72 K73 F78 A548 Y1211	M58-I76 HydrophobicContact CE-CG2 3.95Å; Y71-I76 WeakPolarHBondContact CA-O 3.49Å; G72-I76 PolarHBondContact N-O 3.23Å; K73-I76 HydrophobicContact CB-CG1 3.96Å; K73-I76 WeakPolarHBondContact O-CA 3.33Å; K73-I76 WeakPolarHBondContact O-CB 3.35Å; K73-I76 WeakPolarHBondContact O-CG1 3.43Å; K73-I76 PolarHBondContact O-N 2.77Å; I76-F78 HydrophobicContact CG2-CD2 4.44Å; I76-F78 HydrophobicContact CG2-CE2 3.63Å; I76-F78 HydrophobicContact CG2-CZ 4.18Å; I76-A548 HydrophobicContact CD1-CB 3.9Å; I76-Y1211 VanDerWaalsContact CD1-CB 3.46Å; I76-Y1211 HydrophobicContact CD1-CD1 4.07Å; I76-Y1211 HydrophobicContact CD1-CG 4.2Å; I76-Y1211 HydrophobicContact CG2-CD1 4.44Å
77	S	88.5	Confident	90.6	Very high	20 Å²	20	33.9 Å²	33.9	14%	0.14	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	141.9	170.5	72.1	0	0	0	0	112	I70 G588 Y1211	I70-S77 CarbonylContact O-C 3.6Å; I70-S77 VanDerWaalsContact O-CA 3.24Å; I70-S77 WeakPolarHBondContact O-CA 3.03Å; S77-G588 WeakPolarHBondContact OG-CA 3.42Å; S77-Y1211 VanDerWaalsContact O-CE1 3.32Å; S77-Y1211 WeakPolarHBondContact O-CE1 3.36Å; S77-Y1211 PolarHBondContact O-OH 3.24Å
78	F	90.1	Very high	90.7	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.031	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	145.8	168.9	-51.7	-88.2	0	0	0	109.2	M58 Y69 I70 I76 L114 Y1211 L1213	M58-F78 HydrophobicContact CE-CE2 4.2Å; M58-F78 HydrophobicContact SD-CE2 4.34Å; Y69-F78 CarbonylContact C-O 3.57Å; Y69-F78 WeakPolarHBondContact CA-O 3.5Å; I70-F78 HydrophobicContact CB-CB 4.19Å; I70-F78 HydrophobicContact CB-CD2 4.11Å; I70-F78 HydrophobicContact CG2-CD2 4.24Å; I70-F78 PolarHBondContact N-O 2.82Å; I70-F78 PolarHBondContact O-N 3.21Å; I76-F78 HydrophobicContact CG2-CD2 4.44Å; I76-F78 HydrophobicContact CG2-CE2 3.63Å; I76-F78 HydrophobicContact CG2-CZ 4.18Å; F78-L114 HydrophobicContact CB-CD1 4.22Å; F78-L114 HydrophobicContact CD1-CD1 3.52Å; F78-L114 HydrophobicContact CD2-CD1 3.84Å; F78-L114 HydrophobicContact CD2-CD2 4.16Å; F78-L114 HydrophobicContact CE1-CD1 3.7Å; F78-L114 HydrophobicContact CE1-CG 4.46Å; F78-L114 HydrophobicContact CE2-CD1 4.04Å; F78-L114 HydrophobicContact CE2-CD2 3.82Å; F78-L114 HydrophobicContact CE2-CG 4.46Å; F78-L114 HydrophobicContact CG-CD1 3.58Å; F78-L114 HydrophobicContact CZ-CD1 3.97Å; F78-L114 HydrophobicContact CZ-CD2 4.08Å; F78-L114 HydrophobicContact CZ-CG 4.36Å; F78-Y1211 HydrophobicContact CD1-CE1 4.3Å; F78-Y1211 HydrophobicContact CD1-CE2 4.03Å; F78-Y1211 AromaticContact CD1-CZ 3.64Å; F78-Y1211 VanDerWaalsContact CD1-OH 3.3Å; F78-Y1211 WeakPolarHBondContact CD1-OH 3.47Å; F78-Y1211 HydrophobicContact CE1-CD1 4.46Å; F78-Y1211 AromaticContact CE1-CD2 3.84Å; F78-Y1211 HydrophobicContact CE1-CD2 3.84Å; F78-Y1211 AromaticContact CE1-CE1 3.91Å; F78-Y1211 HydrophobicContact CE1-CE1 3.91Å; F78-Y1211 AromaticContact CE1-CE2 3.23Å; F78-Y1211 HydrophobicContact CE1-CE2 3.23Å; F78-Y1211 HydrophobicContact CE1-CG 4.44Å; F78-Y1211 AromaticContact CE1-CZ 3.25Å; F78-Y1211 WeakPolarHBondContact CE1-OH 3.44Å; F78-Y1211 HydrophobicContact CZ-CD1 4.37Å; F78-Y1211 HydrophobicContact CZ-CD2 4.02Å; F78-Y1211 HydrophobicContact CZ-CE1 4.18Å; F78-Y1211 AromaticContact CZ-CE2 3.87Å; F78-Y1211 HydrophobicContact CZ-CE2 3.87Å; F78-Y1211 HydrophobicContact CZ-CG 4.29Å; F78-Y1211 AromaticContact CZ-CZ 3.94Å; F78-L1213 HydrophobicContact CZ-CD2 3.98Å
79	S	90.2	Very high	90.7	Very high	62 Å²	62	36.3 Å²	36.3	43%	0.434	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.4	173.9	65.3	0	0	0	0	110.2	I68	I68-S79 CarbonylContact O-C 3.53Å; I68-S79 VanDerWaalsContact O-CA 3.28Å; I68-S79 WeakPolarHBondContact O-CA 3.45Å
80	A	92.5	Very high	90.7	Very high	14 Å²	14	38.7 Å²	38.7	12%	0.116	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	165	166	0	0	0	0	0	110.4	I68 W112 L124	I68-A80 PolarHBondContact N-O 3Å; I68-A80 PolarHBondContact O-N 2.75Å; A80-W112 HydrophobicContact CB-CE3 4.17Å; A80-W112 HydrophobicContact CB-CH2 3.86Å; A80-W112 HydrophobicContact CB-CZ3 3.51Å; A80-L124 HydrophobicContact CB-CB 4.17Å; A80-L124 HydrophobicContact CB-CD2 3.88Å; A80-L124 HydrophobicContact CB-CG 4.21Å
81	V	91.9	Very high	90.7	Very high	38 Å²	38	38.7 Å²	38.7	23%	0.23	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.3	173.6	-171.3	0	0	0	0	107.7	K22 G66	K22-V81 HydrophobicContact CB-CG2 4.09Å; G66-V81 CarbonylContact O-C 3.6Å; G66-V81 WeakPolarHBondContact O-CA 3.38Å
82	H	93.3	Very high	90.7	Very high	13 Å²	13	40.2 Å²	40.2	6%	0.06	22%	0.22	C	C	.	.			trans	-65.2	136.9	171.1	-79.9	-89.2	0	0	0	111.2	G66 T84 Y88 T102 Y110 W112 Q126	G66-H82 PolarHBondContact O-CD2 3.42Å; G66-H82 PolarHBondContact O-N 3.27Å; H82-T84 VanDerWaalsContact C-N 3.3Å; H82-Y88 HydrophobicContact CB-CE1 4.11Å; H82-Y88 HydrophobicContact CB-CE2 3.87Å; H82-Y88 VanDerWaalsContact CB-CZ 3.47Å; H82-Y88 VanDerWaalsContact CB-OH 3.25Å; H82-Y88 WeakPolarHBondContact CB-OH 3.29Å; H82-Y88 AromaticContact CD2-CD1 3.66Å; H82-Y88 AromaticContact CD2-CE1 3.37Å; H82-Y88 WeakPolarHBondContact CD2-CE1 3.35Å; H82-Y88 AromaticContact CD2-CZ 3.63Å; H82-Y88 AromaticContact CE1-CD1 3.97Å; H82-Y88 AromaticContact CE1-CE1 3.35Å; H82-Y88 WeakPolarHBondContact CE1-CE1 3.36Å; H82-Y88 AromaticContact CG-CE1 3.38Å; H82-Y88 AromaticContact CG-CE2 4Å; H82-Y88 AromaticContact CG-CZ 3.3Å; H82-Y88 AromaticContact ND1-CE1 3.38Å; H82-Y88 WeakPolarHBondContact ND1-CE1 3.48Å; H82-Y88 AromaticContact ND1-CZ 3.61Å; H82-Y88 PolarHBondContact ND1-OH 2.71Å; H82-Y88 AromaticContact NE2-CD1 3.55Å; H82-Y88 AromaticContact NE2-CE1 3.37Å; H82-Y88 WeakPolarHBondContact NE2-CE1 3.42Å; H82-T102 PolarHBondContact CE1-OG1 2.85Å; H82-T102 VanDerWaalsContact CE1-OG1 3.23Å; H82-T102 PolarHBondContact NE2-OG1 3.32Å; H82-Y110 AromaticContact CE1-CD1 3.86Å; H82-Y110 AromaticContact CE1-CD2 3.92Å; H82-Y110 AromaticContact CE1-CG 3.59Å; H82-Y110 AromaticContact ND1-CD1 3.76Å; H82-Y110 AromaticContact ND1-CE1 3.97Å; H82-Y110 AromaticContact ND1-CG 3.95Å; H82-W112 AromaticContact CD2-CZ2 3.83Å; H82-W112 AromaticContact CE1-CE2 3.65Å; H82-W112 AromaticContact CE1-CZ2 3.49Å; H82-W112 VanDerWaalsContact CE1-CZ2 3.49Å; H82-W112 WeakPolarHBondContact CE1-CZ2 3.1Å; H82-W112 AromaticContact CE1-NE1 3.24Å; H82-W112 PolarHBondContact CE1-NE1 3.28Å; H82-W112 AromaticContact CG-CZ2 3.79Å; H82-W112 AromaticContact ND1-CZ2 3.57Å; H82-W112 AromaticContact NE2-CE2 3.78Å; H82-W112 AromaticContact NE2-CZ2 3.64Å; H82-W112 AromaticContact NE2-NE1 3.36Å; H82-W112 PolarHBondContact NE2-NE1 2.87Å; H82-Q126 PolarHBondContact ND1-OE1 2.92Å
83	E	86.7	Confident	90.7	Very high	179 Å²	179	40.7 Å²	40.7	84%	0.836	22%	0.222	S	C	*	.	S	Bend	trans	-72.9	-26.3	174.8	-59.2	-178.1	160.7	0	0	112.6
84	T	87.2	Confident	90.7	Very high	49 Å²	49	38 Å²	38	30%	0.301	21%	0.21	S	C	.	.	S	Bend	trans	-89.1	127.3	-176.5	36.2	0	0	0	0	111.8	H82 A86 Y88 Y110	H82-T84 VanDerWaalsContact C-N 3.3Å; T84-A86 PolarHBondContact O-N 2.87Å; T84-A86 VanDerWaalsContact O-N 3.11Å; T84-Y88 PolarHBondContact O-OH 3.27Å; T84-Y88 PolarHBondContact OG1-OH 3.41Å; T84-Y110 PolarHBondContact OG1-OH 2.89Å
85	N	86	Confident	90.8	Very high	126 Å²	126	40.5 Å²	40.5	67%	0.674	23%	0.225	S	C	*	.			trans	-71.3	99.5	169.5	175.5	18.4	0	0	0	110.5	F19	F19-N85 HydrophobicContact CE1-CB 3.88Å; F19-N85 VanDerWaalsContact CE1-OD1 3.22Å; F19-N85 WeakPolarHBondContact CE1-OD1 3.36Å; F19-N85 HydrophobicContact CZ-CB 4.29Å; F19-N85 VanDerWaalsContact CZ-ND2 3.28Å; F19-N85 WeakPolarHBondContact CZ-ND2 3.41Å; F19-N85 VanDerWaalsContact CZ-OD1 3.22Å; F19-N85 WeakPolarHBondContact CZ-OD1 3.17Å
86	A	92.3	Very high	91	Very high	21 Å²	21	41.1 Å²	41.1	17%	0.174	23%	0.231	C	C	.	.			trans	-147.1	170.3	174.8	0	0	0	0	0	109.2	T84 Y88 T104	T84-A86 PolarHBondContact O-N 2.87Å; T84-A86 VanDerWaalsContact O-N 3.11Å; A86-Y88 HydrophobicContact CB-CE2 4.06Å; A86-Y88 WeakPolarHBondContact O-CD2 3.27Å; A86-Y88 VanDerWaalsContact O-CE2 3.28Å; A86-Y88 WeakPolarHBondContact O-CE2 3.44Å; A86-T104 HydrophobicContact CB-CG2 3.74Å
87	Q	94.7	Very high	91	Very high	77 Å²	77	42.8 Å²	42.8	36%	0.36	24%	0.243	S	C	.	.			trans	-95	124.8	170.5	-51.2	-171.4	24.1	0	0	109.9	R64 T104 D105	R64-Q87 HydrophobicContact CG-CB 4.26Å; Q87-T104 CarbonylContact O-C 3.55Å; Q87-T104 WeakPolarHBondContact O-CA 3.35Å; Q87-T104 WeakPolarHBondContact O-CB 3.43Å; Q87-D105 HydrophobicContact CB-CB 4.16Å; Q87-D105 WeakPolarHBondContact CB-OD2 3.38Å; Q87-D105 WeakPolarHBondContact CG-OD2 3.41Å; Q87-D105 PolarHBondContact O-N 2.85Å
88	Y	96.4	Very high	91	Very high	1 Å²	1	43.6 Å²	43.6	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122	-175.4	-66.5	-86.3	0	0	0	110.8	T48 R64 H82 T84 A86 T104 Y110	T48-Y88 WeakPolarHBondContact CB-O 3.28Å; T48-Y88 WeakPolarHBondContact CG2-O 3.45Å; T48-Y88 PolarHBondContact OG1-O 3.4Å; R64-Y88 PolarHBondContact O-N 3.09Å; H82-Y88 HydrophobicContact CB-CE1 4.11Å; H82-Y88 HydrophobicContact CB-CE2 3.87Å; H82-Y88 VanDerWaalsContact CB-CZ 3.47Å; H82-Y88 VanDerWaalsContact CB-OH 3.25Å; H82-Y88 WeakPolarHBondContact CB-OH 3.29Å; H82-Y88 AromaticContact CD2-CD1 3.66Å; H82-Y88 AromaticContact CD2-CE1 3.37Å; H82-Y88 WeakPolarHBondContact CD2-CE1 3.35Å; H82-Y88 AromaticContact CD2-CZ 3.63Å; H82-Y88 AromaticContact CE1-CD1 3.97Å; H82-Y88 AromaticContact CE1-CE1 3.35Å; H82-Y88 WeakPolarHBondContact CE1-CE1 3.36Å; H82-Y88 AromaticContact CG-CE1 3.38Å; H82-Y88 AromaticContact CG-CE2 4Å; H82-Y88 AromaticContact CG-CZ 3.3Å; H82-Y88 AromaticContact ND1-CE1 3.38Å; H82-Y88 WeakPolarHBondContact ND1-CE1 3.48Å; H82-Y88 AromaticContact ND1-CZ 3.61Å; H82-Y88 PolarHBondContact ND1-OH 2.71Å; H82-Y88 AromaticContact NE2-CD1 3.55Å; H82-Y88 AromaticContact NE2-CE1 3.37Å; H82-Y88 WeakPolarHBondContact NE2-CE1 3.42Å; T84-Y88 PolarHBondContact O-OH 3.27Å; T84-Y88 PolarHBondContact OG1-OH 3.41Å; A86-Y88 HydrophobicContact CB-CE2 4.06Å; A86-Y88 WeakPolarHBondContact O-CD2 3.27Å; A86-Y88 VanDerWaalsContact O-CE2 3.28Å; A86-Y88 WeakPolarHBondContact O-CE2 3.44Å; Y88-T104 HydrophobicContact CD1-CG2 3.64Å; Y88-T104 HydrophobicContact CE1-CG2 3.37Å; Y88-T104 HydrophobicContact CG-CG2 4.38Å; Y88-Y110 HydrophobicContact CE1-CD2 4.34Å; Y88-Y110 HydrophobicContact CE1-CE2 4.12Å
89	I	96	Very high	91	Very high	56 Å²	56	45.2 Å²	45.2	29%	0.287	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-28.8	-165.1	61.7	171.1	0	0	0	114.3	L103 D105	I89-L103 HydrophobicContact CD1-CD2 3.94Å; I89-L103 HydrophobicContact CD1-CG 4.1Å; I89-L103 HydrophobicContact CG1-CB 4.28Å; I89-L103 HydrophobicContact CG1-CD2 4.26Å; I89-L103 HydrophobicContact CG1-CG 4.1Å; I89-L103 WeakPolarHBondContact CG1-O 3.21Å; I89-L103 PolarHBondContact N-O 2.94Å; I89-D105 HydrophobicContact CG2-CB 4.16Å
90	Q	95.5	Very high	91.1	Very high	59 Å²	59	42.3 Å²	42.3	28%	0.276	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	142.9	-175.3	-164.1	174.5	5	0	0	112.1	L62 V92 T102 L103	L62-Q90 VanDerWaalsContact CD2-O 3.24Å; L62-Q90 WeakPolarHBondContact CD2-O 3.44Å; Q90-V92 HydrophobicContact CG-CG2 4.22Å; Q90-T102 VanDerWaalsContact O-CA 3.29Å; Q90-T102 WeakPolarHBondContact O-CA 3.48Å; Q90-L103 HydrophobicContact CB-CB 4.32Å; Q90-L103 PolarHBondContact O-N 2.89Å
91	V	96	Very high	91.2	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.1	166.8	57.3	0	0	0	0	109.9	S49 A51 A60 L62 L100 V101 T102	S49-V91 PolarHBondContact OG-N 3.36Å; A51-V91 HydrophobicContact CB-CG1 4.03Å; A51-V91 HydrophobicContact CB-CG2 4.39Å; A60-V91 HydrophobicContact CB-CG2 4.26Å; L62-V91 HydrophobicContact CB-CB 3.97Å; L62-V91 HydrophobicContact CB-CG1 3.77Å; L62-V91 HydrophobicContact CD2-CB 4.08Å; V91-L100 HydrophobicContact CG2-CB 4.34Å; V91-L100 HydrophobicContact CG2-CD1 3.99Å; V91-L100 HydrophobicContact CG2-CD2 4.49Å; V91-V101 CarbonylContact C-O 3.58Å; V91-V101 WeakPolarHBondContact CA-O 3.46Å; V91-T102 HydrophobicContact CB-CG2 4.19Å; V91-T102 HydrophobicContact CG2-CG2 4.1Å
92	V	93.4	Very high	91.4	Very high	38 Å²	38	40 Å²	40	23%	0.23	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	134.3	175.8	-177.5	0	0	0	0	109.1	Q90 L100 V101 L160	Q90-V92 HydrophobicContact CG-CG2 4.22Å; V92-L100 CarbonylContact O-C 3.59Å; V92-L100 VanDerWaalsContact O-CA 3.26Å; V92-L100 WeakPolarHBondContact O-CA 3.27Å; V92-L100 WeakPolarHBondContact O-CB 3.46Å; V92-V101 PolarHBondContact N-O 2.99Å; V92-V101 PolarHBondContact O-N 2.79Å; V92-L160 HydrophobicContact CG2-CD1 4.27Å
93	F	91.9	Very high	91.5	Very high	10 Å²	10	39.6 Å²	39.6	4%	0.044	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	142.6	171.1	-83	-74.6	0	0	0	111.6	A51 D53 I56 M58 A60 I70 T95 L100	A51-F93 HydrophobicContact CB-CD2 3.74Å; A51-F93 HydrophobicContact CB-CE2 4.22Å; D53-F93 HydrophobicContact CB-CB 3.81Å; D53-F93 HydrophobicContact CB-CD1 4.04Å; D53-F93 HydrophobicContact CB-CD2 3.81Å; D53-F93 HydrophobicContact CB-CE2 4.31Å; D53-F93 HydrophobicContact CB-CG 3.65Å; I56-F93 HydrophobicContact CD1-CE1 4.19Å; M58-F93 HydrophobicContact CB-CZ 4.36Å; M58-F93 WeakPolarHBondContact O-CE2 3.33Å; A60-F93 HydrophobicContact CB-CD2 4.44Å; A60-F93 HydrophobicContact CB-CE2 3.51Å; A60-F93 HydrophobicContact CB-CZ 3.58Å; I70-F93 HydrophobicContact CG2-CZ 4.27Å; F93-T95 PolarHBondContact O-N 3.44Å; F93-L100 HydrophobicContact CD1-CB 3.91Å; F93-L100 HydrophobicContact CE1-CB 4.24Å; F93-L100 HydrophobicContact CE1-CD2 4.01Å; F93-L100 HydrophobicContact CG-CB 4.47Å; F93-L100 HydrophobicContact CZ-CD2 4.44Å
94	L	89.6	Confident	92	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	87.2	164.2	-53.2	-167.7	0	0	0	107.2	G96 S97 K99 V101 L111 Y162 I169 L183 W196	L94-G96 PolarHBondContact O-N 3.31Å; L94-S97 VanDerWaalsContact CB-OG 3.23Å; L94-S97 WeakPolarHBondContact CB-OG 3.4Å; L94-S97 WeakPolarHBondContact O-CB 3.42Å; L94-S97 PolarHBondContact O-N 3.02Å; L94-S97 PolarHBondContact O-OG 3.4Å; L94-K99 HydrophobicContact CB-CB 4.07Å; L94-K99 HydrophobicContact CD1-CB 3.83Å; L94-K99 HydrophobicContact CD1-CD 4.44Å; L94-K99 HydrophobicContact CG-CB 4.06Å; L94-K99 PolarHBondContact N-O 2.8Å; L94-V101 HydrophobicContact CD1-CG2 4.36Å; L94-V101 HydrophobicContact CD2-CG2 4.08Å; L94-V101 HydrophobicContact CG-CG2 4.37Å; L94-L111 HydrophobicContact CD1-CD1 3.86Å; L94-Y162 HydrophobicContact CB-CE1 4.27Å; L94-Y162 HydrophobicContact CB-CE2 4.18Å; L94-Y162 HydrophobicContact CD2-CD2 3.7Å; L94-Y162 HydrophobicContact CD2-CE2 3.59Å; L94-Y162 HydrophobicContact CD2-CG 4.26Å; L94-Y162 HydrophobicContact CG-CE2 4.31Å; L94-I169 HydrophobicContact CD2-CD1 4.02Å; L94-I169 HydrophobicContact CD2-CG1 4.37Å; L94-L183 HydrophobicContact CD1-CD1 4.04Å; L94-W196 HydrophobicContact CD1-CH2 4.31Å; L94-W196 HydrophobicContact CD1-CZ2 4.26Å
95	T	87.1	Confident	92.2	Very high	67 Å²	67	30.9 Å²	30.9	41%	0.411	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-39.5	124.9	-167.4	-50.1	0	0	0	0	114	P54 V55 F93 S97	P54-T95 HydrophobicContact CG-CG2 4.45Å; V55-T95 HydrophobicContact CB-CG2 4.33Å; V55-T95 HydrophobicContact CG2-CG2 3.65Å; F93-T95 PolarHBondContact O-N 3.44Å; T95-S97 PolarHBondContact O-N 2.86Å; T95-S97 VanDerWaalsContact O-N 3.15Å
96	G	86.3	Confident	92.5	Very high	21 Å²	21	27.5 Å²	27.5	22%	0.216	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	-14.3	179.6	0	0	0	0	0	115.8	D53 L94	D53-G96 PolarHBondContact OD1-N 3.31Å; D53-G96 PolarHBondContact OD2-N 3.15Å; L94-G96 PolarHBondContact O-N 3.31Å
97	S	85.5	Confident	92.5	Very high	36 Å²	36	26.9 Å²	26.9	25%	0.252	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-1.3	-171.6	81.6	0	0	0	0	115.2	L94 T95 K99	L94-S97 VanDerWaalsContact CB-OG 3.23Å; L94-S97 WeakPolarHBondContact CB-OG 3.4Å; L94-S97 WeakPolarHBondContact O-CB 3.42Å; L94-S97 PolarHBondContact O-N 3.02Å; L94-S97 PolarHBondContact O-OG 3.4Å; T95-S97 PolarHBondContact O-N 2.86Å; T95-S97 VanDerWaalsContact O-N 3.15Å; S97-K99 PolarHBondContact O-N 3.28Å
98	R	87.5	Confident	92.5	Very high	37 Å²	37	24.1 Å²	24.1	14%	0.14	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	22	-175.2	-57.6	-178.2	-174	165.7	5.1	114.8	I56 L114 S1214 I1216	I56-R98 HydrophobicContact CG2-CG 4.19Å; R98-L114 HydrophobicContact CB-CB 4.22Å; R98-L114 PolarHBondContact O-N 3.34Å; R98-S1214 PolarHBondContact NH1-O 3.35Å; R98-S1214 VanDerWaalsContact NH2-C 3.25Å; R98-S1214 PolarHBondContact NH2-O 2.99Å; R98-S1214 PolarHBondContact NH2-OG 3.01Å; R98-I1216 VanDerWaalsContact CZ-CG1 3.43Å
99	K	90.5	Very high	92.3	Very high	42 Å²	42	24.2 Å²	24.2	18%	0.183	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	149.4	175.3	-66.7	165.8	-175.3	176.9	0	109.3	L94 S97 L111 W112 E113	L94-K99 HydrophobicContact CB-CB 4.07Å; L94-K99 HydrophobicContact CD1-CB 3.83Å; L94-K99 HydrophobicContact CD1-CD 4.44Å; L94-K99 HydrophobicContact CG-CB 4.06Å; L94-K99 PolarHBondContact N-O 2.8Å; S97-K99 PolarHBondContact O-N 3.28Å; K99-L111 HydrophobicContact CB-CD1 3.87Å; K99-L111 HydrophobicContact CD-CD1 4.36Å; K99-L111 HydrophobicContact CG-CD1 4.32Å; K99-W112 CarbonylContact C-O 3.55Å; K99-W112 WeakPolarHBondContact CA-O 3.16Å; K99-W112 WeakPolarHBondContact CB-O 3.47Å; K99-E113 WeakPolarHBondContact CE-OE1 3.43Å; K99-E113 HydrophobicContact CG-CB 3.97Å; K99-E113 HydrophobicContact CG-CG 3.87Å; K99-E113 IonicContact NZ-OE1 2.77Å
100	L	93	Very high	92.2	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	152.7	170	62.4	84.9	0	0	0	109.1	A60 I68 I70 V91 V92 F93 T102 W112 L124	A60-L100 HydrophobicContact CB-CD2 4.3Å; I68-L100 HydrophobicContact CD1-CD1 4.38Å; I68-L100 HydrophobicContact CG2-CD2 4.37Å; I70-L100 HydrophobicContact CD1-CD2 3.56Å; I70-L100 HydrophobicContact CG1-CD2 3.99Å; V91-L100 HydrophobicContact CG2-CB 4.34Å; V91-L100 HydrophobicContact CG2-CD1 3.99Å; V91-L100 HydrophobicContact CG2-CD2 4.49Å; V92-L100 CarbonylContact O-C 3.59Å; V92-L100 VanDerWaalsContact O-CA 3.26Å; V92-L100 WeakPolarHBondContact O-CA 3.27Å; V92-L100 WeakPolarHBondContact O-CB 3.46Å; F93-L100 HydrophobicContact CD1-CB 3.91Å; F93-L100 HydrophobicContact CE1-CB 4.24Å; F93-L100 HydrophobicContact CE1-CD2 4.01Å; F93-L100 HydrophobicContact CG-CB 4.47Å; F93-L100 HydrophobicContact CZ-CD2 4.44Å; L100-T102 HydrophobicContact CD1-CG2 3.83Å; L100-W112 HydrophobicContact CD1-CB 3.66Å; L100-W112 HydrophobicContact CD1-CG 3.83Å; L100-W112 HydrophobicContact CG-CB 3.93Å; L100-W112 PolarHBondContact N-O 3.17Å; L100-W112 PolarHBondContact O-N 3.28Å; L100-L124 HydrophobicContact CD2-CD1 4.4Å; L100-L124 HydrophobicContact CD2-CD2 4.44Å
101	V	93.8	Very high	92	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.024	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.7	175.8	168.3	0	0	0	0	109	V91 V92 L94 M109 Y110 L111 I169 W196	V91-V101 CarbonylContact C-O 3.58Å; V91-V101 WeakPolarHBondContact CA-O 3.46Å; V92-V101 PolarHBondContact N-O 2.99Å; V92-V101 PolarHBondContact O-N 2.79Å; L94-V101 HydrophobicContact CD1-CG2 4.36Å; L94-V101 HydrophobicContact CD2-CG2 4.08Å; L94-V101 HydrophobicContact CG-CG2 4.37Å; V101-M109 HydrophobicContact CG1-CE 4.5Å; V101-M109 HydrophobicContact CG1-CG 3.32Å; V101-M109 HydrophobicContact CG1-SD 3.76Å; V101-Y110 VanDerWaalsContact CA-O 3.28Å; V101-Y110 WeakPolarHBondContact CA-O 3.39Å; V101-L111 HydrophobicContact CG2-CD1 3.83Å; V101-I169 HydrophobicContact CB-CD1 4.06Å; V101-I169 HydrophobicContact CG1-CD1 4.05Å; V101-I169 HydrophobicContact CG2-CD1 3.72Å; V101-W196 HydrophobicContact CG2-CZ2 4.12Å
102	T	96.2	Very high	91.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137.2	175.5	50.4	0	0	0	0	110.1	L62 I68 H82 Q90 V91 L100 Y110 W112	L62-T102 HydrophobicContact CD1-CG2 4.03Å; L62-T102 HydrophobicContact CD2-CG2 4.25Å; I68-T102 HydrophobicContact CD1-CG2 3.9Å; I68-T102 HydrophobicContact CG1-CG2 4.37Å; H82-T102 PolarHBondContact CE1-OG1 2.85Å; H82-T102 VanDerWaalsContact CE1-OG1 3.23Å; H82-T102 PolarHBondContact NE2-OG1 3.32Å; Q90-T102 VanDerWaalsContact O-CA 3.29Å; Q90-T102 WeakPolarHBondContact O-CA 3.48Å; V91-T102 HydrophobicContact CB-CG2 4.19Å; V91-T102 HydrophobicContact CG2-CG2 4.1Å; L100-T102 HydrophobicContact CD1-CG2 3.83Å; T102-Y110 PolarHBondContact N-O 3Å; T102-Y110 PolarHBondContact O-N 2.91Å; T102-W112 PolarHBondContact OG1-NE1 3.11Å; T102-W112 VanDerWaalsContact OG1-NE1 3.17Å
103	L	96.1	Very high	91.8	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.016	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	144.5	-178.3	-177.7	66.3	0	0	0	111.1	I89 Q90 V157 L160	I89-L103 HydrophobicContact CD1-CD2 3.94Å; I89-L103 HydrophobicContact CD1-CG 4.1Å; I89-L103 HydrophobicContact CG1-CB 4.28Å; I89-L103 HydrophobicContact CG1-CD2 4.26Å; I89-L103 HydrophobicContact CG1-CG 4.1Å; I89-L103 WeakPolarHBondContact CG1-O 3.21Å; I89-L103 PolarHBondContact N-O 2.94Å; Q90-L103 HydrophobicContact CB-CB 4.32Å; Q90-L103 PolarHBondContact O-N 2.89Å; L103-V157 HydrophobicContact CD1-CG2 4.49Å; L103-V157 HydrophobicContact CD2-CB 3.96Å; L103-V157 HydrophobicContact CD2-CG1 3.73Å; L103-L160 HydrophobicContact CD2-CD1 4.12Å; L103-L160 HydrophobicContact CD2-CG 4.45Å
104	T	96.3	Very high	91.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	165.3	172.9	64.6	0	0	0	0	113.2	A86 Q87 Y88 S106 D107 D108 Y110	A86-T104 HydrophobicContact CB-CG2 3.74Å; Q87-T104 CarbonylContact O-C 3.55Å; Q87-T104 WeakPolarHBondContact O-CA 3.35Å; Q87-T104 WeakPolarHBondContact O-CB 3.43Å; Y88-T104 HydrophobicContact CD1-CG2 3.64Å; Y88-T104 HydrophobicContact CE1-CG2 3.37Å; Y88-T104 HydrophobicContact CG-CG2 4.38Å; T104-S106 PolarHBondContact O-N 3.38Å; T104-S106 PolarHBondContact OG1-N 3.19Å; T104-D107 PolarHBondContact O-N 3.4Å; T104-D108 HydrophobicContact CG2-CB 4.36Å; T104-D108 PolarHBondContact N-O 2.79Å; T104-D108 VanDerWaalsContact N-O 3.09Å; T104-D108 WeakPolarHBondContact OG1-CB 3.4Å; T104-D108 PolarHBondContact OG1-N 3.46Å; T104-D108 PolarHBondContact OG1-O 3.24Å; T104-Y110 HydrophobicContact CG2-CD2 4.46Å; T104-Y110 HydrophobicContact CG2-CE2 3.8Å
105	D	92.3	Very high	91.4	Very high	45 Å²	45	20.4 Å²	20.4	24%	0.241	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-5.9	168.7	72.8	-18.6	0	0	0	115.1	Q87 I89	Q87-D105 HydrophobicContact CB-CB 4.16Å; Q87-D105 WeakPolarHBondContact CB-OD2 3.38Å; Q87-D105 WeakPolarHBondContact CG-OD2 3.41Å; Q87-D105 PolarHBondContact O-N 2.85Å; I89-D105 HydrophobicContact CG2-CB 4.16Å
106	S	92.2	Very high	91.1	Very high	56 Å²	56	20.5 Å²	20.5	39%	0.392	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	10.9	-176.7	-56.6	0	0	0	0	112.4	T104 D108	T104-S106 PolarHBondContact O-N 3.38Å; T104-S106 PolarHBondContact OG1-N 3.19Å; S106-D108 PolarHBondContact O-N 3.08Å
107	D	93.3	Very high	90.6	Very high	8 Å²	8	23.7 Å²	23.7	4%	0.043	14%	0.136	C	C	.	.	S	Bend	trans	58.2	28.1	-175.6	-47.9	-63.5	0	0	0	114.2	T104 R132 I133 T134 H156 V157	T104-D107 PolarHBondContact O-N 3.4Å; D107-R132 CarbonylContact O-C 3.52Å; D107-R132 WeakPolarHBondContact O-CA 3.43Å; D107-R132 PolarHBondContact O-N 2.83Å; D107-I133 HydrophobicContact CB-CG1 4.33Å; D107-I133 PolarHBondContact O-N 2.8Å; D107-T134 HydrophobicContact CB-CG2 4.22Å; D107-T134 PolarHBondContact OD2-OG1 2.77Å; D107-H156 IonicContact OD1-ND1 3.35Å; D107-H156 IonicContact OD2-CE1 3.87Å; D107-H156 IonicContact OD2-CG 2.7Å; D107-H156 IonicContact OD2-ND1 3.83Å; D107-H156 PolarHBondContact OD2-ND1 3.25Å; D107-V157 HydrophobicContact CB-CG2 4.36Å; D107-V157 WeakPolarHBondContact OD1-CG2 3.19Å; D107-V157 PolarHBondContact OD1-N 3.39Å
108	D	93.4	Very high	89.9	Confident	18 Å²	18	24.3 Å²	24.3	10%	0.096	14%	0.141	C	C	.	.			trans	-86.9	124.7	167.5	-69.5	-8.1	0	0	0	109	T104 S106 Y110 L130 K131 R132	T104-D108 HydrophobicContact CG2-CB 4.36Å; T104-D108 PolarHBondContact N-O 2.79Å; T104-D108 VanDerWaalsContact N-O 3.09Å; T104-D108 WeakPolarHBondContact OG1-CB 3.4Å; T104-D108 PolarHBondContact OG1-N 3.46Å; T104-D108 PolarHBondContact OG1-O 3.24Å; S106-D108 PolarHBondContact O-N 3.08Å; D108-Y110 HydrophobicContact CB-CD2 4.49Å; D108-Y110 HydrophobicContact CB-CE2 3.67Å; D108-L130 WeakPolarHBondContact CA-O 3.46Å; D108-K131 WeakPolarHBondContact OD1-CA 3.5Å; D108-K131 VanDerWaalsContact OD1-CB 3.26Å; D108-K131 WeakPolarHBondContact OD1-CB 3.32Å; D108-R132 PolarHBondContact OD1-N 2.87Å
109	M	93.1	Very high	88.9	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.1	-177.9	-169.6	-177.4	86	0	0	110.4	V101 C129 L130 I133 I169 V181 W196	V101-M109 HydrophobicContact CG1-CE 4.5Å; V101-M109 HydrophobicContact CG1-CG 3.32Å; V101-M109 HydrophobicContact CG1-SD 3.76Å; M109-C129 CarbonylContact O-C 3.56Å; M109-C129 WeakPolarHBondContact O-CA 3.34Å; M109-L130 PolarHBondContact N-O 3.2Å; M109-L130 PolarHBondContact O-N 3.49Å; M109-I133 HydrophobicContact CB-CD1 4.31Å; M109-I133 HydrophobicContact CB-CG2 3.95Å; M109-I133 HydrophobicContact SD-CD1 4.39Å; M109-I169 HydrophobicContact CE-CD1 4.33Å; M109-I169 HydrophobicContact SD-CD1 4.12Å; M109-V181 HydrophobicContact CE-CB 4.42Å; M109-V181 HydrophobicContact CE-CG1 3.63Å; M109-V181 HydrophobicContact SD-CG1 4.44Å; M109-W196 HydrophobicContact CE-CD2 3.81Å; M109-W196 HydrophobicContact CE-CE3 4.03Å; M109-W196 HydrophobicContact CE-CG 4.18Å; M109-W196 HydrophobicContact CE-CH2 4.4Å; M109-W196 HydrophobicContact CE-CZ2 4.22Å; M109-W196 HydrophobicContact CE-CZ3 4.32Å
110	Y	93.1	Very high	87.5	Confident	3 Å²	3	29.2 Å²	29.2	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	133.2	-177.2	-60	-111.7	0	0	0	110.5	H82 T84 Y88 V101 T102 T104 D108 Q126 S128 C129	H82-Y110 AromaticContact CE1-CD1 3.86Å; H82-Y110 AromaticContact CE1-CD2 3.92Å; H82-Y110 AromaticContact CE1-CG 3.59Å; H82-Y110 AromaticContact ND1-CD1 3.76Å; H82-Y110 AromaticContact ND1-CE1 3.97Å; H82-Y110 AromaticContact ND1-CG 3.95Å; T84-Y110 PolarHBondContact OG1-OH 2.89Å; Y88-Y110 HydrophobicContact CE1-CD2 4.34Å; Y88-Y110 HydrophobicContact CE1-CE2 4.12Å; V101-Y110 VanDerWaalsContact CA-O 3.28Å; V101-Y110 WeakPolarHBondContact CA-O 3.39Å; T102-Y110 PolarHBondContact N-O 3Å; T102-Y110 PolarHBondContact O-N 2.91Å; T104-Y110 HydrophobicContact CG2-CD2 4.46Å; T104-Y110 HydrophobicContact CG2-CE2 3.8Å; D108-Y110 HydrophobicContact CB-CD2 4.49Å; D108-Y110 HydrophobicContact CB-CE2 3.67Å; Y110-Q126 HydrophobicContact CD1-CG 4.39Å; Y110-Q126 VanDerWaalsContact CD1-OE1 3.27Å; Y110-S128 WeakPolarHBondContact CA-O 3.18Å; Y110-C129 HydrophobicContact CD1-CB 3.7Å; Y110-C129 HydrophobicContact CE1-CB 3.86Å; Y110-C129 WeakPolarHBondContact CE1-SG 3.34Å; Y110-C129 HydrophobicContact CG-CB 4.33Å; Y110-C129 VanDerWaalsContact CZ-SG 3.53Å
111	L	91.8	Very high	86.4	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.9	172.3	179.2	63	0	0	0	110	L94 K99 V101 R127 S128 F195 W196	L94-L111 HydrophobicContact CD1-CD1 3.86Å; K99-L111 HydrophobicContact CB-CD1 3.87Å; K99-L111 HydrophobicContact CD-CD1 4.36Å; K99-L111 HydrophobicContact CG-CD1 4.32Å; V101-L111 HydrophobicContact CG2-CD1 3.83Å; L111-R127 HydrophobicContact CD2-CB 4.27Å; L111-R127 HydrophobicContact CG-CB 4.25Å; L111-R127 PolarHBondContact O-N 3.48Å; L111-S128 WeakPolarHBondContact CB-OG 3.33Å; L111-S128 PolarHBondContact N-O 3.34Å; L111-S128 PolarHBondContact O-N 3.43Å; L111-F195 HydrophobicContact CD2-CD1 4.22Å; L111-W196 HydrophobicContact CD1-CZ2 4.1Å; L111-W196 HydrophobicContact CD2-CZ2 4.25Å
112	W	92.9	Very high	85.7	Confident	10 Å²	10	31.5 Å²	31.5	4%	0.038	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147.5	172	-63.9	87.5	0	0	0	110.1	I68 A80 H82 K99 L100 T102 L124 T125 Q126	I68-W112 HydrophobicContact CD1-CD2 3.78Å; I68-W112 HydrophobicContact CD1-CE3 4.47Å; I68-W112 HydrophobicContact CD1-CG 4.09Å; I68-W112 HydrophobicContact CD1-CH2 4.34Å; I68-W112 HydrophobicContact CD1-CZ2 3.61Å; I68-W112 VanDerWaalsContact CD1-NE1 3.29Å; A80-W112 HydrophobicContact CB-CE3 4.17Å; A80-W112 HydrophobicContact CB-CH2 3.86Å; A80-W112 HydrophobicContact CB-CZ3 3.51Å; H82-W112 AromaticContact CD2-CZ2 3.83Å; H82-W112 AromaticContact CE1-CE2 3.65Å; H82-W112 AromaticContact CE1-CZ2 3.49Å; H82-W112 VanDerWaalsContact CE1-CZ2 3.49Å; H82-W112 WeakPolarHBondContact CE1-CZ2 3.1Å; H82-W112 AromaticContact CE1-NE1 3.24Å; H82-W112 PolarHBondContact CE1-NE1 3.28Å; H82-W112 AromaticContact CG-CZ2 3.79Å; H82-W112 AromaticContact ND1-CZ2 3.57Å; H82-W112 AromaticContact NE2-CE2 3.78Å; H82-W112 AromaticContact NE2-CZ2 3.64Å; H82-W112 AromaticContact NE2-NE1 3.36Å; H82-W112 PolarHBondContact NE2-NE1 2.87Å; K99-W112 CarbonylContact C-O 3.55Å; K99-W112 WeakPolarHBondContact CA-O 3.16Å; K99-W112 WeakPolarHBondContact CB-O 3.47Å; L100-W112 HydrophobicContact CD1-CB 3.66Å; L100-W112 HydrophobicContact CD1-CG 3.83Å; L100-W112 HydrophobicContact CG-CB 3.93Å; L100-W112 PolarHBondContact N-O 3.17Å; L100-W112 PolarHBondContact O-N 3.28Å; T102-W112 PolarHBondContact OG1-NE1 3.11Å; T102-W112 VanDerWaalsContact OG1-NE1 3.17Å; W112-L124 HydrophobicContact CB-CD1 3.89Å; W112-L124 HydrophobicContact CB-CG 4.26Å; W112-L124 HydrophobicContact CD2-CG 4.47Å; W112-L124 HydrophobicContact CE3-CD2 4.35Å; W112-L124 HydrophobicContact CE3-CG 3.88Å; W112-T125 CarbonylContact C-O 3.54Å; W112-T125 WeakPolarHBondContact CA-O 3.41Å; W112-T125 VanDerWaalsContact CE3-C 3.45Å; W112-Q126 HydrophobicContact CD2-CB 4.14Å; W112-Q126 HydrophobicContact CD2-CG 4.32Å; W112-Q126 HydrophobicContact CE3-CB 3.81Å; W112-Q126 HydrophobicContact CE3-CG 4.48Å; W112-Q126 HydrophobicContact CH2-CB 3.87Å; W112-Q126 HydrophobicContact CH2-CG 4.31Å; W112-Q126 HydrophobicContact CZ2-CB 4.18Å; W112-Q126 HydrophobicContact CZ2-CG 4.14Å; W112-Q126 HydrophobicContact CZ3-CB 3.67Å; W112-Q126 HydrophobicContact CZ3-CG 4.48Å
113	E	91.3	Very high	85.2	Confident	41 Å²	41	35.5 Å²	35.5	19%	0.192	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	135.3	175.1	-174	177.3	-128.1	0	0	110.6	K99 T115 T125 R127	K99-E113 WeakPolarHBondContact CE-OE1 3.43Å; K99-E113 HydrophobicContact CG-CB 3.97Å; K99-E113 HydrophobicContact CG-CG 3.87Å; K99-E113 IonicContact NZ-OE1 2.77Å; E113-T115 HydrophobicContact CB-CG2 4.22Å; E113-T115 HydrophobicContact CG-CG2 3.91Å; E113-T115 PolarHBondContact O-N 2.79Å; E113-T125 PolarHBondContact N-O 3.35Å; E113-T125 PolarHBondContact O-N 3.41Å; E113-T125 PolarHBondContact O-OG1 3.3Å; E113-R127 HydrophobicContact CB-CG 3.52Å; E113-R127 IonicContact OE2-CZ 3.77Å; E113-R127 IonicContact OE2-NE 3.63Å; E113-R127 PolarHBondContact OE2-NE 2.67Å; E113-R127 IonicContact OE2-NH2 2.7Å; E113-R127 PolarHBondContact OE2-NH2 3.17Å
114	L	89.4	Confident	84.9	Confident	9 Å²	9	36.2 Å²	36.2	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	97.7	176.5	-168.4	62.7	0	0	0	109.7	M58 F78 R98 L124 L1213	M58-L114 HydrophobicContact SD-CD2 4.1Å; F78-L114 HydrophobicContact CB-CD1 4.22Å; F78-L114 HydrophobicContact CD1-CD1 3.52Å; F78-L114 HydrophobicContact CD2-CD1 3.84Å; F78-L114 HydrophobicContact CD2-CD2 4.16Å; F78-L114 HydrophobicContact CE1-CD1 3.7Å; F78-L114 HydrophobicContact CE1-CG 4.46Å; F78-L114 HydrophobicContact CE2-CD1 4.04Å; F78-L114 HydrophobicContact CE2-CD2 3.82Å; F78-L114 HydrophobicContact CE2-CG 4.46Å; F78-L114 HydrophobicContact CG-CD1 3.58Å; F78-L114 HydrophobicContact CZ-CD1 3.97Å; F78-L114 HydrophobicContact CZ-CD2 4.08Å; F78-L114 HydrophobicContact CZ-CG 4.36Å; R98-L114 HydrophobicContact CB-CB 4.22Å; R98-L114 PolarHBondContact O-N 3.34Å; L114-L124 HydrophobicContact CB-CD1 4.39Å; L114-L124 HydrophobicContact CD1-CB 4.31Å; L114-L124 HydrophobicContact CD1-CD1 4.38Å; L114-L1213 HydrophobicContact CD2-CD2 3.48Å; L114-L1213 VanDerWaalsContact CD2-CD2 3.48Å; L114-L1213 HydrophobicContact CG-CD1 4.15Å; L114-L1213 HydrophobicContact CG-CD2 3.81Å; L114-L1213 WeakPolarHBondContact O-CD1 3.09Å
115	T	84.9	Confident	84.6	Confident	23 Å²	23	37.5 Å²	37.5	14%	0.141	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	144.1	-170.2	54.2	0	0	0	0	111.8	E113 S122 Q123 T125 R127	E113-T115 HydrophobicContact CB-CG2 4.22Å; E113-T115 HydrophobicContact CG-CG2 3.91Å; E113-T115 PolarHBondContact O-N 2.79Å; T115-S122 CarbonylContact O-C 3.58Å; T115-S122 WeakPolarHBondContact O-CA 3.25Å; T115-S122 VanDerWaalsContact O-CB 3.24Å; T115-S122 WeakPolarHBondContact O-CB 3.21Å; T115-Q123 PolarHBondContact N-O 3.42Å; T115-Q123 PolarHBondContact O-N 3.23Å; T115-Q123 PolarHBondContact OG1-O 3.38Å; T115-T125 VanDerWaalsContact CG2-OG1 3.23Å; T115-T125 WeakPolarHBondContact CG2-OG1 3.18Å; T115-T125 PolarHBondContact OG1-OG1 2.97Å; T115-R127 VanDerWaalsContact CG2-NH2 3.34Å
116	S	80	Confident	84.5	Confident	70 Å²	70	38.4 Å²	38.4	49%	0.49	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.4	171.8	-140.8	0	0	0	0	110.1	S118 S121 S122	S116-S118 PolarHBondContact OG-O 3.14Å; S116-S121 PolarHBondContact OG-O 3.1Å; S116-S122 PolarHBondContact OG-OG 3.41Å
117	V	75.1	Confident	84.2	Confident	88 Å²	88	40.8 Å²	40.8	53%	0.533	22%	0.218	S	C	.	.	S	Bend	trans	-84.3	-33.4	176.5	-172.1	0	0	0	0	110.5	S121 Q123	V117-S121 PolarHBondContact N-O 2.89Å; V117-Q123 HydrophobicContact CG2-CB 4.33Å; V117-Q123 HydrophobicContact CG2-CG 3.55Å
118	S	71.1	Confident	83.8	Confident	49 Å²	49	40.6 Å²	40.6	34%	0.343	22%	0.217	S	C	.	.	S	Bend	trans	-143.7	-175.6	174.9	77.5	0	0	0	0	110.7	S116 T120 S121	S116-S118 PolarHBondContact OG-O 3.14Å; S118-T120 PolarHBondContact O-N 3.39Å; S118-T120 PolarHBondContact OG-N 3.42Å; S118-T120 VanDerWaalsContact OG-N 3.1Å; S118-S121 WeakPolarHBondContact CB-OG 3.44Å; S118-S121 PolarHBondContact N-O 2.88Å; S118-S121 PolarHBondContact OG-N 3.11Å; S118-S121 PolarHBondContact OG-OG 3.43Å
119	Q	66.1	Low	83.6	Confident	143 Å²	143	41 Å²	41	67%	0.668	22%	0.222	S	C	*	.	S	Bend	trans	-69.5	-8.4	171.4	-64	-168.9	16	0	0	114.3	R1212	Q119-R1212 WeakPolarHBondContact O-CG 3.41Å; Q119-R1212 PolarHBondContact O-NE 3.36Å
120	T	62.4	Low	83.4	Confident	38 Å²	38	41.4 Å²	41.4	23%	0.233	22%	0.224	C	C	.	.	S	Bend	trans	-135.7	1.8	-176.7	62.8	0	0	0	0	113.6	S118 L549 Y1211	S118-T120 PolarHBondContact O-N 3.39Å; S118-T120 PolarHBondContact OG-N 3.42Å; S118-T120 VanDerWaalsContact OG-N 3.1Å; T120-L549 HydrophobicContact CG2-CD1 3.77Å; T120-Y1211 CarbonylContact C-O 3.4Å
121	S	69.4	Low	83.2	Confident	48 Å²	48	47.2 Å²	47.2	34%	0.336	25%	0.249	S	C	.	.			trans	-135.9	132.5	176.3	63.3	0	0	0	0	110.6	S116 V117 S118	S116-S121 PolarHBondContact OG-O 3.1Å; V117-S121 PolarHBondContact N-O 2.89Å; S118-S121 WeakPolarHBondContact CB-OG 3.44Å; S118-S121 PolarHBondContact N-O 2.88Å; S118-S121 PolarHBondContact OG-N 3.11Å; S118-S121 PolarHBondContact OG-OG 3.43Å
122	S	79.9	Confident	83.1	Confident	6 Å²	6	55.2 Å²	55.2	4%	0.042	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	148.8	174.7	-45.5	0	0	0	0	107.7	T115 S116 Y1211	T115-S122 CarbonylContact O-C 3.58Å; T115-S122 WeakPolarHBondContact O-CA 3.25Å; T115-S122 VanDerWaalsContact O-CB 3.24Å; T115-S122 WeakPolarHBondContact O-CB 3.21Å; S116-S122 PolarHBondContact OG-OG 3.41Å; S122-Y1211 WeakPolarHBondContact O-CE2 3.3Å; S122-Y1211 PolarHBondContact O-OH 2.92Å
123	Q	84.5	Confident	83	Confident	84 Å²	84	54.8 Å²	54.8	39%	0.393	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	155.5	-171.3	68	-176.1	18.4	0	0	110.4	T115 V117 T125	T115-Q123 PolarHBondContact N-O 3.42Å; T115-Q123 PolarHBondContact O-N 3.23Å; T115-Q123 PolarHBondContact OG1-O 3.38Å; V117-Q123 HydrophobicContact CG2-CB 4.33Å; V117-Q123 HydrophobicContact CG2-CG 3.55Å; Q123-T125 HydrophobicContact CG-CG2 4.01Å; Q123-T125 VanDerWaalsContact NE2-CG2 3.34Å
124	L	90.2	Very high	83	Confident	17 Å²	17	53.1 Å²	53.1	9%	0.089	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	108.8	174.9	-173.9	64.4	0	0	0	108.8	I68 I70 A80 L100 W112 L114	I68-L124 HydrophobicContact CB-CD2 4.19Å; I68-L124 HydrophobicContact CD1-CD2 4.46Å; I68-L124 HydrophobicContact CG2-CD2 3.73Å; I70-L124 HydrophobicContact CD1-CD1 3.72Å; I70-L124 HydrophobicContact CD1-CD2 3.71Å; I70-L124 HydrophobicContact CD1-CG 4.24Å; I70-L124 HydrophobicContact CG1-CD2 4.19Å; A80-L124 HydrophobicContact CB-CB 4.17Å; A80-L124 HydrophobicContact CB-CD2 3.88Å; A80-L124 HydrophobicContact CB-CG 4.21Å; L100-L124 HydrophobicContact CD2-CD1 4.4Å; L100-L124 HydrophobicContact CD2-CD2 4.44Å; W112-L124 HydrophobicContact CB-CD1 3.89Å; W112-L124 HydrophobicContact CB-CG 4.26Å; W112-L124 HydrophobicContact CD2-CG 4.47Å; W112-L124 HydrophobicContact CE3-CD2 4.35Å; W112-L124 HydrophobicContact CE3-CG 3.88Å; L114-L124 HydrophobicContact CB-CD1 4.39Å; L114-L124 HydrophobicContact CD1-CB 4.31Å; L114-L124 HydrophobicContact CD1-CD1 4.38Å
125	T	89.8	Confident	82.9	Confident	28 Å²	28	55.1 Å²	55.1	17%	0.172	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.5	-177.2	31.6	0	0	0	0	111.6	W112 E113 T115 Q123 R127	W112-T125 CarbonylContact C-O 3.54Å; W112-T125 WeakPolarHBondContact CA-O 3.41Å; W112-T125 VanDerWaalsContact CE3-C 3.45Å; E113-T125 PolarHBondContact N-O 3.35Å; E113-T125 PolarHBondContact O-N 3.41Å; E113-T125 PolarHBondContact O-OG1 3.3Å; T115-T125 VanDerWaalsContact CG2-OG1 3.23Å; T115-T125 WeakPolarHBondContact CG2-OG1 3.18Å; T115-T125 PolarHBondContact OG1-OG1 2.97Å; Q123-T125 HydrophobicContact CG-CG2 4.01Å; Q123-T125 VanDerWaalsContact NE2-CG2 3.34Å; T125-R127 PolarHBondContact O-N 3.14Å
126	Q	90.2	Very high	82.9	Confident	64 Å²	64	58.6 Å²	58.6	30%	0.299	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	123.4	168.2	-162.1	179.9	-101.1	0	0	108.1	H82 Y110 W112	H82-Q126 PolarHBondContact ND1-OE1 2.92Å; Y110-Q126 HydrophobicContact CD1-CG 4.39Å; Y110-Q126 VanDerWaalsContact CD1-OE1 3.27Å; W112-Q126 HydrophobicContact CD2-CB 4.14Å; W112-Q126 HydrophobicContact CD2-CG 4.32Å; W112-Q126 HydrophobicContact CE3-CB 3.81Å; W112-Q126 HydrophobicContact CE3-CG 4.48Å; W112-Q126 HydrophobicContact CH2-CB 3.87Å; W112-Q126 HydrophobicContact CH2-CG 4.31Å; W112-Q126 HydrophobicContact CZ2-CB 4.18Å; W112-Q126 HydrophobicContact CZ2-CG 4.14Å; W112-Q126 HydrophobicContact CZ3-CB 3.67Å; W112-Q126 HydrophobicContact CZ3-CG 4.48Å
127	R	86.4	Confident	83.1	Confident	105 Å²	105	55.2 Å²	55.2	40%	0.396	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-32.9	-175.4	-68.8	-53.3	-150	169.2	12.9	113.8	L111 E113 T115 T125 F192	L111-R127 HydrophobicContact CD2-CB 4.27Å; L111-R127 HydrophobicContact CG-CB 4.25Å; L111-R127 PolarHBondContact O-N 3.48Å; E113-R127 HydrophobicContact CB-CG 3.52Å; E113-R127 IonicContact OE2-CZ 3.77Å; E113-R127 IonicContact OE2-NE 3.63Å; E113-R127 PolarHBondContact OE2-NE 2.67Å; E113-R127 IonicContact OE2-NH2 2.7Å; E113-R127 PolarHBondContact OE2-NH2 3.17Å; T115-R127 VanDerWaalsContact CG2-NH2 3.34Å; T125-R127 PolarHBondContact O-N 3.14Å; R127-F192 VanDerWaalsContact O-CD1 3.25Å; R127-F192 WeakPolarHBondContact O-CD1 3.17Å
128	S	85.3	Confident	83.1	Confident	4 Å²	4	54.8 Å²	54.8	3%	0.028	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	162.2	176.2	49.4	0	0	0	0	111.9	Y110 L111 F192 W196	Y110-S128 WeakPolarHBondContact CA-O 3.18Å; L111-S128 WeakPolarHBondContact CB-OG 3.33Å; L111-S128 PolarHBondContact N-O 3.34Å; L111-S128 PolarHBondContact O-N 3.43Å; S128-F192 WeakPolarHBondContact CB-O 3.21Å; S128-W196 VanDerWaalsContact OG-CD1 3.32Å; S128-W196 PolarHBondContact OG-NE1 3.31Å
129	C	88.1	Confident	82.6	Confident	27 Å²	27	55.3 Å²	55.3	18%	0.182	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	125.6	174.3	175.4	0	0	0	0	108.2	M109 Y110	M109-C129 CarbonylContact O-C 3.56Å; M109-C129 WeakPolarHBondContact O-CA 3.34Å; Y110-C129 HydrophobicContact CD1-CB 3.7Å; Y110-C129 HydrophobicContact CE1-CB 3.86Å; Y110-C129 WeakPolarHBondContact CE1-SG 3.34Å; Y110-C129 HydrophobicContact CG-CB 4.33Å; Y110-C129 VanDerWaalsContact CZ-SG 3.53Å
130	L	89.3	Confident	82	Confident	12 Å²	12	55.7 Å²	55.7	6%	0.063	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	114.2	174.3	-164.2	68.6	0	0	0	107.6	D108 M109 I133 V181 W196 L198	D108-L130 WeakPolarHBondContact CA-O 3.46Å; M109-L130 PolarHBondContact N-O 3.2Å; M109-L130 PolarHBondContact O-N 3.49Å; L130-I133 HydrophobicContact CB-CG2 4.02Å; L130-I133 HydrophobicContact CD2-CG2 3.72Å; L130-I133 HydrophobicContact CG-CG2 3.84Å; L130-V181 HydrophobicContact CD2-CG1 3.57Å; L130-W196 HydrophobicContact CD1-CB 4.48Å; L130-W196 HydrophobicContact CD2-CB 3.97Å; L130-L198 HydrophobicContact CD1-CD2 3.99Å; L130-L198 HydrophobicContact CD1-CG 4.03Å; L130-L198 HydrophobicContact CD2-CD2 3.97Å; L130-L198 HydrophobicContact CD2-CG 4.49Å; L130-L198 HydrophobicContact CG-CD2 3.82Å; L130-L198 HydrophobicContact CG-CG 4.39Å
131	K	90.1	Very high	81.2	Confident	125 Å²	125	59.2 Å²	59.2	54%	0.543	30%	0.3	S	S	.	.			trans	-91.6	140.8	-172.7	-65.4	-160.5	173.6	-167.4	0	112.8	D108 I133	D108-K131 WeakPolarHBondContact OD1-CA 3.5Å; D108-K131 VanDerWaalsContact OD1-CB 3.26Å; D108-K131 WeakPolarHBondContact OD1-CB 3.32Å; K131-I133 PolarHBondContact O-N 2.89Å
132	R	89.3	Confident	79.8	Confident	169 Å²	169	62.8 Å²	62.8	64%	0.638	33%	0.325	S	S	*	.			trans	45.1	61.7	178.7	-59.4	177.9	174.4	-177.1	-5.9	112.3	D107 D108 T134 S135	D107-R132 CarbonylContact O-C 3.52Å; D107-R132 WeakPolarHBondContact O-CA 3.43Å; D107-R132 PolarHBondContact O-N 2.83Å; D108-R132 PolarHBondContact OD1-N 2.87Å; R132-T134 PolarHBondContact O-N 3.12Å; R132-T134 VanDerWaalsContact O-N 3.09Å; R132-S135 WeakPolarHBondContact O-CB 3.34Å; R132-S135 PolarHBondContact O-N 3.16Å; R132-S135 PolarHBondContact O-OG 2.93Å
133	I	91.1	Very high	78	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.8	-172.2	69.2	179.8	0	0	0	113.3	D107 M109 L130 K131 V157 I171 V181 P199	D107-I133 HydrophobicContact CB-CG1 4.33Å; D107-I133 PolarHBondContact O-N 2.8Å; M109-I133 HydrophobicContact CB-CD1 4.31Å; M109-I133 HydrophobicContact CB-CG2 3.95Å; M109-I133 HydrophobicContact SD-CD1 4.39Å; L130-I133 HydrophobicContact CB-CG2 4.02Å; L130-I133 HydrophobicContact CD2-CG2 3.72Å; L130-I133 HydrophobicContact CG-CG2 3.84Å; K131-I133 PolarHBondContact O-N 2.89Å; I133-V157 HydrophobicContact CD1-CG2 3.88Å; I133-V157 HydrophobicContact CG1-CG2 4.03Å; I133-I171 HydrophobicContact CB-CD1 4.5Å; I133-I171 HydrophobicContact CD1-CD1 3.76Å; I133-I171 HydrophobicContact CD1-CG2 3.99Å; I133-I171 HydrophobicContact CG1-CD1 3.81Å; I133-V181 HydrophobicContact CD1-CG2 4.34Å; I133-P199 WeakPolarHBondContact O-CD 3.34Å; I133-P199 WeakPolarHBondContact O-CG 3.3Å
134	T	91	Very high	76	Confident	7 Å²	7	67.7 Å²	67.7	4%	0.043	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-7.1	175.8	52.6	0	0	0	0	114.4	D107 R132 Q136 L137 S155 V157 T173	D107-T134 HydrophobicContact CB-CG2 4.22Å; D107-T134 PolarHBondContact OD2-OG1 2.77Å; R132-T134 PolarHBondContact O-N 3.12Å; R132-T134 VanDerWaalsContact O-N 3.09Å; T134-Q136 PolarHBondContact O-N 3.02Å; T134-Q136 VanDerWaalsContact O-N 3.09Å; T134-L137 PolarHBondContact O-N 2.74Å; T134-S155 WeakPolarHBondContact CB-O 3.21Å; T134-S155 PolarHBondContact OG1-O 2.9Å; T134-V157 HydrophobicContact CG2-CG2 3.71Å; T134-T173 HydrophobicContact CG2-CG2 3.93Å
135	S	87.9	Confident	73.6	Confident	51 Å²	51	72.5 Å²	72.5	36%	0.357	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.6	-169.9	55.4	0	0	0	0	115.5	R132	R132-S135 WeakPolarHBondContact O-CB 3.34Å; R132-S135 PolarHBondContact O-N 3.16Å; R132-S135 PolarHBondContact O-OG 2.93Å
136	Q	84.4	Confident	71.3	Confident	95 Å²	95	77 Å²	77	44%	0.444	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-14.1	175.4	-58.6	-169.5	9.4	0	0	113.3	T134 K138 P199	T134-Q136 PolarHBondContact O-N 3.02Å; T134-Q136 VanDerWaalsContact O-N 3.09Å; Q136-K138 VanDerWaalsContact C-N 3.25Å; Q136-K138 PolarHBondContact O-N 3.44Å; Q136-K138 VanDerWaalsContact O-N 3.11Å; Q136-P199 PolarHBondContact OE1-O 3.34Å
137	L	84.7	Confident	68.8	Low	0 Å²	0	79.1 Å²	79.1	0%	0	46%	0.462	C	S	.	.			trans	-90.8	49.5	-174.5	-53	-178.8	0	0	0	111.6	T134 I171 T173 N175 W177 A179 P199 A204	T134-L137 PolarHBondContact O-N 2.74Å; L137-I171 HydrophobicContact CD1-CD1 4.05Å; L137-I171 HydrophobicContact CD1-CG1 4.48Å; L137-T173 HydrophobicContact CD1-CG2 4.19Å; L137-N175 PolarHBondContact O-ND2 3.31Å; L137-W177 HydrophobicContact CB-CD2 4.36Å; L137-W177 HydrophobicContact CB-CE3 4.23Å; L137-W177 HydrophobicContact CD2-CE3 3.86Å; L137-W177 HydrophobicContact CD2-CZ3 4.21Å; L137-A179 HydrophobicContact CD1-CB 3.68Å; L137-A179 HydrophobicContact CD2-CB 4Å; L137-P199 HydrophobicContact CD1-CG 4.17Å; L137-P199 HydrophobicContact CD2-CB 4.39Å; L137-P199 HydrophobicContact CG-CG 4.43Å; L137-A204 HydrophobicContact CD2-CB 4.17Å
138	K	74.1	Confident	66.5	Low	78 Å²	78	78.9 Å²	78.9	34%	0.339	48%	0.477	S	S	.	.			trans	-99	131.8	179.6	-66.7	-176.6	176.3	-176.5	0	110.5	Q136 L140 E152	Q136-K138 VanDerWaalsContact C-N 3.25Å; Q136-K138 PolarHBondContact O-N 3.44Å; Q136-K138 VanDerWaalsContact O-N 3.11Å; K138-L140 PolarHBondContact O-N 2.81Å; K138-E152 IonicContact NZ-OE1 3.42Å; K138-E152 PolarHBondContact NZ-OE1 2.86Å
139	S	61.3	Low	64.5	Low	60 Å²	60	86.3 Å²	86.3	42%	0.42	52%	0.516	S	S	.	.			trans	-69	109.3	166.4	42.7	0	0	0	0	109.7	P141	S139-P141 WeakPolarHBondContact O-CD 3.37Å
140	L	52.7	Low	62.2	Low	152 Å²	152	92.9 Å²	92.9	80%	0.796	55%	0.549	S	S	*	.			trans	-64.5	123.9	170.5	-122.4	76.3	0	0	0	109	K138 S142	K138-L140 PolarHBondContact O-N 2.81Å; L140-S142 PolarHBondContact O-N 2.88Å
141	P	46.7	Very low	60.1	Low	111 Å²	111	99.3 Å²	99.3	72%	0.721	58%	0.584	S	S	*	*			trans	-71.3	98.6	173.4	27.9	-32.3	0	0	0	109.1	S139 G143	S139-P141 WeakPolarHBondContact O-CD 3.37Å; P141-G143 PolarHBondContact O-N 3.26Å
142	S	39.8	Very low	58.5	Low	124 Å²	124	99.9 Å²	99.9	87%	0.867	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	103.4	179.5	-63.4	0	0	0	0	111.6	L140	L140-S142 PolarHBondContact O-N 2.88Å
143	G	42.3	Very low	57.1	Low	76 Å²	76	99.1 Å²	99.1	78%	0.784	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	111.3	10.2	157.3	0	0	0	0	0	118.9	P141	P141-G143 PolarHBondContact O-N 3.26Å
144	V	42.2	Very low	56.2	Low	117 Å²	117	103 Å²	103	71%	0.709	62%	0.616	S	S	*	*			trans	-123.8	123.9	175.3	-173.6	0	0	0	0	111.4	S146	V144-S146 PolarHBondContact O-N 2.77Å
145	P	39.1	Very low	56	Low	118 Å²	118	103 Å²	103	77%	0.766	62%	0.616	S	S	*	*			trans	-68.3	124.4	174.1	28.1	-32.8	0	0	0	110.2	S147	P145-S147 PolarHBondContact O-N 3.31Å
146	S	40.8	Very low	56.2	Low	123 Å²	123	103 Å²	103	86%	0.86	61%	0.611	S	S	*	*			trans	-73.4	96.5	-171.6	45.4	0	0	0	0	113.3	V144 S148	V144-S146 PolarHBondContact O-N 2.77Å; S146-S148 PolarHBondContact O-N 2.96Å
147	S	38.7	Very low	56.7	Low	108 Å²	108	98.9 Å²	98.9	76%	0.755	59%	0.592	S	S	*	*			trans	-79.4	106.4	162.3	57.7	0	0	0	0	110.7	P145	P145-S147 PolarHBondContact O-N 3.31Å
148	S	38.6	Very low	57.2	Low	100 Å²	100	100.7 Å²	100.7	70%	0.699	60%	0.603	S	S	*	*	S	Bend	trans	28.1	92.5	157.6	62.2	0	0	0	0	118.5	S146	S146-S148 PolarHBondContact O-N 2.96Å
149	N	41.7	Very low	58.1	Low	159 Å²	159	97.5 Å²	97.5	85%	0.85	59%	0.591	S	S	*	*			trans	-158.2	124.7	135.2	-101.1	-27.5	0	0	0	110.3	N151	N149-N151 VanDerWaalsContact C-N 3.26Å; N149-N151 PolarHBondContact O-N 2.82Å
150	N	39.8	Very low	59.6	Low	165 Å²	165	96 Å²	96	88%	0.882	58%	0.578	S	S	*	*			trans	-81.8	58.6	-169.9	-69.3	-15.8	0	0	0	113.4
151	N	46.9	Very low	61.4	Low	148 Å²	148	89.6 Å²	89.6	79%	0.791	55%	0.546	S	S	*	.			trans	-104	91.9	159.7	-72.6	-4.7	0	0	0	107.2	N149 E153	N149-N151 VanDerWaalsContact C-N 3.26Å; N149-N151 PolarHBondContact O-N 2.82Å; N151-E153 PolarHBondContact O-N 2.88Å
152	E	56.2	Low	63.3	Low	137 Å²	137	86.6 Å²	86.6	64%	0.64	52%	0.52	S	S	*	.			trans	-58.9	120	162.2	-71	-164.3	92	0	0	107.6	K138 T154	K138-E152 IonicContact NZ-OE1 3.42Å; K138-E152 PolarHBondContact NZ-OE1 2.86Å; E152-T154 VanDerWaalsContact C-N 3.33Å; E152-T154 HydrophobicContact CB-CG2 4.49Å; E152-T154 PolarHBondContact O-N 2.84Å
153	E	59.9	Low	65.4	Low	152 Å²	152	81 Å²	81	71%	0.71	48%	0.482	S	S	*	.			trans	-66.2	98.5	166.8	-73.6	-175	144.5	0	0	107.9	N151	N151-E153 PolarHBondContact O-N 2.88Å
154	T	72.4	Confident	67.3	Low	82 Å²	82	81 Å²	81	50%	0.503	47%	0.469	S	S	.	.			trans	-84	115.9	173.2	51.6	0	0	0	0	108.6	E152 H156	E152-T154 VanDerWaalsContact C-N 3.33Å; E152-T154 HydrophobicContact CB-CG2 4.49Å; E152-T154 PolarHBondContact O-N 2.84Å; T154-H156 PolarHBondContact OG1-NE2 2.99Å
155	S	86.1	Confident	69	Low	7 Å²	7	79.6 Å²	79.6	5%	0.049	46%	0.458	C	S	.	.			trans	-79.6	141.6	168.7	173.3	0	0	0	0	109.7	T134 T173 D174 N175	T134-S155 WeakPolarHBondContact CB-O 3.21Å; T134-S155 PolarHBondContact OG1-O 2.9Å; S155-T173 WeakPolarHBondContact OG-CB 3.28Å; S155-D174 VanDerWaalsContact CA-OD1 3.25Å; S155-D174 WeakPolarHBondContact CA-OD1 3.23Å; S155-D174 PolarHBondContact OG-OD1 3.03Å; S155-N175 PolarHBondContact OG-OD1 3.16Å
156	H	92.7	Very high	70.8	Confident	52 Å²	52	75.4 Å²	75.4	24%	0.241	44%	0.437	C	S	.	.			trans	-123.8	147.2	-177.1	-69.2	-57.9	0	0	0	111.8	D107 T154 T158 T173 D174	D107-H156 IonicContact OD1-ND1 3.35Å; D107-H156 IonicContact OD2-CE1 3.87Å; D107-H156 IonicContact OD2-CG 2.7Å; D107-H156 IonicContact OD2-ND1 3.83Å; D107-H156 PolarHBondContact OD2-ND1 3.25Å; T154-H156 PolarHBondContact OG1-NE2 2.99Å; H156-T158 PolarHBondContact O-N 3.49Å; H156-T173 CarbonylContact O-C 3.59Å; H156-T173 VanDerWaalsContact O-CA 3.24Å; H156-T173 WeakPolarHBondContact O-CA 3.39Å; H156-D174 IonicContact CD2-OD2 3Å; H156-D174 PolarHBondContact N-OD1 3.4Å; H156-D174 PolarHBondContact O-N 3.16Å
157	V	95	Very high	72.6	Confident	8 Å²	8	77.5 Å²	77.5	5%	0.048	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	128.7	174.6	-179.7	0	0	0	0	109.8	L103 D107 I133 T134 L160 I171 G172	L103-V157 HydrophobicContact CD1-CG2 4.49Å; L103-V157 HydrophobicContact CD2-CB 3.96Å; L103-V157 HydrophobicContact CD2-CG1 3.73Å; D107-V157 HydrophobicContact CB-CG2 4.36Å; D107-V157 WeakPolarHBondContact OD1-CG2 3.19Å; D107-V157 PolarHBondContact OD1-N 3.39Å; I133-V157 HydrophobicContact CD1-CG2 3.88Å; I133-V157 HydrophobicContact CG1-CG2 4.03Å; T134-V157 HydrophobicContact CG2-CG2 3.71Å; V157-L160 HydrophobicContact CG1-CD2 3.73Å; V157-L160 HydrophobicContact CG1-CG 4.18Å; V157-I171 HydrophobicContact CG2-CD1 4.46Å; V157-G172 WeakPolarHBondContact CA-O 3.38Å
158	T	94.6	Very high	74.9	Confident	38 Å²	38	72.8 Å²	72.8	23%	0.233	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-30	178.7	45.5	0	0	0	0	112.8	F6 H156 G172 T173 D174 A226 V227	F6-T158 HydrophobicContact CE2-CG2 3.76Å; F6-T158 HydrophobicContact CZ-CG2 3.5Å; H156-T158 PolarHBondContact O-N 3.49Å; T158-G172 PolarHBondContact N-O 2.89Å; T158-G172 PolarHBondContact OG1-O 3.02Å; T158-G172 VanDerWaalsContact OG1-O 3.11Å; T158-T173 VanDerWaalsContact OG1-CA 3.3Å; T158-T173 WeakPolarHBondContact OG1-CA 3.25Å; T158-T173 PolarHBondContact OG1-N 3.26Å; T158-T173 PolarHBondContact OG1-O 2.84Å; T158-D174 HydrophobicContact CG2-CB 3.76Å; T158-A226 HydrophobicContact CG2-CB 4.42Å; T158-V227 WeakPolarHBondContact CB-O 3.32Å; T158-V227 PolarHBondContact OG1-O 2.92Å
159	A	93.5	Very high	77.3	Confident	10 Å²	10	68.2 Å²	68.2	8%	0.083	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.3	-179.4	0	0	0	0	0	111.1	G172 V227 L230	A159-G172 PolarHBondContact N-O 2.92Å; A159-G172 PolarHBondContact O-N 2.94Å; A159-V227 HydrophobicContact CB-CG1 4.34Å; A159-L230 HydrophobicContact CB-CB 3.75Å
160	L	92.3	Very high	79.8	Confident	30 Å²	30	61 Å²	61	16%	0.157	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.4	173.2	-68.3	-175.5	0	0	0	109.7	V92 L103 V157 I169 L170 I171	V92-L160 HydrophobicContact CG2-CD1 4.27Å; L103-L160 HydrophobicContact CD2-CD1 4.12Å; L103-L160 HydrophobicContact CD2-CG 4.45Å; V157-L160 HydrophobicContact CG1-CD2 3.73Å; V157-L160 HydrophobicContact CG1-CG 4.18Å; L160-I169 HydrophobicContact CD2-CG2 4.05Å; L160-L170 WeakPolarHBondContact CA-O 3.14Å; L160-I171 HydrophobicContact CD2-CB 4.2Å; L160-I171 HydrophobicContact CD2-CG2 3.6Å
161	C	90	Very high	82.4	Confident	16 Å²	16	53.1 Å²	53.1	11%	0.108	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	120.7	168.4	-177.1	0	0	0	0	109.2	L170 L230	C161-L170 HydrophobicContact CB-CB 4.31Å; C161-L170 PolarHBondContact N-O 2.9Å; C161-L170 PolarHBondContact O-N 2.82Å; C161-L230 HydrophobicContact CB-CB 4.5Å; C161-L230 HydrophobicContact CB-CD2 4.21Å; C161-L230 HydrophobicContact CB-CG 3.85Å
162	Y	85.9	Confident	84.7	Confident	49 Å²	49	46.1 Å²	46.1	19%	0.192	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	124.4	167.6	-179.1	-132	0	0	0	108.3	L94 G166 S168 I169	L94-Y162 HydrophobicContact CB-CE1 4.27Å; L94-Y162 HydrophobicContact CB-CE2 4.18Å; L94-Y162 HydrophobicContact CD2-CD2 3.7Å; L94-Y162 HydrophobicContact CD2-CE2 3.59Å; L94-Y162 HydrophobicContact CD2-CG 4.26Å; L94-Y162 HydrophobicContact CG-CE2 4.31Å; Y162-G166 VanDerWaalsContact OH-CA 3.24Å; Y162-G166 WeakPolarHBondContact OH-CA 3.16Å; Y162-G166 PolarHBondContact OH-O 2.86Å; Y162-S168 WeakPolarHBondContact CD2-O 3.45Å; Y162-I169 HydrophobicContact CD2-CG1 4.11Å
163	A	85	Confident	86.6	Confident	6 Å²	6	39.6 Å²	39.6	5%	0.05	21%	0.211	C	C	.	.			trans	-76.5	144.8	-176.6	0	0	0	0	0	111.1	D165 G166 S168	A163-D165 WeakPolarHBondContact CB-OD1 3.5Å; A163-D165 PolarHBondContact O-N 3.48Å; A163-G166 PolarHBondContact O-N 3.31Å; A163-S168 WeakPolarHBondContact CB-OG 3.23Å; A163-S168 PolarHBondContact N-O 3.44Å
164	S	81.7	Confident	88.2	Confident	75 Å²	75	34.7 Å²	34.7	52%	0.524	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-16	177.8	60.7	0	0	0	0	114.2	G166 E232	S164-G166 PolarHBondContact O-N 3.33Å; S164-E232 WeakPolarHBondContact CB-OE2 3.32Å; S164-E232 PolarHBondContact N-OE2 2.99Å; S164-E232 PolarHBondContact OG-OE1 2.86Å; S164-E232 PolarHBondContact OG-OE2 2.85Å
165	D	79.2	Confident	89.1	Confident	88 Å²	88	32.8 Å²	32.8	47%	0.471	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-14.3	173	81.8	-14.9	0	0	0	114	A163 R167 S168	A163-D165 WeakPolarHBondContact CB-OD1 3.5Å; A163-D165 PolarHBondContact O-N 3.48Å; D165-R167 WeakPolarHBondContact O-CG 3.19Å; D165-R167 PolarHBondContact O-N 3.34Å; D165-R167 PolarHBondContact OD1-N 2.84Å; D165-S168 PolarHBondContact OD1-N 2.81Å; D165-S168 PolarHBondContact OD1-OG 2.89Å
166	G	77	Confident	89.5	Confident	31 Å²	31	32.5 Å²	32.5	32%	0.32	18%	0.175	S	C	.	.	S	Bend	trans	68.5	11.2	-178.8	0	0	0	0	0	114.9	Y162 A163 S164	Y162-G166 VanDerWaalsContact OH-CA 3.24Å; Y162-G166 WeakPolarHBondContact OH-CA 3.16Å; Y162-G166 PolarHBondContact OH-O 2.86Å; A163-G166 PolarHBondContact O-N 3.31Å; S164-G166 PolarHBondContact O-N 3.33Å
167	R	77.9	Confident	89.6	Confident	166 Å²	166	31.2 Å²	31.2	63%	0.626	17%	0.168	S	C	*	.	S	Bend	trans	-125.8	-8.8	-170.6	-65.6	172.7	-177	-171.3	0.5	113.5	D165 L183	D165-R167 WeakPolarHBondContact O-CG 3.19Å; D165-R167 PolarHBondContact O-N 3.34Å; D165-R167 PolarHBondContact OD1-N 2.84Å; R167-L183 WeakPolarHBondContact O-CB 3.47Å; R167-L183 PolarHBondContact O-N 2.72Å
168	S	86	Confident	89.6	Confident	9 Å²	9	31 Å²	31	6%	0.063	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151.8	178.5	62.5	0	0	0	0	113.7	Y162 A163 D165 S180 V181	Y162-S168 WeakPolarHBondContact CD2-O 3.45Å; A163-S168 WeakPolarHBondContact CB-OG 3.23Å; A163-S168 PolarHBondContact N-O 3.44Å; D165-S168 PolarHBondContact OD1-N 2.81Å; D165-S168 PolarHBondContact OD1-OG 2.89Å; S168-S180 WeakPolarHBondContact CB-OG 3.27Å; S168-V181 WeakPolarHBondContact CA-O 3.35Å
169	I	90.6	Very high	89.6	Confident	5 Å²	5	29.3 Å²	29.3	3%	0.026	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.1	167.5	-62.6	170.6	0	0	0	106.5	L94 V101 M109 L160 Y162 I171 V181 W196	L94-I169 HydrophobicContact CD2-CD1 4.02Å; L94-I169 HydrophobicContact CD2-CG1 4.37Å; V101-I169 HydrophobicContact CB-CD1 4.06Å; V101-I169 HydrophobicContact CG1-CD1 4.05Å; V101-I169 HydrophobicContact CG2-CD1 3.72Å; M109-I169 HydrophobicContact CE-CD1 4.33Å; M109-I169 HydrophobicContact SD-CD1 4.12Å; L160-I169 HydrophobicContact CD2-CG2 4.05Å; Y162-I169 HydrophobicContact CD2-CG1 4.11Å; I169-I171 HydrophobicContact CG2-CG2 4.27Å; I169-V181 PolarHBondContact N-O 2.69Å; I169-V181 PolarHBondContact O-N 2.79Å; I169-W196 HydrophobicContact CD1-CH2 3.64Å; I169-W196 HydrophobicContact CD1-CZ2 4.34Å; I169-W196 HydrophobicContact CD1-CZ3 4.17Å; I169-W196 HydrophobicContact CG1-CH2 4.04Å; I169-W196 HydrophobicContact CG1-CZ3 4.25Å
170	L	92.9	Very high	89.4	Confident	7 Å²	7	29.9 Å²	29.9	4%	0.037	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.3	172	-60	166.7	0	0	0	108.5	L160 C161 A179 L230 L240	L160-L170 WeakPolarHBondContact CA-O 3.14Å; C161-L170 HydrophobicContact CB-CB 4.31Å; C161-L170 PolarHBondContact N-O 2.9Å; C161-L170 PolarHBondContact O-N 2.82Å; L170-A179 CarbonylContact C-O 3.58Å; L170-A179 WeakPolarHBondContact CA-O 3.48Å; L170-L230 HydrophobicContact CB-CD2 3.89Å; L170-L240 HydrophobicContact CD1-CD1 3.72Å; L170-L240 HydrophobicContact CD1-CD2 3.48Å; L170-L240 VanDerWaalsContact CD1-CD2 3.48Å; L170-L240 HydrophobicContact CD1-CG 4.25Å
171	I	95.1	Very high	89.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.6	179.2	72.6	178.3	0	0	0	108.8	I133 L137 V157 L160 I169 V178 A179 V181 P199	I133-I171 HydrophobicContact CB-CD1 4.5Å; I133-I171 HydrophobicContact CD1-CD1 3.76Å; I133-I171 HydrophobicContact CD1-CG2 3.99Å; I133-I171 HydrophobicContact CG1-CD1 3.81Å; L137-I171 HydrophobicContact CD1-CD1 4.05Å; L137-I171 HydrophobicContact CD1-CG1 4.48Å; V157-I171 HydrophobicContact CG2-CD1 4.46Å; L160-I171 HydrophobicContact CD2-CB 4.2Å; L160-I171 HydrophobicContact CD2-CG2 3.6Å; I169-I171 HydrophobicContact CG2-CG2 4.27Å; I171-V178 CarbonylContact O-C 3.59Å; I171-V178 VanDerWaalsContact O-CA 3.27Å; I171-V178 WeakPolarHBondContact O-CA 3.36Å; I171-A179 HydrophobicContact CG1-CB 4.27Å; I171-A179 PolarHBondContact N-O 2.97Å; I171-A179 PolarHBondContact O-N 2.83Å; I171-V181 HydrophobicContact CD1-CG2 4.14Å; I171-V181 HydrophobicContact CG2-CG2 3.87Å; I171-P199 HydrophobicContact CD1-CG 4.11Å
172	G	95.3	Very high	89.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	150.2	166.8	0	0	0	0	0	109.9	V157 T158 A159 W177	V157-G172 WeakPolarHBondContact CA-O 3.38Å; T158-G172 PolarHBondContact N-O 2.89Å; T158-G172 PolarHBondContact OG1-O 3.02Å; T158-G172 VanDerWaalsContact OG1-O 3.11Å; A159-G172 PolarHBondContact N-O 2.92Å; A159-G172 PolarHBondContact O-N 2.94Å; G172-W177 WeakPolarHBondContact CA-O 3.49Å
173	T	95.5	Very high	88.5	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	160.8	-174.5	54.9	0	0	0	0	114.2	T134 L137 S155 H156 T158 N175 G176 W177 V227	T134-T173 HydrophobicContact CG2-CG2 3.93Å; L137-T173 HydrophobicContact CD1-CG2 4.19Å; S155-T173 WeakPolarHBondContact OG-CB 3.28Å; H156-T173 CarbonylContact O-C 3.59Å; H156-T173 VanDerWaalsContact O-CA 3.24Å; H156-T173 WeakPolarHBondContact O-CA 3.39Å; T158-T173 VanDerWaalsContact OG1-CA 3.3Å; T158-T173 WeakPolarHBondContact OG1-CA 3.25Å; T158-T173 PolarHBondContact OG1-N 3.26Å; T158-T173 PolarHBondContact OG1-O 2.84Å; T173-N175 VanDerWaalsContact C-N 3.27Å; T173-N175 WeakPolarHBondContact CB-OD1 3.4Å; T173-N175 PolarHBondContact O-N 2.88Å; T173-N175 PolarHBondContact OG1-OD1 3.33Å; T173-G176 PolarHBondContact O-N 3.15Å; T173-W177 PolarHBondContact N-O 2.99Å; T173-W177 WeakPolarHBondContact OG1-CA 3.39Å; T173-W177 WeakPolarHBondContact OG1-CB 3.42Å; T173-W177 PolarHBondContact OG1-N 3.44Å; T173-W177 PolarHBondContact OG1-O 3.01Å; T173-V227 PolarHBondContact O-N 2.94Å
174	D	93.9	Very high	87.6	Confident	50 Å²	50	34.5 Å²	34.5	27%	0.267	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-20.7	178.4	67.3	-14.7	0	0	0	114.9	F6 S155 H156 T158 A226	F6-D174 HydrophobicContact CE2-CB 4.4Å; S155-D174 VanDerWaalsContact CA-OD1 3.25Å; S155-D174 WeakPolarHBondContact CA-OD1 3.23Å; S155-D174 PolarHBondContact OG-OD1 3.03Å; H156-D174 IonicContact CD2-OD2 3Å; H156-D174 PolarHBondContact N-OD1 3.4Å; H156-D174 PolarHBondContact O-N 3.16Å; T158-D174 HydrophobicContact CG2-CB 3.76Å; D174-A226 HydrophobicContact CB-CB 4.44Å; D174-A226 WeakPolarHBondContact O-CA 3.47Å; D174-A226 WeakPolarHBondContact O-CB 3.16Å
175	N	92	Very high	86.6	Confident	42 Å²	42	35.6 Å²	35.6	23%	0.225	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	9	170.5	71	-14.2	0	0	0	114	L137 S155 T173 W177	L137-N175 PolarHBondContact O-ND2 3.31Å; S155-N175 PolarHBondContact OG-OD1 3.16Å; T173-N175 VanDerWaalsContact C-N 3.27Å; T173-N175 WeakPolarHBondContact CB-OD1 3.4Å; T173-N175 PolarHBondContact O-N 2.88Å; T173-N175 PolarHBondContact OG1-OD1 3.33Å; N175-W177 VanDerWaalsContact OD1-CD1 3.28Å
176	G	93.1	Very high	85.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	90.3	9.2	166.6	0	0	0	0	0	116.9	T173 D225 Y244	T173-G176 PolarHBondContact O-N 3.15Å; G176-D225 WeakPolarHBondContact CA-O 3.44Å; G176-D225 PolarHBondContact N-O 2.92Å; G176-Y244 PolarHBondContact O-OH 3.14Å
177	W	94.5	Very high	84.2	Confident	26 Å²	26	39.2 Å²	39.2	10%	0.098	19%	0.194	C	C	.	.			trans	-84.2	143.3	175.5	-63.3	53.1	0	0	0	110.8	L137 G172 T173 N175 A201 A204 I205 N206	L137-W177 HydrophobicContact CB-CD2 4.36Å; L137-W177 HydrophobicContact CB-CE3 4.23Å; L137-W177 HydrophobicContact CD2-CE3 3.86Å; L137-W177 HydrophobicContact CD2-CZ3 4.21Å; G172-W177 WeakPolarHBondContact CA-O 3.49Å; T173-W177 PolarHBondContact N-O 2.99Å; T173-W177 WeakPolarHBondContact OG1-CA 3.39Å; T173-W177 WeakPolarHBondContact OG1-CB 3.42Å; T173-W177 PolarHBondContact OG1-N 3.44Å; T173-W177 PolarHBondContact OG1-O 3.01Å; N175-W177 VanDerWaalsContact OD1-CD1 3.28Å; W177-A201 HydrophobicContact CH2-CB 4.31Å; W177-A201 HydrophobicContact CZ3-CB 3.98Å; W177-A204 HydrophobicContact CE3-CB 3.64Å; W177-A204 HydrophobicContact CZ3-CB 3.99Å; W177-I205 CarbonylContact C-O 3.48Å; W177-I205 WeakPolarHBondContact CA-O 3.16Å; W177-N206 HydrophobicContact CD2-CB 3.62Å; W177-N206 HydrophobicContact CE3-CB 3.84Å; W177-N206 HydrophobicContact CG-CB 4.15Å; W177-N206 HydrophobicContact CH2-CB 4.13Å; W177-N206 HydrophobicContact CZ2-CB 3.92Å; W177-N206 HydrophobicContact CZ3-CB 4.08Å
178	V	95.4	Very high	83	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.012	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.3	163.7	177.7	0	0	0	0	108.6	I171 I205 V227 L230 I242	I171-V178 CarbonylContact O-C 3.59Å; I171-V178 VanDerWaalsContact O-CA 3.27Å; I171-V178 WeakPolarHBondContact O-CA 3.36Å; V178-I205 HydrophobicContact CB-CB 4.27Å; V178-I205 HydrophobicContact CB-CD1 4.4Å; V178-I205 HydrophobicContact CG1-CD1 4.45Å; V178-I205 PolarHBondContact N-O 3.49Å; V178-I205 PolarHBondContact O-N 2.82Å; V178-V227 HydrophobicContact CG2-CG1 4.18Å; V178-V227 HydrophobicContact CG2-CG2 3.91Å; V178-L230 HydrophobicContact CG1-CD1 3.79Å; V178-L230 HydrophobicContact CG1-CD2 4.02Å; V178-L230 HydrophobicContact CG2-CD1 4.1Å; V178-I242 HydrophobicContact CB-CD1 4.34Å; V178-I242 HydrophobicContact CG2-CD1 3.93Å; V178-I242 HydrophobicContact CG2-CG1 4.22Å; V178-I242 HydrophobicContact CG2-CG2 3.88Å
179	A	94.1	Very high	81.4	Confident	3 Å²	3	39.5 Å²	39.5	3%	0.025	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	160.7	-177.5	0	0	0	0	0	112.3	L137 L170 I171 P199 A204	L137-A179 HydrophobicContact CD1-CB 3.68Å; L137-A179 HydrophobicContact CD2-CB 4Å; L170-A179 CarbonylContact C-O 3.58Å; L170-A179 WeakPolarHBondContact CA-O 3.48Å; I171-A179 HydrophobicContact CG1-CB 4.27Å; I171-A179 PolarHBondContact N-O 2.97Å; I171-A179 PolarHBondContact O-N 2.83Å; A179-P199 HydrophobicContact CB-CB 3.58Å; A179-P199 HydrophobicContact CB-CG 4.41Å; A179-A204 HydrophobicContact CB-CB 3.84Å
180	S	91.1	Very high	79.6	Confident	22 Å²	22	47 Å²	47	15%	0.154	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121.4	-175.7	-174.1	0	0	0	0	111.6	S168 R182	S168-S180 WeakPolarHBondContact CB-OG 3.27Å; S180-R182 WeakPolarHBondContact OG-CG 3.39Å
181	V	90.6	Very high	77.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108	167.7	-169.4	0	0	0	0	107.1	M109 L130 I133 S168 I169 I171 W196 P199	M109-V181 HydrophobicContact CE-CB 4.42Å; M109-V181 HydrophobicContact CE-CG1 3.63Å; M109-V181 HydrophobicContact SD-CG1 4.44Å; L130-V181 HydrophobicContact CD2-CG1 3.57Å; I133-V181 HydrophobicContact CD1-CG2 4.34Å; S168-V181 WeakPolarHBondContact CA-O 3.35Å; I169-V181 PolarHBondContact N-O 2.69Å; I169-V181 PolarHBondContact O-N 2.79Å; I171-V181 HydrophobicContact CD1-CG2 4.14Å; I171-V181 HydrophobicContact CG2-CG2 3.87Å; V181-W196 HydrophobicContact CG1-CB 4.27Å; V181-W196 HydrophobicContact CG1-CD2 4.4Å; V181-W196 HydrophobicContact CG1-CE3 3.84Å; V181-W196 WeakPolarHBondContact O-CZ3 3.36Å; V181-P199 HydrophobicContact CG2-CG 4.3Å
182	R	84.2	Confident	75.7	Confident	124 Å²	124	56.3 Å²	56.3	47%	0.468	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	136.3	-170.8	-62.7	-176.6	-176.4	135.5	5.4	111.8	S180 W196 C197 D203	S180-R182 WeakPolarHBondContact OG-CG 3.39Å; R182-W196 CarbonylContact O-C 3.54Å; R182-W196 WeakPolarHBondContact O-CA 3.26Å; R182-C197 PolarHBondContact O-N 3.39Å; R182-D203 IonicContact CZ-OD2 3.15Å; R182-D203 IonicContact NH1-OD2 2.71Å; R182-D203 PolarHBondContact NH1-OD2 2.85Å; R182-D203 IonicContact NH2-OD2 2.73Å; R182-D203 PolarHBondContact NH2-OD2 3.11Å
183	L	73.3	Confident	73.6	Confident	23 Å²	23	60.3 Å²	60.3	12%	0.12	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	115.7	-178.6	-148.2	167.2	0	0	0	109.3	L94 R167 T185 F195 W196	L94-L183 HydrophobicContact CD1-CD1 4.04Å; R167-L183 WeakPolarHBondContact O-CB 3.47Å; R167-L183 PolarHBondContact O-N 2.72Å; L183-T185 HydrophobicContact CD2-CG2 4.19Å; L183-T185 PolarHBondContact O-N 3.29Å; L183-F195 HydrophobicContact CD2-CD1 3.7Å; L183-F195 HydrophobicContact CD2-CE1 3.74Å; L183-W196 HydrophobicContact CB-CD2 4.39Å; L183-W196 HydrophobicContact CB-CE3 3.86Å; L183-W196 HydrophobicContact CB-CH2 3.98Å; L183-W196 HydrophobicContact CB-CZ2 4.45Å; L183-W196 HydrophobicContact CB-CZ3 3.65Å; L183-W196 HydrophobicContact CD1-CH2 3.55Å; L183-W196 HydrophobicContact CD1-CZ2 3.64Å; L183-W196 HydrophobicContact CD1-CZ3 4.14Å; L183-W196 HydrophobicContact CG-CD2 4.12Å; L183-W196 HydrophobicContact CG-CE3 4.05Å; L183-W196 HydrophobicContact CG-CH2 3.74Å; L183-W196 HydrophobicContact CG-CZ2 3.76Å; L183-W196 HydrophobicContact CG-CZ3 3.88Å
184	N	67.5	Low	71.7	Confident	52 Å²	52	64.6 Å²	64.6	28%	0.278	35%	0.353	S	S	.	.			trans	-92.7	94.6	-172.2	-173.5	13.4	0	0	0	110.6	N186 K194 F195	N184-N186 VanDerWaalsContact C-N 3.29Å; N184-N186 PolarHBondContact O-N 3.37Å; N184-K194 VanDerWaalsContact CB-O 3.28Å; N184-K194 WeakPolarHBondContact CB-O 3.06Å; N184-K194 PolarHBondContact ND2-O 2.85Å; N184-F195 PolarHBondContact N-O 2.81Å
185	T	59.8	Low	70.3	Confident	98 Å²	98	65.6 Å²	65.6	60%	0.601	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-4.7	-172.8	57.4	0	0	0	0	115	L183	L183-T185 HydrophobicContact CD2-CG2 4.19Å; L183-T185 PolarHBondContact O-N 3.29Å
186	N	52.9	Low	69.6	Low	144 Å²	144	64 Å²	64	77%	0.77	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	8.7	-162.4	-75.9	6.5	0	0	0	115.6	N184	N184-N186 VanDerWaalsContact C-N 3.29Å; N184-N186 PolarHBondContact O-N 3.37Å
187	T	53	Low	69.1	Low	50 Å²	50	67 Å²	67	31%	0.307	37%	0.365	S	S	.	.			trans	-103.5	109.6	-179.3	54.6	0	0	0	0	112.9	T189	T187-T189 PolarHBondContact O-N 2.99Å
188	A	52.6	Low	68.7	Low	112 Å²	112	68.9 Å²	68.9	93%	0.926	38%	0.377	S	S	*	.			trans	-75.9	41	171.9	0	0	0	0	0	113.1
189	T	52.7	Low	68.3	Low	69 Å²	69	68.9 Å²	68.9	42%	0.423	38%	0.377	S	S	.	.	S	Bend	trans	-129.4	127.4	-175.2	58.6	0	0	0	0	110.7	T187 D191	T187-T189 PolarHBondContact O-N 2.99Å; T189-D191 PolarHBondContact O-N 3.41Å
190	D	52	Low	67.9	Low	162 Å²	162	70.8 Å²	70.8	87%	0.866	39%	0.39	S	S	*	.			trans	-67.4	18.2	-178.8	-64.7	-43.4	0	0	0	115.4	F192	D190-F192 PolarHBondContact O-N 3.34Å
191	D	54.3	Low	67.6	Low	65 Å²	65	71.3 Å²	71.3	35%	0.348	40%	0.396	S	S	.	.			trans	-85.7	100.7	178.5	-174.2	-14.5	0	0	0	109.6	T189 T193 K194	T189-D191 PolarHBondContact O-N 3.41Å; D191-T193 PolarHBondContact O-N 2.95Å; D191-T193 PolarHBondContact OD1-N 3.23Å; D191-T193 PolarHBondContact OD1-OG1 2.85Å; D191-K194 HydrophobicContact CB-CD 3.92Å; D191-K194 HydrophobicContact CB-CG 4.12Å; D191-K194 WeakPolarHBondContact O-CB 3.34Å; D191-K194 PolarHBondContact O-N 3.05Å; D191-K194 WeakPolarHBondContact OD2-CE 3.23Å; D191-K194 IonicContact OD2-NZ 3.79Å; D191-K194 PolarHBondContact OD2-NZ 3.35Å
192	F	51.2	Low	67.4	Low	139 Å²	139	77.7 Å²	77.7	61%	0.61	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-52.6	-25.1	-172.9	-57.8	-62	0	0	0	114.7	R127 S128 D190 K194	R127-F192 VanDerWaalsContact O-CD1 3.25Å; R127-F192 WeakPolarHBondContact O-CD1 3.17Å; S128-F192 WeakPolarHBondContact CB-O 3.21Å; D190-F192 PolarHBondContact O-N 3.34Å; F192-K194 VanDerWaalsContact C-N 3.32Å
193	T	52.5	Low	67.5	Low	83 Å²	83	75.9 Å²	75.9	51%	0.509	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-71.8	-24.4	177.6	61.7	0	0	0	0	113.2	D191 F195	D191-T193 PolarHBondContact O-N 2.95Å; D191-T193 PolarHBondContact OD1-N 3.23Å; D191-T193 PolarHBondContact OD1-OG1 2.85Å; T193-F195 VanDerWaalsContact C-N 3.34Å; T193-F195 PolarHBondContact O-N 3.25Å
194	K	54.3	Low	68.4	Low	91 Å²	91	74.8 Å²	74.8	40%	0.396	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-81.5	-10.5	-172.2	-64.8	-176.9	-178.1	136.2	0	114.6	N184 D191 F192 W196	N184-K194 VanDerWaalsContact CB-O 3.28Å; N184-K194 WeakPolarHBondContact CB-O 3.06Å; N184-K194 PolarHBondContact ND2-O 2.85Å; D191-K194 HydrophobicContact CB-CD 3.92Å; D191-K194 HydrophobicContact CB-CG 4.12Å; D191-K194 WeakPolarHBondContact O-CB 3.34Å; D191-K194 PolarHBondContact O-N 3.05Å; D191-K194 WeakPolarHBondContact OD2-CE 3.23Å; D191-K194 IonicContact OD2-NZ 3.79Å; D191-K194 PolarHBondContact OD2-NZ 3.35Å; F192-K194 VanDerWaalsContact C-N 3.32Å; K194-W196 VanDerWaalsContact C-N 3.25Å; K194-W196 PolarHBondContact O-N 2.8Å
195	F	66.3	Low	69.6	Low	71 Å²	71	72.5 Å²	72.5	31%	0.311	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-71.5	-18.1	-179.9	-128.3	-82.6	0	0	0	113.7	L111 L183 N184 T193	L111-F195 HydrophobicContact CD2-CD1 4.22Å; L183-F195 HydrophobicContact CD2-CD1 3.7Å; L183-F195 HydrophobicContact CD2-CE1 3.74Å; N184-F195 PolarHBondContact N-O 2.81Å; T193-F195 VanDerWaalsContact C-N 3.34Å; T193-F195 PolarHBondContact O-N 3.25Å
196	W	76.9	Confident	71.1	Confident	9 Å²	9	69.5 Å²	69.5	3%	0.034	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.8	176.5	-66.9	97.6	0	0	0	110.3	L94 V101 M109 L111 S128 L130 I169 V181 R182 L183 K194	L94-W196 HydrophobicContact CD1-CH2 4.31Å; L94-W196 HydrophobicContact CD1-CZ2 4.26Å; V101-W196 HydrophobicContact CG2-CZ2 4.12Å; M109-W196 HydrophobicContact CE-CD2 3.81Å; M109-W196 HydrophobicContact CE-CE3 4.03Å; M109-W196 HydrophobicContact CE-CG 4.18Å; M109-W196 HydrophobicContact CE-CH2 4.4Å; M109-W196 HydrophobicContact CE-CZ2 4.22Å; M109-W196 HydrophobicContact CE-CZ3 4.32Å; L111-W196 HydrophobicContact CD1-CZ2 4.1Å; L111-W196 HydrophobicContact CD2-CZ2 4.25Å; S128-W196 VanDerWaalsContact OG-CD1 3.32Å; S128-W196 PolarHBondContact OG-NE1 3.31Å; L130-W196 HydrophobicContact CD1-CB 4.48Å; L130-W196 HydrophobicContact CD2-CB 3.97Å; I169-W196 HydrophobicContact CD1-CH2 3.64Å; I169-W196 HydrophobicContact CD1-CZ2 4.34Å; I169-W196 HydrophobicContact CD1-CZ3 4.17Å; I169-W196 HydrophobicContact CG1-CH2 4.04Å; I169-W196 HydrophobicContact CG1-CZ3 4.25Å; V181-W196 HydrophobicContact CG1-CB 4.27Å; V181-W196 HydrophobicContact CG1-CD2 4.4Å; V181-W196 HydrophobicContact CG1-CE3 3.84Å; V181-W196 WeakPolarHBondContact O-CZ3 3.36Å; R182-W196 CarbonylContact O-C 3.54Å; R182-W196 WeakPolarHBondContact O-CA 3.26Å; L183-W196 HydrophobicContact CB-CD2 4.39Å; L183-W196 HydrophobicContact CB-CE3 3.86Å; L183-W196 HydrophobicContact CB-CH2 3.98Å; L183-W196 HydrophobicContact CB-CZ2 4.45Å; L183-W196 HydrophobicContact CB-CZ3 3.65Å; L183-W196 HydrophobicContact CD1-CH2 3.55Å; L183-W196 HydrophobicContact CD1-CZ2 3.64Å; L183-W196 HydrophobicContact CD1-CZ3 4.14Å; L183-W196 HydrophobicContact CG-CD2 4.12Å; L183-W196 HydrophobicContact CG-CE3 4.05Å; L183-W196 HydrophobicContact CG-CH2 3.74Å; L183-W196 HydrophobicContact CG-CZ2 3.76Å; L183-W196 HydrophobicContact CG-CZ3 3.88Å; K194-W196 VanDerWaalsContact C-N 3.25Å; K194-W196 PolarHBondContact O-N 2.8Å
197	C	82.5	Confident	73	Confident	61 Å²	61	63.9 Å²	63.9	41%	0.412	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	133.3	170.6	-63.4	0	0	0	0	110.1	R182	R182-C197 PolarHBondContact O-N 3.39Å
198	L	85.1	Confident	74.6	Confident	67 Å²	67	65.1 Å²	65.1	35%	0.351	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-56.9	143.8	164.5	-78.2	170.6	0	0	0	109.8	L130 S200	L130-L198 HydrophobicContact CD1-CD2 3.99Å; L130-L198 HydrophobicContact CD1-CG 4.03Å; L130-L198 HydrophobicContact CD2-CD2 3.97Å; L130-L198 HydrophobicContact CD2-CG 4.49Å; L130-L198 HydrophobicContact CG-CD2 3.82Å; L130-L198 HydrophobicContact CG-CG 4.39Å; L198-S200 PolarHBondContact O-N 3.45Å
199	P	87.5	Confident	76.4	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-67	126.9	176.9	23.9	-27.3	0	0	0	110.2	I133 Q136 L137 I171 A179 V181	I133-P199 WeakPolarHBondContact O-CD 3.34Å; I133-P199 WeakPolarHBondContact O-CG 3.3Å; Q136-P199 PolarHBondContact OE1-O 3.34Å; L137-P199 HydrophobicContact CD1-CG 4.17Å; L137-P199 HydrophobicContact CD2-CB 4.39Å; L137-P199 HydrophobicContact CG-CG 4.43Å; I171-P199 HydrophobicContact CD1-CG 4.11Å; A179-P199 HydrophobicContact CB-CB 3.58Å; A179-P199 HydrophobicContact CB-CG 4.41Å; V181-P199 HydrophobicContact CG2-CG 4.3Å
200	S	85.4	Confident	78.2	Confident	43 Å²	43	60.3 Å²	60.3	30%	0.301	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-77.7	143.9	173.3	179.8	0	0	0	0	110.8	L198 D202 A204	L198-S200 PolarHBondContact O-N 3.45Å; S200-D202 VanDerWaalsContact C-N 3.28Å; S200-D202 PolarHBondContact O-N 2.86Å; S200-D202 PolarHBondContact OG-N 3.26Å; S200-A204 WeakPolarHBondContact O-CB 3.34Å; S200-A204 PolarHBondContact O-N 3.3Å
201	A	85.7	Confident	79.8	Confident	34 Å²	34	54.7 Å²	54.7	28%	0.281	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.9	174.4	0	0	0	0	0	113	W177 A204	W177-A201 HydrophobicContact CH2-CB 4.31Å; W177-A201 HydrophobicContact CZ3-CB 3.98Å; A201-A204 PolarHBondContact O-N 2.92Å
202	D	85.3	Confident	81.2	Confident	133 Å²	133	56.6 Å²	56.6	71%	0.711	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-37.5	-179.7	-55.3	-43.4	0	0	0	112.1	S200 A204 R209	S200-D202 VanDerWaalsContact C-N 3.28Å; S200-D202 PolarHBondContact O-N 2.86Å; S200-D202 PolarHBondContact OG-N 3.26Å; D202-A204 VanDerWaalsContact C-N 3.28Å; D202-A204 PolarHBondContact O-N 3.45Å; D202-R209 PolarHBondContact O-NH1 3.06Å
203	D	86.1	Confident	82.5	Confident	86 Å²	86	52.1 Å²	52.1	46%	0.46	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.1	177.2	-82.8	26.6	0	0	0	112.4	R182	R182-D203 IonicContact CZ-OD2 3.15Å; R182-D203 IonicContact NH1-OD2 2.71Å; R182-D203 PolarHBondContact NH1-OD2 2.85Å; R182-D203 IonicContact NH2-OD2 2.73Å; R182-D203 PolarHBondContact NH2-OD2 3.11Å
204	A	92.1	Very high	84.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-81.7	146.8	-175.2	0	0	0	0	0	112.9	L137 W177 A179 S200 A201 D202 N206 R209	L137-A204 HydrophobicContact CD2-CB 4.17Å; W177-A204 HydrophobicContact CE3-CB 3.64Å; W177-A204 HydrophobicContact CZ3-CB 3.99Å; A179-A204 HydrophobicContact CB-CB 3.84Å; S200-A204 WeakPolarHBondContact O-CB 3.34Å; S200-A204 PolarHBondContact O-N 3.3Å; A201-A204 PolarHBondContact O-N 2.92Å; D202-A204 VanDerWaalsContact C-N 3.28Å; D202-A204 PolarHBondContact O-N 3.45Å; A204-N206 PolarHBondContact O-N 3.08Å; A204-R209 PolarHBondContact O-NH1 3.49Å
205	I	93.7	Very high	85.6	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.026	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-86.6	101	169.1	-50.5	167.1	0	0	0	107.1	W177 V178 I210 L240 I242 F252 L254	W177-I205 CarbonylContact C-O 3.48Å; W177-I205 WeakPolarHBondContact CA-O 3.16Å; V178-I205 HydrophobicContact CB-CB 4.27Å; V178-I205 HydrophobicContact CB-CD1 4.4Å; V178-I205 HydrophobicContact CG1-CD1 4.45Å; V178-I205 PolarHBondContact N-O 3.49Å; V178-I205 PolarHBondContact O-N 2.82Å; I205-I210 HydrophobicContact CG2-CD1 3.6Å; I205-I210 HydrophobicContact CG2-CG1 3.57Å; I205-L240 HydrophobicContact CD1-CD1 4.4Å; I205-I242 HydrophobicContact CD1-CD1 3.97Å; I205-I242 HydrophobicContact CG2-CD1 4.5Å; I205-F252 HydrophobicContact CD1-CD1 3.55Å; I205-F252 HydrophobicContact CD1-CE1 3.58Å; I205-F252 HydrophobicContact CD1-CG 4.08Å; I205-F252 HydrophobicContact CD1-CZ 4.12Å; I205-F252 HydrophobicContact CG1-CD1 4.4Å; I205-F252 HydrophobicContact CG1-CE1 3.95Å; I205-F252 HydrophobicContact CG1-CZ 4.1Å; I205-F252 HydrophobicContact CG2-CD2 4.35Å; I205-F252 HydrophobicContact CG2-CE2 4.03Å; I205-F252 HydrophobicContact CG2-CZ 4.23Å; I205-L254 HydrophobicContact CD1-CD2 3.83Å
206	N	92	Very high	86.3	Confident	35 Å²	35	46.3 Å²	46.3	19%	0.187	28%	0.277	C	S	.	.			trans	-96.6	163.6	174.6	64.9	58	0	0	0	111.3	W177 A204 S208 R209 I210	W177-N206 HydrophobicContact CD2-CB 3.62Å; W177-N206 HydrophobicContact CE3-CB 3.84Å; W177-N206 HydrophobicContact CG-CB 4.15Å; W177-N206 HydrophobicContact CH2-CB 4.13Å; W177-N206 HydrophobicContact CZ2-CB 3.92Å; W177-N206 HydrophobicContact CZ3-CB 4.08Å; A204-N206 PolarHBondContact O-N 3.08Å; N206-S208 PolarHBondContact O-N 3.14Å; N206-S208 VanDerWaalsContact O-N 3.17Å; N206-S208 WeakPolarHBondContact OD1-CA 3.41Å; N206-S208 WeakPolarHBondContact OD1-CB 3.48Å; N206-S208 PolarHBondContact OD1-N 3.44Å; N206-S208 VanDerWaalsContact OD1-N 3.11Å; N206-R209 WeakPolarHBondContact O-CB 3.48Å; N206-R209 PolarHBondContact O-N 3.16Å; N206-R209 VanDerWaalsContact O-N 3.13Å; N206-R209 PolarHBondContact OD1-N 3.25Å; N206-I210 PolarHBondContact O-N 3.22Å
207	P	90.9	Very high	86.6	Confident	26 Å²	26	51.7 Å²	51.7	17%	0.169	31%	0.307	C	S	.	.	H	α-helix	trans	-52.3	-36	178.7	-32.9	39	0	0	0	114.8	I210 L211 A224	P207-I210 PolarHBondContact O-N 3.45Å; P207-L211 WeakPolarHBondContact O-CB 3.45Å; P207-L211 VanDerWaalsContact O-CG 3.27Å; P207-L211 WeakPolarHBondContact O-CG 3.49Å; P207-L211 PolarHBondContact O-N 3.34Å; P207-A224 HydrophobicContact CB-CB 3.95Å; P207-A224 HydrophobicContact CG-CB 4.25Å
208	S	88.2	Confident	86.6	Confident	75 Å²	75	51.5 Å²	51.5	52%	0.524	30%	0.298	S	S	.	.	H	α-helix	trans	-66.2	-47.5	177.9	-49.1	0	0	0	0	111.6	N206 I210 L211 D212	N206-S208 PolarHBondContact O-N 3.14Å; N206-S208 VanDerWaalsContact O-N 3.17Å; N206-S208 WeakPolarHBondContact OD1-CA 3.41Å; N206-S208 WeakPolarHBondContact OD1-CB 3.48Å; N206-S208 PolarHBondContact OD1-N 3.44Å; N206-S208 VanDerWaalsContact OD1-N 3.11Å; S208-I210 PolarHBondContact O-N 3.29Å; S208-L211 PolarHBondContact O-N 3.15Å; S208-L211 VanDerWaalsContact O-N 3.08Å; S208-D212 WeakPolarHBondContact O-CB 3.5Å; S208-D212 PolarHBondContact O-N 2.92Å
209	R	89.9	Confident	86.5	Confident	80 Å²	80	51.9 Å²	51.9	30%	0.302	29%	0.294	S	S	.	.	H	α-helix	trans	-54.6	-39.2	177.4	-165.7	-172.5	-166	131.7	7.1	112.1	D202 A204 N206 D257	D202-R209 PolarHBondContact O-NH1 3.06Å; A204-R209 PolarHBondContact O-NH1 3.49Å; N206-R209 WeakPolarHBondContact O-CB 3.48Å; N206-R209 PolarHBondContact O-N 3.16Å; N206-R209 VanDerWaalsContact O-N 3.13Å; N206-R209 PolarHBondContact OD1-N 3.25Å; R209-D257 IonicContact CZ-OD1 3.32Å; R209-D257 VanDerWaalsContact CZ-OD1 3.32Å; R209-D257 IonicContact CZ-OD2 3.52Å; R209-D257 IonicContact NE-OD1 2.8Å; R209-D257 PolarHBondContact NE-OD1 3.06Å; R209-D257 IonicContact NE-OD2 3.44Å; R209-D257 PolarHBondContact NE-OD2 3.46Å; R209-D257 VanDerWaalsContact NH2-CG 3.25Å; R209-D257 IonicContact NH2-OD1 3.1Å; R209-D257 PolarHBondContact NH2-OD1 3.45Å; R209-D257 VanDerWaalsContact NH2-OD1 3.1Å; R209-D257 IonicContact NH2-OD2 2.74Å; R209-D257 PolarHBondContact NH2-OD2 3.49Å
210	I	89.5	Confident	86.1	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-69.6	-48.6	175.7	-72.4	161.6	0	0	0	111.5	I205 N206 P207 S208 D212 G213 I214 Y244 L250 V259	I205-I210 HydrophobicContact CG2-CD1 3.6Å; I205-I210 HydrophobicContact CG2-CG1 3.57Å; N206-I210 PolarHBondContact O-N 3.22Å; P207-I210 PolarHBondContact O-N 3.45Å; S208-I210 PolarHBondContact O-N 3.29Å; I210-D212 VanDerWaalsContact C-N 3.27Å; I210-D212 PolarHBondContact O-N 3.01Å; I210-G213 PolarHBondContact O-N 3.41Å; I210-I214 HydrophobicContact CG2-CD1 4.44Å; I210-Y244 HydrophobicContact CD1-CE2 4.3Å; I210-Y244 WeakPolarHBondContact CD1-OH 3.47Å; I210-L250 HydrophobicContact CD1-CD2 4.21Å; I210-L250 HydrophobicContact CG1-CD2 4.4Å; I210-L250 HydrophobicContact CG2-CD2 3.51Å; I210-V259 HydrophobicContact CG2-CG2 4.12Å
211	L	86.2	Confident	85.9	Confident	44 Å²	44	69 Å²	69	23%	0.23	36%	0.36	C	S	.	.	H	α-helix	trans	-65.8	-31.7	-178.4	-70.8	170.7	0	0	0	111.8	P207 S208 G213 I214 R219 L222	P207-L211 WeakPolarHBondContact O-CB 3.45Å; P207-L211 VanDerWaalsContact O-CG 3.27Å; P207-L211 WeakPolarHBondContact O-CG 3.49Å; P207-L211 PolarHBondContact O-N 3.34Å; S208-L211 PolarHBondContact O-N 3.15Å; S208-L211 VanDerWaalsContact O-N 3.08Å; L211-G213 VanDerWaalsContact C-N 3.28Å; L211-G213 PolarHBondContact O-N 2.9Å; L211-I214 WeakPolarHBondContact O-CB 3.37Å; L211-I214 PolarHBondContact O-N 2.79Å; L211-R219 HydrophobicContact CB-CG 4.34Å; L211-R219 HydrophobicContact CD2-CB 4.25Å; L211-R219 HydrophobicContact CD2-CG 4.2Å; L211-R219 WeakPolarHBondContact O-CD 3.39Å; L211-R219 PolarHBondContact O-NE 3.14Å; L211-R219 PolarHBondContact O-NH2 3.3Å; L211-L222 HydrophobicContact CD2-CB 4.37Å
212	D	84.3	Confident	86	Confident	105 Å²	105	68.5 Å²	68.5	56%	0.561	35%	0.352	S	S	*	.	H	α-helix	trans	-64.8	-27.9	-178.8	-78.7	-32.8	0	0	0	114	S208 I210 I214 R219	S208-D212 WeakPolarHBondContact O-CB 3.5Å; S208-D212 PolarHBondContact O-N 2.92Å; I210-D212 VanDerWaalsContact C-N 3.27Å; I210-D212 PolarHBondContact O-N 3.01Å; D212-I214 PolarHBondContact O-N 3.22Å; D212-R219 PolarHBondContact O-NH2 2.9Å; D212-R219 IonicContact OD1-CZ 2.74Å; D212-R219 IonicContact OD1-NH1 3.82Å; D212-R219 PolarHBondContact OD1-NH1 2.88Å; D212-R219 IonicContact OD1-NH2 3.53Å
213	G	79.1	Confident	86.2	Confident	45 Å²	45	70.1 Å²	70.1	46%	0.464	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	4.4	171.2	0	0	0	0	0	115.7	I210 L211	I210-G213 PolarHBondContact O-N 3.41Å; L211-G213 VanDerWaalsContact C-N 3.28Å; L211-G213 PolarHBondContact O-N 2.9Å
214	I	85.3	Confident	86.4	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.026	33%	0.333	C	S	.	.	S	Bend	trans	-121.8	145.6	-172.7	-54.6	170.4	0	0	0	109.7	I210 L211 D212 R218 R219 L222 L262 P326	I210-I214 HydrophobicContact CG2-CD1 4.44Å; L211-I214 WeakPolarHBondContact O-CB 3.37Å; L211-I214 PolarHBondContact O-N 2.79Å; D212-I214 PolarHBondContact O-N 3.22Å; I214-R218 HydrophobicContact CG2-CB 3.64Å; I214-R219 HydrophobicContact CB-CG 4.2Å; I214-R219 HydrophobicContact CG2-CG 4.34Å; I214-R219 VanDerWaalsContact O-CZ 3.28Å; I214-R219 PolarHBondContact O-NE 2.91Å; I214-R219 PolarHBondContact O-NH2 3.22Å; I214-L222 HydrophobicContact CD1-CD1 3.83Å; I214-L222 HydrophobicContact CG2-CD1 4.22Å; I214-L262 HydrophobicContact CD1-CD1 3.82Å; I214-L262 HydrophobicContact CD1-CD2 4.02Å; I214-L262 HydrophobicContact CG1-CD1 4.15Å; I214-L262 HydrophobicContact CG2-CD1 4.4Å; I214-P326 HydrophobicContact CG1-CG 4.34Å
215	S	84.7	Confident	86.4	Confident	33 Å²	33	67.9 Å²	67.9	23%	0.231	34%	0.339	C	S	.	.			trans	-63.9	147	175.8	77.8	0	0	0	0	112.1	D217 R218 R219 Q325	S215-D217 PolarHBondContact O-N 3.04Å; S215-D217 VanDerWaalsContact O-N 3.15Å; S215-R218 PolarHBondContact O-N 3Å; S215-R219 WeakPolarHBondContact O-CG 3.47Å; S215-R219 PolarHBondContact O-N 3.29Å; S215-Q325 PolarHBondContact OG-NE2 3.27Å
216	P	82	Confident	86.4	Confident	84 Å²	84	67.9 Å²	67.9	55%	0.545	34%	0.339	S	S	.	.	H	α-helix	trans	-52.2	-39.5	-177	-28.6	36	0	0	0	114.3	R218 R219 Q220	P216-R218 VanDerWaalsContact C-N 3.31Å; P216-R218 PolarHBondContact O-N 3.17Å; P216-R219 WeakPolarHBondContact O-CB 3.14Å; P216-R219 PolarHBondContact O-N 2.98Å; P216-Q220 PolarHBondContact O-N 3.3Å
217	D	82.7	Confident	86.7	Confident	122 Å²	122	66.2 Å²	66.2	65%	0.652	33%	0.33	S	S	*	.	H	α-helix	trans	-65.1	-33.9	-178.6	-45.4	-61.3	0	0	0	112.7	S215	S215-D217 PolarHBondContact O-N 3.04Å; S215-D217 VanDerWaalsContact O-N 3.15Å
218	R	82.2	Confident	86.9	Confident	58 Å²	58	66.7 Å²	66.7	22%	0.219	33%	0.333	C	S	.	.	H	α-helix	trans	-80.4	-33.3	174.9	-82.1	173.2	66.7	-165.1	6.6	111.8	I214 S215 P216 Q220 R221 L222 P326	I214-R218 HydrophobicContact CG2-CB 3.64Å; S215-R218 PolarHBondContact O-N 3Å; P216-R218 VanDerWaalsContact C-N 3.31Å; P216-R218 PolarHBondContact O-N 3.17Å; R218-Q220 VanDerWaalsContact C-N 3.27Å; R218-Q220 PolarHBondContact O-N 3.2Å; R218-R221 PolarHBondContact O-N 2.98Å; R218-L222 WeakPolarHBondContact O-CG 3Å; R218-P326 VanDerWaalsContact CZ-O 3.31Å; R218-P326 PolarHBondContact NH1-O 3.34Å; R218-P326 PolarHBondContact NH2-O 2.99Å
219	R	82.7	Confident	87.4	Confident	75 Å²	75	63.7 Å²	63.7	28%	0.283	31%	0.311	S	S	.	.	H	α-helix	trans	-54.4	-41.1	177.4	-66.2	178.3	-157.6	-150.4	-4.1	112.5	L211 D212 I214 S215 P216 R221 L222	L211-R219 HydrophobicContact CB-CG 4.34Å; L211-R219 HydrophobicContact CD2-CB 4.25Å; L211-R219 HydrophobicContact CD2-CG 4.2Å; L211-R219 WeakPolarHBondContact O-CD 3.39Å; L211-R219 PolarHBondContact O-NE 3.14Å; L211-R219 PolarHBondContact O-NH2 3.3Å; D212-R219 PolarHBondContact O-NH2 2.9Å; D212-R219 IonicContact OD1-CZ 2.74Å; D212-R219 IonicContact OD1-NH1 3.82Å; D212-R219 PolarHBondContact OD1-NH1 2.88Å; D212-R219 IonicContact OD1-NH2 3.53Å; I214-R219 HydrophobicContact CB-CG 4.2Å; I214-R219 HydrophobicContact CG2-CG 4.34Å; I214-R219 VanDerWaalsContact O-CZ 3.28Å; I214-R219 PolarHBondContact O-NE 2.91Å; I214-R219 PolarHBondContact O-NH2 3.22Å; S215-R219 WeakPolarHBondContact O-CG 3.47Å; S215-R219 PolarHBondContact O-N 3.29Å; P216-R219 WeakPolarHBondContact O-CB 3.14Å; P216-R219 PolarHBondContact O-N 2.98Å; R219-R221 PolarHBondContact O-N 2.83Å; R219-R221 VanDerWaalsContact O-N 3.08Å; R219-L222 PolarHBondContact O-N 3.48Å; R219-L222 VanDerWaalsContact O-N 3.08Å
220	Q	79.3	Confident	87.7	Confident	173 Å²	173	60.6 Å²	60.6	81%	0.808	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.3	-176.1	-66.3	-175	9.7	0	0	114.8	P216 R218	P216-Q220 PolarHBondContact O-N 3.3Å; R218-Q220 VanDerWaalsContact C-N 3.27Å; R218-Q220 PolarHBondContact O-N 3.2Å
221	R	81.3	Confident	87.9	Confident	229 Å²	229	61.9 Å²	61.9	86%	0.864	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-1.8	-179	-60.1	-176.6	-176.8	177.9	1.2	113.3	R218 R219	R218-R221 PolarHBondContact O-N 2.98Å; R219-R221 PolarHBondContact O-N 2.83Å; R219-R221 VanDerWaalsContact O-N 3.08Å
222	L	88.2	Confident	88.1	Confident	24 Å²	24	61.3 Å²	61.3	13%	0.126	31%	0.306	C	S	.	.			trans	-112.9	141.7	-171.9	-63.1	176.5	0	0	0	110.3	L211 I214 R218 R219 L248 L262 P264	L211-L222 HydrophobicContact CD2-CB 4.37Å; I214-L222 HydrophobicContact CD1-CD1 3.83Å; I214-L222 HydrophobicContact CG2-CD1 4.22Å; R218-L222 WeakPolarHBondContact O-CG 3Å; R219-L222 PolarHBondContact O-N 3.48Å; R219-L222 VanDerWaalsContact O-N 3.08Å; L222-L248 HydrophobicContact CB-CD2 4.09Å; L222-L248 HydrophobicContact CD2-CD1 3.82Å; L222-L248 HydrophobicContact CD2-CD2 4.19Å; L222-L262 HydrophobicContact CD1-CD1 4.09Å; L222-L262 HydrophobicContact CD1-CD2 4.42Å; L222-P264 HydrophobicContact CD2-CB 4.22Å
223	R	89	Confident	88.4	Confident	167 Å²	167	56.5 Å²	56.5	63%	0.63	28%	0.28	S	S	*	.			trans	-137.3	106.3	179.5	-171.6	-176.7	-173.2	-155.6	1.1	110.5	D225 S246	R223-D225 HydrophobicContact CG-CB 4.32Å; R223-D225 IonicContact NH1-OD2 3.33Å; R223-D225 PolarHBondContact O-N 3.35Å; R223-S246 VanDerWaalsContact O-CB 3.27Å; R223-S246 WeakPolarHBondContact O-CB 3.23Å; R223-S246 PolarHBondContact O-OG 3.31Å
224	A	90.3	Very high	88.7	Confident	17 Å²	17	56.1 Å²	56.1	14%	0.14	27%	0.269	C	S	.	.			trans	-83.7	93.1	166.1	0	0	0	0	0	108.6	P207 Y244	P207-A224 HydrophobicContact CB-CB 3.95Å; P207-A224 HydrophobicContact CG-CB 4.25Å; A224-Y244 HydrophobicContact CB-CD1 4.05Å; A224-Y244 HydrophobicContact CB-CD2 4.2Å; A224-Y244 HydrophobicContact CB-CE1 3.66Å; A224-Y244 HydrophobicContact CB-CE2 3.85Å; A224-Y244 HydrophobicContact CB-CG 4.3Å
225	D	92.2	Very high	88.4	Confident	23 Å²	23	59.6 Å²	59.6	12%	0.123	31%	0.306	C	S	.	.			trans	-100.6	-132.9	172.3	66.5	-17.5	0	0	0	110.6	G176 R223 Y244 N245 S246	G176-D225 WeakPolarHBondContact CA-O 3.44Å; G176-D225 PolarHBondContact N-O 2.92Å; R223-D225 HydrophobicContact CG-CB 4.32Å; R223-D225 IonicContact NH1-OD2 3.33Å; R223-D225 PolarHBondContact O-N 3.35Å; D225-Y244 WeakPolarHBondContact O-CD1 3.34Å; D225-Y244 WeakPolarHBondContact O-CE1 3.48Å; D225-N245 PolarHBondContact OD1-N 2.85Å; D225-N245 PolarHBondContact OD2-ND2 2.97Å; D225-S246 WeakPolarHBondContact OD1-CB 3.29Å; D225-S246 PolarHBondContact OD1-N 3.27Å; D225-S246 PolarHBondContact OD2-N 3.45Å
226	A	95.2	Very high	88.5	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.033	30%	0.301	C	S	.	.	S	Bend	trans	-66.1	133.6	-178.5	0	0	0	0	0	112.6	A2 T158 D174 V228 Y244 N245	A2-A226 HydrophobicContact CB-CB 4.46Å; T158-A226 HydrophobicContact CG2-CB 4.42Å; D174-A226 HydrophobicContact CB-CB 4.44Å; D174-A226 WeakPolarHBondContact O-CA 3.47Å; D174-A226 WeakPolarHBondContact O-CB 3.16Å; A226-V228 PolarHBondContact O-N 2.87Å; A226-Y244 WeakPolarHBondContact O-CA 3.42Å; A226-N245 HydrophobicContact CB-CB 4.14Å; A226-N245 PolarHBondContact O-N 2.73Å
227	V	97.1	Very high	88.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	105	175.1	-175.9	0	0	0	0	109.6	T158 A159 T173 V178 V229 L230 I242 G243 Y244	T158-V227 WeakPolarHBondContact CB-O 3.32Å; T158-V227 PolarHBondContact OG1-O 2.92Å; A159-V227 HydrophobicContact CB-CG1 4.34Å; T173-V227 PolarHBondContact O-N 2.94Å; V178-V227 HydrophobicContact CG2-CG1 4.18Å; V178-V227 HydrophobicContact CG2-CG2 3.91Å; V227-V229 WeakPolarHBondContact CG1-O 3.44Å; V227-L230 HydrophobicContact CG1-CB 4.25Å; V227-I242 HydrophobicContact CG1-CG2 4.1Å; V227-I242 HydrophobicContact CG2-CG2 4.42Å; V227-G243 CarbonylContact C-O 3.56Å; V227-Y244 HydrophobicContact CG2-CD1 4.29Å; V227-Y244 HydrophobicContact CG2-CE1 3.71Å
228	V	96.4	Very high	88.9	Confident	36 Å²	36	55 Å²	55	22%	0.218	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-26.8	179.7	-69.3	0	0	0	0	112.9	A226 G243 N245 L269	A226-V228 PolarHBondContact O-N 2.87Å; V228-G243 WeakPolarHBondContact CG2-O 3.33Å; V228-G243 PolarHBondContact N-O 2.74Å; V228-N245 HydrophobicContact CG1-CB 3.79Å; V228-L269 HydrophobicContact CG2-CB 4.18Å; V228-L269 HydrophobicContact CG2-CD2 4.04Å; V228-L269 HydrophobicContact CG2-CG 4.2Å
229	V	96.8	Very high	89.3	Confident	12 Å²	12	52.8 Å²	52.8	7%	0.073	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.2	176.3	172.9	0	0	0	0	108.7	V227 L241 G243 L269 A272	V227-V229 WeakPolarHBondContact CG1-O 3.44Å; V229-L241 HydrophobicContact CG1-CD2 3.7Å; V229-L241 HydrophobicContact CG1-CG 4.1Å; V229-G243 PolarHBondContact N-O 3.14Å; V229-G243 VanDerWaalsContact N-O 3.09Å; V229-G243 PolarHBondContact O-N 2.83Å; V229-L269 HydrophobicContact CB-CD2 4.21Å; V229-L269 HydrophobicContact CG2-CD2 3.8Å; V229-L269 HydrophobicContact CG2-CG 4.3Å; V229-A272 HydrophobicContact CG1-CB 4.09Å; V229-A272 HydrophobicContact CG2-CB 4.08Å
230	L	96.2	Very high	89.9	Confident	15 Å²	15	49.2 Å²	49.2	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	114.4	170.3	-177	61.1	0	0	0	107.8	A159 C161 L170 V178 V227 L241 I242	A159-L230 HydrophobicContact CB-CB 3.75Å; C161-L230 HydrophobicContact CB-CB 4.5Å; C161-L230 HydrophobicContact CB-CD2 4.21Å; C161-L230 HydrophobicContact CB-CG 3.85Å; L170-L230 HydrophobicContact CB-CD2 3.89Å; V178-L230 HydrophobicContact CG1-CD1 3.79Å; V178-L230 HydrophobicContact CG1-CD2 4.02Å; V178-L230 HydrophobicContact CG2-CD1 4.1Å; V227-L230 HydrophobicContact CG1-CB 4.25Å; L230-L241 WeakPolarHBondContact CA-O 3.37Å; L230-I242 HydrophobicContact CD1-CG1 4.08Å
231	S	94.1	Very high	90.7	Very high	28 Å²	28	41 Å²	41	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	152	176.6	67.2	0	0	0	0	111.1	L240 L241 W274	S231-L240 CarbonylContact O-C 3.58Å; S231-L240 WeakPolarHBondContact O-CA 3.43Å; S231-L241 PolarHBondContact N-O 3.35Å; S231-L241 VanDerWaalsContact N-O 3.1Å; S231-L241 PolarHBondContact O-N 2.82Å; S231-W274 PolarHBondContact OG-NE1 3.23Å; S231-W274 VanDerWaalsContact OG-NE1 3.14Å
232	E	91.5	Very high	91.5	Very high	32 Å²	32	30.1 Å²	30.1	15%	0.15	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	144	171.7	-165	165.4	-154.2	0	0	110.2	S164 P234 P237 G238 L240 W274	S164-E232 WeakPolarHBondContact CB-OE2 3.32Å; S164-E232 PolarHBondContact N-OE2 2.99Å; S164-E232 PolarHBondContact OG-OE1 2.86Å; S164-E232 PolarHBondContact OG-OE2 2.85Å; E232-P234 WeakPolarHBondContact O-CD 3.3Å; E232-P237 VanDerWaalsContact OE1-CA 3.25Å; E232-P237 WeakPolarHBondContact OE1-CA 3.45Å; E232-G238 PolarHBondContact OE1-N 3.4Å; E232-L240 HydrophobicContact CB-CD2 4.31Å; E232-L240 HydrophobicContact CG-CD2 4.33Å; E232-W274 PolarHBondContact O-NE1 3.31Å
233	R	90.3	Very high	91.9	Very high	4 Å²	4	29 Å²	29	2%	0.015	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-71.8	120.1	177.9	-176	-175.2	179.8	-158.6	-3.4	109.2	G235 F236 Q239 L251 W274 G294 M295 G315	R233-G235 PolarHBondContact O-N 2.82Å; R233-F236 HydrophobicContact CB-CB 4.21Å; R233-F236 HydrophobicContact CG-CB 4.27Å; R233-F236 HydrophobicContact CG-CD2 3.74Å; R233-F236 HydrophobicContact CG-CG 4.35Å; R233-F236 PolarHBondContact O-N 2.84Å; R233-Q239 HydrophobicContact CB-CB 4.06Å; R233-Q239 VanDerWaalsContact CD-OE1 3.32Å; R233-Q239 PolarHBondContact N-O 2.77Å; R233-L251 HydrophobicContact CB-CD1 4.34Å; R233-W274 HydrophobicContact CB-CH2 3.94Å; R233-W274 HydrophobicContact CB-CZ2 3.64Å; R233-W274 HydrophobicContact CG-CH2 3.6Å; R233-W274 HydrophobicContact CG-CZ2 3.8Å; R233-W274 HydrophobicContact CG-CZ3 4.04Å; R233-G294 PolarHBondContact NE-O 2.98Å; R233-M295 PolarHBondContact NH2-SD 3.15Å; R233-G315 PolarHBondContact NH2-O 2.97Å
234	P	84.4	Confident	92.3	Very high	38 Å²	38	21 Å²	21	25%	0.247	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	129.5	-178.9	-27.9	34.9	0	0	0	112	E232 F236 W274 L293	E232-P234 WeakPolarHBondContact O-CD 3.3Å; P234-F236 VanDerWaalsContact C-N 3.3Å; P234-F236 VanDerWaalsContact O-CD2 3.26Å; P234-F236 WeakPolarHBondContact O-CD2 3.47Å; P234-F236 PolarHBondContact O-N 3.27Å; P234-W274 VanDerWaalsContact CD-CD1 3.48Å; P234-W274 VanDerWaalsContact CD-CG 3.48Å; P234-W274 HydrophobicContact CG-CB 3.97Å; P234-W274 HydrophobicContact CG-CD2 4.5Å; P234-W274 HydrophobicContact CG-CG 3.87Å; P234-L293 HydrophobicContact CB-CB 4.18Å; P234-L293 HydrophobicContact CB-CD2 3.92Å; P234-L293 HydrophobicContact CB-CG 4.15Å; P234-L293 HydrophobicContact CG-CD2 3.89Å; P234-L293 HydrophobicContact CG-CG 4.09Å
235	G	80.6	Confident	92.6	Very high	77 Å²	77	21 Å²	21	79%	0.794	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.7	-6.6	-177	0	0	0	0	0	116	R233 P237	R233-G235 PolarHBondContact O-N 2.82Å; G235-P237 WeakPolarHBondContact O-CD 3.25Å
236	F	85.9	Confident	92.7	Very high	30 Å²	30	21.5 Å²	21.5	13%	0.132	15%	0.148	C	C	.	.			trans	-125.9	78.2	-177.4	-60.9	-91.2	0	0	0	112.5	R233 P234 G238 Q239 F316	R233-F236 HydrophobicContact CB-CB 4.21Å; R233-F236 HydrophobicContact CG-CB 4.27Å; R233-F236 HydrophobicContact CG-CD2 3.74Å; R233-F236 HydrophobicContact CG-CG 4.35Å; R233-F236 PolarHBondContact O-N 2.84Å; P234-F236 VanDerWaalsContact C-N 3.3Å; P234-F236 VanDerWaalsContact O-CD2 3.26Å; P234-F236 WeakPolarHBondContact O-CD2 3.47Å; P234-F236 PolarHBondContact O-N 3.27Å; F236-G238 PolarHBondContact O-N 2.67Å; F236-Q239 HydrophobicContact CB-CB 4.04Å; F236-Q239 HydrophobicContact CB-CG 4.07Å; F236-Q239 PolarHBondContact O-N 2.85Å; F236-F316 WeakPolarHBondContact CE1-O 3.4Å; F236-F316 HydrophobicContact CE2-CD1 4.47Å; F236-F316 HydrophobicContact CZ-CB 4.32Å; F236-F316 AromaticContact CZ-CD1 3.73Å; F236-F316 HydrophobicContact CZ-CD1 3.73Å; F236-F316 HydrophobicContact CZ-CE1 4.49Å; F236-F316 HydrophobicContact CZ-CG 4.36Å
237	P	85.1	Confident	92.6	Very high	99 Å²	99	21.4 Å²	21.4	64%	0.643	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	130.1	178.9	-27.8	36.3	0	0	0	112.9	E232 G235	E232-P237 VanDerWaalsContact OE1-CA 3.25Å; E232-P237 WeakPolarHBondContact OE1-CA 3.45Å; G235-P237 WeakPolarHBondContact O-CD 3.25Å
238	G	87.3	Confident	92.5	Very high	15 Å²	15	21.7 Å²	21.7	16%	0.155	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-5	-177.2	0	0	0	0	0	115.9	E232 F236 L254	E232-G238 PolarHBondContact OE1-N 3.4Å; F236-G238 PolarHBondContact O-N 2.67Å; G238-L254 WeakPolarHBondContact O-CB 3.43Å; G238-L254 WeakPolarHBondContact O-CG 3.34Å; G238-L254 PolarHBondContact O-N 2.76Å
239	Q	92.4	Very high	92.4	Very high	10 Å²	10	20.1 Å²	20.1	5%	0.047	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	113.1	170.1	-65.8	-176.3	12.5	0	0	109.9	R233 F236 L251 F252 D253 M260	R233-Q239 HydrophobicContact CB-CB 4.06Å; R233-Q239 VanDerWaalsContact CD-OE1 3.32Å; R233-Q239 PolarHBondContact N-O 2.77Å; F236-Q239 HydrophobicContact CB-CB 4.04Å; F236-Q239 HydrophobicContact CB-CG 4.07Å; F236-Q239 PolarHBondContact O-N 2.85Å; Q239-L251 HydrophobicContact CB-CD1 4.44Å; Q239-F252 CarbonylContact C-O 3.56Å; Q239-F252 WeakPolarHBondContact CA-O 3.44Å; Q239-D253 HydrophobicContact CG-CB 4.46Å; Q239-M260 VanDerWaalsContact CD-SD 3.59Å; Q239-M260 HydrophobicContact CG-SD 3.86Å
240	L	94.8	Very high	92.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.8	-175.3	-54.7	-177.6	0	0	0	111.5	L170 I205 S231 E232 I242 L251 F252 L254	L170-L240 HydrophobicContact CD1-CD1 3.72Å; L170-L240 HydrophobicContact CD1-CD2 3.48Å; L170-L240 VanDerWaalsContact CD1-CD2 3.48Å; L170-L240 HydrophobicContact CD1-CG 4.25Å; I205-L240 HydrophobicContact CD1-CD1 4.4Å; S231-L240 CarbonylContact O-C 3.58Å; S231-L240 WeakPolarHBondContact O-CA 3.43Å; E232-L240 HydrophobicContact CB-CD2 4.31Å; E232-L240 HydrophobicContact CG-CD2 4.33Å; L240-I242 HydrophobicContact CB-CG1 4.22Å; L240-L251 CarbonylContact O-C 3.52Å; L240-L251 WeakPolarHBondContact O-CA 3.42Å; L240-F252 PolarHBondContact N-O 3.02Å; L240-F252 PolarHBondContact O-N 2.64Å; L240-L254 HydrophobicContact CD1-CD1 3.99Å; L240-L254 HydrophobicContact CD1-CD2 3.83Å; L240-L254 HydrophobicContact CD1-CG 3.89Å; L240-L254 HydrophobicContact CD2-CD1 4.47Å; L240-L254 HydrophobicContact CG-CD1 4.23Å; L240-L254 HydrophobicContact CG-CG 4.1Å
241	L	96.4	Very high	92.2	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.3	156.8	174.7	69.6	0	0	0	108.7	V229 L230 S231 L250 A272 W274 L297	V229-L241 HydrophobicContact CG1-CD2 3.7Å; V229-L241 HydrophobicContact CG1-CG 4.1Å; L230-L241 WeakPolarHBondContact CA-O 3.37Å; S231-L241 PolarHBondContact N-O 3.35Å; S231-L241 VanDerWaalsContact N-O 3.1Å; S231-L241 PolarHBondContact O-N 2.82Å; L241-L250 WeakPolarHBondContact CA-O 3.26Å; L241-A272 HydrophobicContact CD2-CB 4.28Å; L241-W274 HydrophobicContact CB-CZ2 3.8Å; L241-W274 HydrophobicContact CD2-CZ2 4.43Å; L241-L297 HydrophobicContact CD1-CD2 3.68Å; L241-L297 HydrophobicContact CD2-CD1 3.43Å; L241-L297 VanDerWaalsContact CD2-CD1 3.43Å; L241-L297 HydrophobicContact CD2-CD2 3.73Å; L241-L297 HydrophobicContact CD2-CG 4.23Å; L241-L297 HydrophobicContact CG-CD2 4.38Å
242	I	97.6	Very high	92.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	116.8	172.6	-53.5	174.9	0	0	0	107.1	V178 I205 V227 L230 L240 Y244 S249 L250 F252	V178-I242 HydrophobicContact CB-CD1 4.34Å; V178-I242 HydrophobicContact CG2-CD1 3.93Å; V178-I242 HydrophobicContact CG2-CG1 4.22Å; V178-I242 HydrophobicContact CG2-CG2 3.88Å; I205-I242 HydrophobicContact CD1-CD1 3.97Å; I205-I242 HydrophobicContact CG2-CD1 4.5Å; V227-I242 HydrophobicContact CG1-CG2 4.1Å; V227-I242 HydrophobicContact CG2-CG2 4.42Å; L230-I242 HydrophobicContact CD1-CG1 4.08Å; L240-I242 HydrophobicContact CB-CG1 4.22Å; I242-Y244 HydrophobicContact CG2-CD2 4.45Å; I242-Y244 HydrophobicContact CG2-CE1 4.41Å; I242-Y244 HydrophobicContact CG2-CE2 3.69Å; I242-S249 CarbonylContact O-C 3.59Å; I242-L250 HydrophobicContact CB-CD1 3.98Å; I242-L250 HydrophobicContact CB-CG 4.2Å; I242-L250 HydrophobicContact CD1-CD1 4.18Å; I242-L250 HydrophobicContact CG1-CD1 4.31Å; I242-L250 PolarHBondContact N-O 2.98Å; I242-L250 PolarHBondContact O-N 3.44Å; I242-F252 HydrophobicContact CD1-CB 4.01Å; I242-F252 HydrophobicContact CD1-CG 4.46Å
243	G	97	Very high	92.2	Very high	0 Å²	0	17 Å²	17	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	131.7	179.2	0	0	0	0	0	111.9	V227 V228 V229	V227-G243 CarbonylContact C-O 3.56Å; V228-G243 WeakPolarHBondContact CG2-O 3.33Å; V228-G243 PolarHBondContact N-O 2.74Å; V229-G243 PolarHBondContact N-O 3.14Å; V229-G243 VanDerWaalsContact N-O 3.09Å; V229-G243 PolarHBondContact O-N 2.83Å
244	Y	97.1	Very high	92.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	142.1	-174.8	-68.7	-76.1	0	0	0	111.8	G176 I210 A224 D225 A226 V227 I242 S246 G247 L248 L250 L269	G176-Y244 PolarHBondContact O-OH 3.14Å; I210-Y244 HydrophobicContact CD1-CE2 4.3Å; I210-Y244 WeakPolarHBondContact CD1-OH 3.47Å; A224-Y244 HydrophobicContact CB-CD1 4.05Å; A224-Y244 HydrophobicContact CB-CD2 4.2Å; A224-Y244 HydrophobicContact CB-CE1 3.66Å; A224-Y244 HydrophobicContact CB-CE2 3.85Å; A224-Y244 HydrophobicContact CB-CG 4.3Å; D225-Y244 WeakPolarHBondContact O-CD1 3.34Å; D225-Y244 WeakPolarHBondContact O-CE1 3.48Å; A226-Y244 WeakPolarHBondContact O-CA 3.42Å; V227-Y244 HydrophobicContact CG2-CD1 4.29Å; V227-Y244 HydrophobicContact CG2-CE1 3.71Å; I242-Y244 HydrophobicContact CG2-CD2 4.45Å; I242-Y244 HydrophobicContact CG2-CE1 4.41Å; I242-Y244 HydrophobicContact CG2-CE2 3.69Å; Y244-S246 PolarHBondContact O-N 2.96Å; Y244-G247 PolarHBondContact O-N 2.84Å; Y244-L248 WeakPolarHBondContact CB-O 3.26Å; Y244-L248 HydrophobicContact CD2-CB 4.39Å; Y244-L248 HydrophobicContact CD2-CD2 4.27Å; Y244-L248 HydrophobicContact CD2-CG 4.18Å; Y244-L248 WeakPolarHBondContact CD2-O 3.47Å; Y244-L248 PolarHBondContact N-O 3.39Å; Y244-L250 HydrophobicContact CE2-CD2 4Å; Y244-L269 WeakPolarHBondContact O-CB 3.07Å
245	N	96.1	Very high	92.4	Very high	16 Å²	16	29.9 Å²	29.9	9%	0.086	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-25.4	177.4	166.4	82.5	0	0	0	113.2	I5 D225 A226 V228 G247 G268	I5-N245 WeakPolarHBondContact CD1-OD1 3.23Å; D225-N245 PolarHBondContact OD1-N 2.85Å; D225-N245 PolarHBondContact OD2-ND2 2.97Å; A226-N245 HydrophobicContact CB-CB 4.14Å; A226-N245 PolarHBondContact O-N 2.73Å; V228-N245 HydrophobicContact CG1-CB 3.79Å; N245-G247 PolarHBondContact O-N 3.38Å; N245-G268 WeakPolarHBondContact O-CA 3.41Å
246	S	94.7	Very high	92.7	Very high	33 Å²	33	28.4 Å²	28.4	23%	0.231	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-19.2	173.6	65.7	0	0	0	0	115.3	R223 D225 Y244 L248	R223-S246 VanDerWaalsContact O-CB 3.27Å; R223-S246 WeakPolarHBondContact O-CB 3.23Å; R223-S246 PolarHBondContact O-OG 3.31Å; D225-S246 WeakPolarHBondContact OD1-CB 3.29Å; D225-S246 PolarHBondContact OD1-N 3.27Å; D225-S246 PolarHBondContact OD2-N 3.45Å; Y244-S246 PolarHBondContact O-N 2.96Å; S246-L248 PolarHBondContact OG-N 2.68Å
247	G	93.1	Very high	92.8	Very high	2 Å²	2	30.9 Å²	30.9	2%	0.021	16%	0.163	C	C	.	.	S	Bend	trans	102.8	-2.8	-168.5	0	0	0	0	0	113.7	Y244 N245 W265 H267	Y244-G247 PolarHBondContact O-N 2.84Å; N245-G247 PolarHBondContact O-N 3.38Å; G247-W265 PolarHBondContact O-N 3.1Å; G247-H267 WeakPolarHBondContact CA-O 3.29Å
248	L	94.5	Very high	93	Very high	7 Å²	7	30.3 Å²	30.3	4%	0.037	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	117	175.8	174.5	57.9	0	0	0	112	L222 Y244 S246 L262 P264	L222-L248 HydrophobicContact CB-CD2 4.09Å; L222-L248 HydrophobicContact CD2-CD1 3.82Å; L222-L248 HydrophobicContact CD2-CD2 4.19Å; Y244-L248 WeakPolarHBondContact CB-O 3.26Å; Y244-L248 HydrophobicContact CD2-CB 4.39Å; Y244-L248 HydrophobicContact CD2-CD2 4.27Å; Y244-L248 HydrophobicContact CD2-CG 4.18Å; Y244-L248 WeakPolarHBondContact CD2-O 3.47Å; Y244-L248 PolarHBondContact N-O 3.39Å; S246-L248 PolarHBondContact OG-N 2.68Å; L248-L262 HydrophobicContact CD1-CD2 4.11Å; L248-P264 HydrophobicContact CD1-CB 4.26Å
249	S	95.2	Very high	93.2	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.014	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	149.3	162.9	-77	0	0	0	0	111.5	I242 L263 L269	I242-S249 CarbonylContact O-C 3.59Å; S249-L263 PolarHBondContact N-O 3.02Å; S249-L263 CarbonylContact O-C 3.56Å; S249-L263 WeakPolarHBondContact O-CA 3.39Å; S249-L263 PolarHBondContact O-N 2.97Å; S249-L269 VanDerWaalsContact OG-CD2 3.32Å; S249-L269 WeakPolarHBondContact OG-CD2 3.41Å
250	L	95.1	Very high	93.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	153.3	174.8	68.3	83.5	0	0	0	112.2	I210 L241 I242 Y244 F252 V259 A261 L262	I210-L250 HydrophobicContact CD1-CD2 4.21Å; I210-L250 HydrophobicContact CG1-CD2 4.4Å; I210-L250 HydrophobicContact CG2-CD2 3.51Å; L241-L250 WeakPolarHBondContact CA-O 3.26Å; I242-L250 HydrophobicContact CB-CD1 3.98Å; I242-L250 HydrophobicContact CB-CG 4.2Å; I242-L250 HydrophobicContact CD1-CD1 4.18Å; I242-L250 HydrophobicContact CG1-CD1 4.31Å; I242-L250 PolarHBondContact N-O 2.98Å; I242-L250 PolarHBondContact O-N 3.44Å; Y244-L250 HydrophobicContact CE2-CD2 4Å; L250-F252 HydrophobicContact CD1-CB 3.78Å; L250-F252 HydrophobicContact CD1-CD2 4.45Å; L250-V259 HydrophobicContact CB-CG1 4.32Å; L250-A261 WeakPolarHBondContact CA-O 3.48Å; L250-A261 WeakPolarHBondContact CB-O 3.43Å; L250-L262 HydrophobicContact CB-CD2 3.94Å; L250-L262 HydrophobicContact CD2-CD2 4.4Å
251	L	94.3	Very high	92.9	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	126.8	168.8	-168.8	72.6	0	0	0	108.6	R233 Q239 L240 V259 M260 A261 W274 L311 I314	R233-L251 HydrophobicContact CB-CD1 4.34Å; Q239-L251 HydrophobicContact CB-CD1 4.44Å; L240-L251 CarbonylContact O-C 3.52Å; L240-L251 WeakPolarHBondContact O-CA 3.42Å; L251-V259 CarbonylContact O-C 3.5Å; L251-M260 HydrophobicContact CB-CB 4.22Å; L251-M260 HydrophobicContact CD2-CB 4.08Å; L251-M260 HydrophobicContact CD2-CE 4.33Å; L251-M260 HydrophobicContact CD2-SD 3.72Å; L251-M260 HydrophobicContact CG-CB 4.27Å; L251-M260 HydrophobicContact CG-SD 4.08Å; L251-M260 PolarHBondContact O-N 3.02Å; L251-A261 HydrophobicContact CB-CB 4.49Å; L251-A261 PolarHBondContact N-O 2.79Å; L251-W274 HydrophobicContact CD1-CH2 4.09Å; L251-W274 HydrophobicContact CD1-CZ2 4.34Å; L251-L311 HydrophobicContact CD2-CD2 4.43Å; L251-I314 HydrophobicContact CD2-CD1 3.77Å; L251-I314 HydrophobicContact CD2-CG2 4.42Å
252	F	93.6	Very high	92.8	Very high	2 Å²	2	31 Å²	31	1%	0.009	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.6	-178.5	-168.1	-84.6	0	0	0	110.3	I205 Q239 L240 I242 L250 L254 D257 R258 V259	I205-F252 HydrophobicContact CD1-CD1 3.55Å; I205-F252 HydrophobicContact CD1-CE1 3.58Å; I205-F252 HydrophobicContact CD1-CG 4.08Å; I205-F252 HydrophobicContact CD1-CZ 4.12Å; I205-F252 HydrophobicContact CG1-CD1 4.4Å; I205-F252 HydrophobicContact CG1-CE1 3.95Å; I205-F252 HydrophobicContact CG1-CZ 4.1Å; I205-F252 HydrophobicContact CG2-CD2 4.35Å; I205-F252 HydrophobicContact CG2-CE2 4.03Å; I205-F252 HydrophobicContact CG2-CZ 4.23Å; Q239-F252 CarbonylContact C-O 3.56Å; Q239-F252 WeakPolarHBondContact CA-O 3.44Å; L240-F252 PolarHBondContact N-O 3.02Å; L240-F252 PolarHBondContact O-N 2.64Å; I242-F252 HydrophobicContact CD1-CB 4.01Å; I242-F252 HydrophobicContact CD1-CG 4.46Å; L250-F252 HydrophobicContact CD1-CB 3.78Å; L250-F252 HydrophobicContact CD1-CD2 4.45Å; F252-L254 HydrophobicContact CD1-CD2 4.29Å; F252-L254 HydrophobicContact CE1-CD2 4.3Å; F252-D257 WeakPolarHBondContact CZ-OD1 3.3Å; F252-R258 WeakPolarHBondContact CA-O 3.4Å; F252-V259 HydrophobicContact CD2-CG2 4.15Å
253	D	91.2	Very high	92.6	Very high	19 Å²	19	31 Å²	31	10%	0.102	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	113.1	173.1	176.5	14.1	0	0	0	110.2	Q239 R255 S256 D257 R258 M260	Q239-D253 HydrophobicContact CG-CB 4.46Å; D253-R255 PolarHBondContact O-N 2.7Å; D253-R255 VanDerWaalsContact OD1-CB 3.3Å; D253-R255 WeakPolarHBondContact OD1-CB 3.06Å; D253-R255 PolarHBondContact OD1-N 3.18Å; D253-S256 WeakPolarHBondContact CB-OG 3.5Å; D253-S256 VanDerWaalsContact CG-OG 3.25Å; D253-S256 PolarHBondContact O-N 3.05Å; D253-S256 WeakPolarHBondContact OD2-CB 3.27Å; D253-S256 PolarHBondContact OD2-N 3.4Å; D253-S256 PolarHBondContact OD2-OG 2.79Å; D253-D257 WeakPolarHBondContact O-CA 3.32Å; D253-D257 PolarHBondContact O-N 2.94Å; D253-R258 PolarHBondContact N-O 2.98Å; D253-R258 PolarHBondContact O-N 3.02Å; D253-M260 HydrophobicContact CB-CG 3.96Å; D253-M260 HydrophobicContact CB-SD 3.8Å
254	L	90	Very high	92.4	Very high	80 Å²	80	33 Å²	33	42%	0.419	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-27	175.5	-69.8	-179.4	0	0	0	113.1	I205 G238 L240 F252	I205-L254 HydrophobicContact CD1-CD2 3.83Å; G238-L254 WeakPolarHBondContact O-CB 3.43Å; G238-L254 WeakPolarHBondContact O-CG 3.34Å; G238-L254 PolarHBondContact O-N 2.76Å; L240-L254 HydrophobicContact CD1-CD1 3.99Å; L240-L254 HydrophobicContact CD1-CD2 3.83Å; L240-L254 HydrophobicContact CD1-CG 3.89Å; L240-L254 HydrophobicContact CD2-CD1 4.47Å; L240-L254 HydrophobicContact CG-CD1 4.23Å; L240-L254 HydrophobicContact CG-CG 4.1Å; F252-L254 HydrophobicContact CD1-CD2 4.29Å; F252-L254 HydrophobicContact CE1-CD2 4.3Å
255	R	88.1	Confident	92.2	Very high	233 Å²	233	36.3 Å²	36.3	88%	0.879	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-35.7	-174.7	-165	179.7	-164.1	170.2	6.6	112.9	D253	D253-R255 PolarHBondContact O-N 2.7Å; D253-R255 VanDerWaalsContact OD1-CB 3.3Å; D253-R255 WeakPolarHBondContact OD1-CB 3.06Å; D253-R255 PolarHBondContact OD1-N 3.18Å
256	S	87	Confident	92	Very high	46 Å²	46	42.5 Å²	42.5	32%	0.322	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	5.9	175.8	60.1	0	0	0	0	113.9	D253 R258	D253-S256 WeakPolarHBondContact CB-OG 3.5Å; D253-S256 VanDerWaalsContact CG-OG 3.25Å; D253-S256 PolarHBondContact O-N 3.05Å; D253-S256 WeakPolarHBondContact OD2-CB 3.27Å; D253-S256 PolarHBondContact OD2-N 3.4Å; D253-S256 PolarHBondContact OD2-OG 2.79Å; S256-R258 VanDerWaalsContact C-N 3.32Å; S256-R258 PolarHBondContact O-N 3.22Å; S256-R258 WeakPolarHBondContact OG-CD 3.37Å; S256-R258 WeakPolarHBondContact OG-CG 3.2Å; S256-R258 PolarHBondContact OG-NE 2.67Å
257	D	89.3	Confident	91.9	Very high	82 Å²	82	43.9 Å²	43.9	44%	0.439	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	46.9	174.3	-165.3	23.7	0	0	0	113.5	R209 F252 D253	R209-D257 IonicContact CZ-OD1 3.32Å; R209-D257 VanDerWaalsContact CZ-OD1 3.32Å; R209-D257 IonicContact CZ-OD2 3.52Å; R209-D257 IonicContact NE-OD1 2.8Å; R209-D257 PolarHBondContact NE-OD1 3.06Å; R209-D257 IonicContact NE-OD2 3.44Å; R209-D257 PolarHBondContact NE-OD2 3.46Å; R209-D257 VanDerWaalsContact NH2-CG 3.25Å; R209-D257 IonicContact NH2-OD1 3.1Å; R209-D257 PolarHBondContact NH2-OD1 3.45Å; R209-D257 VanDerWaalsContact NH2-OD1 3.1Å; R209-D257 IonicContact NH2-OD2 2.74Å; R209-D257 PolarHBondContact NH2-OD2 3.49Å; F252-D257 WeakPolarHBondContact CZ-OD1 3.3Å; D253-D257 WeakPolarHBondContact O-CA 3.32Å; D253-D257 PolarHBondContact O-N 2.94Å
258	R	88.8	Confident	92	Very high	87 Å²	87	44.4 Å²	44.4	33%	0.328	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	154.6	-171.6	70.3	-168.6	-179.9	169.7	6.2	113.9	F252 D253 S256 M260 S322	F252-R258 WeakPolarHBondContact CA-O 3.4Å; D253-R258 PolarHBondContact N-O 2.98Å; D253-R258 PolarHBondContact O-N 3.02Å; S256-R258 VanDerWaalsContact C-N 3.32Å; S256-R258 PolarHBondContact O-N 3.22Å; S256-R258 WeakPolarHBondContact OG-CD 3.37Å; S256-R258 WeakPolarHBondContact OG-CG 3.2Å; S256-R258 PolarHBondContact OG-NE 2.67Å; R258-M260 PolarHBondContact O-N 2.98Å; R258-S322 PolarHBondContact NH1-OG 2.82Å
259	V	90.9	Very high	92.1	Very high	13 Å²	13	44.1 Å²	44.1	8%	0.079	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	122.2	166.9	-177.5	0	0	0	0	109.1	I210 L250 L251 F252 A261 L262 P326	I210-V259 HydrophobicContact CG2-CG2 4.12Å; L250-V259 HydrophobicContact CB-CG1 4.32Å; L251-V259 CarbonylContact O-C 3.5Å; F252-V259 HydrophobicContact CD2-CG2 4.15Å; V259-A261 WeakPolarHBondContact CG1-O 3.34Å; V259-L262 HydrophobicContact CG1-CD2 3.95Å; V259-L262 HydrophobicContact CG1-CG 3.97Å; V259-P326 HydrophobicContact CB-CB 4.41Å; V259-P326 HydrophobicContact CB-CG 4.28Å; V259-P326 HydrophobicContact CG1-CB 3.95Å; V259-P326 HydrophobicContact CG1-CG 4.07Å
260	M	90.1	Very high	92.1	Very high	28 Å²	28	45.4 Å²	45.4	14%	0.138	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-36.6	175	-63.1	-178	75.2	0	0	112.5	Q239 L251 D253 R258 I314 P327	Q239-M260 VanDerWaalsContact CD-SD 3.59Å; Q239-M260 HydrophobicContact CG-SD 3.86Å; L251-M260 HydrophobicContact CB-CB 4.22Å; L251-M260 HydrophobicContact CD2-CB 4.08Å; L251-M260 HydrophobicContact CD2-CE 4.33Å; L251-M260 HydrophobicContact CD2-SD 3.72Å; L251-M260 HydrophobicContact CG-CB 4.27Å; L251-M260 HydrophobicContact CG-SD 4.08Å; L251-M260 PolarHBondContact O-N 3.02Å; D253-M260 HydrophobicContact CB-CG 3.96Å; D253-M260 HydrophobicContact CB-SD 3.8Å; R258-M260 PolarHBondContact O-N 2.98Å; M260-I314 HydrophobicContact CE-CG2 3.57Å; M260-P327 WeakPolarHBondContact O-CD 3.44Å
261	A	92	Very high	92.2	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	155.4	-179.2	0	0	0	0	0	111.8	L250 L251 V259 I314 P327 L329	L250-A261 WeakPolarHBondContact CA-O 3.48Å; L250-A261 WeakPolarHBondContact CB-O 3.43Å; L251-A261 HydrophobicContact CB-CB 4.49Å; L251-A261 PolarHBondContact N-O 2.79Å; V259-A261 WeakPolarHBondContact CG1-O 3.34Å; A261-I314 HydrophobicContact CB-CD1 3.49Å; A261-I314 VanDerWaalsContact CB-CD1 3.49Å; A261-I314 HydrophobicContact CB-CG1 4.35Å; A261-P327 HydrophobicContact CB-CG 4.27Å; A261-L329 HydrophobicContact CB-CD1 3.95Å; A261-L329 HydrophobicContact CB-CG 4.21Å
262	L	92.8	Very high	92.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	133.2	177.9	-69.6	164.3	0	0	0	110.2	I214 L222 L248 L250 V259 P326 P327 L328 L329	I214-L262 HydrophobicContact CD1-CD1 3.82Å; I214-L262 HydrophobicContact CD1-CD2 4.02Å; I214-L262 HydrophobicContact CG1-CD1 4.15Å; I214-L262 HydrophobicContact CG2-CD1 4.4Å; L222-L262 HydrophobicContact CD1-CD1 4.09Å; L222-L262 HydrophobicContact CD1-CD2 4.42Å; L248-L262 HydrophobicContact CD1-CD2 4.11Å; L250-L262 HydrophobicContact CB-CD2 3.94Å; L250-L262 HydrophobicContact CD2-CD2 4.4Å; V259-L262 HydrophobicContact CG1-CD2 3.95Å; V259-L262 HydrophobicContact CG1-CG 3.97Å; L262-P326 HydrophobicContact CD1-CB 4.39Å; L262-P326 HydrophobicContact CD1-CG 3.85Å; L262-P326 HydrophobicContact CG-CB 4.45Å; L262-P326 HydrophobicContact CG-CG 4.34Å; L262-P327 PolarHBondContact N-O 3.48Å; L262-L328 HydrophobicContact CB-CD1 4.06Å; L262-L329 PolarHBondContact O-N 2.9Å
263	L	94	Very high	92.2	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	74.5	-175.2	-52.6	92.6	0	0	0	109.1	S249 W309 L329	S249-L263 PolarHBondContact N-O 3.02Å; S249-L263 CarbonylContact O-C 3.56Å; S249-L263 WeakPolarHBondContact O-CA 3.39Å; S249-L263 PolarHBondContact O-N 2.97Å; L263-W309 HydrophobicContact CB-CD2 4Å; L263-W309 HydrophobicContact CB-CE3 3.73Å; L263-W309 HydrophobicContact CB-CH2 4Å; L263-W309 HydrophobicContact CB-CZ2 4.25Å; L263-W309 HydrophobicContact CB-CZ3 3.73Å; L263-W309 HydrophobicContact CD2-CB 3.74Å; L263-W309 HydrophobicContact CD2-CD2 3.72Å; L263-W309 HydrophobicContact CD2-CE3 3.77Å; L263-W309 HydrophobicContact CD2-CG 3.74Å; L263-W309 HydrophobicContact CG-CD2 4.39Å; L263-W309 HydrophobicContact CG-CE3 4.08Å; L263-W309 HydrophobicContact CG-CZ3 4.46Å; L263-L329 HydrophobicContact CD2-CD1 4Å; L263-L329 HydrophobicContact CG-CB 4.29Å; L263-L329 HydrophobicContact CG-CD1 4.1Å
264	P	92.5	Very high	92.1	Very high	41 Å²	41	47.9 Å²	47.9	27%	0.266	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	133.1	-175.2	34.4	-34.9	0	0	0	112.8	L222 L248 L328	L222-P264 HydrophobicContact CD2-CB 4.22Å; L248-P264 HydrophobicContact CD1-CB 4.26Å; P264-L328 HydrophobicContact CG-CD1 3.91Å; P264-L328 HydrophobicContact CG-CD2 4.21Å; P264-L328 HydrophobicContact CG-CG 4.09Å
265	W	92.6	Very high	91.9	Very high	70 Å²	70	44.1 Å²	44.1	27%	0.265	21%	0.213	S	C	.	.			trans	-121.1	156.8	169.5	-165.7	-120.9	0	0	0	112.7	G247 H267 H301 W309 M331 P335	G247-W265 PolarHBondContact O-N 3.1Å; W265-H267 AromaticContact NE1-CD2 3.69Å; W265-H301 AromaticContact CD1-CE1 3.51Å; W265-H301 AromaticContact CD1-CG 3.87Å; W265-H301 AromaticContact CD1-ND1 3.47Å; W265-H301 AromaticContact CD1-NE2 3.94Å; W265-H301 AromaticContact CG-CE1 3.89Å; W265-W309 HydrophobicContact CB-CZ2 4.36Å; W265-M331 HydrophobicContact CD2-SD 4.14Å; W265-M331 HydrophobicContact CE3-SD 3.65Å; W265-M331 HydrophobicContact CZ3-SD 3.92Å; W265-P335 HydrophobicContact CD2-CG 4.24Å; W265-P335 VanDerWaalsContact CE2-CG 3.44Å; W265-P335 VanDerWaalsContact CH2-CD 3.45Å; W265-P335 HydrophobicContact CH2-CG 3.63Å; W265-P335 HydrophobicContact CZ2-CG 3.13Å; W265-P335 HydrophobicContact CZ3-CG 4.32Å
266	Q	92.2	Very high	91	Very high	146 Å²	146	33.2 Å²	33.2	68%	0.682	17%	0.173	S	C	*	.	S	Bend	trans	-80.1	-23.4	-176.7	72.8	-178.8	12.4	0	0	114.1
267	H	93.5	Very high	89.5	Confident	62 Å²	62	31.5 Å²	31.5	29%	0.287	16%	0.163	S	C	.	.	S	Bend	trans	-102.6	142	176.9	-63.9	-58.3	0	0	0	110	G247 W265 L269 H301 D303	G247-H267 WeakPolarHBondContact CA-O 3.29Å; W265-H267 AromaticContact NE1-CD2 3.69Å; H267-L269 PolarHBondContact O-N 3.42Å; H267-H301 HydrophobicContact CB-CB 4.31Å; H267-H301 PolarHBondContact O-ND1 3.48Å; H267-D303 HydrophobicContact CB-CB 4.47Å; H267-D303 IonicContact CD2-OD2 2.65Å; H267-D303 PolarHBondContact CD2-OD2 2.8Å; H267-D303 IonicContact CG-OD2 3.83Å; H267-D303 IonicContact NE2-OD2 3.35Å
268	G	94.8	Very high	87.6	Confident	13 Å²	13	30 Å²	30	13%	0.134	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-56.2	134.5	-177.7	0	0	0	0	0	111.5	N245 H301 S302	N245-G268 WeakPolarHBondContact O-CA 3.41Å; G268-H301 WeakPolarHBondContact O-CA 3.22Å; G268-S302 WeakPolarHBondContact CA-OG 3.42Å; G268-S302 PolarHBondContact N-OG 3.5Å; G268-S302 WeakPolarHBondContact O-CB 3.47Å; G268-S302 PolarHBondContact O-N 2.99Å; G268-S302 PolarHBondContact O-OG 2.84Å
269	L	96.5	Very high	85.6	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	139.9	175.5	-173.9	73.3	0	0	0	109.1	V228 V229 Y244 S249 H267 T299	V228-L269 HydrophobicContact CG2-CB 4.18Å; V228-L269 HydrophobicContact CG2-CD2 4.04Å; V228-L269 HydrophobicContact CG2-CG 4.2Å; V229-L269 HydrophobicContact CB-CD2 4.21Å; V229-L269 HydrophobicContact CG2-CD2 3.8Å; V229-L269 HydrophobicContact CG2-CG 4.3Å; Y244-L269 WeakPolarHBondContact O-CB 3.07Å; S249-L269 VanDerWaalsContact OG-CD2 3.32Å; S249-L269 WeakPolarHBondContact OG-CD2 3.41Å; H267-L269 PolarHBondContact O-N 3.42Å; L269-T299 HydrophobicContact CD1-CG2 3.91Å
270	E	96.2	Very high	83.5	Confident	28 Å²	28	31.3 Å²	31.3	13%	0.131	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	-41.1	176.2	-63.4	-75.3	169.5	0	0	110.8	A300 S302 L346 I347	E270-A300 PolarHBondContact N-O 2.64Å; E270-S302 WeakPolarHBondContact OE1-CB 3.31Å; E270-L346 HydrophobicContact CG-CB 4.3Å; E270-I347 VanDerWaalsContact CB-O 3.25Å; E270-I347 WeakPolarHBondContact CB-O 3.25Å
271	A	96.2	Very high	81.3	Confident	14 Å²	14	32.7 Å²	32.7	12%	0.116	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	162.9	177	0	0	0	0	0	112.3	A300 V350	A271-A300 HydrophobicContact CB-CB 4.37Å; A271-A300 PolarHBondContact N-O 3.45Å; A271-A300 PolarHBondContact O-N 3.15Å; A271-V350 HydrophobicContact CB-CG1 4.05Å
272	A	95.6	Very high	78.9	Confident	21 Å²	21	36.8 Å²	36.8	17%	0.174	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	152.2	168.7	0	0	0	0	0	111.7	V229 L241 L297 L298 T299	V229-A272 HydrophobicContact CG1-CB 4.09Å; V229-A272 HydrophobicContact CG2-CB 4.08Å; L241-A272 HydrophobicContact CD2-CB 4.28Å; A272-L297 HydrophobicContact CB-CD1 3.95Å; A272-L297 HydrophobicContact CB-CD2 4.41Å; A272-L297 HydrophobicContact CB-CG 4.25Å; A272-L298 CarbonylContact C-O 3.53Å; A272-L298 WeakPolarHBondContact CA-O 3.41Å; A272-L298 WeakPolarHBondContact CB-O 3.49Å; A272-T299 HydrophobicContact CB-CG2 3.92Å
273	A	92.3	Very high	76.4	Confident	16 Å²	16	46.3 Å²	46.3	13%	0.132	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	136.8	177.6	0	0	0	0	0	111.1	C275 L298 V350	A273-C275 PolarHBondContact O-N 3.26Å; A273-L298 PolarHBondContact N-O 3.26Å; A273-L298 PolarHBondContact O-N 3.05Å; A273-V350 HydrophobicContact CB-CG1 4.42Å
274	W	89.3	Confident	73.5	Confident	24 Å²	24	51.6 Å²	51.6	9%	0.091	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	131.5	169.6	-65.2	102.3	0	0	0	109.7	S231 E232 R233 P234 L241 L251 G294 L297 L311	S231-W274 PolarHBondContact OG-NE1 3.23Å; S231-W274 VanDerWaalsContact OG-NE1 3.14Å; E232-W274 PolarHBondContact O-NE1 3.31Å; R233-W274 HydrophobicContact CB-CH2 3.94Å; R233-W274 HydrophobicContact CB-CZ2 3.64Å; R233-W274 HydrophobicContact CG-CH2 3.6Å; R233-W274 HydrophobicContact CG-CZ2 3.8Å; R233-W274 HydrophobicContact CG-CZ3 4.04Å; P234-W274 VanDerWaalsContact CD-CD1 3.48Å; P234-W274 VanDerWaalsContact CD-CG 3.48Å; P234-W274 HydrophobicContact CG-CB 3.97Å; P234-W274 HydrophobicContact CG-CD2 4.5Å; P234-W274 HydrophobicContact CG-CG 3.87Å; L241-W274 HydrophobicContact CB-CZ2 3.8Å; L241-W274 HydrophobicContact CD2-CZ2 4.43Å; L251-W274 HydrophobicContact CD1-CH2 4.09Å; L251-W274 HydrophobicContact CD1-CZ2 4.34Å; W274-G294 WeakPolarHBondContact CZ3-O 3.34Å; W274-L297 HydrophobicContact CD2-CD1 4.17Å; W274-L297 HydrophobicContact CE3-CD1 4.29Å; W274-L311 HydrophobicContact CH2-CD2 4.13Å; W274-L311 HydrophobicContact CZ3-CD1 3.95Å; W274-L311 HydrophobicContact CZ3-CD2 4.06Å
275	C	84.6	Confident	71	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	171.1	-175.4	66.2	0	0	0	0	111.7	A273 R296 L298 W352	A273-C275 PolarHBondContact O-N 3.26Å; C275-R296 PolarHBondContact N-O 2.9Å; C275-R296 WeakPolarHBondContact O-CB 3.35Å; C275-R296 VanDerWaalsContact SG-CB 3.59Å; C275-L298 HydrophobicContact CB-CB 4.25Å; C275-W352 HydrophobicContact CB-CB 3.62Å; C275-W352 HydrophobicContact CB-CD2 3.88Å; C275-W352 HydrophobicContact CB-CG 3.42Å; C275-W352 VanDerWaalsContact CB-CG 3.42Å
276	G	69.1	Low	68.3	Low	4 Å²	4	61.5 Å²	61.5	4%	0.041	33%	0.329	C	S	.	.			trans	85.4	127.5	179	0	0	0	0	0	113.3	L293	G276-L293 WeakPolarHBondContact O-CA 3.38Å; G276-L293 PolarHBondContact O-N 2.89Å
277	G	56.4	Low	65.9	Low	10 Å²	10	57.2 Å²	57.2	10%	0.103	31%	0.314	C	S	.	.	S	Bend	trans	133.7	167.7	-176.5	0	0	0	0	0	110.9	P291 W352	G277-P291 WeakPolarHBondContact CA-O 3.3Å; G277-W352 WeakPolarHBondContact O-CH2 3.45Å; G277-W352 WeakPolarHBondContact O-CZ2 2.91Å
278	S	49.5	Very low	63.5	Low	51 Å²	51	58.9 Å²	58.9	36%	0.357	33%	0.33	S	S	.	.			trans	-90.9	-7.4	-178.5	58.3	0	0	0	0	114.1	Q280	S278-Q280 PolarHBondContact O-N 2.81Å
279	G	47.8	Very low	61.2	Low	20 Å²	20	60.4 Å²	60.4	21%	0.206	33%	0.333	C	S	.	.			trans	65.5	6	-174.4	0	0	0	0	0	115.3
280	Q	45.9	Very low	58.8	Low	108 Å²	108	63.7 Å²	63.7	51%	0.505	35%	0.349	S	S	.	.			trans	-85.9	129.1	178.3	-70.3	-72.5	-22.4	0	0	109.4	S278 N282	S278-Q280 PolarHBondContact O-N 2.81Å; Q280-N282 PolarHBondContact O-N 2.74Å
281	P	42.9	Very low	56.6	Low	56 Å²	56	63.9 Å²	63.9	36%	0.364	35%	0.352	S	S	.	.			trans	-63.8	129.1	175.7	26.1	-33.7	0	0	0	109.8	R283	P281-R283 PolarHBondContact O-N 3.13Å
282	N	43.3	Very low	54.8	Low	87 Å²	87	67.5 Å²	67.5	47%	0.465	37%	0.367	S	S	.	.			trans	-68.9	87.5	-169.6	-159.6	-12.6	0	0	0	111.6	Q280	Q280-N282 PolarHBondContact O-N 2.74Å
283	R	38.9	Very low	53.5	Low	199 Å²	199	70.1 Å²	70.1	75%	0.751	38%	0.377	S	S	*	.			trans	-110.8	110.8	-176.3	-72.2	-173.9	178.3	-172.1	1.9	111.2	P281	P281-R283 PolarHBondContact O-N 3.13Å
284	S	34.3	Very low	52.8	Low	112 Å²	112	69.4 Å²	69.4	78%	0.783	37%	0.371	S	S	*	.	S	Bend	trans	63.9	130.3	177.5	51.9	0	0	0	0	116.6
285	N	39	Very low	52.4	Low	149 Å²	149	69.4 Å²	69.4	80%	0.797	37%	0.372	S	S	*	.			trans	58.3	88.1	-176.7	-66.6	1.7	0	0	0	115.3	T287	N285-T287 PolarHBondContact O-N 2.91Å
286	Q	36.6	Very low	52.4	Low	170 Å²	170	70 Å²	70	79%	0.794	38%	0.375	S	S	*	.			trans	-55.7	104.6	160.9	-71	176.5	-20.4	0	0	109.4
287	T	40.8	Very low	53.4	Low	57 Å²	57	69.8 Å²	69.8	35%	0.35	37%	0.373	S	S	.	.			trans	-85.1	133.2	156.3	51.4	0	0	0	0	107.1	N285 H289	N285-T287 PolarHBondContact O-N 2.91Å; T287-H289 PolarHBondContact O-N 2.79Å
288	P	44.5	Very low	55.1	Low	96 Å²	96	69.3 Å²	69.3	62%	0.623	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	3	-166.9	21.6	-31.9	0	0	0	115.7
289	H	46.5	Very low	57.2	Low	45 Å²	45	66.9 Å²	66.9	21%	0.208	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.8	11.4	-164.8	-59.6	-40.5	0	0	0	115.9	T287 V394 A397 V401	T287-H289 PolarHBondContact O-N 2.79Å; H289-V394 WeakPolarHBondContact O-CG2 2.94Å; H289-A397 HydrophobicContact CB-CB 3.75Å; H289-A397 PolarHBondContact CD2-O 2.78Å; H289-A397 VanDerWaalsContact CD2-O 3.23Å; H289-A397 PolarHBondContact NE2-O 3.44Å; H289-V401 WeakPolarHBondContact NE2-CG2 3.46Å
290	Q	45.5	Very low	59.5	Low	71 Å²	71	66 Å²	66	33%	0.332	34%	0.341	S	S	.	.	S	Bend	trans	-58.5	142.6	166.1	-81.5	-174.9	-15.7	0	0	110	Q292	Q290-Q292 WeakPolarHBondContact O-CG 3.49Å; Q290-Q292 PolarHBondContact O-N 2.63Å; Q290-Q292 VanDerWaalsContact O-N 3.15Å
291	P	49.9	Very low	61.9	Low	31 Å²	31	60.9 Å²	60.9	20%	0.201	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-71.7	117.3	-179.9	14.7	0.8	0	0	0	106.9	G277 A390 V394	G277-P291 WeakPolarHBondContact CA-O 3.3Å; P291-A390 HydrophobicContact CB-CB 3.97Å; P291-A390 HydrophobicContact CG-CB 3.83Å; P291-V394 VanDerWaalsContact CD-CG2 3.44Å; P291-V394 HydrophobicContact CG-CG2 3.67Å
292	Q	57.6	Low	64.4	Low	90 Å²	90	60.1 Å²	60.1	42%	0.421	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-95.7	136.1	-178.3	-60.1	-161.2	4.7	0	0	110.5	Q290 G294 M295 F316	Q290-Q292 WeakPolarHBondContact O-CG 3.49Å; Q290-Q292 PolarHBondContact O-N 2.63Å; Q290-Q292 VanDerWaalsContact O-N 3.15Å; Q292-G294 PolarHBondContact O-N 3.02Å; Q292-M295 WeakPolarHBondContact O-CB 3.39Å; Q292-M295 WeakPolarHBondContact O-CG 3.45Å; Q292-M295 PolarHBondContact O-N 3.41Å; Q292-F316 HydrophobicContact CB-CE1 3.94Å; Q292-F316 HydrophobicContact CB-CZ 4.19Å; Q292-F316 HydrophobicContact CG-CE1 4.09Å; Q292-F316 HydrophobicContact CG-CZ 4.22Å
293	L	69.2	Low	66.8	Low	77 Å²	77	57.7 Å²	57.7	40%	0.403	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	135.6	172.2	-154.8	77.1	0	0	0	108.6	P234 G276 W352	P234-L293 HydrophobicContact CB-CB 4.18Å; P234-L293 HydrophobicContact CB-CD2 3.92Å; P234-L293 HydrophobicContact CB-CG 4.15Å; P234-L293 HydrophobicContact CG-CD2 3.89Å; P234-L293 HydrophobicContact CG-CG 4.09Å; G276-L293 WeakPolarHBondContact O-CA 3.38Å; G276-L293 PolarHBondContact O-N 2.89Å; L293-W352 HydrophobicContact CD1-CE3 3.91Å; L293-W352 HydrophobicContact CD1-CZ3 3.6Å
294	G	77.7	Confident	69.4	Low	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.8	1.7	-173.1	0	0	0	0	0	115.4	R233 W274 Q292	R233-G294 PolarHBondContact NE-O 2.98Å; W274-G294 WeakPolarHBondContact CZ3-O 3.34Å; Q292-G294 PolarHBondContact O-N 3.02Å
295	M	80.2	Confident	72.2	Confident	24 Å²	24	42.9 Å²	42.9	12%	0.118	23%	0.228	C	C	.	.	S	Bend	trans	-99.7	-12.9	173	-65.6	-54.2	-58.3	0	0	114.6	R233 Q292 L311 F316	R233-M295 PolarHBondContact NH2-SD 3.15Å; Q292-M295 WeakPolarHBondContact O-CB 3.39Å; Q292-M295 WeakPolarHBondContact O-CG 3.45Å; Q292-M295 PolarHBondContact O-N 3.41Å; M295-L311 WeakPolarHBondContact CE-O 3.29Å; M295-L311 WeakPolarHBondContact O-CD1 3.49Å; M295-L311 PolarHBondContact O-N 3.08Å; M295-F316 HydrophobicContact CG-CE1 4.19Å; M295-F316 HydrophobicContact CG-CZ 3.87Å; M295-F316 HydrophobicContact SD-CD1 4.49Å; M295-F316 HydrophobicContact SD-CE1 4.02Å; M295-F316 HydrophobicContact SD-CE2 4.27Å; M295-F316 HydrophobicContact SD-CZ 3.9Å
296	R	84.9	Confident	74.7	Confident	12 Å²	12	35.9 Å²	35.9	5%	0.045	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	151.5	173.5	-79	175.2	159.6	175	-8.9	111.6	C275 V308 W309 E332 I386 A389	C275-R296 PolarHBondContact N-O 2.9Å; C275-R296 WeakPolarHBondContact O-CB 3.35Å; C275-R296 VanDerWaalsContact SG-CB 3.59Å; R296-V308 HydrophobicContact CB-CG1 4.48Å; R296-V308 HydrophobicContact CG-CG1 4.4Å; R296-W309 VanDerWaalsContact CA-O 3.25Å; R296-W309 WeakPolarHBondContact CA-O 3.44Å; R296-E332 IonicContact CZ-OE1 2.71Å; R296-E332 IonicContact CZ-OE2 3.54Å; R296-E332 IonicContact NE-OE1 2.74Å; R296-E332 PolarHBondContact NE-OE1 3.04Å; R296-E332 IonicContact NE-OE2 3.15Å; R296-E332 PolarHBondContact NE-OE2 2.98Å; R296-E332 VanDerWaalsContact NE-OE2 3.1Å; R296-E332 VanDerWaalsContact NH2-CD 3.27Å; R296-E332 IonicContact NH2-OE1 3.64Å; R296-E332 PolarHBondContact NH2-OE1 3.17Å; R296-E332 IonicContact NH2-OE2 3.52Å; R296-E332 PolarHBondContact NH2-OE2 3.1Å; R296-I386 PolarHBondContact NH1-O 3.3Å; R296-A389 VanDerWaalsContact NH2-CB 3.32Å
297	L	90.3	Very high	77.3	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.6	178.2	-176.2	70.4	0	0	0	110.4	L241 A272 W274 T299 V308 W309 L311	L241-L297 HydrophobicContact CD1-CD2 3.68Å; L241-L297 HydrophobicContact CD2-CD1 3.43Å; L241-L297 VanDerWaalsContact CD2-CD1 3.43Å; L241-L297 HydrophobicContact CD2-CD2 3.73Å; L241-L297 HydrophobicContact CD2-CG 4.23Å; L241-L297 HydrophobicContact CG-CD2 4.38Å; A272-L297 HydrophobicContact CB-CD1 3.95Å; A272-L297 HydrophobicContact CB-CD2 4.41Å; A272-L297 HydrophobicContact CB-CG 4.25Å; W274-L297 HydrophobicContact CD2-CD1 4.17Å; W274-L297 HydrophobicContact CE3-CD1 4.29Å; L297-T299 HydrophobicContact CD2-CG2 3.88Å; L297-T299 HydrophobicContact CG-CG2 4.08Å; L297-V308 CarbonylContact O-C 3.58Å; L297-V308 WeakPolarHBondContact O-CA 3.1Å; L297-W309 HydrophobicContact CB-CB 4.33Å; L297-W309 PolarHBondContact N-O 3.39Å; L297-W309 PolarHBondContact O-N 2.68Å; L297-L311 HydrophobicContact CB-CD1 4.17Å
298	L	91.5	Very high	79.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.4	169.8	174.5	59.8	0	0	0	108.8	A272 A273 C275 L306 G307 V308 V350 T361 V424	A272-L298 CarbonylContact C-O 3.53Å; A272-L298 WeakPolarHBondContact CA-O 3.41Å; A272-L298 WeakPolarHBondContact CB-O 3.49Å; A273-L298 PolarHBondContact N-O 3.26Å; A273-L298 PolarHBondContact O-N 3.05Å; C275-L298 HydrophobicContact CB-CB 4.25Å; L298-L306 HydrophobicContact CD1-CB 4.4Å; L298-G307 CarbonylContact C-O 3.59Å; L298-G307 WeakPolarHBondContact CA-O 3.49Å; L298-G307 WeakPolarHBondContact CD1-O 3.47Å; L298-V308 HydrophobicContact CB-CG2 4.5Å; L298-V308 HydrophobicContact CD1-CG2 3.88Å; L298-V350 HydrophobicContact CD2-CG2 3.48Å; L298-V350 VanDerWaalsContact CD2-CG2 3.48Å; L298-V350 HydrophobicContact CG-CG2 3.78Å; L298-T361 HydrophobicContact CD2-CG2 3.8Å; L298-V424 HydrophobicContact CD1-CG1 3.66Å
299	T	94.9	Very high	81.7	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.006	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	147.2	178	55.6	0	0	0	0	111.8	L269 A272 L297 H301 L306 G307 W309	L269-T299 HydrophobicContact CD1-CG2 3.91Å; A272-T299 HydrophobicContact CB-CG2 3.92Å; L297-T299 HydrophobicContact CD2-CG2 3.88Å; L297-T299 HydrophobicContact CG-CG2 4.08Å; T299-H301 WeakPolarHBondContact CB-NE2 3.42Å; T299-H301 PolarHBondContact OG1-NE2 2.83Å; T299-L306 WeakPolarHBondContact O-CA 3.27Å; T299-G307 PolarHBondContact N-O 2.76Å; T299-G307 PolarHBondContact O-N 3.36Å; T299-G307 PolarHBondContact OG1-O 2.89Å; T299-W309 PolarHBondContact OG1-NE1 3.38Å
300	A	95.5	Very high	83.5	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	139.8	177.7	0	0	0	0	0	110.9	E270 A271 L306 I347 V350	E270-A300 PolarHBondContact N-O 2.64Å; A271-A300 HydrophobicContact CB-CB 4.37Å; A271-A300 PolarHBondContact N-O 3.45Å; A271-A300 PolarHBondContact O-N 3.15Å; A300-L306 HydrophobicContact CB-CD2 3.74Å; A300-I347 HydrophobicContact CB-CB 4Å; A300-I347 HydrophobicContact CB-CG2 3.63Å; A300-V350 HydrophobicContact CB-CB 3.91Å; A300-V350 HydrophobicContact CB-CG1 3.76Å
301	H	95.8	Very high	85.4	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.005	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	159.5	-164.9	-59.1	-79.5	0	0	0	114.4	W265 H267 G268 T299 D303 G304 S305 I347	W265-H301 AromaticContact CD1-CE1 3.51Å; W265-H301 AromaticContact CD1-CG 3.87Å; W265-H301 AromaticContact CD1-ND1 3.47Å; W265-H301 AromaticContact CD1-NE2 3.94Å; W265-H301 AromaticContact CG-CE1 3.89Å; H267-H301 HydrophobicContact CB-CB 4.31Å; H267-H301 PolarHBondContact O-ND1 3.48Å; G268-H301 WeakPolarHBondContact O-CA 3.22Å; T299-H301 WeakPolarHBondContact CB-NE2 3.42Å; T299-H301 PolarHBondContact OG1-NE2 2.83Å; H301-D303 WeakPolarHBondContact CB-OD1 3.21Å; H301-D303 PolarHBondContact O-N 2.84Å; H301-G304 PolarHBondContact O-N 2.92Å; H301-S305 PolarHBondContact N-O 2.95Å; H301-I347 PolarHBondContact O-N 2.8Å
302	S	95.5	Very high	86.4	Confident	41 Å²	41	20.9 Å²	20.9	29%	0.287	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-15.5	-176.1	52.2	0	0	0	0	115.7	G268 E270	G268-S302 WeakPolarHBondContact CA-OG 3.42Å; G268-S302 PolarHBondContact N-OG 3.5Å; G268-S302 WeakPolarHBondContact O-CB 3.47Å; G268-S302 PolarHBondContact O-N 2.99Å; G268-S302 PolarHBondContact O-OG 2.84Å; E270-S302 WeakPolarHBondContact OE1-CB 3.31Å
303	D	93.8	Very high	87	Confident	35 Å²	35	23.8 Å²	23.8	19%	0.187	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-12.6	172.1	63.4	-16.8	0	0	0	113.3	H267 H301 S305	H267-D303 HydrophobicContact CB-CB 4.47Å; H267-D303 IonicContact CD2-OD2 2.65Å; H267-D303 PolarHBondContact CD2-OD2 2.8Å; H267-D303 IonicContact CG-OD2 3.83Å; H267-D303 IonicContact NE2-OD2 3.35Å; H301-D303 WeakPolarHBondContact CB-OD1 3.21Å; H301-D303 PolarHBondContact O-N 2.84Å; D303-S305 VanDerWaalsContact CG-OG 3.27Å; D303-S305 WeakPolarHBondContact OD1-CB 3.44Å; D303-S305 PolarHBondContact OD1-N 3.01Å; D303-S305 PolarHBondContact OD1-OG 2.88Å; D303-S305 PolarHBondContact OD2-OG 2.82Å; D303-S305 VanDerWaalsContact OD2-OG 3.1Å
304	G	93.2	Very high	87.3	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	94.4	18.2	-174.3	0	0	0	0	0	114.1	H301 P338 K345 I347	H301-G304 PolarHBondContact O-N 2.92Å; G304-P338 VanDerWaalsContact O-CD 3.29Å; G304-P338 WeakPolarHBondContact O-CD 3.29Å; G304-K345 WeakPolarHBondContact CA-O 3.37Å; G304-I347 WeakPolarHBondContact O-CD1 3.34Å
305	S	92.6	Very high	86.7	Confident	1 Å²	1	22 Å²	22	1%	0.007	11%	0.113	C	C	.	.			trans	-96.1	155.1	177.5	69.2	0	0	0	0	114	H301 D303 S336	H301-S305 PolarHBondContact N-O 2.95Å; D303-S305 VanDerWaalsContact CG-OG 3.27Å; D303-S305 WeakPolarHBondContact OD1-CB 3.44Å; D303-S305 PolarHBondContact OD1-N 3.01Å; D303-S305 PolarHBondContact OD1-OG 2.88Å; D303-S305 PolarHBondContact OD2-OG 2.82Å; D303-S305 VanDerWaalsContact OD2-OG 3.1Å; S305-S336 CarbonylContact C-O 3.47Å; S305-S336 VanDerWaalsContact CA-O 3.3Å; S305-S336 WeakPolarHBondContact CA-O 3.44Å
306	L	92.7	Very high	85.7	Confident	1 Å²	1	26 Å²	26	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	142.5	173.3	-67.6	-179.3	0	0	0	110.5	L298 T299 A300 P335 S336 P338 I347 V350 F363 V424	L298-L306 HydrophobicContact CD1-CB 4.4Å; T299-L306 WeakPolarHBondContact O-CA 3.27Å; A300-L306 HydrophobicContact CB-CD2 3.74Å; L306-P335 CarbonylContact O-C 3.49Å; L306-P335 WeakPolarHBondContact O-CA 3.44Å; L306-P335 WeakPolarHBondContact O-CB 3.11Å; L306-S336 PolarHBondContact N-O 3.11Å; L306-S336 PolarHBondContact O-N 2.79Å; L306-P338 HydrophobicContact CD1-CG 3.75Å; L306-P338 HydrophobicContact CG-CG 3.98Å; L306-I347 HydrophobicContact CD1-CD1 4.34Å; L306-I347 HydrophobicContact CD2-CD1 3.66Å; L306-I347 HydrophobicContact CD2-CG2 4.16Å; L306-I347 HydrophobicContact CG-CD1 3.64Å; L306-V350 HydrophobicContact CD2-CG2 4.1Å; L306-F363 HydrophobicContact CD1-CD1 3.86Å; L306-F363 HydrophobicContact CD1-CE1 4.13Å; L306-F363 HydrophobicContact CD1-CG 4.26Å; L306-V424 HydrophobicContact CB-CG1 3.68Å
307	G	90.7	Very high	84.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145.9	-176.2	0	0	0	0	0	114.1	L298 T299	L298-G307 CarbonylContact C-O 3.59Å; L298-G307 WeakPolarHBondContact CA-O 3.49Å; L298-G307 WeakPolarHBondContact CD1-O 3.47Å; T299-G307 PolarHBondContact N-O 2.76Å; T299-G307 PolarHBondContact O-N 3.36Å; T299-G307 PolarHBondContact OG1-O 2.89Å
308	V	88.9	Confident	82.1	Confident	1 Å²	1	33 Å²	33	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.4	175.3	173.5	0	0	0	0	111.3	R296 L297 L298 M331 E332 I386 V424	R296-V308 HydrophobicContact CB-CG1 4.48Å; R296-V308 HydrophobicContact CG-CG1 4.4Å; L297-V308 CarbonylContact O-C 3.58Å; L297-V308 WeakPolarHBondContact O-CA 3.1Å; L298-V308 HydrophobicContact CB-CG2 4.5Å; L298-V308 HydrophobicContact CD1-CG2 3.88Å; V308-M331 CarbonylContact O-C 3.42Å; V308-M331 WeakPolarHBondContact O-CA 3.4Å; V308-M331 WeakPolarHBondContact O-CB 3.49Å; V308-E332 PolarHBondContact O-N 3.25Å; V308-I386 HydrophobicContact CG2-CD1 3.79Å; V308-I386 HydrophobicContact CG2-CG1 4.14Å; V308-V424 HydrophobicContact CB-CG2 4Å; V308-V424 HydrophobicContact CG2-CB 4.28Å; V308-V424 HydrophobicContact CG2-CG1 3.85Å; V308-V424 HydrophobicContact CG2-CG2 3.78Å
309	W	89.7	Confident	79.9	Confident	6 Å²	6	36.7 Å²	36.7	2%	0.023	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	137.9	177	-54.8	77.8	0	0	0	110.6	L263 W265 R296 L297 T299 L329 M331	L263-W309 HydrophobicContact CB-CD2 4Å; L263-W309 HydrophobicContact CB-CE3 3.73Å; L263-W309 HydrophobicContact CB-CH2 4Å; L263-W309 HydrophobicContact CB-CZ2 4.25Å; L263-W309 HydrophobicContact CB-CZ3 3.73Å; L263-W309 HydrophobicContact CD2-CB 3.74Å; L263-W309 HydrophobicContact CD2-CD2 3.72Å; L263-W309 HydrophobicContact CD2-CE3 3.77Å; L263-W309 HydrophobicContact CD2-CG 3.74Å; L263-W309 HydrophobicContact CG-CD2 4.39Å; L263-W309 HydrophobicContact CG-CE3 4.08Å; L263-W309 HydrophobicContact CG-CZ3 4.46Å; W265-W309 HydrophobicContact CB-CZ2 4.36Å; R296-W309 VanDerWaalsContact CA-O 3.25Å; R296-W309 WeakPolarHBondContact CA-O 3.44Å; L297-W309 HydrophobicContact CB-CB 4.33Å; L297-W309 PolarHBondContact N-O 3.39Å; L297-W309 PolarHBondContact O-N 2.68Å; T299-W309 PolarHBondContact OG1-NE1 3.38Å; W309-L329 HydrophobicContact CE3-CB 4.43Å; W309-L329 WeakPolarHBondContact CZ3-O 3.35Å; W309-M331 HydrophobicContact CD2-CG 3.46Å; W309-M331 VanDerWaalsContact CD2-CG 3.46Å; W309-M331 HydrophobicContact CE3-CG 3.6Å; W309-M331 HydrophobicContact CG-CG 4.15Å; W309-M331 HydrophobicContact CH2-CG 3.61Å; W309-M331 HydrophobicContact CH2-SD 4.03Å; W309-M331 HydrophobicContact CZ2-CG 3.45Å; W309-M331 VanDerWaalsContact CZ2-CG 3.45Å; W309-M331 HydrophobicContact CZ2-SD 3.58Å; W309-M331 VanDerWaalsContact CZ2-SD 3.58Å; W309-M331 HydrophobicContact CZ3-CG 3.68Å
310	S	83.9	Confident	77.5	Confident	24 Å²	24	43.3 Å²	43.3	17%	0.168	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.4	174	-177.8	0	0	0	0	110.3	R312 E332	S310-R312 WeakPolarHBondContact OG-CD 3.49Å; S310-R312 VanDerWaalsContact OG-CG 3.31Å; S310-R312 WeakPolarHBondContact OG-CG 3.42Å; S310-R312 PolarHBondContact OG-NE 3.14Å; S310-E332 WeakPolarHBondContact CB-OE1 3.34Å
311	L	84	Confident	75.3	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	28%	0.283	C	S	.	.			trans	-107.1	21	175.7	-57.8	92.7	0	0	0	112.2	L251 W274 M295 L297 E313 I314 L329	L251-L311 HydrophobicContact CD2-CD2 4.43Å; W274-L311 HydrophobicContact CH2-CD2 4.13Å; W274-L311 HydrophobicContact CZ3-CD1 3.95Å; W274-L311 HydrophobicContact CZ3-CD2 4.06Å; M295-L311 WeakPolarHBondContact CE-O 3.29Å; M295-L311 WeakPolarHBondContact O-CD1 3.49Å; M295-L311 PolarHBondContact O-N 3.08Å; L297-L311 HydrophobicContact CB-CD1 4.17Å; L311-E313 PolarHBondContact O-N 3.05Å; L311-I314 HydrophobicContact CB-CD1 4.15Å; L311-I314 HydrophobicContact CB-CG1 4.44Å; L311-I314 HydrophobicContact CD2-CD1 3.89Å; L311-I314 HydrophobicContact CG-CD1 4.43Å; L311-I314 PolarHBondContact O-N 3.16Å; L311-L329 HydrophobicContact CD2-CD1 4.42Å; L311-L329 HydrophobicContact CG-CD1 4.04Å
312	R	72.4	Confident	73.2	Confident	122 Å²	122	52.7 Å²	52.7	46%	0.46	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-53.4	-40.4	-179.8	-68.5	175.7	-148.3	-140.8	1.1	112.6	S310 I314 G315 E332 S393	S310-R312 WeakPolarHBondContact OG-CD 3.49Å; S310-R312 VanDerWaalsContact OG-CG 3.31Å; S310-R312 WeakPolarHBondContact OG-CG 3.42Å; S310-R312 PolarHBondContact OG-NE 3.14Å; R312-I314 PolarHBondContact O-N 3.29Å; R312-G315 PolarHBondContact O-N 3.1Å; R312-G315 VanDerWaalsContact O-N 3.08Å; R312-E332 IonicContact NH2-OE1 3.74Å; R312-E332 PolarHBondContact NH2-OE1 2.86Å; R312-S393 PolarHBondContact NH1-OG 2.66Å; R312-S393 PolarHBondContact NH2-OG 2.94Å
313	E	70.6	Confident	71.4	Confident	151 Å²	151	55 Å²	55	71%	0.706	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-60.8	-22.5	179.5	-62.4	179.6	-170.3	0	0	114.2	L311 L329	L311-E313 PolarHBondContact O-N 3.05Å; E313-L329 HydrophobicContact CB-CD2 4.25Å; E313-L329 HydrophobicContact CG-CD2 4.45Å; E313-L329 WeakPolarHBondContact OE2-CD2 3.41Å
314	I	73.8	Confident	70.1	Confident	18 Å²	18	62 Å²	62	9%	0.092	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-84.6	-25.6	179	-49.5	-175.5	0	0	0	111.2	L251 M260 A261 L311 R312 L329	L251-I314 HydrophobicContact CD2-CD1 3.77Å; L251-I314 HydrophobicContact CD2-CG2 4.42Å; M260-I314 HydrophobicContact CE-CG2 3.57Å; A261-I314 HydrophobicContact CB-CD1 3.49Å; A261-I314 VanDerWaalsContact CB-CD1 3.49Å; A261-I314 HydrophobicContact CB-CG1 4.35Å; L311-I314 HydrophobicContact CB-CD1 4.15Å; L311-I314 HydrophobicContact CB-CG1 4.44Å; L311-I314 HydrophobicContact CD2-CD1 3.89Å; L311-I314 HydrophobicContact CG-CD1 4.43Å; L311-I314 PolarHBondContact O-N 3.16Å; R312-I314 PolarHBondContact O-N 3.29Å; I314-L329 HydrophobicContact CD1-CD1 4.24Å
315	G	64.9	Low	69.5	Low	23 Å²	23	65 Å²	65	24%	0.237	36%	0.363	C	S	.	.			trans	65	-165.6	-180	0	0	0	0	0	115.4	R233 R312	R233-G315 PolarHBondContact NH2-O 2.97Å; R312-G315 PolarHBondContact O-N 3.1Å; R312-G315 VanDerWaalsContact O-N 3.08Å
316	F	59.5	Low	69.2	Low	106 Å²	106	65.4 Å²	65.4	47%	0.465	37%	0.365	S	S	.	.	S	Bend	trans	-102.2	-14.5	177.5	-64.5	-90.4	0	0	0	113.6	F236 Q292 M295	F236-F316 WeakPolarHBondContact CE1-O 3.4Å; F236-F316 HydrophobicContact CE2-CD1 4.47Å; F236-F316 HydrophobicContact CZ-CB 4.32Å; F236-F316 AromaticContact CZ-CD1 3.73Å; F236-F316 HydrophobicContact CZ-CD1 3.73Å; F236-F316 HydrophobicContact CZ-CE1 4.49Å; F236-F316 HydrophobicContact CZ-CG 4.36Å; Q292-F316 HydrophobicContact CB-CE1 3.94Å; Q292-F316 HydrophobicContact CB-CZ 4.19Å; Q292-F316 HydrophobicContact CG-CE1 4.09Å; Q292-F316 HydrophobicContact CG-CZ 4.22Å; M295-F316 HydrophobicContact CG-CE1 4.19Å; M295-F316 HydrophobicContact CG-CZ 3.87Å; M295-F316 HydrophobicContact SD-CD1 4.49Å; M295-F316 HydrophobicContact SD-CE1 4.02Å; M295-F316 HydrophobicContact SD-CE2 4.27Å; M295-F316 HydrophobicContact SD-CZ 3.9Å
317	G	52.5	Low	69	Low	48 Å²	48	67.2 Å²	67.2	50%	0.495	38%	0.377	S	S	.	.	S	Bend	trans	-84.6	144.9	-177.9	0	0	0	0	0	112.3	T319	G317-T319 PolarHBondContact O-N 3.22Å
318	T	47	Very low	68.9	Low	112 Å²	112	71.3 Å²	71.3	69%	0.687	40%	0.398	S	S	*	.			trans	-69.2	83	156.3	52.1	0	0	0	0	108.1	T320	T318-T320 PolarHBondContact O-N 3.22Å
319	T	46.6	Very low	68.9	Low	78 Å²	78	71.5 Å²	71.5	48%	0.479	40%	0.399	S	S	.	.			trans	-59.2	109.3	-178.2	20.6	0	0	0	0	110.2	G317 I321	G317-T319 PolarHBondContact O-N 3.22Å; T319-I321 PolarHBondContact O-N 3.43Å
320	T	44.6	Very low	68.7	Low	139 Å²	139	78.9 Å²	78.9	85%	0.853	43%	0.434	S	S	*	.	S	Bend	trans	-69.4	-15.8	177.4	47.6	0	0	0	0	112.4	T318	T318-T320 PolarHBondContact O-N 3.22Å
321	I	48.6	Very low	68.8	Low	149 Å²	149	79 Å²	79	76%	0.764	43%	0.432	S	S	*	.	S	Bend	trans	-112.8	85.8	172.4	-50	168.7	0	0	0	107.1	T319	T319-I321 PolarHBondContact O-N 3.43Å
322	S	52.4	Low	68.6	Low	50 Å²	50	81.2 Å²	81.2	35%	0.35	44%	0.443	S	S	.	.			trans	-82.8	143.9	172.8	50.6	0	0	0	0	110.9	R258	R258-S322 PolarHBondContact NH1-OG 2.82Å
323	P	56.7	Low	68.8	Low	89 Å²	89	77.8 Å²	77.8	58%	0.578	43%	0.432	S	S	*	.			trans	-57.4	148.5	165.6	27.1	-34.3	0	0	0	110.1	Q325	P323-Q325 PolarHBondContact O-N 2.92Å
324	I	67.4	Low	69.1	Low	183 Å²	183	74.6 Å²	74.6	94%	0.938	43%	0.431	S	S	*	.	S	Bend	trans	-57.6	-20.5	178.4	-66	171.3	0	0	0	111.8
325	Q	80.9	Confident	69.6	Low	63 Å²	63	74.8 Å²	74.8	29%	0.294	43%	0.434	S	S	.	.	S	Bend	trans	-137.6	139.3	-176.5	-163.3	171.7	8.4	0	0	111.1	S215 P323	S215-Q325 PolarHBondContact OG-NE2 3.27Å; P323-Q325 PolarHBondContact O-N 2.92Å
326	P	85.6	Confident	70.6	Confident	9 Å²	9	75.5 Å²	75.5	6%	0.058	44%	0.435	C	S	.	.			trans	-61.5	134.9	179	21.4	-33.4	0	0	0	112	I214 R218 V259 L262	I214-P326 HydrophobicContact CG1-CG 4.34Å; R218-P326 VanDerWaalsContact CZ-O 3.31Å; R218-P326 PolarHBondContact NH1-O 3.34Å; R218-P326 PolarHBondContact NH2-O 2.99Å; V259-P326 HydrophobicContact CB-CB 4.41Å; V259-P326 HydrophobicContact CB-CG 4.28Å; V259-P326 HydrophobicContact CG1-CB 3.95Å; V259-P326 HydrophobicContact CG1-CG 4.07Å; L262-P326 HydrophobicContact CD1-CB 4.39Å; L262-P326 HydrophobicContact CD1-CG 3.85Å; L262-P326 HydrophobicContact CG-CB 4.45Å; L262-P326 HydrophobicContact CG-CG 4.34Å
327	P	88.9	Confident	72	Confident	38 Å²	38	73.3 Å²	73.3	25%	0.247	43%	0.427	C	S	.	.			trans	-55.2	148.3	171.5	22.2	-34.1	0	0	0	111.7	M260 A261 L262	M260-P327 WeakPolarHBondContact O-CD 3.44Å; A261-P327 HydrophobicContact CB-CG 4.27Å; L262-P327 PolarHBondContact N-O 3.48Å
328	L	88.6	Confident	73.8	Confident	87 Å²	87	71.3 Å²	71.3	46%	0.455	41%	0.405	S	S	.	.	B	Isolated β-bridge	trans	-97.5	101.6	167.4	-154.6	92.4	0	0	0	106	L262 P264	L262-L328 HydrophobicContact CB-CD1 4.06Å; P264-L328 HydrophobicContact CG-CD1 3.91Å; P264-L328 HydrophobicContact CG-CD2 4.21Å; P264-L328 HydrophobicContact CG-CG 4.09Å
329	L	89.2	Confident	75.9	Confident	5 Å²	5	66.1 Å²	66.1	3%	0.026	37%	0.373	C	S	.	.			trans	-70	153.5	178.2	-62.7	177.8	0	0	0	109.5	A261 L262 L263 W309 L311 E313 I314	A261-L329 HydrophobicContact CB-CD1 3.95Å; A261-L329 HydrophobicContact CB-CG 4.21Å; L262-L329 PolarHBondContact O-N 2.9Å; L263-L329 HydrophobicContact CD2-CD1 4Å; L263-L329 HydrophobicContact CG-CB 4.29Å; L263-L329 HydrophobicContact CG-CD1 4.1Å; W309-L329 HydrophobicContact CE3-CB 4.43Å; W309-L329 WeakPolarHBondContact CZ3-O 3.35Å; L311-L329 HydrophobicContact CD2-CD1 4.42Å; L311-L329 HydrophobicContact CG-CD1 4.04Å; E313-L329 HydrophobicContact CB-CD2 4.25Å; E313-L329 HydrophobicContact CG-CD2 4.45Å; E313-L329 WeakPolarHBondContact OE2-CD2 3.41Å; I314-L329 HydrophobicContact CD1-CD1 4.24Å
330	Q	84.8	Confident	77.7	Confident	161 Å²	161	63.6 Å²	63.6	75%	0.752	36%	0.362	S	S	*	.			trans	-109	157.8	168.3	-63.8	-172.8	5.2	0	0	109.5
331	M	86	Confident	79.7	Confident	26 Å²	26	62.7 Å²	62.7	13%	0.128	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-71.1	150.5	170.4	-63.6	172.6	57.9	0	0	109.5	W265 V308 W309 E333 P335	W265-M331 HydrophobicContact CD2-SD 4.14Å; W265-M331 HydrophobicContact CE3-SD 3.65Å; W265-M331 HydrophobicContact CZ3-SD 3.92Å; V308-M331 CarbonylContact O-C 3.42Å; V308-M331 WeakPolarHBondContact O-CA 3.4Å; V308-M331 WeakPolarHBondContact O-CB 3.49Å; W309-M331 HydrophobicContact CD2-CG 3.46Å; W309-M331 VanDerWaalsContact CD2-CG 3.46Å; W309-M331 HydrophobicContact CE3-CG 3.6Å; W309-M331 HydrophobicContact CG-CG 4.15Å; W309-M331 HydrophobicContact CH2-CG 3.61Å; W309-M331 HydrophobicContact CH2-SD 4.03Å; W309-M331 HydrophobicContact CZ2-CG 3.45Å; W309-M331 VanDerWaalsContact CZ2-CG 3.45Å; W309-M331 HydrophobicContact CZ2-SD 3.58Å; W309-M331 VanDerWaalsContact CZ2-SD 3.58Å; W309-M331 HydrophobicContact CZ3-CG 3.68Å; M331-E333 VanDerWaalsContact C-N 3.26Å; M331-E333 WeakPolarHBondContact CB-O 3.45Å; M331-E333 PolarHBondContact O-N 3.14Å; M331-P335 HydrophobicContact CE-CB 3.7Å; M331-P335 VanDerWaalsContact CE-CD 3.49Å; M331-P335 HydrophobicContact CE-CG 3.71Å; M331-P335 HydrophobicContact SD-CG 4.18Å
332	E	80.2	Confident	81.6	Confident	49 Å²	49	62.4 Å²	62.4	23%	0.229	35%	0.352	C	S	.	.	S	Bend	trans	-65.5	-34.1	177.3	-66.9	-174.4	154.9	0	0	111.2	R296 V308 S310 R312	R296-E332 IonicContact CZ-OE1 2.71Å; R296-E332 IonicContact CZ-OE2 3.54Å; R296-E332 IonicContact NE-OE1 2.74Å; R296-E332 PolarHBondContact NE-OE1 3.04Å; R296-E332 IonicContact NE-OE2 3.15Å; R296-E332 PolarHBondContact NE-OE2 2.98Å; R296-E332 VanDerWaalsContact NE-OE2 3.1Å; R296-E332 VanDerWaalsContact NH2-CD 3.27Å; R296-E332 IonicContact NH2-OE1 3.64Å; R296-E332 PolarHBondContact NH2-OE1 3.17Å; R296-E332 IonicContact NH2-OE2 3.52Å; R296-E332 PolarHBondContact NH2-OE2 3.1Å; V308-E332 PolarHBondContact O-N 3.25Å; S310-E332 WeakPolarHBondContact CB-OE1 3.34Å; R312-E332 IonicContact NH2-OE1 3.74Å; R312-E332 PolarHBondContact NH2-OE1 2.86Å
333	E	77.1	Confident	83.4	Confident	50 Å²	50	64.4 Å²	64.4	23%	0.234	36%	0.364	C	S	.	.	S	Bend	trans	-138.6	165.7	170.5	-63.2	-162.5	161	0	0	110.7	M331 P421 I422 H423	M331-E333 VanDerWaalsContact C-N 3.26Å; M331-E333 WeakPolarHBondContact CB-O 3.45Å; M331-E333 PolarHBondContact O-N 3.14Å; E333-P421 VanDerWaalsContact OE1-C 3.29Å; E333-P421 WeakPolarHBondContact OE1-CB 3.29Å; E333-I422 VanDerWaalsContact CD-C 3.41Å; E333-I422 VanDerWaalsContact CD-O 3.27Å; E333-I422 PolarHBondContact OE1-N 2.87Å; E333-H423 IonicContact OE1-CE1 2.75Å; E333-H423 IonicContact OE1-ND1 2.73Å; E333-H423 WeakPolarHBondContact OE2-CA 3.41Å; E333-H423 IonicContact OE2-CE1 3.61Å; E333-H423 IonicContact OE2-CG 3.75Å; E333-H423 IonicContact OE2-ND1 3.61Å; E333-H423 PolarHBondContact OE2-ND1 2.88Å
334	A	76.6	Confident	85.2	Confident	83 Å²	83	60.2 Å²	60.2	69%	0.686	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-63.1	139.5	168.5	0	0	0	0	0	110.1	S336	A334-S336 PolarHBondContact O-N 3.09Å
335	P	84	Confident	86.5	Confident	23 Å²	23	54.7 Å²	54.7	15%	0.149	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-64	132.7	-176.7	16.9	-21.6	0	0	0	111.9	W265 L306 M331	W265-P335 HydrophobicContact CD2-CG 4.24Å; W265-P335 VanDerWaalsContact CE2-CG 3.44Å; W265-P335 VanDerWaalsContact CH2-CD 3.45Å; W265-P335 HydrophobicContact CH2-CG 3.63Å; W265-P335 HydrophobicContact CZ2-CG 3.13Å; W265-P335 HydrophobicContact CZ3-CG 4.32Å; L306-P335 CarbonylContact O-C 3.49Å; L306-P335 WeakPolarHBondContact O-CA 3.44Å; L306-P335 WeakPolarHBondContact O-CB 3.11Å; M331-P335 HydrophobicContact CE-CB 3.7Å; M331-P335 VanDerWaalsContact CE-CD 3.49Å; M331-P335 HydrophobicContact CE-CG 3.71Å; M331-P335 HydrophobicContact SD-CG 4.18Å
336	S	85.2	Confident	87.2	Confident	38 Å²	38	54.6 Å²	54.6	27%	0.266	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-93.1	141	-180	56.4	0	0	0	0	110.8	S305 L306 A334 P338	S305-S336 CarbonylContact C-O 3.47Å; S305-S336 VanDerWaalsContact CA-O 3.3Å; S305-S336 WeakPolarHBondContact CA-O 3.44Å; L306-S336 PolarHBondContact N-O 3.11Å; L306-S336 PolarHBondContact O-N 2.79Å; A334-S336 PolarHBondContact O-N 3.09Å; S336-P338 WeakPolarHBondContact O-CD 3.34Å
337	M	89.5	Confident	87.7	Confident	60 Å²	60	54.1 Å²	54.1	30%	0.296	30%	0.304	S	S	.	.			trans	-87.5	108.8	165.6	-68.1	173.5	62.9	0	0	108.6	Y339 G340 F342 C344	M337-Y339 PolarHBondContact O-N 3.12Å; M337-Y339 VanDerWaalsContact O-N 3.1Å; M337-G340 PolarHBondContact O-N 3.01Å; M337-F342 WeakPolarHBondContact CE-O 3.19Å; M337-C344 HydrophobicContact CE-CB 3.85Å
338	P	89.3	Confident	88	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.039	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-35.6	-171.1	-31.1	39.5	0	0	0	114.6	G304 L306 S336 I347 F363 F425	G304-P338 VanDerWaalsContact O-CD 3.29Å; G304-P338 WeakPolarHBondContact O-CD 3.29Å; L306-P338 HydrophobicContact CD1-CG 3.75Å; L306-P338 HydrophobicContact CG-CG 3.98Å; S336-P338 WeakPolarHBondContact O-CD 3.34Å; P338-I347 HydrophobicContact CG-CD1 4.16Å; P338-F363 HydrophobicContact CB-CE1 4.22Å; P338-F363 HydrophobicContact CB-CE2 4.32Å; P338-F363 HydrophobicContact CB-CZ 3.59Å; P338-F363 HydrophobicContact CG-CE1 4.2Å; P338-F363 HydrophobicContact CG-CE2 4.28Å; P338-F363 HydrophobicContact CG-CZ 3.79Å; P338-F425 HydrophobicContact CB-CD1 4.01Å; P338-F425 HydrophobicContact CB-CD2 3.66Å; P338-F425 HydrophobicContact CB-CE1 4.07Å; P338-F425 HydrophobicContact CB-CE2 3.74Å; P338-F425 HydrophobicContact CB-CG 3.79Å; P338-F425 HydrophobicContact CB-CZ 3.93Å; P338-F425 HydrophobicContact CG-CB 4.37Å; P338-F425 HydrophobicContact CG-CD2 4.13Å; P338-F425 HydrophobicContact CG-CG 4.15Å; P338-F425 WeakPolarHBondContact O-CE1 3.3Å
339	Y	91	Very high	88.3	Confident	3 Å²	3	53.1 Å²	53.1	1%	0.012	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	31	179.4	-53.1	-58.8	0	0	0	112	M337 F363 M367 P368 S379 F425 H432 W622 P623	M337-Y339 PolarHBondContact O-N 3.12Å; M337-Y339 VanDerWaalsContact O-N 3.1Å; Y339-F363 HydrophobicContact CD2-CE2 4.29Å; Y339-F363 HydrophobicContact CD2-CZ 4.28Å; Y339-F363 AromaticContact CE2-CE2 3.63Å; Y339-F363 HydrophobicContact CE2-CE2 3.63Å; Y339-F363 AromaticContact CE2-CZ 3.47Å; Y339-F363 HydrophobicContact CE2-CZ 3.47Å; Y339-F363 VanDerWaalsContact CE2-CZ 3.47Å; Y339-F363 AromaticContact CZ-CZ 3.87Å; Y339-M367 HydrophobicContact CD2-CE 3.31Å; Y339-M367 HydrophobicContact CE2-CE 3.23Å; Y339-M367 HydrophobicContact CG-CE 4.22Å; Y339-P368 WeakPolarHBondContact O-CG 3.06Å; Y339-S379 WeakPolarHBondContact CE2-OG 3.38Å; Y339-S379 VanDerWaalsContact OH-CB 3.27Å; Y339-S379 WeakPolarHBondContact OH-CB 3.39Å; Y339-S379 PolarHBondContact OH-OG 2.95Å; Y339-F425 HydrophobicContact CE1-CZ 4.31Å; Y339-H432 AromaticContact CE1-CE1 3.77Å; Y339-H432 AromaticContact CE1-NE2 3.93Å; Y339-H432 AromaticContact CZ-NE2 3.83Å; Y339-H432 PolarHBondContact OH-NE2 2.99Å; Y339-W622 AromaticContact CD1-CE2 3.88Å; Y339-W622 AromaticContact CD1-CZ2 3.77Å; Y339-W622 HydrophobicContact CD1-CZ2 3.77Å; Y339-W622 AromaticContact CD1-NE1 3.99Å; Y339-W622 HydrophobicContact CE1-CH2 4.32Å; Y339-W622 AromaticContact CE1-CZ2 3.99Å; Y339-W622 HydrophobicContact CE1-CZ2 3.99Å; Y339-P623 HydrophobicContact CD1-CB 3.74Å; Y339-P623 HydrophobicContact CD1-CG 3.52Å; Y339-P623 HydrophobicContact CD2-CG 4.28Å; Y339-P623 HydrophobicContact CE1-CB 3.56Å; Y339-P623 HydrophobicContact CE1-CG 3.88Å; Y339-P623 HydrophobicContact CG-CB 4.33Å; Y339-P623 HydrophobicContact CG-CG 3.72Å
340	G	85.2	Confident	88.5	Confident	24 Å²	24	53.2 Å²	53.2	25%	0.247	30%	0.299	C	S	.	.			trans	-67.5	-176.3	171.1	0	0	0	0	0	112.9	M337 F342	M337-G340 PolarHBondContact O-N 3.01Å; G340-F342 VanDerWaalsContact C-N 3.34Å
341	P	87	Confident	88.8	Confident	121 Å²	121	48 Å²	48	79%	0.786	27%	0.274	S	S	*	.	S	Bend	cis	-82.8	-2.6	3.2	34	-36.9	0	0	0	113.9
342	F	87.6	Confident	88.9	Confident	143 Å²	143	47.5 Å²	47.5	63%	0.627	27%	0.271	S	S	*	.	S	Bend	trans	-67.7	148.3	-179.1	-64.5	-73.6	0	0	0	112.2	M337 G340 C344 P368	M337-F342 WeakPolarHBondContact CE-O 3.19Å; G340-F342 VanDerWaalsContact C-N 3.34Å; F342-C344 PolarHBondContact O-N 3.31Å; F342-C344 VanDerWaalsContact O-N 3.15Å; F342-C344 PolarHBondContact O-SG 3Å; F342-C344 VanDerWaalsContact O-SG 3.4Å; F342-P368 HydrophobicContact CB-CB 4.48Å
343	P	90.7	Very high	89.3	Confident	91 Å²	91	45.4 Å²	45.4	59%	0.591	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-57.8	118.3	177.4	-26.3	35.2	0	0	0	112.9	R369	P343-R369 WeakPolarHBondContact O-CB 3.47Å; P343-R369 PolarHBondContact O-N 2.75Å
344	C	94	Very high	89.4	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.007	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-87.1	171.1	-177.7	-69.1	0	0	0	0	113.2	M337 F342 G366 M367 R369	M337-C344 HydrophobicContact CE-CB 3.85Å; F342-C344 PolarHBondContact O-N 3.31Å; F342-C344 VanDerWaalsContact O-N 3.15Å; F342-C344 PolarHBondContact O-SG 3Å; F342-C344 VanDerWaalsContact O-SG 3.4Å; C344-G366 WeakPolarHBondContact CB-O 3.31Å; C344-G366 PolarHBondContact SG-O 2.92Å; C344-M367 CarbonylContact C-O 3.5Å; C344-M367 VanDerWaalsContact CA-O 3.24Å; C344-M367 WeakPolarHBondContact CA-O 3.39Å; C344-R369 PolarHBondContact O-NE 3.31Å; C344-R369 PolarHBondContact O-NH2 3.26Å
345	K	95.3	Very high	89.6	Confident	68 Å²	68	40.9 Å²	40.9	30%	0.296	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-80.7	157.2	153.5	-70.1	-167.6	175.7	-177.3	0	108.9	G304 G366 M367 R369 G373 E374	G304-K345 WeakPolarHBondContact CA-O 3.37Å; K345-G366 VanDerWaalsContact O-CA 3.31Å; K345-G366 WeakPolarHBondContact O-CA 3.48Å; K345-M367 PolarHBondContact N-O 2.69Å; K345-R369 HydrophobicContact CG-CB 4.33Å; K345-R369 HydrophobicContact CG-CG 4.08Å; K345-G373 VanDerWaalsContact CD-O 3.32Å; K345-G373 WeakPolarHBondContact CD-O 3.28Å; K345-G373 WeakPolarHBondContact CE-O 3.39Å; K345-G373 PolarHBondContact NZ-O 2.69Å; K345-E374 IonicContact NZ-OE1 3.74Å; K345-E374 PolarHBondContact NZ-OE1 3.03Å
346	L	96	Very high	89.1	Confident	60 Å²	60	43 Å²	43	31%	0.314	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-52.7	156.4	177.6	61.5	86.9	0	0	0	113	E270 G366	E270-L346 HydrophobicContact CG-CB 4.3Å; L346-G366 PolarHBondContact O-N 3.33Å; L346-G366 VanDerWaalsContact O-N 3.12Å
347	I	96.3	Very high	88.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	108.8	166.1	-67.4	171.3	0	0	0	107.6	E270 A300 H301 G304 L306 P338 K349 F363 V364	E270-I347 VanDerWaalsContact CB-O 3.25Å; E270-I347 WeakPolarHBondContact CB-O 3.25Å; A300-I347 HydrophobicContact CB-CB 4Å; A300-I347 HydrophobicContact CB-CG2 3.63Å; H301-I347 PolarHBondContact O-N 2.8Å; G304-I347 WeakPolarHBondContact O-CD1 3.34Å; L306-I347 HydrophobicContact CD1-CD1 4.34Å; L306-I347 HydrophobicContact CD2-CD1 3.66Å; L306-I347 HydrophobicContact CD2-CG2 4.16Å; L306-I347 HydrophobicContact CG-CD1 3.64Å; P338-I347 HydrophobicContact CG-CD1 4.16Å; I347-K349 WeakPolarHBondContact CG2-O 3.39Å; I347-F363 HydrophobicContact CD1-CD2 3.88Å; I347-F363 HydrophobicContact CD1-CE2 4.13Å; I347-F363 HydrophobicContact CD1-CG 4.48Å; I347-F363 HydrophobicContact CG1-CD2 4.06Å; I347-F363 HydrophobicContact CG1-CE2 4.49Å; I347-F363 HydrophobicContact CG2-CB 3.81Å; I347-F363 HydrophobicContact CG2-CD2 4.16Å; I347-F363 HydrophobicContact CG2-CG 4.39Å; I347-V364 CarbonylContact C-O 3.53Å; I347-V364 VanDerWaalsContact CA-O 3.25Å; I347-V364 WeakPolarHBondContact CA-O 3.41Å
348	S	94.8	Very high	87.6	Confident	50 Å²	50	45.2 Å²	45.2	35%	0.35	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-24	-168.3	57.3	0	0	0	0	114.5	V364	S348-V364 PolarHBondContact N-O 3.23Å; S348-V364 WeakPolarHBondContact OG-CG1 3.38Å
349	K	94.6	Very high	87.1	Confident	53 Å²	53	45 Å²	45	23%	0.23	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	144.5	176.2	-69.3	-175.9	175.2	171.4	0	108.9	I347 F351 F363 V364 D443 L444	I347-K349 WeakPolarHBondContact CG2-O 3.39Å; K349-F351 HydrophobicContact CB-CE2 4Å; K349-F351 HydrophobicContact CD-CE2 4.3Å; K349-F363 WeakPolarHBondContact O-CA 3.36Å; K349-V364 HydrophobicContact CB-CB 4.22Å; K349-V364 HydrophobicContact CB-CG2 3.86Å; K349-V364 PolarHBondContact O-N 2.76Å; K349-D443 IonicContact NZ-OD1 3.1Å; K349-D443 PolarHBondContact NZ-OD1 2.93Å; K349-L444 HydrophobicContact CD-CD2 4.15Å
350	V	94	Very high	86.9	Confident	7 Å²	7	44.9 Å²	44.9	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.3	171.2	68.9	0	0	0	0	109.4	A271 A273 L298 A300 L306 V362 F363	A271-V350 HydrophobicContact CB-CG1 4.05Å; A273-V350 HydrophobicContact CB-CG1 4.42Å; L298-V350 HydrophobicContact CD2-CG2 3.48Å; L298-V350 VanDerWaalsContact CD2-CG2 3.48Å; L298-V350 HydrophobicContact CG-CG2 3.78Å; A300-V350 HydrophobicContact CB-CB 3.91Å; A300-V350 HydrophobicContact CB-CG1 3.76Å; L306-V350 HydrophobicContact CD2-CG2 4.1Å; V350-V362 CarbonylContact C-O 3.55Å; V350-V362 WeakPolarHBondContact CA-O 3.37Å; V350-F363 HydrophobicContact CG2-CB 4.25Å
351	F	90.7	Very high	87.1	Confident	52 Å²	52	43.7 Å²	43.7	23%	0.228	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	144.9	176.1	-64.2	-102.4	0	0	0	108.6	K349 L353 T361 V362 L444	K349-F351 HydrophobicContact CB-CE2 4Å; K349-F351 HydrophobicContact CD-CE2 4.3Å; F351-L353 HydrophobicContact CB-CD2 3.85Å; F351-L353 HydrophobicContact CB-CG 4.34Å; F351-T361 WeakPolarHBondContact O-CA 3.33Å; F351-V362 HydrophobicContact CB-CB 4.34Å; F351-V362 PolarHBondContact N-O 2.91Å; F351-V362 PolarHBondContact O-N 2.55Å; F351-L444 HydrophobicContact CD2-CD1 3.8Å; F351-L444 HydrophobicContact CD2-CD2 4.41Å; F351-L444 HydrophobicContact CD2-CG 4.39Å; F351-L444 HydrophobicContact CE2-CD1 3.46Å; F351-L444 VanDerWaalsContact CE2-CD1 3.46Å; F351-L444 HydrophobicContact CE2-CD2 3.83Å; F351-L444 HydrophobicContact CE2-CG 3.64Å; F351-L444 HydrophobicContact CG-CD1 4.47Å; F351-L444 HydrophobicContact CZ-CD1 3.86Å; F351-L444 HydrophobicContact CZ-CG 4.03Å
352	W	88.6	Confident	87.5	Confident	15 Å²	15	38 Å²	38	6%	0.057	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.2	163.5	-177.8	91.6	0	0	0	107	C275 G277 L293 P354	C275-W352 HydrophobicContact CB-CB 3.62Å; C275-W352 HydrophobicContact CB-CD2 3.88Å; C275-W352 HydrophobicContact CB-CG 3.42Å; C275-W352 VanDerWaalsContact CB-CG 3.42Å; G277-W352 WeakPolarHBondContact O-CH2 3.45Å; G277-W352 WeakPolarHBondContact O-CZ2 2.91Å; L293-W352 HydrophobicContact CD1-CE3 3.91Å; L293-W352 HydrophobicContact CD1-CZ3 3.6Å; W352-P354 HydrophobicContact CH2-CB 4.49Å; W352-P354 HydrophobicContact CZ3-CB 4.23Å
353	L	87.5	Confident	87.8	Confident	5 Å²	5	31.1 Å²	31.1	3%	0.026	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.3	-170.4	-53.7	-177.5	0	0	0	109.9	F351 S355 I360 V362 P446 V454 L457 L470	F351-L353 HydrophobicContact CB-CD2 3.85Å; F351-L353 HydrophobicContact CB-CG 4.34Å; L353-S355 PolarHBondContact O-N 3.36Å; L353-I360 HydrophobicContact CB-CB 4.24Å; L353-I360 PolarHBondContact N-O 3.06Å; L353-I360 PolarHBondContact O-N 3.01Å; L353-V362 HydrophobicContact CD1-CG2 3.69Å; L353-V362 HydrophobicContact CG-CG2 4.26Å; L353-P446 HydrophobicContact CD1-CB 4.23Å; L353-P446 HydrophobicContact CD2-CB 3.62Å; L353-P446 HydrophobicContact CD2-CG 3.79Å; L353-V454 HydrophobicContact CB-CB 4.36Å; L353-V454 HydrophobicContact CB-CG2 3.94Å; L353-V454 HydrophobicContact CD1-CG1 4.42Å; L353-V454 HydrophobicContact CD2-CG2 4.3Å; L353-L457 HydrophobicContact CD1-CD1 4.14Å; L353-L470 HydrophobicContact CD1-CD1 3.84Å
354	P	79.7	Confident	88.1	Confident	30 Å²	30	27.4 Å²	27.4	20%	0.195	16%	0.159	C	C	.	.			trans	-62.9	133.9	172.6	23.6	-31.8	0	0	0	110.9	W352 P453 V454	W352-P354 HydrophobicContact CH2-CB 4.49Å; W352-P354 HydrophobicContact CZ3-CB 4.23Å; P354-P453 CarbonylContact O-C 3.55Å; P354-P453 WeakPolarHBondContact O-CA 3.45Å; P354-V454 HydrophobicContact CG-CG2 4.2Å; P354-V454 PolarHBondContact O-N 2.67Å
355	S	80	Confident	88.1	Confident	9 Å²	9	28.1 Å²	28.1	6%	0.063	17%	0.166	C	C	.	.			trans	-144.4	156	169.5	175.5	0	0	0	0	110.9	L353 L357 G358 R382	L353-S355 PolarHBondContact O-N 3.36Å; S355-L357 PolarHBondContact O-N 2.66Å; S355-L357 VanDerWaalsContact O-N 3.17Å; S355-G358 VanDerWaalsContact CB-O 3.31Å; S355-G358 WeakPolarHBondContact CB-O 3.38Å; S355-G358 PolarHBondContact O-N 2.83Å; S355-R382 PolarHBondContact OG-NH2 3.46Å
356	A	73.3	Confident	88	Confident	66 Å²	66	24.9 Å²	24.9	55%	0.545	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-15.1	-176.5	0	0	0	0	0	114
357	L	73	Confident	87.9	Confident	121 Å²	121	22.1 Å²	22.1	63%	0.634	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107	12.4	-179.1	-60.7	177.9	0	0	0	113.4	S355	S355-L357 PolarHBondContact O-N 2.66Å; S355-L357 VanDerWaalsContact O-N 3.17Å
358	G	71.4	Confident	87.8	Confident	25 Å²	25	22.7 Å²	22.7	26%	0.258	14%	0.141	S	C	.	.	S	Bend	trans	113.8	162.3	-169.7	0	0	0	0	0	111.8	S355	S355-G358 VanDerWaalsContact CB-O 3.31Å; S355-G358 WeakPolarHBondContact CB-O 3.38Å; S355-G358 PolarHBondContact O-N 2.83Å
359	G	78.7	Confident	87.7	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.01	15%	0.15	C	C	.	.			trans	-64.7	146.8	177.9	0	0	0	0	0	112.1	D387	G359-D387 WeakPolarHBondContact CA-OD1 3.23Å; G359-D387 PolarHBondContact N-OD1 3.21Å; G359-D387 VanDerWaalsContact N-OD1 3.1Å; G359-D387 PolarHBondContact N-OD2 2.96Å
360	I	86.9	Confident	87.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.2	174.3	-46.1	169.8	0	0	0	107.5	L353 V362 I380 L381 R382 L470	L353-I360 HydrophobicContact CB-CB 4.24Å; L353-I360 PolarHBondContact N-O 3.06Å; L353-I360 PolarHBondContact O-N 3.01Å; I360-V362 HydrophobicContact CG2-CG2 4.17Å; I360-I380 HydrophobicContact CG2-CG2 3.46Å; I360-I380 VanDerWaalsContact CG2-CG2 3.46Å; I360-L381 CarbonylContact C-O 3.53Å; I360-L381 WeakPolarHBondContact CA-O 3.39Å; I360-R382 VanDerWaalsContact CD1-NH2 3.29Å; I360-R382 HydrophobicContact CG1-CB 4.49Å; I360-L470 HydrophobicContact CD1-CB 3.98Å; I360-L470 HydrophobicContact CD1-CD1 4.07Å; I360-L470 HydrophobicContact CD1-CD2 4.23Å; I360-L470 HydrophobicContact CD1-CG 4.33Å
361	T	89.7	Confident	87.3	Confident	0 Å²	0	34 Å²	34	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	131	170.6	-63.2	0	0	0	0	108.4	L298 F351 L381	L298-T361 HydrophobicContact CD2-CG2 3.8Å; F351-T361 WeakPolarHBondContact O-CA 3.33Å; T361-L381 HydrophobicContact CG2-CD1 4.4Å; T361-L381 HydrophobicContact CG2-CG 4.43Å; T361-L381 PolarHBondContact N-O 3.43Å; T361-L381 PolarHBondContact O-N 2.8Å
362	V	94.3	Very high	87.3	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.6	176.9	180	0	0	0	0	108.7	V350 F351 L353 I360 V378 S379 I380 L457	V350-V362 CarbonylContact C-O 3.55Å; V350-V362 WeakPolarHBondContact CA-O 3.37Å; F351-V362 HydrophobicContact CB-CB 4.34Å; F351-V362 PolarHBondContact N-O 2.91Å; F351-V362 PolarHBondContact O-N 2.55Å; L353-V362 HydrophobicContact CD1-CG2 3.69Å; L353-V362 HydrophobicContact CG-CG2 4.26Å; I360-V362 HydrophobicContact CG2-CG2 4.17Å; V362-V378 HydrophobicContact CG1-CG1 3.76Å; V362-S379 CarbonylContact C-O 3.57Å; V362-S379 VanDerWaalsContact CA-O 3.29Å; V362-S379 WeakPolarHBondContact CA-O 3.5Å; V362-I380 HydrophobicContact CG1-CG1 4.35Å; V362-I380 HydrophobicContact CG2-CG1 4.26Å; V362-I380 HydrophobicContact CG2-CG2 4.19Å; V362-L457 HydrophobicContact CG1-CD2 3.93Å; V362-L457 HydrophobicContact CG2-CD2 4.27Å
363	F	95	Very high	87.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.4	178	71.9	-97.7	0	0	0	113.2	L306 P338 Y339 I347 K349 V350 S379 L381 F425	L306-F363 HydrophobicContact CD1-CD1 3.86Å; L306-F363 HydrophobicContact CD1-CE1 4.13Å; L306-F363 HydrophobicContact CD1-CG 4.26Å; P338-F363 HydrophobicContact CB-CE1 4.22Å; P338-F363 HydrophobicContact CB-CE2 4.32Å; P338-F363 HydrophobicContact CB-CZ 3.59Å; P338-F363 HydrophobicContact CG-CE1 4.2Å; P338-F363 HydrophobicContact CG-CE2 4.28Å; P338-F363 HydrophobicContact CG-CZ 3.79Å; Y339-F363 HydrophobicContact CD2-CE2 4.29Å; Y339-F363 HydrophobicContact CD2-CZ 4.28Å; Y339-F363 AromaticContact CE2-CE2 3.63Å; Y339-F363 HydrophobicContact CE2-CE2 3.63Å; Y339-F363 AromaticContact CE2-CZ 3.47Å; Y339-F363 HydrophobicContact CE2-CZ 3.47Å; Y339-F363 VanDerWaalsContact CE2-CZ 3.47Å; Y339-F363 AromaticContact CZ-CZ 3.87Å; I347-F363 HydrophobicContact CD1-CD2 3.88Å; I347-F363 HydrophobicContact CD1-CE2 4.13Å; I347-F363 HydrophobicContact CD1-CG 4.48Å; I347-F363 HydrophobicContact CG1-CD2 4.06Å; I347-F363 HydrophobicContact CG1-CE2 4.49Å; I347-F363 HydrophobicContact CG2-CB 3.81Å; I347-F363 HydrophobicContact CG2-CD2 4.16Å; I347-F363 HydrophobicContact CG2-CG 4.39Å; K349-F363 WeakPolarHBondContact O-CA 3.36Å; V350-F363 HydrophobicContact CG2-CB 4.25Å; F363-S379 VanDerWaalsContact CE1-CB 3.44Å; F363-S379 WeakPolarHBondContact CE2-OG 3.46Å; F363-S379 WeakPolarHBondContact CZ-OG 3.12Å; F363-S379 PolarHBondContact N-O 3.36Å; F363-S379 PolarHBondContact O-N 3.29Å; F363-L381 HydrophobicContact CD1-CD2 4.11Å; F363-L381 HydrophobicContact CE1-CD2 3.64Å; F363-F425 HydrophobicContact CE1-CD2 4.2Å; F363-F425 HydrophobicContact CE1-CE2 4.22Å; F363-F425 HydrophobicContact CZ-CE2 4.45Å
364	V	96.8	Very high	87.4	Confident	13 Å²	13	40.8 Å²	40.8	8%	0.079	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.5	-175.1	-177.2	0	0	0	0	110.1	I347 S348 K349 V378 L441 L444	I347-V364 CarbonylContact C-O 3.53Å; I347-V364 VanDerWaalsContact CA-O 3.25Å; I347-V364 WeakPolarHBondContact CA-O 3.41Å; S348-V364 PolarHBondContact N-O 3.23Å; S348-V364 WeakPolarHBondContact OG-CG1 3.38Å; K349-V364 HydrophobicContact CB-CB 4.22Å; K349-V364 HydrophobicContact CB-CG2 3.86Å; K349-V364 PolarHBondContact O-N 2.76Å; V364-V378 HydrophobicContact CG2-CG2 4.29Å; V364-L441 HydrophobicContact CB-CD2 4.41Å; V364-L441 HydrophobicContact CG1-CD2 3.75Å; V364-L441 HydrophobicContact CG2-CD2 3.69Å; V364-L444 HydrophobicContact CG2-CD2 3.41Å; V364-L444 VanDerWaalsContact CG2-CD2 3.41Å
365	G	94.1	Very high	88	Confident	15 Å²	15	44 Å²	44	16%	0.155	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	87.9	-133.8	-178.5	0	0	0	0	0	113.5	M367 T377	G365-M367 WeakPolarHBondContact O-CE 3.21Å; G365-M367 PolarHBondContact O-N 3.17Å; G365-T377 PolarHBondContact N-O 3.11Å; G365-T377 VanDerWaalsContact N-O 3.13Å
366	G	93.1	Very high	88.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.259	C	S	.	.			trans	71.4	8.1	-175	0	0	0	0	0	115.1	C344 K345 L346	C344-G366 WeakPolarHBondContact CB-O 3.31Å; C344-G366 PolarHBondContact SG-O 2.92Å; K345-G366 VanDerWaalsContact O-CA 3.31Å; K345-G366 WeakPolarHBondContact O-CA 3.48Å; L346-G366 PolarHBondContact O-N 3.33Å; L346-G366 VanDerWaalsContact O-N 3.12Å
367	M	94.5	Very high	89.8	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.015	24%	0.235	C	C	.	.			trans	-71.9	140.7	-173.3	-70.4	-63.7	103.7	0	0	113.8	Y339 C344 K345 G365 R369 T377 C434 P623 F625	Y339-M367 HydrophobicContact CD2-CE 3.31Å; Y339-M367 HydrophobicContact CE2-CE 3.23Å; Y339-M367 HydrophobicContact CG-CE 4.22Å; C344-M367 CarbonylContact C-O 3.5Å; C344-M367 VanDerWaalsContact CA-O 3.24Å; C344-M367 WeakPolarHBondContact CA-O 3.39Å; K345-M367 PolarHBondContact N-O 2.69Å; G365-M367 WeakPolarHBondContact O-CE 3.21Å; G365-M367 PolarHBondContact O-N 3.17Å; M367-R369 PolarHBondContact O-N 3.5Å; M367-R369 VanDerWaalsContact O-N 3.14Å; M367-T377 HydrophobicContact CE-CG2 4.34Å; M367-T377 HydrophobicContact CG-CG2 3.96Å; M367-T377 VanDerWaalsContact CG-OG1 3.25Å; M367-T377 WeakPolarHBondContact CG-OG1 3.29Å; M367-T377 HydrophobicContact SD-CG2 3.78Å; M367-C434 WeakPolarHBondContact CE-SG 3.23Å; M367-P623 HydrophobicContact CE-CG 4.22Å; M367-P623 HydrophobicContact SD-CG 4.34Å; M367-F625 HydrophobicContact SD-CE1 3.85Å; M367-F625 HydrophobicContact SD-CZ 3.81Å
368	P	93.9	Very high	90.9	Very high	11 Å²	11	37.8 Å²	37.8	7%	0.071	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-50.9	117.6	168.4	-28.5	35.4	0	0	0	111.7	Y339 F342 A370 T371 Y372 G373	Y339-P368 WeakPolarHBondContact O-CG 3.06Å; F342-P368 HydrophobicContact CB-CB 4.48Å; P368-A370 VanDerWaalsContact C-N 3.31Å; P368-A370 PolarHBondContact O-N 3.45Å; P368-T371 PolarHBondContact O-N 2.81Å; P368-Y372 HydrophobicContact CB-CD2 4.34Å; P368-Y372 HydrophobicContact CG-CD2 4.16Å; P368-Y372 PolarHBondContact O-N 3.06Å; P368-G373 PolarHBondContact O-N 2.94Å
369	R	91.8	Very high	92.1	Very high	145 Å²	145	36.6 Å²	36.6	55%	0.547	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-33.9	-163.9	-172.1	-179.1	-57.1	-179.9	3.2	113.8	P343 C344 K345 M367	P343-R369 WeakPolarHBondContact O-CB 3.47Å; P343-R369 PolarHBondContact O-N 2.75Å; C344-R369 PolarHBondContact O-NE 3.31Å; C344-R369 PolarHBondContact O-NH2 3.26Å; K345-R369 HydrophobicContact CG-CB 4.33Å; K345-R369 HydrophobicContact CG-CG 4.08Å; M367-R369 PolarHBondContact O-N 3.5Å; M367-R369 VanDerWaalsContact O-N 3.14Å
370	A	90.4	Very high	92.8	Very high	106 Å²	106	36.6 Å²	36.6	88%	0.876	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-37.6	-176.8	0	0	0	0	0	113.1	P368	P368-A370 VanDerWaalsContact C-N 3.31Å; P368-A370 PolarHBondContact O-N 3.45Å
371	T	89.5	Confident	92.8	Very high	96 Å²	96	36.6 Å²	36.6	59%	0.589	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-45.1	-170.8	-38.8	0	0	0	0	112.5	P368	P368-T371 PolarHBondContact O-N 2.81Å
372	Y	91.6	Very high	92.6	Very high	63 Å²	63	37.1 Å²	37.1	25%	0.247	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.3	13.2	-170.6	-54.9	-61.1	0	0	0	112.9	P368 E374 R375 F625	P368-Y372 HydrophobicContact CB-CD2 4.34Å; P368-Y372 HydrophobicContact CG-CD2 4.16Å; P368-Y372 PolarHBondContact O-N 3.06Å; Y372-E374 PolarHBondContact O-N 3.12Å; Y372-E374 VanDerWaalsContact O-N 3.15Å; Y372-R375 PolarHBondContact O-N 2.68Å; Y372-F625 AromaticContact CD1-CE2 3.74Å; Y372-F625 HydrophobicContact CD1-CE2 3.74Å; Y372-F625 AromaticContact CD1-CZ 3.79Å; Y372-F625 HydrophobicContact CD1-CZ 3.79Å; Y372-F625 HydrophobicContact CD2-CE2 4.07Å; Y372-F625 HydrophobicContact CD2-CZ 4.01Å; Y372-F625 AromaticContact CE1-CE2 3.64Å; Y372-F625 HydrophobicContact CE1-CE2 3.64Å; Y372-F625 HydrophobicContact CE1-CZ 4.18Å; Y372-F625 AromaticContact CE2-CE2 3.98Å; Y372-F625 HydrophobicContact CE2-CE2 3.98Å; Y372-F625 HydrophobicContact CE2-CZ 4.39Å; Y372-F625 AromaticContact CG-CE2 3.96Å; Y372-F625 HydrophobicContact CG-CE2 3.96Å; Y372-F625 AromaticContact CG-CZ 3.69Å; Y372-F625 HydrophobicContact CG-CZ 3.69Å; Y372-F625 AromaticContact CZ-CE2 3.77Å
373	G	88.7	Confident	91.2	Very high	10 Å²	10	38 Å²	38	10%	0.103	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-37.4	-174.2	0	0	0	0	0	114.1	K345 P368	K345-G373 VanDerWaalsContact CD-O 3.32Å; K345-G373 WeakPolarHBondContact CD-O 3.28Å; K345-G373 WeakPolarHBondContact CE-O 3.39Å; K345-G373 PolarHBondContact NZ-O 2.69Å; P368-G373 PolarHBondContact O-N 2.94Å
374	E	90	Very high	89.7	Confident	142 Å²	142	38 Å²	38	66%	0.664	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	0.1	-176.9	-56.2	-50.2	109.2	0	0	114.2	K345 Y372	K345-E374 IonicContact NZ-OE1 3.74Å; K345-E374 PolarHBondContact NZ-OE1 3.03Å; Y372-E374 PolarHBondContact O-N 3.12Å; Y372-E374 VanDerWaalsContact O-N 3.15Å
375	R	92	Very high	87.9	Confident	99 Å²	99	38.1 Å²	38.1	37%	0.374	20%	0.203	S	C	.	.			trans	-75.6	146.9	173.3	-67.5	-168.9	178.3	-150.9	9.3	111.5	Y372 T377 D436	Y372-R375 PolarHBondContact O-N 2.68Å; R375-T377 HydrophobicContact CB-CG2 3.83Å; R375-D436 WeakPolarHBondContact CD-OD2 3.18Å; R375-D436 IonicContact CZ-OD2 3.89Å; R375-D436 IonicContact NE-OD2 3.43Å; R375-D436 IonicContact NH1-OD2 2.74Å; R375-D436 PolarHBondContact NH1-OD2 2.94Å
376	H	94.6	Very high	86.3	Confident	61 Å²	61	37.4 Å²	37.4	28%	0.282	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	101.4	177	-64.7	-59.6	0	0	0	109	L437 S440	H376-L437 HydrophobicContact CB-CB 4.05Å; H376-L437 VanDerWaalsContact O-CB 3.29Å; H376-L437 WeakPolarHBondContact O-CB 3.29Å; H376-L437 PolarHBondContact O-N 3.01Å; H376-S440 PolarHBondContact CE1-OG 3.05Å; H376-S440 PolarHBondContact NE2-OG 3.25Å
377	T	95.9	Very high	84.5	Confident	4 Å²	4	38.4 Å²	38.4	3%	0.025	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.4	-165.2	59.8	0	0	0	0	115.4	G365 M367 R375 L435 F625	G365-T377 PolarHBondContact N-O 3.11Å; G365-T377 VanDerWaalsContact N-O 3.13Å; M367-T377 HydrophobicContact CE-CG2 4.34Å; M367-T377 HydrophobicContact CG-CG2 3.96Å; M367-T377 VanDerWaalsContact CG-OG1 3.25Å; M367-T377 WeakPolarHBondContact CG-OG1 3.29Å; M367-T377 HydrophobicContact SD-CG2 3.78Å; R375-T377 HydrophobicContact CB-CG2 3.83Å; T377-L435 WeakPolarHBondContact CA-O 3.3Å; T377-F625 HydrophobicContact CG2-CE1 3.96Å
378	V	97	Very high	82.7	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	113.4	170.6	-178.5	0	0	0	0	108.2	V362 V364 I380 L435 L437 L441 L459	V362-V378 HydrophobicContact CG1-CG1 3.76Å; V364-V378 HydrophobicContact CG2-CG2 4.29Å; V378-I380 HydrophobicContact CG1-CG1 4.35Å; V378-L435 HydrophobicContact CB-CB 4.44Å; V378-L435 PolarHBondContact N-O 2.86Å; V378-L435 VanDerWaalsContact N-O 3.09Å; V378-L435 WeakPolarHBondContact O-CB 3.45Å; V378-L435 PolarHBondContact O-N 3.47Å; V378-L437 HydrophobicContact CG2-CD1 3.83Å; V378-L441 HydrophobicContact CG2-CD1 4.44Å; V378-L441 HydrophobicContact CG2-CD2 3.71Å; V378-L459 HydrophobicContact CB-CD1 4.27Å; V378-L459 HydrophobicContact CG1-CD1 4.46Å; V378-L459 HydrophobicContact CG1-CD2 4.23Å; V378-L459 HydrophobicContact CG2-CD1 4.06Å; V378-L459 HydrophobicContact CG2-CD2 4.27Å
379	S	94.9	Very high	80.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.3	177	-55.3	0	0	0	0	109.8	Y339 V362 F363 V433 C434	Y339-S379 WeakPolarHBondContact CE2-OG 3.38Å; Y339-S379 VanDerWaalsContact OH-CB 3.27Å; Y339-S379 WeakPolarHBondContact OH-CB 3.39Å; Y339-S379 PolarHBondContact OH-OG 2.95Å; V362-S379 CarbonylContact C-O 3.57Å; V362-S379 VanDerWaalsContact CA-O 3.29Å; V362-S379 WeakPolarHBondContact CA-O 3.5Å; F363-S379 VanDerWaalsContact CE1-CB 3.44Å; F363-S379 WeakPolarHBondContact CE2-OG 3.46Å; F363-S379 WeakPolarHBondContact CZ-OG 3.12Å; F363-S379 PolarHBondContact N-O 3.36Å; F363-S379 PolarHBondContact O-N 3.29Å; S379-V433 WeakPolarHBondContact CA-O 3.47Å; S379-C434 PolarHBondContact OG-SG 2.66Å
380	I	93.2	Very high	78.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.8	178.2	-53.3	-179.4	0	0	0	106.7	I360 V362 V378 H432 V433 L435 L457 I468 L470 W475	I360-I380 HydrophobicContact CG2-CG2 3.46Å; I360-I380 VanDerWaalsContact CG2-CG2 3.46Å; V362-I380 HydrophobicContact CG1-CG1 4.35Å; V362-I380 HydrophobicContact CG2-CG1 4.26Å; V362-I380 HydrophobicContact CG2-CG2 4.19Å; V378-I380 HydrophobicContact CG1-CG1 4.35Å; I380-H432 WeakPolarHBondContact O-CA 3.3Å; I380-H432 PolarHBondContact O-CD2 3.09Å; I380-V433 PolarHBondContact N-O 2.84Å; I380-V433 PolarHBondContact O-N 2.68Å; I380-L435 HydrophobicContact CD1-CD1 3.76Å; I380-L435 HydrophobicContact CG1-CD1 4.45Å; I380-L457 HydrophobicContact CD1-CD2 3.92Å; I380-I468 HydrophobicContact CD1-CD1 3.95Å; I380-I468 HydrophobicContact CD1-CG2 4.49Å; I380-L470 HydrophobicContact CG2-CD2 4.47Å; I380-W475 HydrophobicContact CB-CE3 3.89Å; I380-W475 HydrophobicContact CB-CH2 4.13Å; I380-W475 HydrophobicContact CB-CZ3 3.56Å; I380-W475 HydrophobicContact CG2-CD2 4.01Å; I380-W475 HydrophobicContact CG2-CE3 3.62Å; I380-W475 HydrophobicContact CG2-CH2 3.6Å; I380-W475 HydrophobicContact CG2-CZ2 3.98Å; I380-W475 HydrophobicContact CG2-CZ3 3.42Å; I380-W475 VanDerWaalsContact CG2-CZ3 3.42Å; I380-W475 WeakPolarHBondContact O-CH2 3.44Å; I380-W475 WeakPolarHBondContact O-CZ3 3.15Å
381	L	88.6	Confident	77	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137.4	179.3	59	108.2	0	0	0	111.7	I360 T361 F363 F425 E431 H432	I360-L381 CarbonylContact C-O 3.53Å; I360-L381 WeakPolarHBondContact CA-O 3.39Å; T361-L381 HydrophobicContact CG2-CD1 4.4Å; T361-L381 HydrophobicContact CG2-CG 4.43Å; T361-L381 PolarHBondContact N-O 3.43Å; T361-L381 PolarHBondContact O-N 2.8Å; F363-L381 HydrophobicContact CD1-CD2 4.11Å; F363-L381 HydrophobicContact CE1-CD2 3.64Å; L381-F425 HydrophobicContact CD2-CD2 3.56Å; L381-F425 HydrophobicContact CD2-CE2 3.65Å; L381-E431 WeakPolarHBondContact CA-O 3.41Å; L381-H432 HydrophobicContact CB-CB 4.25Å
382	R	84.2	Confident	75.3	Confident	12 Å²	12	33.2 Å²	33.2	5%	0.045	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.5	175.5	177.4	-175.6	-69.4	154.8	-6.1	108.9	S355 I360 E431 L470 W475	S355-R382 PolarHBondContact OG-NH2 3.46Å; I360-R382 VanDerWaalsContact CD1-NH2 3.29Å; I360-R382 HydrophobicContact CG1-CB 4.49Å; R382-E431 HydrophobicContact CB-CB 4.36Å; R382-E431 WeakPolarHBondContact CD-OE2 3.3Å; R382-E431 IonicContact CZ-OE2 2.67Å; R382-E431 PolarHBondContact N-O 3.47Å; R382-E431 IonicContact NE-OE2 3.06Å; R382-E431 IonicContact NH1-OE1 2.91Å; R382-E431 IonicContact NH1-OE2 3.43Å; R382-E431 PolarHBondContact NH1-OE2 3.45Å; R382-L470 PolarHBondContact NH2-O 3.46Å; R382-W475 HydrophobicContact CB-CZ2 3.89Å
383	G	65.8	Low	73.3	Confident	19 Å²	19	31.6 Å²	31.6	20%	0.196	17%	0.167	C	C	.	.			trans	93.8	9	178.9	0	0	0	0	0	115.4
384	S	62.7	Low	71.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.165	C	C	.	.			trans	-50.6	142.6	165.4	53.2	0	0	0	0	111	I386 D387	S384-I386 PolarHBondContact O-N 3.01Å; S384-D387 PolarHBondContact O-N 3.22Å
385	N	59.3	Low	69.9	Low	15 Å²	15	28.8 Å²	28.8	8%	0.08	16%	0.157	C	C	.	.	H	α-helix	trans	-57.8	-10.7	-175.9	-75.7	-8.4	0	0	0	114.9	D387 Q388 A389 P421 H423	N385-D387 PolarHBondContact O-N 3.41Å; N385-Q388 PolarHBondContact O-N 3.28Å; N385-Q388 VanDerWaalsContact OD1-CD 3.31Å; N385-Q388 PolarHBondContact OD1-NE2 3.37Å; N385-Q388 VanDerWaalsContact OD1-NE2 3.14Å; N385-A389 WeakPolarHBondContact O-CB 3.15Å; N385-A389 PolarHBondContact O-N 3.3Å; N385-P421 PolarHBondContact ND2-O 2.89Å; N385-H423 HydrophobicContact CB-CB 4.48Å; N385-H423 PolarHBondContact N-O 2.88Å
386	I	60.5	Low	68	Low	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-45.1	-44.3	162.8	-58	179.4	0	0	0	111.8	R296 V308 S384 A390	R296-I386 PolarHBondContact NH1-O 3.3Å; V308-I386 HydrophobicContact CG2-CD1 3.79Å; V308-I386 HydrophobicContact CG2-CG1 4.14Å; S384-I386 PolarHBondContact O-N 3.01Å; I386-A390 WeakPolarHBondContact O-CB 3.49Å; I386-A390 PolarHBondContact O-N 3.24Å
387	D	54.9	Low	65.9	Low	21 Å²	21	25.3 Å²	25.3	11%	0.112	16%	0.16	C	C	.	.	H	α-helix	trans	-74.9	-45.8	-179.5	-69.6	-25.3	0	0	0	112.4	G359 S384 N385 A389 A390 N391	G359-D387 WeakPolarHBondContact CA-OD1 3.23Å; G359-D387 PolarHBondContact N-OD1 3.21Å; G359-D387 VanDerWaalsContact N-OD1 3.1Å; G359-D387 PolarHBondContact N-OD2 2.96Å; S384-D387 PolarHBondContact O-N 3.22Å; N385-D387 PolarHBondContact O-N 3.41Å; D387-A389 VanDerWaalsContact C-N 3.27Å; D387-A389 PolarHBondContact O-N 2.99Å; D387-A390 WeakPolarHBondContact O-CB 3.31Å; D387-A390 PolarHBondContact O-N 2.97Å; D387-A390 VanDerWaalsContact O-N 3.14Å; D387-N391 PolarHBondContact O-N 2.94Å
388	Q	56.8	Low	63.8	Low	99 Å²	99	31.6 Å²	31.6	46%	0.463	18%	0.183	S	C	.	.	H	α-helix	trans	-58.9	-42.8	176.3	-61.4	-167.9	26.3	0	0	110.7	N385 N391 A392	N385-Q388 PolarHBondContact O-N 3.28Å; N385-Q388 VanDerWaalsContact OD1-CD 3.31Å; N385-Q388 PolarHBondContact OD1-NE2 3.37Å; N385-Q388 VanDerWaalsContact OD1-NE2 3.14Å; Q388-N391 PolarHBondContact O-N 3.38Å; Q388-A392 WeakPolarHBondContact O-CB 3.22Å; Q388-A392 PolarHBondContact O-N 2.85Å
389	A	51.9	Low	62	Low	6 Å²	6	36.1 Å²	36.1	5%	0.05	21%	0.207	C	C	.	.	H	α-helix	trans	-70.8	-29.3	177.6	0	0	0	0	0	113.5	R296 N385 D387 S393 I422	R296-A389 VanDerWaalsContact NH2-CB 3.32Å; N385-A389 WeakPolarHBondContact O-CB 3.15Å; N385-A389 PolarHBondContact O-N 3.3Å; D387-A389 VanDerWaalsContact C-N 3.27Å; D387-A389 PolarHBondContact O-N 2.99Å; A389-S393 VanDerWaalsContact O-CB 3.29Å; A389-S393 WeakPolarHBondContact O-CB 3.31Å; A389-S393 PolarHBondContact O-N 2.97Å; A389-S393 PolarHBondContact O-OG 3.05Å; A389-I422 HydrophobicContact CB-CB 4.14Å; A389-I422 HydrophobicContact CB-CD1 3.67Å; A389-I422 HydrophobicContact CB-CG1 3.64Å; A389-I422 HydrophobicContact CB-CG2 3.44Å; A389-I422 VanDerWaalsContact CB-CG2 3.44Å
390	A	53	Low	60.1	Low	6 Å²	6	38.8 Å²	38.8	5%	0.05	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-51.1	169.2	0	0	0	0	0	109.3	P291 I386 D387 S393 V394	P291-A390 HydrophobicContact CB-CB 3.97Å; P291-A390 HydrophobicContact CG-CB 3.83Å; I386-A390 WeakPolarHBondContact O-CB 3.49Å; I386-A390 PolarHBondContact O-N 3.24Å; D387-A390 WeakPolarHBondContact O-CB 3.31Å; D387-A390 PolarHBondContact O-N 2.97Å; D387-A390 VanDerWaalsContact O-N 3.14Å; A390-S393 PolarHBondContact O-N 3.06Å; A390-V394 WeakPolarHBondContact O-CG2 3.48Å; A390-V394 PolarHBondContact O-N 3.28Å; A390-V394 VanDerWaalsContact O-N 3.15Å
391	N	52.6	Low	58.4	Low	107 Å²	107	41.9 Å²	41.9	57%	0.572	25%	0.247	S	C	*	.	H	α-helix	trans	-61.7	-44.8	175.3	-80.6	-16.9	0	0	0	113.4	D387 Q388 S393 V394 V395	D387-N391 PolarHBondContact O-N 2.94Å; Q388-N391 PolarHBondContact O-N 3.38Å; N391-S393 PolarHBondContact O-N 3.29Å; N391-V394 VanDerWaalsContact O-CB 3.31Å; N391-V394 WeakPolarHBondContact O-CB 3.28Å; N391-V394 PolarHBondContact O-N 2.94Å; N391-V395 PolarHBondContact O-N 3.45Å
392	A	52.3	Low	57.1	Low	34 Å²	34	44.9 Å²	44.9	28%	0.281	27%	0.272	S	S	.	.	H	α-helix	trans	-60.4	-35.4	177.2	0	0	0	0	0	111.8	Q388 V395 A396 A419	Q388-A392 WeakPolarHBondContact O-CB 3.22Å; Q388-A392 PolarHBondContact O-N 2.85Å; A392-V395 PolarHBondContact O-N 2.92Å; A392-A396 WeakPolarHBondContact O-CB 3.49Å; A392-A396 PolarHBondContact O-N 3.38Å; A392-A419 HydrophobicContact CB-CB 4.07Å
393	S	49.8	Very low	56	Low	29 Å²	29	48.1 Å²	48.1	20%	0.203	30%	0.302	C	S	.	.	H	α-helix	trans	-69.3	-32.8	174.8	-56.9	0	0	0	0	112.6	R312 A389 A390 N391 A397	R312-S393 PolarHBondContact NH1-OG 2.66Å; R312-S393 PolarHBondContact NH2-OG 2.94Å; A389-S393 VanDerWaalsContact O-CB 3.29Å; A389-S393 WeakPolarHBondContact O-CB 3.31Å; A389-S393 PolarHBondContact O-N 2.97Å; A389-S393 PolarHBondContact O-OG 3.05Å; A390-S393 PolarHBondContact O-N 3.06Å; N391-S393 PolarHBondContact O-N 3.29Å; S393-A397 VanDerWaalsContact O-CB 3.25Å; S393-A397 WeakPolarHBondContact O-CB 3Å; S393-A397 PolarHBondContact O-N 3.21Å
394	V	52.8	Low	55.7	Low	13 Å²	13	55.6 Å²	55.6	8%	0.079	33%	0.331	C	S	.	.	H	α-helix	trans	-63.3	-46.1	170.3	-176.8	0	0	0	0	110.4	H289 P291 A390 N391 R398	H289-V394 WeakPolarHBondContact O-CG2 2.94Å; P291-V394 VanDerWaalsContact CD-CG2 3.44Å; P291-V394 HydrophobicContact CG-CG2 3.67Å; A390-V394 WeakPolarHBondContact O-CG2 3.48Å; A390-V394 PolarHBondContact O-N 3.28Å; A390-V394 VanDerWaalsContact O-N 3.15Å; N391-V394 VanDerWaalsContact O-CB 3.31Å; N391-V394 WeakPolarHBondContact O-CB 3.28Å; N391-V394 PolarHBondContact O-N 2.94Å; V394-R398 WeakPolarHBondContact O-CB 3.24Å; V394-R398 VanDerWaalsContact O-CG 3.26Å; V394-R398 WeakPolarHBondContact O-CG 3.38Å; V394-R398 PolarHBondContact O-N 3.4Å
395	V	54.2	Low	55.5	Low	80 Å²	80	58.4 Å²	58.4	49%	0.485	36%	0.355	S	S	.	.	H	α-helix	trans	-66.1	-48.9	-178.8	175.7	0	0	0	0	110.8	N391 A392 A397 R398 L399	N391-V395 PolarHBondContact O-N 3.45Å; A392-V395 PolarHBondContact O-N 2.92Å; V395-A397 VanDerWaalsContact C-N 3.32Å; V395-A397 PolarHBondContact O-N 3.28Å; V395-R398 WeakPolarHBondContact O-CB 3.29Å; V395-R398 PolarHBondContact O-N 2.86Å; V395-L399 HydrophobicContact CG1-CD1 4.21Å; V395-L399 WeakPolarHBondContact O-CG 3.33Å; V395-L399 PolarHBondContact O-N 3.41Å
396	A	53	Low	55.1	Low	59 Å²	59	67.2 Å²	67.2	49%	0.488	40%	0.395	S	S	.	.	H	α-helix	trans	-59.4	-40.7	177.6	0	0	0	0	0	112.5	A392 L399 A400	A392-A396 WeakPolarHBondContact O-CB 3.49Å; A392-A396 PolarHBondContact O-N 3.38Å; A396-L399 PolarHBondContact O-N 2.95Å; A396-A400 PolarHBondContact O-N 3.07Å
397	A	51.4	Low	54.7	Low	27 Å²	27	74.4 Å²	74.4	22%	0.223	43%	0.434	C	S	.	.	H	α-helix	trans	-74.1	-31.9	177.6	0	0	0	0	0	112.8	H289 S393 V395 A400 V401	H289-A397 HydrophobicContact CB-CB 3.75Å; H289-A397 PolarHBondContact CD2-O 2.78Å; H289-A397 VanDerWaalsContact CD2-O 3.23Å; H289-A397 PolarHBondContact NE2-O 3.44Å; S393-A397 VanDerWaalsContact O-CB 3.25Å; S393-A397 WeakPolarHBondContact O-CB 3Å; S393-A397 PolarHBondContact O-N 3.21Å; V395-A397 VanDerWaalsContact C-N 3.32Å; V395-A397 PolarHBondContact O-N 3.28Å; A397-A400 PolarHBondContact O-N 3.1Å; A397-V401 PolarHBondContact O-N 2.81Å
398	R	51.3	Low	54.3	Low	137 Å²	137	81.2 Å²	81.2	52%	0.517	47%	0.47	S	S	.	.	H	α-helix	trans	-61.4	-42.1	167.8	-77.4	172.5	178.3	-172.4	-0.2	112	V394 V395 A402	V394-R398 WeakPolarHBondContact O-CB 3.24Å; V394-R398 VanDerWaalsContact O-CG 3.26Å; V394-R398 WeakPolarHBondContact O-CG 3.38Å; V394-R398 PolarHBondContact O-N 3.4Å; V395-R398 WeakPolarHBondContact O-CB 3.29Å; V395-R398 PolarHBondContact O-N 2.86Å; R398-A402 WeakPolarHBondContact O-CB 3.21Å; R398-A402 PolarHBondContact O-N 3.15Å
399	L	57.9	Low	53.8	Low	95 Å²	95	84 Å²	84	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-64.9	-39.7	174.7	-68.6	169	0	0	0	111.4	V395 A396 A402 A403	V395-L399 HydrophobicContact CG1-CD1 4.21Å; V395-L399 WeakPolarHBondContact O-CG 3.33Å; V395-L399 PolarHBondContact O-N 3.41Å; A396-L399 PolarHBondContact O-N 2.95Å; L399-A402 PolarHBondContact O-N 2.91Å; L399-A403 WeakPolarHBondContact O-CB 3.26Å; L399-A403 PolarHBondContact O-N 2.94Å
400	A	55.9	Low	53.6	Low	55 Å²	55	92.9 Å²	92.9	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-43.2	176.7	0	0	0	0	0	113	A396 A397 A403 E404	A396-A400 PolarHBondContact O-N 3.07Å; A397-A400 PolarHBondContact O-N 3.1Å; A400-A403 PolarHBondContact O-N 2.9Å; A400-E404 PolarHBondContact O-N 3Å
401	V	58.3	Low	53.1	Low	65 Å²	65	99.8 Å²	99.8	39%	0.394	56%	0.563	S	S	.	*	H	α-helix	trans	-73.7	-27.8	175.8	158.1	0	0	0	0	113	H289 A397 A403 E404 A405	H289-V401 WeakPolarHBondContact NE2-CG2 3.46Å; A397-V401 PolarHBondContact O-N 2.81Å; V401-A403 VanDerWaalsContact C-N 3.32Å; V401-E404 PolarHBondContact O-N 2.81Å; V401-A405 PolarHBondContact O-N 3.24Å
402	A	61.2	Low	52.5	Low	63 Å²	63	99.9 Å²	99.9	52%	0.521	57%	0.57	S	S	.	*	H	α-helix	trans	-66.2	-35.5	167.7	0	0	0	0	0	111.7	R398 L399 E404 A405	R398-A402 WeakPolarHBondContact O-CB 3.21Å; R398-A402 PolarHBondContact O-N 3.15Å; L399-A402 PolarHBondContact O-N 2.91Å; A402-E404 VanDerWaalsContact C-N 3.29Å; A402-E404 PolarHBondContact O-N 3.29Å; A402-A405 PolarHBondContact O-N 2.76Å; A402-A405 VanDerWaalsContact O-O 3.05Å
403	A	61.4	Low	51.9	Low	81 Å²	81	107.9 Å²	107.9	67%	0.669	60%	0.601	S	S	*	*	H	α-helix	trans	-74.4	-13.7	176.5	0	0	0	0	0	114.4	L399 A400 V401	L399-A403 WeakPolarHBondContact O-CB 3.26Å; L399-A403 PolarHBondContact O-N 2.94Å; A400-A403 PolarHBondContact O-N 2.9Å; V401-A403 VanDerWaalsContact C-N 3.32Å
404	E	58.4	Low	51.1	Low	175 Å²	175	114.8 Å²	114.8	82%	0.818	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-2.2	171.8	-70.8	-171.4	171	0	0	113	A400 V401 A402	A400-E404 PolarHBondContact O-N 3Å; V401-E404 PolarHBondContact O-N 2.81Å; A402-E404 VanDerWaalsContact C-N 3.29Å; A402-E404 PolarHBondContact O-N 3.29Å
405	A	57.8	Low	50.3	Low	60 Å²	60	118 Å²	118	50%	0.496	65%	0.653	S	S	.	*	S	Bend	trans	-128.1	109.4	-176.9	0	0	0	0	0	111.7	V401 A402	V401-A405 PolarHBondContact O-N 3.24Å; A402-A405 PolarHBondContact O-N 2.76Å; A402-A405 VanDerWaalsContact O-O 3.05Å
406	E	51.6	Low	49.3	Very low	199 Å²	199	120.3 Å²	120.3	93%	0.93	67%	0.673	S	S	*	*			trans	102.2	135.6	173.6	-57	-176.9	164.6	0	0	116.1
407	D	51.1	Low	48.7	Very low	151 Å²	151	125 Å²	125	81%	0.807	69%	0.689	S	S	*	*	S	Bend	trans	-78.4	147	178.5	-63.3	-69.1	0	0	0	111	D409	D407-D409 PolarHBondContact O-N 3Å
408	D	47.6	Very low	48.3	Very low	164 Å²	164	129 Å²	129	88%	0.877	72%	0.715	S	S	*	*	S	Bend	trans	33.3	65.3	154.8	-67.9	-16.3	0	0	0	118.5
409	D	47.1	Very low	48	Very low	158 Å²	158	125.4 Å²	125.4	85%	0.845	72%	0.715	S	S	*	*			trans	-137.6	145.5	155.8	-99.2	-39.5	0	0	0	110.9	D407 I411	D407-D409 PolarHBondContact O-N 3Å; D409-I411 PolarHBondContact O-N 2.7Å
410	E	46	Very low	47.3	Very low	193 Å²	193	124.4 Å²	124.4	90%	0.902	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-62.8	116.9	-164.8	-67.6	-179.5	135.9	0	0	114	P412	E410-P412 WeakPolarHBondContact O-CD 3.19Å
411	I	42.9	Very low	46.7	Very low	151 Å²	151	125.4 Å²	125.4	77%	0.774	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-70.1	125.7	171.1	-57.1	174.7	0	0	0	109.4	D409 E413	D409-I411 PolarHBondContact O-N 2.7Å; I411-E413 PolarHBondContact O-N 2.8Å
412	P	39.4	Very low	46.4	Very low	109 Å²	109	124.2 Å²	124.2	71%	0.708	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-66.3	132.9	175.6	-18.9	31.6	0	0	0	112	E410 E414	E410-P412 WeakPolarHBondContact O-CD 3.19Å; P412-E414 PolarHBondContact O-N 2.99Å
413	E	40.9	Very low	46.2	Very low	201 Å²	201	125 Å²	125	94%	0.939	70%	0.7	S	S	*	*	S	Bend	trans	-72.6	56	173.3	-70	-158.8	151.1	0	0	113.2	I411	I411-E413 PolarHBondContact O-N 2.8Å
414	E	33	Very low	46.2	Very low	175 Å²	175	121.3 Å²	121.3	82%	0.818	67%	0.669	S	S	*	*			trans	-136.1	83.9	169.7	-74.8	-162.6	167.1	0	0	111.4	P412	P412-E414 PolarHBondContact O-N 2.99Å
415	S	36.3	Very low	46.9	Very low	80 Å²	80	113.9 Å²	113.9	56%	0.559	63%	0.634	S	S	*	*			trans	175.4	44.4	147.7	44.1	0	0	0	0	115	L417	S415-L417 PolarHBondContact O-N 3.19Å
416	S	33.1	Very low	47.6	Very low	129 Å²	129	112.7 Å²	112.7	90%	0.902	62%	0.619	S	S	*	*			trans	-76.1	39	161.3	58.5	0	0	0	0	112.6	S418	S416-S418 PolarHBondContact O-N 2.93Å; S416-S418 VanDerWaalsContact O-N 3.16Å
417	L	39.7	Very low	48.6	Very low	157 Å²	157	106 Å²	106	82%	0.822	59%	0.594	S	S	*	*			trans	-77.7	99.1	170.7	-74.7	169.8	0	0	0	108.2	S415 A419	S415-L417 PolarHBondContact O-N 3.19Å; L417-A419 PolarHBondContact O-N 3.4Å
418	S	43	Very low	49.6	Very low	110 Å²	110	105.2 Å²	105.2	77%	0.769	59%	0.59	S	S	*	*			trans	-54.1	112.2	164.8	55.9	0	0	0	0	108.2	S416	S416-S418 PolarHBondContact O-N 2.93Å; S416-S418 VanDerWaalsContact O-N 3.16Å
419	A	44.4	Very low	51	Low	63 Å²	63	97.9 Å²	97.9	52%	0.521	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-53.8	134.9	176.1	0	0	0	0	0	108.9	A392 L417	A392-A419 HydrophobicContact CB-CB 4.07Å; L417-A419 PolarHBondContact O-N 3.4Å
420	P	44.2	Very low	52.3	Low	73 Å²	73	95.7 Å²	95.7	47%	0.474	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-58.3	148.3	-178.1	23.8	-33.5	0	0	0	110.7
421	P	43.8	Very low	54	Low	76 Å²	76	88.2 Å²	88.2	49%	0.494	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-53.1	142.6	-179.5	19	-30.4	0	0	0	112.2	E333 N385 H423	E333-P421 VanDerWaalsContact OE1-C 3.29Å; E333-P421 WeakPolarHBondContact OE1-CB 3.29Å; N385-P421 PolarHBondContact ND2-O 2.89Å; P421-H423 VanDerWaalsContact C-N 3.29Å; P421-H423 PolarHBondContact O-N 2.93Å
422	I	52.1	Low	56	Low	40 Å²	40	82.2 Å²	82.2	21%	0.205	48%	0.481	C	S	.	.			trans	-90.7	68.4	-164.7	-49.5	172.9	0	0	0	109	E333 A389 V424	E333-I422 VanDerWaalsContact CD-C 3.41Å; E333-I422 VanDerWaalsContact CD-O 3.27Å; E333-I422 PolarHBondContact OE1-N 2.87Å; A389-I422 HydrophobicContact CB-CB 4.14Å; A389-I422 HydrophobicContact CB-CD1 3.67Å; A389-I422 HydrophobicContact CB-CG1 3.64Å; A389-I422 HydrophobicContact CB-CG2 3.44Å; A389-I422 VanDerWaalsContact CB-CG2 3.44Å; I422-V424 PolarHBondContact O-N 2.91Å
423	H	55.8	Low	58.4	Low	80 Å²	80	77.7 Å²	77.7	37%	0.37	45%	0.451	S	S	.	.			trans	-61.7	120.9	178.4	-62.5	-28.2	0	0	0	111.5	E333 N385 P421 F425	E333-H423 IonicContact OE1-CE1 2.75Å; E333-H423 IonicContact OE1-ND1 2.73Å; E333-H423 WeakPolarHBondContact OE2-CA 3.41Å; E333-H423 IonicContact OE2-CE1 3.61Å; E333-H423 IonicContact OE2-CG 3.75Å; E333-H423 IonicContact OE2-ND1 3.61Å; E333-H423 PolarHBondContact OE2-ND1 2.88Å; N385-H423 HydrophobicContact CB-CB 4.48Å; N385-H423 PolarHBondContact N-O 2.88Å; P421-H423 VanDerWaalsContact C-N 3.29Å; P421-H423 PolarHBondContact O-N 2.93Å; H423-F425 PolarHBondContact O-N 2.8Å
424	V	62.9	Low	60.9	Low	3 Å²	3	68.1 Å²	68.1	2%	0.018	41%	0.406	C	S	.	.	S	Bend	trans	-62.4	-36.9	179.3	177.9	0	0	0	0	111.3	L298 L306 V308 I422	L298-V424 HydrophobicContact CD1-CG1 3.66Å; L306-V424 HydrophobicContact CB-CG1 3.68Å; V308-V424 HydrophobicContact CB-CG2 4Å; V308-V424 HydrophobicContact CG2-CB 4.28Å; V308-V424 HydrophobicContact CG2-CG1 3.85Å; V308-V424 HydrophobicContact CG2-CG2 3.78Å; I422-V424 PolarHBondContact O-N 2.91Å
425	F	71.6	Confident	63.8	Low	20 Å²	20	59.8 Å²	59.8	9%	0.088	37%	0.367	C	S	.	.	S	Bend	trans	-129	132.7	172.5	172.8	-92.1	0	0	0	107.2	P338 Y339 F363 L381 H423 H432 W622	P338-F425 HydrophobicContact CB-CD1 4.01Å; P338-F425 HydrophobicContact CB-CD2 3.66Å; P338-F425 HydrophobicContact CB-CE1 4.07Å; P338-F425 HydrophobicContact CB-CE2 3.74Å; P338-F425 HydrophobicContact CB-CG 3.79Å; P338-F425 HydrophobicContact CB-CZ 3.93Å; P338-F425 HydrophobicContact CG-CB 4.37Å; P338-F425 HydrophobicContact CG-CD2 4.13Å; P338-F425 HydrophobicContact CG-CG 4.15Å; P338-F425 WeakPolarHBondContact O-CE1 3.3Å; Y339-F425 HydrophobicContact CE1-CZ 4.31Å; F363-F425 HydrophobicContact CE1-CD2 4.2Å; F363-F425 HydrophobicContact CE1-CE2 4.22Å; F363-F425 HydrophobicContact CZ-CE2 4.45Å; L381-F425 HydrophobicContact CD2-CD2 3.56Å; L381-F425 HydrophobicContact CD2-CE2 3.65Å; H423-F425 PolarHBondContact O-N 2.8Å; F425-H432 AromaticContact CE2-CE1 3.86Å; F425-H432 AromaticContact CE2-NE2 3.93Å; F425-H432 AromaticContact CZ-CE1 3.6Å; F425-W622 HydrophobicContact CE1-CH2 4.05Å; F425-W622 HydrophobicContact CE1-CZ2 4.03Å; F425-W622 AromaticContact CZ-CH2 3.76Å; F425-W622 HydrophobicContact CZ-CH2 3.76Å; F425-W622 AromaticContact CZ-CZ2 3.97Å; F425-W622 HydrophobicContact CZ-CZ2 3.97Å
426	D	73.1	Confident	66.4	Low	34 Å²	34	57.3 Å²	57.3	18%	0.182	35%	0.348	C	S	.	.			trans	-114.1	123.2	173.6	-174.7	-4.5	0	0	0	107.1	D428 A429	D426-D428 PolarHBondContact O-N 2.98Å; D426-D428 PolarHBondContact OD1-N 2.89Å; D426-A429 HydrophobicContact CB-CB 4.27Å; D426-A429 WeakPolarHBondContact O-CB 3.01Å
427	S	73.1	Confident	69.3	Low	58 Å²	58	51.5 Å²	51.5	41%	0.406	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-24.8	177.3	51.8	0	0	0	0	112.3	A429	S427-A429 VanDerWaalsContact C-N 3.31Å
428	D	72	Confident	71.6	Confident	135 Å²	135	45.6 Å²	45.6	72%	0.722	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	16.2	-172.7	-54.2	1.2	0	0	0	109.9	D426	D426-D428 PolarHBondContact O-N 2.98Å; D426-D428 PolarHBondContact OD1-N 2.89Å
429	A	76.5	Confident	74	Confident	11 Å²	11	40.9 Å²	40.9	9%	0.091	25%	0.245	C	C	.	.			trans	-56.6	133.3	179	0	0	0	0	0	111.2	D426 S427 E431 H432	D426-A429 HydrophobicContact CB-CB 4.27Å; D426-A429 WeakPolarHBondContact O-CB 3.01Å; S427-A429 VanDerWaalsContact C-N 3.31Å; A429-E431 PolarHBondContact O-N 2.86Å; A429-E431 VanDerWaalsContact O-N 3.08Å; A429-H432 HydrophobicContact CB-CB 4.42Å
430	P	74	Confident	76.4	Confident	111 Å²	111	38.7 Å²	38.7	72%	0.721	23%	0.226	S	C	*	.	S	Bend	trans	-65.6	-20.9	-168	25.6	-36.2	0	0	0	114.4
431	E	82.1	Confident	78.9	Confident	37 Å²	37	37 Å²	37	17%	0.173	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	114.4	164.1	-61.6	-178.3	140.3	0	0	108.2	L381 R382 A429 S473 G474 W475	L381-E431 WeakPolarHBondContact CA-O 3.41Å; R382-E431 HydrophobicContact CB-CB 4.36Å; R382-E431 WeakPolarHBondContact CD-OE2 3.3Å; R382-E431 IonicContact CZ-OE2 2.67Å; R382-E431 PolarHBondContact N-O 3.47Å; R382-E431 IonicContact NE-OE2 3.06Å; R382-E431 IonicContact NH1-OE1 2.91Å; R382-E431 IonicContact NH1-OE2 3.43Å; R382-E431 PolarHBondContact NH1-OE2 3.45Å; A429-E431 PolarHBondContact O-N 2.86Å; A429-E431 VanDerWaalsContact O-N 3.08Å; E431-S473 WeakPolarHBondContact OE1-CA 3.14Å; E431-S473 VanDerWaalsContact OE1-CB 3.3Å; E431-S473 WeakPolarHBondContact OE1-CB 3.32Å; E431-S473 PolarHBondContact OE1-OG 2.93Å; E431-G474 PolarHBondContact OE1-N 2.84Å; E431-W475 HydrophobicContact CB-CH2 3.65Å; E431-W475 HydrophobicContact CB-CZ2 3.49Å; E431-W475 VanDerWaalsContact CB-CZ2 3.49Å; E431-W475 HydrophobicContact CG-CZ2 4.45Å; E431-W475 VanDerWaalsContact O-CH2 3.3Å; E431-W475 WeakPolarHBondContact O-CH2 3.32Å; E431-W475 PolarHBondContact OE2-NE1 3.24Å
432	H	86	Confident	81.4	Confident	24 Å²	24	34.9 Å²	34.9	11%	0.111	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	129	174.8	173.8	-148.8	0	0	0	110.1	Y339 I380 L381 F425 A429 W622	Y339-H432 AromaticContact CE1-CE1 3.77Å; Y339-H432 AromaticContact CE1-NE2 3.93Å; Y339-H432 AromaticContact CZ-NE2 3.83Å; Y339-H432 PolarHBondContact OH-NE2 2.99Å; I380-H432 WeakPolarHBondContact O-CA 3.3Å; I380-H432 PolarHBondContact O-CD2 3.09Å; L381-H432 HydrophobicContact CB-CB 4.25Å; F425-H432 AromaticContact CE2-CE1 3.86Å; F425-H432 AromaticContact CE2-NE2 3.93Å; F425-H432 AromaticContact CZ-CE1 3.6Å; A429-H432 HydrophobicContact CB-CB 4.42Å; H432-W622 AromaticContact CE1-CH2 3.53Å; H432-W622 AromaticContact CE1-CZ3 3.74Å; H432-W622 AromaticContact ND1-CH2 3.78Å; H432-W622 AromaticContact ND1-CZ3 3.75Å
433	V	89.3	Confident	83.5	Confident	14 Å²	14	34 Å²	34	9%	0.085	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	134.4	179	177.2	0	0	0	0	109.8	S379 I380 L435 W475 R626	S379-V433 WeakPolarHBondContact CA-O 3.47Å; I380-V433 PolarHBondContact N-O 2.84Å; I380-V433 PolarHBondContact O-N 2.68Å; V433-L435 HydrophobicContact CG1-CD2 3.61Å; V433-L435 HydrophobicContact CG1-CG 4.16Å; V433-W475 HydrophobicContact CB-CE3 4.18Å; V433-W475 HydrophobicContact CB-CZ3 3.97Å; V433-W475 HydrophobicContact CG2-CE3 3.96Å; V433-W475 HydrophobicContact CG2-CZ3 3.88Å; V433-R626 HydrophobicContact CG1-CB 3.6Å; V433-R626 HydrophobicContact CG1-CG 4.49Å
434	C	92.2	Very high	85.4	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	98.5	167.5	-165.2	0	0	0	0	109.6	M367 S379 D436 P623 P624 F625 R626	M367-C434 WeakPolarHBondContact CE-SG 3.23Å; S379-C434 PolarHBondContact OG-SG 2.66Å; C434-D436 PolarHBondContact O-N 3.48Å; C434-P623 HydrophobicContact CB-CB 4.07Å; C434-P624 WeakPolarHBondContact CB-O 3.39Å; C434-P624 PolarHBondContact N-O 3.08Å; C434-F625 HydrophobicContact CB-CD1 4.2Å; C434-F625 CarbonylContact O-C 3.5Å; C434-F625 VanDerWaalsContact O-CA 3.28Å; C434-F625 WeakPolarHBondContact O-CA 3.33Å; C434-R626 PolarHBondContact O-N 3.25Å
435	L	93.9	Very high	87	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	129.2	179.6	-58.6	174.3	0	0	0	110.2	T377 V378 I380 V433 L459 I468 F477 R626 A628	T377-L435 WeakPolarHBondContact CA-O 3.3Å; V378-L435 HydrophobicContact CB-CB 4.44Å; V378-L435 PolarHBondContact N-O 2.86Å; V378-L435 VanDerWaalsContact N-O 3.09Å; V378-L435 WeakPolarHBondContact O-CB 3.45Å; V378-L435 PolarHBondContact O-N 3.47Å; I380-L435 HydrophobicContact CD1-CD1 3.76Å; I380-L435 HydrophobicContact CG1-CD1 4.45Å; V433-L435 HydrophobicContact CG1-CD2 3.61Å; V433-L435 HydrophobicContact CG1-CG 4.16Å; L435-L459 HydrophobicContact CD1-CD1 4.07Å; L435-I468 HydrophobicContact CD1-CD1 3.39Å; L435-I468 HydrophobicContact CD1-CG1 4.25Å; L435-F477 HydrophobicContact CD2-CE1 4.25Å; L435-F477 HydrophobicContact CD2-CZ 4.08Å; L435-R626 CarbonylContact C-O 3.57Å; L435-R626 WeakPolarHBondContact CA-O 3.02Å; L435-R626 HydrophobicContact CD2-CB 4.37Å; L435-A628 HydrophobicContact CB-CB 4.22Å; L435-A628 HydrophobicContact CD2-CB 4.35Å
436	D	92.4	Very high	88.1	Confident	29 Å²	29	32 Å²	32	16%	0.155	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	112.6	175.1	-163.8	15.1	0	0	0	109.4	R375 C434 F625 R626 A628	R375-D436 WeakPolarHBondContact CD-OD2 3.18Å; R375-D436 IonicContact CZ-OD2 3.89Å; R375-D436 IonicContact NE-OD2 3.43Å; R375-D436 IonicContact NH1-OD2 2.74Å; R375-D436 PolarHBondContact NH1-OD2 2.94Å; C434-D436 PolarHBondContact O-N 3.48Å; D436-F625 HydrophobicContact CB-CD1 4.28Å; D436-R626 PolarHBondContact N-O 2.91Å; D436-A628 PolarHBondContact O-N 2.95Å
437	L	93.8	Very high	89.1	Confident	7 Å²	7	30.4 Å²	30.4	4%	0.037	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.4	-171.9	-60.6	167.1	0	0	0	111.5	H376 V378 S439 L441 L459 V466 A628	H376-L437 HydrophobicContact CB-CB 4.05Å; H376-L437 VanDerWaalsContact O-CB 3.29Å; H376-L437 WeakPolarHBondContact O-CB 3.29Å; H376-L437 PolarHBondContact O-N 3.01Å; V378-L437 HydrophobicContact CG2-CD1 3.83Å; L437-S439 VanDerWaalsContact C-N 3.29Å; L437-S439 PolarHBondContact O-N 3.31Å; L437-L441 HydrophobicContact CD1-CB 3.96Å; L437-L441 HydrophobicContact CD1-CD1 3.99Å; L437-L441 HydrophobicContact CD1-CG 4.47Å; L437-L459 HydrophobicContact CD1-CD1 4.47Å; L437-L459 HydrophobicContact CD2-CD1 4Å; L437-V466 HydrophobicContact CD2-CG2 4.27Å; L437-A628 HydrophobicContact CD2-CB 3.91Å
438	P	87.7	Confident	89.9	Confident	33 Å²	33	28.1 Å²	28.1	21%	0.214	17%	0.166	C	C	.	.	S	Bend	trans	-79	-10.5	-175.4	31.7	-36.2	0	0	0	113.7	E464 A628 F631	P438-E464 VanDerWaalsContact CG-OE1 3.31Å; P438-E464 WeakPolarHBondContact CG-OE1 3.38Å; P438-A628 VanDerWaalsContact CD-O 3.24Å; P438-A628 WeakPolarHBondContact CD-O 3.1Å; P438-F631 HydrophobicContact CB-CD1 4.24Å; P438-F631 WeakPolarHBondContact CB-O 3.19Å; P438-F631 HydrophobicContact CG-CB 4.11Å; P438-F631 HydrophobicContact CG-CD1 4.39Å; P438-F631 WeakPolarHBondContact CG-O 3.5Å
439	S	93.9	Very high	90.5	Very high	10 Å²	10	24.5 Å²	24.5	7%	0.07	15%	0.151	C	C	.	.	S	Bend	trans	-141.9	164.8	174.1	61.3	0	0	0	0	110.2	L437 L441 C461 E463	L437-S439 VanDerWaalsContact C-N 3.29Å; L437-S439 PolarHBondContact O-N 3.31Å; S439-L441 PolarHBondContact O-N 2.78Å; S439-C461 VanDerWaalsContact OG-CB 3.31Å; S439-C461 WeakPolarHBondContact OG-CB 3.38Å; S439-E463 PolarHBondContact OG-N 3.14Å
440	S	94.8	Very high	90.6	Very high	18 Å²	18	27.3 Å²	27.3	13%	0.126	17%	0.167	C	C	.	.			trans	-61	135.3	-175.9	-40.2	0	0	0	0	111.1	H376 V442 C461 E462	H376-S440 PolarHBondContact CE1-OG 3.05Å; H376-S440 PolarHBondContact NE2-OG 3.25Å; S440-V442 PolarHBondContact O-N 3.07Å; S440-C461 CarbonylContact O-C 3.49Å; S440-C461 VanDerWaalsContact O-CA 3.26Å; S440-C461 WeakPolarHBondContact O-CA 3.35Å; S440-E462 WeakPolarHBondContact CB-OE2 3.32Å; S440-E462 PolarHBondContact O-N 3.15Å; S440-E462 PolarHBondContact OG-OE2 3.37Å
441	L	96.9	Very high	90.6	Very high	36 Å²	36	28.7 Å²	28.7	19%	0.188	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	122.8	167.5	-172.7	74	0	0	0	109.3	V364 V378 L437 S439 L444 L459	V364-L441 HydrophobicContact CB-CD2 4.41Å; V364-L441 HydrophobicContact CG1-CD2 3.75Å; V364-L441 HydrophobicContact CG2-CD2 3.69Å; V378-L441 HydrophobicContact CG2-CD1 4.44Å; V378-L441 HydrophobicContact CG2-CD2 3.71Å; L437-L441 HydrophobicContact CD1-CB 3.96Å; L437-L441 HydrophobicContact CD1-CD1 3.99Å; L437-L441 HydrophobicContact CD1-CG 4.47Å; S439-L441 PolarHBondContact O-N 2.78Å; L441-L444 HydrophobicContact CD2-CD2 3.87Å; L441-L459 HydrophobicContact CD1-CB 3.82Å; L441-L459 HydrophobicContact CD1-CD2 4.33Å
442	V	96.4	Very high	90.2	Very high	32 Å²	32	27.3 Å²	27.3	19%	0.194	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-55.4	175.9	173.8	0	0	0	0	109.4	P47 T48 S440 L460 E462	P47-V442 HydrophobicContact CG-CG2 4.39Å; P47-V442 WeakPolarHBondContact O-CG1 3.49Å; T48-V442 VanDerWaalsContact C-CG1 3.48Å; T48-V442 WeakPolarHBondContact O-CG1 3.18Å; S440-V442 PolarHBondContact O-N 3.07Å; V442-L460 WeakPolarHBondContact CA-O 3.33Å; V442-L460 HydrophobicContact CB-CG 4.46Å; V442-L460 WeakPolarHBondContact CB-O 3.31Å; V442-L460 HydrophobicContact CG1-CD2 4.49Å; V442-L460 PolarHBondContact N-O 2.92Å; V442-E462 HydrophobicContact CG2-CB 4.41Å; V442-E462 HydrophobicContact CG2-CG 3.64Å
443	D	95.7	Very high	89.9	Confident	23 Å²	23	28.1 Å²	28.1	12%	0.123	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	164.5	-176.1	-154.9	4.6	0	0	0	111.3	S49 V50 K349 L460	S49-D443 VanDerWaalsContact CA-OD2 3.24Å; S49-D443 WeakPolarHBondContact CA-OD2 3.48Å; S49-D443 WeakPolarHBondContact CB-OD2 3.46Å; S49-D443 PolarHBondContact OG-OD2 3.05Å; V50-D443 HydrophobicContact CG1-CB 3.97Å; V50-D443 PolarHBondContact N-OD2 2.79Å; K349-D443 IonicContact NZ-OD1 3.1Å; K349-D443 PolarHBondContact NZ-OD1 2.93Å; D443-L460 HydrophobicContact CB-CB 4.42Å; D443-L460 HydrophobicContact CB-CD2 4.26Å; D443-L460 PolarHBondContact N-O 2.81Å; D443-L460 VanDerWaalsContact N-O 3.08Å; D443-L460 WeakPolarHBondContact O-CA 3.13Å; D443-L460 WeakPolarHBondContact O-CB 3.13Å; D443-L460 PolarHBondContact O-N 2.98Å
444	L	96	Very high	90	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.026	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	142.3	178.5	84	97.5	0	0	0	111.3	K349 F351 V364 L441 L457 V458 L459	K349-L444 HydrophobicContact CD-CD2 4.15Å; F351-L444 HydrophobicContact CD2-CD1 3.8Å; F351-L444 HydrophobicContact CD2-CD2 4.41Å; F351-L444 HydrophobicContact CD2-CG 4.39Å; F351-L444 HydrophobicContact CE2-CD1 3.46Å; F351-L444 VanDerWaalsContact CE2-CD1 3.46Å; F351-L444 HydrophobicContact CE2-CD2 3.83Å; F351-L444 HydrophobicContact CE2-CG 3.64Å; F351-L444 HydrophobicContact CG-CD1 4.47Å; F351-L444 HydrophobicContact CZ-CD1 3.86Å; F351-L444 HydrophobicContact CZ-CG 4.03Å; V364-L444 HydrophobicContact CG2-CD2 3.41Å; V364-L444 VanDerWaalsContact CG2-CD2 3.41Å; L441-L444 HydrophobicContact CD2-CD2 3.87Å; L444-L457 HydrophobicContact CD1-CD1 3.78Å; L444-V458 CarbonylContact C-O 3.44Å; L444-V458 VanDerWaalsContact CA-O 3.27Å; L444-V458 WeakPolarHBondContact CA-O 3.2Å; L444-L459 HydrophobicContact CB-CD2 3.81Å
445	V	95.3	Very high	90	Very high	21 Å²	21	31.1 Å²	31.1	13%	0.127	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	130.7	-179.1	67.2	0	0	0	0	111.5	V50 L59 V447 V458	V50-V445 HydrophobicContact CB-CG1 4.38Å; V50-V445 HydrophobicContact CG1-CB 3.96Å; V50-V445 HydrophobicContact CG1-CG1 3.66Å; V50-V445 HydrophobicContact CG2-CG1 3.83Å; L59-V445 HydrophobicContact CD1-CG1 4.03Å; V445-V447 HydrophobicContact CG1-CG2 4.46Å; V445-V458 HydrophobicContact CG1-CB 3.96Å; V445-V458 HydrophobicContact CG1-CG1 4.47Å; V445-V458 PolarHBondContact N-O 2.86Å; V445-V458 PolarHBondContact O-N 3.25Å
446	P	94.6	Very high	90.1	Very high	34 Å²	34	31.3 Å²	31.3	22%	0.221	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	141.8	168.4	31.2	-33.5	0	0	0	110.6	L353 V454 L457	L353-P446 HydrophobicContact CD1-CB 4.23Å; L353-P446 HydrophobicContact CD2-CB 3.62Å; L353-P446 HydrophobicContact CD2-CG 3.79Å; P446-V454 HydrophobicContact CB-CG1 3.62Å; P446-V454 HydrophobicContact CB-CG2 4.03Å; P446-L457 HydrophobicContact CB-CD1 4.34Å
447	V	95.2	Very high	90.3	Very high	1 Å²	1	30 Å²	30	1%	0.006	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	128	-179.1	167.9	0	0	0	0	109.6	Y52 V445 V454 Q455 I456 V458 I543	Y52-V447 HydrophobicContact CD1-CB 4.33Å; Y52-V447 HydrophobicContact CD1-CG1 4.45Å; Y52-V447 HydrophobicContact CD1-CG2 4Å; Y52-V447 HydrophobicContact CD2-CG1 4.35Å; Y52-V447 HydrophobicContact CD2-CG2 4.07Å; Y52-V447 HydrophobicContact CE1-CB 4.27Å; Y52-V447 HydrophobicContact CE1-CG1 4.02Å; Y52-V447 HydrophobicContact CE1-CG2 4.39Å; Y52-V447 HydrophobicContact CE2-CG1 3.91Å; Y52-V447 HydrophobicContact CE2-CG2 4.47Å; Y52-V447 HydrophobicContact CG-CG2 3.84Å; V445-V447 HydrophobicContact CG1-CG2 4.46Å; V447-V454 WeakPolarHBondContact O-CG1 3.4Å; V447-Q455 PolarHBondContact O-N 3.48Å; V447-I456 HydrophobicContact CB-CD1 4.1Å; V447-I456 HydrophobicContact CB-CG1 3.57Å; V447-I456 HydrophobicContact CG1-CD1 4.05Å; V447-I456 HydrophobicContact CG1-CG1 3.85Å; V447-I456 HydrophobicContact CG2-CG1 4.38Å; V447-I456 PolarHBondContact N-O 2.86Å; V447-I456 PolarHBondContact O-N 3.38Å; V447-I456 VanDerWaalsContact O-N 3.14Å; V447-V458 HydrophobicContact CG2-CG2 3.91Å; V447-I543 HydrophobicContact CG1-CD1 4.11Å; V447-I543 HydrophobicContact CG1-CG1 3.75Å; V447-I543 HydrophobicContact CG2-CD1 4.45Å
448	G	90	Very high	90.5	Very high	10 Å²	10	29.6 Å²	29.6	10%	0.103	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	-177.2	-178.9	0	0	0	0	0	111.6	Y52	Y52-G448 WeakPolarHBondContact CE1-O 3.35Å; Y52-G448 PolarHBondContact OH-O 2.98Å
449	S	83	Confident	91	Very high	58 Å²	58	28 Å²	28	41%	0.406	17%	0.168	S	C	.	.			trans	-73	148.3	173.9	51.3	0	0	0	0	111.3	D451 G452	S449-D451 PolarHBondContact O-N 2.65Å; S449-G452 PolarHBondContact O-N 2.58Å
450	V	80	Confident	91.2	Very high	71 Å²	71	27.6 Å²	27.6	43%	0.43	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	128.6	170.1	-169	0	0	0	0	110.3	P54 V55 G452	P54-V450 HydrophobicContact CB-CG2 3.82Å; P54-V450 HydrophobicContact CG-CG2 4.09Å; P54-V450 WeakPolarHBondContact O-CG2 3.38Å; V55-V450 HydrophobicContact CG2-CG2 3.67Å; V450-G452 PolarHBondContact O-N 3.25Å
451	D	73.4	Confident	91.3	Very high	140 Å²	140	26.7 Å²	26.7	75%	0.749	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	19.2	180	-50.4	-36.3	0	0	0	116.1	S449	S449-D451 PolarHBondContact O-N 2.65Å
452	G	73.4	Confident	91.3	Very high	8 Å²	8	29 Å²	29	8%	0.082	17%	0.168	C	C	.	.	S	Bend	trans	-116.4	-176.3	179.8	0	0	0	0	0	113.4	S449 V450	S449-G452 PolarHBondContact O-N 2.58Å; V450-G452 PolarHBondContact O-N 3.25Å
453	P	81	Confident	91.2	Very high	41 Å²	41	30.8 Å²	30.8	27%	0.266	17%	0.174	S	C	.	.			trans	-64.6	140.5	177.9	28.1	-35.1	0	0	0	111.2	P354 Q455	P354-P453 CarbonylContact O-C 3.55Å; P354-P453 WeakPolarHBondContact O-CA 3.45Å; P453-Q455 PolarHBondContact O-N 3.2Å
454	V	89.6	Confident	91.2	Very high	14 Å²	14	30 Å²	30	9%	0.085	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	129	171.3	-176.2	0	0	0	0	108.3	L353 P354 P446 V447 I456 L470	L353-V454 HydrophobicContact CB-CB 4.36Å; L353-V454 HydrophobicContact CB-CG2 3.94Å; L353-V454 HydrophobicContact CD1-CG1 4.42Å; L353-V454 HydrophobicContact CD2-CG2 4.3Å; P354-V454 HydrophobicContact CG-CG2 4.2Å; P354-V454 PolarHBondContact O-N 2.67Å; P446-V454 HydrophobicContact CB-CG1 3.62Å; P446-V454 HydrophobicContact CB-CG2 4.03Å; V447-V454 WeakPolarHBondContact O-CG1 3.4Å; V454-I456 VanDerWaalsContact CG1-O 3.29Å; V454-I456 WeakPolarHBondContact CG1-O 3.49Å; V454-L470 HydrophobicContact CB-CD1 4.42Å; V454-L470 HydrophobicContact CG1-CD1 3.85Å
455	Q	93.3	Very high	91.2	Very high	63 Å²	63	30.1 Å²	30.1	29%	0.294	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-42.4	-177.6	-60.1	-177.2	18	0	0	110.5	V447 P453 L470 I471	V447-Q455 PolarHBondContact O-N 3.48Å; P453-Q455 PolarHBondContact O-N 3.2Å; Q455-L470 PolarHBondContact O-N 3.44Å; Q455-I471 HydrophobicContact CB-CD1 3.86Å; Q455-I471 HydrophobicContact CB-CG1 4.38Å; Q455-I471 HydrophobicContact CG-CD1 4.04Å
456	I	95.9	Very high	91.2	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	156.1	-174.4	72.8	169.5	0	0	0	111.1	V447 V454 V458 V467 I468 M478 W541 P542	V447-I456 HydrophobicContact CB-CD1 4.1Å; V447-I456 HydrophobicContact CB-CG1 3.57Å; V447-I456 HydrophobicContact CG1-CD1 4.05Å; V447-I456 HydrophobicContact CG1-CG1 3.85Å; V447-I456 HydrophobicContact CG2-CG1 4.38Å; V447-I456 PolarHBondContact N-O 2.86Å; V447-I456 PolarHBondContact O-N 3.38Å; V447-I456 VanDerWaalsContact O-N 3.14Å; V454-I456 VanDerWaalsContact CG1-O 3.29Å; V454-I456 WeakPolarHBondContact CG1-O 3.49Å; I456-V458 HydrophobicContact CD1-CG2 4.13Å; I456-V467 HydrophobicContact CB-CG1 4.35Å; I456-V467 HydrophobicContact CD1-CG1 3.71Å; I456-V467 HydrophobicContact CG1-CG1 4.4Å; I456-I468 CarbonylContact C-O 3.58Å; I456-I468 WeakPolarHBondContact CA-O 3.45Å; I456-I468 VanDerWaalsContact CB-O 3.27Å; I456-I468 WeakPolarHBondContact CB-O 3.49Å; I456-M478 HydrophobicContact CB-CE 4.04Å; I456-M478 HydrophobicContact CD1-CE 3.62Å; I456-M478 HydrophobicContact CG1-CE 4.38Å; I456-M478 HydrophobicContact CG2-CE 3.46Å; I456-M478 VanDerWaalsContact CG2-CE 3.46Å; I456-M478 HydrophobicContact CG2-SD 3.9Å; I456-W541 HydrophobicContact CD1-CH2 4.4Å; I456-W541 HydrophobicContact CD1-CZ3 4.46Å; I456-P542 HydrophobicContact CD1-CG 3.53Å; I456-P542 HydrophobicContact CG1-CG 3.96Å; I456-P542 HydrophobicContact CG2-CG 3.79Å
457	L	96.8	Very high	91.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.3	169.6	-168.5	64.6	0	0	0	109.8	L353 V362 I380 L444 P446 L459 V467 I468 L470	L353-L457 HydrophobicContact CD1-CD1 4.14Å; V362-L457 HydrophobicContact CG1-CD2 3.93Å; V362-L457 HydrophobicContact CG2-CD2 4.27Å; I380-L457 HydrophobicContact CD1-CD2 3.92Å; L444-L457 HydrophobicContact CD1-CD1 3.78Å; P446-L457 HydrophobicContact CB-CD1 4.34Å; L457-L459 HydrophobicContact CD2-CD2 3.84Å; L457-L459 HydrophobicContact CG-CD2 3.95Å; L457-V467 WeakPolarHBondContact O-CA 3.46Å; L457-I468 HydrophobicContact CB-CB 4.32Å; L457-I468 HydrophobicContact CB-CD1 4.35Å; L457-I468 HydrophobicContact CD2-CD1 4.21Å; L457-I468 PolarHBondContact N-O 3.44Å; L457-I468 PolarHBondContact O-N 3.11Å; L457-L470 HydrophobicContact CB-CD1 4.02Å; L457-L470 HydrophobicContact CB-CG 4.33Å
458	V	97.8	Very high	91.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.3	174.8	179.6	0	0	0	0	108.9	L444 V445 V447 I456 M465 V467	L444-V458 CarbonylContact C-O 3.44Å; L444-V458 VanDerWaalsContact CA-O 3.27Å; L444-V458 WeakPolarHBondContact CA-O 3.2Å; V445-V458 HydrophobicContact CG1-CB 3.96Å; V445-V458 HydrophobicContact CG1-CG1 4.47Å; V445-V458 PolarHBondContact N-O 2.86Å; V445-V458 PolarHBondContact O-N 3.25Å; V447-V458 HydrophobicContact CG2-CG2 3.91Å; I456-V458 HydrophobicContact CD1-CG2 4.13Å; V458-M465 HydrophobicContact CG1-CG 3.7Å; V458-M465 HydrophobicContact CG1-SD 3.65Å; V458-V467 HydrophobicContact CG2-CG1 4.33Å; V458-V467 HydrophobicContact CG2-CG2 4.5Å
459	L	97.7	Very high	91.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	111.9	173.3	-53.2	-174.8	0	0	0	108.8	V378 L435 L437 L441 L444 L457 M465 V466 I468	V378-L459 HydrophobicContact CB-CD1 4.27Å; V378-L459 HydrophobicContact CG1-CD1 4.46Å; V378-L459 HydrophobicContact CG1-CD2 4.23Å; V378-L459 HydrophobicContact CG2-CD1 4.06Å; V378-L459 HydrophobicContact CG2-CD2 4.27Å; L435-L459 HydrophobicContact CD1-CD1 4.07Å; L437-L459 HydrophobicContact CD1-CD1 4.47Å; L437-L459 HydrophobicContact CD2-CD1 4Å; L441-L459 HydrophobicContact CD1-CB 3.82Å; L441-L459 HydrophobicContact CD1-CD2 4.33Å; L444-L459 HydrophobicContact CB-CD2 3.81Å; L457-L459 HydrophobicContact CD2-CD2 3.84Å; L457-L459 HydrophobicContact CG-CD2 3.95Å; L459-M465 WeakPolarHBondContact O-CA 3.47Å; L459-V466 HydrophobicContact CB-CB 4.23Å; L459-V466 PolarHBondContact N-O 3.35Å; L459-V466 PolarHBondContact O-N 2.98Å; L459-I468 HydrophobicContact CD1-CD1 3.67Å; L459-I468 HydrophobicContact CG-CD1 3.94Å
460	L	98	Very high	91.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	108.9	174.5	-179.7	64.9	0	0	0	108.3	F43 P47 V50 V61 V442 D443	F43-L460 HydrophobicContact CE2-CD1 3.86Å; F43-L460 HydrophobicContact CZ-CD1 3.72Å; P47-L460 HydrophobicContact CB-CD1 3.79Å; P47-L460 HydrophobicContact CB-CD2 3.91Å; P47-L460 HydrophobicContact CB-CG 3.97Å; P47-L460 HydrophobicContact CG-CD1 4.22Å; P47-L460 HydrophobicContact CG-CG 4.41Å; V50-L460 HydrophobicContact CB-CB 4.36Å; V50-L460 HydrophobicContact CB-CD2 3.77Å; V50-L460 HydrophobicContact CG1-CB 4.21Å; V50-L460 HydrophobicContact CG1-CD2 4.32Å; V61-L460 HydrophobicContact CG1-CD1 4.44Å; V61-L460 HydrophobicContact CG1-CD2 4.38Å; V442-L460 WeakPolarHBondContact CA-O 3.33Å; V442-L460 HydrophobicContact CB-CG 4.46Å; V442-L460 WeakPolarHBondContact CB-O 3.31Å; V442-L460 HydrophobicContact CG1-CD2 4.49Å; V442-L460 PolarHBondContact N-O 2.92Å; D443-L460 HydrophobicContact CB-CB 4.42Å; D443-L460 HydrophobicContact CB-CD2 4.26Å; D443-L460 PolarHBondContact N-O 2.81Å; D443-L460 VanDerWaalsContact N-O 3.08Å; D443-L460 WeakPolarHBondContact O-CA 3.13Å; D443-L460 WeakPolarHBondContact O-CB 3.13Å; D443-L460 PolarHBondContact O-N 2.98Å
461	C	97.3	Very high	92.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	172.5	176.5	-51.4	0	0	0	0	110.4	F43 P47 S439 S440 E463 E464	F43-C461 WeakPolarHBondContact CZ-O 3.24Å; P47-C461 VanDerWaalsContact CG-O 3.3Å; P47-C461 WeakPolarHBondContact CG-O 3.16Å; S439-C461 VanDerWaalsContact OG-CB 3.31Å; S439-C461 WeakPolarHBondContact OG-CB 3.38Å; S440-C461 CarbonylContact O-C 3.49Å; S440-C461 VanDerWaalsContact O-CA 3.26Å; S440-C461 WeakPolarHBondContact O-CA 3.35Å; C461-E463 VanDerWaalsContact C-N 3.25Å; C461-E463 PolarHBondContact O-N 3.12Å; C461-E464 WeakPolarHBondContact CA-O 3.19Å; C461-E464 WeakPolarHBondContact CB-O 3.34Å; C461-E464 PolarHBondContact N-O 2.77Å
462	E	96.1	Very high	93	Very high	84 Å²	84	20.5 Å²	20.5	39%	0.393	11%	0.108	S	C	.	.	S	Bend	trans	-61.9	-32.6	180	-75.3	179.5	133.1	0	0	113	S440 V442	S440-E462 WeakPolarHBondContact CB-OE2 3.32Å; S440-E462 PolarHBondContact O-N 3.15Å; S440-E462 PolarHBondContact OG-OE2 3.37Å; V442-E462 HydrophobicContact CG2-CB 4.41Å; V442-E462 HydrophobicContact CG2-CG 3.64Å
463	E	95	Very high	93.4	Very high	70 Å²	70	24 Å²	24	33%	0.327	13%	0.131	S	C	.	.	S	Bend	trans	-118.9	-11	-172.7	-62	-65.3	165.7	0	0	114.6	F43 S439 C461 H487 F631	F43-E463 VanDerWaalsContact CD1-C 3.48Å; F43-E463 VanDerWaalsContact CD1-O 3.28Å; F43-E463 WeakPolarHBondContact CD1-O 3.47Å; S439-E463 PolarHBondContact OG-N 3.14Å; C461-E463 VanDerWaalsContact C-N 3.25Å; C461-E463 PolarHBondContact O-N 3.12Å; E463-H487 PolarHBondContact O-CE1 2.6Å; E463-H487 PolarHBondContact O-NE2 2.75Å; E463-H487 IonicContact OE2-CD2 2.8Å; E463-H487 IonicContact OE2-CE1 3.66Å; E463-H487 IonicContact OE2-NE2 3.87Å; E463-H487 PolarHBondContact OE2-NE2 3.11Å; E463-F631 HydrophobicContact CB-CD1 3.77Å; E463-F631 HydrophobicContact CB-CD2 3.95Å; E463-F631 HydrophobicContact CB-CE1 3.81Å; E463-F631 HydrophobicContact CB-CE2 4.01Å; E463-F631 HydrophobicContact CB-CG 3.83Å; E463-F631 HydrophobicContact CB-CZ 3.95Å; E463-F631 HydrophobicContact CG-CD1 4.19Å; E463-F631 HydrophobicContact CG-CE1 3.71Å; E463-F631 HydrophobicContact CG-CE2 4.19Å; E463-F631 HydrophobicContact CG-CZ 3.72Å
464	E	95.5	Very high	93.5	Very high	6 Å²	6	22.8 Å²	22.8	3%	0.028	13%	0.126	C	C	.	.			trans	-156.2	168.3	176.3	68	177.2	134.4	0	0	114.2	F43 P438 C461 V466 C485 G629 V630 F631	F43-E464 VanDerWaalsContact CE2-C 3.45Å; F43-E464 VanDerWaalsContact CZ-C 3.5Å; P438-E464 VanDerWaalsContact CG-OE1 3.31Å; P438-E464 WeakPolarHBondContact CG-OE1 3.38Å; C461-E464 WeakPolarHBondContact CA-O 3.19Å; C461-E464 WeakPolarHBondContact CB-O 3.34Å; C461-E464 PolarHBondContact N-O 2.77Å; E464-V466 HydrophobicContact CG-CG2 3.89Å; E464-C485 HydrophobicContact CB-CB 3.89Å; E464-G629 WeakPolarHBondContact OE1-CA 3.37Å; E464-V630 PolarHBondContact OE1-N 2.92Å; E464-V630 VanDerWaalsContact OE2-CG2 3.29Å; E464-V630 WeakPolarHBondContact OE2-CG2 3.17Å; E464-V630 PolarHBondContact OE2-N 2.77Å; E464-F631 HydrophobicContact CG-CB 4.21Å; E464-F631 WeakPolarHBondContact OE1-CB 3.38Å; E464-F631 PolarHBondContact OE1-N 2.72Å
465	M	95.9	Very high	93.5	Very high	8 Å²	8	22.2 Å²	22.2	4%	0.039	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	108.8	168	-173	174.2	74.6	0	0	109.7	F43 L59 V458 L459 V467 P480 L483 W541	F43-M465 HydrophobicContact CD2-CB 4.42Å; F43-M465 HydrophobicContact CE2-CB 3.95Å; L59-M465 HydrophobicContact CD2-SD 4.07Å; V458-M465 HydrophobicContact CG1-CG 3.7Å; V458-M465 HydrophobicContact CG1-SD 3.65Å; L459-M465 WeakPolarHBondContact O-CA 3.47Å; M465-V467 HydrophobicContact CE-CG2 4.01Å; M465-V467 HydrophobicContact CG-CG2 4.07Å; M465-P480 HydrophobicContact CE-CB 3.3Å; M465-P480 HydrophobicContact CE-CG 3.97Å; M465-L483 HydrophobicContact CE-CB 3.9Å; M465-L483 HydrophobicContact CE-CD1 4.08Å; M465-L483 HydrophobicContact SD-CB 4.3Å; M465-L483 HydrophobicContact SD-CD1 3.76Å; M465-W541 HydrophobicContact CE-CH2 4.27Å
466	V	95.4	Very high	93.3	Very high	5 Å²	5	19.4 Å²	19.4	3%	0.03	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	133.1	174.4	-173.8	0	0	0	0	108.5	L437 L459 E464 F477 A628	L437-V466 HydrophobicContact CD2-CG2 4.27Å; L459-V466 HydrophobicContact CB-CB 4.23Å; L459-V466 PolarHBondContact N-O 3.35Å; L459-V466 PolarHBondContact O-N 2.98Å; E464-V466 HydrophobicContact CG-CG2 3.89Å; V466-F477 HydrophobicContact CG1-CD1 3.76Å; V466-F477 HydrophobicContact CG1-CE1 3.84Å; V466-A628 HydrophobicContact CG1-CB 4.45Å
467	V	96.3	Very high	93.1	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.012	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135	-177.6	-171.4	0	0	0	0	109.6	I456 L457 V458 M465 F477 M478 P480 W541	I456-V467 HydrophobicContact CB-CG1 4.35Å; I456-V467 HydrophobicContact CD1-CG1 3.71Å; I456-V467 HydrophobicContact CG1-CG1 4.4Å; L457-V467 WeakPolarHBondContact O-CA 3.46Å; V458-V467 HydrophobicContact CG2-CG1 4.33Å; V458-V467 HydrophobicContact CG2-CG2 4.5Å; M465-V467 HydrophobicContact CE-CG2 4.01Å; M465-V467 HydrophobicContact CG-CG2 4.07Å; V467-F477 CarbonylContact O-C 3.54Å; V467-F477 VanDerWaalsContact O-CA 3.31Å; V467-F477 WeakPolarHBondContact O-CA 3.34Å; V467-M478 HydrophobicContact CB-CB 4.22Å; V467-M478 HydrophobicContact CG1-CB 4.11Å; V467-M478 HydrophobicContact CG1-CE 3.56Å; V467-M478 PolarHBondContact O-N 2.91Å; V467-P480 HydrophobicContact CG2-CB 4.16Å; V467-P480 HydrophobicContact CG2-CG 4.49Å; V467-W541 HydrophobicContact CB-CZ3 4.34Å; V467-W541 HydrophobicContact CG1-CH2 4.2Å; V467-W541 HydrophobicContact CG1-CZ3 3.9Å; V467-W541 HydrophobicContact CG2-CH2 4.03Å; V467-W541 HydrophobicContact CG2-CZ3 4.15Å
468	I	95.1	Very high	92.8	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.8	-172.3	-59.1	145.1	0	0	0	108.9	I380 L435 I456 L457 L459 L470 W475 F477	I380-I468 HydrophobicContact CD1-CD1 3.95Å; I380-I468 HydrophobicContact CD1-CG2 4.49Å; L435-I468 HydrophobicContact CD1-CD1 3.39Å; L435-I468 HydrophobicContact CD1-CG1 4.25Å; I456-I468 CarbonylContact C-O 3.58Å; I456-I468 WeakPolarHBondContact CA-O 3.45Å; I456-I468 VanDerWaalsContact CB-O 3.27Å; I456-I468 WeakPolarHBondContact CB-O 3.49Å; L457-I468 HydrophobicContact CB-CB 4.32Å; L457-I468 HydrophobicContact CB-CD1 4.35Å; L457-I468 HydrophobicContact CD2-CD1 4.21Å; L457-I468 PolarHBondContact N-O 3.44Å; L457-I468 PolarHBondContact O-N 3.11Å; L459-I468 HydrophobicContact CD1-CD1 3.67Å; L459-I468 HydrophobicContact CG-CD1 3.94Å; I468-L470 HydrophobicContact CG2-CD2 4.08Å; I468-W475 HydrophobicContact CG2-CB 3.7Å; I468-F477 HydrophobicContact CG1-CD1 3.92Å; I468-F477 HydrophobicContact CG1-CE1 4.01Å
469	D	93.4	Very high	92.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.9	169.7	179.9	-9.8	0	0	0	109.4	I471 T472 W475 P476 M478 S537 L539	D469-I471 WeakPolarHBondContact OD1-CA 3.33Å; D469-I471 WeakPolarHBondContact OD1-CB 3.03Å; D469-I471 PolarHBondContact OD1-N 2.88Å; D469-T472 PolarHBondContact OD1-N 2.76Å; D469-T472 VanDerWaalsContact OD2-CB 3.22Å; D469-T472 WeakPolarHBondContact OD2-CB 3.49Å; D469-T472 PolarHBondContact OD2-OG1 2.92Å; D469-W475 WeakPolarHBondContact O-CA 3.02Å; D469-W475 WeakPolarHBondContact O-CB 3.45Å; D469-P476 HydrophobicContact CB-CG 4.13Å; D469-P476 WeakPolarHBondContact CB-O 3.09Å; D469-P476 PolarHBondContact N-O 2.62Å; D469-M478 HydrophobicContact CB-CG 4Å; D469-M478 HydrophobicContact CB-SD 4.44Å; D469-S537 WeakPolarHBondContact OD2-CB 3.24Å; D469-S537 PolarHBondContact OD2-OG 3.5Å; D469-L539 VanDerWaalsContact OD2-CD1 3.32Å; D469-L539 WeakPolarHBondContact OD2-CD1 3.49Å
470	L	91.9	Very high	92.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-101.3	-5.1	177.4	-63.7	-179.6	0	0	0	113	L353 I360 I380 R382 V454 Q455 L457 I468 W475	L353-L470 HydrophobicContact CD1-CD1 3.84Å; I360-L470 HydrophobicContact CD1-CB 3.98Å; I360-L470 HydrophobicContact CD1-CD1 4.07Å; I360-L470 HydrophobicContact CD1-CD2 4.23Å; I360-L470 HydrophobicContact CD1-CG 4.33Å; I380-L470 HydrophobicContact CG2-CD2 4.47Å; R382-L470 PolarHBondContact NH2-O 3.46Å; V454-L470 HydrophobicContact CB-CD1 4.42Å; V454-L470 HydrophobicContact CG1-CD1 3.85Å; Q455-L470 PolarHBondContact O-N 3.44Å; L457-L470 HydrophobicContact CB-CD1 4.02Å; L457-L470 HydrophobicContact CB-CG 4.33Å; I468-L470 HydrophobicContact CG2-CD2 4.08Å; L470-W475 HydrophobicContact CD2-CG 4.29Å
471	I	88.7	Confident	91.8	Very high	90 Å²	90	25.4 Å²	25.4	46%	0.462	14%	0.136	S	C	.	.	S	Bend	trans	-82.7	-47.3	176.6	-60.9	167.6	0	0	0	109.5	Q455 D469 L539	Q455-I471 HydrophobicContact CB-CD1 3.86Å; Q455-I471 HydrophobicContact CB-CG1 4.38Å; Q455-I471 HydrophobicContact CG-CD1 4.04Å; D469-I471 WeakPolarHBondContact OD1-CA 3.33Å; D469-I471 WeakPolarHBondContact OD1-CB 3.03Å; D469-I471 PolarHBondContact OD1-N 2.88Å; I471-L539 HydrophobicContact CB-CD1 3.95Å; I471-L539 HydrophobicContact CD1-CD1 3.97Å; I471-L539 HydrophobicContact CG2-CD1 4.21Å
472	T	88.2	Confident	91.6	Very high	36 Å²	36	25.4 Å²	25.4	22%	0.221	14%	0.136	C	C	.	.	S	Bend	trans	-76.6	132.3	180	-52.7	0	0	0	0	110.6	D469 W475 P476 A526	D469-T472 PolarHBondContact OD1-N 2.76Å; D469-T472 VanDerWaalsContact OD2-CB 3.22Å; D469-T472 WeakPolarHBondContact OD2-CB 3.49Å; D469-T472 PolarHBondContact OD2-OG1 2.92Å; T472-W475 PolarHBondContact O-N 3.1Å; T472-W475 VanDerWaalsContact O-N 3.16Å; T472-P476 HydrophobicContact CG2-CG 3.94Å; T472-A526 HydrophobicContact CG2-CB 3.96Å
473	S	82.7	Confident	91.6	Very high	81 Å²	81	21.4 Å²	21.4	57%	0.566	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	150.2	174.9	-177.9	0	0	0	0	111.5	E431 W475	E431-S473 WeakPolarHBondContact OE1-CA 3.14Å; E431-S473 VanDerWaalsContact OE1-CB 3.3Å; E431-S473 WeakPolarHBondContact OE1-CB 3.32Å; E431-S473 PolarHBondContact OE1-OG 2.93Å; S473-W475 PolarHBondContact O-N 3.22Å
474	G	83.3	Confident	91.6	Very high	16 Å²	16	19 Å²	19	17%	0.165	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	-0.4	-169.3	0	0	0	0	0	114.4	E431 R626	E431-G474 PolarHBondContact OE1-N 2.84Å; G474-R626 PolarHBondContact O-NH1 2.9Å
475	W	89.5	Confident	91.5	Very high	1 Å²	1	19.1 Å²	19.1	0%	0.004	11%	0.108	C	C	.	.			trans	45.2	64.4	175.5	-46.8	-38.2	0	0	0	115.2	I380 R382 E431 V433 I468 D469 L470 T472 S473 R626	I380-W475 HydrophobicContact CB-CE3 3.89Å; I380-W475 HydrophobicContact CB-CH2 4.13Å; I380-W475 HydrophobicContact CB-CZ3 3.56Å; I380-W475 HydrophobicContact CG2-CD2 4.01Å; I380-W475 HydrophobicContact CG2-CE3 3.62Å; I380-W475 HydrophobicContact CG2-CH2 3.6Å; I380-W475 HydrophobicContact CG2-CZ2 3.98Å; I380-W475 HydrophobicContact CG2-CZ3 3.42Å; I380-W475 VanDerWaalsContact CG2-CZ3 3.42Å; I380-W475 WeakPolarHBondContact O-CH2 3.44Å; I380-W475 WeakPolarHBondContact O-CZ3 3.15Å; R382-W475 HydrophobicContact CB-CZ2 3.89Å; E431-W475 HydrophobicContact CB-CH2 3.65Å; E431-W475 HydrophobicContact CB-CZ2 3.49Å; E431-W475 VanDerWaalsContact CB-CZ2 3.49Å; E431-W475 HydrophobicContact CG-CZ2 4.45Å; E431-W475 VanDerWaalsContact O-CH2 3.3Å; E431-W475 WeakPolarHBondContact O-CH2 3.32Å; E431-W475 PolarHBondContact OE2-NE1 3.24Å; V433-W475 HydrophobicContact CB-CE3 4.18Å; V433-W475 HydrophobicContact CB-CZ3 3.97Å; V433-W475 HydrophobicContact CG2-CE3 3.96Å; V433-W475 HydrophobicContact CG2-CZ3 3.88Å; I468-W475 HydrophobicContact CG2-CB 3.7Å; D469-W475 WeakPolarHBondContact O-CA 3.02Å; D469-W475 WeakPolarHBondContact O-CB 3.45Å; L470-W475 HydrophobicContact CD2-CG 4.29Å; T472-W475 PolarHBondContact O-N 3.1Å; T472-W475 VanDerWaalsContact O-N 3.16Å; S473-W475 PolarHBondContact O-N 3.22Å; W475-R626 PolarHBondContact O-NH2 3.41Å
476	P	89.6	Confident	91.4	Very high	5 Å²	5	18.7 Å²	18.7	3%	0.032	11%	0.107	C	C	.	.			trans	-65.4	156.4	-179.8	28.4	-34.8	0	0	0	112.3	D469 T472 A526 G535	D469-P476 HydrophobicContact CB-CG 4.13Å; D469-P476 WeakPolarHBondContact CB-O 3.09Å; D469-P476 PolarHBondContact N-O 2.62Å; T472-P476 HydrophobicContact CG2-CG 3.94Å; P476-A526 HydrophobicContact CG-CB 4.23Å; P476-G535 CarbonylContact C-O 3.44Å; P476-G535 WeakPolarHBondContact CA-O 3.2Å; P476-G535 WeakPolarHBondContact CB-O 3.33Å
477	F	90.8	Very high	91.3	Very high	5 Å²	5	18.9 Å²	18.9	2%	0.022	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	149	176.8	-59.9	-64.8	0	0	0	111.3	L435 V466 V467 I468 F521 G535 W536 S537 A628	L435-F477 HydrophobicContact CD2-CE1 4.25Å; L435-F477 HydrophobicContact CD2-CZ 4.08Å; V466-F477 HydrophobicContact CG1-CD1 3.76Å; V466-F477 HydrophobicContact CG1-CE1 3.84Å; V467-F477 CarbonylContact O-C 3.54Å; V467-F477 VanDerWaalsContact O-CA 3.31Å; V467-F477 WeakPolarHBondContact O-CA 3.34Å; I468-F477 HydrophobicContact CG1-CD1 3.92Å; I468-F477 HydrophobicContact CG1-CE1 4.01Å; F477-F521 HydrophobicContact CD2-CE1 4.08Å; F477-F521 HydrophobicContact CD2-CZ 4.28Å; F477-F521 AromaticContact CE2-CE1 3.9Å; F477-F521 HydrophobicContact CE2-CE1 3.9Å; F477-F521 HydrophobicContact CE2-CZ 4.22Å; F477-G535 PolarHBondContact N-O 3.44Å; F477-W536 HydrophobicContact CB-CE3 4.03Å; F477-W536 HydrophobicContact CB-CZ3 3.98Å; F477-W536 CarbonylContact O-C 3.57Å; F477-W536 WeakPolarHBondContact O-CA 3.17Å; F477-S537 PolarHBondContact O-N 2.93Å; F477-A628 HydrophobicContact CE1-CB 3.78Å; F477-A628 HydrophobicContact CZ-CB 3.52Å
478	M	90.9	Very high	91	Very high	10 Å²	10	19.2 Å²	19.2	5%	0.049	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.8	172.3	-60.6	-152.2	-49.1	0	0	111.2	I456 V467 D469 P480 W541 P542	I456-M478 HydrophobicContact CB-CE 4.04Å; I456-M478 HydrophobicContact CD1-CE 3.62Å; I456-M478 HydrophobicContact CG1-CE 4.38Å; I456-M478 HydrophobicContact CG2-CE 3.46Å; I456-M478 VanDerWaalsContact CG2-CE 3.46Å; I456-M478 HydrophobicContact CG2-SD 3.9Å; V467-M478 HydrophobicContact CB-CB 4.22Å; V467-M478 HydrophobicContact CG1-CB 4.11Å; V467-M478 HydrophobicContact CG1-CE 3.56Å; V467-M478 PolarHBondContact O-N 2.91Å; D469-M478 HydrophobicContact CB-CG 4Å; D469-M478 HydrophobicContact CB-SD 4.44Å; M478-P480 WeakPolarHBondContact O-CD 3.34Å; M478-W541 HydrophobicContact CE-CE3 3.6Å; M478-W541 HydrophobicContact CE-CZ3 3.61Å; M478-P542 HydrophobicContact CE-CG 4.37Å
479	R	88.5	Confident	90.7	Very high	89 Å²	89	19.6 Å²	19.6	34%	0.336	11%	0.111	S	C	.	.			trans	-80.8	116.3	171.1	-68.1	178.3	177.4	78.7	9.7	109.9	E518 W536	R479-E518 WeakPolarHBondContact CD-OE1 3.27Å; R479-E518 IonicContact CZ-OE1 3.7Å; R479-E518 IonicContact NE-OE1 3.97Å; R479-E518 PolarHBondContact NE-OE1 3.32Å; R479-E518 IonicContact NH2-OE1 2.75Å; R479-W536 HydrophobicContact CG-CD2 4.35Å; R479-W536 HydrophobicContact CG-CE3 3.67Å; R479-W536 HydrophobicContact CG-CH2 4.11Å; R479-W536 HydrophobicContact CG-CZ3 3.55Å; R479-W536 VanDerWaalsContact CZ-CD2 3.45Å; R479-W536 VanDerWaalsContact NH1-CG 3.29Å; R479-W536 VanDerWaalsContact NH2-CD2 3.34Å; R479-W536 VanDerWaalsContact NH2-CG 3.32Å
480	P	92.5	Very high	90.7	Very high	15 Å²	15	22.6 Å²	22.6	10%	0.097	13%	0.132	C	C	.	.			trans	-74.5	129.2	175.3	33.5	-35.7	0	0	0	109.6	M465 V467 M478 Y482 T484 W541	M465-P480 HydrophobicContact CE-CB 3.3Å; M465-P480 HydrophobicContact CE-CG 3.97Å; V467-P480 HydrophobicContact CG2-CB 4.16Å; V467-P480 HydrophobicContact CG2-CG 4.49Å; M478-P480 WeakPolarHBondContact O-CD 3.34Å; P480-Y482 CarbonylContact C-O 3.59Å; P480-Y482 WeakPolarHBondContact CB-O 3.42Å; P480-Y482 PolarHBondContact O-N 3.23Å; P480-T484 PolarHBondContact O-OG1 2.77Å; P480-T484 VanDerWaalsContact O-OG1 3.12Å; P480-W541 HydrophobicContact CB-CH2 3.92Å; P480-W541 HydrophobicContact CB-CZ3 3.99Å
481	P	91.9	Very high	90.7	Very high	10 Å²	10	23.8 Å²	23.8	7%	0.065	14%	0.139	C	C	.	.	S	Bend	trans	-73.5	-16.1	-175.2	28.1	-33.2	0	0	0	112.8	P74 W541 I564 C590 L591	P74-P481 HydrophobicContact CB-CB 4.16Å; P74-P481 HydrophobicContact CB-CG 4.22Å; P74-P481 HydrophobicContact CG-CB 3.97Å; P74-P481 HydrophobicContact CG-CG 3.57Å; P481-W541 HydrophobicContact CG-CB 4.33Å; P481-W541 HydrophobicContact CG-CD2 3.8Å; P481-W541 HydrophobicContact CG-CE3 4.43Å; P481-W541 HydrophobicContact CG-CG 3.72Å; P481-I564 HydrophobicContact CB-CD1 3.9Å; P481-C590 CarbonylContact O-C 3.22Å; P481-C590 WeakPolarHBondContact O-CA 3.34Å; P481-C590 WeakPolarHBondContact O-CB 3.32Å; P481-L591 PolarHBondContact O-N 2.85Å
482	Y	93.2	Very high	91	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-132	170.2	171.5	39.4	-112.4	0	0	0	108.3	L59 Y71 G72 P480 T484 W541	L59-Y482 HydrophobicContact CD2-CE2 4.46Å; Y71-Y482 VanDerWaalsContact CB-CE2 3.49Å; Y71-Y482 VanDerWaalsContact CB-CZ 3.42Å; Y71-Y482 AromaticContact CD1-CD1 3.81Å; Y71-Y482 HydrophobicContact CD1-CD1 3.81Å; Y71-Y482 AromaticContact CD1-CD2 3.83Å; Y71-Y482 HydrophobicContact CD1-CD2 3.83Å; Y71-Y482 HydrophobicContact CD1-CE1 4.37Å; Y71-Y482 HydrophobicContact CD1-CE2 4.38Å; Y71-Y482 AromaticContact CD1-CG 3.51Å; Y71-Y482 HydrophobicContact CD1-CG 3.51Å; Y71-Y482 HydrophobicContact CD2-CD2 4.18Å; Y71-Y482 HydrophobicContact CD2-CE2 4.41Å; Y71-Y482 HydrophobicContact CE1-CD2 4.44Å; Y71-Y482 HydrophobicContact CE1-CG 4.07Å; Y71-Y482 HydrophobicContact CG-CD1 4.2Å; Y71-Y482 AromaticContact CG-CD2 3.68Å; Y71-Y482 HydrophobicContact CG-CD2 3.68Å; Y71-Y482 HydrophobicContact CG-CE1 4.37Å; Y71-Y482 AromaticContact CG-CE2 3.87Å; Y71-Y482 HydrophobicContact CG-CE2 3.87Å; Y71-Y482 AromaticContact CG-CG 3.85Å; Y71-Y482 HydrophobicContact CG-CG 3.85Å; G72-Y482 VanDerWaalsContact O-CE1 3.25Å; G72-Y482 WeakPolarHBondContact O-CE1 3.44Å; G72-Y482 PolarHBondContact O-OH 3.19Å; P480-Y482 CarbonylContact C-O 3.59Å; P480-Y482 WeakPolarHBondContact CB-O 3.42Å; P480-Y482 PolarHBondContact O-N 3.23Å; Y482-T484 PolarHBondContact O-N 2.77Å; Y482-T484 VanDerWaalsContact O-N 3.15Å; Y482-W541 AromaticContact CE1-NE1 3.95Å; Y482-W541 AromaticContact CE2-CZ2 3.81Å; Y482-W541 HydrophobicContact CE2-CZ2 3.81Å; Y482-W541 AromaticContact CZ-CE2 3.93Å; Y482-W541 AromaticContact CZ-CZ2 3.91Å; Y482-W541 AromaticContact CZ-NE1 3.48Å; Y482-W541 PolarHBondContact OH-NE1 2.9Å
483	L	95.3	Very high	91.3	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	13%	0.128	C	C	.	.	S	Bend	trans	57.1	24.3	-175.6	-62.3	169.5	0	0	0	113.8	F43 P44 L59 V61 Y71 M465	F43-L483 HydrophobicContact CD2-CB 4.27Å; F43-L483 WeakPolarHBondContact CD2-O 3.22Å; P44-L483 HydrophobicContact CG-CD2 4.13Å; L59-L483 HydrophobicContact CD2-CD1 4.45Å; V61-L483 HydrophobicContact CG2-CD1 3.7Å; Y71-L483 HydrophobicContact CD2-CD1 3.89Å; Y71-L483 HydrophobicContact CD2-CG 4.2Å; Y71-L483 HydrophobicContact CE2-CD1 3.63Å; Y71-L483 HydrophobicContact CE2-CD2 3.71Å; Y71-L483 HydrophobicContact CE2-CG 3.57Å; M465-L483 HydrophobicContact CE-CB 3.9Å; M465-L483 HydrophobicContact CE-CD1 4.08Å; M465-L483 HydrophobicContact SD-CB 4.3Å; M465-L483 HydrophobicContact SD-CD1 3.76Å
484	T	94	Very high	91.9	Very high	20 Å²	20	18.8 Å²	18.8	12%	0.123	11%	0.106	C	C	.	.			trans	-66.8	138.1	-179	-36.6	0	0	0	0	110.8	G42 F43 P480 Y482 L486 W583	G42-T484 CarbonylContact C-O 3.56Å; G42-T484 WeakPolarHBondContact CA-O 3.28Å; F43-T484 PolarHBondContact N-O 3.42Å; P480-T484 PolarHBondContact O-OG1 2.77Å; P480-T484 VanDerWaalsContact O-OG1 3.12Å; Y482-T484 PolarHBondContact O-N 2.77Å; Y482-T484 VanDerWaalsContact O-N 3.15Å; T484-L486 PolarHBondContact O-N 2.92Å; T484-W583 HydrophobicContact CG2-CH2 4.28Å; T484-W583 HydrophobicContact CG2-CZ3 3.75Å
485	C	94	Very high	92.4	Very high	7 Å²	7	18.7 Å²	18.7	5%	0.047	10%	0.102	C	C	.	.			trans	-66.8	102.6	174.6	-171.6	0	0	0	0	110	E464 T488 V630	E464-C485 HydrophobicContact CB-CB 3.89Å; C485-T488 HydrophobicContact CB-CG2 4.43Å; C485-V630 HydrophobicContact CB-CG2 3.82Å
486	L	94.2	Very high	92.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.	S	Bend	trans	-76.6	-26.4	174.3	-89.4	-179.8	0	0	0	112.2	T484 L491 L571 T573 H575 W583 L591 G1186 L1188	T484-L486 PolarHBondContact O-N 2.92Å; L486-L491 HydrophobicContact CB-CD1 4.37Å; L486-L491 WeakPolarHBondContact O-CD2 3.46Å; L486-L571 HydrophobicContact CD2-CD2 4.11Å; L486-T573 HydrophobicContact CD2-CG2 4.23Å; L486-H575 PolarHBondContact O-CE1 2.79Å; L486-H575 VanDerWaalsContact O-CE1 3.25Å; L486-W583 HydrophobicContact CD2-CD2 4.1Å; L486-W583 HydrophobicContact CD2-CH2 4.37Å; L486-W583 HydrophobicContact CD2-CZ2 3.94Å; L486-L591 HydrophobicContact CD1-CD2 4.5Å; L486-L591 HydrophobicContact CD2-CD2 3.38Å; L486-L591 HydrophobicContact CG-CD2 3.98Å; L486-G1186 WeakPolarHBondContact CB-O 3.45Å; L486-L1188 HydrophobicContact CD1-CB 4.3Å; L486-L1188 HydrophobicContact CD1-CD1 4.09Å; L486-L1188 HydrophobicContact CD1-CG 3.94Å
487	H	92.5	Very high	92.8	Very high	9 Å²	9	18.4 Å²	18.4	4%	0.042	10%	0.1	C	C	.	.			trans	-107.5	46.5	-174.3	64.4	-57	0	0	0	111.7	E463 T489 L491 F631 G1186	E463-H487 PolarHBondContact O-CE1 2.6Å; E463-H487 PolarHBondContact O-NE2 2.75Å; E463-H487 IonicContact OE2-CD2 2.8Å; E463-H487 IonicContact OE2-CE1 3.66Å; E463-H487 IonicContact OE2-NE2 3.87Å; E463-H487 PolarHBondContact OE2-NE2 3.11Å; H487-T489 CarbonylContact C-O 3.55Å; H487-T489 WeakPolarHBondContact CA-O 3.24Å; H487-T489 CarbonylContact O-C 3.52Å; H487-T489 WeakPolarHBondContact O-CA 3.31Å; H487-T489 PolarHBondContact O-N 3.44Å; H487-L491 HydrophobicContact CB-CG 4.25Å; H487-F631 AromaticContact CD2-CE2 3.83Å; H487-F631 WeakPolarHBondContact O-CD2 3.42Å; H487-G1186 WeakPolarHBondContact ND1-CA 3.34Å
488	T	89.9	Confident	92.7	Very high	9 Å²	9	18.2 Å²	18.2	6%	0.055	10%	0.099	C	C	.	.	S	Bend	trans	-45.9	-38.1	175.4	55.1	0	0	0	0	111.9	C485 V630 D632	C485-T488 HydrophobicContact CB-CG2 4.43Å; T488-V630 WeakPolarHBondContact CB-O 3.42Å; T488-V630 HydrophobicContact CG2-CB 4.03Å; T488-V630 HydrophobicContact CG2-CG2 3.82Å; T488-D632 PolarHBondContact O-N 2.86Å
489	T	90.4	Very high	92.3	Very high	8 Å²	8	18.7 Å²	18.7	5%	0.049	10%	0.101	C	C	.	.	S	Bend	trans	-130.5	168.7	150.2	54.4	0	0	0	0	108.4	H487 L491 H575 D577 D632	H487-T489 CarbonylContact C-O 3.55Å; H487-T489 WeakPolarHBondContact CA-O 3.24Å; H487-T489 CarbonylContact O-C 3.52Å; H487-T489 WeakPolarHBondContact O-CA 3.31Å; H487-T489 PolarHBondContact O-N 3.44Å; T489-L491 PolarHBondContact O-N 2.92Å; T489-H575 PolarHBondContact O-ND1 3.29Å; T489-H575 WeakPolarHBondContact OG1-CB 3.21Å; T489-D577 HydrophobicContact CG2-CB 4.17Å; T489-D577 PolarHBondContact OG1-OD1 2.87Å; T489-D632 HydrophobicContact CG2-CB 3.89Å
490	S	91.8	Very high	92.3	Very high	62 Å²	62	15 Å²	15	43%	0.434	9%	0.089	S	C	.	.			trans	-42.9	123.9	-177.3	-50	0	0	0	0	113.4	T492 H575 E576	S490-T492 PolarHBondContact O-N 3.01Å; S490-H575 WeakPolarHBondContact O-CA 3.29Å; S490-E576 WeakPolarHBondContact CB-OE2 3.33Å; S490-E576 PolarHBondContact O-N 2.78Å; S490-E576 VanDerWaalsContact O-N 3.13Å; S490-E576 PolarHBondContact OG-OE2 3.27Å
491	L	93.3	Very high	91.8	Very high	26 Å²	26	15.6 Å²	15.6	14%	0.136	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	117	172.1	-72.7	-174.9	0	0	0	110.8	L486 H487 T489 T573 P1185	L486-L491 HydrophobicContact CB-CD1 4.37Å; L486-L491 WeakPolarHBondContact O-CD2 3.46Å; H487-L491 HydrophobicContact CB-CG 4.25Å; T489-L491 PolarHBondContact O-N 2.92Å; L491-T573 HydrophobicContact CD2-CG2 3.85Å; L491-P1185 WeakPolarHBondContact CD1-O 3.25Å
492	T	93.8	Very high	91.4	Very high	46 Å²	46	19.1 Å²	19.1	28%	0.282	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-27.7	179.3	58.6	0	0	0	0	112.8	S490 G574 E576 A641 I642	S490-T492 PolarHBondContact O-N 3.01Å; T492-G574 PolarHBondContact N-O 3.08Å; T492-G574 VanDerWaalsContact OG1-C 3.3Å; T492-G574 PolarHBondContact OG1-O 3.49Å; T492-E576 HydrophobicContact CG2-CB 3.96Å; T492-A641 HydrophobicContact CG2-CB 4.44Å; T492-I642 WeakPolarHBondContact CB-O 3.32Å; T492-I642 PolarHBondContact OG1-O 3.1Å
493	T	94.8	Very high	91	Very high	30 Å²	30	23 Å²	23	18%	0.184	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	151.9	178.6	-164	0	0	0	0	110.5	G574 I642 Q643 I645	T493-G574 PolarHBondContact N-O 3.06Å; T493-G574 PolarHBondContact O-N 3.42Å; T493-I642 HydrophobicContact CG2-CG2 3.8Å; T493-Q643 WeakPolarHBondContact CB-O 3.35Å; T493-Q643 PolarHBondContact OG1-O 3.01Å; T493-I645 HydrophobicContact CG2-CD1 3.94Å; T493-I645 HydrophobicContact CG2-CG1 4.01Å
494	Y	96.3	Very high	90.7	Very high	26 Å²	26	23.1 Å²	23.1	10%	0.102	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	156.1	173.6	59.3	-98.2	0	0	0	111.4	L572 S1156 V1158 L1180 Q1182 L1188	Y494-L572 CarbonylContact C-O 3.56Å; Y494-L572 WeakPolarHBondContact CA-O 3.29Å; Y494-L572 WeakPolarHBondContact CB-O 3.19Å; Y494-S1156 VanDerWaalsContact OH-CB 3.23Å; Y494-S1156 WeakPolarHBondContact OH-CB 3.47Å; Y494-S1156 PolarHBondContact OH-O 2.89Å; Y494-V1158 HydrophobicContact CD2-CG1 4.08Å; Y494-V1158 HydrophobicContact CE2-CG1 3.62Å; Y494-L1180 HydrophobicContact CD2-CD1 4.11Å; Y494-L1180 HydrophobicContact CE2-CB 3.98Å; Y494-L1180 HydrophobicContact CE2-CD1 4.38Å; Y494-Q1182 HydrophobicContact CE1-CB 4.28Å; Y494-Q1182 PolarHBondContact OH-N 3.31Å; Y494-L1188 HydrophobicContact CD1-CD1 4.3Å; Y494-L1188 HydrophobicContact CD1-CD2 3.99Å; Y494-L1188 HydrophobicContact CD2-CD1 3.99Å; Y494-L1188 HydrophobicContact CD2-CD2 4.33Å; Y494-L1188 HydrophobicContact CE1-CD2 3.62Å; Y494-L1188 HydrophobicContact CE2-CD1 4.4Å; Y494-L1188 HydrophobicContact CE2-CD2 4.01Å; Y494-L1188 HydrophobicContact CG-CD1 3.95Å; Y494-L1188 HydrophobicContact CG-CD2 4.33Å
495	N	93.3	Very high	90.5	Very high	13 Å²	13	22.4 Å²	22.4	7%	0.07	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	142.3	-179.4	-161	-5.5	0	0	0	110.8	I497 L572 Q1161	N495-I497 HydrophobicContact CB-CD1 4.26Å; N495-L572 PolarHBondContact N-O 3.39Å; N495-L572 PolarHBondContact O-N 2.7Å; N495-Q1161 VanDerWaalsContact ND2-CD 3.29Å; N495-Q1161 PolarHBondContact ND2-OE1 2.93Å
496	L	94.6	Very high	90.2	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	110.6	171.7	-178.2	62.4	0	0	0	109.3	T498 D569 L585 S1160 Q1161 L1178 L1180 L1190	L496-T498 HydrophobicContact CD2-CG2 4.19Å; L496-T498 HydrophobicContact CG-CG2 4.03Å; L496-D569 HydrophobicContact CD1-CB 4.39Å; L496-L585 HydrophobicContact CD1-CD1 3.73Å; L496-S1160 WeakPolarHBondContact O-CA 3.17Å; L496-S1160 WeakPolarHBondContact O-CB 3.26Å; L496-Q1161 PolarHBondContact O-N 2.94Å; L496-L1178 HydrophobicContact CD2-CB 4.37Å; L496-L1178 HydrophobicContact CD2-CD1 4.34Å; L496-L1180 HydrophobicContact CB-CD1 3.76Å; L496-L1180 HydrophobicContact CB-CG 4.34Å; L496-L1190 HydrophobicContact CD2-CD1 3.56Å
497	I	92.8	Very high	90	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	107.4	176	-49.4	-55.4	0	0	0	108	N495 V500 D569 L570 L572 L647 Q1161	N495-I497 HydrophobicContact CB-CD1 4.26Å; I497-V500 HydrophobicContact CB-CG2 4.36Å; I497-V500 HydrophobicContact CG2-CG2 3.94Å; I497-V500 WeakPolarHBondContact O-CG2 3.25Å; I497-D569 CarbonylContact O-C 3.56Å; I497-D569 WeakPolarHBondContact O-CA 3.44Å; I497-L570 PolarHBondContact N-O 3.31Å; I497-L570 PolarHBondContact O-N 2.7Å; I497-L572 HydrophobicContact CG1-CD1 3.7Å; I497-L572 HydrophobicContact CG1-CG 4.02Å; I497-L647 HydrophobicContact CG1-CB 4.43Å; I497-L647 HydrophobicContact CG1-CD2 4.48Å; I497-L647 HydrophobicContact CG2-CD2 4.36Å; I497-Q1161 CarbonylContact C-O 3.5Å; I497-Q1161 WeakPolarHBondContact CA-O 3.47Å; I497-Q1161 HydrophobicContact CD1-CB 4.2Å
498	T	88.6	Confident	90	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	150.6	-179.8	61.3	0	0	0	0	111.3	L496 D569 Q1161 P1162 G1163 L1203	L496-T498 HydrophobicContact CD2-CG2 4.19Å; L496-T498 HydrophobicContact CG-CG2 4.03Å; T498-D569 VanDerWaalsContact CA-OD1 3.24Å; T498-D569 WeakPolarHBondContact CA-OD1 3.42Å; T498-Q1161 PolarHBondContact N-O 3.04Å; T498-Q1161 PolarHBondContact OG1-O 3.15Å; T498-Q1161 VanDerWaalsContact OG1-O 3.11Å; T498-P1162 CarbonylContact O-C 3.58Å; T498-P1162 WeakPolarHBondContact O-CA 3.47Å; T498-G1163 PolarHBondContact O-N 3.33Å; T498-L1203 HydrophobicContact CG2-CD1 4.19Å
499	Q	82.7	Confident	89.9	Confident	20 Å²	20	28.6 Å²	28.6	9%	0.093	18%	0.175	C	C	.	.	S	Bend	trans	61.3	52.3	173.3	-48.3	171.1	79.2	0	0	111.4	D569 V1173 L1203	Q499-D569 PolarHBondContact N-OD1 3.24Å; Q499-V1173 PolarHBondContact NE2-O 3.05Å; Q499-L1203 HydrophobicContact CG-CD2 4.25Å
500	V	87.5	Confident	89.7	Confident	13 Å²	13	30.5 Å²	30.5	8%	0.079	19%	0.192	C	C	.	.			trans	-71.7	150.1	178.9	-175	0	0	0	0	109.5	I497 L504 L505 D568 L570	I497-V500 HydrophobicContact CB-CG2 4.36Å; I497-V500 HydrophobicContact CG2-CG2 3.94Å; I497-V500 WeakPolarHBondContact O-CG2 3.25Å; V500-L504 HydrophobicContact CG1-CB 4.17Å; V500-L504 HydrophobicContact CG1-CD2 3.77Å; V500-L504 HydrophobicContact CG1-CG 4.35Å; V500-L505 HydrophobicContact CB-CD1 4.18Å; V500-L505 HydrophobicContact CB-CD2 4.31Å; V500-L505 HydrophobicContact CB-CG 4.12Å; V500-L505 HydrophobicContact CG1-CD1 4.45Å; V500-L505 HydrophobicContact CG1-CD2 4.15Å; V500-L505 HydrophobicContact CG1-CG 3.89Å; V500-D568 WeakPolarHBondContact CB-O 3.26Å; V500-D568 PolarHBondContact N-O 3.41Å; V500-L570 HydrophobicContact CB-CD1 4.48Å; V500-L570 HydrophobicContact CG1-CD1 3.91Å; V500-L570 HydrophobicContact CG2-CB 4.18Å; V500-L570 HydrophobicContact CG2-CD1 4Å; V500-L570 HydrophobicContact CG2-CG 3.96Å
501	S	83.6	Confident	89.4	Confident	27 Å²	27	27.5 Å²	27.5	19%	0.189	17%	0.171	C	C	.	.			trans	-65.1	137	175.8	82.3	0	0	0	0	110.4	T503 L504 L505 N650	S501-T503 PolarHBondContact O-N 2.98Å; S501-L504 PolarHBondContact O-N 3.08Å; S501-L504 VanDerWaalsContact O-N 3.14Å; S501-L504 VanDerWaalsContact OG-CB 3.24Å; S501-L504 WeakPolarHBondContact OG-CB 3.26Å; S501-L504 PolarHBondContact OG-N 2.85Å; S501-L505 PolarHBondContact O-N 2.82Å; S501-L505 VanDerWaalsContact O-N 3.08Å; S501-N650 PolarHBondContact OG-OD1 2.82Å
502	S	82.3	Confident	88.9	Confident	84 Å²	84	26.4 Å²	26.4	59%	0.587	17%	0.166	S	C	*	.	H	α-helix	trans	-60.6	-32.8	176.5	51.4	0	0	0	0	111.9	L505 S506	S502-L505 PolarHBondContact O-N 3.01Å; S502-S506 WeakPolarHBondContact O-CB 3.31Å; S502-S506 PolarHBondContact O-N 2.82Å; S502-S506 PolarHBondContact O-OG 2.85Å; S502-S506 VanDerWaalsContact O-OG 3.08Å
503	T	85.8	Confident	88.3	Confident	81 Å²	81	27.8 Å²	27.8	50%	0.497	18%	0.182	S	C	.	.	H	α-helix	trans	-61.4	-45.6	173.6	-48.2	0	0	0	0	112.1	S501 N507	S501-T503 PolarHBondContact O-N 2.98Å; T503-N507 WeakPolarHBondContact O-CB 3.23Å; T503-N507 PolarHBondContact O-N 3.34Å; T503-N507 VanDerWaalsContact O-N 3.09Å; T503-N507 PolarHBondContact O-ND2 3.35Å
504	L	88.9	Confident	87.5	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-65.2	-43.5	177.4	-176.3	68	0	0	0	111.2	V500 S501 N507 L508 L647 F666	V500-L504 HydrophobicContact CG1-CB 4.17Å; V500-L504 HydrophobicContact CG1-CD2 3.77Å; V500-L504 HydrophobicContact CG1-CG 4.35Å; S501-L504 PolarHBondContact O-N 3.08Å; S501-L504 VanDerWaalsContact O-N 3.14Å; S501-L504 VanDerWaalsContact OG-CB 3.24Å; S501-L504 WeakPolarHBondContact OG-CB 3.26Å; S501-L504 PolarHBondContact OG-N 2.85Å; L504-N507 PolarHBondContact O-N 2.74Å; L504-L508 HydrophobicContact CD1-CD1 4.42Å; L504-L508 HydrophobicContact CD2-CD1 4.31Å; L504-L508 HydrophobicContact CG-CD1 3.89Å; L504-L508 HydrophobicContact CG-CG 4.41Å; L504-L508 WeakPolarHBondContact O-CB 3.45Å; L504-L508 WeakPolarHBondContact O-CG 3.21Å; L504-L508 PolarHBondContact O-N 3.14Å; L504-L647 HydrophobicContact CD2-CD1 3.82Å; L504-L647 HydrophobicContact CD2-CD2 3.8Å; L504-L647 HydrophobicContact CD2-CG 4.21Å; L504-F666 HydrophobicContact CD1-CD2 3.66Å; L504-F666 HydrophobicContact CD1-CE2 3.48Å; L504-F666 VanDerWaalsContact CD1-CE2 3.48Å
505	L	89.6	Confident	86.6	Confident	6 Å²	6	30 Å²	30	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-59.4	-49.9	178.3	-71.9	169.2	0	0	0	111.4	V500 S501 S502 N507 L508 E509 D568 L570	V500-L505 HydrophobicContact CB-CD1 4.18Å; V500-L505 HydrophobicContact CB-CD2 4.31Å; V500-L505 HydrophobicContact CB-CG 4.12Å; V500-L505 HydrophobicContact CG1-CD1 4.45Å; V500-L505 HydrophobicContact CG1-CD2 4.15Å; V500-L505 HydrophobicContact CG1-CG 3.89Å; S501-L505 PolarHBondContact O-N 2.82Å; S501-L505 VanDerWaalsContact O-N 3.08Å; S502-L505 PolarHBondContact O-N 3.01Å; L505-N507 VanDerWaalsContact C-N 3.31Å; L505-N507 PolarHBondContact O-N 2.9Å; L505-L508 PolarHBondContact O-N 3.47Å; L505-E509 WeakPolarHBondContact O-CG 3.48Å; L505-E509 PolarHBondContact O-N 3.1Å; L505-D568 HydrophobicContact CD1-CB 3.69Å; L505-L570 HydrophobicContact CD2-CD1 4.05Å; L505-L570 HydrophobicContact CD2-CD2 3.86Å; L505-L570 HydrophobicContact CD2-CG 3.87Å
506	S	88.4	Confident	85.5	Confident	75 Å²	75	30 Å²	30	52%	0.524	19%	0.19	S	C	.	.	H	α-helix	trans	-59.2	-40.2	176.8	-64.7	0	0	0	0	112.6	S502 E509 A510	S502-S506 WeakPolarHBondContact O-CB 3.31Å; S502-S506 PolarHBondContact O-N 2.82Å; S502-S506 PolarHBondContact O-OG 2.85Å; S502-S506 VanDerWaalsContact O-OG 3.08Å; S506-E509 PolarHBondContact O-N 2.96Å; S506-A510 VanDerWaalsContact O-CB 3.3Å; S506-A510 WeakPolarHBondContact O-CB 2.99Å; S506-A510 PolarHBondContact O-N 3.44Å
507	N	89.9	Confident	84.2	Confident	51 Å²	51	30.9 Å²	30.9	27%	0.273	20%	0.196	S	C	.	.	H	α-helix	trans	-67.2	-42	177.1	-71.2	-10.7	0	0	0	112.1	T503 L504 L505 A510 A511 F666	T503-N507 WeakPolarHBondContact O-CB 3.23Å; T503-N507 PolarHBondContact O-N 3.34Å; T503-N507 VanDerWaalsContact O-N 3.09Å; T503-N507 PolarHBondContact O-ND2 3.35Å; L504-N507 PolarHBondContact O-N 2.74Å; L505-N507 VanDerWaalsContact C-N 3.31Å; L505-N507 PolarHBondContact O-N 2.9Å; N507-A510 PolarHBondContact O-N 2.81Å; N507-A511 VanDerWaalsContact O-CB 3.27Å; N507-A511 WeakPolarHBondContact O-CB 3.39Å; N507-A511 PolarHBondContact O-N 3.15Å; N507-F666 HydrophobicContact CB-CD1 3.85Å; N507-F666 HydrophobicContact CB-CD2 4.17Å; N507-F666 HydrophobicContact CB-CE1 3.72Å; N507-F666 HydrophobicContact CB-CE2 4.06Å; N507-F666 HydrophobicContact CB-CG 4.06Å; N507-F666 HydrophobicContact CB-CZ 3.82Å
508	L	90.8	Very high	82.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-41.3	174.8	-75.4	164.5	0	0	0	111.9	L504 L505 G512 L570 F582 I594 Y595 F666 L719	L504-L508 HydrophobicContact CD1-CD1 4.42Å; L504-L508 HydrophobicContact CD2-CD1 4.31Å; L504-L508 HydrophobicContact CG-CD1 3.89Å; L504-L508 HydrophobicContact CG-CG 4.41Å; L504-L508 WeakPolarHBondContact O-CB 3.45Å; L504-L508 WeakPolarHBondContact O-CG 3.21Å; L504-L508 PolarHBondContact O-N 3.14Å; L505-L508 PolarHBondContact O-N 3.47Å; L508-G512 WeakPolarHBondContact O-CA 3.44Å; L508-G512 PolarHBondContact O-N 2.83Å; L508-L570 HydrophobicContact CD1-CD1 3.67Å; L508-F582 HydrophobicContact CD1-CD1 3.74Å; L508-F582 HydrophobicContact CD1-CE1 4.21Å; L508-F582 HydrophobicContact CD2-CD1 3.68Å; L508-F582 HydrophobicContact CD2-CD2 4.43Å; L508-F582 HydrophobicContact CD2-CE1 3.91Å; L508-F582 HydrophobicContact CD2-CG 3.98Å; L508-F582 HydrophobicContact CD2-CZ 4.39Å; L508-F582 HydrophobicContact CG-CD1 4.4Å; L508-I594 HydrophobicContact CB-CD1 3.62Å; L508-I594 HydrophobicContact CB-CG1 4.41Å; L508-I594 HydrophobicContact CD1-CD1 4.24Å; L508-Y595 HydrophobicContact CD2-CD1 3.82Å; L508-Y595 HydrophobicContact CD2-CG 4.03Å; L508-F666 HydrophobicContact CB-CZ 4.45Å; L508-F666 HydrophobicContact CD2-CE2 4.02Å; L508-F666 HydrophobicContact CD2-CZ 3.77Å; L508-F666 HydrophobicContact CG-CE2 3.97Å; L508-F666 HydrophobicContact CG-CZ 3.85Å; L508-L719 HydrophobicContact CD2-CD1 4.04Å
509	E	88.4	Confident	81.2	Confident	28 Å²	28	33 Å²	33	13%	0.131	21%	0.214	C	C	.	.	H	α-helix	trans	-70.6	-38.2	177.9	-68.6	-163.9	148.7	0	0	112.4	L505 S506 G512 A513 S558 R584 R592 I594	L505-E509 WeakPolarHBondContact O-CG 3.48Å; L505-E509 PolarHBondContact O-N 3.1Å; S506-E509 PolarHBondContact O-N 2.96Å; E509-G512 PolarHBondContact O-N 3.24Å; E509-A513 WeakPolarHBondContact O-CB 3.45Å; E509-A513 PolarHBondContact O-N 3.42Å; E509-S558 WeakPolarHBondContact OE2-CB 3.39Å; E509-R584 VanDerWaalsContact OE1-CD 3.26Å; E509-R584 WeakPolarHBondContact OE1-CD 3.5Å; E509-R584 IonicContact OE1-CZ 3.66Å; E509-R584 IonicContact OE1-NE 3.95Å; E509-R584 IonicContact OE1-NH1 3.58Å; E509-R584 PolarHBondContact OE1-NH1 3.35Å; E509-R584 IonicContact OE2-NH1 2.68Å; E509-R592 VanDerWaalsContact CD-NH2 3.34Å; E509-R592 IonicContact OE1-CZ 2.76Å; E509-R592 IonicContact OE1-NH2 3.73Å; E509-R592 PolarHBondContact OE1-NH2 2.81Å; E509-I594 HydrophobicContact CG-CB 4.31Å; E509-I594 HydrophobicContact CG-CD1 4.06Å; E509-I594 HydrophobicContact CG-CG2 4.3Å
510	A	86.3	Confident	79.8	Confident	48 Å²	48	36.2 Å²	36.2	40%	0.397	23%	0.225	S	C	.	.	H	α-helix	trans	-66.1	-44.8	174.8	0	0	0	0	0	112.2	S506 N507 Y514 P716	S506-A510 VanDerWaalsContact O-CB 3.3Å; S506-A510 WeakPolarHBondContact O-CB 2.99Å; S506-A510 PolarHBondContact O-N 3.44Å; N507-A510 PolarHBondContact O-N 2.81Å; A510-Y514 WeakPolarHBondContact O-CB 3.16Å; A510-Y514 PolarHBondContact O-N 2.86Å; A510-P716 HydrophobicContact CB-CB 4.28Å
511	A	85.9	Confident	78	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-45.7	173.2	0	0	0	0	0	110.9	N507 A513 Y514 Y515 Y595 F666	N507-A511 VanDerWaalsContact O-CB 3.27Å; N507-A511 WeakPolarHBondContact O-CB 3.39Å; N507-A511 PolarHBondContact O-N 3.15Å; A511-A513 PolarHBondContact O-N 3.48Å; A511-Y514 PolarHBondContact O-N 2.8Å; A511-Y515 HydrophobicContact CB-CD2 4.03Å; A511-Y515 HydrophobicContact CB-CE2 4.27Å; A511-Y515 WeakPolarHBondContact O-CD2 3.42Å; A511-Y515 PolarHBondContact O-N 3.24Å; A511-Y595 HydrophobicContact CB-CD2 3.84Å; A511-Y595 HydrophobicContact CB-CE2 3.69Å; A511-F666 HydrophobicContact CB-CE1 4.13Å
512	G	83.4	Confident	76.1	Confident	3 Å²	3	37.5 Å²	37.5	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-55.3	-49.7	176.6	0	0	0	0	0	114.5	L508 E509 Y514 G516 P517 I594	L508-G512 WeakPolarHBondContact O-CA 3.44Å; L508-G512 PolarHBondContact O-N 2.83Å; E509-G512 PolarHBondContact O-N 3.24Å; G512-Y514 VanDerWaalsContact C-N 3.26Å; G512-Y514 PolarHBondContact O-N 2.99Å; G512-G516 CarbonylContact O-C 3.46Å; G512-G516 WeakPolarHBondContact O-CA 3.2Å; G512-G516 PolarHBondContact O-N 3.41Å; G512-P517 WeakPolarHBondContact O-CD 3.03Å; G512-I594 WeakPolarHBondContact CA-O 3.28Å
513	A	80.1	Confident	74.3	Confident	74 Å²	74	39.9 Å²	39.9	61%	0.612	23%	0.232	S	C	*	.	H	α-helix	trans	-63.3	-32.5	178.5	0	0	0	0	0	112.6	E509 A511	E509-A513 WeakPolarHBondContact O-CB 3.45Å; E509-A513 PolarHBondContact O-N 3.42Å; A511-A513 PolarHBondContact O-N 3.48Å
514	Y	79.3	Confident	71.9	Confident	58 Å²	58	39 Å²	39	23%	0.227	24%	0.239	C	C	.	.	H	α-helix	trans	-89.1	-49.3	-175.3	-173.6	-98.9	0	0	0	113.6	A510 A511 G512 R523 L715 P716	A510-Y514 WeakPolarHBondContact O-CB 3.16Å; A510-Y514 PolarHBondContact O-N 2.86Å; A511-Y514 PolarHBondContact O-N 2.8Å; G512-Y514 VanDerWaalsContact C-N 3.26Å; G512-Y514 PolarHBondContact O-N 2.99Å; Y514-R523 VanDerWaalsContact CD1-NH1 3.27Å; Y514-R523 PolarHBondContact O-NH1 3.19Å; Y514-L715 HydrophobicContact CE1-CD2 3.68Å; Y514-L715 HydrophobicContact CE2-CD2 4.49Å; Y514-L715 VanDerWaalsContact CZ-CD2 3.48Å; Y514-L715 WeakPolarHBondContact OH-CD2 3.11Å; Y514-P716 VanDerWaalsContact CB-CG 3.44Å; Y514-P716 HydrophobicContact CD1-CG 3.68Å; Y514-P716 HydrophobicContact CD2-CG 4.21Å; Y514-P716 HydrophobicContact CG-CG 3.5Å
515	Y	75.7	Confident	69.5	Low	46 Å²	46	40.7 Å²	40.7	18%	0.18	26%	0.257	C	S	.	.	H	α-helix	trans	-85.9	-13.6	-178.4	-58.1	-72.1	0	0	0	113.1	A511 F705 P716 Q718	A511-Y515 HydrophobicContact CB-CD2 4.03Å; A511-Y515 HydrophobicContact CB-CE2 4.27Å; A511-Y515 WeakPolarHBondContact O-CD2 3.42Å; A511-Y515 PolarHBondContact O-N 3.24Å; Y515-F705 HydrophobicContact CE1-CE1 4.25Å; Y515-P716 HydrophobicContact CE2-CG 4.11Å; Y515-P716 PolarHBondContact OH-O 2.76Å; Y515-Q718 HydrophobicContact CD2-CB 4.28Å; Y515-Q718 HydrophobicContact CE2-CB 3.71Å; Y515-Q718 HydrophobicContact CE2-CG 4.47Å; Y515-Q718 VanDerWaalsContact CZ-OE1 3.28Å
516	G	70.8	Confident	67.2	Low	12 Å²	12	42.5 Å²	42.5	12%	0.124	27%	0.272	C	S	.	.			trans	87.7	133.5	-175.7	0	0	0	0	0	111.7	G512 E518	G512-G516 CarbonylContact O-C 3.46Å; G512-G516 WeakPolarHBondContact O-CA 3.2Å; G512-G516 PolarHBondContact O-N 3.41Å; G516-E518 PolarHBondContact O-N 3.49Å
517	P	67.7	Low	65.1	Low	20 Å²	20	42.3 Å²	42.3	13%	0.13	27%	0.265	C	S	.	.	S	Bend	trans	-72.2	-12.3	176	23.8	-26	0	0	0	113	G512 R593 T596	G512-P517 WeakPolarHBondContact O-CD 3.03Å; P517-R593 HydrophobicContact CB-CB 4.35Å; P517-R593 HydrophobicContact CB-CG 4.1Å; P517-R593 WeakPolarHBondContact CB-O 3.49Å; P517-R593 PolarHBondContact O-NE 3.07Å; P517-T596 WeakPolarHBondContact O-CB 3.47Å; P517-T596 PolarHBondContact O-OG1 3.02Å
518	E	65.8	Low	62.9	Low	17 Å²	17	44.4 Å²	44.4	8%	0.079	29%	0.289	C	S	.	.	S	Bend	trans	-139.8	97.1	-168	-36.1	-159.3	-156.7	0	0	109.9	R479 G516 R520 F521 W536 R593 V630	R479-E518 WeakPolarHBondContact CD-OE1 3.27Å; R479-E518 IonicContact CZ-OE1 3.7Å; R479-E518 IonicContact NE-OE1 3.97Å; R479-E518 PolarHBondContact NE-OE1 3.32Å; R479-E518 IonicContact NH2-OE1 2.75Å; G516-E518 PolarHBondContact O-N 3.49Å; E518-R520 PolarHBondContact O-N 2.73Å; E518-F521 PolarHBondContact O-N 2.83Å; E518-W536 HydrophobicContact CB-CZ2 4.19Å; E518-W536 VanDerWaalsContact CD-CZ2 3.49Å; E518-W536 HydrophobicContact CG-CZ2 4.2Å; E518-W536 WeakPolarHBondContact OE2-CZ2 3.25Å; E518-R593 VanDerWaalsContact CD-NH2 3.3Å; E518-R593 IonicContact OE2-CZ 2.67Å; E518-R593 IonicContact OE2-NE 2.67Å; E518-R593 IonicContact OE2-NH2 3.99Å; E518-R593 PolarHBondContact OE2-NH2 3.06Å; E518-V630 WeakPolarHBondContact OE2-CG1 3.29Å
519	G	51.5	Low	60.5	Low	28 Å²	28	52 Å²	52	29%	0.289	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-65.1	-27.3	-162.9	0	0	0	0	0	116.4	F521 Y598	G519-F521 PolarHBondContact O-N 3.37Å; G519-Y598 PolarHBondContact N-OH 3.46Å; G519-Y598 VanDerWaalsContact N-OH 3.09Å
520	R	54.4	Low	58.6	Low	87 Å²	87	53.5 Å²	53.5	33%	0.328	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-64.7	-36.8	-178.6	-87.7	-173.2	178.2	-121	5.7	113.3	E518 D632	E518-R520 PolarHBondContact O-N 2.73Å; R520-D632 IonicContact CZ-OD2 3.68Å; R520-D632 IonicContact NE-OD2 3.83Å; R520-D632 IonicContact NH2-OD1 3.38Å; R520-D632 IonicContact NH2-OD2 3.93Å; R520-D632 PolarHBondContact NH2-OD2 3.03Å
521	F	49.7	Very low	56.7	Low	33 Å²	33	55.3 Å²	55.3	15%	0.145	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-98.8	14.8	-173.6	-66.6	-65.7	0	0	0	113.7	F477 E518 G519 G534 W536 G629 V630	F477-F521 HydrophobicContact CD2-CE1 4.08Å; F477-F521 HydrophobicContact CD2-CZ 4.28Å; F477-F521 AromaticContact CE2-CE1 3.9Å; F477-F521 HydrophobicContact CE2-CE1 3.9Å; F477-F521 HydrophobicContact CE2-CZ 4.22Å; E518-F521 PolarHBondContact O-N 2.83Å; G519-F521 PolarHBondContact O-N 3.37Å; F521-G534 WeakPolarHBondContact CD1-O 3.48Å; F521-W536 HydrophobicContact CB-CZ2 4.47Å; F521-W536 VanDerWaalsContact CB-NE1 3.3Å; F521-W536 AromaticContact CD2-CE2 3.99Å; F521-W536 HydrophobicContact CD2-CH2 4.43Å; F521-W536 AromaticContact CD2-CZ2 3.59Å; F521-W536 HydrophobicContact CD2-CZ2 3.59Å; F521-W536 HydrophobicContact CE2-CZ2 4.21Å; F521-W536 HydrophobicContact CG-CZ2 4.32Å; F521-G629 VanDerWaalsContact CE2-O 3.25Å; F521-G629 WeakPolarHBondContact CE2-O 3.48Å; F521-G629 WeakPolarHBondContact CZ-O 3.42Å; F521-V630 HydrophobicContact CD2-CG1 4.29Å; F521-V630 HydrophobicContact CE2-CG1 3.79Å
522	G	44.3	Very low	54.8	Low	33 Å²	33	59.1 Å²	59.1	34%	0.34	37%	0.373	S	S	.	.			trans	69.1	-173.5	172.7	0	0	0	0	0	116.1
523	R	42.9	Very low	53.3	Low	135 Å²	135	60.1 Å²	60.1	51%	0.509	38%	0.383	S	S	.	.	S	Bend	trans	-71.4	136.1	176.8	-64.8	175.6	-179.6	-112.2	19.4	109.3	Y514	Y514-R523 VanDerWaalsContact CD1-NH1 3.27Å; Y514-R523 PolarHBondContact O-NH1 3.19Å
524	G	36.8	Very low	52.3	Low	63 Å²	63	57.2 Å²	57.2	65%	0.649	36%	0.36	S	S	*	.	S	Bend	trans	-60.8	154.6	-164.7	0	0	0	0	0	116.8
525	G	38.5	Very low	52	Low	38 Å²	38	54.6 Å²	54.6	39%	0.392	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	132.8	142.5	-180	0	0	0	0	0	110.6	I527	G525-I527 PolarHBondContact O-N 3.24Å
526	A	40.6	Very low	52.3	Low	43 Å²	43	53.1 Å²	53.1	36%	0.355	35%	0.345	S	S	.	.			trans	-62.6	129.9	166	0	0	0	0	0	108.2	T472 P476 A528	T472-A526 HydrophobicContact CG2-CB 3.96Å; P476-A526 HydrophobicContact CG-CB 4.23Å; A526-A528 PolarHBondContact O-N 2.78Å; A526-A528 VanDerWaalsContact O-N 3.08Å
527	I	44.8	Very low	53.1	Low	72 Å²	72	53.5 Å²	53.5	37%	0.369	35%	0.346	S	S	.	.			trans	-80.4	100	-167.1	-46.7	-176.3	0	0	0	108.9	G525 D529 N530	G525-I527 PolarHBondContact O-N 3.24Å; I527-D529 PolarHBondContact O-N 2.88Å; I527-N530 HydrophobicContact CG2-CB 4.03Å
528	A	42.7	Very low	53.8	Low	95 Å²	95	57.8 Å²	57.8	79%	0.785	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.8	174.9	0	0	0	0	0	112.6	A526	A526-A528 PolarHBondContact O-N 2.78Å; A526-A528 VanDerWaalsContact O-N 3.08Å
529	D	41.3	Very low	54.9	Low	159 Å²	159	60.2 Å²	60.2	85%	0.85	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-6.7	-170.8	-53.7	-36.4	0	0	0	114.1	I527	I527-D529 PolarHBondContact O-N 2.88Å
530	N	49.4	Very low	56.6	Low	60 Å²	60	63.3 Å²	63.3	32%	0.321	40%	0.404	S	S	.	.			trans	-157	94	175.5	-171.5	-21.2	0	0	0	110.6	I527 S532 G533	I527-N530 HydrophobicContact CG2-CB 4.03Å; N530-S532 PolarHBondContact O-N 2.9Å; N530-S532 WeakPolarHBondContact OD1-CA 3.3Å; N530-S532 WeakPolarHBondContact OD1-CB 3.46Å; N530-S532 PolarHBondContact OD1-N 2.83Å; N530-S532 PolarHBondContact OD1-OG 3.31Å; N530-G533 PolarHBondContact O-N 3.48Å; N530-G533 PolarHBondContact OD1-N 2.98Å
531	P	46.1	Very low	58.4	Low	85 Å²	85	60.3 Å²	60.3	55%	0.552	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.5	-179.4	26.2	-34.1	0	0	0	113.9	G533	P531-G533 VanDerWaalsContact C-N 3.29Å
532	S	45.9	Very low	60.4	Low	80 Å²	80	59.8 Å²	59.8	56%	0.559	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.2	172.7	-43.1	0	0	0	0	112	N530 R626	N530-S532 PolarHBondContact O-N 2.9Å; N530-S532 WeakPolarHBondContact OD1-CA 3.3Å; N530-S532 WeakPolarHBondContact OD1-CB 3.46Å; N530-S532 PolarHBondContact OD1-N 2.83Å; N530-S532 PolarHBondContact OD1-OG 3.31Å; S532-R626 WeakPolarHBondContact O-CD 3.49Å; S532-R626 WeakPolarHBondContact O-CG 3.18Å
533	G	52.2	Low	62.7	Low	24 Å²	24	58.2 Å²	58.2	25%	0.247	38%	0.377	C	S	.	.	S	Bend	trans	-74.8	124.8	-179.8	0	0	0	0	0	112.8	N530 P531 G535	N530-G533 PolarHBondContact O-N 3.48Å; N530-G533 PolarHBondContact OD1-N 2.98Å; P531-G533 VanDerWaalsContact C-N 3.29Å; G533-G535 PolarHBondContact O-N 2.83Å
534	G	58.2	Low	64.9	Low	13 Å²	13	55.5 Å²	55.5	13%	0.134	37%	0.37	C	S	.	.			trans	-67.8	89.9	177.3	0	0	0	0	0	112.9	F521	F521-G534 WeakPolarHBondContact CD1-O 3.48Å
535	G	72.7	Confident	67.4	Low	3 Å²	3	52.8 Å²	52.8	3%	0.031	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-81.2	173	173.9	0	0	0	0	0	113.9	P476 F477 G533	P476-G535 CarbonylContact C-O 3.44Å; P476-G535 WeakPolarHBondContact CA-O 3.2Å; P476-G535 WeakPolarHBondContact CB-O 3.33Å; F477-G535 PolarHBondContact N-O 3.44Å; G533-G535 PolarHBondContact O-N 2.83Å
536	W	82.3	Confident	69.6	Low	16 Å²	16	51.6 Å²	51.6	6%	0.061	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-101.4	132.5	169.7	-68.2	102.5	0	0	0	111.3	F477 R479 E518 F521 V630	F477-W536 HydrophobicContact CB-CE3 4.03Å; F477-W536 HydrophobicContact CB-CZ3 3.98Å; F477-W536 CarbonylContact O-C 3.57Å; F477-W536 WeakPolarHBondContact O-CA 3.17Å; R479-W536 HydrophobicContact CG-CD2 4.35Å; R479-W536 HydrophobicContact CG-CE3 3.67Å; R479-W536 HydrophobicContact CG-CH2 4.11Å; R479-W536 HydrophobicContact CG-CZ3 3.55Å; R479-W536 VanDerWaalsContact CZ-CD2 3.45Å; R479-W536 VanDerWaalsContact NH1-CG 3.29Å; R479-W536 VanDerWaalsContact NH2-CD2 3.34Å; R479-W536 VanDerWaalsContact NH2-CG 3.32Å; E518-W536 HydrophobicContact CB-CZ2 4.19Å; E518-W536 VanDerWaalsContact CD-CZ2 3.49Å; E518-W536 HydrophobicContact CG-CZ2 4.2Å; E518-W536 WeakPolarHBondContact OE2-CZ2 3.25Å; F521-W536 HydrophobicContact CB-CZ2 4.47Å; F521-W536 VanDerWaalsContact CB-NE1 3.3Å; F521-W536 AromaticContact CD2-CE2 3.99Å; F521-W536 HydrophobicContact CD2-CH2 4.43Å; F521-W536 AromaticContact CD2-CZ2 3.59Å; F521-W536 HydrophobicContact CD2-CZ2 3.59Å; F521-W536 HydrophobicContact CE2-CZ2 4.21Å; F521-W536 HydrophobicContact CG-CZ2 4.32Å; W536-V630 HydrophobicContact CH2-CG1 4.07Å; W536-V630 HydrophobicContact CZ2-CG1 4.18Å
537	S	87	Confident	71.3	Confident	19 Å²	19	55.4 Å²	55.4	13%	0.133	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-66.2	148.2	173.9	-174.5	0	0	0	0	111.6	D469 F477 L539	D469-S537 WeakPolarHBondContact OD2-CB 3.24Å; D469-S537 PolarHBondContact OD2-OG 3.5Å; F477-S537 PolarHBondContact O-N 2.93Å; S537-L539 PolarHBondContact OG-N 2.93Å; S537-L539 VanDerWaalsContact OG-N 3.07Å
538	S	83.5	Confident	72.4	Confident	111 Å²	111	54 Å²	54	78%	0.776	34%	0.339	S	S	*	.			trans	-98.2	-3.2	170.6	57	0	0	0	0	113.3
539	L	87.8	Confident	73.4	Confident	67 Å²	67	52 Å²	52	35%	0.351	32%	0.315	S	S	.	.	S	Bend	trans	-68.4	147.4	179.5	-65.1	-171.8	0	0	0	111.7	D469 I471 S537	D469-L539 VanDerWaalsContact OD2-CD1 3.32Å; D469-L539 WeakPolarHBondContact OD2-CD1 3.49Å; I471-L539 HydrophobicContact CB-CD1 3.95Å; I471-L539 HydrophobicContact CD1-CD1 3.97Å; I471-L539 HydrophobicContact CG2-CD1 4.21Å; S537-L539 PolarHBondContact OG-N 2.93Å; S537-L539 VanDerWaalsContact OG-N 3.07Å
540	P	88.2	Confident	74	Confident	93 Å²	93	50.4 Å²	50.4	60%	0.604	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-68.1	149.3	173.4	30.5	-35.3	0	0	0	110.8
541	W	90.9	Very high	73.9	Confident	24 Å²	24	49.5 Å²	49.5	9%	0.091	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-55.7	122.8	174.9	-175.6	-105.1	0	0	0	111.4	I456 M465 V467 M478 P480 P481 Y482 I543 Q544	I456-W541 HydrophobicContact CD1-CH2 4.4Å; I456-W541 HydrophobicContact CD1-CZ3 4.46Å; M465-W541 HydrophobicContact CE-CH2 4.27Å; V467-W541 HydrophobicContact CB-CZ3 4.34Å; V467-W541 HydrophobicContact CG1-CH2 4.2Å; V467-W541 HydrophobicContact CG1-CZ3 3.9Å; V467-W541 HydrophobicContact CG2-CH2 4.03Å; V467-W541 HydrophobicContact CG2-CZ3 4.15Å; M478-W541 HydrophobicContact CE-CE3 3.6Å; M478-W541 HydrophobicContact CE-CZ3 3.61Å; P480-W541 HydrophobicContact CB-CH2 3.92Å; P480-W541 HydrophobicContact CB-CZ3 3.99Å; P481-W541 HydrophobicContact CG-CB 4.33Å; P481-W541 HydrophobicContact CG-CD2 3.8Å; P481-W541 HydrophobicContact CG-CE3 4.43Å; P481-W541 HydrophobicContact CG-CG 3.72Å; Y482-W541 AromaticContact CE1-NE1 3.95Å; Y482-W541 AromaticContact CE2-CZ2 3.81Å; Y482-W541 HydrophobicContact CE2-CZ2 3.81Å; Y482-W541 AromaticContact CZ-CE2 3.93Å; Y482-W541 AromaticContact CZ-CZ2 3.91Å; Y482-W541 AromaticContact CZ-NE1 3.48Å; Y482-W541 PolarHBondContact OH-NE1 2.9Å; W541-I543 HydrophobicContact CZ2-CD1 3.86Å; W541-I543 HydrophobicContact CZ2-CG1 4.49Å; W541-Q544 PolarHBondContact O-NE2 3.23Å
542	P	91.9	Very high	74.1	Confident	23 Å²	23	46.7 Å²	46.7	15%	0.149	29%	0.287	C	S	.	.			trans	-81.6	-23	-166.6	31.5	-37.2	0	0	0	114	I456 M478 Q544	I456-P542 HydrophobicContact CD1-CG 3.53Å; I456-P542 HydrophobicContact CG1-CG 3.96Å; I456-P542 HydrophobicContact CG2-CG 3.79Å; M478-P542 HydrophobicContact CE-CG 4.37Å; P542-Q544 WeakPolarHBondContact O-CG 3.48Å; P542-Q544 PolarHBondContact O-N 3.47Å
543	I	92.4	Very high	74	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	29%	0.287	C	S	.	.			trans	-75.9	113.6	179.7	-56.5	170.5	0	0	0	108.6	Y52 D57 L59 K73 V447 W541	Y52-I543 HydrophobicContact CE2-CG1 4.25Å; D57-I543 WeakPolarHBondContact O-CG2 3.46Å; D57-I543 WeakPolarHBondContact OD1-CA 3.37Å; D57-I543 WeakPolarHBondContact OD1-CG2 3.42Å; L59-I543 HydrophobicContact CB-CD1 4.11Å; K73-I543 WeakPolarHBondContact CA-O 3.42Å; V447-I543 HydrophobicContact CG1-CD1 4.11Å; V447-I543 HydrophobicContact CG1-CG1 3.75Å; V447-I543 HydrophobicContact CG2-CD1 4.45Å; W541-I543 HydrophobicContact CZ2-CD1 3.86Å; W541-I543 HydrophobicContact CZ2-CG1 4.49Å
544	Q	89.9	Confident	73.9	Confident	77 Å²	77	48.4 Å²	48.4	36%	0.36	29%	0.286	S	S	.	.			trans	-126.3	10.8	-171.5	-65.7	-63.1	-46	0	0	113.4	D57 W541 P542	D57-Q544 WeakPolarHBondContact OD2-CA 3.23Å; D57-Q544 PolarHBondContact OD2-N 2.93Å; W541-Q544 PolarHBondContact O-NE2 3.23Å; P542-Q544 WeakPolarHBondContact O-CG 3.48Å; P542-Q544 PolarHBondContact O-N 3.47Å
545	G	89.3	Confident	73.8	Confident	7 Å²	7	49.3 Å²	49.3	7%	0.072	29%	0.288	C	S	.	.			trans	-64	141.7	-179.2	0	0	0	0	0	115.1	I56 D57 G72 K73	I56-G545 VanDerWaalsContact O-CA 3.27Å; I56-G545 WeakPolarHBondContact O-CA 3.4Å; D57-G545 WeakPolarHBondContact O-CA 3.42Å; D57-G545 PolarHBondContact O-N 3.05Å; D57-G545 PolarHBondContact OD2-N 2.68Å; G72-G545 CarbonylContact C-O 3.59Å; G72-G545 WeakPolarHBondContact CA-O 3.49Å; K73-G545 PolarHBondContact N-O 2.92Å
546	G	83.9	Confident	72.9	Confident	13 Å²	13	50.6 Å²	50.6	13%	0.134	30%	0.296	C	S	.	.	S	Bend	trans	83.1	157.1	-179.2	0	0	0	0	0	114.3
547	H	77.8	Confident	71.2	Confident	123 Å²	123	55.7 Å²	55.7	57%	0.569	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	116.3	-179.2	-75.3	-85.7	0	0	0	111.4	Y1211 R1212	H547-Y1211 CarbonylContact O-C 3.2Å; H547-Y1211 WeakPolarHBondContact O-CA 3.47Å; H547-Y1211 WeakPolarHBondContact O-CB 3.38Å; H547-R1212 HydrophobicContact CB-CB 4.43Å; H547-R1212 PolarHBondContact N-O 3.22Å; H547-R1212 PolarHBondContact O-N 2.9Å
548	A	67.8	Low	69.3	Low	41 Å²	41	56.3 Å²	56.3	34%	0.339	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.3	173.6	0	0	0	0	0	109.9	I76	I76-A548 HydrophobicContact CD1-CB 3.9Å
549	L	62.3	Low	67.5	Low	55 Å²	55	55.6 Å²	55.6	29%	0.288	33%	0.329	S	S	.	.			trans	-90.1	101.6	170.3	-66.3	171.8	0	0	0	107.4	T120 N551 I1210 R1212	T120-L549 HydrophobicContact CG2-CD1 3.77Å; L549-N551 PolarHBondContact O-N 3.37Å; L549-I1210 HydrophobicContact CB-CB 4.4Å; L549-I1210 HydrophobicContact CB-CG2 3.94Å; L549-I1210 HydrophobicContact CD1-CG2 4.09Å; L549-I1210 PolarHBondContact N-O 3.25Å; L549-R1212 HydrophobicContact CD1-CG 4.17Å
550	I	53.9	Low	65.4	Low	125 Å²	125	58 Å²	58	64%	0.641	34%	0.341	S	S	*	.			trans	-67.6	99.9	-171.9	-54.5	172.3	0	0	0	110.2	L555 L565	I550-L555 HydrophobicContact CG2-CD1 4.1Å; I550-L565 HydrophobicContact CG2-CD1 3.67Å
551	N	48	Very low	63.3	Low	41 Å²	41	57.2 Å²	57.2	22%	0.219	35%	0.35	C	S	.	.			trans	-123	105.9	-176.7	-76	-0.4	0	0	0	111.4	L549 L1098 I1210	L549-N551 PolarHBondContact O-N 3.37Å; N551-L1098 HydrophobicContact CB-CD2 4.15Å; N551-L1098 VanDerWaalsContact CG-CD2 3.48Å; N551-L1098 VanDerWaalsContact OD1-CD2 3.27Å; N551-L1098 WeakPolarHBondContact OD1-CD2 3.39Å; N551-I1210 HydrophobicContact CB-CD1 3.95Å; N551-I1210 WeakPolarHBondContact ND2-CD1 3.24Å
552	G	49.9	Very low	61.4	Low	26 Å²	26	57.7 Å²	57.7	27%	0.268	36%	0.363	S	S	.	.			trans	158.9	116.3	168.4	0	0	0	0	0	113.2	R554 L555	G552-R554 PolarHBondContact O-N 3.3Å; G552-L555 WeakPolarHBondContact O-CB 3.24Å; G552-L555 PolarHBondContact O-N 3.09Å
553	S	43.4	Very low	59.8	Low	81 Å²	81	63.5 Å²	63.5	57%	0.566	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	16.2	-179.9	83.4	0	0	0	0	114.5
554	R	51.7	Low	58.7	Low	58 Å²	58	64.9 Å²	64.9	22%	0.219	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	14.9	177.2	-59.9	-174	-170.9	-117.8	-10.2	112.3	G552 S556 C1171	G552-R554 PolarHBondContact O-N 3.3Å; R554-S556 PolarHBondContact O-N 3.44Å; R554-C1171 VanDerWaalsContact CZ-O 3.23Å; R554-C1171 PolarHBondContact NH1-O 3.29Å; R554-C1171 PolarHBondContact NH2-O 2.91Å
555	L	55.4	Low	57.9	Low	32 Å²	32	63.9 Å²	63.9	17%	0.168	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	110.4	170.6	-72.3	178.1	0	0	0	107.1	I550 G552 L565 T567	I550-L555 HydrophobicContact CG2-CD1 4.1Å; G552-L555 WeakPolarHBondContact O-CB 3.24Å; G552-L555 PolarHBondContact O-N 3.09Å; L555-L565 HydrophobicContact CB-CB 3.76Å; L555-L565 HydrophobicContact CB-CD1 3.93Å; L555-L565 HydrophobicContact CB-CG 4.46Å; L555-L565 HydrophobicContact CD1-CB 4.37Å; L555-L565 HydrophobicContact CD1-CD1 4.25Å; L555-L565 HydrophobicContact CD2-CB 4.24Å; L555-L565 HydrophobicContact CG-CB 4.34Å; L555-T567 HydrophobicContact CD2-CG2 4.29Å
556	S	53.2	Low	57.5	Low	31 Å²	31	64.4 Å²	64.4	22%	0.217	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	138.4	-165.1	-179.8	0	0	0	0	111	R554 S558 Y566 D568 R584	R554-S556 PolarHBondContact O-N 3.44Å; S556-S558 PolarHBondContact O-N 3.4Å; S556-S558 VanDerWaalsContact O-N 3.1Å; S556-Y566 PolarHBondContact N-O 3.43Å; S556-D568 WeakPolarHBondContact CB-OD1 3.35Å; S556-D568 PolarHBondContact OG-OD1 2.96Å; S556-R584 VanDerWaalsContact CB-NH2 3.31Å; S556-R584 PolarHBondContact OG-NH2 2.92Å
557	T	46.6	Very low	57.5	Low	123 Å²	123	63.9 Å²	63.9	76%	0.755	39%	0.39	S	S	*	.			trans	-84.6	23.7	-163.9	55.5	0	0	0	0	114.6	S559	T557-S559 VanDerWaalsContact C-N 3.33Å; T557-S559 PolarHBondContact O-N 3.09Å
558	S	47	Very low	57.8	Low	32 Å²	32	60.3 Å²	60.3	22%	0.224	38%	0.376	C	S	.	.			trans	-71.9	84.3	175.4	55.7	0	0	0	0	110.4	E509 S556 L560 R584	E509-S558 WeakPolarHBondContact OE2-CB 3.39Å; S556-S558 PolarHBondContact O-N 3.4Å; S556-S558 VanDerWaalsContact O-N 3.1Å; S558-L560 PolarHBondContact O-N 3.15Å; S558-R584 PolarHBondContact OG-NH1 3.35Å
559	S	45.6	Very low	58.8	Low	96 Å²	96	58.9 Å²	58.9	67%	0.671	36%	0.362	S	S	*	.			trans	-75.1	19.8	-173.3	52.6	0	0	0	0	115.4	T557 G561	T557-S559 VanDerWaalsContact C-N 3.33Å; T557-S559 PolarHBondContact O-N 3.09Å; S559-G561 PolarHBondContact O-N 2.98Å
560	L	43.8	Very low	60.4	Low	117 Å²	117	56.2 Å²	56.2	61%	0.613	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	91.9	-178.7	-122.8	78.1	0	0	0	110.9	S558	S558-L560 PolarHBondContact O-N 3.15Å
561	G	45.3	Very low	62.4	Low	77 Å²	77	50.3 Å²	50.3	79%	0.794	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.5	25.2	169.4	0	0	0	0	0	116.9	S559	S559-G561 PolarHBondContact O-N 2.98Å
562	G	50.5	Low	64.7	Low	34 Å²	34	48.4 Å²	48.4	35%	0.351	31%	0.308	S	S	.	.	S	Bend	trans	135	176.8	166.7	0	0	0	0	0	115	I564	G562-I564 PolarHBondContact O-N 3.47Å
563	N	59.2	Low	67	Low	145 Å²	145	47.2 Å²	47.2	78%	0.775	30%	0.295	S	S	*	.	S	Bend	trans	-71.8	26.4	-177.6	-73.8	-42.3	0	0	0	114.5
564	I	69	Low	69.5	Low	28 Å²	28	43.3 Å²	43.3	14%	0.144	27%	0.268	C	S	.	.			trans	-102.8	123.9	-176.3	-41.4	179	0	0	0	108.3	P74 P481 G562 Y566	P74-I564 HydrophobicContact CB-CD1 3.51Å; P74-I564 HydrophobicContact CB-CG1 3.76Å; P74-I564 HydrophobicContact CB-CG2 4.31Å; P74-I564 HydrophobicContact CG-CD1 3.69Å; P74-I564 HydrophobicContact CG-CG1 4.12Å; P481-I564 HydrophobicContact CB-CD1 3.9Å; G562-I564 PolarHBondContact O-N 3.47Å; I564-Y566 HydrophobicContact CB-CE2 3.86Å; I564-Y566 HydrophobicContact CG2-CD2 4.44Å; I564-Y566 HydrophobicContact CG2-CE1 4.31Å; I564-Y566 HydrophobicContact CG2-CE2 3.84Å
565	L	72.5	Confident	71.5	Confident	57 Å²	57	40.6 Å²	40.6	30%	0.298	26%	0.258	S	S	.	.			trans	-95.8	130.3	172.6	-55.2	171.4	0	0	0	109.6	I550 L555 S586	I550-L565 HydrophobicContact CG2-CD1 3.67Å; L555-L565 HydrophobicContact CB-CB 3.76Å; L555-L565 HydrophobicContact CB-CD1 3.93Å; L555-L565 HydrophobicContact CB-CG 4.46Å; L555-L565 HydrophobicContact CD1-CB 4.37Å; L555-L565 HydrophobicContact CD1-CD1 4.25Å; L555-L565 HydrophobicContact CD2-CB 4.24Å; L555-L565 HydrophobicContact CG-CB 4.34Å; L565-S586 WeakPolarHBondContact O-CB 3.47Å; L565-S586 PolarHBondContact O-OG 2.79Å
566	Y	81.2	Confident	73.3	Confident	17 Å²	17	41.2 Å²	41.2	7%	0.067	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	156.9	178.7	-67.1	-86.9	0	0	0	111	S556 I564 R584 L585 R592	S556-Y566 PolarHBondContact N-O 3.43Å; I564-Y566 HydrophobicContact CB-CE2 3.86Å; I564-Y566 HydrophobicContact CG2-CD2 4.44Å; I564-Y566 HydrophobicContact CG2-CE1 4.31Å; I564-Y566 HydrophobicContact CG2-CE2 3.84Å; Y566-R584 HydrophobicContact CD1-CB 3.92Å; Y566-R584 HydrophobicContact CG-CB 4.14Å; Y566-L585 WeakPolarHBondContact CA-O 3.31Å; Y566-R592 HydrophobicContact CD1-CB 4.35Å; Y566-R592 HydrophobicContact CE1-CB 3.57Å; Y566-R592 HydrophobicContact CE2-CB 4.44Å
567	T	83.8	Confident	75	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	160.7	173.6	60.1	0	0	0	0	111.5	L555 D569 R584 L585 Y1207	L555-T567 HydrophobicContact CD2-CG2 4.29Å; T567-D569 PolarHBondContact O-N 2.9Å; T567-R584 PolarHBondContact O-NE 2.98Å; T567-R584 PolarHBondContact O-NH2 2.82Å; T567-L585 PolarHBondContact N-O 2.74Å; T567-L585 PolarHBondContact OG1-O 3.09Å; T567-Y1207 HydrophobicContact CG2-CD1 4.34Å; T567-Y1207 HydrophobicContact CG2-CE1 3.65Å; T567-Y1207 PolarHBondContact OG1-OH 3.41Å; T567-Y1207 VanDerWaalsContact OG1-OH 3.07Å
568	D	84.3	Confident	77.2	Confident	49 Å²	49	36.3 Å²	36.3	26%	0.262	23%	0.227	S	C	.	.	S	Bend	trans	-83.2	27.5	167.9	-63.5	-41.6	0	0	0	112.3	V500 L505 S556 R584	V500-D568 WeakPolarHBondContact CB-O 3.26Å; V500-D568 PolarHBondContact N-O 3.41Å; L505-D568 HydrophobicContact CD1-CB 3.69Å; S556-D568 WeakPolarHBondContact CB-OD1 3.35Å; S556-D568 PolarHBondContact OG-OD1 2.96Å; D568-R584 IonicContact OD1-NH2 2.76Å; D568-R584 PolarHBondContact OD1-NH2 3Å
569	D	89.3	Confident	79.3	Confident	10 Å²	10	34.8 Å²	34.8	5%	0.053	22%	0.216	C	C	.	.			trans	-112.3	150.7	176	-60.6	-14.9	0	0	0	109	L496 I497 T498 Q499 T567 Y1207	L496-D569 HydrophobicContact CD1-CB 4.39Å; I497-D569 CarbonylContact O-C 3.56Å; I497-D569 WeakPolarHBondContact O-CA 3.44Å; T498-D569 VanDerWaalsContact CA-OD1 3.24Å; T498-D569 WeakPolarHBondContact CA-OD1 3.42Å; Q499-D569 PolarHBondContact N-OD1 3.24Å; T567-D569 PolarHBondContact O-N 2.9Å; D569-Y1207 WeakPolarHBondContact CB-OH 3.25Å; D569-Y1207 PolarHBondContact OD2-OH 3.01Å
570	L	93.9	Very high	81.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.3	178.8	-70.2	171.2	0	0	0	110.8	I497 V500 L505 L508 L572 F582 W583 R584 I594 L647	I497-L570 PolarHBondContact N-O 3.31Å; I497-L570 PolarHBondContact O-N 2.7Å; V500-L570 HydrophobicContact CB-CD1 4.48Å; V500-L570 HydrophobicContact CG1-CD1 3.91Å; V500-L570 HydrophobicContact CG2-CB 4.18Å; V500-L570 HydrophobicContact CG2-CD1 4Å; V500-L570 HydrophobicContact CG2-CG 3.96Å; L505-L570 HydrophobicContact CD2-CD1 4.05Å; L505-L570 HydrophobicContact CD2-CD2 3.86Å; L505-L570 HydrophobicContact CD2-CG 3.87Å; L508-L570 HydrophobicContact CD1-CD1 3.67Å; L570-L572 HydrophobicContact CB-CD2 4.04Å; L570-L572 HydrophobicContact CD1-CD2 4.5Å; L570-F582 HydrophobicContact CD1-CD1 4.3Å; L570-W583 WeakPolarHBondContact CA-O 3.21Å; L570-R584 HydrophobicContact CD2-CG 3.9Å; L570-I594 HydrophobicContact CD2-CD1 3.86Å; L570-I594 HydrophobicContact CD2-CG1 4.49Å; L570-L647 HydrophobicContact CD1-CD2 4.23Å
571	L	96.6	Very high	84.1	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	122.6	156.7	165.8	66.6	0	0	0	106.7	L486 T573 W583 L585 L591 L1180 L1188	L486-L571 HydrophobicContact CD2-CD2 4.11Å; L571-T573 HydrophobicContact CD1-CG2 4.37Å; L571-T573 HydrophobicContact CD2-CG2 4.45Å; L571-T573 HydrophobicContact CG-CG2 4.23Å; L571-W583 HydrophobicContact CB-CB 4.13Å; L571-W583 HydrophobicContact CD2-CB 4.48Å; L571-W583 HydrophobicContact CG-CB 4.43Å; L571-W583 PolarHBondContact N-O 3.03Å; L571-W583 WeakPolarHBondContact O-CB 3.5Å; L571-W583 PolarHBondContact O-N 3.49Å; L571-L585 HydrophobicContact CB-CD1 3.81Å; L571-L585 HydrophobicContact CB-CD2 4.3Å; L571-L585 HydrophobicContact CB-CG 4.25Å; L571-L591 HydrophobicContact CD2-CD1 4.23Å; L571-L591 HydrophobicContact CD2-CD2 4.44Å; L571-L1180 HydrophobicContact CD1-CD1 3.86Å; L571-L1188 HydrophobicContact CD1-CD1 3.95Å; L571-L1188 HydrophobicContact CD2-CD1 4.05Å
572	L	97.2	Very high	86.5	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.9	171.8	-54.8	-177.3	0	0	0	108.3	Y494 N495 I497 L570 F582 I645 L647	Y494-L572 CarbonylContact C-O 3.56Å; Y494-L572 WeakPolarHBondContact CA-O 3.29Å; Y494-L572 WeakPolarHBondContact CB-O 3.19Å; N495-L572 PolarHBondContact N-O 3.39Å; N495-L572 PolarHBondContact O-N 2.7Å; I497-L572 HydrophobicContact CG1-CD1 3.7Å; I497-L572 HydrophobicContact CG1-CG 4.02Å; L570-L572 HydrophobicContact CB-CD2 4.04Å; L570-L572 HydrophobicContact CD1-CD2 4.5Å; L572-F582 HydrophobicContact CD2-CB 4.36Å; L572-F582 HydrophobicContact CD2-CD1 3.31Å; L572-F582 HydrophobicContact CD2-CE1 3.62Å; L572-F582 HydrophobicContact CD2-CG 3.89Å; L572-F582 HydrophobicContact CD2-CZ 4.41Å; L572-I645 HydrophobicContact CB-CD1 4.26Å; L572-I645 HydrophobicContact CB-CG2 4.24Å; L572-I645 HydrophobicContact CD1-CG2 3.62Å; L572-L647 HydrophobicContact CD1-CB 3.8Å; L572-L647 HydrophobicContact CD1-CD2 3.87Å; L572-L647 HydrophobicContact CD1-CG 4.49Å
573	T	97.4	Very high	88.7	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137	171.4	58.3	0	0	0	0	110.2	L486 L491 L571 H575 V580 A581 W583	L486-T573 HydrophobicContact CD2-CG2 4.23Å; L491-T573 HydrophobicContact CD2-CG2 3.85Å; L571-T573 HydrophobicContact CD1-CG2 4.37Å; L571-T573 HydrophobicContact CD2-CG2 4.45Å; L571-T573 HydrophobicContact CG-CG2 4.23Å; T573-H575 PolarHBondContact OG1-NE2 3.21Å; T573-V580 CarbonylContact O-C 3.52Å; T573-V580 VanDerWaalsContact O-CA 3.29Å; T573-V580 WeakPolarHBondContact O-CA 3.45Å; T573-A581 PolarHBondContact N-O 3.42Å; T573-A581 PolarHBondContact O-N 3.3Å; T573-W583 PolarHBondContact OG1-NE1 2.84Å
574	G	96.3	Very high	90.2	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.1	171.4	0	0	0	0	0	109.6	T492 T493	T492-G574 PolarHBondContact N-O 3.08Å; T492-G574 VanDerWaalsContact OG1-C 3.3Å; T492-G574 PolarHBondContact OG1-O 3.49Å; T493-G574 PolarHBondContact N-O 3.06Å; T493-G574 PolarHBondContact O-N 3.42Å
575	H	94.3	Very high	91.3	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	164.8	-165.9	-68.5	-96.4	0	0	0	112.5	L486 T489 S490 T573 D577 G578 S579 A641 I642	L486-H575 PolarHBondContact O-CE1 2.79Å; L486-H575 VanDerWaalsContact O-CE1 3.25Å; T489-H575 PolarHBondContact O-ND1 3.29Å; T489-H575 WeakPolarHBondContact OG1-CB 3.21Å; S490-H575 WeakPolarHBondContact O-CA 3.29Å; T573-H575 PolarHBondContact OG1-NE2 3.21Å; H575-D577 WeakPolarHBondContact CB-OD1 3.48Å; H575-G578 PolarHBondContact O-N 3.02Å; H575-S579 WeakPolarHBondContact CB-OG 3.26Å; H575-S579 PolarHBondContact CD2-OG 3.39Å; H575-S579 PolarHBondContact N-O 3.28Å; H575-A641 WeakPolarHBondContact O-CA 3.21Å; H575-I642 PolarHBondContact O-N 3.14Å
576	E	92.1	Very high	91.9	Very high	46 Å²	46	9.1 Å²	9.1	22%	0.215	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-27.1	-178.8	-168	161	-144.1	0	0	113.2	S490 T492 G578 M635 A641	S490-E576 WeakPolarHBondContact CB-OE2 3.33Å; S490-E576 PolarHBondContact O-N 2.78Å; S490-E576 VanDerWaalsContact O-N 3.13Å; S490-E576 PolarHBondContact OG-OE2 3.27Å; T492-E576 HydrophobicContact CG2-CB 3.96Å; E576-G578 PolarHBondContact O-N 2.88Å; E576-M635 HydrophobicContact CG-CE 4.48Å; E576-M635 HydrophobicContact CG-CG 4.08Å; E576-M635 HydrophobicContact CG-SD 4.47Å; E576-M635 VanDerWaalsContact OE1-CE 3.27Å; E576-M635 WeakPolarHBondContact OE1-CE 3.49Å; E576-A641 HydrophobicContact CB-CB 4.46Å; E576-A641 HydrophobicContact CG-CB 4.11Å; E576-A641 WeakPolarHBondContact O-CA 3.33Å; E576-A641 WeakPolarHBondContact O-CB 3.45Å; E576-A641 PolarHBondContact O-N 3.04Å
577	D	89.4	Confident	92	Very high	50 Å²	50	9 Å²	9	27%	0.267	5%	0.05	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-0	170.7	70.5	-13	0	0	0	114.4	T489 H575 S579 V640	T489-D577 HydrophobicContact CG2-CB 4.17Å; T489-D577 PolarHBondContact OG1-OD1 2.87Å; H575-D577 WeakPolarHBondContact CB-OD1 3.48Å; D577-S579 VanDerWaalsContact C-N 3.33Å; D577-S579 WeakPolarHBondContact OD1-CB 3.37Å; D577-S579 PolarHBondContact OD1-N 2.89Å; D577-S579 PolarHBondContact OD1-OG 3.33Å; D577-S579 PolarHBondContact OD2-OG 2.92Å; D577-V640 WeakPolarHBondContact O-CG2 3.22Å
578	G	92.1	Very high	92	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.049	C	C	.	.	S	Bend	trans	76.5	16	-175.4	0	0	0	0	0	114.5	H575 E576 T599 V640	H575-G578 PolarHBondContact O-N 3.02Å; E576-G578 PolarHBondContact O-N 2.88Å; G578-T599 WeakPolarHBondContact O-CB 3.37Å; G578-T599 WeakPolarHBondContact O-CG2 3.48Å; G578-T599 PolarHBondContact O-N 3.47Å; G578-T599 PolarHBondContact O-OG1 2.88Å; G578-V640 VanDerWaalsContact CA-O 3.31Å; G578-V640 WeakPolarHBondContact CA-O 3.31Å
579	S	92.3	Very high	92.2	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.007	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	152	170.3	72.4	0	0	0	0	112.6	H575 D577 L597 I642	H575-S579 WeakPolarHBondContact CB-OG 3.26Å; H575-S579 PolarHBondContact CD2-OG 3.39Å; H575-S579 PolarHBondContact N-O 3.28Å; D577-S579 VanDerWaalsContact C-N 3.33Å; D577-S579 WeakPolarHBondContact OD1-CB 3.37Å; D577-S579 PolarHBondContact OD1-N 2.89Å; D577-S579 PolarHBondContact OD1-OG 3.33Å; D577-S579 PolarHBondContact OD2-OG 2.92Å; S579-L597 CarbonylContact C-O 3.56Å; S579-L597 WeakPolarHBondContact CA-O 3.35Å; S579-I642 WeakPolarHBondContact O-CG1 3.45Å
580	V	95.5	Very high	92.3	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.035	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	111.8	169.6	177.4	0	0	0	0	108.6	T573 F582 L597 I642 I645 V654	T573-V580 CarbonylContact O-C 3.52Å; T573-V580 VanDerWaalsContact O-CA 3.29Å; T573-V580 WeakPolarHBondContact O-CA 3.45Å; V580-F582 HydrophobicContact CB-CE2 4.44Å; V580-F582 HydrophobicContact CG1-CD2 4.43Å; V580-F582 HydrophobicContact CG1-CE2 3.81Å; V580-F582 HydrophobicContact CG1-CZ 4.23Å; V580-L597 HydrophobicContact CB-CB 4.33Å; V580-L597 PolarHBondContact N-O 3.21Å; V580-L597 PolarHBondContact O-N 3.34Å; V580-I642 HydrophobicContact CG2-CD1 4.22Å; V580-I642 HydrophobicContact CG2-CG1 3.88Å; V580-I642 HydrophobicContact CG2-CG2 4.25Å; V580-I645 HydrophobicContact CB-CD1 4.49Å; V580-I645 HydrophobicContact CG1-CD1 3.7Å; V580-I645 HydrophobicContact CG1-CG1 4.24Å; V580-I645 HydrophobicContact CG1-CG2 4.48Å; V580-I645 HydrophobicContact CG2-CD1 4.13Å; V580-I645 HydrophobicContact CG2-CG1 4.19Å; V580-V654 HydrophobicContact CG2-CG1 3.92Å; V580-V654 HydrophobicContact CG2-CG2 4.17Å
581	A	94.8	Very high	92.2	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.036	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	138.4	179.4	0	0	0	0	0	111.6	T573 W583 R593	T573-A581 PolarHBondContact N-O 3.42Å; T573-A581 PolarHBondContact O-N 3.3Å; A581-W583 HydrophobicContact CB-CZ2 4.05Å; A581-R593 HydrophobicContact CB-CG 4.5Å
582	F	95.8	Very high	91.9	Very high	2 Å²	2	9.4 Å²	9.4	1%	0.009	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.3	-177.9	-67.6	-108.1	0	0	0	108.6	L508 L570 L572 V580 I594 Y595 L597 L652 L719	L508-F582 HydrophobicContact CD1-CD1 3.74Å; L508-F582 HydrophobicContact CD1-CE1 4.21Å; L508-F582 HydrophobicContact CD2-CD1 3.68Å; L508-F582 HydrophobicContact CD2-CD2 4.43Å; L508-F582 HydrophobicContact CD2-CE1 3.91Å; L508-F582 HydrophobicContact CD2-CG 3.98Å; L508-F582 HydrophobicContact CD2-CZ 4.39Å; L508-F582 HydrophobicContact CG-CD1 4.4Å; L570-F582 HydrophobicContact CD1-CD1 4.3Å; L572-F582 HydrophobicContact CD2-CB 4.36Å; L572-F582 HydrophobicContact CD2-CD1 3.31Å; L572-F582 HydrophobicContact CD2-CE1 3.62Å; L572-F582 HydrophobicContact CD2-CG 3.89Å; L572-F582 HydrophobicContact CD2-CZ 4.41Å; V580-F582 HydrophobicContact CB-CE2 4.44Å; V580-F582 HydrophobicContact CG1-CD2 4.43Å; V580-F582 HydrophobicContact CG1-CE2 3.81Å; V580-F582 HydrophobicContact CG1-CZ 4.23Å; F582-I594 HydrophobicContact CB-CG1 3.97Å; F582-I594 WeakPolarHBondContact O-CG1 3.3Å; F582-I594 PolarHBondContact O-N 3.06Å; F582-Y595 WeakPolarHBondContact CB-O 3.47Å; F582-Y595 AromaticContact CD2-CD1 3.8Å; F582-Y595 HydrophobicContact CD2-CD1 3.8Å; F582-Y595 AromaticContact CE2-CD1 3.97Å; F582-Y595 HydrophobicContact CE2-CD1 3.97Å; F582-Y595 HydrophobicContact CG-CD1 4.5Å; F582-Y595 PolarHBondContact N-O 3.28Å; F582-L597 HydrophobicContact CE2-CB 4.17Å; F582-L652 HydrophobicContact CE1-CD1 4.5Å; F582-L652 HydrophobicContact CZ-CD1 4.1Å; F582-L652 HydrophobicContact CZ-CD2 3.86Å; F582-L719 HydrophobicContact CE1-CD1 4.32Å; F582-L719 HydrophobicContact CE2-CD1 4.16Å; F582-L719 HydrophobicContact CZ-CD1 3.7Å
583	W	94.8	Very high	91.6	Very high	2 Å²	2	10.1 Å²	10.1	1%	0.008	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128	-174.3	-51.6	87.7	0	0	0	111.1	T484 L486 L570 L571 T573 A581 L591 R592 R593	T484-W583 HydrophobicContact CG2-CH2 4.28Å; T484-W583 HydrophobicContact CG2-CZ3 3.75Å; L486-W583 HydrophobicContact CD2-CD2 4.1Å; L486-W583 HydrophobicContact CD2-CH2 4.37Å; L486-W583 HydrophobicContact CD2-CZ2 3.94Å; L570-W583 WeakPolarHBondContact CA-O 3.21Å; L571-W583 HydrophobicContact CB-CB 4.13Å; L571-W583 HydrophobicContact CD2-CB 4.48Å; L571-W583 HydrophobicContact CG-CB 4.43Å; L571-W583 PolarHBondContact N-O 3.03Å; L571-W583 WeakPolarHBondContact O-CB 3.5Å; L571-W583 PolarHBondContact O-N 3.49Å; T573-W583 PolarHBondContact OG1-NE1 2.84Å; A581-W583 HydrophobicContact CB-CZ2 4.05Å; W583-L591 HydrophobicContact CB-CD1 3.82Å; W583-L591 HydrophobicContact CB-CD2 4.17Å; W583-L591 HydrophobicContact CB-CG 3.97Å; W583-L591 HydrophobicContact CD2-CD2 3.73Å; W583-L591 HydrophobicContact CD2-CG 4.24Å; W583-L591 HydrophobicContact CE3-CD2 3.41Å; W583-L591 VanDerWaalsContact CE3-CD2 3.41Å; W583-L591 HydrophobicContact CE3-CG 3.75Å; W583-L591 HydrophobicContact CG-CD2 4.08Å; W583-L591 HydrophobicContact CG-CG 4.38Å; W583-L591 HydrophobicContact CZ3-CD2 3.98Å; W583-R592 CarbonylContact C-O 3.52Å; W583-R592 WeakPolarHBondContact CA-O 3.28Å; W583-R593 HydrophobicContact CD2-CB 4.28Å; W583-R593 HydrophobicContact CE3-CB 3.66Å; W583-R593 HydrophobicContact CE3-CG 4.36Å; W583-R593 HydrophobicContact CH2-CB 4.13Å; W583-R593 HydrophobicContact CH2-CG 4.43Å; W583-R593 HydrophobicContact CZ3-CB 3.59Å; W583-R593 HydrophobicContact CZ3-CG 4.32Å
584	R	91.9	Very high	91.2	Very high	1 Å²	1	10.3 Å²	10.3	0%	0.004	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	139.9	165	-67.1	-171.5	76	-179.2	4.8	109.7	E509 S556 S558 Y566 T567 D568 L570 L591 R592 I594	E509-R584 VanDerWaalsContact OE1-CD 3.26Å; E509-R584 WeakPolarHBondContact OE1-CD 3.5Å; E509-R584 IonicContact OE1-CZ 3.66Å; E509-R584 IonicContact OE1-NE 3.95Å; E509-R584 IonicContact OE1-NH1 3.58Å; E509-R584 PolarHBondContact OE1-NH1 3.35Å; E509-R584 IonicContact OE2-NH1 2.68Å; S556-R584 VanDerWaalsContact CB-NH2 3.31Å; S556-R584 PolarHBondContact OG-NH2 2.92Å; S558-R584 PolarHBondContact OG-NH1 3.35Å; Y566-R584 HydrophobicContact CD1-CB 3.92Å; Y566-R584 HydrophobicContact CG-CB 4.14Å; T567-R584 PolarHBondContact O-NE 2.98Å; T567-R584 PolarHBondContact O-NH2 2.82Å; D568-R584 IonicContact OD1-NH2 2.76Å; D568-R584 PolarHBondContact OD1-NH2 3Å; L570-R584 HydrophobicContact CD2-CG 3.9Å; R584-L591 WeakPolarHBondContact O-CA 3.42Å; R584-R592 PolarHBondContact N-O 3.45Å; R584-R592 PolarHBondContact O-N 2.93Å; R584-I594 HydrophobicContact CB-CG2 4.26Å; R584-I594 HydrophobicContact CG-CD1 3.95Å; R584-I594 HydrophobicContact CG-CG1 4.38Å; R584-I594 HydrophobicContact CG-CG2 3.76Å
585	L	91	Very high	91	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.005	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	153.4	-176.4	-57.7	100.9	0	0	0	110.8	Y41 L496 Y566 T567 L571 L591 Y1207	Y41-L585 HydrophobicContact CD1-CD2 4.26Å; Y41-L585 HydrophobicContact CD2-CD2 4.13Å; Y41-L585 HydrophobicContact CE1-CB 4.29Å; Y41-L585 HydrophobicContact CE1-CD2 4.06Å; Y41-L585 HydrophobicContact CE2-CD2 3.9Å; Y41-L585 HydrophobicContact CG-CD2 4.32Å; L496-L585 HydrophobicContact CD1-CD1 3.73Å; Y566-L585 WeakPolarHBondContact CA-O 3.31Å; T567-L585 PolarHBondContact N-O 2.74Å; T567-L585 PolarHBondContact OG1-O 3.09Å; L571-L585 HydrophobicContact CB-CD1 3.81Å; L571-L585 HydrophobicContact CB-CD2 4.3Å; L571-L585 HydrophobicContact CB-CG 4.25Å; L585-L591 HydrophobicContact CB-CD1 4.38Å; L585-L591 HydrophobicContact CD2-CD1 4.16Å; L585-L591 HydrophobicContact CG-CD1 3.74Å; L585-Y1207 HydrophobicContact CB-CD1 4.33Å; L585-Y1207 HydrophobicContact CB-CE1 3.66Å; L585-Y1207 HydrophobicContact CD2-CE1 4.37Å; L585-Y1207 HydrophobicContact CG-CE1 4.44Å
586	S	86.9	Confident	90.8	Very high	8 Å²	8	11.3 Å²	11.3	6%	0.056	6%	0.056	C	C	.	.			trans	-138	175.7	168.9	-173.8	0	0	0	0	109.4	Y41 L565 C590	Y41-S586 VanDerWaalsContact CE1-O 3.27Å; Y41-S586 WeakPolarHBondContact CE1-O 3.33Å; Y41-S586 PolarHBondContact OH-O 3.44Å; L565-S586 WeakPolarHBondContact O-CB 3.47Å; L565-S586 PolarHBondContact O-OG 2.79Å; S586-C590 PolarHBondContact N-O 2.9Å
587	A	83.2	Confident	90.8	Very high	16 Å²	16	9.5 Å²	9.5	13%	0.132	5%	0.047	C	C	.	.	S	Bend	trans	-64.1	163.5	173.7	0	0	0	0	0	111.7	G75 G589 C590	G75-A587 WeakPolarHBondContact CA-O 3.17Å; A587-G589 PolarHBondContact O-N 3.19Å; A587-C590 WeakPolarHBondContact O-CB 3.24Å; A587-C590 PolarHBondContact O-N 2.99Å
588	G	83.8	Confident	90.9	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	32.5	172.6	0	0	0	0	0	114.6	S39 S77 C590	S39-G588 PolarHBondContact OG-N 3.2Å; S77-G588 WeakPolarHBondContact OG-CA 3.42Å; G588-C590 PolarHBondContact O-N 3.34Å
589	G	88	Confident	90.8	Very high	3 Å²	3	9.4 Å²	9.4	3%	0.031	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	10.6	-176.9	0	0	0	0	0	114.9	S39 D40 Y41 A587	S39-G589 PolarHBondContact OG-N 3.49Å; D40-G589 WeakPolarHBondContact O-CA 3.47Å; Y41-G589 VanDerWaalsContact CD1-C 3.47Å; Y41-G589 WeakPolarHBondContact CD1-O 3.35Å; A587-G589 PolarHBondContact O-N 3.19Å
590	C	91.5	Very high	90.7	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.048	C	C	.	.			trans	-76.9	133.9	-174.8	-73.6	0	0	0	0	113.3	Y41 G75 P481 S586 A587 G588	Y41-C590 WeakPolarHBondContact CE1-O 3.47Å; G75-C590 PolarHBondContact N-SG 2.96Å; P481-C590 CarbonylContact O-C 3.22Å; P481-C590 WeakPolarHBondContact O-CA 3.34Å; P481-C590 WeakPolarHBondContact O-CB 3.32Å; S586-C590 PolarHBondContact N-O 2.9Å; A587-C590 WeakPolarHBondContact O-CB 3.24Å; A587-C590 PolarHBondContact O-N 2.99Å; G588-C590 PolarHBondContact O-N 3.34Å
591	L	91.2	Very high	90.2	Very high	3 Å²	3	13.6 Å²	13.6	2%	0.016	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	137.4	-171.9	-162	75.9	0	0	0	111.4	Y41 P481 L486 L571 W583 R584 L585	Y41-L591 HydrophobicContact CD1-CB 4.38Å; Y41-L591 HydrophobicContact CD1-CD1 4.12Å; P481-L591 PolarHBondContact O-N 2.85Å; L486-L591 HydrophobicContact CD1-CD2 4.5Å; L486-L591 HydrophobicContact CD2-CD2 3.38Å; L486-L591 HydrophobicContact CG-CD2 3.98Å; L571-L591 HydrophobicContact CD2-CD1 4.23Å; L571-L591 HydrophobicContact CD2-CD2 4.44Å; W583-L591 HydrophobicContact CB-CD1 3.82Å; W583-L591 HydrophobicContact CB-CD2 4.17Å; W583-L591 HydrophobicContact CB-CG 3.97Å; W583-L591 HydrophobicContact CD2-CD2 3.73Å; W583-L591 HydrophobicContact CD2-CG 4.24Å; W583-L591 HydrophobicContact CE3-CD2 3.41Å; W583-L591 VanDerWaalsContact CE3-CD2 3.41Å; W583-L591 HydrophobicContact CE3-CG 3.75Å; W583-L591 HydrophobicContact CG-CD2 4.08Å; W583-L591 HydrophobicContact CG-CG 4.38Å; W583-L591 HydrophobicContact CZ3-CD2 3.98Å; R584-L591 WeakPolarHBondContact O-CA 3.42Å; L585-L591 HydrophobicContact CB-CD1 4.38Å; L585-L591 HydrophobicContact CD2-CD1 4.16Å; L585-L591 HydrophobicContact CG-CD1 3.74Å
592	R	89.5	Confident	89.9	Confident	63 Å²	63	14.2 Å²	14.2	24%	0.238	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121.5	176.8	-173.5	174.5	92.2	107.3	-5.2	111.2	E509 Y566 W583 R584 I594	E509-R592 VanDerWaalsContact CD-NH2 3.34Å; E509-R592 IonicContact OE1-CZ 2.76Å; E509-R592 IonicContact OE1-NH2 3.73Å; E509-R592 PolarHBondContact OE1-NH2 2.81Å; Y566-R592 HydrophobicContact CD1-CB 4.35Å; Y566-R592 HydrophobicContact CE1-CB 3.57Å; Y566-R592 HydrophobicContact CE2-CB 4.44Å; W583-R592 CarbonylContact C-O 3.52Å; W583-R592 WeakPolarHBondContact CA-O 3.28Å; R584-R592 PolarHBondContact N-O 3.45Å; R584-R592 PolarHBondContact O-N 2.93Å; R592-I594 HydrophobicContact CG-CG2 4.41Å; R592-I594 PolarHBondContact O-N 3.1Å
593	R	91	Very high	89.6	Confident	17 Å²	17	14.1 Å²	14.1	6%	0.064	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	116.7	166.6	-166	147.7	63.8	161.1	-13.7	108.2	P517 E518 A581 W583 T596	P517-R593 HydrophobicContact CB-CB 4.35Å; P517-R593 HydrophobicContact CB-CG 4.1Å; P517-R593 WeakPolarHBondContact CB-O 3.49Å; P517-R593 PolarHBondContact O-NE 3.07Å; E518-R593 VanDerWaalsContact CD-NH2 3.3Å; E518-R593 IonicContact OE2-CZ 2.67Å; E518-R593 IonicContact OE2-NE 2.67Å; E518-R593 IonicContact OE2-NH2 3.99Å; E518-R593 PolarHBondContact OE2-NH2 3.06Å; A581-R593 HydrophobicContact CB-CG 4.5Å; W583-R593 HydrophobicContact CD2-CB 4.28Å; W583-R593 HydrophobicContact CE3-CB 3.66Å; W583-R593 HydrophobicContact CE3-CG 4.36Å; W583-R593 HydrophobicContact CH2-CB 4.13Å; W583-R593 HydrophobicContact CH2-CG 4.43Å; W583-R593 HydrophobicContact CZ3-CB 3.59Å; W583-R593 HydrophobicContact CZ3-CG 4.32Å; R593-T596 WeakPolarHBondContact CD-OG1 3.38Å; R593-T596 PolarHBondContact NH1-OG1 2.99Å
594	I	90.2	Very high	89.2	Confident	3 Å²	3	18 Å²	18	2%	0.015	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-29.9	177.4	64.8	164.5	0	0	0	112.1	L508 E509 G512 L570 F582 R584 R592	L508-I594 HydrophobicContact CB-CD1 3.62Å; L508-I594 HydrophobicContact CB-CG1 4.41Å; L508-I594 HydrophobicContact CD1-CD1 4.24Å; E509-I594 HydrophobicContact CG-CB 4.31Å; E509-I594 HydrophobicContact CG-CD1 4.06Å; E509-I594 HydrophobicContact CG-CG2 4.3Å; G512-I594 WeakPolarHBondContact CA-O 3.28Å; L570-I594 HydrophobicContact CD2-CD1 3.86Å; L570-I594 HydrophobicContact CD2-CG1 4.49Å; F582-I594 HydrophobicContact CB-CG1 3.97Å; F582-I594 WeakPolarHBondContact O-CG1 3.3Å; F582-I594 PolarHBondContact O-N 3.06Å; R584-I594 HydrophobicContact CB-CG2 4.26Å; R584-I594 HydrophobicContact CG-CD1 3.95Å; R584-I594 HydrophobicContact CG-CG1 4.38Å; R584-I594 HydrophobicContact CG-CG2 3.76Å; R592-I594 HydrophobicContact CG-CG2 4.41Å; R592-I594 PolarHBondContact O-N 3.1Å
595	Y	90.8	Very high	88.2	Confident	12 Å²	12	21.7 Å²	21.7	5%	0.047	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	150.1	-179.7	-175.4	-106	0	0	0	109.8	L508 A511 F582 L597 L719	L508-Y595 HydrophobicContact CD2-CD1 3.82Å; L508-Y595 HydrophobicContact CD2-CG 4.03Å; A511-Y595 HydrophobicContact CB-CD2 3.84Å; A511-Y595 HydrophobicContact CB-CE2 3.69Å; F582-Y595 WeakPolarHBondContact CB-O 3.47Å; F582-Y595 AromaticContact CD2-CD1 3.8Å; F582-Y595 HydrophobicContact CD2-CD1 3.8Å; F582-Y595 AromaticContact CE2-CD1 3.97Å; F582-Y595 HydrophobicContact CE2-CD1 3.97Å; F582-Y595 HydrophobicContact CG-CD1 4.5Å; F582-Y595 PolarHBondContact N-O 3.28Å; Y595-L597 HydrophobicContact CE1-CB 3.96Å; Y595-L597 HydrophobicContact CE1-CD1 4.44Å; Y595-L719 HydrophobicContact CD1-CD1 4.22Å; Y595-L719 HydrophobicContact CE1-CB 4.22Å; Y595-L719 HydrophobicContact CE1-CD1 3.82Å; Y595-L719 HydrophobicContact CE1-CG 4.4Å
596	T	91.4	Very high	87.1	Confident	9 Å²	9	22.2 Å²	22.2	6%	0.055	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126.9	170	-59.6	0	0	0	0	109.2	P517 R593 Y598	P517-T596 WeakPolarHBondContact O-CB 3.47Å; P517-T596 PolarHBondContact O-OG1 3.02Å; R593-T596 WeakPolarHBondContact CD-OG1 3.38Å; R593-T596 PolarHBondContact NH1-OG1 2.99Å; T596-Y598 HydrophobicContact CG2-CD1 4.47Å; T596-Y598 HydrophobicContact CG2-CD2 4.15Å; T596-Y598 HydrophobicContact CG2-CE1 4.01Å; T596-Y598 HydrophobicContact CG2-CE2 3.65Å
597	L	92.1	Very high	85.7	Confident	8 Å²	8	25.5 Å²	25.5	4%	0.042	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	111.7	174.9	179	65.1	0	0	0	109.5	S579 V580 F582 Y595 T599 L652 Y664 L719	S579-L597 CarbonylContact C-O 3.56Å; S579-L597 WeakPolarHBondContact CA-O 3.35Å; V580-L597 HydrophobicContact CB-CB 4.33Å; V580-L597 PolarHBondContact N-O 3.21Å; V580-L597 PolarHBondContact O-N 3.34Å; F582-L597 HydrophobicContact CE2-CB 4.17Å; Y595-L597 HydrophobicContact CE1-CB 3.96Å; Y595-L597 HydrophobicContact CE1-CD1 4.44Å; L597-T599 HydrophobicContact CG-CG2 4.42Å; L597-L652 HydrophobicContact CD2-CD2 3.43Å; L597-L652 VanDerWaalsContact CD2-CD2 3.43Å; L597-Y664 HydrophobicContact CD1-CD1 4.09Å; L597-Y664 HydrophobicContact CD1-CE1 3.74Å; L597-Y664 HydrophobicContact CD2-CD1 4Å; L597-Y664 HydrophobicContact CD2-CD2 3.79Å; L597-Y664 HydrophobicContact CD2-CE1 3.98Å; L597-Y664 HydrophobicContact CD2-CE2 3.72Å; L597-Y664 HydrophobicContact CD2-CG 3.92Å; L597-Y664 HydrophobicContact CG-CE1 4.28Å; L597-L719 HydrophobicContact CD1-CB 4.19Å
598	Y	90.2	Very high	84.1	Confident	48 Å²	48	28.9 Å²	28.9	19%	0.188	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	108.3	174.7	-64.6	-83.2	0	0	0	109.8	G519 T596 I601 L609	G519-Y598 PolarHBondContact N-OH 3.46Å; G519-Y598 VanDerWaalsContact N-OH 3.09Å; T596-Y598 HydrophobicContact CG2-CD1 4.47Å; T596-Y598 HydrophobicContact CG2-CD2 4.15Å; T596-Y598 HydrophobicContact CG2-CE1 4.01Å; T596-Y598 HydrophobicContact CG2-CE2 3.65Å; Y598-I601 WeakPolarHBondContact O-CD1 3.31Å; Y598-I601 WeakPolarHBondContact O-CG1 3.41Å; Y598-L609 HydrophobicContact CD1-CD1 3.59Å; Y598-L609 HydrophobicContact CE1-CD1 3.95Å; Y598-L609 HydrophobicContact CG-CD1 4.19Å
599	T	91.8	Very high	82.4	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.006	17%	0.169	C	C	.	.	S	Bend	trans	-81.8	-25.4	-179.3	73	0	0	0	0	112.9	G578 L597 I601 L602 F603 I642 V654 I662 Y664	G578-T599 WeakPolarHBondContact O-CB 3.37Å; G578-T599 WeakPolarHBondContact O-CG2 3.48Å; G578-T599 PolarHBondContact O-N 3.47Å; G578-T599 PolarHBondContact O-OG1 2.88Å; L597-T599 HydrophobicContact CG-CG2 4.42Å; T599-I601 PolarHBondContact O-N 3.07Å; T599-L602 PolarHBondContact O-N 2.89Å; T599-F603 WeakPolarHBondContact O-CE2 3.41Å; T599-I642 HydrophobicContact CG2-CD1 4.15Å; T599-V654 HydrophobicContact CG2-CG1 4.34Å; T599-I662 HydrophobicContact CG2-CD1 4.24Å; T599-Y664 HydrophobicContact CG2-CE2 4.16Å
600	A	88.5	Confident	80	Confident	11 Å²	11	38.4 Å²	38.4	9%	0.091	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-55.8	-32	179.8	0	0	0	0	0	113.6	L602 F603 V606 V640	A600-L602 PolarHBondContact O-N 2.63Å; A600-F603 PolarHBondContact O-N 2.81Å; A600-V606 HydrophobicContact CB-CG1 4.28Å; A600-V640 HydrophobicContact CB-CB 4.35Å; A600-V640 HydrophobicContact CB-CG1 4.09Å; A600-V640 HydrophobicContact CB-CG2 4.36Å
601	I	85.5	Confident	77.5	Confident	78 Å²	78	43.7 Å²	43.7	40%	0.4	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-55.2	-26.4	-178	71.6	-173.9	0	0	0	113.3	Y598 T599 F603 R698 F701	Y598-I601 WeakPolarHBondContact O-CD1 3.31Å; Y598-I601 WeakPolarHBondContact O-CG1 3.41Å; T599-I601 PolarHBondContact O-N 3.07Å; I601-F603 PolarHBondContact O-N 2.91Å; I601-R698 WeakPolarHBondContact O-CD 3.43Å; I601-R698 PolarHBondContact O-NE 3.14Å; I601-F701 HydrophobicContact CB-CZ 4.23Å; I601-F701 HydrophobicContact CD1-CZ 4.14Å; I601-F701 HydrophobicContact CG1-CZ 3.93Å; I601-F701 VanDerWaalsContact O-CE2 3.29Å; I601-F701 WeakPolarHBondContact O-CE2 3.27Å
602	L	88.5	Confident	75.1	Confident	13 Å²	13	45.9 Å²	45.9	7%	0.068	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-72.3	-12.9	-178.5	-62.8	179	0	0	0	113.7	T599 A600 I662 L697 R698 F701 A721 V724	T599-L602 PolarHBondContact O-N 2.89Å; A600-L602 PolarHBondContact O-N 2.63Å; L602-I662 HydrophobicContact CD1-CD1 4.05Å; L602-I662 HydrophobicContact CD1-CG2 4.13Å; L602-L697 HydrophobicContact CB-CD1 4.07Å; L602-L697 WeakPolarHBondContact O-CD1 3.43Å; L602-R698 PolarHBondContact O-N 2.93Å; L602-F701 HydrophobicContact CD2-CD2 4.35Å; L602-F701 HydrophobicContact CD2-CE2 4.21Å; L602-A721 HydrophobicContact CD1-CB 4.03Å; L602-V724 HydrophobicContact CD1-CG2 4.4Å
603	F	90.8	Very high	72.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-112	143.4	-167.9	-52	-64.8	0	0	0	113.6	T599 A600 I601 V606 V640 Q660 I662 L695 T696 R698 F726	T599-F603 WeakPolarHBondContact O-CE2 3.41Å; A600-F603 PolarHBondContact O-N 2.81Å; I601-F603 PolarHBondContact O-N 2.91Å; F603-V606 HydrophobicContact CB-CG2 3.92Å; F603-V640 HydrophobicContact CD2-CG1 4.04Å; F603-V640 HydrophobicContact CE2-CG1 4.47Å; F603-Q660 HydrophobicContact CZ-CB 4.37Å; F603-Q660 HydrophobicContact CZ-CG 4.1Å; F603-I662 HydrophobicContact CE2-CD1 4.46Å; F603-I662 HydrophobicContact CZ-CD1 4.1Å; F603-L695 HydrophobicContact CB-CD2 4.31Å; F603-L695 HydrophobicContact CD1-CB 3.71Å; F603-L695 HydrophobicContact CD1-CD1 4.39Å; F603-L695 HydrophobicContact CD2-CD1 4Å; F603-L695 HydrophobicContact CD2-CD2 4.5Å; F603-L695 HydrophobicContact CE1-CB 4.04Å; F603-L695 HydrophobicContact CE1-CD1 4.33Å; F603-L695 HydrophobicContact CE2-CD1 3.93Å; F603-L695 HydrophobicContact CG-CB 4.03Å; F603-L695 HydrophobicContact CG-CD1 4.23Å; F603-L695 HydrophobicContact CG-CD2 4.28Å; F603-L695 HydrophobicContact CG-CG 4.43Å; F603-L695 HydrophobicContact CZ-CD1 4.1Å; F603-T696 CarbonylContact C-O 3.57Å; F603-T696 WeakPolarHBondContact CA-O 3.25Å; F603-T696 WeakPolarHBondContact CB-O 3.34Å; F603-R698 PolarHBondContact O-NE 2.8Å; F603-R698 PolarHBondContact O-NH2 3.42Å; F603-F726 HydrophobicContact CD1-CZ 4.35Å; F603-F726 AromaticContact CE1-CE1 3.84Å; F603-F726 HydrophobicContact CE1-CE1 3.84Å; F603-F726 AromaticContact CE1-CZ 3.82Å; F603-F726 HydrophobicContact CE1-CZ 3.82Å
604	E	85.3	Confident	69.7	Low	82 Å²	82	52 Å²	52	38%	0.383	29%	0.29	S	S	.	.	S	Bend	trans	-74.3	-46.2	-178.8	-69.1	176.8	176.6	0	0	111.4	V606 T696 R698 K699	E604-V606 PolarHBondContact O-N 3.47Å; E604-V606 VanDerWaalsContact O-N 3.1Å; E604-T696 PolarHBondContact N-O 2.75Å; E604-T696 WeakPolarHBondContact OE2-CG2 3.28Å; E604-R698 HydrophobicContact CB-CG 4.48Å; E604-R698 HydrophobicContact CG-CB 4.2Å; E604-R698 HydrophobicContact CG-CG 3.62Å; E604-R698 WeakPolarHBondContact OE1-CA 3.47Å; E604-K699 PolarHBondContact OE1-N 3.4Å; E604-K699 VanDerWaalsContact OE1-N 3.14Å
605	D	71.5	Confident	67.6	Low	80 Å²	80	56.9 Å²	56.9	43%	0.428	32%	0.32	S	S	.	.	S	Bend	trans	-79.3	10.8	-169.4	-48.8	-54.2	0	0	0	114.9	R639 T696	D605-R639 VanDerWaalsContact CB-NH2 3.34Å; D605-R639 PolarHBondContact O-NH2 2.98Å; D605-R639 VanDerWaalsContact O-NH2 3.14Å; D605-R639 IonicContact OD2-NH1 3.12Å; D605-T696 WeakPolarHBondContact OD2-CB 3.12Å; D605-T696 PolarHBondContact OD2-N 3.36Å; D605-T696 PolarHBondContact OD2-OG1 2.55Å
606	V	68.4	Low	65.2	Low	12 Å²	12	62.4 Å²	62.4	7%	0.073	35%	0.35	C	S	.	.	S	Bend	trans	-110.7	115.8	179.8	-170.9	0	0	0	0	105.6	A600 F603 E604 Q608 D637 V640 L695	A600-V606 HydrophobicContact CB-CG1 4.28Å; F603-V606 HydrophobicContact CB-CG2 3.92Å; E604-V606 PolarHBondContact O-N 3.47Å; E604-V606 VanDerWaalsContact O-N 3.1Å; V606-Q608 PolarHBondContact O-N 2.68Å; V606-Q608 VanDerWaalsContact O-N 3.17Å; V606-D637 HydrophobicContact CG1-CB 4.47Å; V606-V640 HydrophobicContact CG1-CG1 4.33Å; V606-V640 HydrophobicContact CG2-CG1 3.61Å; V606-L695 HydrophobicContact CG2-CD2 3.87Å
607	S	55.7	Low	62.9	Low	77 Å²	77	68.3 Å²	68.3	54%	0.538	38%	0.381	S	S	.	.			trans	-45.7	125.8	169.1	40	0	0	0	0	107.4
608	Q	50.5	Low	60.7	Low	87 Å²	87	73 Å²	73	41%	0.407	41%	0.407	S	S	.	.			trans	-60.9	156.6	-172.8	-69.6	179.5	111.7	0	0	108.8	V606 D610 R698	V606-Q608 PolarHBondContact O-N 2.68Å; V606-Q608 VanDerWaalsContact O-N 3.17Å; Q608-D610 HydrophobicContact CB-CB 4.24Å; Q608-D610 PolarHBondContact NE2-OD1 2.73Å; Q608-D610 PolarHBondContact O-N 3.45Å; Q608-R698 VanDerWaalsContact CG-NH2 3.33Å
609	L	47.7	Very low	58.8	Low	88 Å²	88	74.3 Å²	74.3	46%	0.461	43%	0.434	S	S	.	.			trans	-60.9	63.4	136.1	-73.1	150.1	0	0	0	107.7	Y598 H611	Y598-L609 HydrophobicContact CD1-CD1 3.59Å; Y598-L609 HydrophobicContact CE1-CD1 3.95Å; Y598-L609 HydrophobicContact CG-CD1 4.19Å; L609-H611 PolarHBondContact O-N 2.98Å; L609-H611 VanDerWaalsContact O-N 3.11Å
610	D	37.4	Very low	56.9	Low	114 Å²	114	81.6 Å²	81.6	61%	0.61	47%	0.473	S	S	*	.			trans	-59.7	114.2	157.1	-78.2	-38.6	0	0	0	102.3	Q608	Q608-D610 HydrophobicContact CB-CB 4.24Å; Q608-D610 PolarHBondContact NE2-OD1 2.73Å; Q608-D610 PolarHBondContact O-N 3.45Å
611	H	39.8	Very low	56	Low	111 Å²	111	83.8 Å²	83.8	51%	0.514	49%	0.491	S	S	.	.			trans	-48.5	143.4	-174.7	-72.8	-91.1	0	0	0	108.9	L609 N613 G614	L609-H611 PolarHBondContact O-N 2.98Å; L609-H611 VanDerWaalsContact O-N 3.11Å; H611-N613 HydrophobicContact CB-CB 3.9Å; H611-N613 CarbonylContact O-C 3.52Å; H611-N613 PolarHBondContact O-N 2.81Å; H611-G614 PolarHBondContact O-N 2.99Å
612	P	40	Very low	55.8	Low	50 Å²	50	85 Å²	85	33%	0.325	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-60.6	6.2	168.1	25.7	-32.8	0	0	0	113.2	G614 V615	P612-G614 PolarHBondContact O-N 2.91Å; P612-G614 VanDerWaalsContact O-N 3.09Å; P612-V615 WeakPolarHBondContact O-CG2 3.12Å; P612-V615 PolarHBondContact O-N 3.49Å
613	N	34.3	Very low	55.8	Low	141 Å²	141	84.4 Å²	84.4	75%	0.754	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-58.5	-2.4	153.2	-56.3	24.8	0	0	0	113.6	H611	H611-N613 HydrophobicContact CB-CB 3.9Å; H611-N613 CarbonylContact O-C 3.52Å; H611-N613 PolarHBondContact O-N 2.81Å
614	G	33.8	Very low	55.6	Low	66 Å²	66	86.2 Å²	86.2	68%	0.68	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-104.7	25.5	162.7	0	0	0	0	0	114	H611 P612	H611-G614 PolarHBondContact O-N 2.99Å; P612-G614 PolarHBondContact O-N 2.91Å; P612-G614 VanDerWaalsContact O-N 3.09Å
615	V	44.7	Very low	55.7	Low	106 Å²	106	84.7 Å²	84.7	64%	0.642	49%	0.492	S	S	*	.	S	Bend	trans	-60.2	132.2	136.9	-160.3	0	0	0	0	104.6	P612 D617	P612-V615 WeakPolarHBondContact O-CG2 3.12Å; P612-V615 PolarHBondContact O-N 3.49Å; V615-D617 PolarHBondContact O-N 3.23Å
616	D	40.6	Very low	56.5	Low	128 Å²	128	81.4 Å²	81.4	68%	0.684	47%	0.473	S	S	*	.			trans	-53.2	114.3	161.2	-64.8	-63.3	0	0	0	106.4	D618	D616-D618 PolarHBondContact O-N 3.22Å
617	D	44.1	Very low	57.4	Low	133 Å²	133	85.9 Å²	85.9	71%	0.711	49%	0.493	S	S	*	.			trans	-74.6	52.6	171.2	-165.5	35.8	0	0	0	108.3	V615 G619	V615-D617 PolarHBondContact O-N 3.23Å; D617-G619 PolarHBondContact O-N 2.82Å
618	D	45.3	Very low	58.9	Low	108 Å²	108	82.3 Å²	82.3	58%	0.578	47%	0.468	S	S	*	.			trans	-62	89.5	156.4	-75.1	-18.7	0	0	0	104.9	D616 D620 A621	D616-D618 PolarHBondContact O-N 3.22Å; D618-D620 PolarHBondContact O-N 2.93Å; D618-A621 VanDerWaalsContact O-CB 3.3Å; D618-A621 WeakPolarHBondContact O-CB 3.49Å; D618-A621 PolarHBondContact O-N 2.96Å
619	G	50.1	Low	60.7	Low	74 Å²	74	78.7 Å²	78.7	76%	0.763	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-6.3	173.5	0	0	0	0	0	113.9	D617	D617-G619 PolarHBondContact O-N 2.82Å
620	D	53	Low	62.6	Low	155 Å²	155	75.9 Å²	75.9	83%	0.829	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	4.3	173.6	-61.6	-34.2	0	0	0	113.8	D618 W622	D618-D620 PolarHBondContact O-N 2.93Å; D620-W622 PolarHBondContact O-N 3.38Å
621	A	69.4	Low	65.2	Low	57 Å²	57	72 Å²	72	47%	0.471	42%	0.419	S	S	.	.			trans	-66.2	100.7	-178.3	0	0	0	0	0	112.4	D618 P623 P624	D618-A621 VanDerWaalsContact O-CB 3.3Å; D618-A621 WeakPolarHBondContact O-CB 3.49Å; D618-A621 PolarHBondContact O-N 2.96Å; A621-P623 CarbonylContact C-O 3.58Å; A621-P623 CarbonylContact O-C 3.54Å; A621-P624 WeakPolarHBondContact O-CA 3.36Å
622	W	81.2	Confident	67.5	Low	103 Å²	103	68 Å²	68	39%	0.39	40%	0.401	S	S	.	.	S	Bend	trans	-108.7	128.8	176.3	-174.5	-102.8	0	0	0	112.3	Y339 F425 H432 D620 P624	Y339-W622 AromaticContact CD1-CE2 3.88Å; Y339-W622 AromaticContact CD1-CZ2 3.77Å; Y339-W622 HydrophobicContact CD1-CZ2 3.77Å; Y339-W622 AromaticContact CD1-NE1 3.99Å; Y339-W622 HydrophobicContact CE1-CH2 4.32Å; Y339-W622 AromaticContact CE1-CZ2 3.99Å; Y339-W622 HydrophobicContact CE1-CZ2 3.99Å; F425-W622 HydrophobicContact CE1-CH2 4.05Å; F425-W622 HydrophobicContact CE1-CZ2 4.03Å; F425-W622 AromaticContact CZ-CH2 3.76Å; F425-W622 HydrophobicContact CZ-CH2 3.76Å; F425-W622 AromaticContact CZ-CZ2 3.97Å; F425-W622 HydrophobicContact CZ-CZ2 3.97Å; H432-W622 AromaticContact CE1-CH2 3.53Å; H432-W622 AromaticContact CE1-CZ3 3.74Å; H432-W622 AromaticContact ND1-CH2 3.78Å; H432-W622 AromaticContact ND1-CZ3 3.75Å; D620-W622 PolarHBondContact O-N 3.38Å; W622-P624 HydrophobicContact CE3-CG 4.49Å; W622-P624 HydrophobicContact CZ3-CG 4.29Å
623	P	87.6	Confident	69.6	Low	1 Å²	1	68.8 Å²	68.8	1%	0.006	41%	0.407	C	S	.	.	S	Bend	cis	-59.2	154.2	-5	-25.6	35.6	0	0	0	114.6	Y339 M367 C434 A621 F625	Y339-P623 HydrophobicContact CD1-CB 3.74Å; Y339-P623 HydrophobicContact CD1-CG 3.52Å; Y339-P623 HydrophobicContact CD2-CG 4.28Å; Y339-P623 HydrophobicContact CE1-CB 3.56Å; Y339-P623 HydrophobicContact CE1-CG 3.88Å; Y339-P623 HydrophobicContact CG-CB 4.33Å; Y339-P623 HydrophobicContact CG-CG 3.72Å; M367-P623 HydrophobicContact CE-CG 4.22Å; M367-P623 HydrophobicContact SD-CG 4.34Å; C434-P623 HydrophobicContact CB-CB 4.07Å; A621-P623 CarbonylContact C-O 3.58Å; A621-P623 CarbonylContact O-C 3.54Å; P623-F625 VanDerWaalsContact C-N 3.26Å; P623-F625 HydrophobicContact CB-CD2 4.49Å; P623-F625 HydrophobicContact CB-CE1 4.37Å; P623-F625 HydrophobicContact CB-CE2 4.12Å; P623-F625 HydrophobicContact CB-CZ 4.04Å; P623-F625 HydrophobicContact CG-CE2 4.16Å; P623-F625 HydrophobicContact CG-CZ 3.97Å; P623-F625 WeakPolarHBondContact O-CD2 3.47Å; P623-F625 PolarHBondContact O-N 3.36Å
624	P	87.8	Confident	71.8	Confident	37 Å²	37	69.4 Å²	69.4	24%	0.24	40%	0.403	C	S	.	.			trans	-73.2	79.2	-177.3	30.5	-34.5	0	0	0	110.7	C434 A621 W622	C434-P624 WeakPolarHBondContact CB-O 3.39Å; C434-P624 PolarHBondContact N-O 3.08Å; A621-P624 WeakPolarHBondContact O-CA 3.36Å; W622-P624 HydrophobicContact CE3-CG 4.49Å; W622-P624 HydrophobicContact CZ3-CG 4.29Å
625	F	87.2	Confident	73.6	Confident	51 Å²	51	71.4 Å²	71.4	22%	0.224	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	132.1	-173.1	-74.4	-65.1	0	0	0	112.2	M367 Y372 T377 C434 D436 P623	M367-F625 HydrophobicContact SD-CE1 3.85Å; M367-F625 HydrophobicContact SD-CZ 3.81Å; Y372-F625 AromaticContact CD1-CE2 3.74Å; Y372-F625 HydrophobicContact CD1-CE2 3.74Å; Y372-F625 AromaticContact CD1-CZ 3.79Å; Y372-F625 HydrophobicContact CD1-CZ 3.79Å; Y372-F625 HydrophobicContact CD2-CE2 4.07Å; Y372-F625 HydrophobicContact CD2-CZ 4.01Å; Y372-F625 AromaticContact CE1-CE2 3.64Å; Y372-F625 HydrophobicContact CE1-CE2 3.64Å; Y372-F625 HydrophobicContact CE1-CZ 4.18Å; Y372-F625 AromaticContact CE2-CE2 3.98Å; Y372-F625 HydrophobicContact CE2-CE2 3.98Å; Y372-F625 HydrophobicContact CE2-CZ 4.39Å; Y372-F625 AromaticContact CG-CE2 3.96Å; Y372-F625 HydrophobicContact CG-CE2 3.96Å; Y372-F625 AromaticContact CG-CZ 3.69Å; Y372-F625 HydrophobicContact CG-CZ 3.69Å; Y372-F625 AromaticContact CZ-CE2 3.77Å; T377-F625 HydrophobicContact CG2-CE1 3.96Å; C434-F625 HydrophobicContact CB-CD1 4.2Å; C434-F625 CarbonylContact O-C 3.5Å; C434-F625 VanDerWaalsContact O-CA 3.28Å; C434-F625 WeakPolarHBondContact O-CA 3.33Å; D436-F625 HydrophobicContact CB-CD1 4.28Å; P623-F625 VanDerWaalsContact C-N 3.26Å; P623-F625 HydrophobicContact CB-CD2 4.49Å; P623-F625 HydrophobicContact CB-CE1 4.37Å; P623-F625 HydrophobicContact CB-CE2 4.12Å; P623-F625 HydrophobicContact CB-CZ 4.04Å; P623-F625 HydrophobicContact CG-CE2 4.16Å; P623-F625 HydrophobicContact CG-CZ 3.97Å; P623-F625 WeakPolarHBondContact O-CD2 3.47Å; P623-F625 PolarHBondContact O-N 3.36Å
626	R	88.1	Confident	75	Confident	11 Å²	11	71.7 Å²	71.7	4%	0.042	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	118.6	168.9	-172.2	173.5	75.7	179.1	6.5	110.5	V433 C434 L435 D436 G474 W475 S532 A628	V433-R626 HydrophobicContact CG1-CB 3.6Å; V433-R626 HydrophobicContact CG1-CG 4.49Å; C434-R626 PolarHBondContact O-N 3.25Å; L435-R626 CarbonylContact C-O 3.57Å; L435-R626 WeakPolarHBondContact CA-O 3.02Å; L435-R626 HydrophobicContact CD2-CB 4.37Å; D436-R626 PolarHBondContact N-O 2.91Å; G474-R626 PolarHBondContact O-NH1 2.9Å; W475-R626 PolarHBondContact O-NH2 3.41Å; S532-R626 WeakPolarHBondContact O-CD 3.49Å; S532-R626 WeakPolarHBondContact O-CG 3.18Å; R626-A628 PolarHBondContact O-N 3.49Å
627	Q	86.3	Confident	77.2	Confident	105 Å²	105	66.9 Å²	66.9	49%	0.491	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	132.6	177.5	-160.4	170.6	48.4	0	0	110.3
628	A	88.9	Confident	79.4	Confident	2 Å²	2	62.3 Å²	62.3	2%	0.017	35%	0.346	C	S	.	.			trans	-122.1	161.8	-175.8	0	0	0	0	0	111.2	L435 D436 L437 P438 V466 F477 R626	L435-A628 HydrophobicContact CB-CB 4.22Å; L435-A628 HydrophobicContact CD2-CB 4.35Å; D436-A628 PolarHBondContact O-N 2.95Å; L437-A628 HydrophobicContact CD2-CB 3.91Å; P438-A628 VanDerWaalsContact CD-O 3.24Å; P438-A628 WeakPolarHBondContact CD-O 3.1Å; V466-A628 HydrophobicContact CG1-CB 4.45Å; F477-A628 HydrophobicContact CE1-CB 3.78Å; F477-A628 HydrophobicContact CZ-CB 3.52Å; R626-A628 PolarHBondContact O-N 3.49Å
629	G	88.1	Confident	81.6	Confident	11 Å²	11	58.8 Å²	58.8	11%	0.113	33%	0.325	C	S	.	.			trans	76.5	169.3	177.1	0	0	0	0	0	115.2	E464 F521	E464-G629 WeakPolarHBondContact OE1-CA 3.37Å; F521-G629 VanDerWaalsContact CE2-O 3.25Å; F521-G629 WeakPolarHBondContact CE2-O 3.48Å; F521-G629 WeakPolarHBondContact CZ-O 3.42Å
630	V	87.8	Confident	83.7	Confident	29 Å²	29	55.4 Å²	55.4	18%	0.176	29%	0.29	C	S	.	.	S	Bend	trans	-114.1	-5.3	179.9	-67.1	0	0	0	0	113.1	E464 C485 T488 E518 F521 W536	E464-V630 PolarHBondContact OE1-N 2.92Å; E464-V630 VanDerWaalsContact OE2-CG2 3.29Å; E464-V630 WeakPolarHBondContact OE2-CG2 3.17Å; E464-V630 PolarHBondContact OE2-N 2.77Å; C485-V630 HydrophobicContact CB-CG2 3.82Å; T488-V630 WeakPolarHBondContact CB-O 3.42Å; T488-V630 HydrophobicContact CG2-CB 4.03Å; T488-V630 HydrophobicContact CG2-CG2 3.82Å; E518-V630 WeakPolarHBondContact OE2-CG1 3.29Å; F521-V630 HydrophobicContact CD2-CG1 4.29Å; F521-V630 HydrophobicContact CE2-CG1 3.79Å; W536-V630 HydrophobicContact CH2-CG1 4.07Å; W536-V630 HydrophobicContact CZ2-CG1 4.18Å
631	F	91.1	Very high	85.7	Confident	32 Å²	32	48.2 Å²	48.2	14%	0.14	25%	0.252	C	S	.	.			trans	-75.2	134.3	175.5	179	-107.8	0	0	0	111	P438 E463 E464 H487 P633	P438-F631 HydrophobicContact CB-CD1 4.24Å; P438-F631 WeakPolarHBondContact CB-O 3.19Å; P438-F631 HydrophobicContact CG-CB 4.11Å; P438-F631 HydrophobicContact CG-CD1 4.39Å; P438-F631 WeakPolarHBondContact CG-O 3.5Å; E463-F631 HydrophobicContact CB-CD1 3.77Å; E463-F631 HydrophobicContact CB-CD2 3.95Å; E463-F631 HydrophobicContact CB-CE1 3.81Å; E463-F631 HydrophobicContact CB-CE2 4.01Å; E463-F631 HydrophobicContact CB-CG 3.83Å; E463-F631 HydrophobicContact CB-CZ 3.95Å; E463-F631 HydrophobicContact CG-CD1 4.19Å; E463-F631 HydrophobicContact CG-CE1 3.71Å; E463-F631 HydrophobicContact CG-CE2 4.19Å; E463-F631 HydrophobicContact CG-CZ 3.72Å; E464-F631 HydrophobicContact CG-CB 4.21Å; E464-F631 WeakPolarHBondContact OE1-CB 3.38Å; E464-F631 PolarHBondContact OE1-N 2.72Å; H487-F631 AromaticContact CD2-CE2 3.83Å; H487-F631 WeakPolarHBondContact O-CD2 3.42Å; F631-P633 HydrophobicContact CE1-CB 3.76Å; F631-P633 HydrophobicContact CE1-CG 4.3Å; F631-P633 HydrophobicContact CZ-CB 4.15Å
632	D	87.6	Confident	87	Confident	28 Å²	28	45.6 Å²	45.6	15%	0.15	23%	0.23	C	C	.	.			trans	-125.8	107	178	-169.2	-9.6	0	0	0	108.5	T488 T489 R520 F634	T488-D632 PolarHBondContact O-N 2.86Å; T489-D632 HydrophobicContact CG2-CB 3.89Å; R520-D632 IonicContact CZ-OD2 3.68Å; R520-D632 IonicContact NE-OD2 3.83Å; R520-D632 IonicContact NH2-OD1 3.38Å; R520-D632 IonicContact NH2-OD2 3.93Å; R520-D632 PolarHBondContact NH2-OD2 3.03Å; D632-F634 PolarHBondContact O-N 3.08Å; D632-F634 WeakPolarHBondContact OD1-CB 3.29Å; D632-F634 WeakPolarHBondContact OD1-CD2 3.4Å; D632-F634 PolarHBondContact OD1-N 3.1Å; D632-F634 VanDerWaalsContact OD1-N 3.11Å
633	P	84.3	Confident	87.6	Confident	67 Å²	67	42.8 Å²	42.8	44%	0.435	22%	0.221	S	C	.	.			trans	-74.8	-6	179.6	30.2	-34	0	0	0	113	F631	F631-P633 HydrophobicContact CE1-CB 3.76Å; F631-P633 HydrophobicContact CE1-CG 4.3Å; F631-P633 HydrophobicContact CZ-CB 4.15Å
634	F	80.2	Confident	88	Confident	153 Å²	153	46.2 Å²	46.2	67%	0.671	24%	0.236	S	C	*	.			trans	-94.8	158.1	-174.9	-55.5	-69.9	0	0	0	112.4	D632	D632-F634 PolarHBondContact O-N 3.08Å; D632-F634 WeakPolarHBondContact OD1-CB 3.29Å; D632-F634 WeakPolarHBondContact OD1-CD2 3.4Å; D632-F634 PolarHBondContact OD1-N 3.1Å; D632-F634 VanDerWaalsContact OD1-N 3.11Å
635	M	72.7	Confident	88.4	Confident	108 Å²	108	44.8 Å²	44.8	53%	0.532	23%	0.226	S	C	.	.			trans	-133.9	107.6	179.4	179.2	-151.4	-51.5	0	0	108.1	E576	E576-M635 HydrophobicContact CG-CE 4.48Å; E576-M635 HydrophobicContact CG-CG 4.08Å; E576-M635 HydrophobicContact CG-SD 4.47Å; E576-M635 VanDerWaalsContact OE1-CE 3.27Å; E576-M635 WeakPolarHBondContact OE1-CE 3.49Å
636	D	72.9	Confident	88.7	Confident	112 Å²	112	44.8 Å²	44.8	60%	0.599	23%	0.225	S	C	*	.	S	Bend	trans	-73.6	-51.9	-178.5	-61.3	-33.4	0	0	0	111.9
637	D	88.6	Confident	88.8	Confident	27 Å²	27	44.5 Å²	44.5	14%	0.144	22%	0.224	C	C	.	.			trans	-150.7	107.7	-178.1	-171.8	-5.6	0	0	0	113.1	V606 R639 V640	V606-D637 HydrophobicContact CG1-CB 4.47Å; D637-R639 PolarHBondContact O-N 2.88Å; D637-R639 WeakPolarHBondContact OD1-CB 3.46Å; D637-R639 WeakPolarHBondContact OD1-CG 3.42Å; D637-R639 PolarHBondContact OD1-N 2.72Å; D637-R639 IonicContact OD1-NE 2.7Å; D637-R639 PolarHBondContact OD1-NE 2.82Å; D637-R639 IonicContact OD2-CZ 3.43Å; D637-R639 IonicContact OD2-NE 2.67Å; D637-R639 PolarHBondContact OD2-NE 2.77Å; D637-R639 IonicContact OD2-NH2 3.28Å; D637-R639 PolarHBondContact OD2-NH2 2.76Å; D637-V640 WeakPolarHBondContact O-CG2 3.28Å; D637-V640 PolarHBondContact O-N 2.79Å
638	S	88.9	Confident	88.8	Confident	38 Å²	38	40 Å²	40	27%	0.266	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-6.8	177	62.5	0	0	0	0	114.9	A641 A657 H692	S638-A641 WeakPolarHBondContact O-CB 3.47Å; S638-A657 VanDerWaalsContact O-CB 3.3Å; S638-A657 WeakPolarHBondContact O-CB 3.22Å; S638-H692 PolarHBondContact OG-CE1 2.78Å; S638-H692 VanDerWaalsContact OG-CE1 3.25Å
639	R	92.6	Very high	88.5	Confident	34 Å²	34	41.1 Å²	41.1	13%	0.128	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-37.9	172	-68.9	-175	-65.8	166.7	0.1	112.8	D605 D637 A641 A658 Q660 H692 A693 P694 L695	D605-R639 VanDerWaalsContact CB-NH2 3.34Å; D605-R639 PolarHBondContact O-NH2 2.98Å; D605-R639 VanDerWaalsContact O-NH2 3.14Å; D605-R639 IonicContact OD2-NH1 3.12Å; D637-R639 PolarHBondContact O-N 2.88Å; D637-R639 WeakPolarHBondContact OD1-CB 3.46Å; D637-R639 WeakPolarHBondContact OD1-CG 3.42Å; D637-R639 PolarHBondContact OD1-N 2.72Å; D637-R639 IonicContact OD1-NE 2.7Å; D637-R639 PolarHBondContact OD1-NE 2.82Å; D637-R639 IonicContact OD2-CZ 3.43Å; D637-R639 IonicContact OD2-NE 2.67Å; D637-R639 PolarHBondContact OD2-NE 2.77Å; D637-R639 IonicContact OD2-NH2 3.28Å; D637-R639 PolarHBondContact OD2-NH2 2.76Å; R639-A641 VanDerWaalsContact C-N 3.3Å; R639-A658 HydrophobicContact CB-CB 3.84Å; R639-A658 HydrophobicContact CG-CB 4.09Å; R639-A658 PolarHBondContact O-N 2.81Å; R639-Q660 PolarHBondContact O-NE2 3Å; R639-H692 HydrophobicContact CG-CB 3.79Å; R639-A693 VanDerWaalsContact CD-O 3.23Å; R639-A693 WeakPolarHBondContact CD-O 3.46Å; R639-P694 PolarHBondContact NH1-O 2.66Å; R639-L695 HydrophobicContact CB-CD1 4.31Å; R639-L695 HydrophobicContact CB-CD2 3.9Å; R639-L695 HydrophobicContact CB-CG 4.09Å
640	V	93.4	Very high	88.4	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.018	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-21.3	-177.3	-69.4	0	0	0	0	112.8	D577 G578 A600 F603 V606 D637 I642 L695	D577-V640 WeakPolarHBondContact O-CG2 3.22Å; G578-V640 VanDerWaalsContact CA-O 3.31Å; G578-V640 WeakPolarHBondContact CA-O 3.31Å; A600-V640 HydrophobicContact CB-CB 4.35Å; A600-V640 HydrophobicContact CB-CG1 4.09Å; A600-V640 HydrophobicContact CB-CG2 4.36Å; F603-V640 HydrophobicContact CD2-CG1 4.04Å; F603-V640 HydrophobicContact CE2-CG1 4.47Å; V606-V640 HydrophobicContact CG1-CG1 4.33Å; V606-V640 HydrophobicContact CG2-CG1 3.61Å; D637-V640 WeakPolarHBondContact O-CG2 3.28Å; D637-V640 PolarHBondContact O-N 2.79Å; V640-I642 PolarHBondContact O-N 2.93Å; V640-L695 HydrophobicContact CG1-CD1 4.07Å; V640-L695 HydrophobicContact CG1-CD2 4.15Å
641	A	94.7	Very high	88.5	Confident	4 Å²	4	42.5 Å²	42.5	3%	0.033	21%	0.213	C	C	.	.			trans	-39.9	121.9	179.9	0	0	0	0	0	113.3	T492 H575 E576 S638 R639 G656 A657	T492-A641 HydrophobicContact CG2-CB 4.44Å; H575-A641 WeakPolarHBondContact O-CA 3.21Å; E576-A641 HydrophobicContact CB-CB 4.46Å; E576-A641 HydrophobicContact CG-CB 4.11Å; E576-A641 WeakPolarHBondContact O-CA 3.33Å; E576-A641 WeakPolarHBondContact O-CB 3.45Å; E576-A641 PolarHBondContact O-N 3.04Å; S638-A641 WeakPolarHBondContact O-CB 3.47Å; R639-A641 VanDerWaalsContact C-N 3.3Å; A641-G656 CarbonylContact O-C 3.53Å; A641-G656 VanDerWaalsContact O-CA 3.25Å; A641-G656 WeakPolarHBondContact O-CA 3.39Å; A641-A657 HydrophobicContact CB-CB 4.07Å; A641-A657 PolarHBondContact O-N 3.04Å
642	I	96.8	Very high	88.7	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	148.1	177.9	-52.7	-48.5	0	0	0	109	T492 T493 H575 S579 V580 T599 V640 I645 V654	T492-I642 WeakPolarHBondContact CB-O 3.32Å; T492-I642 PolarHBondContact OG1-O 3.1Å; T493-I642 HydrophobicContact CG2-CG2 3.8Å; H575-I642 PolarHBondContact O-N 3.14Å; S579-I642 WeakPolarHBondContact O-CG1 3.45Å; V580-I642 HydrophobicContact CG2-CD1 4.22Å; V580-I642 HydrophobicContact CG2-CG1 3.88Å; V580-I642 HydrophobicContact CG2-CG2 4.25Å; T599-I642 HydrophobicContact CG2-CD1 4.15Å; V640-I642 PolarHBondContact O-N 2.93Å; I642-I645 HydrophobicContact CG2-CD1 4.31Å; I642-I645 HydrophobicContact CG2-CG1 3.81Å; I642-V654 HydrophobicContact CD1-CG1 3.58Å; I642-V654 HydrophobicContact CG1-CG1 4.3Å; I642-V654 HydrophobicContact CG2-CG1 3.74Å
643	Q	95.1	Very high	89.1	Confident	45 Å²	45	39.7 Å²	39.7	21%	0.21	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	-35.6	177.9	-63	-70.5	-70.5	0	0	111.4	T493 G655 A657 R732	T493-Q643 WeakPolarHBondContact CB-O 3.35Å; T493-Q643 PolarHBondContact OG1-O 3.01Å; Q643-G655 WeakPolarHBondContact CA-O 3.35Å; Q643-G655 PolarHBondContact N-O 3Å; Q643-A657 HydrophobicContact CG-CB 4.19Å; Q643-R732 HydrophobicContact CG-CB 4.21Å
644	F	95.1	Very high	89.8	Confident	72 Å²	72	36.7 Å²	36.7	32%	0.316	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	137.9	176.8	-89.3	-94.4	0	0	0	111.2	V654 G655 I733 T734 L736	F644-V654 WeakPolarHBondContact O-CA 3.45Å; F644-G655 PolarHBondContact N-O 3.4Å; F644-G655 PolarHBondContact O-N 2.86Å; F644-I733 HydrophobicContact CD2-CG2 4.32Å; F644-I733 WeakPolarHBondContact CD2-O 3.37Å; F644-T734 VanDerWaalsContact CE2-O 3.29Å; F644-T734 WeakPolarHBondContact CE2-O 3.28Å; F644-T734 VanDerWaalsContact CZ-O 3.23Å; F644-T734 WeakPolarHBondContact CZ-O 3.34Å; F644-L736 HydrophobicContact CB-CD1 3.79Å; F644-L736 HydrophobicContact CB-CG 4.08Å
645	I	95.8	Very high	90.6	Very high	7 Å²	7	29.4 Å²	29.4	4%	0.036	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.8	167.3	-58.1	163.7	0	0	0	107.2	T493 L572 V580 I642 L652	T493-I645 HydrophobicContact CG2-CD1 3.94Å; T493-I645 HydrophobicContact CG2-CG1 4.01Å; L572-I645 HydrophobicContact CB-CD1 4.26Å; L572-I645 HydrophobicContact CB-CG2 4.24Å; L572-I645 HydrophobicContact CD1-CG2 3.62Å; V580-I645 HydrophobicContact CB-CD1 4.49Å; V580-I645 HydrophobicContact CG1-CD1 3.7Å; V580-I645 HydrophobicContact CG1-CG1 4.24Å; V580-I645 HydrophobicContact CG1-CG2 4.48Å; V580-I645 HydrophobicContact CG2-CD1 4.13Å; V580-I645 HydrophobicContact CG2-CG1 4.19Å; I642-I645 HydrophobicContact CG2-CD1 4.31Å; I642-I645 HydrophobicContact CG2-CG1 3.81Å; I645-L652 HydrophobicContact CG2-CD1 3.74Å
646	Y	93.1	Very high	91.7	Very high	52 Å²	52	24.3 Å²	24.3	20%	0.204	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.6	172.5	-162.5	-113.2	0	0	0	109	V648 V653 L737 L738	Y646-V648 HydrophobicContact CD1-CG2 4.26Å; Y646-V648 HydrophobicContact CE1-CG2 3.54Å; Y646-V653 PolarHBondContact N-O 2.9Å; Y646-V653 PolarHBondContact O-N 2.89Å; Y646-L737 HydrophobicContact CE1-CD1 4.02Å; Y646-L738 HydrophobicContact CD1-CB 4.27Å; Y646-L738 HydrophobicContact CD1-CD2 3.86Å; Y646-L738 HydrophobicContact CD1-CG 3.78Å; Y646-L738 HydrophobicContact CE1-CB 4.46Å; Y646-L738 HydrophobicContact CE1-CD2 4.34Å; Y646-L738 HydrophobicContact CE1-CG 3.85Å
647	L	91.7	Very high	92.7	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.021	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.5	179.8	176.1	64.5	0	0	0	108.5	I497 L504 L570 L572 L652	I497-L647 HydrophobicContact CG1-CB 4.43Å; I497-L647 HydrophobicContact CG1-CD2 4.48Å; I497-L647 HydrophobicContact CG2-CD2 4.36Å; L504-L647 HydrophobicContact CD2-CD1 3.82Å; L504-L647 HydrophobicContact CD2-CD2 3.8Å; L504-L647 HydrophobicContact CD2-CG 4.21Å; L570-L647 HydrophobicContact CD1-CD2 4.23Å; L572-L647 HydrophobicContact CD1-CB 3.8Å; L572-L647 HydrophobicContact CD1-CD2 3.87Å; L572-L647 HydrophobicContact CD1-CG 4.49Å; L647-L652 HydrophobicContact CB-CD1 4.15Å; L647-L652 HydrophobicContact CD1-CB 4.15Å; L647-L652 HydrophobicContact CD1-CD1 4.23Å
648	V	85.8	Confident	93	Very high	11 Å²	11	18.4 Å²	18.4	7%	0.067	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	129.5	173.5	164	0	0	0	0	108.8	Y646 N650 T651 L738 T1165	Y646-V648 HydrophobicContact CD1-CG2 4.26Å; Y646-V648 HydrophobicContact CE1-CG2 3.54Å; V648-N650 PolarHBondContact O-N 2.97Å; V648-T651 PolarHBondContact N-O 3.33Å; V648-T651 VanDerWaalsContact N-O 3.12Å; V648-T651 PolarHBondContact O-N 2.92Å; V648-L738 HydrophobicContact CB-CD1 4.2Å; V648-L738 HydrophobicContact CB-CD2 4.41Å; V648-L738 HydrophobicContact CB-CG 4.43Å; V648-L738 HydrophobicContact CG1-CD1 4.36Å; V648-T1165 HydrophobicContact CG1-CG2 3.69Å
649	D	83.3	Confident	93.2	Very high	26 Å²	26	16.6 Å²	16.6	14%	0.139	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	-92.5	179.7	-70.4	-64.8	0	0	0	112.9	G1163 S1164 T1165	D649-G1163 PolarHBondContact N-O 3.17Å; D649-S1164 WeakPolarHBondContact OD1-CA 3.43Å; D649-S1164 VanDerWaalsContact OD1-CB 3.24Å; D649-S1164 WeakPolarHBondContact OD1-CB 3.46Å; D649-S1164 PolarHBondContact OD1-OG 2.71Å; D649-T1165 PolarHBondContact OD1-N 3.12Å; D649-T1165 WeakPolarHBondContact OD2-CB 3.46Å; D649-T1165 WeakPolarHBondContact OD2-CG2 3.36Å; D649-T1165 PolarHBondContact OD2-N 3.13Å; D649-T1165 PolarHBondContact OD2-OG1 3.01Å
650	N	85.4	Confident	93.4	Very high	68 Å²	68	15.1 Å²	15.1	36%	0.364	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	4.9	176.1	-75.6	-14.7	0	0	0	114.1	S501 V648	S501-N650 PolarHBondContact OG-OD1 2.82Å; V648-N650 PolarHBondContact O-N 2.97Å
651	T	90.5	Very high	93.6	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.5	-179.2	-60.7	0	0	0	0	110.8	V648 V653 V663 Q665 L738 E740 I766	V648-T651 PolarHBondContact N-O 3.33Å; V648-T651 VanDerWaalsContact N-O 3.12Å; V648-T651 PolarHBondContact O-N 2.92Å; T651-V653 HydrophobicContact CG2-CG2 4.2Å; T651-V663 HydrophobicContact CG2-CG1 3.93Å; T651-Q665 HydrophobicContact CG2-CG 4.34Å; T651-Q665 PolarHBondContact OG1-NE2 3.08Å; T651-L738 HydrophobicContact CG2-CD2 3.87Å; T651-E740 WeakPolarHBondContact CB-OE1 3.29Å; T651-E740 PolarHBondContact OG1-OE1 3.12Å; T651-I766 HydrophobicContact CG2-CD1 3.6Å; T651-I766 HydrophobicContact CG2-CG1 4.36Å
652	L	94.9	Very high	93.7	Very high	1 Å²	1	15 Å²	15	1%	0.005	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.3	172.1	177.4	81.6	0	0	0	109.1	F582 L597 I645 L647 V654 Y664 L719	F582-L652 HydrophobicContact CE1-CD1 4.5Å; F582-L652 HydrophobicContact CZ-CD1 4.1Å; F582-L652 HydrophobicContact CZ-CD2 3.86Å; L597-L652 HydrophobicContact CD2-CD2 3.43Å; L597-L652 VanDerWaalsContact CD2-CD2 3.43Å; I645-L652 HydrophobicContact CG2-CD1 3.74Å; L647-L652 HydrophobicContact CB-CD1 4.15Å; L647-L652 HydrophobicContact CD1-CB 4.15Å; L647-L652 HydrophobicContact CD1-CD1 4.23Å; L652-V654 HydrophobicContact CD2-CG2 3.78Å; L652-V654 HydrophobicContact CG-CG2 3.91Å; L652-Y664 HydrophobicContact CD2-CD2 4.21Å; L652-Y664 HydrophobicContact CD2-CG 4.43Å; L652-Y664 PolarHBondContact N-O 2.88Å; L652-Y664 PolarHBondContact O-N 3.31Å; L652-L719 HydrophobicContact CB-CD2 4.5Å; L652-L719 HydrophobicContact CD2-CD1 4.15Å
653	V	96.3	Very high	93.7	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129	169.7	-172.2	0	0	0	0	109.6	Y646 T651 V661 I662 V663 L736 L738 L768	Y646-V653 PolarHBondContact N-O 2.9Å; Y646-V653 PolarHBondContact O-N 2.89Å; T651-V653 HydrophobicContact CG2-CG2 4.2Å; V653-V661 HydrophobicContact CG1-CG1 3.57Å; V653-I662 WeakPolarHBondContact CA-O 3.26Å; V653-V663 HydrophobicContact CG1-CG2 4.23Å; V653-V663 HydrophobicContact CG2-CB 4.48Å; V653-V663 HydrophobicContact CG2-CG1 4.32Å; V653-V663 HydrophobicContact CG2-CG2 4.03Å; V653-L736 HydrophobicContact CG1-CD1 4.02Å; V653-L738 HydrophobicContact CB-CD2 4.49Å; V653-L738 HydrophobicContact CG2-CB 4.29Å; V653-L738 HydrophobicContact CG2-CD2 3.57Å; V653-L768 HydrophobicContact CG1-CD1 3.91Å; V653-L768 HydrophobicContact CG1-CD2 4.06Å
654	V	97.6	Very high	93.6	Very high	4 Å²	4	13.1 Å²	13.1	2%	0.024	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.1	-176.6	-170.4	0	0	0	0	108.7	V580 T599 I642 F644 L652 V661 I662 Y664	V580-V654 HydrophobicContact CG2-CG1 3.92Å; V580-V654 HydrophobicContact CG2-CG2 4.17Å; T599-V654 HydrophobicContact CG2-CG1 4.34Å; I642-V654 HydrophobicContact CD1-CG1 3.58Å; I642-V654 HydrophobicContact CG1-CG1 4.3Å; I642-V654 HydrophobicContact CG2-CG1 3.74Å; F644-V654 WeakPolarHBondContact O-CA 3.45Å; L652-V654 HydrophobicContact CD2-CG2 3.78Å; L652-V654 HydrophobicContact CG-CG2 3.91Å; V654-V661 CarbonylContact O-C 3.58Å; V654-V661 VanDerWaalsContact O-CA 3.32Å; V654-V661 WeakPolarHBondContact O-CA 3.34Å; V654-I662 PolarHBondContact N-O 2.86Å; V654-I662 PolarHBondContact O-N 3.05Å; V654-Y664 HydrophobicContact CG2-CD2 4.18Å; V654-Y664 HydrophobicContact CG2-CE2 4.21Å
655	G	97.4	Very high	93.4	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.2	175.3	0	0	0	0	0	111.1	Q643 F644 Q660	Q643-G655 WeakPolarHBondContact CA-O 3.35Å; Q643-G655 PolarHBondContact N-O 3Å; F644-G655 PolarHBondContact N-O 3.4Å; F644-G655 PolarHBondContact O-N 2.86Å; G655-Q660 WeakPolarHBondContact CA-O 3.31Å
656	G	96	Very high	93	Very high	2 Å²	2	12.2 Å²	12.2	2%	0.021	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-173.4	-173.3	0	0	0	0	0	115.9	A641 Q660 I733	A641-G656 CarbonylContact O-C 3.53Å; A641-G656 VanDerWaalsContact O-CA 3.25Å; A641-G656 WeakPolarHBondContact O-CA 3.39Å; G656-Q660 PolarHBondContact N-O 3.24Å; G656-I733 PolarHBondContact O-N 3.3Å; G656-I733 VanDerWaalsContact O-N 3.14Å
657	A	94.4	Very high	92.6	Very high	13 Å²	13	11 Å²	11	11%	0.107	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-28.2	-172.4	0	0	0	0	0	114.9	S638 A641 Q643 R732	S638-A657 VanDerWaalsContact O-CB 3.3Å; S638-A657 WeakPolarHBondContact O-CB 3.22Å; A641-A657 HydrophobicContact CB-CB 4.07Å; A641-A657 PolarHBondContact O-N 3.04Å; Q643-A657 HydrophobicContact CG-CB 4.19Å; A657-R732 WeakPolarHBondContact O-CA 3.18Å; A657-R732 WeakPolarHBondContact O-CB 3.27Å; A657-R732 PolarHBondContact O-N 3.15Å
658	A	94.2	Very high	92.1	Very high	1 Å²	1	17 Å²	17	1%	0.008	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	23.6	176.9	0	0	0	0	0	113.6	R639 Q660 L695 P730	R639-A658 HydrophobicContact CB-CB 3.84Å; R639-A658 HydrophobicContact CG-CB 4.09Å; R639-A658 PolarHBondContact O-N 2.81Å; A658-Q660 VanDerWaalsContact CA-OE1 3.29Å; A658-Q660 PolarHBondContact O-N 3.28Å; A658-L695 HydrophobicContact CB-CD1 4.3Å; A658-L695 HydrophobicContact CB-CG 4.31Å; A658-P730 CarbonylContact C-O 3.29Å; A658-P730 CarbonylContact O-C 3.48Å; A658-P730 WeakPolarHBondContact O-CA 3.37Å; A658-P730 WeakPolarHBondContact O-CB 3.09Å
659	G	94.2	Very high	91.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	72.5	13.7	176.6	0	0	0	0	0	114.9	V727 A731	G659-V727 WeakPolarHBondContact O-CB 3.45Å; G659-V727 WeakPolarHBondContact O-CG2 3.33Å; G659-V727 PolarHBondContact O-N 2.83Å; G659-A731 WeakPolarHBondContact CA-O 3.48Å; G659-A731 PolarHBondContact N-O 2.79Å
660	Q	96.3	Very high	91.7	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.019	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	137	167.6	74.6	-76.2	21.3	0	0	110.7	F603 R639 G655 G656 A658 L695 I725 F726	F603-Q660 HydrophobicContact CZ-CB 4.37Å; F603-Q660 HydrophobicContact CZ-CG 4.1Å; R639-Q660 PolarHBondContact O-NE2 3Å; G655-Q660 WeakPolarHBondContact CA-O 3.31Å; G656-Q660 PolarHBondContact N-O 3.24Å; A658-Q660 VanDerWaalsContact CA-OE1 3.29Å; A658-Q660 PolarHBondContact O-N 3.28Å; Q660-L695 HydrophobicContact CB-CD1 4.49Å; Q660-L695 HydrophobicContact CG-CD1 4.02Å; Q660-I725 CarbonylContact C-O 3.54Å; Q660-I725 WeakPolarHBondContact CA-O 3.5Å; Q660-F726 HydrophobicContact CB-CD1 3.97Å; Q660-F726 HydrophobicContact CB-CE1 3.93Å
661	V	97.8	Very high	91.4	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	130.1	168.4	-172.6	0	0	0	0	108.4	V653 V654 I725 I733 L736 L768 L770	V653-V661 HydrophobicContact CG1-CG1 3.57Å; V654-V661 CarbonylContact O-C 3.58Å; V654-V661 VanDerWaalsContact O-CA 3.32Å; V654-V661 WeakPolarHBondContact O-CA 3.34Å; V661-I725 HydrophobicContact CB-CB 4.29Å; V661-I725 PolarHBondContact N-O 3.09Å; V661-I725 PolarHBondContact O-N 2.99Å; V661-I733 HydrophobicContact CG2-CD1 3.43Å; V661-I733 VanDerWaalsContact CG2-CD1 3.43Å; V661-I733 HydrophobicContact CG2-CG1 3.73Å; V661-L736 HydrophobicContact CG1-CD1 4.27Å; V661-L736 HydrophobicContact CG1-CD2 3.96Å; V661-L736 HydrophobicContact CG2-CD2 4.07Å; V661-L768 HydrophobicContact CG1-CD2 3.87Å; V661-L770 HydrophobicContact CG2-CB 4.39Å; V661-L770 HydrophobicContact CG2-CD2 4.09Å
662	I	96.7	Very high	90.8	Very high	3 Å²	3	20.4 Å²	20.4	2%	0.015	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.9	-176.6	-46.9	156.7	0	0	0	108.4	T599 L602 F603 V653 V654 Y664 A721 G723 V724	T599-I662 HydrophobicContact CG2-CD1 4.24Å; L602-I662 HydrophobicContact CD1-CD1 4.05Å; L602-I662 HydrophobicContact CD1-CG2 4.13Å; F603-I662 HydrophobicContact CE2-CD1 4.46Å; F603-I662 HydrophobicContact CZ-CD1 4.1Å; V653-I662 WeakPolarHBondContact CA-O 3.26Å; V654-I662 PolarHBondContact N-O 2.86Å; V654-I662 PolarHBondContact O-N 3.05Å; I662-Y664 HydrophobicContact CB-CD2 4.2Å; I662-Y664 HydrophobicContact CB-CE2 3.59Å; I662-Y664 HydrophobicContact CD1-CE2 4.24Å; I662-Y664 HydrophobicContact CG2-CD2 3.79Å; I662-Y664 HydrophobicContact CG2-CE1 4.27Å; I662-Y664 HydrophobicContact CG2-CE2 3.24Å; I662-A721 HydrophobicContact CG2-CB 3.78Å; I662-G723 WeakPolarHBondContact CA-O 3.21Å; I662-V724 HydrophobicContact CG2-CG2 4.12Å
663	V	95.5	Very high	90.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	130.1	174.9	179.3	0	0	0	0	107.2	T651 V653 A721 T722 G723 I766 L768 V781	T651-V663 HydrophobicContact CG2-CG1 3.93Å; V653-V663 HydrophobicContact CG1-CG2 4.23Å; V653-V663 HydrophobicContact CG2-CB 4.48Å; V653-V663 HydrophobicContact CG2-CG1 4.32Å; V653-V663 HydrophobicContact CG2-CG2 4.03Å; V663-A721 CarbonylContact O-C 3.48Å; V663-A721 WeakPolarHBondContact O-CA 3.33Å; V663-T722 WeakPolarHBondContact CG1-OG1 3.41Å; V663-T722 PolarHBondContact O-N 2.73Å; V663-T722 PolarHBondContact O-OG1 3.02Å; V663-G723 PolarHBondContact N-O 2.91Å; V663-G723 PolarHBondContact O-N 3.46Å; V663-I766 HydrophobicContact CG1-CD1 3.74Å; V663-L768 HydrophobicContact CG2-CD2 3.89Å; V663-V781 HydrophobicContact CG2-CG2 4.11Å
664	Y	94	Very high	89.8	Confident	7 Å²	7	27.2 Å²	27.2	3%	0.027	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141	-179.7	-70.2	-91.5	0	0	0	110.7	L597 T599 L652 V654 I662 L719 Q720 A721	L597-Y664 HydrophobicContact CD1-CD1 4.09Å; L597-Y664 HydrophobicContact CD1-CE1 3.74Å; L597-Y664 HydrophobicContact CD2-CD1 4Å; L597-Y664 HydrophobicContact CD2-CD2 3.79Å; L597-Y664 HydrophobicContact CD2-CE1 3.98Å; L597-Y664 HydrophobicContact CD2-CE2 3.72Å; L597-Y664 HydrophobicContact CD2-CG 3.92Å; L597-Y664 HydrophobicContact CG-CE1 4.28Å; T599-Y664 HydrophobicContact CG2-CE2 4.16Å; L652-Y664 HydrophobicContact CD2-CD2 4.21Å; L652-Y664 HydrophobicContact CD2-CG 4.43Å; L652-Y664 PolarHBondContact N-O 2.88Å; L652-Y664 PolarHBondContact O-N 3.31Å; V654-Y664 HydrophobicContact CG2-CD2 4.18Å; V654-Y664 HydrophobicContact CG2-CE2 4.21Å; I662-Y664 HydrophobicContact CB-CD2 4.2Å; I662-Y664 HydrophobicContact CB-CE2 3.59Å; I662-Y664 HydrophobicContact CD1-CE2 4.24Å; I662-Y664 HydrophobicContact CG2-CD2 3.79Å; I662-Y664 HydrophobicContact CG2-CE1 4.27Å; I662-Y664 HydrophobicContact CG2-CE2 3.24Å; Y664-L719 HydrophobicContact CD1-CB 4.39Å; Y664-Q720 VanDerWaalsContact CA-O 3.3Å; Y664-Q720 WeakPolarHBondContact CA-O 2.99Å; Y664-Q720 VanDerWaalsContact CD1-C 3.47Å; Y664-A721 HydrophobicContact CD1-CB 4.07Å; Y664-A721 HydrophobicContact CE1-CB 3.75Å
665	Q	91.2	Very high	89.5	Confident	31 Å²	31	29.2 Å²	29.2	15%	0.145	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	156	171	-63.4	-175.8	-52.2	0	0	109.3	T651 L667 Q720 T722	T651-Q665 HydrophobicContact CG2-CG 4.34Å; T651-Q665 PolarHBondContact OG1-NE2 3.08Å; Q665-L667 PolarHBondContact O-N 2.82Å; Q665-Q720 PolarHBondContact N-O 3.28Å; Q665-Q720 PolarHBondContact O-N 2.61Å; Q665-T722 HydrophobicContact CB-CG2 3.9Å; Q665-T722 HydrophobicContact CG-CG2 4.15Å
666	F	87.5	Confident	89.3	Confident	29 Å²	29	29.5 Å²	29.5	13%	0.127	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	118.5	173.9	-91.7	-82.9	0	0	0	110.8	L504 N507 L508 A511 A717 Q718 L719	L504-F666 HydrophobicContact CD1-CD2 3.66Å; L504-F666 HydrophobicContact CD1-CE2 3.48Å; L504-F666 VanDerWaalsContact CD1-CE2 3.48Å; N507-F666 HydrophobicContact CB-CD1 3.85Å; N507-F666 HydrophobicContact CB-CD2 4.17Å; N507-F666 HydrophobicContact CB-CE1 3.72Å; N507-F666 HydrophobicContact CB-CE2 4.06Å; N507-F666 HydrophobicContact CB-CG 4.06Å; N507-F666 HydrophobicContact CB-CZ 3.82Å; L508-F666 HydrophobicContact CB-CZ 4.45Å; L508-F666 HydrophobicContact CD2-CE2 4.02Å; L508-F666 HydrophobicContact CD2-CZ 3.77Å; L508-F666 HydrophobicContact CG-CE2 3.97Å; L508-F666 HydrophobicContact CG-CZ 3.85Å; A511-F666 HydrophobicContact CB-CE1 4.13Å; F666-A717 HydrophobicContact CB-CB 4.43Å; F666-A717 HydrophobicContact CD1-CB 3.84Å; F666-A717 WeakPolarHBondContact CD1-O 3.44Å; F666-A717 WeakPolarHBondContact CE1-O 3.46Å; F666-Q718 WeakPolarHBondContact CA-O 3.28Å; F666-L719 HydrophobicContact CD2-CD2 3.64Å; F666-L719 HydrophobicContact CD2-CG 3.96Å; F666-L719 HydrophobicContact CE1-CG 4.41Å; F666-L719 HydrophobicContact CE2-CD1 4.13Å; F666-L719 HydrophobicContact CE2-CD2 3.69Å; F666-L719 HydrophobicContact CE2-CG 3.57Å; F666-L719 HydrophobicContact CG-CD2 4.36Å; F666-L719 HydrophobicContact CZ-CD1 4.37Å; F666-L719 HydrophobicContact CZ-CD2 4.43Å; F666-L719 HydrophobicContact CZ-CG 3.84Å
667	L	84.9	Confident	89.3	Confident	26 Å²	26	34.8 Å²	34.8	14%	0.136	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.3	176.9	-62	175.4	0	0	0	110.9	Q665 F669 P671 Q718 Q720 T722 P784	Q665-L667 PolarHBondContact O-N 2.82Å; L667-F669 VanDerWaalsContact C-N 3.3Å; L667-F669 HydrophobicContact CB-CD1 4.43Å; L667-F669 HydrophobicContact CB-CE1 4.45Å; L667-F669 HydrophobicContact CD1-CE2 4.38Å; L667-F669 HydrophobicContact CD1-CZ 4.19Å; L667-F669 HydrophobicContact CD2-CE1 4.09Å; L667-F669 HydrophobicContact CD2-CZ 4.28Å; L667-P671 HydrophobicContact CD1-CG 4.16Å; L667-Q718 PolarHBondContact N-O 2.84Å; L667-Q718 PolarHBondContact O-N 3.15Å; L667-Q718 VanDerWaalsContact O-N 3.12Å; L667-Q720 HydrophobicContact CB-CB 4.03Å; L667-Q720 HydrophobicContact CB-CG 4.04Å; L667-Q720 HydrophobicContact CD1-CB 4.07Å; L667-Q720 HydrophobicContact CG-CB 4.34Å; L667-T722 HydrophobicContact CD1-CG2 3.84Å; L667-P784 HydrophobicContact CD1-CB 4.32Å; L667-P784 HydrophobicContact CD1-CG 4.03Å; L667-P784 HydrophobicContact CD2-CG 4.36Å
668	N	81.2	Confident	89.4	Confident	131 Å²	131	34.2 Å²	34.2	70%	0.701	18%	0.182	S	C	*	.	S	Bend	trans	-90.4	5.1	176	-57	12.1	0	0	0	112.2	A717	N668-A717 WeakPolarHBondContact OD1-CB 3.31Å
669	F	79.7	Confident	89.5	Confident	65 Å²	65	36.8 Å²	36.8	29%	0.285	20%	0.198	S	C	.	.	S	Bend	trans	-145.7	152.4	-177.7	65.2	-87.1	0	0	0	110.1	L667 P671 Q720 P786	L667-F669 VanDerWaalsContact C-N 3.3Å; L667-F669 HydrophobicContact CB-CD1 4.43Å; L667-F669 HydrophobicContact CB-CE1 4.45Å; L667-F669 HydrophobicContact CD1-CE2 4.38Å; L667-F669 HydrophobicContact CD1-CZ 4.19Å; L667-F669 HydrophobicContact CD2-CE1 4.09Å; L667-F669 HydrophobicContact CD2-CZ 4.28Å; F669-P671 HydrophobicContact CE2-CB 4.12Å; F669-P671 WeakPolarHBondContact O-CD 3.37Å; F669-Q720 WeakPolarHBondContact O-CG 3.44Å; F669-P786 HydrophobicContact CE1-CB 4.18Å; F669-P786 HydrophobicContact CZ-CB 4.1Å
670	T	79.5	Confident	89.5	Confident	26 Å²	26	37.3 Å²	37.3	16%	0.16	20%	0.2	C	C	.	.			trans	-84.8	114.7	172.1	-52.6	0	0	0	0	109.1	F701 Q720	T670-F701 HydrophobicContact CG2-CB 4.22Å; T670-F701 HydrophobicContact CG2-CD1 4.24Å; T670-Q720 PolarHBondContact OG1-NE2 2.87Å
671	P	79.6	Confident	89.2	Confident	13 Å²	13	38.1 Å²	38.1	8%	0.084	20%	0.204	C	C	.	.			trans	-73.2	153.9	177.7	31.7	-35.6	0	0	0	111.2	L667 F669 I673 A721 P784	L667-P671 HydrophobicContact CD1-CG 4.16Å; F669-P671 HydrophobicContact CE2-CB 4.12Å; F669-P671 WeakPolarHBondContact O-CD 3.37Å; P671-I673 HydrophobicContact CG-CG1 4.28Å; P671-A721 WeakPolarHBondContact CG-O 3.45Å; P671-P784 HydrophobicContact CB-CB 4.42Å
672	C	78.5	Confident	88.6	Confident	72 Å²	72	45.8 Å²	45.8	49%	0.486	24%	0.237	S	C	.	.			trans	-77.7	123.1	166.7	177.9	0	0	0	0	109.3	P795	C672-P795 HydrophobicContact CB-CG 4.03Å; C672-P795 WeakPolarHBondContact O-CB 3.12Å; C672-P795 WeakPolarHBondContact O-CG 3.3Å
673	I	82.5	Confident	88	Confident	42 Å²	42	50.1 Å²	50.1	22%	0.215	27%	0.268	C	S	.	.			trans	-113.5	128.3	-173.1	-47.4	170.1	0	0	0	110.1	P671 A721 V724	P671-I673 HydrophobicContact CG-CG1 4.28Å; I673-A721 HydrophobicContact CD1-CB 3.55Å; I673-A721 WeakPolarHBondContact CD1-O 3.35Å; I673-V724 HydrophobicContact CG2-CB 4.25Å; I673-V724 HydrophobicContact CG2-CG2 4.07Å
674	E	86.9	Confident	87.5	Confident	103 Å²	103	53.5 Å²	53.5	48%	0.481	29%	0.285	S	S	.	.			trans	-107.6	125.8	166.1	179.4	174.7	-169	0	0	108.7	P797 P798	E674-P797 HydrophobicContact CB-CB 4.05Å; E674-P797 HydrophobicContact CG-CB 4.09Å; E674-P798 WeakPolarHBondContact O-CD 3.22Å
675	P	92.1	Very high	86.9	Confident	46 Å²	46	59.1 Å²	59.1	30%	0.299	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-79.5	143.5	-173.3	30.3	-33.6	0	0	0	112.6	L697 V724 F726	P675-L697 HydrophobicContact CB-CD2 4.08Å; P675-L697 HydrophobicContact CG-CD2 3.86Å; P675-V724 VanDerWaalsContact CA-O 3.32Å; P675-V724 WeakPolarHBondContact CA-O 3.25Å; P675-V724 HydrophobicContact CB-CB 4.32Å; P675-V724 HydrophobicContact CB-CG1 4.2Å; P675-F726 HydrophobicContact CB-CD2 3.89Å; P675-F726 HydrophobicContact CB-CE2 3.75Å; P675-F726 HydrophobicContact CG-CE2 4.26Å
676	A	93.5	Very high	86.3	Confident	6 Å²	6	59.3 Å²	59.3	5%	0.05	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	133.1	177	0	0	0	0	0	112.3	V724 I725 F726 P798 P800	A676-V724 PolarHBondContact N-O 3.09Å; A676-I725 HydrophobicContact CB-CG1 4.32Å; A676-I725 CarbonylContact O-C 3.44Å; A676-I725 WeakPolarHBondContact O-CA 3.4Å; A676-F726 PolarHBondContact O-N 2.85Å; A676-P798 HydrophobicContact CB-CB 3.76Å; A676-P798 HydrophobicContact CB-CG 4.2Å; A676-P798 WeakPolarHBondContact CB-O 2.97Å; A676-P800 HydrophobicContact CB-CG 4.34Å
677	I	95.7	Very high	86	Confident	112 Å²	112	58 Å²	58	57%	0.574	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.2	177.6	-56.1	177.8	0	0	0	110.7	F726 Q728	I677-F726 CarbonylContact C-O 3.59Å; I677-F726 WeakPolarHBondContact CA-O 3.45Å; I677-Q728 HydrophobicContact CG2-CB 4.5Å
678	V	96.5	Very high	86.1	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	94.8	177.3	179.6	0	0	0	0	109.2	I680 I725 F726 V727 Q728 L770 V779 P800 A803	V678-I680 HydrophobicContact CG1-CG1 4.09Å; V678-I680 PolarHBondContact O-N 3.07Å; V678-I680 VanDerWaalsContact O-N 3.16Å; V678-I725 HydrophobicContact CB-CG2 4.44Å; V678-I725 HydrophobicContact CG2-CG2 3.59Å; V678-F726 PolarHBondContact N-O 2.96Å; V678-V727 WeakPolarHBondContact O-CA 3.1Å; V678-Q728 PolarHBondContact O-N 2.83Å; V678-L770 HydrophobicContact CG1-CD1 4.4Å; V678-V779 HydrophobicContact CG2-CG2 3.5Å; V678-V779 VanDerWaalsContact CG2-CG2 3.5Å; V678-P800 HydrophobicContact CG2-CB 4.21Å; V678-P800 HydrophobicContact CG2-CG 4.12Å; V678-A803 HydrophobicContact CG1-CB 4.05Å
679	T	95.9	Very high	86.4	Confident	56 Å²	56	59.5 Å²	59.5	34%	0.344	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	94.1	-179.6	-55.6	0	0	0	0	111.4	K682 Q728 A803	T679-K682 HydrophobicContact CG2-CG 3.56Å; T679-Q728 HydrophobicContact CG2-CB 4.38Å; T679-A803 WeakPolarHBondContact O-CB 3.35Å
680	I	94.2	Very high	86.6	Confident	10 Å²	10	64.3 Å²	64.3	5%	0.051	35%	0.347	C	S	.	.	S	Bend	trans	-74.7	-47.5	178.4	-64.5	-177.6	0	0	0	111.2	V678 V727 Q728 L770 T772 H774 S805	V678-I680 HydrophobicContact CG1-CG1 4.09Å; V678-I680 PolarHBondContact O-N 3.07Å; V678-I680 VanDerWaalsContact O-N 3.16Å; I680-V727 HydrophobicContact CD1-CG1 3.4Å; I680-V727 VanDerWaalsContact CD1-CG1 3.4Å; I680-V727 HydrophobicContact CG1-CG1 3.82Å; I680-Q728 PolarHBondContact N-O 2.86Å; I680-L770 HydrophobicContact CD1-CD1 4.28Å; I680-T772 HydrophobicContact CD1-CG2 4.03Å; I680-T772 WeakPolarHBondContact CD1-OG1 3.37Å; I680-H774 HydrophobicContact CG2-CB 4.18Å; I680-H774 WeakPolarHBondContact CG2-O 3.43Å; I680-S805 WeakPolarHBondContact O-CB 3.25Å
681	K	89.5	Confident	86.7	Confident	22 Å²	22	64.9 Å²	64.9	10%	0.096	36%	0.358	C	S	.	.	S	Bend	trans	-133.6	121.4	173.3	-169.6	76.9	173.5	-171.4	0	109.6	M684 F687 Q728 I807 D809	K681-M684 VanDerWaalsContact CE-SD 3.54Å; K681-F687 HydrophobicContact CB-CD1 4.42Å; K681-F687 HydrophobicContact CB-CE1 3.82Å; K681-F687 HydrophobicContact CB-CZ 4.18Å; K681-F687 HydrophobicContact CG-CD1 3.63Å; K681-F687 HydrophobicContact CG-CE1 3.53Å; K681-F687 HydrophobicContact CG-CG 4.22Å; K681-F687 HydrophobicContact CG-CZ 4.03Å; K681-Q728 PolarHBondContact N-O 3.37Å; K681-I807 HydrophobicContact CB-CD1 4.06Å; K681-I807 HydrophobicContact CD-CD1 4.16Å; K681-I807 HydrophobicContact CG-CD1 3.91Å; K681-D809 IonicContact NZ-OD1 3.54Å; K681-D809 PolarHBondContact NZ-OD1 2.93Å
682	K	86	Confident	86.8	Confident	160 Å²	160	68 Å²	68	70%	0.696	37%	0.371	S	S	*	.			trans	-70.4	146.9	172.7	-69.9	-178.6	177.8	-175.2	0	110.2	T679 M684	T679-K682 HydrophobicContact CG2-CG 3.56Å; K682-M684 PolarHBondContact O-N 3.3Å
683	S	83.5	Confident	87.3	Confident	94 Å²	94	67.4 Å²	67.4	66%	0.657	37%	0.371	S	S	*	.			trans	-59.8	132.3	168.4	-169	0	0	0	0	109.4
684	M	85.9	Confident	87.6	Confident	72 Å²	72	68.4 Å²	68.4	36%	0.355	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-153	160.6	-177.8	59.5	-179	-72	0	0	109.5	K681 K682 G686 F687 L814	K681-M684 VanDerWaalsContact CE-SD 3.54Å; K682-M684 PolarHBondContact O-N 3.3Å; M684-G686 PolarHBondContact O-N 2.75Å; M684-F687 HydrophobicContact CG-CB 3.84Å; M684-F687 PolarHBondContact N-O 3.4Å; M684-F687 VanDerWaalsContact N-O 3.15Å; M684-F687 CarbonylContact O-C 3.34Å; M684-F687 WeakPolarHBondContact O-CA 3.46Å; M684-F687 PolarHBondContact O-N 2.85Å; M684-L814 HydrophobicContact CE-CD1 4.26Å; M684-L814 HydrophobicContact SD-CD2 4.37Å
685	P	81	Confident	87.9	Confident	125 Å²	125	63.8 Å²	63.8	81%	0.812	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	126.5	175.3	-28	36.4	0	0	0	111.7
686	G	77.4	Confident	88	Confident	34 Å²	34	64.3 Å²	64.3	35%	0.351	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	-19.2	-173.8	0	0	0	0	0	115.9	M684 L814	M684-G686 PolarHBondContact O-N 2.75Å; G686-L814 CarbonylContact O-C 3.54Å; G686-L814 WeakPolarHBondContact O-CB 3.49Å
687	F	83	Confident	87.8	Confident	3 Å²	3	65.4 Å²	65.4	1%	0.013	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-123.3	96.2	174.7	-174.2	-99	0	0	0	111.5	K681 M684 P729 H774 I807 L814 A817 A818	K681-F687 HydrophobicContact CB-CD1 4.42Å; K681-F687 HydrophobicContact CB-CE1 3.82Å; K681-F687 HydrophobicContact CB-CZ 4.18Å; K681-F687 HydrophobicContact CG-CD1 3.63Å; K681-F687 HydrophobicContact CG-CE1 3.53Å; K681-F687 HydrophobicContact CG-CG 4.22Å; K681-F687 HydrophobicContact CG-CZ 4.03Å; M684-F687 HydrophobicContact CG-CB 3.84Å; M684-F687 PolarHBondContact N-O 3.4Å; M684-F687 VanDerWaalsContact N-O 3.15Å; M684-F687 CarbonylContact O-C 3.34Å; M684-F687 WeakPolarHBondContact O-CA 3.46Å; M684-F687 PolarHBondContact O-N 2.85Å; F687-P729 HydrophobicContact CZ-CG 4.08Å; F687-H774 AromaticContact CE2-CD2 3.93Å; F687-H774 AromaticContact CZ-CD2 3.72Å; F687-I807 HydrophobicContact CD2-CD1 4.4Å; F687-I807 HydrophobicContact CE2-CD1 3.8Å; F687-I807 HydrophobicContact CZ-CD1 4.08Å; F687-L814 HydrophobicContact CB-CB 4.02Å; F687-L814 HydrophobicContact CB-CD2 3.82Å; F687-L814 HydrophobicContact CB-CG 4.37Å; F687-L814 HydrophobicContact CD2-CB 4.46Å; F687-L814 HydrophobicContact CD2-CD2 4.27Å; F687-L814 WeakPolarHBondContact CD2-O 3.46Å; F687-L814 HydrophobicContact CG-CD2 4.26Å; F687-A817 HydrophobicContact CD2-CB 4.37Å; F687-A817 HydrophobicContact CE2-CB 3.81Å; F687-A818 HydrophobicContact CD2-CB 4.35Å; F687-A818 HydrophobicContact CE2-CB 4.5Å
688	Q	85.8	Confident	87.3	Confident	137 Å²	137	63.3 Å²	63.3	64%	0.64	35%	0.351	S	S	*	.			trans	-125	125.4	170.5	-175	179.8	13.5	0	0	108	A818	Q688-A818 WeakPolarHBondContact O-CB 3.38Å
689	W	86.9	Confident	86	Confident	51 Å²	51	72 Å²	72	19%	0.193	39%	0.389	C	S	.	.			trans	-61.9	138	-178.8	175.9	-113	0	0	0	112.3	G691 H692 P729 P730 A731 H774 G820	W689-G691 VanDerWaalsContact CE2-CA 3.49Å; W689-G691 VanDerWaalsContact CZ2-CA 3.46Å; W689-G691 VanDerWaalsContact NE1-C 3.33Å; W689-G691 PolarHBondContact NE1-O 3.02Å; W689-H692 PolarHBondContact NE1-O 3.43Å; W689-P729 HydrophobicContact CB-CB 4.26Å; W689-P729 HydrophobicContact CD2-CB 3.84Å; W689-P729 HydrophobicContact CE3-CB 3.78Å; W689-P729 HydrophobicContact CE3-CG 4.38Å; W689-P729 HydrophobicContact CG-CB 4.09Å; W689-P729 HydrophobicContact CZ3-CB 4.39Å; W689-P730 HydrophobicContact CZ2-CG 4.45Å; W689-P730 WeakPolarHBondContact CZ2-O 3.47Å; W689-A731 HydrophobicContact CH2-CB 3.61Å; W689-A731 HydrophobicContact CZ2-CB 4.33Å; W689-A731 HydrophobicContact CZ3-CB 4Å; W689-H774 AromaticContact CZ3-CE1 3.6Å; W689-H774 AromaticContact CZ3-NE2 3.77Å; W689-G820 VanDerWaalsContact CZ3-CA 3.5Å
690	K	84.1	Confident	84	Confident	165 Å²	165	74.2 Å²	74.2	72%	0.717	41%	0.406	S	S	*	.			trans	-129.6	12.5	-177.7	-57.3	-173.9	179.5	-176.7	0	114.1	A818	K690-A818 PolarHBondContact N-O 2.9Å
691	G	82.6	Confident	82	Confident	38 Å²	38	77.2 Å²	77.2	39%	0.392	42%	0.419	S	S	.	.	S	Bend	trans	-96	-156.2	172.8	0	0	0	0	0	111.7	W689	W689-G691 VanDerWaalsContact CE2-CA 3.49Å; W689-G691 VanDerWaalsContact CZ2-CA 3.46Å; W689-G691 VanDerWaalsContact NE1-C 3.33Å; W689-G691 PolarHBondContact NE1-O 3.02Å
692	H	82	Confident	79.9	Confident	80 Å²	80	79.1 Å²	79.1	37%	0.37	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-53.4	144.7	-179.9	-60.6	-75.2	0	0	0	113.8	S638 R639 W689 P730	S638-H692 PolarHBondContact OG-CE1 2.78Å; S638-H692 VanDerWaalsContact OG-CE1 3.25Å; R639-H692 HydrophobicContact CG-CB 3.79Å; W689-H692 PolarHBondContact NE1-O 3.43Å; H692-P730 VanDerWaalsContact O-CG 3.31Å; H692-P730 WeakPolarHBondContact O-CG 3.22Å
693	A	88.8	Confident	77.7	Confident	59 Å²	59	77.4 Å²	77.4	49%	0.488	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-62.1	151.3	164.3	0	0	0	0	0	110.3	R639	R639-A693 VanDerWaalsContact CD-O 3.23Å; R639-A693 WeakPolarHBondContact CD-O 3.46Å
694	P	89.1	Confident	75.8	Confident	62 Å²	62	81.7 Å²	81.7	40%	0.403	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-60.7	158.5	169.7	29.8	-34.5	0	0	0	110.4	R639 P730	R639-P694 PolarHBondContact NH1-O 2.66Å; P694-P730 HydrophobicContact CB-CB 4.01Å; P694-P730 HydrophobicContact CB-CG 4.33Å
695	L	93.3	Very high	73.9	Confident	6 Å²	6	82.8 Å²	82.8	3%	0.031	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-83.6	141.4	171.9	-73.4	162.9	0	0	0	110.4	F603 V606 R639 V640 A658 Q660 F726	F603-L695 HydrophobicContact CB-CD2 4.31Å; F603-L695 HydrophobicContact CD1-CB 3.71Å; F603-L695 HydrophobicContact CD1-CD1 4.39Å; F603-L695 HydrophobicContact CD2-CD1 4Å; F603-L695 HydrophobicContact CD2-CD2 4.5Å; F603-L695 HydrophobicContact CE1-CB 4.04Å; F603-L695 HydrophobicContact CE1-CD1 4.33Å; F603-L695 HydrophobicContact CE2-CD1 3.93Å; F603-L695 HydrophobicContact CG-CB 4.03Å; F603-L695 HydrophobicContact CG-CD1 4.23Å; F603-L695 HydrophobicContact CG-CD2 4.28Å; F603-L695 HydrophobicContact CG-CG 4.43Å; F603-L695 HydrophobicContact CZ-CD1 4.1Å; V606-L695 HydrophobicContact CG2-CD2 3.87Å; R639-L695 HydrophobicContact CB-CD1 4.31Å; R639-L695 HydrophobicContact CB-CD2 3.9Å; R639-L695 HydrophobicContact CB-CG 4.09Å; V640-L695 HydrophobicContact CG1-CD1 4.07Å; V640-L695 HydrophobicContact CG1-CD2 4.15Å; A658-L695 HydrophobicContact CB-CD1 4.3Å; A658-L695 HydrophobicContact CB-CG 4.31Å; Q660-L695 HydrophobicContact CB-CD1 4.49Å; Q660-L695 HydrophobicContact CG-CD1 4.02Å; L695-F726 HydrophobicContact CB-CE1 4.16Å; L695-F726 WeakPolarHBondContact O-CE1 3.5Å; L695-F726 WeakPolarHBondContact O-CZ 3.35Å
696	T	92.7	Very high	71.8	Confident	58 Å²	58	82.3 Å²	82.3	36%	0.356	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-93.7	123.9	175.7	-49.1	0	0	0	0	110.6	F603 E604 D605	F603-T696 CarbonylContact C-O 3.57Å; F603-T696 WeakPolarHBondContact CA-O 3.25Å; F603-T696 WeakPolarHBondContact CB-O 3.34Å; E604-T696 PolarHBondContact N-O 2.75Å; E604-T696 WeakPolarHBondContact OE2-CG2 3.28Å; D605-T696 WeakPolarHBondContact OD2-CB 3.12Å; D605-T696 PolarHBondContact OD2-N 3.36Å; D605-T696 PolarHBondContact OD2-OG1 2.55Å
697	L	90.5	Very high	70.1	Confident	29 Å²	29	83.8 Å²	83.8	15%	0.152	45%	0.446	C	S	.	.	B	Isolated β-bridge	trans	-75.2	133.2	177.2	-175.8	75.4	0	0	0	111.1	L602 P675 K699 V724 F726	L602-L697 HydrophobicContact CB-CD1 4.07Å; L602-L697 WeakPolarHBondContact O-CD1 3.43Å; P675-L697 HydrophobicContact CB-CD2 4.08Å; P675-L697 HydrophobicContact CG-CD2 3.86Å; L697-K699 PolarHBondContact O-N 2.86Å; L697-V724 HydrophobicContact CD1-CG1 4.32Å; L697-V724 HydrophobicContact CD1-CG2 4.16Å; L697-F726 HydrophobicContact CB-CE2 4.12Å; L697-F726 HydrophobicContact CB-CZ 4.13Å
698	R	85.2	Confident	68.1	Low	68 Å²	68	89 Å²	89	26%	0.257	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-57.6	126.9	175.9	-71.7	-176.1	-171.4	-143.8	-5.3	112.2	I601 L602 F603 E604 Q608 C700 F701	I601-R698 WeakPolarHBondContact O-CD 3.43Å; I601-R698 PolarHBondContact O-NE 3.14Å; L602-R698 PolarHBondContact O-N 2.93Å; F603-R698 PolarHBondContact O-NE 2.8Å; F603-R698 PolarHBondContact O-NH2 3.42Å; E604-R698 HydrophobicContact CB-CG 4.48Å; E604-R698 HydrophobicContact CG-CB 4.2Å; E604-R698 HydrophobicContact CG-CG 3.62Å; E604-R698 WeakPolarHBondContact OE1-CA 3.47Å; Q608-R698 VanDerWaalsContact CG-NH2 3.33Å; R698-C700 PolarHBondContact O-N 2.93Å; R698-F701 HydrophobicContact CB-CD2 4.47Å
699	K	68.2	Low	66.3	Low	182 Å²	182	88.5 Å²	88.5	79%	0.791	48%	0.483	S	S	*	.	S	Bend	trans	-71.6	113.9	171	-67.8	170.9	-173.8	160.8	0	110.5	E604 L697	E604-K699 PolarHBondContact OE1-N 3.4Å; E604-K699 VanDerWaalsContact OE1-N 3.14Å; L697-K699 PolarHBondContact O-N 2.86Å
700	C	54.2	Low	64.5	Low	104 Å²	104	94.2 Å²	94.2	70%	0.703	51%	0.512	S	S	*	.			trans	63.5	104.4	-178	-75.9	0	0	0	0	116.4	R698 S702	R698-C700 PolarHBondContact O-N 2.93Å; C700-S702 VanDerWaalsContact C-N 3.34Å
701	F	51.6	Low	63	Low	73 Å²	73	91.5 Å²	91.5	32%	0.32	50%	0.502	S	S	.	.			trans	-92.5	12.7	168.7	-134.5	-92	0	0	0	113.2	I601 L602 T670 R698	I601-F701 HydrophobicContact CB-CZ 4.23Å; I601-F701 HydrophobicContact CD1-CZ 4.14Å; I601-F701 HydrophobicContact CG1-CZ 3.93Å; I601-F701 VanDerWaalsContact O-CE2 3.29Å; I601-F701 WeakPolarHBondContact O-CE2 3.27Å; L602-F701 HydrophobicContact CD2-CD2 4.35Å; L602-F701 HydrophobicContact CD2-CE2 4.21Å; T670-F701 HydrophobicContact CG2-CB 4.22Å; T670-F701 HydrophobicContact CG2-CD1 4.24Å; R698-F701 HydrophobicContact CB-CD2 4.47Å
702	S	45.6	Very low	61.6	Low	62 Å²	62	96.3 Å²	96.3	43%	0.434	52%	0.524	S	S	.	.			trans	-77.3	-28.3	-164.8	44.8	0	0	0	0	115	C700	C700-S702 VanDerWaalsContact C-N 3.34Å
703	D	39.9	Very low	60.5	Low	124 Å²	124	96.9 Å²	96.9	66%	0.663	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	2.7	-154.5	-61.8	3.8	0	0	0	114.6
704	K	44.3	Very low	59.5	Low	183 Å²	183	100 Å²	100	80%	0.796	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	1.1	-179.4	-71.7	-163.1	175.8	-171.3	0	115.8
705	F	44.8	Very low	58.8	Low	96 Å²	96	99.4 Å²	99.4	42%	0.421	54%	0.542	S	S	.	.			trans	-126.6	32.5	175.3	-80.7	-79.2	0	0	0	112.8	Y515 A707	Y515-F705 HydrophobicContact CE1-CE1 4.25Å; F705-A707 PolarHBondContact O-N 3.03Å
706	T	37.6	Very low	58.2	Low	115 Å²	115	100.7 Å²	100.7	71%	0.706	55%	0.55	S	S	*	*			trans	-62.5	106.5	156.9	45.8	0	0	0	0	107.9	N708	T706-N708 PolarHBondContact O-N 2.85Å
707	A	41.5	Very low	57.7	Low	64 Å²	64	98.8 Å²	98.8	53%	0.529	54%	0.54	S	S	.	.			trans	-52.6	128.4	174.3	0	0	0	0	0	109	F705	F705-A707 PolarHBondContact O-N 3.03Å
708	N	42.3	Very low	57.5	Low	113 Å²	113	98.6 Å²	98.6	60%	0.604	54%	0.539	S	S	*	.			trans	-60.7	125.9	177.1	-137.2	10.6	0	0	0	107	T706 E710 Q711	T706-N708 PolarHBondContact O-N 2.85Å; N708-E710 PolarHBondContact O-N 3.43Å; N708-Q711 PolarHBondContact O-N 2.74Å
709	P	47	Very low	57.8	Low	127 Å²	127	95.8 Å²	95.8	83%	0.825	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.2	-166.7	22.1	-32.9	0	0	0	114.6
710	E	50.2	Low	58.9	Low	171 Å²	171	88 Å²	88	80%	0.799	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.3	175.4	-58.3	-173.8	151.4	0	0	114.2	N708 T712	N708-E710 PolarHBondContact O-N 3.43Å; E710-T712 PolarHBondContact O-N 2.82Å
711	Q	50.8	Low	60.6	Low	107 Å²	107	83.3 Å²	83.3	50%	0.5	46%	0.463	S	S	.	.			trans	-79.5	104.9	176.7	-87	-177.1	-6.1	0	0	112	N708 T713	N708-Q711 PolarHBondContact O-N 2.74Å; Q711-T713 VanDerWaalsContact C-N 3.33Å; Q711-T713 PolarHBondContact O-N 2.95Å
712	T	53.3	Low	62.5	Low	140 Å²	140	80.6 Å²	80.6	86%	0.859	45%	0.453	S	S	*	.			trans	-75.7	-11.5	-177.5	48.3	0	0	0	0	115.1	E710	E710-T712 PolarHBondContact O-N 2.82Å
713	T	59.6	Low	64.7	Low	92 Å²	92	77.7 Å²	77.7	56%	0.564	43%	0.433	S	S	*	.	S	Bend	trans	-104	126.6	179.6	55.2	0	0	0	0	111.7	Q711 L715	Q711-T713 VanDerWaalsContact C-N 3.33Å; Q711-T713 PolarHBondContact O-N 2.95Å; T713-L715 PolarHBondContact O-N 3.48Å
714	P	68.2	Low	67.3	Low	125 Å²	125	71.8 Å²	71.8	81%	0.812	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-64.7	135.9	178.5	26.8	-34	0	0	0	111.7
715	L	74.1	Confident	69.8	Low	49 Å²	49	63 Å²	63	26%	0.257	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-61.7	136.7	177.7	-57.7	175.4	0	0	0	110.8	Y514 T713	Y514-L715 HydrophobicContact CE1-CD2 3.68Å; Y514-L715 HydrophobicContact CE2-CD2 4.49Å; Y514-L715 VanDerWaalsContact CZ-CD2 3.48Å; Y514-L715 WeakPolarHBondContact OH-CD2 3.11Å; T713-L715 PolarHBondContact O-N 3.48Å
716	P	80.3	Confident	72.2	Confident	33 Å²	33	59.6 Å²	59.6	21%	0.214	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-67.8	145.4	173.6	27.3	-31.4	0	0	0	110.8	A510 Y514 Y515	A510-P716 HydrophobicContact CB-CB 4.28Å; Y514-P716 VanDerWaalsContact CB-CG 3.44Å; Y514-P716 HydrophobicContact CD1-CG 3.68Å; Y514-P716 HydrophobicContact CD2-CG 4.21Å; Y514-P716 HydrophobicContact CG-CG 3.5Å; Y515-P716 HydrophobicContact CE2-CG 4.11Å; Y515-P716 PolarHBondContact OH-O 2.76Å
717	A	83.2	Confident	75	Confident	17 Å²	17	54.2 Å²	54.2	14%	0.14	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-52.3	141.6	173.5	0	0	0	0	0	110.8	F666 N668	F666-A717 HydrophobicContact CB-CB 4.43Å; F666-A717 HydrophobicContact CD1-CB 3.84Å; F666-A717 WeakPolarHBondContact CD1-O 3.44Å; F666-A717 WeakPolarHBondContact CE1-O 3.46Å; N668-A717 WeakPolarHBondContact OD1-CB 3.31Å
718	Q	86.5	Confident	77.5	Confident	26 Å²	26	54.6 Å²	54.6	12%	0.121	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	163.5	172.8	72.3	-177	-0.6	0	0	111.3	Y515 F666 L667 Q720	Y515-Q718 HydrophobicContact CD2-CB 4.28Å; Y515-Q718 HydrophobicContact CE2-CB 3.71Å; Y515-Q718 HydrophobicContact CE2-CG 4.47Å; Y515-Q718 VanDerWaalsContact CZ-OE1 3.28Å; F666-Q718 WeakPolarHBondContact CA-O 3.28Å; L667-Q718 PolarHBondContact N-O 2.84Å; L667-Q718 PolarHBondContact O-N 3.15Å; L667-Q718 VanDerWaalsContact O-N 3.12Å; Q718-Q720 HydrophobicContact CG-CG 3.9Å; Q718-Q720 PolarHBondContact O-N 3.09Å
719	L	90.7	Very high	80	Confident	8 Å²	8	49.3 Å²	49.3	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	100.3	173	-79.3	168.4	0	0	0	109.5	L508 F582 Y595 L597 L652 Y664 F666	L508-L719 HydrophobicContact CD2-CD1 4.04Å; F582-L719 HydrophobicContact CE1-CD1 4.32Å; F582-L719 HydrophobicContact CE2-CD1 4.16Å; F582-L719 HydrophobicContact CZ-CD1 3.7Å; Y595-L719 HydrophobicContact CD1-CD1 4.22Å; Y595-L719 HydrophobicContact CE1-CB 4.22Å; Y595-L719 HydrophobicContact CE1-CD1 3.82Å; Y595-L719 HydrophobicContact CE1-CG 4.4Å; L597-L719 HydrophobicContact CD1-CB 4.19Å; L652-L719 HydrophobicContact CB-CD2 4.5Å; L652-L719 HydrophobicContact CD2-CD1 4.15Å; Y664-L719 HydrophobicContact CD1-CB 4.39Å; F666-L719 HydrophobicContact CD2-CD2 3.64Å; F666-L719 HydrophobicContact CD2-CG 3.96Å; F666-L719 HydrophobicContact CE1-CG 4.41Å; F666-L719 HydrophobicContact CE2-CD1 4.13Å; F666-L719 HydrophobicContact CE2-CD2 3.69Å; F666-L719 HydrophobicContact CE2-CG 3.57Å; F666-L719 HydrophobicContact CG-CD2 4.36Å; F666-L719 HydrophobicContact CZ-CD1 4.37Å; F666-L719 HydrophobicContact CZ-CD2 4.43Å; F666-L719 HydrophobicContact CZ-CG 3.84Å
720	Q	90.6	Very high	82.2	Confident	20 Å²	20	43.3 Å²	43.3	9%	0.093	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.9	179.1	-71.6	-78.2	13.2	0	0	109.5	Y664 Q665 L667 F669 T670 Q718 T722	Y664-Q720 VanDerWaalsContact CA-O 3.3Å; Y664-Q720 WeakPolarHBondContact CA-O 2.99Å; Y664-Q720 VanDerWaalsContact CD1-C 3.47Å; Q665-Q720 PolarHBondContact N-O 3.28Å; Q665-Q720 PolarHBondContact O-N 2.61Å; L667-Q720 HydrophobicContact CB-CB 4.03Å; L667-Q720 HydrophobicContact CB-CG 4.04Å; L667-Q720 HydrophobicContact CD1-CB 4.07Å; L667-Q720 HydrophobicContact CG-CB 4.34Å; F669-Q720 WeakPolarHBondContact O-CG 3.44Å; T670-Q720 PolarHBondContact OG1-NE2 2.87Å; Q718-Q720 HydrophobicContact CG-CG 3.9Å; Q718-Q720 PolarHBondContact O-N 3.09Å; Q720-T722 PolarHBondContact O-N 3.34Å
721	A	91.5	Very high	84.1	Confident	4 Å²	4	35.3 Å²	35.3	3%	0.033	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127.2	176.3	0	0	0	0	0	109.4	L602 I662 V663 Y664 P671 I673	L602-A721 HydrophobicContact CD1-CB 4.03Å; I662-A721 HydrophobicContact CG2-CB 3.78Å; V663-A721 CarbonylContact O-C 3.48Å; V663-A721 WeakPolarHBondContact O-CA 3.33Å; Y664-A721 HydrophobicContact CD1-CB 4.07Å; Y664-A721 HydrophobicContact CE1-CB 3.75Å; P671-A721 WeakPolarHBondContact CG-O 3.45Å; I673-A721 HydrophobicContact CD1-CB 3.55Å; I673-A721 WeakPolarHBondContact CD1-O 3.35Å
722	T	90.3	Very high	86.2	Confident	17 Å²	17	34.2 Å²	34.2	10%	0.104	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-15.9	-179.8	62.2	0	0	0	0	112.7	V663 Q665 L667 Q720 P784	V663-T722 WeakPolarHBondContact CG1-OG1 3.41Å; V663-T722 PolarHBondContact O-N 2.73Å; V663-T722 PolarHBondContact O-OG1 3.02Å; Q665-T722 HydrophobicContact CB-CG2 3.9Å; Q665-T722 HydrophobicContact CG-CG2 4.15Å; L667-T722 HydrophobicContact CD1-CG2 3.84Å; Q720-T722 PolarHBondContact O-N 3.34Å; T722-P784 HydrophobicContact CG2-CB 4.4Å; T722-P784 HydrophobicContact CG2-CG 3.86Å
723	G	91.4	Very high	88.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	132.4	170.8	0	0	0	0	0	111.5	I662 V663	I662-G723 WeakPolarHBondContact CA-O 3.21Å; V663-G723 PolarHBondContact N-O 2.91Å; V663-G723 PolarHBondContact O-N 3.46Å
724	V	94.7	Very high	89.9	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134	172.6	175.9	0	0	0	0	108.8	L602 I662 I673 P675 A676 L697 F726	L602-V724 HydrophobicContact CD1-CG2 4.4Å; I662-V724 HydrophobicContact CG2-CG2 4.12Å; I673-V724 HydrophobicContact CG2-CB 4.25Å; I673-V724 HydrophobicContact CG2-CG2 4.07Å; P675-V724 VanDerWaalsContact CA-O 3.32Å; P675-V724 WeakPolarHBondContact CA-O 3.25Å; P675-V724 HydrophobicContact CB-CB 4.32Å; P675-V724 HydrophobicContact CB-CG1 4.2Å; A676-V724 PolarHBondContact N-O 3.09Å; L697-V724 HydrophobicContact CD1-CG1 4.32Å; L697-V724 HydrophobicContact CD1-CG2 4.16Å; V724-F726 HydrophobicContact CG1-CE1 4.33Å; V724-F726 HydrophobicContact CG1-CE2 3.98Å; V724-F726 HydrophobicContact CG1-CZ 3.88Å
725	I	97	Very high	91.2	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.9	-176.3	-62.4	152.6	0	0	0	108.5	Q660 V661 A676 V678 L768 L770 V779 V781 P798	Q660-I725 CarbonylContact C-O 3.54Å; Q660-I725 WeakPolarHBondContact CA-O 3.5Å; V661-I725 HydrophobicContact CB-CB 4.29Å; V661-I725 PolarHBondContact N-O 3.09Å; V661-I725 PolarHBondContact O-N 2.99Å; A676-I725 HydrophobicContact CB-CG1 4.32Å; A676-I725 CarbonylContact O-C 3.44Å; A676-I725 WeakPolarHBondContact O-CA 3.4Å; V678-I725 HydrophobicContact CB-CG2 4.44Å; V678-I725 HydrophobicContact CG2-CG2 3.59Å; I725-L768 HydrophobicContact CD1-CD2 3.59Å; I725-L770 HydrophobicContact CG2-CD2 3.8Å; I725-V779 HydrophobicContact CD1-CB 4.03Å; I725-V779 HydrophobicContact CD1-CG1 3.8Å; I725-V779 HydrophobicContact CD1-CG2 4.14Å; I725-V779 HydrophobicContact CG1-CG1 4.15Å; I725-V779 HydrophobicContact CG2-CG2 4.23Å; I725-V781 HydrophobicContact CD1-CG2 4.42Å; I725-P798 HydrophobicContact CG1-CB 4.19Å; I725-P798 HydrophobicContact CG1-CG 4.42Å
726	F	96.4	Very high	92.2	Very high	23 Å²	23	16.5 Å²	16.5	10%	0.101	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.7	172.6	-64.3	-63.4	0	0	0	110.2	F603 Q660 P675 A676 I677 V678 L695 L697 V724	F603-F726 HydrophobicContact CD1-CZ 4.35Å; F603-F726 AromaticContact CE1-CE1 3.84Å; F603-F726 HydrophobicContact CE1-CE1 3.84Å; F603-F726 AromaticContact CE1-CZ 3.82Å; F603-F726 HydrophobicContact CE1-CZ 3.82Å; Q660-F726 HydrophobicContact CB-CD1 3.97Å; Q660-F726 HydrophobicContact CB-CE1 3.93Å; P675-F726 HydrophobicContact CB-CD2 3.89Å; P675-F726 HydrophobicContact CB-CE2 3.75Å; P675-F726 HydrophobicContact CG-CE2 4.26Å; A676-F726 PolarHBondContact O-N 2.85Å; I677-F726 CarbonylContact C-O 3.59Å; I677-F726 WeakPolarHBondContact CA-O 3.45Å; V678-F726 PolarHBondContact N-O 2.96Å; L695-F726 HydrophobicContact CB-CE1 4.16Å; L695-F726 WeakPolarHBondContact O-CE1 3.5Å; L695-F726 WeakPolarHBondContact O-CZ 3.35Å; L697-F726 HydrophobicContact CB-CE2 4.12Å; L697-F726 HydrophobicContact CB-CZ 4.13Å; V724-F726 HydrophobicContact CG1-CE1 4.33Å; V724-F726 HydrophobicContact CG1-CE2 3.98Å; V724-F726 HydrophobicContact CG1-CZ 3.88Å
727	V	95.8	Very high	92.8	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.012	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	138.8	175.9	-176.1	0	0	0	0	110.4	G659 V678 I680 P729 P730 I733 L770 T772	G659-V727 WeakPolarHBondContact O-CB 3.45Å; G659-V727 WeakPolarHBondContact O-CG2 3.33Å; G659-V727 PolarHBondContact O-N 2.83Å; V678-V727 WeakPolarHBondContact O-CA 3.1Å; I680-V727 HydrophobicContact CD1-CG1 3.4Å; I680-V727 VanDerWaalsContact CD1-CG1 3.4Å; I680-V727 HydrophobicContact CG1-CG1 3.82Å; V727-P729 CarbonylContact C-O 3.42Å; V727-P729 CarbonylContact O-C 3.57Å; V727-P729 VanDerWaalsContact O-O 3.12Å; V727-P730 VanDerWaalsContact O-CA 3.28Å; V727-P730 WeakPolarHBondContact O-CA 3.46Å; V727-I733 HydrophobicContact CG2-CD1 4.16Å; V727-L770 HydrophobicContact CG2-CD1 3.54Å; V727-L770 HydrophobicContact CG2-CD2 4.22Å; V727-T772 HydrophobicContact CB-CG2 4.46Å; V727-T772 HydrophobicContact CG1-CG2 3.81Å
728	Q	94.6	Very high	93.2	Very high	73 Å²	73	15.4 Å²	15.4	34%	0.341	7%	0.073	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.7	171.8	-169.6	65.7	18.1	0	0	110.5	I677 V678 T679 I680 K681	I677-Q728 HydrophobicContact CG2-CB 4.5Å; V678-Q728 PolarHBondContact O-N 2.83Å; T679-Q728 HydrophobicContact CG2-CB 4.38Å; I680-Q728 PolarHBondContact N-O 2.86Å; K681-Q728 PolarHBondContact N-O 3.37Å
729	P	93.1	Very high	93.1	Very high	1 Å²	1	15 Å²	15	1%	0.006	7%	0.074	C	C	.	.	S	Bend	cis	-66.3	155.9	-1	32.6	-40.3	0	0	0	113.4	F687 W689 V727 A731 H774	F687-P729 HydrophobicContact CZ-CG 4.08Å; W689-P729 HydrophobicContact CB-CB 4.26Å; W689-P729 HydrophobicContact CD2-CB 3.84Å; W689-P729 HydrophobicContact CE3-CB 3.78Å; W689-P729 HydrophobicContact CE3-CG 4.38Å; W689-P729 HydrophobicContact CG-CB 4.09Å; W689-P729 HydrophobicContact CZ3-CB 4.39Å; V727-P729 CarbonylContact C-O 3.42Å; V727-P729 CarbonylContact O-C 3.57Å; V727-P729 VanDerWaalsContact O-O 3.12Å; P729-A731 PolarHBondContact O-N 3.37Å; P729-H774 HydrophobicContact CG-CB 4.14Å
730	P	93.8	Very high	92.5	Very high	1 Å²	1	16 Å²	16	1%	0.006	8%	0.078	C	C	.	.			trans	-77.5	62.6	-178.6	34.9	-38.1	0	0	0	111.1	A658 W689 H692 P694 V727	A658-P730 CarbonylContact C-O 3.29Å; A658-P730 CarbonylContact O-C 3.48Å; A658-P730 WeakPolarHBondContact O-CA 3.37Å; A658-P730 WeakPolarHBondContact O-CB 3.09Å; W689-P730 HydrophobicContact CZ2-CG 4.45Å; W689-P730 WeakPolarHBondContact CZ2-O 3.47Å; H692-P730 VanDerWaalsContact O-CG 3.31Å; H692-P730 WeakPolarHBondContact O-CG 3.22Å; P694-P730 HydrophobicContact CB-CB 4.01Å; P694-P730 HydrophobicContact CB-CG 4.33Å; V727-P730 VanDerWaalsContact O-CA 3.28Å; V727-P730 WeakPolarHBondContact O-CA 3.46Å
731	A	91	Very high	91.6	Very high	3 Å²	3	16.5 Å²	16.5	3%	0.025	8%	0.08	C	C	.	.	P	Polyproline II helix	trans	-98.3	148.1	179.5	0	0	0	0	0	110.8	G659 W689 P729 I733 H774	G659-A731 WeakPolarHBondContact CA-O 3.48Å; G659-A731 PolarHBondContact N-O 2.79Å; W689-A731 HydrophobicContact CH2-CB 3.61Å; W689-A731 HydrophobicContact CZ2-CB 4.33Å; W689-A731 HydrophobicContact CZ3-CB 4Å; P729-A731 PolarHBondContact O-N 3.37Å; A731-I733 PolarHBondContact O-N 2.91Å; A731-H774 WeakPolarHBondContact CB-CE1 3.05Å; A731-H774 WeakPolarHBondContact CB-ND1 3.38Å
732	R	93.1	Very high	90.3	Very high	85 Å²	85	19.9 Å²	19.9	32%	0.321	10%	0.095	S	C	.	.	P	Polyproline II helix	trans	-48.2	141.6	-178.8	69.4	168.1	173.8	-130.3	-19.3	113.2	Q643 A657 T734 P773 E821	Q643-R732 HydrophobicContact CG-CB 4.21Å; A657-R732 WeakPolarHBondContact O-CA 3.18Å; A657-R732 WeakPolarHBondContact O-CB 3.27Å; A657-R732 PolarHBondContact O-N 3.15Å; R732-T734 HydrophobicContact CG-CG2 4.47Å; R732-T734 PolarHBondContact O-N 3.16Å; R732-P773 WeakPolarHBondContact O-CD 3.19Å; R732-E821 IonicContact CZ-OE1 2.69Å; R732-E821 IonicContact NH1-OE1 3.92Å; R732-E821 PolarHBondContact NH1-OE1 2.84Å; R732-E821 IonicContact NH2-OE1 2.68Å; R732-E821 PolarHBondContact NH2-OE1 3.09Å
733	I	96.1	Very high	88.8	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.005	10%	0.096	C	C	.	.	P	Polyproline II helix	trans	-68.9	127.2	173.5	-57.8	-59	0	0	0	109.3	F644 G656 V661 V727 A731 L736 G771 T772	F644-I733 HydrophobicContact CD2-CG2 4.32Å; F644-I733 WeakPolarHBondContact CD2-O 3.37Å; G656-I733 PolarHBondContact O-N 3.3Å; G656-I733 VanDerWaalsContact O-N 3.14Å; V661-I733 HydrophobicContact CG2-CD1 3.43Å; V661-I733 VanDerWaalsContact CG2-CD1 3.43Å; V661-I733 HydrophobicContact CG2-CG1 3.73Å; V727-I733 HydrophobicContact CG2-CD1 4.16Å; A731-I733 PolarHBondContact O-N 2.91Å; I733-L736 HydrophobicContact CG2-CD1 4.24Å; I733-L736 HydrophobicContact CG2-CD2 3.62Å; I733-L736 HydrophobicContact CG2-CG 3.62Å; I733-G771 WeakPolarHBondContact CA-O 3.49Å; I733-T772 HydrophobicContact CD1-CG2 4.28Å
734	T	94.4	Very high	86.9	Confident	15 Å²	15	22.9 Å²	22.9	9%	0.092	11%	0.112	C	C	.	.			trans	-108.2	-8	-177.5	57.4	0	0	0	0	114	F644 R732 G771 T772 P773 I927 I928	F644-T734 VanDerWaalsContact CE2-O 3.29Å; F644-T734 WeakPolarHBondContact CE2-O 3.28Å; F644-T734 VanDerWaalsContact CZ-O 3.23Å; F644-T734 WeakPolarHBondContact CZ-O 3.34Å; R732-T734 HydrophobicContact CG-CG2 4.47Å; R732-T734 PolarHBondContact O-N 3.16Å; T734-G771 PolarHBondContact N-O 2.95Å; T734-G771 PolarHBondContact OG1-O 3.16Å; T734-T772 WeakPolarHBondContact OG1-CA 3.41Å; T734-T772 PolarHBondContact OG1-N 3.07Å; T734-T772 PolarHBondContact OG1-O 2.59Å; T734-P773 HydrophobicContact CG2-CG 4.01Å; T734-I927 HydrophobicContact CG2-CG2 4.22Å; T734-I928 WeakPolarHBondContact CB-O 3.16Å; T734-I928 PolarHBondContact OG1-O 3.01Å
735	S	95.4	Very high	84.9	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.014	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	144.1	174.2	53.1	0	0	0	0	110.3	G771 F931	S735-G771 PolarHBondContact O-N 2.93Å; S735-F931 VanDerWaalsContact OG-CE2 3.23Å; S735-F931 WeakPolarHBondContact OG-CE2 3.44Å
736	L	95.5	Very high	82.7	Confident	15 Å²	15	29.9 Å²	29.9	8%	0.079	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	154.6	170.5	-67.6	178.1	0	0	0	110.5	F644 V653 V661 I733 L768 A769 L770	F644-L736 HydrophobicContact CB-CD1 3.79Å; F644-L736 HydrophobicContact CB-CG 4.08Å; V653-L736 HydrophobicContact CG1-CD1 4.02Å; V661-L736 HydrophobicContact CG1-CD1 4.27Å; V661-L736 HydrophobicContact CG1-CD2 3.96Å; V661-L736 HydrophobicContact CG2-CD2 4.07Å; I733-L736 HydrophobicContact CG2-CD1 4.24Å; I733-L736 HydrophobicContact CG2-CD2 3.62Å; I733-L736 HydrophobicContact CG2-CG 3.62Å; L736-L768 HydrophobicContact CD2-CD1 4.41Å; L736-A769 WeakPolarHBondContact CA-O 3.17Å; L736-L770 HydrophobicContact CD2-CB 3.68Å
737	L	93.6	Very high	80.4	Confident	20 Å²	20	34.1 Å²	34.1	11%	0.105	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	129.4	165.5	179.1	68.4	0	0	0	109.9	Y646 A769 F931 F933	Y646-L737 HydrophobicContact CE1-CD1 4.02Å; L737-A769 PolarHBondContact N-O 3.44Å; L737-A769 PolarHBondContact O-N 3.24Å; L737-F931 HydrophobicContact CB-CB 3.69Å; L737-F931 HydrophobicContact CB-CD2 4.17Å; L737-F931 HydrophobicContact CB-CG 4.3Å; L737-F931 HydrophobicContact CD2-CB 3.54Å; L737-F931 HydrophobicContact CG-CB 4.27Å; L737-F933 HydrophobicContact CD2-CD2 3.35Å; L737-F933 HydrophobicContact CD2-CE2 3.72Å; L737-F933 HydrophobicContact CD2-CG 4.1Å; L737-F933 HydrophobicContact CG-CD2 3.7Å; L737-F933 HydrophobicContact CG-CE2 3.76Å
738	L	90.7	Very high	77.9	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.042	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	152.7	170.7	83.7	84.6	0	0	0	111.2	Y646 V648 T651 V653 E740 I766 L767 L768	Y646-L738 HydrophobicContact CD1-CB 4.27Å; Y646-L738 HydrophobicContact CD1-CD2 3.86Å; Y646-L738 HydrophobicContact CD1-CG 3.78Å; Y646-L738 HydrophobicContact CE1-CB 4.46Å; Y646-L738 HydrophobicContact CE1-CD2 4.34Å; Y646-L738 HydrophobicContact CE1-CG 3.85Å; V648-L738 HydrophobicContact CB-CD1 4.2Å; V648-L738 HydrophobicContact CB-CD2 4.41Å; V648-L738 HydrophobicContact CB-CG 4.43Å; V648-L738 HydrophobicContact CG1-CD1 4.36Å; T651-L738 HydrophobicContact CG2-CD2 3.87Å; V653-L738 HydrophobicContact CB-CD2 4.49Å; V653-L738 HydrophobicContact CG2-CB 4.29Å; V653-L738 HydrophobicContact CG2-CD2 3.57Å; L738-E740 HydrophobicContact CD1-CG 3.56Å; L738-I766 HydrophobicContact CB-CG2 4.31Å; L738-L767 CarbonylContact C-O 3.51Å; L738-L767 WeakPolarHBondContact CA-O 3.33Å; L738-L768 HydrophobicContact CB-CD1 4.5Å
739	S	84.9	Confident	75.3	Confident	18 Å²	18	43 Å²	43	13%	0.126	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	126.7	161.5	-176.8	0	0	0	0	108.8	L767	S739-L767 PolarHBondContact N-O 3.43Å; S739-L767 PolarHBondContact O-N 3.08Å
740	E	78.9	Confident	72.8	Confident	29 Å²	29	46.3 Å²	46.3	14%	0.136	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135.4	169.2	-52.7	-168.8	146.1	0	0	109.7	T651 L738 L764 Q765	T651-E740 WeakPolarHBondContact CB-OE1 3.29Å; T651-E740 PolarHBondContact OG1-OE1 3.12Å; L738-E740 HydrophobicContact CD1-CG 3.56Å; E740-L764 HydrophobicContact CB-CD2 3.78Å; E740-Q765 WeakPolarHBondContact CA-O 3.47Å
741	F	71	Confident	69.9	Low	29 Å²	29	53.5 Å²	53.5	13%	0.127	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	148.9	177.3	63.2	-73.3	0	0	0	111.2	L743 Q765 L767 F780 L984	F741-L743 HydrophobicContact CD2-CD1 3.8Å; F741-L743 HydrophobicContact CE2-CD1 3.53Å; F741-Q765 WeakPolarHBondContact CD1-O 3.47Å; F741-Q765 HydrophobicContact CE1-CB 4.17Å; F741-Q765 WeakPolarHBondContact CE1-O 3.41Å; F741-Q765 HydrophobicContact CE2-CB 4.3Å; F741-Q765 HydrophobicContact CZ-CB 3.98Å; F741-Q765 PolarHBondContact N-O 3.5Å; F741-Q765 PolarHBondContact O-N 2.95Å; F741-L767 HydrophobicContact CD1-CB 4.29Å; F741-L767 HydrophobicContact CE1-CB 3.73Å; F741-F780 AromaticContact CZ-CD2 3.93Å; F741-F780 HydrophobicContact CZ-CD2 3.93Å; F741-F780 AromaticContact CZ-CE2 3.75Å; F741-F780 HydrophobicContact CZ-CE2 3.75Å; F741-L984 HydrophobicContact CE2-CD1 4.3Å; F741-L984 HydrophobicContact CZ-CD1 3.79Å
742	E	64.7	Low	67	Low	76 Å²	76	61.6 Å²	61.6	36%	0.355	30%	0.303	S	S	.	.			trans	-113.4	130.6	-175.8	-147.1	-170.7	138.3	0	0	108.7	T744 G762	E742-T744 WeakPolarHBondContact CG-OG1 3.19Å; E742-T744 PolarHBondContact OE1-OG1 2.94Å; E742-G762 WeakPolarHBondContact CG-O 3.3Å
743	L	57.9	Low	63.9	Low	24 Å²	24	65.1 Å²	65.1	13%	0.126	32%	0.323	C	S	.	.	S	Bend	trans	-87.5	-14.3	-175.2	-109.7	88.9	0	0	0	114.7	F741 H745 L746 L976 P982	F741-L743 HydrophobicContact CD2-CD1 3.8Å; F741-L743 HydrophobicContact CE2-CD1 3.53Å; L743-H745 PolarHBondContact O-N 2.86Å; L743-L746 HydrophobicContact CG-CD1 4.29Å; L743-L746 PolarHBondContact O-N 2.8Å; L743-L746 VanDerWaalsContact O-N 3.1Å; L743-L976 HydrophobicContact CD2-CD2 3.6Å; L743-L976 HydrophobicContact CD2-CG 4.22Å; L743-L976 HydrophobicContact CG-CD2 4.11Å; L743-P982 HydrophobicContact CD1-CB 4.44Å; L743-P982 HydrophobicContact CD1-CG 3.96Å; L743-P982 HydrophobicContact CD2-CB 3.46Å; L743-P982 VanDerWaalsContact CD2-CB 3.46Å; L743-P982 HydrophobicContact CD2-CG 3.63Å; L743-P982 HydrophobicContact CG-CG 4.46Å
744	T	52.7	Low	60.7	Low	55 Å²	55	70.6 Å²	70.6	34%	0.337	36%	0.357	S	S	.	.	H	α-helix	trans	-51.5	-51.3	179.3	42.6	0	0	0	0	111.4	E742 L746 K747	E742-T744 WeakPolarHBondContact CG-OG1 3.19Å; E742-T744 PolarHBondContact OE1-OG1 2.94Å; T744-L746 VanDerWaalsContact C-N 3.27Å; T744-L746 PolarHBondContact O-N 2.92Å; T744-K747 WeakPolarHBondContact O-CB 3.32Å; T744-K747 PolarHBondContact O-N 3.11Å
745	H	52.5	Low	57.5	Low	110 Å²	110	77 Å²	77	51%	0.509	39%	0.39	S	S	.	.	H	α-helix	trans	-64.8	-20.9	178.8	-74	-61.8	0	0	0	115.4	L743 K747 E748	L743-H745 PolarHBondContact O-N 2.86Å; H745-K747 VanDerWaalsContact C-N 3.27Å; H745-K747 PolarHBondContact O-N 2.87Å; H745-E748 IonicContact CE1-OE2 2.68Å; H745-E748 IonicContact CG-OE2 3.61Å; H745-E748 IonicContact ND1-OE2 3.49Å; H745-E748 PolarHBondContact ND1-OE2 2.98Å
746	L	51.3	Low	54.3	Low	37 Å²	37	84.7 Å²	84.7	19%	0.194	43%	0.431	C	S	.	.	H	α-helix	trans	-76.6	-15	174.1	-78.4	163	0	0	0	112.5	L743 T744 V971 L976	L743-L746 HydrophobicContact CG-CD1 4.29Å; L743-L746 PolarHBondContact O-N 2.8Å; L743-L746 VanDerWaalsContact O-N 3.1Å; T744-L746 VanDerWaalsContact C-N 3.27Å; T744-L746 PolarHBondContact O-N 2.92Å; L746-V971 HydrophobicContact CD1-CG1 4.19Å; L746-L976 HydrophobicContact CB-CD1 3.91Å; L746-L976 HydrophobicContact CB-CD2 3.4Å; L746-L976 HydrophobicContact CB-CG 4.31Å; L746-L976 HydrophobicContact CD1-CD1 4.44Å; L746-L976 HydrophobicContact CD1-CD2 4.38Å
747	K	46.7	Very low	51.1	Low	112 Å²	112	91.1 Å²	91.1	49%	0.487	46%	0.464	S	S	.	.	H	α-helix	trans	-80.4	-32.2	174	-68.2	-177.1	170.7	-179.1	0	113.1	T744 H745 F749 S750 L976	T744-K747 WeakPolarHBondContact O-CB 3.32Å; T744-K747 PolarHBondContact O-N 3.11Å; H745-K747 VanDerWaalsContact C-N 3.27Å; H745-K747 PolarHBondContact O-N 2.87Å; K747-F749 PolarHBondContact O-N 3.13Å; K747-F749 VanDerWaalsContact O-N 3.14Å; K747-S750 WeakPolarHBondContact O-CB 3.45Å; K747-S750 PolarHBondContact O-N 2.79Å; K747-L976 WeakPolarHBondContact CE-O 3.46Å; K747-L976 HydrophobicContact CG-CD2 4.36Å
748	E	43.9	Very low	47.9	Very low	133 Å²	133	96.1 Å²	96.1	62%	0.621	50%	0.501	S	S	*	.	H	α-helix	trans	-57.4	-30.2	178.9	-66.3	-179.4	124.2	0	0	112.2	H745 S750	H745-E748 IonicContact CE1-OE2 2.68Å; H745-E748 IonicContact CG-OE2 3.61Å; H745-E748 IonicContact ND1-OE2 3.49Å; H745-E748 PolarHBondContact ND1-OE2 2.98Å; E748-S750 PolarHBondContact O-N 3.19Å
749	F	40.2	Very low	44.8	Very low	130 Å²	130	98.2 Å²	98.2	57%	0.57	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-3.8	175	-80.7	-82.8	0	0	0	115.5	K747 I1023	K747-F749 PolarHBondContact O-N 3.13Å; K747-F749 VanDerWaalsContact O-N 3.14Å; F749-I1023 HydrophobicContact CE1-CG2 4.46Å; F749-I1023 HydrophobicContact CE2-CG2 4.01Å; F749-I1023 HydrophobicContact CZ-CG2 3.63Å
750	S	40.2	Very low	42.2	Very low	69 Å²	69	104.8 Å²	104.8	48%	0.483	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.6	-18.8	-177.6	-167.3	0	0	0	0	114.6	K747 E748 N977	K747-S750 WeakPolarHBondContact O-CB 3.45Å; K747-S750 PolarHBondContact O-N 2.79Å; E748-S750 PolarHBondContact O-N 3.19Å; S750-N977 PolarHBondContact OG-ND2 2.92Å
751	Q	33.9	Very low	40.1	Very low	153 Å²	153	106.1 Å²	106.1	72%	0.715	58%	0.58	S	S	*	*			trans	-146.5	110.2	-173.7	-74.5	-174.9	-37.1	0	0	113.7	Q753	Q751-Q753 PolarHBondContact O-N 2.67Å
752	N	30	Very low	38.6	Very low	173 Å²	173	106.2 Å²	106.2	93%	0.925	59%	0.589	S	S	*	*			trans	-70.8	75.5	150.6	-89.3	-12.1	0	0	0	109.1
753	Q	27.7	Very low	38	Very low	158 Å²	158	103.7 Å²	103.7	74%	0.738	58%	0.583	S	S	*	*			trans	-170.9	114.1	157.2	-109.2	160.5	34.4	0	0	112.4	Q751	Q751-Q753 PolarHBondContact O-N 2.67Å
754	T	28	Very low	38.3	Very low	117 Å²	117	106 Å²	106	72%	0.718	60%	0.596	S	S	*	*			trans	15.7	108.1	144.4	55	0	0	0	0	118.6
755	N	28.6	Very low	39.5	Very low	148 Å²	148	104.9 Å²	104.9	79%	0.791	59%	0.586	S	S	*	*				-176.6	145.1	105.4	-91.4	-21.5	0	0	0	112.9	I757	N755-I757 PolarHBondContact O-N 3.06Å
756	N	26.8	Very low	41.1	Very low	164 Å²	164	99.8 Å²	99.8	88%	0.877	56%	0.563	S	S	*	*			trans	-67.1	114.5	172.3	-73.2	-22.9	0	0	0	110.3
757	I	28.6	Very low	43	Very low	150 Å²	150	98.4 Å²	98.4	77%	0.769	56%	0.556	S	S	*	*			trans	-119.4	87.8	158	-57.3	-178.6	0	0	0	107.6	N755 G759	N755-I757 PolarHBondContact O-N 3.06Å; I757-G759 VanDerWaalsContact C-N 3.3Å; I757-G759 PolarHBondContact O-N 3.37Å; I757-G759 VanDerWaalsContact O-N 3.14Å
758	S	25.9	Very low	45.3	Very low	126 Å²	126	93.1 Å²	93.1	88%	0.881	53%	0.533	S	S	*	.			trans	-74.4	86.2	160	51.5	0	0	0	0	108
759	G	26.5	Very low	47.8	Very low	52 Å²	52	86.8 Å²	86.8	54%	0.536	50%	0.503	S	S	.	.			trans	-163.6	115.9	-174.2	0	0	0	0	0	112.7	I757	I757-G759 VanDerWaalsContact C-N 3.3Å; I757-G759 PolarHBondContact O-N 3.37Å; I757-G759 VanDerWaalsContact O-N 3.14Å
760	D	31	Very low	50.5	Low	155 Å²	155	80.6 Å²	80.6	83%	0.829	48%	0.476	S	S	*	.	S	Bend	trans	63.2	117.4	-175.2	-160.5	20.6	0	0	0	116.3	G762	D760-G762 PolarHBondContact O-N 3.41Å
761	G	34.6	Very low	53.2	Low	57 Å²	57	77.3 Å²	77.3	59%	0.588	45%	0.453	S	S	*	.			trans	-70.7	118.7	-174.9	0	0	0	0	0	111.5	G763	G761-G763 VanDerWaalsContact C-N 3.29Å; G761-G763 PolarHBondContact O-N 3.01Å
762	G	39	Very low	56	Low	31 Å²	31	70 Å²	70	32%	0.32	42%	0.419	S	S	.	.			trans	-59.8	85.9	176.4	0	0	0	0	0	111.8	E742 D760 L764	E742-G762 WeakPolarHBondContact CG-O 3.3Å; D760-G762 PolarHBondContact O-N 3.41Å; G762-L764 PolarHBondContact O-N 3.17Å
763	G	52.6	Low	58.8	Low	23 Å²	23	62.1 Å²	62.1	24%	0.237	38%	0.377	C	S	.	.			trans	-61.1	137.7	-171.6	0	0	0	0	0	112.1	G761 Q765	G761-G763 VanDerWaalsContact C-N 3.29Å; G761-G763 PolarHBondContact O-N 3.01Å; G763-Q765 PolarHBondContact O-N 3.5Å
764	L	63.8	Low	61.8	Low	74 Å²	74	54.7 Å²	54.7	39%	0.387	34%	0.343	S	S	.	.			trans	-57.9	136.3	-173.2	-67.4	112.1	0	0	0	111.6	E740 G762	E740-L764 HydrophobicContact CB-CD2 3.78Å; G762-L764 PolarHBondContact O-N 3.17Å
765	Q	76.9	Confident	64.9	Low	30 Å²	30	49.1 Å²	49.1	14%	0.14	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	146.3	176.2	-56.5	-175.8	13.1	0	0	109.2	E740 F741 G763 F780	E740-Q765 WeakPolarHBondContact CA-O 3.47Å; F741-Q765 WeakPolarHBondContact CD1-O 3.47Å; F741-Q765 HydrophobicContact CE1-CB 4.17Å; F741-Q765 WeakPolarHBondContact CE1-O 3.41Å; F741-Q765 HydrophobicContact CE2-CB 4.3Å; F741-Q765 HydrophobicContact CZ-CB 3.98Å; F741-Q765 PolarHBondContact N-O 3.5Å; F741-Q765 PolarHBondContact O-N 2.95Å; G763-Q765 PolarHBondContact O-N 3.5Å; Q765-F780 HydrophobicContact CB-CE2 3.89Å; Q765-F780 HydrophobicContact CB-CZ 4.43Å; Q765-F780 VanDerWaalsContact OE1-CE2 3.26Å
766	I	87.4	Confident	68.2	Low	3 Å²	3	42 Å²	42	2%	0.015	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.8	-169.4	-62.5	158.3	0	0	0	109.7	T651 V663 L738 L768 V781	T651-I766 HydrophobicContact CG2-CD1 3.6Å; T651-I766 HydrophobicContact CG2-CG1 4.36Å; V663-I766 HydrophobicContact CG1-CD1 3.74Å; L738-I766 HydrophobicContact CB-CG2 4.31Å; I766-L768 HydrophobicContact CG2-CB 4.48Å; I766-V781 HydrophobicContact CB-CB 4.18Å; I766-V781 PolarHBondContact N-O 2.81Å; I766-V781 PolarHBondContact O-N 3.02Å
767	L	90.6	Very high	71.5	Confident	9 Å²	9	34.2 Å²	34.2	5%	0.047	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	116.8	167.2	-171.6	66.4	0	0	0	108.4	L738 S739 F741 V778 L801 F933 I969 L984	L738-L767 CarbonylContact C-O 3.51Å; L738-L767 WeakPolarHBondContact CA-O 3.33Å; S739-L767 PolarHBondContact N-O 3.43Å; S739-L767 PolarHBondContact O-N 3.08Å; F741-L767 HydrophobicContact CD1-CB 4.29Å; F741-L767 HydrophobicContact CE1-CB 3.73Å; L767-V778 HydrophobicContact CD1-CG1 3.61Å; L767-V778 HydrophobicContact CG-CG1 4.08Å; L767-L801 HydrophobicContact CD1-CD1 3.68Å; L767-F933 HydrophobicContact CB-CZ 4.45Å; L767-F933 HydrophobicContact CD2-CE1 3.69Å; L767-F933 HydrophobicContact CD2-CZ 3.88Å; L767-F933 HydrophobicContact CG-CE1 4.36Å; L767-F933 HydrophobicContact CG-CZ 4.05Å; L767-I969 HydrophobicContact CD2-CD1 3.76Å; L767-I969 HydrophobicContact CD2-CG1 4.43Å; L767-I969 HydrophobicContact CD2-CG2 4.42Å; L767-L984 HydrophobicContact CD1-CD1 4.39Å
768	L	94.7	Very high	74.7	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.9	-174.3	175.4	59	0	0	0	110.4	V653 V661 V663 I725 L736 L738 I766 V778 V779	V653-L768 HydrophobicContact CG1-CD1 3.91Å; V653-L768 HydrophobicContact CG1-CD2 4.06Å; V661-L768 HydrophobicContact CG1-CD2 3.87Å; V663-L768 HydrophobicContact CG2-CD2 3.89Å; I725-L768 HydrophobicContact CD1-CD2 3.59Å; L736-L768 HydrophobicContact CD2-CD1 4.41Å; L738-L768 HydrophobicContact CB-CD1 4.5Å; I766-L768 HydrophobicContact CG2-CB 4.48Å; L768-V778 CarbonylContact O-C 3.48Å; L768-V778 WeakPolarHBondContact O-CA 3.22Å; L768-V779 PolarHBondContact N-O 3.1Å; L768-V779 PolarHBondContact O-N 3.03Å
769	A	96.4	Very high	78	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.1	167.7	0	0	0	0	0	109.8	L736 L737 F931 L955	L736-A769 WeakPolarHBondContact CA-O 3.17Å; L737-A769 PolarHBondContact N-O 3.44Å; L737-A769 PolarHBondContact O-N 3.24Å; A769-F931 HydrophobicContact CB-CD1 3.94Å; A769-F931 HydrophobicContact CB-CD2 4.03Å; A769-F931 HydrophobicContact CB-CE1 3.97Å; A769-F931 HydrophobicContact CB-CE2 4.05Å; A769-F931 HydrophobicContact CB-CG 3.97Å; A769-F931 HydrophobicContact CB-CZ 4.03Å; A769-L955 HydrophobicContact CB-CD1 4.12Å; A769-L955 HydrophobicContact CB-CD2 4.19Å
770	L	97.5	Very high	81.1	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.8	-179.4	63.7	80.9	0	0	0	111.1	V661 V678 I680 I725 V727 L736 F776 G777 V779 F931	V661-L770 HydrophobicContact CG2-CB 4.39Å; V661-L770 HydrophobicContact CG2-CD2 4.09Å; V678-L770 HydrophobicContact CG1-CD1 4.4Å; I680-L770 HydrophobicContact CD1-CD1 4.28Å; I725-L770 HydrophobicContact CG2-CD2 3.8Å; V727-L770 HydrophobicContact CG2-CD1 3.54Å; V727-L770 HydrophobicContact CG2-CD2 4.22Å; L736-L770 HydrophobicContact CD2-CB 3.68Å; L770-F776 CarbonylContact O-C 3.49Å; L770-F776 WeakPolarHBondContact O-CA 3.3Å; L770-F776 VanDerWaalsContact O-CB 3.23Å; L770-F776 WeakPolarHBondContact O-CB 3.44Å; L770-G777 PolarHBondContact N-O 2.98Å; L770-G777 PolarHBondContact O-N 2.82Å; L770-V779 HydrophobicContact CD2-CG2 4.11Å; L770-F931 WeakPolarHBondContact O-CZ 3.43Å
771	G	96.2	Very high	84	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	148.4	-176.4	0	0	0	0	0	112.2	I733 T734 S735	I733-G771 WeakPolarHBondContact CA-O 3.49Å; T734-G771 PolarHBondContact N-O 2.95Å; T734-G771 PolarHBondContact OG1-O 3.16Å; S735-G771 PolarHBondContact O-N 2.93Å
772	T	94.4	Very high	86.3	Confident	0 Å²	0	9.2 Å²	9.2	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	175.9	178	62.6	0	0	0	0	110	I680 V727 I733 T734 H774 G775 I928	I680-T772 HydrophobicContact CD1-CG2 4.03Å; I680-T772 WeakPolarHBondContact CD1-OG1 3.37Å; V727-T772 HydrophobicContact CB-CG2 4.46Å; V727-T772 HydrophobicContact CG1-CG2 3.81Å; I733-T772 HydrophobicContact CD1-CG2 4.28Å; T734-T772 WeakPolarHBondContact OG1-CA 3.41Å; T734-T772 PolarHBondContact OG1-N 3.07Å; T734-T772 PolarHBondContact OG1-O 2.59Å; T772-H774 PolarHBondContact O-N 2.86Å; T772-H774 PolarHBondContact OG1-N 3.01Å; T772-G775 PolarHBondContact N-O 2.91Å; T772-G775 PolarHBondContact OG1-N 2.92Å; T772-G775 PolarHBondContact OG1-O 3.37Å; T772-I928 PolarHBondContact O-N 2.82Å
773	P	88.9	Confident	88.1	Confident	8 Å²	8	12 Å²	12	5%	0.052	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.1	167.4	-23.3	36.1	0	0	0	113.8	R732 T734 V925 I927	R732-P773 WeakPolarHBondContact O-CD 3.19Å; T734-P773 HydrophobicContact CG2-CG 4.01Å; P773-V925 WeakPolarHBondContact O-CG1 3.37Å; P773-I927 HydrophobicContact CB-CD1 4.02Å; P773-I927 HydrophobicContact CB-CG1 4.13Å
774	H	90.2	Very high	89.1	Confident	1 Å²	1	12 Å²	12	1%	0.005	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-12.9	-169.8	-56	83.2	0	0	0	114.1	I680 F687 W689 P729 A731 T772 S805 T806 I807 A817	I680-H774 HydrophobicContact CG2-CB 4.18Å; I680-H774 WeakPolarHBondContact CG2-O 3.43Å; F687-H774 AromaticContact CE2-CD2 3.93Å; F687-H774 AromaticContact CZ-CD2 3.72Å; W689-H774 AromaticContact CZ3-CE1 3.6Å; W689-H774 AromaticContact CZ3-NE2 3.77Å; P729-H774 HydrophobicContact CG-CB 4.14Å; A731-H774 WeakPolarHBondContact CB-CE1 3.05Å; A731-H774 WeakPolarHBondContact CB-ND1 3.38Å; T772-H774 PolarHBondContact O-N 2.86Å; T772-H774 PolarHBondContact OG1-N 3.01Å; H774-S805 VanDerWaalsContact O-CA 3.28Å; H774-S805 WeakPolarHBondContact O-CA 3.33Å; H774-S805 PolarHBondContact O-OG 2.93Å; H774-T806 PolarHBondContact O-N 2.67Å; H774-I807 HydrophobicContact CB-CD1 3.91Å; H774-I807 HydrophobicContact CB-CG1 4.43Å; H774-A817 PolarHBondContact NE2-O 2.81Å
775	G	93.3	Very high	89.3	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.2	-159.4	-175	0	0	0	0	0	112.6	T772 V804 T806 I928	T772-G775 PolarHBondContact N-O 2.91Å; T772-G775 PolarHBondContact OG1-N 2.92Å; T772-G775 PolarHBondContact OG1-O 3.37Å; G775-V804 CarbonylContact C-O 3.4Å; G775-V804 VanDerWaalsContact CA-O 3.26Å; G775-V804 WeakPolarHBondContact CA-O 3.35Å; G775-T806 WeakPolarHBondContact CA-OG1 3.37Å; G775-T806 PolarHBondContact N-OG1 2.92Å; G775-I928 VanDerWaalsContact C-CG1 3.45Å; G775-I928 VanDerWaalsContact O-CG1 3.27Å; G775-I928 WeakPolarHBondContact O-CG1 3.21Å
776	F	96.4	Very high	88.8	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	163	178.9	62.3	-84	0	0	0	112.5	L770 L802 V804 I928 F931 I957 Y967	L770-F776 CarbonylContact O-C 3.49Å; L770-F776 WeakPolarHBondContact O-CA 3.3Å; L770-F776 VanDerWaalsContact O-CB 3.23Å; L770-F776 WeakPolarHBondContact O-CB 3.44Å; F776-L802 HydrophobicContact CE2-CD2 3.83Å; F776-L802 HydrophobicContact CE2-CG 4.34Å; F776-V804 HydrophobicContact CD1-CB 4.22Å; F776-V804 HydrophobicContact CE1-CB 3.64Å; F776-V804 HydrophobicContact CE1-CG1 3.74Å; F776-V804 HydrophobicContact CE1-CG2 4.35Å; F776-V804 HydrophobicContact CE2-CB 4.01Å; F776-V804 HydrophobicContact CE2-CG2 4.02Å; F776-V804 HydrophobicContact CZ-CB 3.51Å; F776-V804 HydrophobicContact CZ-CG1 3.89Å; F776-V804 HydrophobicContact CZ-CG2 3.71Å; F776-V804 PolarHBondContact N-O 2.93Å; F776-V804 PolarHBondContact O-N 3.24Å; F776-I928 HydrophobicContact CB-CD1 4.46Å; F776-I928 HydrophobicContact CB-CG1 4.04Å; F776-I928 HydrophobicContact CD1-CD1 3.85Å; F776-I928 HydrophobicContact CD1-CG1 4.33Å; F776-F931 HydrophobicContact CB-CE1 4.17Å; F776-F931 HydrophobicContact CB-CZ 3.96Å; F776-I957 HydrophobicContact CD1-CD1 4.07Å; F776-I957 HydrophobicContact CD1-CG2 4.1Å; F776-I957 HydrophobicContact CD2-CD1 3.65Å; F776-I957 HydrophobicContact CE1-CD1 3.75Å; F776-I957 HydrophobicContact CE1-CG2 4.4Å; F776-I957 HydrophobicContact CE2-CD1 3.3Å; F776-I957 HydrophobicContact CG-CD1 4.03Å; F776-I957 HydrophobicContact CG-CG2 4.43Å; F776-I957 HydrophobicContact CZ-CD1 3.35Å; F776-Y967 HydrophobicContact CE2-CE2 4.25Å; F776-Y967 HydrophobicContact CZ-CD2 4.38Å; F776-Y967 AromaticContact CZ-CE2 3.6Å; F776-Y967 HydrophobicContact CZ-CE2 3.6Å; F776-Y967 AromaticContact CZ-CZ 3.8Å
777	G	96.5	Very high	87.4	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.3	165	0	0	0	0	0	111.7	L770 L802	L770-G777 PolarHBondContact N-O 2.98Å; L770-G777 PolarHBondContact O-N 2.82Å; G777-L802 CarbonylContact C-O 3.55Å; G777-L802 WeakPolarHBondContact CA-O 3.45Å
778	V	96.3	Very high	85.5	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126.3	167.6	-175.1	0	0	0	0	107.8	L767 L768 L801 L802 L955 L986	L767-V778 HydrophobicContact CD1-CG1 3.61Å; L767-V778 HydrophobicContact CG-CG1 4.08Å; L768-V778 CarbonylContact O-C 3.48Å; L768-V778 WeakPolarHBondContact O-CA 3.22Å; V778-L801 PolarHBondContact O-N 2.71Å; V778-L802 HydrophobicContact CB-CB 4.26Å; V778-L802 HydrophobicContact CG2-CB 4.5Å; V778-L802 PolarHBondContact N-O 3.26Å; V778-L802 PolarHBondContact O-N 2.91Å; V778-L955 HydrophobicContact CG2-CD2 3.56Å; V778-L986 HydrophobicContact CB-CD2 4.07Å; V778-L986 HydrophobicContact CG1-CD1 4.41Å; V778-L986 HydrophobicContact CG1-CD2 4.02Å; V778-L986 HydrophobicContact CG2-CD2 3.82Å
779	V	95.2	Very high	83.3	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.3	-177.1	-174	0	0	0	0	108.7	V678 I725 L768 L770 V781 P798 Q799	V678-V779 HydrophobicContact CG2-CG2 3.5Å; V678-V779 VanDerWaalsContact CG2-CG2 3.5Å; I725-V779 HydrophobicContact CD1-CB 4.03Å; I725-V779 HydrophobicContact CD1-CG1 3.8Å; I725-V779 HydrophobicContact CD1-CG2 4.14Å; I725-V779 HydrophobicContact CG1-CG1 4.15Å; I725-V779 HydrophobicContact CG2-CG2 4.23Å; L768-V779 PolarHBondContact N-O 3.1Å; L768-V779 PolarHBondContact O-N 3.03Å; L770-V779 HydrophobicContact CD2-CG2 4.11Å; V779-V781 HydrophobicContact CG1-CG2 4.31Å; V779-P798 HydrophobicContact CG1-CB 3.68Å; V779-Q799 WeakPolarHBondContact CA-O 3.27Å
780	F	92.1	Very high	81	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	124.9	168.7	167.3	-104.3	0	0	0	108.9	F741 Q765 P782 P798 Q799 L801 L981 P982 L984	F741-F780 AromaticContact CZ-CD2 3.93Å; F741-F780 HydrophobicContact CZ-CD2 3.93Å; F741-F780 AromaticContact CZ-CE2 3.75Å; F741-F780 HydrophobicContact CZ-CE2 3.75Å; Q765-F780 HydrophobicContact CB-CE2 3.89Å; Q765-F780 HydrophobicContact CB-CZ 4.43Å; Q765-F780 VanDerWaalsContact OE1-CE2 3.26Å; F780-P782 HydrophobicContact CE1-CB 4.21Å; F780-P798 CarbonylContact O-C 3.59Å; F780-P798 WeakPolarHBondContact O-CA 3.15Å; F780-Q799 HydrophobicContact CD1-CB 4.4Å; F780-Q799 PolarHBondContact N-O 3.24Å; F780-Q799 PolarHBondContact O-N 3.33Å; F780-L801 HydrophobicContact CB-CD1 3.9Å; F780-L801 HydrophobicContact CB-CD2 4.05Å; F780-L801 HydrophobicContact CB-CG 3.91Å; F780-L981 HydrophobicContact CE1-CB 4.4Å; F780-L981 HydrophobicContact CE1-CD1 4.1Å; F780-L981 HydrophobicContact CE1-CD2 4Å; F780-L981 HydrophobicContact CE1-CG 4.4Å; F780-L981 HydrophobicContact CZ-CD2 4.22Å; F780-P982 HydrophobicContact CE2-CG 4.4Å; F780-P982 HydrophobicContact CZ-CG 4.02Å; F780-L984 HydrophobicContact CB-CD1 4.45Å; F780-L984 HydrophobicContact CD2-CD1 3.65Å; F780-L984 HydrophobicContact CE2-CD1 4.17Å; F780-L984 HydrophobicContact CG-CD1 4.2Å
781	V	90.5	Very high	78.6	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.3	-179	-170.6	0	0	0	0	107.6	V663 I725 I766 V779 P798	V663-V781 HydrophobicContact CG2-CG2 4.11Å; I725-V781 HydrophobicContact CD1-CG2 4.42Å; I766-V781 HydrophobicContact CB-CB 4.18Å; I766-V781 PolarHBondContact N-O 2.81Å; I766-V781 PolarHBondContact O-N 3.02Å; V779-V781 HydrophobicContact CG1-CG2 4.31Å; V781-P798 HydrophobicContact CG1-CG 4.47Å; V781-P798 HydrophobicContact CG2-CB 4.3Å
782	P	82.9	Confident	76.2	Confident	12 Å²	12	50.2 Å²	50.2	8%	0.078	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-73.6	161.4	-179.3	31.3	-34.6	0	0	0	111.7	F780 L796 L981	F780-P782 HydrophobicContact CE1-CB 4.21Å; P782-L796 HydrophobicContact CB-CB 4.48Å; P782-L796 HydrophobicContact CG-CB 3.93Å; P782-L796 WeakPolarHBondContact CG-O 3.21Å; P782-L981 HydrophobicContact CB-CD1 4.18Å; P782-L981 HydrophobicContact CB-CD2 3.84Å
783	K	77.4	Confident	74.2	Confident	91 Å²	91	57.5 Å²	57.5	40%	0.396	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-60.7	132.4	174.2	-171.9	-163.4	-178.4	178.7	0	109.8
784	P	73.5	Confident	72.9	Confident	22 Å²	22	65.5 Å²	65.5	14%	0.143	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-65.2	138	168.7	29.3	-35.9	0	0	0	110.5	L667 P671 T722	L667-P784 HydrophobicContact CD1-CB 4.32Å; L667-P784 HydrophobicContact CD1-CG 4.03Å; L667-P784 HydrophobicContact CD2-CG 4.36Å; P671-P784 HydrophobicContact CB-CB 4.42Å; T722-P784 HydrophobicContact CG2-CB 4.4Å; T722-P784 HydrophobicContact CG2-CG 3.86Å
785	L	68.9	Low	71.6	Confident	93 Å²	93	68 Å²	68	49%	0.487	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-102	143.1	173.7	-70.2	167.7	0	0	0	109.7
786	P	66.4	Low	70.7	Confident	69 Å²	69	72.4 Å²	72.4	45%	0.448	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-70.6	141.6	172.5	30.1	-33.6	0	0	0	110.9	F669 N788	F669-P786 HydrophobicContact CE1-CB 4.18Å; F669-P786 HydrophobicContact CZ-CB 4.1Å; P786-N788 PolarHBondContact O-N 2.91Å
787	N	57.8	Low	70.1	Confident	106 Å²	106	74.3 Å²	74.3	57%	0.567	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-7.2	-173.1	-73	-15.5	0	0	0	115.4	D789	N787-D789 VanDerWaalsContact C-N 3.34Å; N787-D789 PolarHBondContact O-N 2.98Å
788	N	50.1	Low	69.8	Low	153 Å²	153	74.7 Å²	74.7	82%	0.818	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-4.9	-171	-76.4	4.4	0	0	0	115	P786 S790	P786-N788 PolarHBondContact O-N 2.91Å; N788-S790 PolarHBondContact O-N 3.48Å
789	D	49.3	Very low	69.5	Low	115 Å²	115	78.1 Å²	78.1	62%	0.615	42%	0.419	S	S	*	.			trans	-73.5	94.3	169.4	-81.1	-17.6	0	0	0	109.9	N787 N791	N787-D789 VanDerWaalsContact C-N 3.34Å; N787-D789 PolarHBondContact O-N 2.98Å; D789-N791 CarbonylContact O-C 3.56Å; D789-N791 PolarHBondContact O-N 3.45Å
790	S	46.5	Very low	69.4	Low	108 Å²	108	81.1 Å²	81.1	76%	0.755	44%	0.438	S	S	*	.	S	Bend	trans	-58	-9.7	-177	54.1	0	0	0	0	115.5	N788 T792	N788-S790 PolarHBondContact O-N 3.48Å; S790-T792 PolarHBondContact O-N 3.39Å
791	N	47.8	Very low	69.5	Low	147 Å²	147	83.3 Å²	83.3	79%	0.786	45%	0.45	S	S	*	.	S	Bend	trans	-89.2	78.6	164.1	-77.4	-48	0	0	0	110	D789 K793	D789-N791 CarbonylContact O-C 3.56Å; D789-N791 PolarHBondContact O-N 3.45Å; N791-K793 PolarHBondContact O-N 3.38Å
792	T	46.6	Very low	69.7	Low	127 Å²	127	84.9 Å²	84.9	78%	0.779	46%	0.458	S	S	*	.			trans	-58.5	85.3	-168.2	58.5	0	0	0	0	114.7	S790 K794	S790-T792 PolarHBondContact O-N 3.39Å; T792-K794 PolarHBondContact O-N 2.93Å
793	K	52.4	Low	70.3	Confident	153 Å²	153	86.4 Å²	86.4	67%	0.665	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-71.6	117	154.6	-74.9	-177.1	177.8	177.4	0	107.2	N791	N791-K793 PolarHBondContact O-N 3.38Å
794	K	60.8	Low	71.1	Confident	177 Å²	177	83.4 Å²	83.4	77%	0.77	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-49.7	142.5	172.3	-83.1	-171.8	171.5	-171	0	110.2	T792 L796	T792-K794 PolarHBondContact O-N 2.93Å; K794-L796 PolarHBondContact O-N 2.84Å
795	P	62.6	Low	72	Confident	53 Å²	53	84 Å²	84	34%	0.344	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-54.8	134.1	172.4	26.2	-35.4	0	0	0	109	C672 P797	C672-P795 HydrophobicContact CB-CG 4.03Å; C672-P795 WeakPolarHBondContact O-CB 3.12Å; C672-P795 WeakPolarHBondContact O-CG 3.3Å; P795-P797 WeakPolarHBondContact O-CD 3.29Å
796	L	75.5	Confident	73	Confident	92 Å²	92	80.4 Å²	80.4	48%	0.482	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-80.8	118.6	-177.9	-79.5	149.3	0	0	0	108.8	P782 K794 L981	P782-L796 HydrophobicContact CB-CB 4.48Å; P782-L796 HydrophobicContact CG-CB 3.93Å; P782-L796 WeakPolarHBondContact CG-O 3.21Å; K794-L796 PolarHBondContact O-N 2.84Å; L796-L981 HydrophobicContact CB-CD1 4.05Å; L796-L981 HydrophobicContact CD1-CD1 3.79Å; L796-L981 HydrophobicContact CD1-CD2 4.39Å; L796-L981 HydrophobicContact CD1-CG 3.95Å; L796-L981 HydrophobicContact CD2-CD1 3.9Å; L796-L981 HydrophobicContact CG-CD1 4.12Å
797	P	83	Confident	73.8	Confident	40 Å²	40	77.5 Å²	77.5	26%	0.26	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-62.8	156.9	177.6	23.8	-32.7	0	0	0	111	E674 P795 Q799	E674-P797 HydrophobicContact CB-CB 4.05Å; E674-P797 HydrophobicContact CG-CB 4.09Å; P795-P797 WeakPolarHBondContact O-CD 3.29Å; P797-Q799 PolarHBondContact O-N 2.96Å
798	P	89.5	Confident	74.9	Confident	8 Å²	8	74.7 Å²	74.7	5%	0.052	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-54.2	137.8	168.5	-19.5	30.5	0	0	0	110.5	E674 A676 I725 V779 F780 V781 P800	E674-P798 WeakPolarHBondContact O-CD 3.22Å; A676-P798 HydrophobicContact CB-CB 3.76Å; A676-P798 HydrophobicContact CB-CG 4.2Å; A676-P798 WeakPolarHBondContact CB-O 2.97Å; I725-P798 HydrophobicContact CG1-CB 4.19Å; I725-P798 HydrophobicContact CG1-CG 4.42Å; V779-P798 HydrophobicContact CG1-CB 3.68Å; F780-P798 CarbonylContact O-C 3.59Å; F780-P798 WeakPolarHBondContact O-CA 3.15Å; V781-P798 HydrophobicContact CG1-CG 4.47Å; V781-P798 HydrophobicContact CG2-CB 4.3Å; P798-P800 WeakPolarHBondContact O-CD 3.38Å
799	Q	90.7	Very high	76.3	Confident	73 Å²	73	73 Å²	73	34%	0.341	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	112.7	-174.7	-63.5	-168.1	-3.7	0	0	110.9	V779 F780 P797 L801	V779-Q799 WeakPolarHBondContact CA-O 3.27Å; F780-Q799 HydrophobicContact CD1-CB 4.4Å; F780-Q799 PolarHBondContact N-O 3.24Å; F780-Q799 PolarHBondContact O-N 3.33Å; P797-Q799 PolarHBondContact O-N 2.96Å; Q799-L801 PolarHBondContact O-N 3.35Å; Q799-L801 VanDerWaalsContact O-N 3.12Å
800	P	93.5	Very high	77.8	Confident	64 Å²	64	70.3 Å²	70.3	42%	0.416	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	111.9	169.3	-21	33.9	0	0	0	110.1	A676 V678 P798	A676-P800 HydrophobicContact CB-CG 4.34Å; V678-P800 HydrophobicContact CG2-CB 4.21Å; V678-P800 HydrophobicContact CG2-CG 4.12Å; P798-P800 WeakPolarHBondContact O-CD 3.38Å
801	L	93.2	Very high	79.4	Confident	45 Å²	45	70 Å²	70	24%	0.236	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-32.9	177.5	-59.9	-176.1	0	0	0	112.1	L767 V778 F780 Q799 L984 L986	L767-L801 HydrophobicContact CD1-CD1 3.68Å; V778-L801 PolarHBondContact O-N 2.71Å; F780-L801 HydrophobicContact CB-CD1 3.9Å; F780-L801 HydrophobicContact CB-CD2 4.05Å; F780-L801 HydrophobicContact CB-CG 3.91Å; Q799-L801 PolarHBondContact O-N 3.35Å; Q799-L801 VanDerWaalsContact O-N 3.12Å; L801-L984 HydrophobicContact CD1-CB 3.62Å; L801-L984 HydrophobicContact CD1-CD1 4.07Å; L801-L984 HydrophobicContact CD2-CB 4.25Å; L801-L986 HydrophobicContact CB-CD1 3.8Å; L801-L986 HydrophobicContact CD1-CD1 3.67Å; L801-L986 HydrophobicContact CG-CD1 4.44Å
802	L	94.7	Very high	80.7	Confident	35 Å²	35	68.1 Å²	68.1	18%	0.183	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	138.3	-175.3	-177.9	61.4	0	0	0	109.9	F776 G777 V778 V804 Y967 L986	F776-L802 HydrophobicContact CE2-CD2 3.83Å; F776-L802 HydrophobicContact CE2-CG 4.34Å; G777-L802 CarbonylContact C-O 3.55Å; G777-L802 WeakPolarHBondContact CA-O 3.45Å; V778-L802 HydrophobicContact CB-CB 4.26Å; V778-L802 HydrophobicContact CG2-CB 4.5Å; V778-L802 PolarHBondContact N-O 3.26Å; V778-L802 PolarHBondContact O-N 2.91Å; L802-V804 HydrophobicContact CD1-CG2 3.64Å; L802-V804 HydrophobicContact CD2-CG2 4.24Å; L802-V804 HydrophobicContact CG-CG2 3.84Å; L802-Y967 HydrophobicContact CD2-CD1 3.66Å; L802-Y967 HydrophobicContact CD2-CE1 3.59Å; L802-Y967 HydrophobicContact CD2-CG 4.34Å; L802-L986 HydrophobicContact CD2-CB 4.02Å; L802-L986 HydrophobicContact CD2-CD2 4.07Å
803	A	95.7	Very high	82.2	Confident	43 Å²	43	62.1 Å²	62.1	36%	0.355	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	127.9	167.5	0	0	0	0	0	108.5	V678 T679	V678-A803 HydrophobicContact CG1-CB 4.05Å; T679-A803 WeakPolarHBondContact O-CB 3.35Å
804	V	95	Very high	83.6	Confident	29 Å²	29	55 Å²	55	18%	0.176	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	116.7	-172.6	176.1	0	0	0	0	109.5	G775 F776 L802	G775-V804 CarbonylContact C-O 3.4Å; G775-V804 VanDerWaalsContact CA-O 3.26Å; G775-V804 WeakPolarHBondContact CA-O 3.35Å; F776-V804 HydrophobicContact CD1-CB 4.22Å; F776-V804 HydrophobicContact CE1-CB 3.64Å; F776-V804 HydrophobicContact CE1-CG1 3.74Å; F776-V804 HydrophobicContact CE1-CG2 4.35Å; F776-V804 HydrophobicContact CE2-CB 4.01Å; F776-V804 HydrophobicContact CE2-CG2 4.02Å; F776-V804 HydrophobicContact CZ-CB 3.51Å; F776-V804 HydrophobicContact CZ-CG1 3.89Å; F776-V804 HydrophobicContact CZ-CG2 3.71Å; F776-V804 PolarHBondContact N-O 2.93Å; F776-V804 PolarHBondContact O-N 3.24Å; L802-V804 HydrophobicContact CD1-CG2 3.64Å; L802-V804 HydrophobicContact CD2-CG2 4.24Å; L802-V804 HydrophobicContact CG-CG2 3.84Å
805	S	92.5	Very high	84.5	Confident	34 Å²	34	52.2 Å²	52.2	24%	0.238	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	145.5	170	-169.3	0	0	0	0	111.8	I680 H774 I807	I680-S805 WeakPolarHBondContact O-CB 3.25Å; H774-S805 VanDerWaalsContact O-CA 3.28Å; H774-S805 WeakPolarHBondContact O-CA 3.33Å; H774-S805 PolarHBondContact O-OG 2.93Å; S805-I807 WeakPolarHBondContact OG-CG1 3.35Å; S805-I807 PolarHBondContact OG-N 3Å; S805-I807 VanDerWaalsContact OG-N 3.12Å
806	T	89.7	Confident	85.1	Confident	17 Å²	17	50.7 Å²	50.7	10%	0.104	28%	0.281	C	S	.	.			trans	-107	12.9	168	51.4	0	0	0	0	113.3	H774 G775 A926 I928	H774-T806 PolarHBondContact O-N 2.67Å; G775-T806 WeakPolarHBondContact CA-OG1 3.37Å; G775-T806 PolarHBondContact N-OG1 2.92Å; T806-A926 VanDerWaalsContact CB-O 3.24Å; T806-A926 WeakPolarHBondContact CB-O 3.1Å; T806-A926 HydrophobicContact CG2-CB 4.36Å; T806-A926 WeakPolarHBondContact CG2-O 3.26Å; T806-A926 PolarHBondContact OG1-O 2.82Å; T806-I928 HydrophobicContact CG2-CD1 3.8Å
807	I	83.7	Confident	85.2	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.041	26%	0.261	C	S	.	.			trans	-90.6	118.1	176.7	-46.6	163.2	0	0	0	109	K681 F687 H774 S805 A813 L814 A817	K681-I807 HydrophobicContact CB-CD1 4.06Å; K681-I807 HydrophobicContact CD-CD1 4.16Å; K681-I807 HydrophobicContact CG-CD1 3.91Å; F687-I807 HydrophobicContact CD2-CD1 4.4Å; F687-I807 HydrophobicContact CE2-CD1 3.8Å; F687-I807 HydrophobicContact CZ-CD1 4.08Å; H774-I807 HydrophobicContact CB-CD1 3.91Å; H774-I807 HydrophobicContact CB-CG1 4.43Å; S805-I807 WeakPolarHBondContact OG-CG1 3.35Å; S805-I807 PolarHBondContact OG-N 3Å; S805-I807 VanDerWaalsContact OG-N 3.12Å; I807-A813 HydrophobicContact CG2-CB 4.32Å; I807-L814 HydrophobicContact CG2-CD2 3.88Å; I807-A817 HydrophobicContact CD1-CB 3.81Å; I807-A817 HydrophobicContact CG1-CB 4.06Å; I807-A817 HydrophobicContact CG2-CB 4.08Å
808	P	81.1	Confident	85	Confident	47 Å²	47	45 Å²	45	31%	0.305	25%	0.25	S	S	.	.			trans	-62.1	148.5	169.3	-16.5	30.3	0	0	0	111.4	N810 N924	P808-N810 PolarHBondContact O-N 2.93Å; P808-N924 WeakPolarHBondContact CD-O 3.43Å; P808-N924 HydrophobicContact CG-CB 4.38Å; P808-N924 WeakPolarHBondContact CG-O 3.49Å
809	D	77.7	Confident	84.3	Confident	119 Å²	119	47 Å²	47	64%	0.636	27%	0.268	S	S	*	.	S	Bend	trans	-79.3	27.3	-177.4	-59.6	-55	0	0	0	114.2	K681	K681-D809 IonicContact NZ-OD1 3.54Å; K681-D809 PolarHBondContact NZ-OD1 2.93Å
810	N	82.1	Confident	83	Confident	57 Å²	57	44.2 Å²	44.2	31%	0.305	26%	0.259	S	S	.	.	S	Bend	trans	-92	145.6	171.9	77.4	64.1	0	0	0	111.2	P808 D812 A813 L814 N924	P808-N810 PolarHBondContact O-N 2.93Å; N810-D812 VanDerWaalsContact C-N 3.32Å; N810-D812 PolarHBondContact O-N 3.49Å; N810-D812 PolarHBondContact OD1-N 3.04Å; N810-A813 PolarHBondContact O-N 3.31Å; N810-A813 VanDerWaalsContact OD1-CB 3.3Å; N810-A813 WeakPolarHBondContact OD1-CB 3.37Å; N810-A813 PolarHBondContact OD1-N 3.27Å; N810-L814 VanDerWaalsContact O-CG 3.3Å; N810-L814 WeakPolarHBondContact O-CG 3.39Å; N810-L814 PolarHBondContact O-N 3.42Å; N810-N924 PolarHBondContact ND2-ND2 3.26Å
811	I	79	Confident	81.5	Confident	103 Å²	103	45.9 Å²	45.9	53%	0.528	26%	0.261	S	S	.	.	H	α-helix	trans	-63.6	-34.1	-168.2	-160.6	162.7	0	0	0	113.6	L814 Q815	I811-L814 PolarHBondContact O-N 2.79Å; I811-Q815 HydrophobicContact CG1-CG 4.45Å; I811-Q815 WeakPolarHBondContact O-CB 3.5Å; I811-Q815 VanDerWaalsContact O-CG 3.31Å; I811-Q815 WeakPolarHBondContact O-CG 3.37Å; I811-Q815 PolarHBondContact O-N 3.32Å
812	D	76.9	Confident	79.7	Confident	107 Å²	107	44.3 Å²	44.3	57%	0.572	26%	0.256	S	S	*	.	H	α-helix	trans	-68.1	-38.8	178.4	-68.6	-24	0	0	0	112.3	N810 E816	N810-D812 VanDerWaalsContact C-N 3.32Å; N810-D812 PolarHBondContact O-N 3.49Å; N810-D812 PolarHBondContact OD1-N 3.04Å; D812-E816 WeakPolarHBondContact O-CB 3.41Å; D812-E816 PolarHBondContact O-N 3.4Å; D812-E816 VanDerWaalsContact O-N 3.12Å
813	A	77	Confident	77.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-70.1	-41.1	175.8	0	0	0	0	0	111.5	I807 N810 E816 A817 N924	I807-A813 HydrophobicContact CG2-CB 4.32Å; N810-A813 PolarHBondContact O-N 3.31Å; N810-A813 VanDerWaalsContact OD1-CB 3.3Å; N810-A813 WeakPolarHBondContact OD1-CB 3.37Å; N810-A813 PolarHBondContact OD1-N 3.27Å; A813-E816 PolarHBondContact O-N 3.23Å; A813-A817 VanDerWaalsContact O-CB 3.29Å; A813-A817 WeakPolarHBondContact O-CB 3.42Å; A813-A817 PolarHBondContact O-N 2.62Å; A813-N924 HydrophobicContact CB-CB 4.13Å
814	L	81.4	Confident	75.8	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-48	176.1	-66.2	170.8	0	0	0	111.2	M684 G686 F687 I807 N810 I811 E816 A817 A818	M684-L814 HydrophobicContact CE-CD1 4.26Å; M684-L814 HydrophobicContact SD-CD2 4.37Å; G686-L814 CarbonylContact O-C 3.54Å; G686-L814 WeakPolarHBondContact O-CB 3.49Å; F687-L814 HydrophobicContact CB-CB 4.02Å; F687-L814 HydrophobicContact CB-CD2 3.82Å; F687-L814 HydrophobicContact CB-CG 4.37Å; F687-L814 HydrophobicContact CD2-CB 4.46Å; F687-L814 HydrophobicContact CD2-CD2 4.27Å; F687-L814 WeakPolarHBondContact CD2-O 3.46Å; F687-L814 HydrophobicContact CG-CD2 4.26Å; I807-L814 HydrophobicContact CG2-CD2 3.88Å; N810-L814 VanDerWaalsContact O-CG 3.3Å; N810-L814 WeakPolarHBondContact O-CG 3.39Å; N810-L814 PolarHBondContact O-N 3.42Å; I811-L814 PolarHBondContact O-N 2.79Å; L814-E816 VanDerWaalsContact C-N 3.34Å; L814-E816 PolarHBondContact O-N 2.98Å; L814-A817 PolarHBondContact O-N 3.49Å; L814-A818 WeakPolarHBondContact O-CB 3.05Å; L814-A818 PolarHBondContact O-N 2.91Å
815	Q	79.6	Confident	74	Confident	117 Å²	117	52.6 Å²	52.6	55%	0.547	28%	0.281	S	S	.	.	H	α-helix	trans	-65.2	-33.5	177.8	-73.2	-176.6	12.1	0	0	113.5	I811	I811-Q815 HydrophobicContact CG1-CG 4.45Å; I811-Q815 WeakPolarHBondContact O-CB 3.5Å; I811-Q815 VanDerWaalsContact O-CG 3.31Å; I811-Q815 WeakPolarHBondContact O-CG 3.37Å; I811-Q815 PolarHBondContact O-N 3.32Å
816	E	75.6	Confident	72.4	Confident	21 Å²	21	54 Å²	54	10%	0.098	28%	0.281	C	S	.	.	H	α-helix	trans	-70.2	-47.8	175	179.7	-173.8	-133.1	0	0	111.9	D812 A813 L814 A818 A819 W823 R826 V925	D812-E816 WeakPolarHBondContact O-CB 3.41Å; D812-E816 PolarHBondContact O-N 3.4Å; D812-E816 VanDerWaalsContact O-N 3.12Å; A813-E816 PolarHBondContact O-N 3.23Å; L814-E816 VanDerWaalsContact C-N 3.34Å; L814-E816 PolarHBondContact O-N 2.98Å; E816-A818 VanDerWaalsContact C-N 3.26Å; E816-A818 PolarHBondContact O-N 3.25Å; E816-A819 PolarHBondContact O-N 2.96Å; E816-W823 WeakPolarHBondContact OE1-CA 3.35Å; E816-R826 WeakPolarHBondContact OE1-CB 3.27Å; E816-R826 IonicContact OE1-CZ 2.63Å; E816-R826 IonicContact OE1-NE 3.54Å; E816-R826 PolarHBondContact OE1-NE 2.81Å; E816-R826 IonicContact OE1-NH1 2.65Å; E816-R826 PolarHBondContact OE1-NH1 3.14Å; E816-R826 IonicContact OE1-NH2 3.02Å; E816-R826 PolarHBondContact OE1-NH2 3.41Å; E816-R826 IonicContact OE2-CZ 3.02Å; E816-R826 IonicContact OE2-NH1 2.99Å; E816-R826 PolarHBondContact OE2-NH1 2.95Å; E816-R826 IonicContact OE2-NH2 3.37Å; E816-R826 PolarHBondContact OE2-NH2 2.88Å; E816-V925 WeakPolarHBondContact OE2-CG2 3.38Å
817	A	78.1	Confident	70.8	Confident	8 Å²	8	57 Å²	57	7%	0.066	29%	0.29	C	S	.	.	H	α-helix	trans	-66.1	-30.6	-179.4	0	0	0	0	0	111.9	F687 H774 I807 A813 L814 A819 G820 V925	F687-A817 HydrophobicContact CD2-CB 4.37Å; F687-A817 HydrophobicContact CE2-CB 3.81Å; H774-A817 PolarHBondContact NE2-O 2.81Å; I807-A817 HydrophobicContact CD1-CB 3.81Å; I807-A817 HydrophobicContact CG1-CB 4.06Å; I807-A817 HydrophobicContact CG2-CB 4.08Å; A813-A817 VanDerWaalsContact O-CB 3.29Å; A813-A817 WeakPolarHBondContact O-CB 3.42Å; A813-A817 PolarHBondContact O-N 2.62Å; L814-A817 PolarHBondContact O-N 3.49Å; A817-A819 PolarHBondContact O-N 2.91Å; A817-G820 PolarHBondContact O-N 3.3Å; A817-V925 HydrophobicContact CB-CG2 4.43Å
818	A	79.3	Confident	69.6	Low	4 Å²	4	60 Å²	60	3%	0.033	31%	0.309	C	S	.	.	H	α-helix	trans	-55.3	-31.7	173.5	0	0	0	0	0	113.9	F687 Q688 K690 L814 E816 G820	F687-A818 HydrophobicContact CD2-CB 4.35Å; F687-A818 HydrophobicContact CE2-CB 4.5Å; Q688-A818 WeakPolarHBondContact O-CB 3.38Å; K690-A818 PolarHBondContact N-O 2.9Å; L814-A818 WeakPolarHBondContact O-CB 3.05Å; L814-A818 PolarHBondContact O-N 2.91Å; E816-A818 VanDerWaalsContact C-N 3.26Å; E816-A818 PolarHBondContact O-N 3.25Å; A818-G820 VanDerWaalsContact C-N 3.31Å; A818-G820 PolarHBondContact O-N 3.28Å
819	A	73.9	Confident	68.7	Low	51 Å²	51	66.9 Å²	66.9	42%	0.421	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	3	-175.8	0	0	0	0	0	114.8	E816 A817 E821	E816-A819 PolarHBondContact O-N 2.96Å; A817-A819 PolarHBondContact O-N 2.91Å; A819-E821 PolarHBondContact O-N 2.82Å
820	G	63.5	Low	67.9	Low	15 Å²	15	64.6 Å²	64.6	16%	0.155	31%	0.314	C	S	.	.	S	Bend	trans	71.6	-49.4	-177.5	0	0	0	0	0	114.7	W689 A817 A818	W689-G820 VanDerWaalsContact CZ3-CA 3.5Å; A817-G820 PolarHBondContact O-N 3.3Å; A818-G820 VanDerWaalsContact C-N 3.31Å; A818-G820 PolarHBondContact O-N 3.28Å
821	E	61.7	Low	66.7	Low	98 Å²	98	66.7 Å²	66.7	46%	0.458	33%	0.325	S	S	.	.	S	Bend	trans	-117.2	9.5	-177.7	-63	-142.3	122.7	0	0	114.4	R732 A819 W823 A824	R732-E821 IonicContact CZ-OE1 2.69Å; R732-E821 IonicContact NH1-OE1 3.92Å; R732-E821 PolarHBondContact NH1-OE1 2.84Å; R732-E821 IonicContact NH2-OE1 2.68Å; R732-E821 PolarHBondContact NH2-OE1 3.09Å; A819-E821 PolarHBondContact O-N 2.82Å; E821-W823 PolarHBondContact O-N 3.08Å; E821-A824 WeakPolarHBondContact O-CB 3.4Å; E821-A824 PolarHBondContact O-N 3.08Å
822	G	55.7	Low	66	Low	13 Å²	13	67.6 Å²	67.6	13%	0.134	33%	0.325	C	S	.	.	H	α-helix	trans	-49.8	-35.5	-177.1	0	0	0	0	0	114.1	A824 R825 R826	G822-A824 VanDerWaalsContact C-N 3.28Å; G822-A824 PolarHBondContact O-N 2.99Å; G822-R825 WeakPolarHBondContact O-CB 3Å; G822-R825 PolarHBondContact O-N 2.87Å; G822-R825 VanDerWaalsContact O-N 3.15Å; G822-R826 PolarHBondContact O-N 2.94Å
823	W	55.2	Low	65.4	Low	46 Å²	46	69.2 Å²	69.2	17%	0.174	33%	0.327	C	S	.	.	H	α-helix	trans	-58.8	-33.2	177.1	107.4	-66.7	0	0	0	114.1	E816 E821 R826 R827 I927 K960	E816-W823 WeakPolarHBondContact OE1-CA 3.35Å; E821-W823 PolarHBondContact O-N 3.08Å; W823-R826 PolarHBondContact O-N 2.75Å; W823-R827 HydrophobicContact CE3-CG 4.45Å; W823-R827 VanDerWaalsContact CH2-NH2 3.25Å; W823-R827 PolarHBondContact O-N 2.88Å; W823-I927 HydrophobicContact CB-CD1 4.36Å; W823-I927 HydrophobicContact CD2-CD1 3.32Å; W823-I927 HydrophobicContact CD2-CG1 4.37Å; W823-I927 VanDerWaalsContact CE2-CD1 3.44Å; W823-I927 HydrophobicContact CE3-CD1 3.72Å; W823-I927 HydrophobicContact CE3-CG1 4.32Å; W823-I927 HydrophobicContact CG-CD1 3.57Å; W823-I927 HydrophobicContact CH2-CD1 4.21Å; W823-I927 HydrophobicContact CZ2-CD1 3.93Å; W823-I927 HydrophobicContact CZ3-CD1 4.12Å; W823-K960 HydrophobicContact CH2-CB 3.89Å; W823-K960 HydrophobicContact CH2-CD 3.4Å; W823-K960 HydrophobicContact CH2-CG 4.23Å; W823-K960 HydrophobicContact CZ2-CD 3.83Å; W823-K960 HydrophobicContact CZ3-CB 4.02Å; W823-K960 HydrophobicContact CZ3-CD 4.3Å
824	A	53.5	Low	64.5	Low	36 Å²	36	73 Å²	73	30%	0.298	35%	0.353	S	S	.	.	H	α-helix	trans	-72.1	-38.9	-179.6	0	0	0	0	0	109.6	E821 G822 R827 T828	E821-A824 WeakPolarHBondContact O-CB 3.4Å; E821-A824 PolarHBondContact O-N 3.08Å; G822-A824 VanDerWaalsContact C-N 3.28Å; G822-A824 PolarHBondContact O-N 2.99Å; A824-R827 PolarHBondContact O-N 3.44Å; A824-T828 PolarHBondContact O-N 2.9Å; A824-T828 PolarHBondContact O-OG1 2.95Å
825	R	57.3	Low	63.7	Low	199 Å²	199	76.9 Å²	76.9	75%	0.751	37%	0.374	S	S	*	.	H	α-helix	trans	-63.2	-39.7	171.3	-60.7	-177.4	177	-171.6	-1	111.1	G822 R829	G822-R825 WeakPolarHBondContact O-CB 3Å; G822-R825 PolarHBondContact O-N 2.87Å; G822-R825 VanDerWaalsContact O-N 3.15Å; R825-R829 WeakPolarHBondContact O-CG 3.42Å; R825-R829 PolarHBondContact O-N 2.84Å; R825-R829 VanDerWaalsContact O-N 3.11Å
826	R	59.4	Low	63.1	Low	63 Å²	63	79.8 Å²	79.8	24%	0.238	38%	0.38	C	S	.	.	H	α-helix	trans	-66.1	-47.8	173.1	-171.5	-176	-70.9	140.5	8.2	112	E816 G822 W823 T828 R829 E830	E816-R826 WeakPolarHBondContact OE1-CB 3.27Å; E816-R826 IonicContact OE1-CZ 2.63Å; E816-R826 IonicContact OE1-NE 3.54Å; E816-R826 PolarHBondContact OE1-NE 2.81Å; E816-R826 IonicContact OE1-NH1 2.65Å; E816-R826 PolarHBondContact OE1-NH1 3.14Å; E816-R826 IonicContact OE1-NH2 3.02Å; E816-R826 PolarHBondContact OE1-NH2 3.41Å; E816-R826 IonicContact OE2-CZ 3.02Å; E816-R826 IonicContact OE2-NH1 2.99Å; E816-R826 PolarHBondContact OE2-NH1 2.95Å; E816-R826 IonicContact OE2-NH2 3.37Å; E816-R826 PolarHBondContact OE2-NH2 2.88Å; G822-R826 PolarHBondContact O-N 2.94Å; W823-R826 PolarHBondContact O-N 2.75Å; R826-T828 VanDerWaalsContact C-N 3.26Å; R826-T828 PolarHBondContact O-N 2.76Å; R826-R829 CarbonylContact O-C 3.44Å; R826-R829 WeakPolarHBondContact O-CA 3.48Å; R826-R829 WeakPolarHBondContact O-CB 3.24Å; R826-R829 PolarHBondContact O-N 2.75Å; R826-E830 WeakPolarHBondContact CD-OE1 3.45Å; R826-E830 HydrophobicContact CG-CG 4.07Å; R826-E830 PolarHBondContact O-N 3.28Å
827	R	55.4	Low	62.2	Low	79 Å²	79	81.5 Å²	81.5	30%	0.298	39%	0.39	S	S	.	.	H	α-helix	trans	-52.1	-43.8	175.3	-86.5	-173.6	164.1	-153	-3.2	112.4	W823 A824 E830 L831 E1040	W823-R827 HydrophobicContact CE3-CG 4.45Å; W823-R827 VanDerWaalsContact CH2-NH2 3.25Å; W823-R827 PolarHBondContact O-N 2.88Å; A824-R827 PolarHBondContact O-N 3.44Å; R827-E830 PolarHBondContact O-N 3.26Å; R827-L831 VanDerWaalsContact O-CB 3.26Å; R827-L831 WeakPolarHBondContact O-CB 3.38Å; R827-L831 PolarHBondContact O-N 2.77Å; R827-E1040 IonicContact NH1-OE1 3.62Å; R827-E1040 IonicContact NH2-OE1 3.8Å
828	T	58.1	Low	61.4	Low	72 Å²	72	84.1 Å²	84.1	44%	0.442	41%	0.407	S	S	.	.	H	α-helix	trans	-66.8	-35.2	176.5	-60.3	0	0	0	0	112.4	A824 R826 K832	A824-T828 PolarHBondContact O-N 2.9Å; A824-T828 PolarHBondContact O-OG1 2.95Å; R826-T828 VanDerWaalsContact C-N 3.26Å; R826-T828 PolarHBondContact O-N 2.76Å; T828-K832 HydrophobicContact CG2-CD 4.37Å; T828-K832 WeakPolarHBondContact O-CB 3.37Å; T828-K832 VanDerWaalsContact O-CG 3.23Å; T828-K832 WeakPolarHBondContact O-CG 3.4Å; T828-K832 PolarHBondContact O-N 3.33Å
829	R	62	Low	60.8	Low	192 Å²	192	90.4 Å²	90.4	73%	0.725	43%	0.434	S	S	*	.	H	α-helix	trans	-69.3	-41.4	172.7	-70	172.9	77.9	-167.3	5.7	112.3	R825 R826 K832 K833	R825-R829 WeakPolarHBondContact O-CG 3.42Å; R825-R829 PolarHBondContact O-N 2.84Å; R825-R829 VanDerWaalsContact O-N 3.11Å; R826-R829 CarbonylContact O-C 3.44Å; R826-R829 WeakPolarHBondContact O-CA 3.48Å; R826-R829 WeakPolarHBondContact O-CB 3.24Å; R826-R829 PolarHBondContact O-N 2.75Å; R829-K832 PolarHBondContact O-N 3.29Å; R829-K833 WeakPolarHBondContact O-CB 3.3Å; R829-K833 PolarHBondContact O-N 3.31Å
830	E	60.6	Low	60.7	Low	70 Å²	70	95.2 Å²	95.2	33%	0.327	44%	0.441	S	S	.	.	H	α-helix	trans	-68	-41.4	177.1	-74.3	-179.6	174.4	0	0	112.1	R826 R827 K833 S834	R826-E830 WeakPolarHBondContact CD-OE1 3.45Å; R826-E830 HydrophobicContact CG-CG 4.07Å; R826-E830 PolarHBondContact O-N 3.28Å; R827-E830 PolarHBondContact O-N 3.26Å; E830-K833 PolarHBondContact O-N 3.09Å; E830-S834 VanDerWaalsContact O-CB 3.29Å; E830-S834 WeakPolarHBondContact O-CB 3.21Å; E830-S834 PolarHBondContact O-N 3.04Å
831	L	58.2	Low	60.9	Low	101 Å²	101	101.3 Å²	101.3	53%	0.529	46%	0.46	S	S	.	.	H	α-helix	trans	-59.5	-48	171.6	-174.2	71.6	0	0	0	110.4	R827 K833 S834 L835	R827-L831 VanDerWaalsContact O-CB 3.26Å; R827-L831 WeakPolarHBondContact O-CB 3.38Å; R827-L831 PolarHBondContact O-N 2.77Å; L831-K833 VanDerWaalsContact C-N 3.31Å; L831-K833 PolarHBondContact O-N 3.46Å; L831-S834 PolarHBondContact O-N 3.28Å; L831-L835 HydrophobicContact CG-CD1 4.13Å; L831-L835 WeakPolarHBondContact O-CB 3.39Å; L831-L835 VanDerWaalsContact O-CG 3.3Å; L831-L835 WeakPolarHBondContact O-CG 3.27Å; L831-L835 PolarHBondContact O-N 3.24Å
832	K	63.7	Low	61	Low	123 Å²	123	101.6 Å²	101.6	54%	0.535	46%	0.464	S	S	.	.	H	α-helix	trans	-60.4	-37	174.5	-75.8	174	-180	-178.2	0	112.4	T828 R829 R836	T828-K832 HydrophobicContact CG2-CD 4.37Å; T828-K832 WeakPolarHBondContact O-CB 3.37Å; T828-K832 VanDerWaalsContact O-CG 3.23Å; T828-K832 WeakPolarHBondContact O-CG 3.4Å; T828-K832 PolarHBondContact O-N 3.33Å; R829-K832 PolarHBondContact O-N 3.29Å; K832-R836 WeakPolarHBondContact O-CB 3.37Å; K832-R836 WeakPolarHBondContact O-CG 3.29Å; K832-R836 PolarHBondContact O-N 3.07Å; K832-R836 VanDerWaalsContact O-N 3.08Å
833	K	63.3	Low	61.5	Low	140 Å²	140	109 Å²	109	61%	0.609	49%	0.492	S	S	*	.	H	α-helix	trans	-69.7	-47.2	176	-171.5	-178.4	177.5	-174.2	0	111.7	R829 E830 L831 R836 D837	R829-K833 WeakPolarHBondContact O-CB 3.3Å; R829-K833 PolarHBondContact O-N 3.31Å; E830-K833 PolarHBondContact O-N 3.09Å; L831-K833 VanDerWaalsContact C-N 3.31Å; L831-K833 PolarHBondContact O-N 3.46Å; K833-R836 WeakPolarHBondContact O-CB 3.44Å; K833-R836 PolarHBondContact O-N 2.87Å; K833-D837 PolarHBondContact O-N 2.83Å
834	S	59.9	Low	62	Low	80 Å²	80	114.3 Å²	114.3	56%	0.559	51%	0.512	S	S	*	.	H	α-helix	trans	-61	-44.6	177.2	-177.7	0	0	0	0	111.8	E830 L831 D837 S838	E830-S834 VanDerWaalsContact O-CB 3.29Å; E830-S834 WeakPolarHBondContact O-CB 3.21Å; E830-S834 PolarHBondContact O-N 3.04Å; L831-S834 PolarHBondContact O-N 3.28Å; S834-D837 PolarHBondContact O-N 3.36Å; S834-S838 WeakPolarHBondContact O-CB 3.45Å; S834-S838 PolarHBondContact O-N 3.24Å
835	L	64.7	Low	62.1	Low	86 Å²	86	117.6 Å²	117.6	45%	0.45	53%	0.528	S	S	.	.	H	α-helix	trans	-59.5	-47.6	172.1	-74.7	170.2	0	0	0	111.4	L831 D837 S838 F839	L831-L835 HydrophobicContact CG-CD1 4.13Å; L831-L835 WeakPolarHBondContact O-CB 3.39Å; L831-L835 VanDerWaalsContact O-CG 3.3Å; L831-L835 WeakPolarHBondContact O-CG 3.27Å; L831-L835 PolarHBondContact O-N 3.24Å; L835-D837 PolarHBondContact O-N 3.43Å; L835-S838 WeakPolarHBondContact O-CB 3.49Å; L835-S838 PolarHBondContact O-N 3.42Å; L835-F839 WeakPolarHBondContact O-CD2 3.16Å; L835-F839 PolarHBondContact O-N 2.86Å
836	R	65.4	Low	61.6	Low	178 Å²	178	118 Å²	118	67%	0.672	53%	0.53	S	S	*	.	H	α-helix	trans	-59.4	-42.6	176.1	-75.9	172.1	-173.2	-166.8	2	112.5	K832 K833 F839 R840	K832-R836 WeakPolarHBondContact O-CB 3.37Å; K832-R836 WeakPolarHBondContact O-CG 3.29Å; K832-R836 PolarHBondContact O-N 3.07Å; K832-R836 VanDerWaalsContact O-N 3.08Å; K833-R836 WeakPolarHBondContact O-CB 3.44Å; K833-R836 PolarHBondContact O-N 2.87Å; R836-F839 PolarHBondContact O-N 3.43Å; R836-R840 WeakPolarHBondContact O-CB 3.24Å; R836-R840 VanDerWaalsContact O-CG 3.27Å; R836-R840 WeakPolarHBondContact O-CG 3.4Å; R836-R840 PolarHBondContact O-N 2.88Å
837	D	57.8	Low	61.2	Low	58 Å²	58	119 Å²	119	31%	0.31	55%	0.547	S	S	.	.	H	α-helix	trans	-72.2	-32.8	178.1	-78.8	-27.5	0	0	0	112.3	K833 S834 L835 R840 R841	K833-D837 PolarHBondContact O-N 2.83Å; S834-D837 PolarHBondContact O-N 3.36Å; L835-D837 PolarHBondContact O-N 3.43Å; D837-R840 PolarHBondContact O-N 2.88Å; D837-R840 WeakPolarHBondContact OD1-CD 3.37Å; D837-R840 IonicContact OD1-NH1 3.18Å; D837-R840 PolarHBondContact OD1-NH1 2.74Å; D837-R841 WeakPolarHBondContact O-CG 3.28Å; D837-R841 PolarHBondContact O-N 2.94Å
838	S	61.4	Low	61	Low	62 Å²	62	121 Å²	121	43%	0.434	57%	0.568	S	S	.	*	H	α-helix	trans	-62	-50.7	169.3	-173.4	0	0	0	0	111.2	S834 L835 R840 R841 L842	S834-S838 WeakPolarHBondContact O-CB 3.45Å; S834-S838 PolarHBondContact O-N 3.24Å; L835-S838 WeakPolarHBondContact O-CB 3.49Å; L835-S838 PolarHBondContact O-N 3.42Å; S838-R840 VanDerWaalsContact C-N 3.28Å; S838-R840 PolarHBondContact O-N 2.94Å; S838-R841 WeakPolarHBondContact O-CB 3.37Å; S838-R841 PolarHBondContact O-N 3.4Å; S838-R841 VanDerWaalsContact O-N 3.11Å; S838-L842 WeakPolarHBondContact O-CB 3.25Å; S838-L842 PolarHBondContact O-N 2.84Å
839	F	66.5	Low	60.3	Low	136 Å²	136	126.9 Å²	126.9	60%	0.596	59%	0.587	S	S	*	*	H	α-helix	trans	-59.9	-35.2	174	-79.9	-65.1	0	0	0	112.8	L835 R836 L842 K843	L835-F839 WeakPolarHBondContact O-CD2 3.16Å; L835-F839 PolarHBondContact O-N 2.86Å; R836-F839 PolarHBondContact O-N 3.43Å; F839-L842 PolarHBondContact O-N 2.72Å; F839-K843 WeakPolarHBondContact O-CB 3.37Å; F839-K843 WeakPolarHBondContact O-CG 3.25Å; F839-K843 PolarHBondContact O-N 2.85Å
840	R	72.3	Confident	59.2	Low	152 Å²	152	122.1 Å²	122.1	57%	0.574	58%	0.583	S	S	*	*	H	α-helix	trans	-65.7	-44.1	172.6	-77.6	167.5	164.4	-169.5	-6.8	112.2	R836 D837 S838 R844	R836-R840 WeakPolarHBondContact O-CB 3.24Å; R836-R840 VanDerWaalsContact O-CG 3.27Å; R836-R840 WeakPolarHBondContact O-CG 3.4Å; R836-R840 PolarHBondContact O-N 2.88Å; D837-R840 PolarHBondContact O-N 2.88Å; D837-R840 WeakPolarHBondContact OD1-CD 3.37Å; D837-R840 IonicContact OD1-NH1 3.18Å; D837-R840 PolarHBondContact OD1-NH1 2.74Å; S838-R840 VanDerWaalsContact C-N 3.28Å; S838-R840 PolarHBondContact O-N 2.94Å; R840-R844 WeakPolarHBondContact O-CG 3.38Å; R840-R844 PolarHBondContact O-N 2.8Å
841	R	65.8	Low	58.1	Low	144 Å²	144	126.3 Å²	126.3	54%	0.543	61%	0.608	S	S	.	*	H	α-helix	trans	-60.1	-46.9	173.5	-70.7	173.5	-172.7	-163.4	3.1	110.5	D837 S838 K843 R844 V845	D837-R841 WeakPolarHBondContact O-CG 3.28Å; D837-R841 PolarHBondContact O-N 2.94Å; S838-R841 WeakPolarHBondContact O-CB 3.37Å; S838-R841 PolarHBondContact O-N 3.4Å; S838-R841 VanDerWaalsContact O-N 3.11Å; R841-K843 PolarHBondContact O-N 2.88Å; R841-R844 WeakPolarHBondContact O-CB 3.35Å; R841-R844 PolarHBondContact O-N 3.33Å; R841-R844 VanDerWaalsContact O-N 3.14Å; R841-V845 WeakPolarHBondContact O-CG2 3.38Å; R841-V845 PolarHBondContact O-N 2.81Å; R841-V845 VanDerWaalsContact O-N 3.08Å
842	L	65.2	Low	57.1	Low	104 Å²	104	131.7 Å²	131.7	55%	0.545	63%	0.627	S	S	.	*	H	α-helix	trans	-66.6	-35.6	-177.6	-149.8	142.7	0	0	0	112.6	S838 F839 V845 R846	S838-L842 WeakPolarHBondContact O-CB 3.25Å; S838-L842 PolarHBondContact O-N 2.84Å; F839-L842 PolarHBondContact O-N 2.72Å; L842-V845 PolarHBondContact O-N 2.77Å; L842-R846 PolarHBondContact O-N 2.86Å
843	K	65	Low	55.8	Low	167 Å²	167	134.8 Å²	134.8	73%	0.726	64%	0.644	S	S	*	*	H	α-helix	trans	-64.2	-40.2	169.9	-80.9	-170.6	173.6	-170.9	0	113	F839 R841 R846 S847	F839-K843 WeakPolarHBondContact O-CB 3.37Å; F839-K843 WeakPolarHBondContact O-CG 3.25Å; F839-K843 PolarHBondContact O-N 2.85Å; R841-K843 PolarHBondContact O-N 2.88Å; K843-R846 PolarHBondContact O-N 3.37Å; K843-S847 PolarHBondContact O-N 2.89Å; K843-S847 VanDerWaalsContact O-N 3.16Å
844	R	65.9	Low	54.5	Low	159 Å²	159	133.8 Å²	133.8	60%	0.6	65%	0.651	S	S	*	*	H	α-helix	trans	-65.1	-36.5	176	-68	175.3	-164.2	137.2	0.5	112.7	R840 R841 R846 S847	R840-R844 WeakPolarHBondContact O-CG 3.38Å; R840-R844 PolarHBondContact O-N 2.8Å; R841-R844 WeakPolarHBondContact O-CB 3.35Å; R841-R844 PolarHBondContact O-N 3.33Å; R841-R844 VanDerWaalsContact O-N 3.14Å; R844-R846 VanDerWaalsContact C-N 3.28Å; R844-R846 PolarHBondContact O-N 3.43Å; R844-S847 PolarHBondContact O-N 3.02Å; R844-S847 PolarHBondContact O-OG 3.14Å; R844-S847 VanDerWaalsContact O-OG 3.06Å
845	V	55.4	Low	53.3	Low	105 Å²	105	137 Å²	137	64%	0.636	67%	0.668	S	S	*	*	H	α-helix	trans	-67.2	-28.7	175.3	175.1	0	0	0	0	112	R841 L842 T848	R841-V845 WeakPolarHBondContact O-CG2 3.38Å; R841-V845 PolarHBondContact O-N 2.81Å; R841-V845 VanDerWaalsContact O-N 3.08Å; L842-V845 PolarHBondContact O-N 2.77Å; V845-T848 PolarHBondContact O-OG1 2.81Å
846	R	48.4	Very low	51.9	Low	208 Å²	208	139 Å²	139	79%	0.785	68%	0.683	S	S	*	*	H	α-helix	trans	-75.9	-31.7	172.3	-99	-176.7	174.3	179.7	-1.4	113.7	L842 K843 R844 T848 K849	L842-R846 PolarHBondContact O-N 2.86Å; K843-R846 PolarHBondContact O-N 3.37Å; R844-R846 VanDerWaalsContact C-N 3.28Å; R844-R846 PolarHBondContact O-N 3.43Å; R846-T848 VanDerWaalsContact C-N 3.26Å; R846-T848 PolarHBondContact O-N 2.65Å; R846-K849 PolarHBondContact O-N 2.59Å
847	S	50.2	Low	50.3	Low	84 Å²	84	136.1 Å²	136.1	59%	0.587	69%	0.69	S	S	*	*	H	α-helix	trans	-75.7	-8.4	-179.2	67.5	0	0	0	0	114.6	K843 R844	K843-S847 PolarHBondContact O-N 2.89Å; K843-S847 VanDerWaalsContact O-N 3.16Å; R844-S847 PolarHBondContact O-N 3.02Å; R844-S847 PolarHBondContact O-OG 3.14Å; R844-S847 VanDerWaalsContact O-OG 3.06Å
848	T	50.5	Low	49.2	Very low	121 Å²	121	137.6 Å²	137.6	74%	0.742	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	12.8	175.9	53.7	0	0	0	0	113.7	V845 R846	V845-T848 PolarHBondContact O-OG1 2.81Å; R846-T848 VanDerWaalsContact C-N 3.26Å; R846-T848 PolarHBondContact O-N 2.65Å
849	K	44.8	Very low	47.7	Very low	195 Å²	195	139.6 Å²	139.6	85%	0.848	73%	0.725	S	S	*	*	S	Bend	trans	-115.2	15.6	-177.1	-142.7	-179.7	-177.6	-176.5	0	114.8	R846	R846-K849 PolarHBondContact O-N 2.59Å
850	S	38.6	Very low	46	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	74%	0.736	S	S	*	*			trans	-126.3	76.3	177.1	59.6	0	0	0	0	111.5
851	N	36	Very low	44.1	Very low	158 Å²	158	136.9 Å²	136.9	85%	0.845	75%	0.745	S	S	*	*			trans	-177.3	95.6	151.3	-98.6	-5.8	0	0	0	109.1
852	F	38.1	Very low	42.3	Very low	214 Å²	214	137.8 Å²	137.8	94%	0.939	76%	0.761	S	S	*	*			trans	-143.7	105.9	165.2	-96.9	-83	0	0	0	108.1
853	Q	36.5	Very low	40.8	Very low	188 Å²	188	139.6 Å²	139.6	88%	0.879	78%	0.776	S	S	*	*			trans	-105.9	145.6	154.2	-83.8	-172.9	-30.8	0	0	107.9
854	P	36	Very low	39.1	Very low	119 Å²	119	136.9 Å²	136.9	77%	0.773	78%	0.778	S	S	*	*			trans	-93.1	150.6	-177.2	36.4	-33.9	0	0	0	112.5
855	V	35.7	Very low	37.6	Very low	149 Å²	149	141.1 Å²	141.1	90%	0.903	79%	0.794	S	S	*	*			trans	-179.4	163.9	141	146.4	0	0	0	0	108.3
856	V	34.9	Very low	36.6	Very low	128 Å²	128	140.7 Å²	140.7	78%	0.776	80%	0.802	S	S	*	*			trans	-111.2	152.1	-153.7	-174.5	0	0	0	0	113.6
857	S	31.3	Very low	35.7	Very low	116 Å²	116	134.3 Å²	134.3	81%	0.811	80%	0.801	S	S	*	*			trans	79	147.8	155.1	51.5	0	0	0	0	122.7
858	A	34	Very low	34.8	Very low	90 Å²	90	138 Å²	138	74%	0.744	81%	0.812	S	S	*	*			trans	93.5	91	161.8	0	0	0	0	0	120.7
859	S	30.7	Very low	33.7	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	82%	0.816	S	S	*	*			trans	50.7	128.7	134.4	56.1	0	0	0	0	124.1
860	T	30.1	Very low	32.9	Very low	138 Å²	138	144.1 Å²	144.1	85%	0.847	82%	0.816	S	S	*	*			trans	60.2	97.5	145.4	52.5	0	0	0	0	120.4
861	A	32.3	Very low	32.6	Very low	92 Å²	92	145 Å²	145	76%	0.76	82%	0.818	S	S	*	*				161.7	136.3	111.6	0	0	0	0	0	113
862	N	28.7	Very low	32.1	Very low	164 Å²	164	143.2 Å²	143.2	88%	0.877	81%	0.812	S	S	*	*			trans	29.5	89.1	154.6	-64.8	-14.7	0	0	0	120.3
863	V	33.6	Very low	32	Very low	141 Å²	141	139.8 Å²	139.8	86%	0.855	81%	0.809	S	S	*	*			trans	-135	134.6	144.2	-177.9	0	0	0	0	110.8
864	S	29.7	Very low	31.7	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-55.1	126.4	-176.9	51.6	0	0	0	0	115.2
865	R	34.1	Very low	31.7	Very low	248 Å²	248	139.2 Å²	139.2	94%	0.936	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-81.2	117.5	167.1	-158.8	173.6	-168.7	172.1	3.6	109.7
866	A	34	Very low	31.4	Very low	96 Å²	96	139.5 Å²	139.5	79%	0.793	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-57.4	138.4	-176.9	0	0	0	0	0	112.6
867	G	29.6	Very low	31.4	Very low	74 Å²	74	145.3 Å²	145.3	76%	0.763	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-73.2	126.7	-163.9	0	0	0	0	0	115.2	R869	G867-R869 VanDerWaalsContact C-N 3.35Å; G867-R869 PolarHBondContact O-N 2.75Å
868	I	31.5	Very low	31.4	Very low	160 Å²	160	144.5 Å²	144.5	82%	0.821	81%	0.814	S	S	*	*			trans	-68.9	96.9	154	-64.4	174	0	0	0	106.8	R870	I868-R870 PolarHBondContact O-N 3.2Å
869	R	28.2	Very low	31.4	Very low	221 Å²	221	144.7 Å²	144.7	83%	0.834	82%	0.816	S	S	*	*			trans	-73.4	87.7	-177.7	-159.9	-177.2	-161.9	-148.7	6.3	110.1	G867 T871	G867-R869 VanDerWaalsContact C-N 3.35Å; G867-R869 PolarHBondContact O-N 2.75Å; R869-T871 PolarHBondContact O-N 3.45Å; R869-T871 VanDerWaalsContact O-N 3.14Å
870	R	28.3	Very low	31.5	Very low	224 Å²	224	145.5 Å²	145.5	85%	0.845	82%	0.818	S	S	*	*			trans	-62	109.4	162.7	-67	-177.8	178.9	118.9	-4.6	108.3	I868	I868-R870 PolarHBondContact O-N 3.2Å
871	T	31.1	Very low	31.8	Very low	110 Å²	110	146.6 Å²	146.6	68%	0.675	82%	0.819	S	S	*	*			trans	-94.9	96	161.7	45.7	0	0	0	0	106.8	R869	R869-T871 PolarHBondContact O-N 3.45Å; R869-T871 VanDerWaalsContact O-N 3.14Å
872	V	26.6	Very low	31.7	Very low	120 Å²	120	150.8 Å²	150.8	73%	0.727	82%	0.823	S	S	*	*				56.8	92.8	83	-176	0	0	0	0	112.3
873	T	35.6	Very low	31.9	Very low	143 Å²	143	149.3 Å²	149.3	88%	0.877	82%	0.82	S	S	*	*			trans	-133.6	94.3	142.2	42.3	0	0	0	0	108
874	Q	29.2	Very low	31.8	Very low	176 Å²	176	149.7 Å²	149.7	82%	0.822	82%	0.817	S	S	*	*			trans	-78.4	142.5	163.6	-79.1	179	-23.5	0	0	109.2
875	S	36.2	Very low	32	Very low	118 Å²	118	151.2 Å²	151.2	83%	0.825	82%	0.821	S	S	*	*			trans	-136.9	122	154.2	62.4	0	0	0	0	108.6
876	N	30.6	Very low	32.1	Very low	156 Å²	156	143.4 Å²	143.4	83%	0.834	81%	0.81	S	S	*	*			trans	-60.5	133.5	-169.4	-67.8	-30.9	0	0	0	114.1
877	R	34.3	Very low	32.3	Very low	250 Å²	250	144.4 Å²	144.4	94%	0.943	81%	0.809	S	S	*	*			trans	-152.2	129.4	131.3	-153.2	170.3	-173.3	170.9	1.5	110.2
878	A	30.9	Very low	32.5	Very low	99 Å²	99	147.3 Å²	147.3	82%	0.818	81%	0.806	S	S	*	*			trans	-98.2	135.2	-179.8	0	0	0	0	0	111.5
879	A	33.5	Very low	32.7	Very low	94 Å²	94	145.6 Å²	145.6	78%	0.777	80%	0.799	S	S	*	*			trans	-171.5	137	140.9	0	0	0	0	0	107.8
880	P	33.6	Very low	33.2	Very low	120 Å²	120	140.3 Å²	140.3	78%	0.779	78%	0.783	S	S	*	*			trans	-95.4	154.7	-171.9	36.8	-34.4	0	0	0	113.2
881	N	35.2	Very low	33.6	Very low	162 Å²	162	133.4 Å²	133.4	87%	0.866	77%	0.774	S	S	*	*			trans	-157.4	141.7	131.3	-101.4	-14.8	0	0	0	110.4
882	Q	30.9	Very low	34.1	Very low	180 Å²	180	135.2 Å²	135.2	84%	0.841	78%	0.775	S	S	*	*			trans	-69.5	159.8	170.2	-65.9	154.7	-23.8	0	0	108.4
883	T	33.9	Very low	34.6	Very low	132 Å²	132	139.9 Å²	139.9	81%	0.81	78%	0.78	S	S	*	*			cis	-152.2	170.1	48.9	40.8	0	0	0	0	114.2
884	D	31	Very low	34.8	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	78%	0.775	S	S	*	*			trans	-65.2	155.7	-176.4	-54.3	-86.2	0	0	0	116
885	V	34.6	Very low	35	Very low	142 Å²	142	139.5 Å²	139.5	86%	0.861	77%	0.771	S	S	*	*				-178	141.5	105.8	154.6	0	0	0	0	109.1
886	A	34.3	Very low	34.9	Very low	85 Å²	85	137.2 Å²	137.2	70%	0.702	77%	0.766	S	S	*	*			trans	-89.5	146.1	-172.7	0	0	0	0	0	113.7
887	P	39.4	Very low	35	Very low	117 Å²	117	141.5 Å²	141.5	76%	0.76	77%	0.77	S	S	*	*			trans	-104.2	88.8	169.1	35.8	-27.4	0	0	0	111.5
888	L	33.5	Very low	35	Very low	135 Å²	135	136 Å²	136	71%	0.707	76%	0.764	S	S	*	*	S	Bend	trans	-104.6	-28.2	159.7	-168.8	58.8	0	0	0	111.4	E890	L888-E890 PolarHBondContact O-N 2.86Å
889	D	36	Very low	35.2	Very low	124 Å²	124	136.6 Å²	136.6	66%	0.663	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-7.7	-172.7	-58.4	-34	0	0	0	115.5
890	E	39.3	Very low	35.2	Very low	110 Å²	110	139.9 Å²	139.9	51%	0.514	76%	0.764	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-14.6	175.6	-178.1	55.6	-156.6	0	0	112.5	L888 R894	L888-E890 PolarHBondContact O-N 2.86Å; E890-R894 IonicContact OE1-NE 3.3Å; E890-R894 IonicContact OE1-NH2 2.66Å
891	A	36.7	Very low	35	Very low	79 Å²	79	142.2 Å²	142.2	65%	0.653	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-31.5	177.1	0	0	0	0	0	112.8
892	E	40	Very low	34.6	Very low	148 Å²	148	141 Å²	141	69%	0.692	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-85.9	-19.9	-174.2	-60.4	-166.5	155.4	0	0	113.3	R894 S895	E892-R894 PolarHBondContact O-N 2.8Å; E892-S895 PolarHBondContact O-OG 3.41Å
893	R	38.1	Very low	34.7	Very low	218 Å²	218	139.6 Å²	139.6	82%	0.823	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-74.6	1.8	176.8	-69	-160.3	75.3	121.5	1	115.3
894	R	39.4	Very low	34.4	Very low	205 Å²	205	142 Å²	142	77%	0.774	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-109.3	0.2	-179.7	-66.9	-169.3	-176.6	-153.4	-0.7	115.6	E890 E892	E890-R894 IonicContact OE1-NE 3.3Å; E890-R894 IonicContact OE1-NH2 2.66Å; E892-R894 PolarHBondContact O-N 2.8Å
895	S	33.4	Very low	34.4	Very low	106 Å²	106	142 Å²	142	74%	0.741	76%	0.761	S	S	*	*			trans	-98.4	81.7	174.6	55.1	0	0	0	0	112	E892	E892-S895 PolarHBondContact O-OG 3.41Å
896	G	34.5	Very low	34.2	Very low	70 Å²	70	142.4 Å²	142.4	72%	0.722	76%	0.757	S	S	*	*			trans	-139.5	85.4	-177.1	0	0	0	0	0	114.4
897	R	33.5	Very low	33.8	Very low	245 Å²	245	142.6 Å²	142.6	93%	0.925	75%	0.753	S	S	*	*			trans	24.3	113.8	158.9	-64	-178.5	176.5	-172.8	-1.6	120
898	V	34.2	Very low	33.5	Very low	134 Å²	134	144.7 Å²	144.7	81%	0.812	75%	0.753	S	S	*	*				-141.1	134.5	123.2	-177.1	0	0	0	0	107.3
899	P	34.1	Very low	33.5	Very low	112 Å²	112	147.9 Å²	147.9	73%	0.727	76%	0.757	S	S	*	*			trans	-94.5	130.6	169.7	34.5	-27.1	0	0	0	110.7
900	D	33.7	Very low	33.6	Very low	163 Å²	163	148.5 Å²	148.5	87%	0.872	76%	0.76	S	S	*	*			trans	-155.2	153.7	156.2	-104.7	-34.2	0	0	0	110
901	E	28.8	Very low	33.9	Very low	169 Å²	169	149.1 Å²	149.1	79%	0.79	77%	0.771	S	S	*	*			trans	-86.4	163.1	-157.4	-56.7	-168.3	144.5	0	0	115.9
902	N	28.1	Very low	34.5	Very low	138 Å²	138	150 Å²	150	74%	0.738	76%	0.762	S	S	*	*			trans	64.3	94.8	156.9	-61.9	-46.9	0	0	0	118.5
903	I	32.5	Very low	35.4	Very low	150 Å²	150	150.1 Å²	150.1	77%	0.769	76%	0.756	S	S	*	*				-161.2	128.5	124.7	-95.6	145.9	0	0	0	109.1	L905	I903-L905 HydrophobicContact CG2-CB 4.15Å; I903-L905 HydrophobicContact CG2-CD1 3.91Å; I903-L905 HydrophobicContact CG2-CG 4Å; I903-L905 PolarHBondContact O-N 2.64Å
904	L	27.9	Very low	36	Very low	183 Å²	183	147.9 Å²	147.9	96%	0.958	76%	0.755	S	S	*	*			trans	-76.2	82.4	173.2	-78.7	165.9	0	0	0	110.8
905	L	30.5	Very low	36.8	Very low	150 Å²	150	140.9 Å²	140.9	79%	0.785	73%	0.732	S	S	*	*			trans	-98.2	104.8	169	-107.2	160.8	0	0	0	110	I903 S907	I903-L905 HydrophobicContact CG2-CB 4.15Å; I903-L905 HydrophobicContact CG2-CD1 3.91Å; I903-L905 HydrophobicContact CG2-CG 4Å; I903-L905 PolarHBondContact O-N 2.64Å; L905-S907 PolarHBondContact O-N 2.94Å
906	I	30.4	Very low	37.8	Very low	149 Å²	149	138.8 Å²	138.8	76%	0.764	72%	0.717	S	S	*	*			trans	-63.3	101.5	172.7	-62.6	169.8	0	0	0	108.2	Q908	I906-Q908 HydrophobicContact CG2-CG 4.31Å; I906-Q908 PolarHBondContact O-N 2.86Å
907	S	26.9	Very low	38.6	Very low	90 Å²	90	140.9 Å²	140.9	63%	0.629	71%	0.711	S	S	*	*			trans	-71.1	96.1	167	55.8	0	0	0	0	108.6	L905 Y909	L905-S907 PolarHBondContact O-N 2.94Å; S907-Y909 PolarHBondContact O-N 3.46Å
908	Q	32.6	Very low	39.8	Very low	160 Å²	160	132.7 Å²	132.7	75%	0.748	68%	0.681	S	S	*	*			trans	-63.1	103.3	167.2	-76.1	-173.5	-16.7	0	0	108.6	I906 N910	I906-Q908 HydrophobicContact CG2-CG 4.31Å; I906-Q908 PolarHBondContact O-N 2.86Å; Q908-N910 PolarHBondContact O-N 2.88Å
909	Y	32.2	Very low	40.8	Very low	202 Å²	202	130.9 Å²	130.9	79%	0.792	67%	0.67	S	S	*	*			trans	-55.6	108.6	159.8	-66.6	-88.9	0	0	0	107.4	S907 V911	S907-Y909 PolarHBondContact O-N 3.46Å; Y909-V911 VanDerWaalsContact C-N 3.27Å; Y909-V911 PolarHBondContact O-N 2.8Å
910	N	38.1	Very low	41.7	Very low	138 Å²	138	132.7 Å²	132.7	74%	0.738	67%	0.668	S	S	*	*			trans	-68.6	85	179.3	-86.4	-41.7	0	0	0	110.1	Q908 E912	Q908-N910 PolarHBondContact O-N 2.88Å; N910-E912 VanDerWaalsContact C-N 3.33Å; N910-E912 PolarHBondContact O-N 2.92Å
911	V	46.6	Very low	42.5	Very low	123 Å²	123	130.8 Å²	130.8	75%	0.745	66%	0.658	S	S	*	*			trans	-73.1	88.5	171.1	-178.1	0	0	0	0	108.2	Y909 R913	Y909-V911 VanDerWaalsContact C-N 3.27Å; Y909-V911 PolarHBondContact O-N 2.8Å; V911-R913 PolarHBondContact O-N 3.14Å
912	E	49.7	Very low	43.4	Very low	98 Å²	98	125.4 Å²	125.4	46%	0.458	64%	0.637	S	S	.	*			trans	-59.7	122.8	171.9	-174.8	171.4	-154.1	0	0	109.3	N910 R1058 A1061	N910-E912 VanDerWaalsContact C-N 3.33Å; N910-E912 PolarHBondContact O-N 2.92Å; E912-R1058 VanDerWaalsContact CD-NH1 3.26Å; E912-R1058 WeakPolarHBondContact OE1-CD 3.49Å; E912-R1058 IonicContact OE1-CZ 3.12Å; E912-R1058 IonicContact OE1-NE 2.77Å; E912-R1058 IonicContact OE1-NH1 2.74Å; E912-R1058 PolarHBondContact OE1-NH1 2.9Å; E912-R1058 IonicContact OE2-NH1 3.88Å; E912-R1058 PolarHBondContact OE2-NH1 3.02Å; E912-A1061 HydrophobicContact CG-CB 3.93Å
913	R	58.5	Low	44.4	Very low	150 Å²	150	120.2 Å²	120.2	57%	0.566	61%	0.613	S	S	*	*			trans	-75.5	129.3	179.4	-60.2	-179.4	-171.8	177.3	7.5	109.3	V911 I915 A1061	V911-R913 PolarHBondContact O-N 3.14Å; R913-I915 PolarHBondContact O-N 2.87Å; R913-A1061 PolarHBondContact N-O 3.47Å
914	E	51.6	Low	45.6	Very low	171 Å²	171	114.9 Å²	114.9	80%	0.799	59%	0.586	S	S	*	*			trans	-66.4	102.5	173.7	-169.3	-171.8	169	0	0	110.2	C916	E914-C916 PolarHBondContact O-N 2.92Å
915	I	55.7	Low	47.3	Very low	58 Å²	58	106.9 Å²	106.9	30%	0.297	55%	0.545	S	S	.	.			trans	-82.4	108.1	166	-58.1	-179.3	0	0	0	106.8	R913 D917 T1060 A1061	R913-I915 PolarHBondContact O-N 2.87Å; I915-D917 PolarHBondContact O-N 2.98Å; I915-T1060 HydrophobicContact CD1-CG2 4.04Å; I915-A1061 HydrophobicContact CD1-CB 3.89Å; I915-A1061 HydrophobicContact CG1-CB 4.28Å
916	C	53.6	Low	49.6	Very low	61 Å²	61	100.5 Å²	100.5	41%	0.412	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-61.4	127.8	172.6	-59.2	0	0	0	0	109.9	E914 R918	E914-C916 PolarHBondContact O-N 2.92Å; C916-R918 PolarHBondContact O-N 3.44Å
917	D	51.7	Low	52.3	Low	115 Å²	115	93.5 Å²	93.5	62%	0.615	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-56.1	137.7	171.4	-75.7	-38.1	0	0	0	110.3	I915	I915-D917 PolarHBondContact O-N 2.98Å
918	R	59.2	Low	55.6	Low	73 Å²	73	89.3 Å²	89.3	28%	0.275	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-74.5	132.2	-178.4	-54.7	-179.6	-171.8	-177.6	-0.3	109.3	C916 Q920 R997 E1041	C916-R918 PolarHBondContact O-N 3.44Å; R918-Q920 PolarHBondContact O-N 2.91Å; R918-R997 HydrophobicContact CB-CB 4.15Å; R918-R997 HydrophobicContact CG-CB 4.48Å; R918-R997 PolarHBondContact NH1-O 2.87Å; R918-E1041 IonicContact CZ-OE1 3.26Å; R918-E1041 IonicContact NE-OE1 2.77Å; R918-E1041 IonicContact NH2-OE1 2.77Å; R918-E1041 PolarHBondContact NH2-OE1 3.33Å
919	V	54.3	Low	58.5	Low	96 Å²	96	82.7 Å²	82.7	58%	0.582	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-57.4	136.3	-177.7	-172	0	0	0	0	109.9	D921 T922	V919-D921 PolarHBondContact O-N 2.92Å; V919-T922 HydrophobicContact CB-CG2 4.29Å; V919-T922 PolarHBondContact O-N 2.92Å; V919-T922 PolarHBondContact O-OG1 2.78Å
920	Q	52.9	Low	61.5	Low	150 Å²	150	73.7 Å²	73.7	70%	0.701	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-53	-34.2	-172.6	-163.9	162.9	-11.2	0	0	112.9	R918 T922	R918-Q920 PolarHBondContact O-N 2.91Å; Q920-T922 VanDerWaalsContact C-N 3.32Å; Q920-T922 PolarHBondContact O-N 3.01Å
921	D	50.3	Low	64.2	Low	122 Å²	122	67.9 Å²	67.9	65%	0.652	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-75	-10.9	-179.4	-45.6	-43.5	0	0	0	114.9	V919 A923 N924	V919-D921 PolarHBondContact O-N 2.92Å; D921-A923 VanDerWaalsContact C-N 3.3Å; D921-N924 PolarHBondContact O-ND2 2.94Å; D921-N924 PolarHBondContact O-OD1 2.83Å
922	T	47.8	Very low	66.5	Low	56 Å²	56	62.5 Å²	62.5	34%	0.344	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-79.2	-13.4	178.2	58.7	0	0	0	0	113.1	V919 Q920 N924	V919-T922 HydrophobicContact CB-CG2 4.29Å; V919-T922 PolarHBondContact O-N 2.92Å; V919-T922 PolarHBondContact O-OG1 2.78Å; Q920-T922 VanDerWaalsContact C-N 3.32Å; Q920-T922 PolarHBondContact O-N 3.01Å; T922-N924 VanDerWaalsContact C-N 3.3Å; T922-N924 PolarHBondContact O-N 2.85Å
923	A	49.8	Very low	68.5	Low	30 Å²	30	59 Å²	59	25%	0.248	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-89	20.8	-172.5	0	0	0	0	0	114.5	D921 V925 A961	D921-A923 VanDerWaalsContact C-N 3.3Å; A923-V925 PolarHBondContact O-N 2.77Å; A923-A961 HydrophobicContact CB-CB 4.2Å
924	N	56.6	Low	69.9	Low	38 Å²	38	51.9 Å²	51.9	20%	0.203	28%	0.279	C	S	.	.			trans	-69.9	3.1	-166.1	-76.9	-1.7	0	0	0	116.8	P808 N810 A813 D921 T922	P808-N924 WeakPolarHBondContact CD-O 3.43Å; P808-N924 HydrophobicContact CG-CB 4.38Å; P808-N924 WeakPolarHBondContact CG-O 3.49Å; N810-N924 PolarHBondContact ND2-ND2 3.26Å; A813-N924 HydrophobicContact CB-CB 4.13Å; D921-N924 PolarHBondContact O-ND2 2.94Å; D921-N924 PolarHBondContact O-OD1 2.83Å; T922-N924 VanDerWaalsContact C-N 3.3Å; T922-N924 PolarHBondContact O-N 2.85Å
925	V	63.7	Low	71.6	Confident	15 Å²	15	43.9 Å²	43.9	9%	0.091	24%	0.242	C	C	.	.			trans	-142.2	101.8	163.9	-176.6	0	0	0	0	108.6	P773 E816 A817 A923 I927	P773-V925 WeakPolarHBondContact O-CG1 3.37Å; E816-V925 WeakPolarHBondContact OE2-CG2 3.38Å; A817-V925 HydrophobicContact CB-CG2 4.43Å; A923-V925 PolarHBondContact O-N 2.77Å; V925-I927 VanDerWaalsContact C-N 3.31Å; V925-I927 HydrophobicContact CG1-CG1 4.05Å; V925-I927 PolarHBondContact O-N 2.98Å
926	A	78.4	Confident	73	Confident	15 Å²	15	42.4 Å²	42.4	12%	0.124	24%	0.236	C	C	.	.			trans	-84.1	76.4	179.7	0	0	0	0	0	110.7	T806 I928 T959 A961	T806-A926 VanDerWaalsContact CB-O 3.24Å; T806-A926 WeakPolarHBondContact CB-O 3.1Å; T806-A926 HydrophobicContact CG2-CB 4.36Å; T806-A926 WeakPolarHBondContact CG2-O 3.26Å; T806-A926 PolarHBondContact OG1-O 2.82Å; A926-I928 PolarHBondContact O-N 3.33Å; A926-T959 HydrophobicContact CB-CG2 4.22Å; A926-A961 HydrophobicContact CB-CB 3.67Å
927	I	88.9	Confident	74.4	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.015	22%	0.222	C	C	.	.			trans	-52.1	133.9	174.5	-60.7	-169	0	0	0	110	T734 P773 W823 V925 T959 K960	T734-I927 HydrophobicContact CG2-CG2 4.22Å; P773-I927 HydrophobicContact CB-CD1 4.02Å; P773-I927 HydrophobicContact CB-CG1 4.13Å; W823-I927 HydrophobicContact CB-CD1 4.36Å; W823-I927 HydrophobicContact CD2-CD1 3.32Å; W823-I927 HydrophobicContact CD2-CG1 4.37Å; W823-I927 VanDerWaalsContact CE2-CD1 3.44Å; W823-I927 HydrophobicContact CE3-CD1 3.72Å; W823-I927 HydrophobicContact CE3-CG1 4.32Å; W823-I927 HydrophobicContact CG-CD1 3.57Å; W823-I927 HydrophobicContact CH2-CD1 4.21Å; W823-I927 HydrophobicContact CZ2-CD1 3.93Å; W823-I927 HydrophobicContact CZ3-CD1 4.12Å; V925-I927 VanDerWaalsContact C-N 3.31Å; V925-I927 HydrophobicContact CG1-CG1 4.05Å; V925-I927 PolarHBondContact O-N 2.98Å; I927-T959 CarbonylContact O-C 3.57Å; I927-T959 VanDerWaalsContact O-CA 3.28Å; I927-T959 WeakPolarHBondContact O-CA 3.49Å; I927-K960 HydrophobicContact CB-CB 4.19Å; I927-K960 HydrophobicContact CB-CD 4.09Å; I927-K960 HydrophobicContact CB-CG 4.08Å; I927-K960 HydrophobicContact CG2-CD 3.86Å; I927-K960 HydrophobicContact CG2-CG 4.14Å; I927-K960 PolarHBondContact O-N 3.38Å
928	I	95.1	Very high	75.5	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	132.4	177.5	-47.7	-58.7	0	0	0	109.2	T734 T772 G775 F776 T806 A926 F931 I957 T959	T734-I928 WeakPolarHBondContact CB-O 3.16Å; T734-I928 PolarHBondContact OG1-O 3.01Å; T772-I928 PolarHBondContact O-N 2.82Å; G775-I928 VanDerWaalsContact C-CG1 3.45Å; G775-I928 VanDerWaalsContact O-CG1 3.27Å; G775-I928 WeakPolarHBondContact O-CG1 3.21Å; F776-I928 HydrophobicContact CB-CD1 4.46Å; F776-I928 HydrophobicContact CB-CG1 4.04Å; F776-I928 HydrophobicContact CD1-CD1 3.85Å; F776-I928 HydrophobicContact CD1-CG1 4.33Å; T806-I928 HydrophobicContact CG2-CD1 3.8Å; A926-I928 PolarHBondContact O-N 3.33Å; I928-F931 HydrophobicContact CG2-CE1 3.96Å; I928-F931 HydrophobicContact CG2-CE2 4.2Å; I928-F931 HydrophobicContact CG2-CZ 3.67Å; I928-I957 HydrophobicContact CD1-CG2 4.08Å; I928-I957 HydrophobicContact CG2-CG2 3.89Å; I928-T959 HydrophobicContact CD1-CG2 4.03Å
929	S	93.4	Very high	75.8	Confident	21 Å²	21	42.3 Å²	42.3	15%	0.147	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	-27.5	-173	45.3	0	0	0	0	114.9	G958 V1000	S929-G958 PolarHBondContact N-O 2.86Å; S929-G958 PolarHBondContact OG-O 2.81Å; S929-V1000 VanDerWaalsContact CB-O 3.26Å; S929-V1000 WeakPolarHBondContact CB-O 3.35Å; S929-V1000 PolarHBondContact OG-O 2.78Å
930	C	95.5	Very high	75.8	Confident	14 Å²	14	39.9 Å²	39.9	10%	0.095	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	157.6	178.9	57	0	0	0	0	111.3	G958	C930-G958 PolarHBondContact O-N 2.9Å
931	F	95.9	Very high	75.7	Confident	16 Å²	16	35.9 Å²	35.9	7%	0.07	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	162.5	173.7	-62.6	-75.9	0	0	0	110.5	S735 L737 A769 L770 F776 I928 L955 F956 I957	S735-F931 VanDerWaalsContact OG-CE2 3.23Å; S735-F931 WeakPolarHBondContact OG-CE2 3.44Å; L737-F931 HydrophobicContact CB-CB 3.69Å; L737-F931 HydrophobicContact CB-CD2 4.17Å; L737-F931 HydrophobicContact CB-CG 4.3Å; L737-F931 HydrophobicContact CD2-CB 3.54Å; L737-F931 HydrophobicContact CG-CB 4.27Å; A769-F931 HydrophobicContact CB-CD1 3.94Å; A769-F931 HydrophobicContact CB-CD2 4.03Å; A769-F931 HydrophobicContact CB-CE1 3.97Å; A769-F931 HydrophobicContact CB-CE2 4.05Å; A769-F931 HydrophobicContact CB-CG 3.97Å; A769-F931 HydrophobicContact CB-CZ 4.03Å; L770-F931 WeakPolarHBondContact O-CZ 3.43Å; F776-F931 HydrophobicContact CB-CE1 4.17Å; F776-F931 HydrophobicContact CB-CZ 3.96Å; I928-F931 HydrophobicContact CG2-CE1 3.96Å; I928-F931 HydrophobicContact CG2-CE2 4.2Å; I928-F931 HydrophobicContact CG2-CZ 3.67Å; F931-L955 HydrophobicContact CB-CD1 4.28Å; F931-L955 HydrophobicContact CD1-CD1 4.08Å; F931-F956 CarbonylContact C-O 3.57Å; F931-F956 VanDerWaalsContact CA-O 3.26Å; F931-F956 WeakPolarHBondContact CA-O 3.3Å; F931-I957 HydrophobicContact CD1-CB 4.2Å; F931-I957 HydrophobicContact CD1-CG1 3.9Å; F931-I957 HydrophobicContact CD1-CG2 4.01Å; F931-I957 HydrophobicContact CE1-CB 4.25Å; F931-I957 HydrophobicContact CE1-CD1 4.32Å; F931-I957 HydrophobicContact CE1-CG1 3.97Å; F931-I957 HydrophobicContact CE1-CG2 3.66Å
932	A	93.9	Very high	75.6	Confident	9 Å²	9	36 Å²	36	7%	0.074	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	143.7	160	0	0	0	0	0	110	F956 L1003	A932-F956 HydrophobicContact CB-CB 4.32Å; A932-F956 PolarHBondContact N-O 2.59Å; A932-F956 WeakPolarHBondContact O-CD2 3.36Å; A932-F956 PolarHBondContact O-N 2.85Å; A932-L1003 HydrophobicContact CB-CB 3.85Å
933	F	90.8	Very high	75.8	Confident	26 Å²	26	38.2 Å²	38.2	11%	0.114	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	154.9	165	-75.7	-69.2	0	0	0	110.3	L737 L767 T954 L955 I969 L1005 L1016	L737-F933 HydrophobicContact CD2-CD2 3.35Å; L737-F933 HydrophobicContact CD2-CE2 3.72Å; L737-F933 HydrophobicContact CD2-CG 4.1Å; L737-F933 HydrophobicContact CG-CD2 3.7Å; L737-F933 HydrophobicContact CG-CE2 3.76Å; L767-F933 HydrophobicContact CB-CZ 4.45Å; L767-F933 HydrophobicContact CD2-CE1 3.69Å; L767-F933 HydrophobicContact CD2-CZ 3.88Å; L767-F933 HydrophobicContact CG-CE1 4.36Å; L767-F933 HydrophobicContact CG-CZ 4.05Å; F933-T954 CarbonylContact C-O 3.53Å; F933-T954 WeakPolarHBondContact CA-O 3.5Å; F933-L955 HydrophobicContact CD1-CB 4.32Å; F933-L955 HydrophobicContact CD1-CD1 4.09Å; F933-L955 HydrophobicContact CE1-CB 4.15Å; F933-L955 HydrophobicContact CE1-CD1 3.82Å; F933-L955 HydrophobicContact CE1-CG 4.44Å; F933-L955 HydrophobicContact CZ-CD1 4.11Å; F933-I969 HydrophobicContact CD1-CD1 4.12Å; F933-I969 HydrophobicContact CE1-CD1 3.79Å; F933-L1005 WeakPolarHBondContact O-CD1 3.45Å; F933-L1016 HydrophobicContact CB-CD2 4.22Å
934	G	88.7	Confident	75.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	175.6	179.8	0	0	0	0	0	113.5	A953 T954 L1016	G934-A953 CarbonylContact O-C 3.5Å; G934-A953 WeakPolarHBondContact O-CA 3.32Å; G934-A953 WeakPolarHBondContact O-CB 3.42Å; G934-T954 PolarHBondContact N-O 3.47Å; G934-T954 PolarHBondContact O-N 3.23Å; G934-L1016 VanDerWaalsContact C-CD1 3.42Å; G934-L1016 WeakPolarHBondContact O-CD1 3.44Å
935	P	86.6	Confident	75.4	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.013	26%	0.262	C	S	.	.			trans	-62.8	162	-178.4	28	-35	0	0	0	111.6	L937 T954 Y1014 Y1019 P1033	P935-L937 HydrophobicContact CG-CD2 4.2Å; P935-L937 PolarHBondContact O-N 3.25Å; P935-T954 WeakPolarHBondContact O-CB 3.17Å; P935-T954 PolarHBondContact O-N 3.26Å; P935-T954 PolarHBondContact O-OG1 3.08Å; P935-Y1014 HydrophobicContact CG-CE1 4.4Å; P935-Y1019 HydrophobicContact CB-CD2 3.79Å; P935-Y1019 HydrophobicContact CB-CE2 3.94Å; P935-Y1019 HydrophobicContact CB-CG 4.17Å; P935-P1033 HydrophobicContact CG-CG 3.96Å
936	P	85.9	Confident	75.1	Confident	28 Å²	28	51 Å²	51	18%	0.182	29%	0.286	C	S	.	.			trans	-67.3	100.2	173.8	26.4	-31.6	0	0	0	110.6	P951 V952 Y1019	P936-P951 HydrophobicContact CB-CB 3.81Å; P936-P951 HydrophobicContact CB-CG 4.32Å; P936-V952 WeakPolarHBondContact CD-O 3.45Å; P936-Y1019 VanDerWaalsContact CD-CZ 3.5Å; P936-Y1019 HydrophobicContact CG-CE1 3.53Å; P936-Y1019 WeakPolarHBondContact CG-OH 3.39Å
937	L	83.2	Confident	74.1	Confident	21 Å²	21	56.1 Å²	56.1	11%	0.11	32%	0.318	C	S	.	.			trans	-88.5	-25	-173.4	-72.3	-179.8	0	0	0	114.6	P935 T954 F956 L1032 L1048 P1049	P935-L937 HydrophobicContact CG-CD2 4.2Å; P935-L937 PolarHBondContact O-N 3.25Å; L937-T954 HydrophobicContact CD1-CG2 4.36Å; L937-T954 PolarHBondContact N-OG1 3.33Å; L937-F956 HydrophobicContact CD1-CE1 4.5Å; L937-F956 HydrophobicContact CD1-CZ 3.78Å; L937-L1032 HydrophobicContact CD2-CD1 4.31Å; L937-L1032 HydrophobicContact CD2-CD2 4.02Å; L937-L1048 HydrophobicContact CD1-CB 4.03Å; L937-L1048 HydrophobicContact CD1-CD1 3.98Å; L937-L1048 HydrophobicContact CD1-CD2 3.8Å; L937-L1048 HydrophobicContact CD1-CG 4.14Å; L937-L1048 HydrophobicContact CD2-CB 3.88Å; L937-L1048 HydrophobicContact CD2-CD1 4.41Å; L937-P1049 HydrophobicContact CB-CB 4.11Å; L937-P1049 HydrophobicContact CD2-CB 4.45Å
938	F	74.8	Confident	73.3	Confident	35 Å²	35	58 Å²	58	15%	0.154	33%	0.33	C	S	.	.			trans	-124.4	120.9	-169.5	-53.8	-82.1	0	0	0	109.5	T954 L966 S968 R990 P1049	F938-T954 HydrophobicContact CE2-CG2 4.31Å; F938-L966 HydrophobicContact CE2-CD2 4.03Å; F938-L966 HydrophobicContact CZ-CD2 4.14Å; F938-S968 VanDerWaalsContact CD2-OG 3.25Å; F938-S968 WeakPolarHBondContact CD2-OG 3.47Å; F938-R990 HydrophobicContact CE1-CG 4.36Å; F938-R990 HydrophobicContact CZ-CG 4.28Å; F938-P1049 HydrophobicContact CD1-CB 4.4Å; F938-P1049 HydrophobicContact CE1-CB 3.85Å; F938-P1049 HydrophobicContact CZ-CB 4.13Å
939	K	65.6	Low	72.4	Confident	191 Å²	191	59 Å²	59	83%	0.83	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-76.3	151.9	167.6	-63.6	-176.8	178.4	-176.2	0	108.7	S941	K939-S941 PolarHBondContact O-N 3.09Å
940	S	54.6	Low	71.8	Confident	44 Å²	44	60.1 Å²	60.1	31%	0.308	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-55.5	136.3	172.3	50	0	0	0	0	109.9
941	S	50.1	Low	71.1	Confident	66 Å²	66	60.9 Å²	60.9	46%	0.462	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-55.1	132.8	177.9	-178.8	0	0	0	0	109.2	K939 S943 N944 A945	K939-S941 PolarHBondContact O-N 3.09Å; S941-S943 PolarHBondContact O-N 2.78Å; S941-S943 PolarHBondContact OG-OG 2.9Å; S941-N944 CarbonylContact O-C 3.37Å; S941-N944 PolarHBondContact O-N 2.84Å; S941-A945 PolarHBondContact O-N 3.38Å; S941-A945 VanDerWaalsContact O-N 3.14Å
942	P	48.7	Very low	70.4	Confident	125 Å²	125	62.1 Å²	62.1	81%	0.812	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-58.4	-26.3	-177.2	22	-32.8	0	0	0	112.9	N944	P942-N944 PolarHBondContact O-N 2.79Å
943	S	50.7	Low	70.2	Confident	102 Å²	102	62 Å²	62	71%	0.713	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-68.6	-11.9	173.9	54.9	0	0	0	0	115.5	S941	S941-S943 PolarHBondContact O-N 2.78Å; S941-S943 PolarHBondContact OG-OG 2.9Å
944	N	49.4	Very low	70.2	Confident	141 Å²	141	60.8 Å²	60.8	75%	0.754	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-141.6	26.8	-178.6	-115.3	-18.3	0	0	0	111.6	S941 P942 R946	S941-N944 CarbonylContact O-C 3.37Å; S941-N944 PolarHBondContact O-N 2.84Å; P942-N944 PolarHBondContact O-N 2.79Å; N944-R946 PolarHBondContact O-N 3.18Å
945	A	49.5	Very low	70.5	Confident	52 Å²	52	60.8 Å²	60.8	43%	0.43	35%	0.345	S	S	.	.			trans	-70.7	88.6	-177.7	0	0	0	0	0	111.1	S941 P947	S941-A945 PolarHBondContact O-N 3.38Å; S941-A945 VanDerWaalsContact O-N 3.14Å; A945-P947 VanDerWaalsContact O-CD 3.28Å; A945-P947 WeakPolarHBondContact O-CD 3.22Å
946	R	56.5	Low	71	Confident	159 Å²	159	60.7 Å²	60.7	60%	0.6	35%	0.345	S	S	*	.			trans	-63.8	115.1	158.6	-74.8	-174.7	174.8	-174.1	-2.4	107.5	N944 T948 L949	N944-R946 PolarHBondContact O-N 3.18Å; R946-T948 PolarHBondContact O-N 3.2Å; R946-L949 HydrophobicContact CB-CD1 4.23Å; R946-L949 HydrophobicContact CB-CG 4.42Å; R946-L949 PolarHBondContact O-N 3.08Å
947	P	57.9	Low	71.6	Confident	122 Å²	122	59.4 Å²	59.4	79%	0.792	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-8.5	-174.4	26.6	-34.8	0	0	0	113.6	A945	A945-P947 VanDerWaalsContact O-CD 3.28Å; A945-P947 WeakPolarHBondContact O-CD 3.22Å
948	T	71.9	Confident	72.2	Confident	43 Å²	43	58.4 Å²	58.4	26%	0.264	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-15.4	179.9	62.7	0	0	0	0	114.4	R946 K973 T974	R946-T948 PolarHBondContact O-N 3.2Å; T948-K973 WeakPolarHBondContact O-CB 3.32Å; T948-K973 VanDerWaalsContact O-CG 3.25Å; T948-K973 WeakPolarHBondContact O-CG 3.26Å; T948-K973 PolarHBondContact O-N 2.94Å; T948-T974 HydrophobicContact CG2-CG2 3.64Å
949	L	77.4	Confident	73.1	Confident	22 Å²	22	56.8 Å²	56.8	12%	0.115	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121	-174.9	-70.3	172.8	0	0	0	112.4	R946 F970 D972 Y987	R946-L949 HydrophobicContact CB-CD1 4.23Å; R946-L949 HydrophobicContact CB-CG 4.42Å; R946-L949 PolarHBondContact O-N 3.08Å; L949-F970 HydrophobicContact CB-CB 4.29Å; L949-F970 HydrophobicContact CB-CD1 4.08Å; L949-F970 HydrophobicContact CD2-CB 4.18Å; L949-D972 HydrophobicContact CD2-CB 4.22Å; L949-Y987 HydrophobicContact CD1-CE2 4.26Å
950	H	80.3	Confident	74.3	Confident	44 Å²	44	50.9 Å²	50.9	20%	0.204	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.6	173.9	-168.3	-82.3	0	0	0	110.7	F970 V971 K973	H950-F970 CarbonylContact O-C 3.33Å; H950-F970 WeakPolarHBondContact O-CA 3.37Å; H950-V971 HydrophobicContact CB-CG1 3.94Å; H950-V971 PolarHBondContact N-O 2.91Å; H950-V971 PolarHBondContact O-N 2.91Å; H950-K973 HydrophobicContact CB-CG 4.17Å
951	P	81.2	Confident	75.8	Confident	31 Å²	31	49.2 Å²	49.2	20%	0.201	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	133.3	175.7	32	-34.5	0	0	0	110.3	P936 F970	P936-P951 HydrophobicContact CB-CB 3.81Å; P936-P951 HydrophobicContact CB-CG 4.32Å; P951-F970 HydrophobicContact CB-CD1 3.89Å; P951-F970 HydrophobicContact CB-CE1 3.71Å; P951-F970 HydrophobicContact CB-CZ 4.37Å; P951-F970 HydrophobicContact CG-CE1 4.43Å
952	V	81.8	Confident	77.8	Confident	42 Å²	42	46 Å²	46	26%	0.255	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-47.6	-174.4	-175.6	0	0	0	0	111.3	P936 I969 V971	P936-V952 WeakPolarHBondContact CD-O 3.45Å; V952-I969 HydrophobicContact CB-CG2 4.47Å; V952-I969 PolarHBondContact N-O 3.23Å; V952-V971 HydrophobicContact CG2-CB 3.84Å; V952-V971 HydrophobicContact CG2-CG1 3.57Å
953	A	87.9	Confident	79.9	Confident	7 Å²	7	40.4 Å²	40.4	6%	0.058	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	171.9	-174.5	0	0	0	0	0	111.6	G934 I969	G934-A953 CarbonylContact O-C 3.5Å; G934-A953 WeakPolarHBondContact O-CA 3.32Å; G934-A953 WeakPolarHBondContact O-CB 3.42Å; A953-I969 HydrophobicContact CB-CB 4.49Å; A953-I969 HydrophobicContact CB-CD1 3.89Å; A953-I969 PolarHBondContact O-N 3.17Å
954	T	92	Very high	82	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.6	167.9	-48.3	0	0	0	0	109.5	F933 G934 P935 L937 F938 F956 L966 Y967	F933-T954 CarbonylContact C-O 3.53Å; F933-T954 WeakPolarHBondContact CA-O 3.5Å; G934-T954 PolarHBondContact N-O 3.47Å; G934-T954 PolarHBondContact O-N 3.23Å; P935-T954 WeakPolarHBondContact O-CB 3.17Å; P935-T954 PolarHBondContact O-N 3.26Å; P935-T954 PolarHBondContact O-OG1 3.08Å; L937-T954 HydrophobicContact CD1-CG2 4.36Å; L937-T954 PolarHBondContact N-OG1 3.33Å; F938-T954 HydrophobicContact CE2-CG2 4.31Å; T954-F956 HydrophobicContact CG2-CD2 4.35Å; T954-F956 HydrophobicContact CG2-CE2 3.88Å; T954-F956 HydrophobicContact CG2-CZ 4.04Å; T954-L966 HydrophobicContact CG2-CB 4.44Å; T954-L966 HydrophobicContact CG2-CD2 4.47Å; T954-Y967 CarbonylContact C-O 3.6Å; T954-Y967 WeakPolarHBondContact CA-O 3.45Å; T954-Y967 WeakPolarHBondContact CG2-O 3.48Å
955	L	95	Very high	84.2	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.1	170.2	175.6	64.2	0	0	0	109.8	A769 V778 F931 F933 I957 L966 Y967 I969 L986	A769-L955 HydrophobicContact CB-CD1 4.12Å; A769-L955 HydrophobicContact CB-CD2 4.19Å; V778-L955 HydrophobicContact CG2-CD2 3.56Å; F931-L955 HydrophobicContact CB-CD1 4.28Å; F931-L955 HydrophobicContact CD1-CD1 4.08Å; F933-L955 HydrophobicContact CD1-CB 4.32Å; F933-L955 HydrophobicContact CD1-CD1 4.09Å; F933-L955 HydrophobicContact CE1-CB 4.15Å; F933-L955 HydrophobicContact CE1-CD1 3.82Å; F933-L955 HydrophobicContact CE1-CG 4.44Å; F933-L955 HydrophobicContact CZ-CD1 4.11Å; L955-I957 HydrophobicContact CD2-CD1 4.08Å; L955-I957 HydrophobicContact CD2-CG1 4.21Å; L955-I957 HydrophobicContact CG-CD1 4.31Å; L955-I957 HydrophobicContact CG-CG1 3.94Å; L955-L966 WeakPolarHBondContact O-CA 3.49Å; L955-Y967 PolarHBondContact N-O 3.17Å; L955-Y967 PolarHBondContact O-N 2.96Å; L955-I969 HydrophobicContact CB-CD1 4.09Å; L955-L986 HydrophobicContact CD2-CD2 4.41Å
956	F	97	Very high	86.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	136.5	173.9	-57.6	-105.1	0	0	0	109.3	F931 A932 L937 T954 V964 K965 L966 L1003 L1005 L1035 L1048	F931-F956 CarbonylContact C-O 3.57Å; F931-F956 VanDerWaalsContact CA-O 3.26Å; F931-F956 WeakPolarHBondContact CA-O 3.3Å; A932-F956 HydrophobicContact CB-CB 4.32Å; A932-F956 PolarHBondContact N-O 2.59Å; A932-F956 WeakPolarHBondContact O-CD2 3.36Å; A932-F956 PolarHBondContact O-N 2.85Å; L937-F956 HydrophobicContact CD1-CE1 4.5Å; L937-F956 HydrophobicContact CD1-CZ 3.78Å; T954-F956 HydrophobicContact CG2-CD2 4.35Å; T954-F956 HydrophobicContact CG2-CE2 3.88Å; T954-F956 HydrophobicContact CG2-CZ 4.04Å; F956-V964 HydrophobicContact CB-CG1 4.44Å; F956-K965 CarbonylContact C-O 3.53Å; F956-K965 WeakPolarHBondContact CA-O 3.32Å; F956-L966 HydrophobicContact CD1-CD1 4.22Å; F956-L966 HydrophobicContact CD1-CD2 3.89Å; F956-L966 HydrophobicContact CD1-CG 3.66Å; F956-L966 HydrophobicContact CE1-CD2 3.5Å; F956-L966 VanDerWaalsContact CE1-CD2 3.5Å; F956-L966 HydrophobicContact CE1-CG 3.83Å; F956-L966 HydrophobicContact CG-CG 4.47Å; F956-L966 HydrophobicContact CZ-CD2 4.28Å; F956-L1003 HydrophobicContact CB-CD1 3.99Å; F956-L1005 HydrophobicContact CE2-CD1 4.41Å; F956-L1005 HydrophobicContact CE2-CD2 4.41Å; F956-L1005 HydrophobicContact CZ-CD2 4.32Å; F956-L1035 HydrophobicContact CD1-CD1 3.86Å; F956-L1035 HydrophobicContact CD1-CD2 3.79Å; F956-L1035 HydrophobicContact CD1-CG 4.45Å; F956-L1035 HydrophobicContact CE1-CD1 4.03Å; F956-L1035 HydrophobicContact CE1-CD2 3.83Å; F956-L1035 HydrophobicContact CE1-CG 4.41Å; F956-L1035 HydrophobicContact CG-CD1 4.32Å; F956-L1048 HydrophobicContact CE1-CD2 3.99Å; F956-L1048 HydrophobicContact CZ-CD1 4.07Å; F956-L1048 HydrophobicContact CZ-CD2 4.16Å
957	I	97.5	Very high	88.2	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	108.3	-170.9	-49.1	-179	0	0	0	109.2	F776 I928 F931 L955 V964 K965 Y967	F776-I957 HydrophobicContact CD1-CD1 4.07Å; F776-I957 HydrophobicContact CD1-CG2 4.1Å; F776-I957 HydrophobicContact CD2-CD1 3.65Å; F776-I957 HydrophobicContact CE1-CD1 3.75Å; F776-I957 HydrophobicContact CE1-CG2 4.4Å; F776-I957 HydrophobicContact CE2-CD1 3.3Å; F776-I957 HydrophobicContact CG-CD1 4.03Å; F776-I957 HydrophobicContact CG-CG2 4.43Å; F776-I957 HydrophobicContact CZ-CD1 3.35Å; I928-I957 HydrophobicContact CD1-CG2 4.08Å; I928-I957 HydrophobicContact CG2-CG2 3.89Å; F931-I957 HydrophobicContact CD1-CB 4.2Å; F931-I957 HydrophobicContact CD1-CG1 3.9Å; F931-I957 HydrophobicContact CD1-CG2 4.01Å; F931-I957 HydrophobicContact CE1-CB 4.25Å; F931-I957 HydrophobicContact CE1-CD1 4.32Å; F931-I957 HydrophobicContact CE1-CG1 3.97Å; F931-I957 HydrophobicContact CE1-CG2 3.66Å; L955-I957 HydrophobicContact CD2-CD1 4.08Å; L955-I957 HydrophobicContact CD2-CG1 4.21Å; L955-I957 HydrophobicContact CG-CD1 4.31Å; L955-I957 HydrophobicContact CG-CG1 3.94Å; I957-V964 CarbonylContact O-C 3.44Å; I957-V964 VanDerWaalsContact O-CA 3.23Å; I957-V964 WeakPolarHBondContact O-CA 3.49Å; I957-K965 HydrophobicContact CB-CB 4.35Å; I957-K965 PolarHBondContact N-O 2.83Å; I957-K965 PolarHBondContact O-N 3.39Å; I957-Y967 HydrophobicContact CD1-CD2 3.74Å; I957-Y967 HydrophobicContact CD1-CE2 3.93Å
958	G	96.1	Very high	89.9	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	142.1	179.7	0	0	0	0	0	112.2	S929 C930	S929-G958 PolarHBondContact N-O 2.86Å; S929-G958 PolarHBondContact OG-O 2.81Å; C930-G958 PolarHBondContact O-N 2.9Å
959	T	94.5	Very high	90.7	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	155.6	-179.6	78.2	0	0	0	0	113.3	A926 I927 I928 A961 G962 T963 V1000	A926-T959 HydrophobicContact CB-CG2 4.22Å; I927-T959 CarbonylContact O-C 3.57Å; I927-T959 VanDerWaalsContact O-CA 3.28Å; I927-T959 WeakPolarHBondContact O-CA 3.49Å; I928-T959 HydrophobicContact CD1-CG2 4.03Å; T959-A961 PolarHBondContact O-N 2.95Å; T959-A961 VanDerWaalsContact O-N 3.16Å; T959-A961 PolarHBondContact OG1-N 3.28Å; T959-G962 PolarHBondContact O-N 2.92Å; T959-G962 VanDerWaalsContact O-N 3.14Å; T959-T963 WeakPolarHBondContact CG2-OG1 3.44Å; T959-T963 PolarHBondContact N-O 3.43Å; T959-T963 PolarHBondContact OG1-N 3.36Å; T959-T963 VanDerWaalsContact OG1-N 3.15Å; T959-T963 PolarHBondContact OG1-O 3.42Å; T959-T963 PolarHBondContact OG1-OG1 3.2Å; T959-V1000 WeakPolarHBondContact O-CG2 3.33Å; T959-V1000 PolarHBondContact O-N 3.3Å
960	K	90.3	Very high	91.2	Very high	67 Å²	67	13.5 Å²	13.5	29%	0.291	7%	0.069	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-2.6	172.2	-56.6	-165.5	-175.4	-178.5	0	113.7	W823 I927 P999	W823-K960 HydrophobicContact CH2-CB 3.89Å; W823-K960 HydrophobicContact CH2-CD 3.4Å; W823-K960 HydrophobicContact CH2-CG 4.23Å; W823-K960 HydrophobicContact CZ2-CD 3.83Å; W823-K960 HydrophobicContact CZ3-CB 4.02Å; W823-K960 HydrophobicContact CZ3-CD 4.3Å; I927-K960 HydrophobicContact CB-CB 4.19Å; I927-K960 HydrophobicContact CB-CD 4.09Å; I927-K960 HydrophobicContact CB-CG 4.08Å; I927-K960 HydrophobicContact CG2-CD 3.86Å; I927-K960 HydrophobicContact CG2-CG 4.14Å; I927-K960 PolarHBondContact O-N 3.38Å; K960-P999 HydrophobicContact CB-CB 4.03Å; K960-P999 HydrophobicContact CB-CG 4.37Å; K960-P999 HydrophobicContact CG-CB 4.31Å; K960-P999 WeakPolarHBondContact O-CG 3.14Å
961	A	87	Confident	91.4	Very high	9 Å²	9	11.5 Å²	11.5	7%	0.074	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	4.9	171.5	0	0	0	0	0	113.5	A923 A926 T959 R997	A923-A961 HydrophobicContact CB-CB 4.2Å; A926-A961 HydrophobicContact CB-CB 3.67Å; T959-A961 PolarHBondContact O-N 2.95Å; T959-A961 VanDerWaalsContact O-N 3.16Å; T959-A961 PolarHBondContact OG1-N 3.28Å; A961-R997 WeakPolarHBondContact O-CD 3.3Å
962	G	90.6	Very high	91.5	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.056	C	C	.	.	S	Bend	trans	73.1	32.5	-178.1	0	0	0	0	0	113.3	T959 L994 A998	T959-G962 PolarHBondContact O-N 2.92Å; T959-G962 VanDerWaalsContact O-N 3.14Å; G962-L994 WeakPolarHBondContact O-CB 3.42Å; G962-L994 WeakPolarHBondContact O-CG 3.25Å; G962-L994 PolarHBondContact O-N 3.05Å; G962-A998 WeakPolarHBondContact CA-O 3.29Å; G962-A998 PolarHBondContact N-O 3.18Å
963	T	93.1	Very high	91.1	Very high	6 Å²	6	14 Å²	14	4%	0.037	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	150.3	171.7	70.7	0	0	0	0	111.3	T959 E991 L992 I993	T959-T963 WeakPolarHBondContact CG2-OG1 3.44Å; T959-T963 PolarHBondContact N-O 3.43Å; T959-T963 PolarHBondContact OG1-N 3.36Å; T959-T963 VanDerWaalsContact OG1-N 3.15Å; T959-T963 PolarHBondContact OG1-O 3.42Å; T959-T963 PolarHBondContact OG1-OG1 3.2Å; T963-E991 VanDerWaalsContact CB-OE1 3.27Å; T963-E991 WeakPolarHBondContact CB-OE1 3.35Å; T963-E991 PolarHBondContact OG1-OE1 3Å; T963-L992 CarbonylContact C-O 3.55Å; T963-L992 WeakPolarHBondContact CA-O 3.17Å; T963-I993 HydrophobicContact CG2-CG1 4.04Å; T963-I993 HydrophobicContact CG2-CG2 4.35Å
964	V	96	Very high	90.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	110.6	173.7	-177.3	0	0	0	0	108.2	F956 I957 L966 E991 L992 V1000 L1003 V1037	F956-V964 HydrophobicContact CB-CG1 4.44Å; I957-V964 CarbonylContact O-C 3.44Å; I957-V964 VanDerWaalsContact O-CA 3.23Å; I957-V964 WeakPolarHBondContact O-CA 3.49Å; V964-L966 HydrophobicContact CG1-CD1 4.31Å; V964-E991 WeakPolarHBondContact O-CA 3.05Å; V964-L992 HydrophobicContact CB-CB 4.26Å; V964-L992 HydrophobicContact CB-CD2 4.38Å; V964-L992 HydrophobicContact CG2-CD2 4.43Å; V964-L992 PolarHBondContact N-O 3.1Å; V964-L992 PolarHBondContact O-N 3.11Å; V964-V1000 HydrophobicContact CG2-CG1 4.47Å; V964-V1000 HydrophobicContact CG2-CG2 4.02Å; V964-L1003 HydrophobicContact CG1-CD1 3.94Å; V964-L1003 HydrophobicContact CG1-CD2 4.01Å; V964-L1003 HydrophobicContact CG2-CD2 3.88Å; V964-V1037 HydrophobicContact CG2-CG1 3.93Å; V964-V1037 HydrophobicContact CG2-CG2 4.32Å
965	K	95.1	Very high	89.2	Confident	44 Å²	44	19 Å²	19	19%	0.191	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	143.5	176.8	-61.7	-168.5	173.8	-165.8	0	110.6	F956 I957 Y967 E991	F956-K965 CarbonylContact C-O 3.53Å; F956-K965 WeakPolarHBondContact CA-O 3.32Å; I957-K965 HydrophobicContact CB-CB 4.35Å; I957-K965 PolarHBondContact N-O 2.83Å; I957-K965 PolarHBondContact O-N 3.39Å; K965-Y967 HydrophobicContact CB-CE2 4.14Å; K965-E991 VanDerWaalsContact CE-CD 3.49Å; K965-E991 WeakPolarHBondContact CE-OE1 3.45Å; K965-E991 HydrophobicContact CG-CB 4.36Å; K965-E991 HydrophobicContact CG-CG 4.07Å
966	L	95.7	Very high	87.8	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.4	179.9	-71.7	78.3	0	0	0	110	F938 T954 L955 F956 V964 S989 R990 L1051	F938-L966 HydrophobicContact CE2-CD2 4.03Å; F938-L966 HydrophobicContact CZ-CD2 4.14Å; T954-L966 HydrophobicContact CG2-CB 4.44Å; T954-L966 HydrophobicContact CG2-CD2 4.47Å; L955-L966 WeakPolarHBondContact O-CA 3.49Å; F956-L966 HydrophobicContact CD1-CD1 4.22Å; F956-L966 HydrophobicContact CD1-CD2 3.89Å; F956-L966 HydrophobicContact CD1-CG 3.66Å; F956-L966 HydrophobicContact CE1-CD2 3.5Å; F956-L966 VanDerWaalsContact CE1-CD2 3.5Å; F956-L966 HydrophobicContact CE1-CG 3.83Å; F956-L966 HydrophobicContact CG-CG 4.47Å; F956-L966 HydrophobicContact CZ-CD2 4.28Å; V964-L966 HydrophobicContact CG1-CD1 4.31Å; L966-S989 PolarHBondContact O-N 2.82Å; L966-R990 HydrophobicContact CB-CB 4.43Å; L966-R990 PolarHBondContact N-O 2.88Å; L966-R990 PolarHBondContact O-N 3.17Å; L966-L1051 HydrophobicContact CD1-CD1 3.85Å; L966-L1051 HydrophobicContact CD2-CD1 3.95Å; L966-L1051 HydrophobicContact CD2-CD2 4.29Å; L966-L1051 HydrophobicContact CD2-CG 4.48Å
967	Y	95.1	Very high	85.9	Confident	18 Å²	18	24.3 Å²	24.3	7%	0.071	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.7	173.6	-74.9	-102.1	0	0	0	109.9	F776 L802 T954 L955 I957 K965 L986 Y987 Y988	F776-Y967 HydrophobicContact CE2-CE2 4.25Å; F776-Y967 HydrophobicContact CZ-CD2 4.38Å; F776-Y967 AromaticContact CZ-CE2 3.6Å; F776-Y967 HydrophobicContact CZ-CE2 3.6Å; F776-Y967 AromaticContact CZ-CZ 3.8Å; L802-Y967 HydrophobicContact CD2-CD1 3.66Å; L802-Y967 HydrophobicContact CD2-CE1 3.59Å; L802-Y967 HydrophobicContact CD2-CG 4.34Å; T954-Y967 CarbonylContact C-O 3.6Å; T954-Y967 WeakPolarHBondContact CA-O 3.45Å; T954-Y967 WeakPolarHBondContact CG2-O 3.48Å; L955-Y967 PolarHBondContact N-O 3.17Å; L955-Y967 PolarHBondContact O-N 2.96Å; I957-Y967 HydrophobicContact CD1-CD2 3.74Å; I957-Y967 HydrophobicContact CD1-CE2 3.93Å; K965-Y967 HydrophobicContact CB-CE2 4.14Å; Y967-L986 HydrophobicContact CD1-CB 4.42Å; Y967-Y987 CarbonylContact C-O 3.17Å; Y967-Y987 WeakPolarHBondContact CA-O 3.16Å; Y967-Y988 HydrophobicContact CE1-CD2 4.33Å; Y967-Y988 HydrophobicContact CE1-CG 4.46Å; Y967-Y988 AromaticContact CE2-CD2 3.94Å; Y967-Y988 HydrophobicContact CE2-CD2 3.94Å; Y967-Y988 AromaticContact CZ-CD2 3.82Å
968	S	92.1	Very high	84	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.014	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	130.6	172.8	-62.6	0	0	0	0	109.5	F938 F970 L986 Y987 S989	F938-S968 VanDerWaalsContact CD2-OG 3.25Å; F938-S968 WeakPolarHBondContact CD2-OG 3.47Å; S968-F970 VanDerWaalsContact CB-CE2 3.49Å; S968-L986 WeakPolarHBondContact O-CA 3.47Å; S968-Y987 PolarHBondContact N-O 3.02Å; S968-Y987 PolarHBondContact O-N 2.95Å; S968-S989 WeakPolarHBondContact CB-OG 3.16Å; S968-S989 PolarHBondContact N-OG 3.1Å; S968-S989 PolarHBondContact OG-OG 3.27Å
969	I	90.3	Very high	82	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.5	-179.5	-60.8	148.3	0	0	0	107.9	L767 F933 V952 A953 L955 L984 Q985 L986	L767-I969 HydrophobicContact CD2-CD1 3.76Å; L767-I969 HydrophobicContact CD2-CG1 4.43Å; L767-I969 HydrophobicContact CD2-CG2 4.42Å; F933-I969 HydrophobicContact CD1-CD1 4.12Å; F933-I969 HydrophobicContact CE1-CD1 3.79Å; V952-I969 HydrophobicContact CB-CG2 4.47Å; V952-I969 PolarHBondContact N-O 3.23Å; A953-I969 HydrophobicContact CB-CB 4.49Å; A953-I969 HydrophobicContact CB-CD1 3.89Å; A953-I969 PolarHBondContact O-N 3.17Å; L955-I969 HydrophobicContact CB-CD1 4.09Å; I969-L984 HydrophobicContact CG2-CD2 4.11Å; I969-Q985 WeakPolarHBondContact CA-O 3.24Å; I969-L986 HydrophobicContact CG1-CD2 3.99Å; I969-L986 HydrophobicContact CG1-CG 3.85Å
970	F	87.5	Confident	80.3	Confident	10 Å²	10	36.9 Å²	36.9	4%	0.044	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150.3	176.3	-63.2	-103	0	0	0	110.4	L949 H950 P951 S968 L984 Q985 Y987	L949-F970 HydrophobicContact CB-CB 4.29Å; L949-F970 HydrophobicContact CB-CD1 4.08Å; L949-F970 HydrophobicContact CD2-CB 4.18Å; H950-F970 CarbonylContact O-C 3.33Å; H950-F970 WeakPolarHBondContact O-CA 3.37Å; P951-F970 HydrophobicContact CB-CD1 3.89Å; P951-F970 HydrophobicContact CB-CE1 3.71Å; P951-F970 HydrophobicContact CB-CZ 4.37Å; P951-F970 HydrophobicContact CG-CE1 4.43Å; S968-F970 VanDerWaalsContact CB-CE2 3.49Å; F970-L984 CarbonylContact O-C 3.58Å; F970-L984 WeakPolarHBondContact O-CA 3.28Å; F970-Q985 PolarHBondContact N-O 3.29Å; F970-Q985 PolarHBondContact O-N 3.49Å; F970-Y987 AromaticContact CD2-CD2 3.63Å; F970-Y987 HydrophobicContact CD2-CD2 3.63Å; F970-Y987 HydrophobicContact CD2-CE2 4.22Å; F970-Y987 AromaticContact CE2-CD2 3.88Å; F970-Y987 HydrophobicContact CE2-CD2 3.88Å
971	V	84.2	Confident	79	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.012	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.4	168.5	66.4	0	0	0	0	109.8	L746 H950 V952 K973 L976 P982 L984	L746-V971 HydrophobicContact CD1-CG1 4.19Å; H950-V971 HydrophobicContact CB-CG1 3.94Å; H950-V971 PolarHBondContact N-O 2.91Å; H950-V971 PolarHBondContact O-N 2.91Å; V952-V971 HydrophobicContact CG2-CB 3.84Å; V952-V971 HydrophobicContact CG2-CG1 3.57Å; V971-K973 PolarHBondContact O-N 2.85Å; V971-L976 HydrophobicContact CG1-CD1 3.95Å; V971-L976 HydrophobicContact CG2-CD1 4.13Å; V971-L976 HydrophobicContact CG2-CG 4.45Å; V971-P982 HydrophobicContact CG2-CB 4.11Å; V971-L984 HydrophobicContact CB-CD2 4.04Å; V971-L984 HydrophobicContact CG2-CD2 4.31Å
972	D	82.1	Confident	78.2	Confident	21 Å²	21	35.3 Å²	35.3	11%	0.112	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	111.5	174.1	-164.5	-31.9	0	0	0	110.9	L949 T974 T975 K983	L949-D972 HydrophobicContact CD2-CB 4.22Å; D972-T974 VanDerWaalsContact CG-OG1 3.22Å; D972-T974 PolarHBondContact O-N 2.89Å; D972-T974 VanDerWaalsContact O-N 3.13Å; D972-T974 WeakPolarHBondContact OD1-CB 3.39Å; D972-T974 PolarHBondContact OD1-N 2.81Å; D972-T974 PolarHBondContact OD1-OG1 3.03Å; D972-T975 HydrophobicContact CB-CG2 4.31Å; D972-T975 PolarHBondContact O-N 3.17Å; D972-T975 PolarHBondContact O-OG1 2.89Å; D972-K983 HydrophobicContact CB-CB 4.21Å; D972-K983 PolarHBondContact N-O 3.01Å; D972-K983 VanDerWaalsContact N-O 3.08Å
973	K	73.7	Confident	77.7	Confident	104 Å²	104	41.1 Å²	41.1	45%	0.452	23%	0.227	S	C	.	.	H	α-helix	trans	-55.4	-27.4	177.6	-70.3	-177.9	175.8	-168.8	0	113.3	T948 H950 V971 T975 L976	T948-K973 WeakPolarHBondContact O-CB 3.32Å; T948-K973 VanDerWaalsContact O-CG 3.25Å; T948-K973 WeakPolarHBondContact O-CG 3.26Å; T948-K973 PolarHBondContact O-N 2.94Å; H950-K973 HydrophobicContact CB-CG 4.17Å; V971-K973 PolarHBondContact O-N 2.85Å; K973-T975 PolarHBondContact O-N 3.2Å; K973-L976 PolarHBondContact O-N 3.09Å
974	T	71.7	Confident	77.4	Confident	89 Å²	89	41.4 Å²	41.4	55%	0.546	23%	0.228	S	C	.	.	H	α-helix	trans	-68.1	-26.2	177.4	63.5	0	0	0	0	112.4	T948 D972	T948-T974 HydrophobicContact CG2-CG2 3.64Å; D972-T974 VanDerWaalsContact CG-OG1 3.22Å; D972-T974 PolarHBondContact O-N 2.89Å; D972-T974 VanDerWaalsContact O-N 3.13Å; D972-T974 WeakPolarHBondContact OD1-CB 3.39Å; D972-T974 PolarHBondContact OD1-N 2.81Å; D972-T974 PolarHBondContact OD1-OG1 3.03Å
975	T	69.5	Low	77.1	Confident	23 Å²	23	43.4 Å²	43.4	14%	0.141	24%	0.237	C	C	.	.	H	α-helix	trans	-86.4	-22.2	179.2	62.6	0	0	0	0	113.5	D972 K973 N977 S978 K983	D972-T975 HydrophobicContact CB-CG2 4.31Å; D972-T975 PolarHBondContact O-N 3.17Å; D972-T975 PolarHBondContact O-OG1 2.89Å; K973-T975 PolarHBondContact O-N 3.2Å; T975-N977 VanDerWaalsContact C-N 3.26Å; T975-N977 PolarHBondContact O-N 3.11Å; T975-S978 PolarHBondContact O-N 3.09Å; T975-S978 VanDerWaalsContact O-N 3.11Å; T975-K983 HydrophobicContact CG2-CB 3.81Å; T975-K983 PolarHBondContact OG1-N 3.24Å
976	L	65.6	Low	76.9	Confident	10 Å²	10	42.3 Å²	42.3	5%	0.052	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-29.8	-177.7	-101.6	152.2	0	0	0	114.5	L743 L746 K747 V971 K973	L743-L976 HydrophobicContact CD2-CD2 3.6Å; L743-L976 HydrophobicContact CD2-CG 4.22Å; L743-L976 HydrophobicContact CG-CD2 4.11Å; L746-L976 HydrophobicContact CB-CD1 3.91Å; L746-L976 HydrophobicContact CB-CD2 3.4Å; L746-L976 HydrophobicContact CB-CG 4.31Å; L746-L976 HydrophobicContact CD1-CD1 4.44Å; L746-L976 HydrophobicContact CD1-CD2 4.38Å; K747-L976 WeakPolarHBondContact CE-O 3.46Å; K747-L976 HydrophobicContact CG-CD2 4.36Å; V971-L976 HydrophobicContact CG1-CD1 3.95Å; V971-L976 HydrophobicContact CG2-CD1 4.13Å; V971-L976 HydrophobicContact CG2-CG 4.45Å; K973-L976 PolarHBondContact O-N 3.09Å
977	N	56.7	Low	76.7	Confident	102 Å²	102	47.3 Å²	47.3	55%	0.545	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	2	179.8	-66.2	-10.7	0	0	0	113.4	S750 T975	S750-N977 PolarHBondContact OG-ND2 2.92Å; T975-N977 VanDerWaalsContact C-N 3.26Å; T975-N977 PolarHBondContact O-N 3.11Å
978	S	57.4	Low	76.6	Confident	60 Å²	60	52.1 Å²	52.1	42%	0.42	27%	0.272	S	S	.	.	S	Bend	trans	-92.4	161.8	177.9	-168.8	0	0	0	0	111.8	T975 V980	T975-S978 PolarHBondContact O-N 3.09Å; T975-S978 VanDerWaalsContact O-N 3.11Å; S978-V980 PolarHBondContact O-N 3.48Å; S978-V980 WeakPolarHBondContact OG-CG2 3.32Å; S978-V980 PolarHBondContact OG-N 2.9Å
979	S	54.2	Low	76.5	Confident	107 Å²	107	53.9 Å²	53.9	75%	0.748	28%	0.284	S	S	*	.	S	Bend	trans	-80.5	5	166.7	67.1	0	0	0	0	113.2
980	V	58	Low	76.6	Confident	98 Å²	98	58.3 Å²	58.3	59%	0.594	30%	0.301	S	S	*	.	S	Bend	trans	-90.5	147	175.2	180	0	0	0	0	109.8	S978	S978-V980 PolarHBondContact O-N 3.48Å; S978-V980 WeakPolarHBondContact OG-CG2 3.32Å; S978-V980 PolarHBondContact OG-N 2.9Å
981	L	64.5	Low	76.8	Confident	36 Å²	36	60.9 Å²	60.9	19%	0.188	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-52	145.5	178	-72.4	173.4	0	0	0	112.9	F780 P782 L796 K983	F780-L981 HydrophobicContact CE1-CB 4.4Å; F780-L981 HydrophobicContact CE1-CD1 4.1Å; F780-L981 HydrophobicContact CE1-CD2 4Å; F780-L981 HydrophobicContact CE1-CG 4.4Å; F780-L981 HydrophobicContact CZ-CD2 4.22Å; P782-L981 HydrophobicContact CB-CD1 4.18Å; P782-L981 HydrophobicContact CB-CD2 3.84Å; L796-L981 HydrophobicContact CB-CD1 4.05Å; L796-L981 HydrophobicContact CD1-CD1 3.79Å; L796-L981 HydrophobicContact CD1-CD2 4.39Å; L796-L981 HydrophobicContact CD1-CG 3.95Å; L796-L981 HydrophobicContact CD2-CD1 3.9Å; L796-L981 HydrophobicContact CG-CD1 4.12Å; L981-K983 PolarHBondContact O-N 2.71Å
982	P	70	Confident	77.2	Confident	8 Å²	8	61.9 Å²	61.9	5%	0.052	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-66.8	130.5	179.6	29.4	-36.4	0	0	0	111.8	L743 F780 V971 L984	L743-P982 HydrophobicContact CD1-CB 4.44Å; L743-P982 HydrophobicContact CD1-CG 3.96Å; L743-P982 HydrophobicContact CD2-CB 3.46Å; L743-P982 VanDerWaalsContact CD2-CB 3.46Å; L743-P982 HydrophobicContact CD2-CG 3.63Å; L743-P982 HydrophobicContact CG-CG 4.46Å; F780-P982 HydrophobicContact CE2-CG 4.4Å; F780-P982 HydrophobicContact CZ-CG 4.02Å; V971-P982 HydrophobicContact CG2-CB 4.11Å; P982-L984 PolarHBondContact O-N 2.96Å; P982-L984 VanDerWaalsContact O-N 3.16Å
983	K	80.2	Confident	77.8	Confident	121 Å²	121	64.7 Å²	64.7	53%	0.526	33%	0.332	S	S	.	.			trans	-84.4	97.6	179.7	-165.9	170.6	-168.6	170.3	0	110.2	D972 T975 L981	D972-K983 HydrophobicContact CB-CB 4.21Å; D972-K983 PolarHBondContact N-O 3.01Å; D972-K983 VanDerWaalsContact N-O 3.08Å; T975-K983 HydrophobicContact CG2-CB 3.81Å; T975-K983 PolarHBondContact OG1-N 3.24Å; L981-K983 PolarHBondContact O-N 2.71Å
984	L	86.7	Confident	78.6	Confident	12 Å²	12	59.8 Å²	59.8	6%	0.063	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	142.8	173	-69.7	166	0	0	0	111.2	F741 L767 F780 L801 I969 F970 V971 P982	F741-L984 HydrophobicContact CE2-CD1 4.3Å; F741-L984 HydrophobicContact CZ-CD1 3.79Å; L767-L984 HydrophobicContact CD1-CD1 4.39Å; F780-L984 HydrophobicContact CB-CD1 4.45Å; F780-L984 HydrophobicContact CD2-CD1 3.65Å; F780-L984 HydrophobicContact CE2-CD1 4.17Å; F780-L984 HydrophobicContact CG-CD1 4.2Å; L801-L984 HydrophobicContact CD1-CB 3.62Å; L801-L984 HydrophobicContact CD1-CD1 4.07Å; L801-L984 HydrophobicContact CD2-CB 4.25Å; I969-L984 HydrophobicContact CG2-CD2 4.11Å; F970-L984 CarbonylContact O-C 3.58Å; F970-L984 WeakPolarHBondContact O-CA 3.28Å; V971-L984 HydrophobicContact CB-CD2 4.04Å; V971-L984 HydrophobicContact CG2-CD2 4.31Å; P982-L984 PolarHBondContact O-N 2.96Å; P982-L984 VanDerWaalsContact O-N 3.16Å
985	Q	88.2	Confident	79.4	Confident	42 Å²	42	62.2 Å²	62.2	20%	0.196	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	134.1	178.3	-66	-173.5	-24.4	0	0	110.4	I969 F970 Y987	I969-Q985 WeakPolarHBondContact CA-O 3.24Å; F970-Q985 PolarHBondContact N-O 3.29Å; F970-Q985 PolarHBondContact O-N 3.49Å; Q985-Y987 HydrophobicContact CB-CD2 4.45Å; Q985-Y987 HydrophobicContact CB-CE2 3.78Å; Q985-Y987 PolarHBondContact OE1-OH 3.25Å
986	L	92	Very high	80.2	Confident	22 Å²	22	61.4 Å²	61.4	12%	0.115	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	123.8	177.7	-74.8	86.9	0	0	0	110.3	V778 L801 L802 L955 Y967 S968 I969	V778-L986 HydrophobicContact CB-CD2 4.07Å; V778-L986 HydrophobicContact CG1-CD1 4.41Å; V778-L986 HydrophobicContact CG1-CD2 4.02Å; V778-L986 HydrophobicContact CG2-CD2 3.82Å; L801-L986 HydrophobicContact CB-CD1 3.8Å; L801-L986 HydrophobicContact CD1-CD1 3.67Å; L801-L986 HydrophobicContact CG-CD1 4.44Å; L802-L986 HydrophobicContact CD2-CB 4.02Å; L802-L986 HydrophobicContact CD2-CD2 4.07Å; L955-L986 HydrophobicContact CD2-CD2 4.41Å; Y967-L986 HydrophobicContact CD1-CB 4.42Å; S968-L986 WeakPolarHBondContact O-CA 3.47Å; I969-L986 HydrophobicContact CG1-CD2 3.99Å; I969-L986 HydrophobicContact CG1-CG 3.85Å
987	Y	92	Very high	81.2	Confident	105 Å²	105	63.2 Å²	63.2	41%	0.412	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.8	176.7	-67.7	-84.5	0	0	0	110.7	L949 Y967 S968 F970 Q985 S989	L949-Y987 HydrophobicContact CD1-CE2 4.26Å; Y967-Y987 CarbonylContact C-O 3.17Å; Y967-Y987 WeakPolarHBondContact CA-O 3.16Å; S968-Y987 PolarHBondContact N-O 3.02Å; S968-Y987 PolarHBondContact O-N 2.95Å; F970-Y987 AromaticContact CD2-CD2 3.63Å; F970-Y987 HydrophobicContact CD2-CD2 3.63Å; F970-Y987 HydrophobicContact CD2-CE2 4.22Å; F970-Y987 AromaticContact CE2-CD2 3.88Å; F970-Y987 HydrophobicContact CE2-CD2 3.88Å; Q985-Y987 HydrophobicContact CB-CD2 4.45Å; Q985-Y987 HydrophobicContact CB-CE2 3.78Å; Q985-Y987 PolarHBondContact OE1-OH 3.25Å; Y987-S989 PolarHBondContact O-N 2.8Å; Y987-S989 PolarHBondContact O-OG 2.95Å; Y987-S989 VanDerWaalsContact O-OG 3.09Å
988	Y	93.1	Very high	82.7	Confident	119 Å²	119	58.4 Å²	58.4	47%	0.467	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	125.8	170.7	172.9	-106.7	0	0	0	109.6	Y967 R990 E991	Y967-Y988 HydrophobicContact CE1-CD2 4.33Å; Y967-Y988 HydrophobicContact CE1-CG 4.46Å; Y967-Y988 AromaticContact CE2-CD2 3.94Å; Y967-Y988 HydrophobicContact CE2-CD2 3.94Å; Y967-Y988 AromaticContact CZ-CD2 3.82Å; Y988-R990 WeakPolarHBondContact CE2-O 3.46Å; Y988-E991 HydrophobicContact CE2-CB 4.25Å; Y988-E991 WeakPolarHBondContact OH-CB 3.39Å; Y988-E991 PolarHBondContact OH-N 2.82Å
989	S	89.9	Confident	84.3	Confident	39 Å²	39	55.6 Å²	55.6	27%	0.273	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-50.7	-171.3	-58.2	0	0	0	0	112.5	L966 S968 Y987	L966-S989 PolarHBondContact O-N 2.82Å; S968-S989 WeakPolarHBondContact CB-OG 3.16Å; S968-S989 PolarHBondContact N-OG 3.1Å; S968-S989 PolarHBondContact OG-OG 3.27Å; Y987-S989 PolarHBondContact O-N 2.8Å; Y987-S989 PolarHBondContact O-OG 2.95Å; Y987-S989 VanDerWaalsContact O-OG 3.09Å
990	R	91.6	Very high	86.3	Confident	94 Å²	94	50.6 Å²	50.6	36%	0.355	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	162.5	179.6	-67.4	-166.5	179.9	-162.2	5.2	111.3	F938 L966 Y988 N1050 L1051	F938-R990 HydrophobicContact CE1-CG 4.36Å; F938-R990 HydrophobicContact CZ-CG 4.28Å; L966-R990 HydrophobicContact CB-CB 4.43Å; L966-R990 PolarHBondContact N-O 2.88Å; L966-R990 PolarHBondContact O-N 3.17Å; Y988-R990 WeakPolarHBondContact CE2-O 3.46Å; R990-N1050 PolarHBondContact NH1-O 3Å; R990-L1051 HydrophobicContact CB-CD1 4.11Å
991	E	91.5	Very high	88	Confident	65 Å²	65	48.5 Å²	48.5	30%	0.304	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136	164.4	175.8	166.6	-146.5	0	0	109.3	T963 V964 K965 Y988 I993	T963-E991 VanDerWaalsContact CB-OE1 3.27Å; T963-E991 WeakPolarHBondContact CB-OE1 3.35Å; T963-E991 PolarHBondContact OG1-OE1 3Å; V964-E991 WeakPolarHBondContact O-CA 3.05Å; K965-E991 VanDerWaalsContact CE-CD 3.49Å; K965-E991 WeakPolarHBondContact CE-OE1 3.45Å; K965-E991 HydrophobicContact CG-CB 4.36Å; K965-E991 HydrophobicContact CG-CG 4.07Å; Y988-E991 HydrophobicContact CE2-CB 4.25Å; Y988-E991 WeakPolarHBondContact OH-CB 3.39Å; Y988-E991 PolarHBondContact OH-N 2.82Å; E991-I993 HydrophobicContact CG-CG1 3.97Å
992	L	93.9	Very high	89.4	Confident	22 Å²	22	48.3 Å²	48.3	12%	0.115	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.9	169.9	165.2	70.4	0	0	0	108	T963 V964 L994 V1037 F1046 L1051	T963-L992 CarbonylContact C-O 3.55Å; T963-L992 WeakPolarHBondContact CA-O 3.17Å; V964-L992 HydrophobicContact CB-CB 4.26Å; V964-L992 HydrophobicContact CB-CD2 4.38Å; V964-L992 HydrophobicContact CG2-CD2 4.43Å; V964-L992 PolarHBondContact N-O 3.1Å; V964-L992 PolarHBondContact O-N 3.11Å; L992-L994 HydrophobicContact CD2-CD2 4.43Å; L992-L994 HydrophobicContact CG-CD2 4.48Å; L992-V1037 HydrophobicContact CD2-CG2 4.08Å; L992-F1046 HydrophobicContact CD1-CD1 4.49Å; L992-F1046 HydrophobicContact CD1-CE1 3.78Å; L992-F1046 HydrophobicContact CD1-CZ 3.89Å; L992-F1046 HydrophobicContact CD2-CD1 4.42Å; L992-F1046 HydrophobicContact CD2-CD2 4.01Å; L992-F1046 HydrophobicContact CD2-CE1 4.05Å; L992-F1046 HydrophobicContact CD2-CE2 3.6Å; L992-F1046 HydrophobicContact CD2-CG 4.4Å; L992-F1046 HydrophobicContact CD2-CZ 3.61Å; L992-F1046 HydrophobicContact CG-CZ 4.35Å; L992-L1051 HydrophobicContact CB-CD1 4.37Å
993	I	92.8	Very high	90.6	Very high	81 Å²	81	48.4 Å²	48.4	42%	0.415	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.9	176.3	-59.1	-177	0	0	0	109	T963 E991	T963-I993 HydrophobicContact CG2-CG1 4.04Å; T963-I993 HydrophobicContact CG2-CG2 4.35Å; E991-I993 HydrophobicContact CG-CG1 3.97Å
994	L	91.2	Very high	91.1	Very high	1 Å²	1	46 Å²	46	1%	0.005	21%	0.211	C	C	.	.			trans	-78.5	122.5	173.5	-57.7	-179.7	0	0	0	109.6	G962 L992 H996 R997 V1000 V1037 F1046	G962-L994 WeakPolarHBondContact O-CB 3.42Å; G962-L994 WeakPolarHBondContact O-CG 3.25Å; G962-L994 PolarHBondContact O-N 3.05Å; L992-L994 HydrophobicContact CD2-CD2 4.43Å; L992-L994 HydrophobicContact CG-CD2 4.48Å; L994-H996 VanDerWaalsContact C-N 3.29Å; L994-H996 PolarHBondContact O-N 2.91Å; L994-R997 WeakPolarHBondContact O-CD 3.32Å; L994-R997 PolarHBondContact O-N 3.46Å; L994-V1000 HydrophobicContact CD1-CG2 4.12Å; L994-V1037 HydrophobicContact CD1-CG1 4.02Å; L994-V1037 HydrophobicContact CD2-CG1 4.46Å; L994-F1046 HydrophobicContact CD2-CZ 4.27Å
995	Q	88.6	Confident	91.4	Very high	139 Å²	139	45.8 Å²	45.8	65%	0.65	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-45.6	-177.5	-71.4	165.8	-45.3	0	0	113.2	R997	Q995-R997 PolarHBondContact O-N 3.46Å
996	H	86	Confident	91.5	Very high	6 Å²	6	43.9 Å²	43.9	3%	0.028	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.8	-178.9	59.8	94.4	0	0	0	114.3	L994 A998 S1039 E1041 Q1042	L994-H996 VanDerWaalsContact C-N 3.29Å; L994-H996 PolarHBondContact O-N 2.91Å; H996-A998 WeakPolarHBondContact ND1-CB 2.85Å; H996-A998 PolarHBondContact ND1-N 2.84Å; H996-A998 PolarHBondContact O-N 3.04Å; H996-S1039 PolarHBondContact CE1-OG 3.02Å; H996-S1039 VanDerWaalsContact CE1-OG 3.27Å; H996-E1041 IonicContact CG-OE2 3.92Å; H996-E1041 IonicContact ND1-OE2 3.22Å; H996-E1041 PolarHBondContact ND1-OE2 2.89Å; H996-Q1042 PolarHBondContact CD2-NE2 3.34Å; H996-Q1042 PolarHBondContact CD2-OE1 2.86Å
997	R	87.3	Confident	91.2	Very high	49 Å²	49	44.7 Å²	44.7	19%	0.185	21%	0.205	C	C	.	.			trans	52	26.1	176.3	-58.6	-66.6	-171.4	151.2	4.4	115.2	R918 A961 L994 Q995	R918-R997 HydrophobicContact CB-CB 4.15Å; R918-R997 HydrophobicContact CG-CB 4.48Å; R918-R997 PolarHBondContact NH1-O 2.87Å; A961-R997 WeakPolarHBondContact O-CD 3.3Å; L994-R997 WeakPolarHBondContact O-CD 3.32Å; L994-R997 PolarHBondContact O-N 3.46Å; Q995-R997 PolarHBondContact O-N 3.46Å
998	A	88.8	Confident	91	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-76	146.9	175.9	0	0	0	0	0	111	G962 H996 V1000 E1040 E1041	G962-A998 WeakPolarHBondContact CA-O 3.29Å; G962-A998 PolarHBondContact N-O 3.18Å; H996-A998 WeakPolarHBondContact ND1-CB 2.85Å; H996-A998 PolarHBondContact ND1-N 2.84Å; H996-A998 PolarHBondContact O-N 3.04Å; A998-V1000 PolarHBondContact O-N 3.47Å; A998-E1040 HydrophobicContact CB-CB 4.44Å; A998-E1041 HydrophobicContact CB-CB 3.83Å; A998-E1041 VanDerWaalsContact CB-CD 3.49Å; A998-E1041 HydrophobicContact CB-CG 3.68Å
999	P	91.1	Very high	90.5	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.013	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-56	131.1	-179.2	-27.8	37.4	0	0	0	112.3	K960 L1001 S1039 E1040	K960-P999 HydrophobicContact CB-CB 4.03Å; K960-P999 HydrophobicContact CB-CG 4.37Å; K960-P999 HydrophobicContact CG-CB 4.31Å; K960-P999 WeakPolarHBondContact O-CG 3.14Å; P999-L1001 PolarHBondContact O-N 3.03Å; P999-S1039 CarbonylContact O-C 3.49Å; P999-S1039 WeakPolarHBondContact O-CA 3.3Å; P999-S1039 VanDerWaalsContact O-CB 3.27Å; P999-S1039 WeakPolarHBondContact O-CB 3.24Å; P999-E1040 HydrophobicContact CB-CG 4.11Å; P999-E1040 HydrophobicContact CG-CG 4.12Å; P999-E1040 VanDerWaalsContact CG-OE1 3.32Å; P999-E1040 WeakPolarHBondContact CG-OE1 3.21Å; P999-E1040 PolarHBondContact O-N 2.84Å
1000	V	95.1	Very high	90.2	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	125.6	169.7	-173.5	0	0	0	0	107.9	S929 T959 V964 L994 A998 L1003 V1037 V1038	S929-V1000 VanDerWaalsContact CB-O 3.26Å; S929-V1000 WeakPolarHBondContact CB-O 3.35Å; S929-V1000 PolarHBondContact OG-O 2.78Å; T959-V1000 WeakPolarHBondContact O-CG2 3.33Å; T959-V1000 PolarHBondContact O-N 3.3Å; V964-V1000 HydrophobicContact CG2-CG1 4.47Å; V964-V1000 HydrophobicContact CG2-CG2 4.02Å; L994-V1000 HydrophobicContact CD1-CG2 4.12Å; A998-V1000 PolarHBondContact O-N 3.47Å; V1000-L1003 HydrophobicContact CG1-CD2 3.99Å; V1000-L1003 HydrophobicContact CG1-CG 4.11Å; V1000-V1037 HydrophobicContact CG1-CG1 4.05Å; V1000-V1037 HydrophobicContact CG2-CG1 4.33Å; V1000-V1038 CarbonylContact C-O 3.5Å; V1000-V1038 WeakPolarHBondContact CA-O 3.44Å; V1000-V1038 WeakPolarHBondContact CG1-O 3.47Å
1001	L	93.7	Very high	90	Very high	55 Å²	55	40.9 Å²	40.9	29%	0.288	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-38.7	-178.8	-63	175.9	0	0	0	111.8	P999 V1038 E1040 I1067	P999-L1001 PolarHBondContact O-N 3.03Å; L1001-V1038 HydrophobicContact CB-CG1 4.39Å; L1001-V1038 PolarHBondContact N-O 2.8Å; L1001-E1040 HydrophobicContact CD1-CG 4.27Å; L1001-E1040 HydrophobicContact CD2-CG 4Å; L1001-E1040 HydrophobicContact CG-CG 4.3Å; L1001-I1067 HydrophobicContact CD1-CB 4.11Å; L1001-I1067 HydrophobicContact CD1-CG2 3.97Å; L1001-I1067 WeakPolarHBondContact CD1-O 3.45Å
1002	S	93.8	Very high	89.7	Confident	31 Å²	31	39.5 Å²	39.5	22%	0.217	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	143.5	-176.1	-178.2	0	0	0	0	111	V1038	S1002-V1038 PolarHBondContact N-O 2.83Å; S1002-V1038 PolarHBondContact O-N 2.95Å
1003	L	95.3	Very high	89.2	Confident	11 Å²	11	39.9 Å²	39.9	6%	0.058	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.6	170.1	-66.7	172.3	0	0	0	107.4	A932 F956 V964 V1000 L1035 S1036 V1037	A932-L1003 HydrophobicContact CB-CB 3.85Å; F956-L1003 HydrophobicContact CB-CD1 3.99Å; V964-L1003 HydrophobicContact CG1-CD1 3.94Å; V964-L1003 HydrophobicContact CG1-CD2 4.01Å; V964-L1003 HydrophobicContact CG2-CD2 3.88Å; V1000-L1003 HydrophobicContact CG1-CD2 3.99Å; V1000-L1003 HydrophobicContact CG1-CG 4.11Å; L1003-L1035 HydrophobicContact CD2-CD1 4.4Å; L1003-S1036 WeakPolarHBondContact CA-O 3.34Å; L1003-V1037 HydrophobicContact CD2-CB 4.26Å; L1003-V1037 HydrophobicContact CD2-CG1 4.11Å; L1003-V1037 HydrophobicContact CD2-CG2 3.84Å
1004	R	91.5	Very high	88.7	Confident	71 Å²	71	38 Å²	38	27%	0.268	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	138.7	176.5	-174	169.8	-77.6	-179.5	0.3	109.9	S1036 S1071	R1004-S1036 PolarHBondContact N-O 3.26Å; R1004-S1036 WeakPolarHBondContact O-CA 3.37Å; R1004-S1036 VanDerWaalsContact O-CB 3.29Å; R1004-S1036 WeakPolarHBondContact O-CB 3.35Å; R1004-S1036 PolarHBondContact O-N 2.82Å; R1004-S1071 PolarHBondContact NH1-OG 3.38Å; R1004-S1071 VanDerWaalsContact NH1-OG 3.1Å
1005	L	92	Very high	87.9	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	142	170.6	-65.2	-178.6	0	0	0	109.9	F933 F956 Y1014 P1033 L1035 L1048	F933-L1005 WeakPolarHBondContact O-CD1 3.45Å; F956-L1005 HydrophobicContact CE2-CD1 4.41Å; F956-L1005 HydrophobicContact CE2-CD2 4.41Å; F956-L1005 HydrophobicContact CZ-CD2 4.32Å; L1005-Y1014 HydrophobicContact CB-CD1 4.13Å; L1005-Y1014 HydrophobicContact CB-CG 4.3Å; L1005-Y1014 HydrophobicContact CD1-CD1 4.12Å; L1005-Y1014 PolarHBondContact O-N 2.86Å; L1005-P1033 HydrophobicContact CB-CB 4.3Å; L1005-P1033 HydrophobicContact CD1-CG 4.35Å; L1005-L1035 HydrophobicContact CD2-CB 4.15Å; L1005-L1035 HydrophobicContact CD2-CD1 3.84Å; L1005-L1048 HydrophobicContact CD2-CD1 3.64Å
1006	I	90.3	Very high	86.9	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.015	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.5	-178.3	-62.1	154.4	0	0	0	107.8	A1008 N1011 M1012 P1033 V1034 L1045 V1072 M1134	I1006-A1008 PolarHBondContact O-N 3.03Å; I1006-N1011 HydrophobicContact CG2-CB 4.35Å; I1006-N1011 WeakPolarHBondContact CG2-O 3.4Å; I1006-M1012 CarbonylContact C-O 3.53Å; I1006-M1012 VanDerWaalsContact CA-O 3.31Å; I1006-M1012 WeakPolarHBondContact CA-O 3.38Å; I1006-P1033 CarbonylContact O-C 3.48Å; I1006-P1033 VanDerWaalsContact O-CA 3.28Å; I1006-P1033 WeakPolarHBondContact O-CA 3.45Å; I1006-P1033 VanDerWaalsContact O-CB 3.31Å; I1006-P1033 WeakPolarHBondContact O-CB 3.31Å; I1006-V1034 PolarHBondContact N-O 2.93Å; I1006-V1034 PolarHBondContact O-N 3.29Å; I1006-L1045 HydrophobicContact CD1-CD2 3.69Å; I1006-V1072 HydrophobicContact CD1-CG2 4.41Å; I1006-V1072 HydrophobicContact CG1-CG2 4.42Å; I1006-M1134 HydrophobicContact CD1-CE 3.56Å; I1006-M1134 HydrophobicContact CG1-CE 4.21Å; I1006-M1134 HydrophobicContact CG2-CE 4.11Å
1007	D	86.7	Confident	85.8	Confident	38 Å²	38	35.8 Å²	35.8	20%	0.203	19%	0.185	C	C	.	.			trans	-62.5	131.8	172.2	170	-113.8	0	0	0	110.9	K1009 S1010 N1011 M1012	D1007-K1009 PolarHBondContact O-N 3.18Å; D1007-K1009 PolarHBondContact OD1-N 3.24Å; D1007-S1010 WeakPolarHBondContact CB-OG 3.18Å; D1007-S1010 VanDerWaalsContact OD1-CB 3.32Å; D1007-S1010 WeakPolarHBondContact OD1-CB 3.38Å; D1007-S1010 PolarHBondContact OD1-N 2.72Å; D1007-S1010 PolarHBondContact OD1-OG 2.84Å; D1007-N1011 VanDerWaalsContact O-CA 3.31Å; D1007-N1011 WeakPolarHBondContact O-CA 3.48Å; D1007-N1011 PolarHBondContact O-N 3.38Å; D1007-M1012 PolarHBondContact N-O 2.78Å
1008	A	85.8	Confident	84.2	Confident	29 Å²	29	35.8 Å²	35.8	24%	0.24	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.4	-171.1	0	0	0	0	0	114.2	I1006 L1032 V1034	I1006-A1008 PolarHBondContact O-N 3.03Å; A1008-L1032 WeakPolarHBondContact CB-O 3.48Å; A1008-V1034 HydrophobicContact CB-CG2 3.99Å
1009	K	84.3	Confident	82.5	Confident	173 Å²	173	38.8 Å²	38.8	75%	0.752	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-47.4	-176.4	-178.9	178.8	176.1	-175.8	0	112.5	D1007	D1007-K1009 PolarHBondContact O-N 3.18Å; D1007-K1009 PolarHBondContact OD1-N 3.24Å
1010	S	83.7	Confident	80.6	Confident	43 Å²	43	44 Å²	44	30%	0.301	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-18.6	-177.1	62.3	0	0	0	0	113.8	D1007 M1012 Y1118	D1007-S1010 WeakPolarHBondContact CB-OG 3.18Å; D1007-S1010 VanDerWaalsContact OD1-CB 3.32Å; D1007-S1010 WeakPolarHBondContact OD1-CB 3.38Å; D1007-S1010 PolarHBondContact OD1-N 2.72Å; D1007-S1010 PolarHBondContact OD1-OG 2.84Å; S1010-M1012 PolarHBondContact O-N 2.98Å; S1010-M1012 WeakPolarHBondContact OG-CB 3.39Å; S1010-M1012 WeakPolarHBondContact OG-CG 3.37Å; S1010-M1012 PolarHBondContact OG-N 3.49Å; S1010-Y1118 WeakPolarHBondContact O-CD2 3.28Å
1011	N	87.4	Confident	78.3	Confident	33 Å²	33	49.9 Å²	49.9	18%	0.176	25%	0.251	C	S	.	.			trans	61.6	15.7	-167.8	-50.2	-77.1	0	0	0	114.5	I1006 D1007 M1134	I1006-N1011 HydrophobicContact CG2-CB 4.35Å; I1006-N1011 WeakPolarHBondContact CG2-O 3.4Å; D1007-N1011 VanDerWaalsContact O-CA 3.31Å; D1007-N1011 WeakPolarHBondContact O-CA 3.48Å; D1007-N1011 PolarHBondContact O-N 3.38Å; N1011-M1134 HydrophobicContact CB-CB 3.82Å
1012	M	83.8	Confident	75.9	Confident	35 Å²	35	53.6 Å²	53.6	17%	0.172	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-72.7	149.9	175.5	-68.6	172	67.3	0	0	111.5	I1006 D1007 S1010 Y1014 Y1118 H1174	I1006-M1012 CarbonylContact C-O 3.53Å; I1006-M1012 VanDerWaalsContact CA-O 3.31Å; I1006-M1012 WeakPolarHBondContact CA-O 3.38Å; D1007-M1012 PolarHBondContact N-O 2.78Å; S1010-M1012 PolarHBondContact O-N 2.98Å; S1010-M1012 WeakPolarHBondContact OG-CB 3.39Å; S1010-M1012 WeakPolarHBondContact OG-CG 3.37Å; S1010-M1012 PolarHBondContact OG-N 3.49Å; M1012-Y1014 PolarHBondContact O-N 2.91Å; M1012-Y1118 HydrophobicContact CB-CE2 4.48Å; M1012-Y1118 HydrophobicContact CG-CD2 3.88Å; M1012-Y1118 HydrophobicContact CG-CE1 4.15Å; M1012-Y1118 HydrophobicContact CG-CE2 3.27Å; M1012-Y1118 VanDerWaalsContact CG-CZ 3.44Å; M1012-Y1118 HydrophobicContact SD-CE2 4.14Å; M1012-H1174 HydrophobicContact CE-CB 3.9Å; M1012-H1174 VanDerWaalsContact CE-CD2 3.43Å; M1012-H1174 WeakPolarHBondContact CE-CD2 3.41Å; M1012-H1174 VanDerWaalsContact CE-CE1 3.41Å; M1012-H1174 WeakPolarHBondContact CE-CE1 3.4Å; M1012-H1174 VanDerWaalsContact CE-ND1 3.31Å; M1012-H1174 WeakPolarHBondContact CE-ND1 3.39Å; M1012-H1174 WeakPolarHBondContact CE-NE2 2.83Å
1013	P	83.9	Confident	73.6	Confident	30 Å²	30	55.3 Å²	55.3	20%	0.195	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-52.8	126.7	162.2	-23.6	34.4	0	0	0	110.5	V1072	P1013-V1072 HydrophobicContact CG-CB 4.18Å; P1013-V1072 HydrophobicContact CG-CG1 4.21Å
1014	Y	82.7	Confident	71.1	Confident	43 Å²	43	59.2 Å²	59.2	17%	0.169	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-84	127.8	-177.9	-178.6	-94.1	0	0	0	110.8	P935 L1005 M1012 Y1019 P1033	P935-Y1014 HydrophobicContact CG-CE1 4.4Å; L1005-Y1014 HydrophobicContact CB-CD1 4.13Å; L1005-Y1014 HydrophobicContact CB-CG 4.3Å; L1005-Y1014 HydrophobicContact CD1-CD1 4.12Å; L1005-Y1014 PolarHBondContact O-N 2.86Å; M1012-Y1014 PolarHBondContact O-N 2.91Å; Y1014-Y1019 WeakPolarHBondContact OH-CB 3.34Å; Y1014-P1033 HydrophobicContact CD1-CB 4.48Å; Y1014-P1033 HydrophobicContact CD1-CG 4.3Å; Y1014-P1033 HydrophobicContact CD2-CB 4.04Å; Y1014-P1033 HydrophobicContact CD2-CG 4.31Å; Y1014-P1033 HydrophobicContact CE1-CG 4.31Å; Y1014-P1033 HydrophobicContact CE2-CB 4.49Å; Y1014-P1033 HydrophobicContact CE2-CG 4.33Å; Y1014-P1033 HydrophobicContact CG-CB 4.04Å; Y1014-P1033 HydrophobicContact CG-CG 4.3Å
1015	S	73.9	Confident	68.6	Low	24 Å²	24	61 Å²	61	17%	0.168	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-93.4	142.8	173	-172.6	0	0	0	0	110.9	S1017 D1018	S1015-S1017 PolarHBondContact O-N 3.1Å; S1015-S1017 WeakPolarHBondContact OG-CB 3.31Å; S1015-S1017 PolarHBondContact OG-N 2.97Å; S1015-S1017 PolarHBondContact OG-OG 3.34Å; S1015-D1018 VanDerWaalsContact CB-OD2 3.32Å; S1015-D1018 WeakPolarHBondContact CB-OD2 3.14Å; S1015-D1018 PolarHBondContact N-OD2 2.83Å; S1015-D1018 WeakPolarHBondContact O-CB 3.46Å; S1015-D1018 PolarHBondContact O-N 2.99Å
1016	L	67.8	Low	65.9	Low	49 Å²	49	66.4 Å²	66.4	26%	0.257	35%	0.349	S	S	.	.	H	α-helix	trans	-66.9	-25.8	171.9	-162.1	72	0	0	0	111.3	F933 G934 D1018 Y1019	F933-L1016 HydrophobicContact CB-CD2 4.22Å; G934-L1016 VanDerWaalsContact C-CD1 3.42Å; G934-L1016 WeakPolarHBondContact O-CD1 3.44Å; L1016-D1018 VanDerWaalsContact C-N 3.27Å; L1016-D1018 PolarHBondContact O-N 3.15Å; L1016-Y1019 WeakPolarHBondContact O-CB 3.25Å; L1016-Y1019 PolarHBondContact O-N 3.22Å
1017	S	62.2	Low	63.6	Low	26 Å²	26	69.8 Å²	69.8	18%	0.182	39%	0.385	C	S	.	.	H	α-helix	trans	-59.5	-36.8	172.6	-54.5	0	0	0	0	112.2	S1015 Y1019 K1020 T1165	S1015-S1017 PolarHBondContact O-N 3.1Å; S1015-S1017 WeakPolarHBondContact OG-CB 3.31Å; S1015-S1017 PolarHBondContact OG-N 2.97Å; S1015-S1017 PolarHBondContact OG-OG 3.34Å; S1017-Y1019 PolarHBondContact O-N 3.38Å; S1017-K1020 VanDerWaalsContact O-CB 3.29Å; S1017-K1020 WeakPolarHBondContact O-CB 3.38Å; S1017-K1020 PolarHBondContact O-N 3.06Å; S1017-T1165 WeakPolarHBondContact OG-CB 3.43Å; S1017-T1165 PolarHBondContact OG-O 2.84Å
1018	D	54.3	Low	61.6	Low	48 Å²	48	75.6 Å²	75.6	26%	0.257	41%	0.408	S	S	.	.	H	α-helix	trans	-60	-35.5	179.4	-53.8	-30	0	0	0	110.7	S1015 L1016 K1020 H1021 Y1022	S1015-D1018 VanDerWaalsContact CB-OD2 3.32Å; S1015-D1018 WeakPolarHBondContact CB-OD2 3.14Å; S1015-D1018 PolarHBondContact N-OD2 2.83Å; S1015-D1018 WeakPolarHBondContact O-CB 3.46Å; S1015-D1018 PolarHBondContact O-N 2.99Å; L1016-D1018 VanDerWaalsContact C-N 3.27Å; L1016-D1018 PolarHBondContact O-N 3.15Å; D1018-K1020 PolarHBondContact O-N 3.04Å; D1018-H1021 PolarHBondContact O-N 2.9Å; D1018-Y1022 WeakPolarHBondContact O-CD2 3.33Å
1019	Y	52.3	Low	59.7	Low	63 Å²	63	80.2 Å²	80.2	25%	0.247	44%	0.439	C	S	.	.	H	α-helix	trans	-63.2	-28.5	177.7	-165.7	-108.5	0	0	0	113.2	P935 P936 Y1014 L1016 S1017 H1021 Y1022 I1023	P935-Y1019 HydrophobicContact CB-CD2 3.79Å; P935-Y1019 HydrophobicContact CB-CE2 3.94Å; P935-Y1019 HydrophobicContact CB-CG 4.17Å; P936-Y1019 VanDerWaalsContact CD-CZ 3.5Å; P936-Y1019 HydrophobicContact CG-CE1 3.53Å; P936-Y1019 WeakPolarHBondContact CG-OH 3.39Å; Y1014-Y1019 WeakPolarHBondContact OH-CB 3.34Å; L1016-Y1019 WeakPolarHBondContact O-CB 3.25Å; L1016-Y1019 PolarHBondContact O-N 3.22Å; S1017-Y1019 PolarHBondContact O-N 3.38Å; Y1019-H1021 PolarHBondContact O-N 2.85Å; Y1019-Y1022 PolarHBondContact O-N 3.29Å; Y1019-I1023 HydrophobicContact CD1-CD1 3.93Å; Y1019-I1023 HydrophobicContact CD1-CG1 3.99Å; Y1019-I1023 HydrophobicContact CE1-CD1 3.53Å; Y1019-I1023 HydrophobicContact CE1-CG1 3.55Å
1020	K	52.7	Low	58.5	Low	111 Å²	111	76.4 Å²	76.4	48%	0.483	42%	0.423	S	S	.	.	H	α-helix	trans	-60	-35.8	-179	-61.1	179.9	179.6	177.1	0	111.7	S1017 D1018 Y1022	S1017-K1020 VanDerWaalsContact O-CB 3.29Å; S1017-K1020 WeakPolarHBondContact O-CB 3.38Å; S1017-K1020 PolarHBondContact O-N 3.06Å; D1018-K1020 PolarHBondContact O-N 3.04Å; K1020-Y1022 VanDerWaalsContact C-N 3.35Å
1021	H	46	Very low	57.9	Low	126 Å²	126	80 Å²	80	58%	0.583	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-12	175.6	-68.9	-63.1	0	0	0	114.5	D1018 Y1019 S1024	D1018-H1021 PolarHBondContact O-N 2.9Å; Y1019-H1021 PolarHBondContact O-N 2.85Å; H1021-S1024 PolarHBondContact O-OG 3.17Å
1022	Y	43.1	Very low	57.8	Low	132 Å²	132	81.9 Å²	81.9	52%	0.518	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-19.4	-176.6	-92.2	-85.6	0	0	0	114.3	D1018 Y1019 K1020 S1024 H1030	D1018-Y1022 WeakPolarHBondContact O-CD2 3.33Å; Y1019-Y1022 PolarHBondContact O-N 3.29Å; K1020-Y1022 VanDerWaalsContact C-N 3.35Å; Y1022-S1024 VanDerWaalsContact C-N 3.31Å; Y1022-H1030 AromaticContact CD1-CE1 3.81Å; Y1022-H1030 AromaticContact CD1-ND1 3.49Å; Y1022-H1030 WeakPolarHBondContact CD1-ND1 3.41Å; Y1022-H1030 AromaticContact CE1-ND1 3.74Å
1023	I	44.9	Very low	58.1	Low	68 Å²	68	80.4 Å²	80.4	35%	0.349	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-27.6	-179.6	-46.2	-177.7	0	0	0	111.3	F749 Y1019 D1025	F749-I1023 HydrophobicContact CE1-CG2 4.46Å; F749-I1023 HydrophobicContact CE2-CG2 4.01Å; F749-I1023 HydrophobicContact CZ-CG2 3.63Å; Y1019-I1023 HydrophobicContact CD1-CD1 3.93Å; Y1019-I1023 HydrophobicContact CD1-CG1 3.99Å; Y1019-I1023 HydrophobicContact CE1-CD1 3.53Å; Y1019-I1023 HydrophobicContact CE1-CG1 3.55Å; I1023-D1025 VanDerWaalsContact C-N 3.32Å; I1023-D1025 PolarHBondContact O-N 2.81Å
1024	S	43.5	Very low	58.6	Low	93 Å²	93	79.2 Å²	79.2	65%	0.65	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-17.4	-179.8	36.2	0	0	0	0	115.1	H1021 Y1022	H1021-S1024 PolarHBondContact O-OG 3.17Å; Y1022-S1024 VanDerWaalsContact C-N 3.31Å
1025	D	38.6	Very low	59.2	Low	108 Å²	108	77.1 Å²	77.1	58%	0.578	43%	0.426	S	S	*	.			trans	-112.5	67.3	-170.1	-149.1	30.2	0	0	0	111.8	I1023 G1027	I1023-D1025 VanDerWaalsContact C-N 3.32Å; I1023-D1025 PolarHBondContact O-N 2.81Å; D1025-G1027 PolarHBondContact O-N 2.87Å
1026	S	36.8	Very low	60.2	Low	120 Å²	120	76.1 Å²	76.1	84%	0.839	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	89.9	-173.7	63	0	0	0	0	113
1027	G	42	Very low	61.6	Low	74 Å²	74	73.8 Å²	73.8	76%	0.763	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-179.3	-12	172	0	0	0	0	0	120	D1025	D1025-G1027 PolarHBondContact O-N 2.87Å
1028	K	42.9	Very low	63.3	Low	160 Å²	160	72.7 Å²	72.7	70%	0.696	40%	0.399	S	S	*	.	S	Bend	trans	-115.3	146.3	-174.9	-71.3	171.9	-176.7	159.7	0	112.4	H1030	K1028-H1030 PolarHBondContact O-CD2 3.08Å; K1028-H1030 PolarHBondContact O-N 3.2Å; K1028-H1030 PolarHBondContact O-NE2 3.05Å; K1028-H1030 VanDerWaalsContact O-NE2 3.17Å
1029	S	47.3	Very low	65.3	Low	126 Å²	126	70.4 Å²	70.4	88%	0.881	39%	0.387	S	S	*	.			trans	-68.6	102.6	174.5	41.4	0	0	0	0	110.5
1030	H	58.7	Low	67.3	Low	92 Å²	92	68.8 Å²	68.8	43%	0.426	38%	0.381	S	S	.	.			trans	-76.4	136.3	-173	-54.7	-77.3	0	0	0	112.9	Y1022 K1028 L1032	Y1022-H1030 AromaticContact CD1-CE1 3.81Å; Y1022-H1030 AromaticContact CD1-ND1 3.49Å; Y1022-H1030 WeakPolarHBondContact CD1-ND1 3.41Å; Y1022-H1030 AromaticContact CE1-ND1 3.74Å; K1028-H1030 PolarHBondContact O-CD2 3.08Å; K1028-H1030 PolarHBondContact O-N 3.2Å; K1028-H1030 PolarHBondContact O-NE2 3.05Å; K1028-H1030 VanDerWaalsContact O-NE2 3.17Å; H1030-L1032 PolarHBondContact O-N 3.49Å; H1030-L1032 VanDerWaalsContact O-N 3.15Å
1031	N	71.6	Confident	69.2	Low	120 Å²	120	63.8 Å²	63.8	64%	0.642	36%	0.36	S	S	*	.			trans	-69.6	105.1	167.1	-87.2	-21.6	0	0	0	109.4
1032	L	84.8	Confident	71.5	Confident	71 Å²	71	58.4 Å²	58.4	37%	0.372	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-66.8	147.4	173.8	-71	171.2	0	0	0	111.2	L937 A1008 H1030 L1048	L937-L1032 HydrophobicContact CD2-CD1 4.31Å; L937-L1032 HydrophobicContact CD2-CD2 4.02Å; A1008-L1032 WeakPolarHBondContact CB-O 3.48Å; H1030-L1032 PolarHBondContact O-N 3.49Å; H1030-L1032 VanDerWaalsContact O-N 3.15Å; L1032-L1048 WeakPolarHBondContact CD1-O 3.47Å
1033	P	90.4	Very high	74.1	Confident	4 Å²	4	52.1 Å²	52.1	3%	0.026	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-64.3	161.7	174.7	27.2	-34	0	0	0	111.8	P935 L1005 I1006 Y1014 L1048	P935-P1033 HydrophobicContact CG-CG 3.96Å; L1005-P1033 HydrophobicContact CB-CB 4.3Å; L1005-P1033 HydrophobicContact CD1-CG 4.35Å; I1006-P1033 CarbonylContact O-C 3.48Å; I1006-P1033 VanDerWaalsContact O-CA 3.28Å; I1006-P1033 WeakPolarHBondContact O-CA 3.45Å; I1006-P1033 VanDerWaalsContact O-CB 3.31Å; I1006-P1033 WeakPolarHBondContact O-CB 3.31Å; Y1014-P1033 HydrophobicContact CD1-CB 4.48Å; Y1014-P1033 HydrophobicContact CD1-CG 4.3Å; Y1014-P1033 HydrophobicContact CD2-CB 4.04Å; Y1014-P1033 HydrophobicContact CD2-CG 4.31Å; Y1014-P1033 HydrophobicContact CE1-CG 4.31Å; Y1014-P1033 HydrophobicContact CE2-CB 4.49Å; Y1014-P1033 HydrophobicContact CE2-CG 4.33Å; Y1014-P1033 HydrophobicContact CG-CB 4.04Å; Y1014-P1033 HydrophobicContact CG-CG 4.3Å; P1033-L1048 HydrophobicContact CG-CD1 4.39Å; P1033-L1048 WeakPolarHBondContact O-CD1 3.33Å
1034	V	93.7	Very high	76.6	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.03	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.9	175.2	-178	0	0	0	0	108.6	I1006 A1008 L1045 F1046 K1054	I1006-V1034 PolarHBondContact N-O 2.93Å; I1006-V1034 PolarHBondContact O-N 3.29Å; A1008-V1034 HydrophobicContact CB-CG2 3.99Å; V1034-L1045 HydrophobicContact CG1-CB 3.71Å; V1034-L1045 HydrophobicContact CG1-CD1 4.42Å; V1034-L1045 HydrophobicContact CG1-CD2 4.27Å; V1034-L1045 HydrophobicContact CG1-CG 4.34Å; V1034-F1046 WeakPolarHBondContact CA-O 3.21Å; V1034-F1046 WeakPolarHBondContact CG1-O 3.27Å; V1034-K1054 HydrophobicContact CG1-CD 4.33Å; V1034-K1054 HydrophobicContact CG2-CD 4.17Å
1035	L	95.7	Very high	79.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	117.3	173.4	177.4	69.4	0	0	0	110.1	F956 L1003 L1005 V1037 L1045 F1046 L1048 L1051	F956-L1035 HydrophobicContact CD1-CD1 3.86Å; F956-L1035 HydrophobicContact CD1-CD2 3.79Å; F956-L1035 HydrophobicContact CD1-CG 4.45Å; F956-L1035 HydrophobicContact CE1-CD1 4.03Å; F956-L1035 HydrophobicContact CE1-CD2 3.83Å; F956-L1035 HydrophobicContact CE1-CG 4.41Å; F956-L1035 HydrophobicContact CG-CD1 4.32Å; L1003-L1035 HydrophobicContact CD2-CD1 4.4Å; L1005-L1035 HydrophobicContact CD2-CB 4.15Å; L1005-L1035 HydrophobicContact CD2-CD1 3.84Å; L1035-V1037 HydrophobicContact CD2-CG2 3.88Å; L1035-V1037 HydrophobicContact CG-CG2 3.94Å; L1035-L1045 CarbonylContact O-C 3.57Å; L1035-L1045 WeakPolarHBondContact O-CA 3.46Å; L1035-F1046 HydrophobicContact CB-CB 4.4Å; L1035-F1046 PolarHBondContact N-O 3.13Å; L1035-F1046 PolarHBondContact O-N 3.17Å; L1035-L1048 HydrophobicContact CB-CD1 4.23Å; L1035-L1048 HydrophobicContact CB-CD2 4.07Å; L1035-L1048 HydrophobicContact CB-CG 4.25Å; L1035-L1051 HydrophobicContact CD2-CD2 3.94Å
1036	S	95.7	Very high	81.8	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.014	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129.4	163.4	-169.2	0	0	0	0	110.6	L1003 R1004	L1003-S1036 WeakPolarHBondContact CA-O 3.34Å; R1004-S1036 PolarHBondContact N-O 3.26Å; R1004-S1036 WeakPolarHBondContact O-CA 3.37Å; R1004-S1036 VanDerWaalsContact O-CB 3.29Å; R1004-S1036 WeakPolarHBondContact O-CB 3.35Å; R1004-S1036 PolarHBondContact O-N 2.82Å
1037	V	97.3	Very high	84.5	Confident	1 Å²	1	38 Å²	38	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	110	170.6	-174.6	0	0	0	0	107.8	V964 L992 L994 V1000 L1003 L1035 R1044 F1046	V964-V1037 HydrophobicContact CG2-CG1 3.93Å; V964-V1037 HydrophobicContact CG2-CG2 4.32Å; L992-V1037 HydrophobicContact CD2-CG2 4.08Å; L994-V1037 HydrophobicContact CD1-CG1 4.02Å; L994-V1037 HydrophobicContact CD2-CG1 4.46Å; V1000-V1037 HydrophobicContact CG1-CG1 4.05Å; V1000-V1037 HydrophobicContact CG2-CG1 4.33Å; L1003-V1037 HydrophobicContact CD2-CB 4.26Å; L1003-V1037 HydrophobicContact CD2-CG1 4.11Å; L1003-V1037 HydrophobicContact CD2-CG2 3.84Å; L1035-V1037 HydrophobicContact CD2-CG2 3.88Å; L1035-V1037 HydrophobicContact CG-CG2 3.94Å; V1037-R1044 PolarHBondContact N-O 2.84Å; V1037-R1044 PolarHBondContact O-N 2.81Å; V1037-F1046 HydrophobicContact CB-CD2 4.41Å; V1037-F1046 HydrophobicContact CB-CE2 4Å; V1037-F1046 HydrophobicContact CG2-CD2 3.74Å; V1037-F1046 HydrophobicContact CG2-CE2 3.68Å
1038	V	97	Very high	86.9	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130.9	173.9	-170.6	0	0	0	0	108.2	V1000 L1001 S1002 I1043 I1067 A1070 F1120	V1000-V1038 CarbonylContact C-O 3.5Å; V1000-V1038 WeakPolarHBondContact CA-O 3.44Å; V1000-V1038 WeakPolarHBondContact CG1-O 3.47Å; L1001-V1038 HydrophobicContact CB-CG1 4.39Å; L1001-V1038 PolarHBondContact N-O 2.8Å; S1002-V1038 PolarHBondContact N-O 2.83Å; S1002-V1038 PolarHBondContact O-N 2.95Å; V1038-I1043 HydrophobicContact CG1-CG1 4.2Å; V1038-I1067 HydrophobicContact CG1-CD1 4.47Å; V1038-I1067 HydrophobicContact CG1-CG2 4.1Å; V1038-A1070 HydrophobicContact CG1-CB 3.88Å; V1038-A1070 HydrophobicContact CG2-CB 4.25Å; V1038-F1120 HydrophobicContact CG2-CE1 4.36Å; V1038-F1120 HydrophobicContact CG2-CE2 4.31Å; V1038-F1120 HydrophobicContact CG2-CZ 3.52Å
1039	S	96	Very high	89	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	170	171.9	65.4	0	0	0	0	111	H996 P999 E1041 Q1042 I1067	H996-S1039 PolarHBondContact CE1-OG 3.02Å; H996-S1039 VanDerWaalsContact CE1-OG 3.27Å; P999-S1039 CarbonylContact O-C 3.49Å; P999-S1039 WeakPolarHBondContact O-CA 3.3Å; P999-S1039 VanDerWaalsContact O-CB 3.27Å; P999-S1039 WeakPolarHBondContact O-CB 3.24Å; S1039-E1041 PolarHBondContact O-N 2.84Å; S1039-E1041 PolarHBondContact OG-N 2.84Å; S1039-Q1042 PolarHBondContact N-O 2.85Å; S1039-Q1042 PolarHBondContact OG-N 2.93Å; S1039-Q1042 PolarHBondContact OG-O 2.94Å; S1039-I1067 WeakPolarHBondContact O-CD1 3.42Å
1040	E	93.8	Very high	91	Very high	28 Å²	28	27.1 Å²	27.1	13%	0.131	14%	0.141	C	C	.	.	S	Bend	trans	-54.5	-21.5	173	-74.2	-178.7	-167.5	0	0	113.6	R827 A998 P999 L1001 T1060 R1066 I1067	R827-E1040 IonicContact NH1-OE1 3.62Å; R827-E1040 IonicContact NH2-OE1 3.8Å; A998-E1040 HydrophobicContact CB-CB 4.44Å; P999-E1040 HydrophobicContact CB-CG 4.11Å; P999-E1040 HydrophobicContact CG-CG 4.12Å; P999-E1040 VanDerWaalsContact CG-OE1 3.32Å; P999-E1040 WeakPolarHBondContact CG-OE1 3.21Å; P999-E1040 PolarHBondContact O-N 2.84Å; L1001-E1040 HydrophobicContact CD1-CG 4.27Å; L1001-E1040 HydrophobicContact CD2-CG 4Å; L1001-E1040 HydrophobicContact CG-CG 4.3Å; E1040-T1060 PolarHBondContact O-OG1 3.43Å; E1040-R1066 HydrophobicContact CB-CB 4.39Å; E1040-R1066 CarbonylContact O-C 3.56Å; E1040-R1066 WeakPolarHBondContact O-CA 3.39Å; E1040-R1066 WeakPolarHBondContact O-CB 3.4Å; E1040-R1066 WeakPolarHBondContact OE2-CD 3.36Å; E1040-R1066 IonicContact OE2-CZ 2.73Å; E1040-R1066 IonicContact OE2-NE 3.23Å; E1040-R1066 IonicContact OE2-NH1 3.83Å; E1040-R1066 PolarHBondContact OE2-NH1 3.42Å; E1040-I1067 PolarHBondContact O-N 3.06Å
1041	E	93.5	Very high	92.6	Very high	7 Å²	7	23.8 Å²	23.8	3%	0.033	13%	0.126	C	C	.	.	S	Bend	trans	-119.2	-26.6	-171.7	-68.4	171.9	-170.1	0	0	115.2	R918 H996 A998 S1039 I1059 T1060	R918-E1041 IonicContact CZ-OE1 3.26Å; R918-E1041 IonicContact NE-OE1 2.77Å; R918-E1041 IonicContact NH2-OE1 2.77Å; R918-E1041 PolarHBondContact NH2-OE1 3.33Å; H996-E1041 IonicContact CG-OE2 3.92Å; H996-E1041 IonicContact ND1-OE2 3.22Å; H996-E1041 PolarHBondContact ND1-OE2 2.89Å; A998-E1041 HydrophobicContact CB-CB 3.83Å; A998-E1041 VanDerWaalsContact CB-CD 3.49Å; A998-E1041 HydrophobicContact CB-CG 3.68Å; S1039-E1041 PolarHBondContact O-N 2.84Å; S1039-E1041 PolarHBondContact OG-N 2.84Å; E1041-I1059 PolarHBondContact O-N 3.45Å; E1041-I1059 VanDerWaalsContact O-N 3.14Å; E1041-T1060 WeakPolarHBondContact CA-OG1 3.48Å; E1041-T1060 HydrophobicContact CG-CG2 4.38Å; E1041-T1060 PolarHBondContact O-N 2.9Å; E1041-T1060 VanDerWaalsContact O-N 3.1Å
1042	Q	95.2	Very high	93.6	Very high	13 Å²	13	23.7 Å²	23.7	6%	0.061	12%	0.122	C	C	.	.			trans	-146.3	147.8	-171.4	-52.2	-170.6	8.4	0	0	111.8	H996 S1039 R1044 A1057	H996-Q1042 PolarHBondContact CD2-NE2 3.34Å; H996-Q1042 PolarHBondContact CD2-OE1 2.86Å; S1039-Q1042 PolarHBondContact N-O 2.85Å; S1039-Q1042 PolarHBondContact OG-N 2.93Å; S1039-Q1042 PolarHBondContact OG-O 2.94Å; Q1042-R1044 VanDerWaalsContact OE1-CZ 3.31Å; Q1042-A1057 VanDerWaalsContact CA-O 3.28Å; Q1042-A1057 WeakPolarHBondContact CA-O 3.37Å; Q1042-A1057 WeakPolarHBondContact CB-O 3.27Å
1043	I	96.7	Very high	94.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.4	165.7	-62.3	150.2	0	0	0	107.4	V1038 K1056 A1057 I1059 I1067 F1120 F1122 L1132 L1137	V1038-I1043 HydrophobicContact CG1-CG1 4.2Å; I1043-K1056 CarbonylContact O-C 3.57Å; I1043-K1056 WeakPolarHBondContact O-CA 3.4Å; I1043-A1057 PolarHBondContact N-O 3.38Å; I1043-A1057 VanDerWaalsContact N-O 3.08Å; I1043-A1057 PolarHBondContact O-N 3.39Å; I1043-I1059 HydrophobicContact CD1-CG1 4.18Å; I1043-I1067 HydrophobicContact CD1-CD1 3.78Å; I1043-I1067 HydrophobicContact CG1-CD1 3.64Å; I1043-F1120 HydrophobicContact CD1-CD1 3.62Å; I1043-F1120 HydrophobicContact CD1-CE1 3.44Å; I1043-F1120 VanDerWaalsContact CD1-CE1 3.44Å; I1043-F1120 HydrophobicContact CD1-CZ 4.43Å; I1043-F1120 HydrophobicContact CG1-CD1 4.41Å; I1043-F1120 HydrophobicContact CG1-CE1 3.87Å; I1043-F1120 HydrophobicContact CG1-CZ 4.43Å; I1043-F1120 HydrophobicContact CG2-CD1 4.44Å; I1043-F1120 HydrophobicContact CG2-CE1 4.16Å; I1043-F1120 HydrophobicContact CG2-CE2 4.41Å; I1043-F1120 HydrophobicContact CG2-CZ 4.18Å; I1043-F1122 HydrophobicContact CD1-CD1 3.64Å; I1043-F1122 HydrophobicContact CD1-CE1 3.99Å; I1043-F1122 HydrophobicContact CD1-CG 4.28Å; I1043-L1132 HydrophobicContact CD1-CD1 3.62Å; I1043-L1137 HydrophobicContact CB-CD1 4.26Å; I1043-L1137 HydrophobicContact CG2-CD1 3.78Å; I1043-L1137 HydrophobicContact CG2-CD2 4.03Å
1044	R	96.5	Very high	94.3	Very high	21 Å²	21	27.2 Å²	27.2	8%	0.079	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136.5	-178.7	-66.4	-178.1	179.9	-156.7	-4.9	110.9	V1037 Q1042 F1046 L1053 F1055 K1056	V1037-R1044 PolarHBondContact N-O 2.84Å; V1037-R1044 PolarHBondContact O-N 2.81Å; Q1042-R1044 VanDerWaalsContact OE1-CZ 3.31Å; R1044-F1046 HydrophobicContact CB-CD2 4.2Å; R1044-F1046 HydrophobicContact CB-CE2 3.41Å; R1044-F1046 VanDerWaalsContact CB-CE2 3.41Å; R1044-F1046 HydrophobicContact CB-CZ 3.85Å; R1044-F1046 HydrophobicContact CG-CE2 4.42Å; R1044-F1046 HydrophobicContact CG-CZ 4.45Å; R1044-L1053 HydrophobicContact CB-CD1 3.84Å; R1044-L1053 HydrophobicContact CG-CD1 4.05Å; R1044-F1055 WeakPolarHBondContact CA-O 3.33Å; R1044-K1056 HydrophobicContact CG-CB 4.13Å
1045	L	96.4	Very high	94.4	Very high	3 Å²	3	30 Å²	30	2%	0.016	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.7	173.4	-67.6	-170.3	0	0	0	109.8	I1006 V1034 L1035 K1054 F1055 P1135 L1137	I1006-L1045 HydrophobicContact CD1-CD2 3.69Å; V1034-L1045 HydrophobicContact CG1-CB 3.71Å; V1034-L1045 HydrophobicContact CG1-CD1 4.42Å; V1034-L1045 HydrophobicContact CG1-CD2 4.27Å; V1034-L1045 HydrophobicContact CG1-CG 4.34Å; L1035-L1045 CarbonylContact O-C 3.57Å; L1035-L1045 WeakPolarHBondContact O-CA 3.46Å; L1045-K1054 HydrophobicContact CB-CB 4.34Å; L1045-K1054 WeakPolarHBondContact O-CB 3.11Å; L1045-K1054 PolarHBondContact O-N 2.99Å; L1045-F1055 HydrophobicContact CB-CB 4.33Å; L1045-F1055 HydrophobicContact CD1-CB 4.5Å; L1045-F1055 HydrophobicContact CD1-CD2 4.29Å; L1045-F1055 PolarHBondContact N-O 2.73Å; L1045-F1055 PolarHBondContact O-N 3.22Å; L1045-P1135 HydrophobicContact CD1-CB 4.1Å; L1045-P1135 VanDerWaalsContact CD1-O 3.29Å; L1045-P1135 WeakPolarHBondContact CD1-O 3.2Å; L1045-L1137 HydrophobicContact CD1-CD2 4.38Å; L1045-L1137 HydrophobicContact CD1-CG 4.39Å; L1045-L1137 HydrophobicContact CG-CD1 4.14Å; L1045-L1137 HydrophobicContact CG-CD2 4.42Å; L1045-L1137 HydrophobicContact CG-CG 4.37Å
1046	F	96	Very high	94.4	Very high	6 Å²	6	35 Å²	35	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.3	-178.3	-62.6	-92	0	0	0	112.4	L992 L994 V1034 L1035 V1037 R1044 L1051 H1052 L1053	L992-F1046 HydrophobicContact CD1-CD1 4.49Å; L992-F1046 HydrophobicContact CD1-CE1 3.78Å; L992-F1046 HydrophobicContact CD1-CZ 3.89Å; L992-F1046 HydrophobicContact CD2-CD1 4.42Å; L992-F1046 HydrophobicContact CD2-CD2 4.01Å; L992-F1046 HydrophobicContact CD2-CE1 4.05Å; L992-F1046 HydrophobicContact CD2-CE2 3.6Å; L992-F1046 HydrophobicContact CD2-CG 4.4Å; L992-F1046 HydrophobicContact CD2-CZ 3.61Å; L992-F1046 HydrophobicContact CG-CZ 4.35Å; L994-F1046 HydrophobicContact CD2-CZ 4.27Å; V1034-F1046 WeakPolarHBondContact CA-O 3.21Å; V1034-F1046 WeakPolarHBondContact CG1-O 3.27Å; L1035-F1046 HydrophobicContact CB-CB 4.4Å; L1035-F1046 PolarHBondContact N-O 3.13Å; L1035-F1046 PolarHBondContact O-N 3.17Å; V1037-F1046 HydrophobicContact CB-CD2 4.41Å; V1037-F1046 HydrophobicContact CB-CE2 4Å; V1037-F1046 HydrophobicContact CG2-CD2 3.74Å; V1037-F1046 HydrophobicContact CG2-CE2 3.68Å; R1044-F1046 HydrophobicContact CB-CD2 4.2Å; R1044-F1046 HydrophobicContact CB-CE2 3.41Å; R1044-F1046 VanDerWaalsContact CB-CE2 3.41Å; R1044-F1046 HydrophobicContact CB-CZ 3.85Å; R1044-F1046 HydrophobicContact CG-CE2 4.42Å; R1044-F1046 HydrophobicContact CG-CZ 4.45Å; F1046-L1051 HydrophobicContact CB-CD2 4.45Å; F1046-L1051 WeakPolarHBondContact CD1-O 3.43Å; F1046-H1052 CarbonylContact C-O 3.55Å; F1046-H1052 WeakPolarHBondContact CA-O 3.37Å; F1046-L1053 HydrophobicContact CD1-CB 4.14Å; F1046-L1053 HydrophobicContact CD1-CD1 4.1Å; F1046-L1053 HydrophobicContact CE1-CB 4.02Å; F1046-L1053 HydrophobicContact CE1-CD1 3.69Å; F1046-L1053 HydrophobicContact CE1-CG 4.47Å; F1046-L1053 HydrophobicContact CE2-CD1 4.35Å; F1046-L1053 HydrophobicContact CZ-CD1 3.84Å
1047	N	94	Very high	94.4	Very high	62 Å²	62	35.5 Å²	35.5	33%	0.332	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	131.5	174.2	-67.3	-26.5	0	0	0	110.6	L1051 H1052 K1054	N1047-L1051 VanDerWaalsContact O-CA 3.3Å; N1047-L1051 WeakPolarHBondContact O-CA 3.43Å; N1047-L1051 PolarHBondContact O-N 2.93Å; N1047-H1052 PolarHBondContact N-O 3.4Å; N1047-K1054 VanDerWaalsContact OD1-CD 3.29Å; N1047-K1054 WeakPolarHBondContact OD1-CD 3.43Å
1048	L	91.3	Very high	94.2	Very high	15 Å²	15	39.9 Å²	39.9	8%	0.079	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	151.6	175.5	-62.2	172.6	0	0	0	110.7	L937 F956 L1005 L1032 P1033 L1035 L1051	L937-L1048 HydrophobicContact CD1-CB 4.03Å; L937-L1048 HydrophobicContact CD1-CD1 3.98Å; L937-L1048 HydrophobicContact CD1-CD2 3.8Å; L937-L1048 HydrophobicContact CD1-CG 4.14Å; L937-L1048 HydrophobicContact CD2-CB 3.88Å; L937-L1048 HydrophobicContact CD2-CD1 4.41Å; F956-L1048 HydrophobicContact CE1-CD2 3.99Å; F956-L1048 HydrophobicContact CZ-CD1 4.07Å; F956-L1048 HydrophobicContact CZ-CD2 4.16Å; L1005-L1048 HydrophobicContact CD2-CD1 3.64Å; L1032-L1048 WeakPolarHBondContact CD1-O 3.47Å; P1033-L1048 HydrophobicContact CG-CD1 4.39Å; P1033-L1048 WeakPolarHBondContact O-CD1 3.33Å; L1035-L1048 HydrophobicContact CB-CD1 4.23Å; L1035-L1048 HydrophobicContact CB-CD2 4.07Å; L1035-L1048 HydrophobicContact CB-CG 4.25Å; L1048-L1051 HydrophobicContact CD2-CD2 3.71Å
1049	P	88.3	Confident	94	Very high	37 Å²	37	40 Å²	40	24%	0.24	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	cis	-83.6	-8.6	-1.6	37	-37.1	0	0	0	113.5	L937 F938 L1051	L937-P1049 HydrophobicContact CB-CB 4.11Å; L937-P1049 HydrophobicContact CD2-CB 4.45Å; F938-P1049 HydrophobicContact CD1-CB 4.4Å; F938-P1049 HydrophobicContact CE1-CB 3.85Å; F938-P1049 HydrophobicContact CZ-CB 4.13Å; P1049-L1051 VanDerWaalsContact C-N 3.31Å; P1049-L1051 PolarHBondContact O-N 2.93Å
1050	N	89.1	Confident	93.8	Very high	79 Å²	79	40.8 Å²	40.8	42%	0.422	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-13	-166.2	-76.5	-19.8	0	0	0	115.3	R990 H1052	R990-N1050 PolarHBondContact NH1-O 3Å; N1050-H1052 WeakPolarHBondContact CB-CD2 3.45Å; N1050-H1052 PolarHBondContact O-N 3.11Å
1051	L	91.3	Very high	93.6	Very high	22 Å²	22	39.7 Å²	39.7	12%	0.115	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	32.1	-175.7	-59.2	166.5	0	0	0	113.2	L966 R990 L992 L1035 F1046 N1047 L1048 P1049	L966-L1051 HydrophobicContact CD1-CD1 3.85Å; L966-L1051 HydrophobicContact CD2-CD1 3.95Å; L966-L1051 HydrophobicContact CD2-CD2 4.29Å; L966-L1051 HydrophobicContact CD2-CG 4.48Å; R990-L1051 HydrophobicContact CB-CD1 4.11Å; L992-L1051 HydrophobicContact CB-CD1 4.37Å; L1035-L1051 HydrophobicContact CD2-CD2 3.94Å; F1046-L1051 HydrophobicContact CB-CD2 4.45Å; F1046-L1051 WeakPolarHBondContact CD1-O 3.43Å; N1047-L1051 VanDerWaalsContact O-CA 3.3Å; N1047-L1051 WeakPolarHBondContact O-CA 3.43Å; N1047-L1051 PolarHBondContact O-N 2.93Å; L1048-L1051 HydrophobicContact CD2-CD2 3.71Å; P1049-L1051 VanDerWaalsContact C-N 3.31Å; P1049-L1051 PolarHBondContact O-N 2.93Å
1052	H	93.3	Very high	93.4	Very high	119 Å²	119	43.7 Å²	43.7	55%	0.551	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	130.9	169.4	-67.8	-57.6	0	0	0	110	F1046 N1047 N1050 K1054	F1046-H1052 CarbonylContact C-O 3.55Å; F1046-H1052 WeakPolarHBondContact CA-O 3.37Å; N1047-H1052 PolarHBondContact N-O 3.4Å; N1050-H1052 WeakPolarHBondContact CB-CD2 3.45Å; N1050-H1052 PolarHBondContact O-N 3.11Å; H1052-K1054 PolarHBondContact O-N 2.77Å
1053	L	95	Very high	93	Very high	78 Å²	78	44.1 Å²	44.1	41%	0.408	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	122.7	176.7	-176.2	69.8	0	0	0	110.3	R1044 F1046 F1055 K1056	R1044-L1053 HydrophobicContact CB-CD1 3.84Å; R1044-L1053 HydrophobicContact CG-CD1 4.05Å; F1046-L1053 HydrophobicContact CD1-CB 4.14Å; F1046-L1053 HydrophobicContact CD1-CD1 4.1Å; F1046-L1053 HydrophobicContact CE1-CB 4.02Å; F1046-L1053 HydrophobicContact CE1-CD1 3.69Å; F1046-L1053 HydrophobicContact CE1-CG 4.47Å; F1046-L1053 HydrophobicContact CE2-CD1 4.35Å; F1046-L1053 HydrophobicContact CZ-CD1 3.84Å; L1053-F1055 WeakPolarHBondContact CD1-O 3.4Å; L1053-K1056 HydrophobicContact CD1-CB 4.42Å; L1053-K1056 HydrophobicContact CD2-CB 4.3Å; L1053-K1056 HydrophobicContact CD2-CD 4.12Å
1054	K	94.2	Very high	92.6	Very high	71 Å²	71	45.5 Å²	45.5	31%	0.309	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-52.6	177	-161.8	-169.5	-166.2	172.2	0	110.9	V1034 L1045 N1047 H1052	V1034-K1054 HydrophobicContact CG1-CD 4.33Å; V1034-K1054 HydrophobicContact CG2-CD 4.17Å; L1045-K1054 HydrophobicContact CB-CB 4.34Å; L1045-K1054 WeakPolarHBondContact O-CB 3.11Å; L1045-K1054 PolarHBondContact O-N 2.99Å; N1047-K1054 VanDerWaalsContact OD1-CD 3.29Å; N1047-K1054 WeakPolarHBondContact OD1-CD 3.43Å; H1052-K1054 PolarHBondContact O-N 2.77Å
1055	F	96.1	Very high	92.3	Very high	63 Å²	63	48.9 Å²	48.9	28%	0.276	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	154	179.4	-64.9	-72	0	0	0	111.2	R1044 L1045 L1053 P1135 Q1136 L1137	R1044-F1055 WeakPolarHBondContact CA-O 3.33Å; L1045-F1055 HydrophobicContact CB-CB 4.33Å; L1045-F1055 HydrophobicContact CD1-CB 4.5Å; L1045-F1055 HydrophobicContact CD1-CD2 4.29Å; L1045-F1055 PolarHBondContact N-O 2.73Å; L1045-F1055 PolarHBondContact O-N 3.22Å; L1053-F1055 WeakPolarHBondContact CD1-O 3.4Å; F1055-P1135 HydrophobicContact CD2-CB 3.95Å; F1055-P1135 HydrophobicContact CD2-CG 4.41Å; F1055-P1135 WeakPolarHBondContact CD2-O 3.25Å; F1055-P1135 HydrophobicContact CE2-CB 3.74Å; F1055-P1135 HydrophobicContact CE2-CG 3.72Å; F1055-P1135 VanDerWaalsContact CG-O 3.3Å; F1055-P1135 WeakPolarHBondContact CG-O 3.03Å; F1055-P1135 HydrophobicContact CZ-CG 4.37Å; F1055-Q1136 HydrophobicContact CD1-CB 4.34Å; F1055-Q1136 HydrophobicContact CE1-CB 4.13Å; F1055-Q1136 HydrophobicContact CE1-CG 3.95Å; F1055-Q1136 HydrophobicContact CZ-CG 4Å; F1055-L1137 HydrophobicContact CB-CD1 4.16Å; F1055-L1137 HydrophobicContact CB-CG 4.22Å
1056	K	95.5	Very high	92.1	Very high	106 Å²	106	53.3 Å²	53.3	46%	0.461	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.5	176	69	-176.8	-177	-172.1	0	110.9	I1043 R1044 L1053	I1043-K1056 CarbonylContact O-C 3.57Å; I1043-K1056 WeakPolarHBondContact O-CA 3.4Å; R1044-K1056 HydrophobicContact CG-CB 4.13Å; L1053-K1056 HydrophobicContact CD1-CB 4.42Å; L1053-K1056 HydrophobicContact CD2-CB 4.3Å; L1053-K1056 HydrophobicContact CD2-CD 4.12Å
1057	A	95.2	Very high	92.1	Very high	11 Å²	11	53.2 Å²	53.2	9%	0.091	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.4	165	0	0	0	0	0	109.4	Q1042 I1043 I1059 L1132 L1137	Q1042-A1057 VanDerWaalsContact CA-O 3.28Å; Q1042-A1057 WeakPolarHBondContact CA-O 3.37Å; Q1042-A1057 WeakPolarHBondContact CB-O 3.27Å; I1043-A1057 PolarHBondContact N-O 3.38Å; I1043-A1057 VanDerWaalsContact N-O 3.08Å; I1043-A1057 PolarHBondContact O-N 3.39Å; A1057-I1059 HydrophobicContact CB-CD1 3.84Å; A1057-I1059 PolarHBondContact O-N 2.99Å; A1057-L1132 HydrophobicContact CB-CD1 3.95Å; A1057-L1137 HydrophobicContact CB-CB 3.96Å; A1057-L1137 HydrophobicContact CB-CD1 4.36Å
1058	R	93	Very high	92	Very high	93 Å²	93	54 Å²	54	35%	0.351	26%	0.259	S	S	.	.			trans	-96.7	66.9	-177.2	-69.5	-177.4	170.1	165.9	-7.5	111.1	E912 T1060 A1061 I1062	E912-R1058 VanDerWaalsContact CD-NH1 3.26Å; E912-R1058 WeakPolarHBondContact OE1-CD 3.49Å; E912-R1058 IonicContact OE1-CZ 3.12Å; E912-R1058 IonicContact OE1-NE 2.77Å; E912-R1058 IonicContact OE1-NH1 2.74Å; E912-R1058 PolarHBondContact OE1-NH1 2.9Å; E912-R1058 IonicContact OE2-NH1 3.88Å; E912-R1058 PolarHBondContact OE2-NH1 3.02Å; R1058-T1060 PolarHBondContact O-N 2.79Å; R1058-A1061 HydrophobicContact CB-CB 4.08Å; R1058-A1061 PolarHBondContact O-N 2.96Å; R1058-I1062 WeakPolarHBondContact O-CG1 3.43Å; R1058-I1062 PolarHBondContact O-N 3Å
1059	I	93.3	Very high	92.1	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-53.8	-56.8	-169.4	-57.1	-48.3	0	0	0	112.6	E1041 I1043 A1057 A1061 I1062 D1063 I1067 F1122 L1132	E1041-I1059 PolarHBondContact O-N 3.45Å; E1041-I1059 VanDerWaalsContact O-N 3.14Å; I1043-I1059 HydrophobicContact CD1-CG1 4.18Å; A1057-I1059 HydrophobicContact CB-CD1 3.84Å; A1057-I1059 PolarHBondContact O-N 2.99Å; I1059-A1061 VanDerWaalsContact C-N 3.26Å; I1059-A1061 PolarHBondContact O-N 3.16Å; I1059-I1062 PolarHBondContact O-N 2.95Å; I1059-I1062 VanDerWaalsContact O-N 3.16Å; I1059-D1063 HydrophobicContact CG2-CB 4.46Å; I1059-D1063 WeakPolarHBondContact O-CB 3.37Å; I1059-D1063 PolarHBondContact O-N 3.43Å; I1059-I1067 HydrophobicContact CB-CD1 4.03Å; I1059-I1067 HydrophobicContact CB-CG1 4.1Å; I1059-I1067 HydrophobicContact CG1-CD1 3.71Å; I1059-I1067 HydrophobicContact CG1-CG1 4.23Å; I1059-I1067 HydrophobicContact CG2-CD1 4.41Å; I1059-I1067 HydrophobicContact CG2-CG1 3.99Å; I1059-F1122 HydrophobicContact CB-CZ 4.2Å; I1059-F1122 HydrophobicContact CD1-CE1 3.72Å; I1059-F1122 HydrophobicContact CD1-CZ 3.64Å; I1059-F1122 HydrophobicContact CG1-CE1 3.96Å; I1059-F1122 HydrophobicContact CG1-CE2 4.38Å; I1059-F1122 HydrophobicContact CG1-CZ 3.69Å; I1059-F1122 HydrophobicContact CG2-CE2 3.59Å; I1059-F1122 HydrophobicContact CG2-CZ 3.44Å; I1059-F1122 VanDerWaalsContact CG2-CZ 3.44Å; I1059-L1132 HydrophobicContact CD1-CD1 4.26Å; I1059-L1132 HydrophobicContact CD1-CD2 4.42Å
1060	T	91.9	Very high	92.3	Very high	18 Å²	18	53.1 Å²	53.1	11%	0.11	26%	0.256	C	S	.	.	H	α-helix	trans	-68.2	-23.5	-175.5	-58	0	0	0	0	113.8	I915 E1040 E1041 R1058 I1062 G1064 Y1065 R1066	I915-T1060 HydrophobicContact CD1-CG2 4.04Å; E1040-T1060 PolarHBondContact O-OG1 3.43Å; E1041-T1060 WeakPolarHBondContact CA-OG1 3.48Å; E1041-T1060 HydrophobicContact CG-CG2 4.38Å; E1041-T1060 PolarHBondContact O-N 2.9Å; E1041-T1060 VanDerWaalsContact O-N 3.1Å; R1058-T1060 PolarHBondContact O-N 2.79Å; T1060-I1062 VanDerWaalsContact C-N 3.33Å; T1060-G1064 VanDerWaalsContact O-CA 3.25Å; T1060-G1064 WeakPolarHBondContact O-CA 3.47Å; T1060-G1064 PolarHBondContact O-N 2.94Å; T1060-Y1065 VanDerWaalsContact CA-O 3.31Å; T1060-Y1065 WeakPolarHBondContact CA-O 3.47Å; T1060-Y1065 WeakPolarHBondContact CB-O 3.26Å; T1060-Y1065 PolarHBondContact OG1-O 2.98Å; T1060-R1066 HydrophobicContact CG2-CG 4.34Å
1061	A	90	Very high	92.4	Very high	5 Å²	5	49.5 Å²	49.5	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-74.8	-27.3	177.9	0	0	0	0	0	112.1	E912 R913 I915 R1058 I1059	E912-A1061 HydrophobicContact CG-CB 3.93Å; R913-A1061 PolarHBondContact N-O 3.47Å; I915-A1061 HydrophobicContact CD1-CB 3.89Å; I915-A1061 HydrophobicContact CG1-CB 4.28Å; R1058-A1061 HydrophobicContact CB-CB 4.08Å; R1058-A1061 PolarHBondContact O-N 2.96Å; I1059-A1061 VanDerWaalsContact C-N 3.26Å; I1059-A1061 PolarHBondContact O-N 3.16Å
1062	I	88.4	Confident	92.3	Very high	91 Å²	91	48.5 Å²	48.5	47%	0.467	23%	0.231	S	C	.	.	H	α-helix	trans	-91.8	-56.8	178.6	-60.5	166.9	0	0	0	109.5	R1058 I1059 T1060	R1058-I1062 WeakPolarHBondContact O-CG1 3.43Å; R1058-I1062 PolarHBondContact O-N 3Å; I1059-I1062 PolarHBondContact O-N 2.95Å; I1059-I1062 VanDerWaalsContact O-N 3.16Å; T1060-I1062 VanDerWaalsContact C-N 3.33Å
1063	D	87.1	Confident	92.1	Very high	22 Å²	22	42.8 Å²	42.8	12%	0.118	21%	0.205	C	C	.	.	H	α-helix	trans	-83.2	-26.8	-169.7	-62.9	32.7	0	0	0	112.6	I1059 Y1065 R1139	I1059-D1063 HydrophobicContact CG2-CB 4.46Å; I1059-D1063 WeakPolarHBondContact O-CB 3.37Å; I1059-D1063 PolarHBondContact O-N 3.43Å; D1063-Y1065 PolarHBondContact O-N 2.99Å; D1063-R1139 IonicContact OD1-CZ 3.04Å; D1063-R1139 IonicContact OD1-NH1 3.57Å; D1063-R1139 PolarHBondContact OD1-NH1 2.79Å; D1063-R1139 IonicContact OD1-NH2 3.66Å; D1063-R1139 IonicContact OD2-CZ 2.76Å; D1063-R1139 IonicContact OD2-NH1 3.55Å; D1063-R1139 PolarHBondContact OD2-NH1 3.26Å; D1063-R1139 IonicContact OD2-NH2 3.92Å; D1063-R1139 PolarHBondContact OD2-NH2 2.68Å
1064	G	88.7	Confident	91.6	Very high	28 Å²	28	40 Å²	40	29%	0.289	20%	0.195	S	C	.	.	S	Bend	trans	77.7	-17.2	-168.2	0	0	0	0	0	115	T1060	T1060-G1064 VanDerWaalsContact O-CA 3.25Å; T1060-G1064 WeakPolarHBondContact O-CA 3.47Å; T1060-G1064 PolarHBondContact O-N 2.94Å
1065	Y	90.2	Very high	91.2	Very high	92 Å²	92	36.9 Å²	36.9	36%	0.361	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-87.9	150.2	175.7	-61.1	-58.7	0	0	0	112.4	T1060 D1063 V1125	T1060-Y1065 VanDerWaalsContact CA-O 3.31Å; T1060-Y1065 WeakPolarHBondContact CA-O 3.47Å; T1060-Y1065 WeakPolarHBondContact CB-O 3.26Å; T1060-Y1065 PolarHBondContact OG1-O 2.98Å; D1063-Y1065 PolarHBondContact O-N 2.99Å; Y1065-V1125 HydrophobicContact CD1-CG2 4.23Å
1066	R	92.1	Very high	90.1	Very high	97 Å²	97	39 Å²	39	37%	0.366	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-88.8	143.9	170.5	-67.7	-174.3	-174.9	-170.6	8.9	111.4	E1040 T1060 N1124 V1125	E1040-R1066 HydrophobicContact CB-CB 4.39Å; E1040-R1066 CarbonylContact O-C 3.56Å; E1040-R1066 WeakPolarHBondContact O-CA 3.39Å; E1040-R1066 WeakPolarHBondContact O-CB 3.4Å; E1040-R1066 WeakPolarHBondContact OE2-CD 3.36Å; E1040-R1066 IonicContact OE2-CZ 2.73Å; E1040-R1066 IonicContact OE2-NE 3.23Å; E1040-R1066 IonicContact OE2-NH1 3.83Å; E1040-R1066 PolarHBondContact OE2-NH1 3.42Å; T1060-R1066 HydrophobicContact CG2-CG 4.34Å; R1066-N1124 CarbonylContact O-C 3.6Å; R1066-N1124 WeakPolarHBondContact O-CA 3.16Å; R1066-N1124 VanDerWaalsContact O-CB 3.3Å; R1066-N1124 WeakPolarHBondContact O-CB 3.24Å; R1066-V1125 HydrophobicContact CB-CG1 4.29Å; R1066-V1125 HydrophobicContact CB-CG2 4.12Å; R1066-V1125 PolarHBondContact O-N 3.15Å
1067	I	95.1	Very high	88.9	Confident	3 Å²	3	37 Å²	37	2%	0.015	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	139.6	170.1	-52.5	-178.7	0	0	0	108.5	L1001 V1038 S1039 E1040 I1043 I1059 F1122	L1001-I1067 HydrophobicContact CD1-CB 4.11Å; L1001-I1067 HydrophobicContact CD1-CG2 3.97Å; L1001-I1067 WeakPolarHBondContact CD1-O 3.45Å; V1038-I1067 HydrophobicContact CG1-CD1 4.47Å; V1038-I1067 HydrophobicContact CG1-CG2 4.1Å; S1039-I1067 WeakPolarHBondContact O-CD1 3.42Å; E1040-I1067 PolarHBondContact O-N 3.06Å; I1043-I1067 HydrophobicContact CD1-CD1 3.78Å; I1043-I1067 HydrophobicContact CG1-CD1 3.64Å; I1059-I1067 HydrophobicContact CB-CD1 4.03Å; I1059-I1067 HydrophobicContact CB-CG1 4.1Å; I1059-I1067 HydrophobicContact CG1-CD1 3.71Å; I1059-I1067 HydrophobicContact CG1-CG1 4.23Å; I1059-I1067 HydrophobicContact CG2-CD1 4.41Å; I1059-I1067 HydrophobicContact CG2-CG1 3.99Å; I1067-F1122 HydrophobicContact CB-CD2 4.37Å; I1067-F1122 HydrophobicContact CD1-CD2 4.42Å; I1067-F1122 HydrophobicContact CG1-CD2 3.94Å; I1067-F1122 HydrophobicContact CG1-CE2 4.05Å; I1067-F1122 HydrophobicContact CG2-CB 4.03Å; I1067-F1122 HydrophobicContact CG2-CD2 4Å; I1067-F1122 HydrophobicContact CG2-CG 4.27Å
1068	K	93	Very high	87.3	Confident	78 Å²	78	42.1 Å²	42.1	34%	0.339	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-52.6	177.8	171.7	60.1	-171.8	-175.3	0	112.1	T1123 V1154 S1155	K1068-T1123 PolarHBondContact N-O 3.04Å; K1068-V1154 WeakPolarHBondContact CG-O 3.44Å; K1068-S1155 VanDerWaalsContact CE-C 3.45Å; K1068-S1155 WeakPolarHBondContact CE-O 3.44Å; K1068-S1155 PolarHBondContact NZ-O 2.67Å
1069	S	92.9	Very high	85.3	Confident	20 Å²	20	40.3 Å²	40.3	14%	0.14	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154.3	-179.2	-166.2	0	0	0	0	109.9	F1122 T1123 V1157 F1159	S1069-F1122 CarbonylContact O-C 3.5Å; S1069-F1122 VanDerWaalsContact O-CA 3.24Å; S1069-F1122 WeakPolarHBondContact O-CA 3.46Å; S1069-F1122 WeakPolarHBondContact O-CB 3.27Å; S1069-T1123 PolarHBondContact O-N 3.05Å; S1069-V1157 VanDerWaalsContact CB-O 3.29Å; S1069-V1157 WeakPolarHBondContact CB-O 3.49Å; S1069-V1157 PolarHBondContact OG-O 3.3Å; S1069-F1159 WeakPolarHBondContact OG-CD2 3.49Å
1070	A	92.7	Very high	82.5	Confident	14 Å²	14	50 Å²	50	12%	0.116	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	143.1	-175.6	0	0	0	0	0	113.3	V1038 F1120 V1121 F1122	V1038-A1070 HydrophobicContact CG1-CB 3.88Å; V1038-A1070 HydrophobicContact CG2-CB 4.25Å; A1070-F1120 HydrophobicContact CB-CE1 3.61Å; A1070-F1120 HydrophobicContact CB-CZ 3.71Å; A1070-V1121 CarbonylContact C-O 3.59Å; A1070-V1121 WeakPolarHBondContact CA-O 2.98Å; A1070-F1122 HydrophobicContact CB-CB 3.82Å
1071	S	91	Very high	79.7	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	167.2	173.7	-163.9	0	0	0	0	111.6	R1004 V1121	R1004-S1071 PolarHBondContact NH1-OG 3.38Å; R1004-S1071 VanDerWaalsContact NH1-OG 3.1Å; S1071-V1121 PolarHBondContact N-O 2.76Å; S1071-V1121 PolarHBondContact O-N 3.14Å
1072	V	90	Very high	76.7	Confident	1 Å²	1	61 Å²	61	1%	0.006	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120	168.3	175.9	0	0	0	0	106.4	I1006 P1013 Y1118 F1120 M1134 G1175	I1006-V1072 HydrophobicContact CD1-CG2 4.41Å; I1006-V1072 HydrophobicContact CG1-CG2 4.42Å; P1013-V1072 HydrophobicContact CG-CB 4.18Å; P1013-V1072 HydrophobicContact CG-CG1 4.21Å; V1072-Y1118 HydrophobicContact CG1-CD1 4.15Å; V1072-F1120 HydrophobicContact CG2-CD2 3.8Å; V1072-F1120 HydrophobicContact CG2-CE2 3.93Å; V1072-M1134 HydrophobicContact CG1-CE 4.02Å; V1072-M1134 HydrophobicContact CG2-CE 3.87Å; V1072-G1175 WeakPolarHBondContact O-CA 3.45Å
1073	V	88	Confident	73.9	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.4	-170.6	177.6	0	0	0	0	109.9	F1075 Y1118 S1119 V1121 G1175 A1177	V1073-F1075 HydrophobicContact CB-CE2 3.79Å; V1073-F1075 HydrophobicContact CB-CZ 4.18Å; V1073-F1075 HydrophobicContact CG1-CD2 4.2Å; V1073-F1075 HydrophobicContact CG1-CE1 4.32Å; V1073-F1075 HydrophobicContact CG1-CE2 3.63Å; V1073-F1075 HydrophobicContact CG1-CZ 3.71Å; V1073-Y1118 WeakPolarHBondContact O-CA 3.32Å; V1073-S1119 PolarHBondContact N-O 3.28Å; V1073-S1119 PolarHBondContact O-N 3.06Å; V1073-V1121 HydrophobicContact CB-CG2 3.72Å; V1073-V1121 HydrophobicContact CG2-CB 3.98Å; V1073-V1121 HydrophobicContact CG2-CG2 3.55Å; V1073-G1175 WeakPolarHBondContact CA-O 3.5Å; V1073-A1177 HydrophobicContact CG1-CB 3.46Å; V1073-A1177 VanDerWaalsContact CG1-CB 3.46Å
1074	G	85.4	Confident	71	Confident	19 Å²	19	65.7 Å²	65.7	20%	0.196	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.6	175.9	0	0	0	0	0	112.1	G1175	G1074-G1175 PolarHBondContact N-O 2.85Å
1075	F	84.7	Confident	68.2	Low	5 Å²	5	72.2 Å²	72.2	2%	0.022	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	114.6	177.6	-64.1	-91.2	0	0	0	110.3	Y33 V1073 I1077 E1117 V1121 L1131 V1193 R1195	Y33-F1075 AromaticContact CD1-CD1 3.89Å; Y33-F1075 HydrophobicContact CD1-CD1 3.89Å; Y33-F1075 AromaticContact CD1-CE1 3.61Å; Y33-F1075 HydrophobicContact CD1-CE1 3.61Å; Y33-F1075 HydrophobicContact CD1-CZ 4.14Å; Y33-F1075 AromaticContact CE1-CD1 3.67Å; Y33-F1075 HydrophobicContact CE1-CD1 3.67Å; Y33-F1075 HydrophobicContact CE1-CD2 4.28Å; Y33-F1075 AromaticContact CE1-CE1 3.74Å; Y33-F1075 HydrophobicContact CE1-CE1 3.74Å; Y33-F1075 HydrophobicContact CE1-CE2 4.38Å; Y33-F1075 AromaticContact CE1-CG 3.93Å; Y33-F1075 HydrophobicContact CE1-CG 3.93Å; Y33-F1075 HydrophobicContact CE1-CZ 4.12Å; V1073-F1075 HydrophobicContact CB-CE2 3.79Å; V1073-F1075 HydrophobicContact CB-CZ 4.18Å; V1073-F1075 HydrophobicContact CG1-CD2 4.2Å; V1073-F1075 HydrophobicContact CG1-CE1 4.32Å; V1073-F1075 HydrophobicContact CG1-CE2 3.63Å; V1073-F1075 HydrophobicContact CG1-CZ 3.71Å; F1075-I1077 PolarHBondContact O-N 3.25Å; F1075-E1117 PolarHBondContact N-O 3.4Å; F1075-E1117 PolarHBondContact O-N 3.23Å; F1075-V1121 HydrophobicContact CE2-CG2 4.11Å; F1075-V1121 HydrophobicContact CZ-CG2 4.02Å; F1075-L1131 HydrophobicContact CE1-CD2 4.39Å; F1075-L1131 HydrophobicContact CE2-CD2 4.3Å; F1075-L1131 HydrophobicContact CZ-CD2 3.77Å; F1075-V1193 HydrophobicContact CE1-CG1 4.18Å; F1075-V1193 WeakPolarHBondContact CE1-O 3.39Å; F1075-V1193 HydrophobicContact CZ-CG1 4.04Å; F1075-R1195 HydrophobicContact CB-CG 4.32Å; F1075-R1195 HydrophobicContact CD1-CG 4.04Å
1076	R	74.8	Confident	65.2	Low	109 Å²	109	73.2 Å²	73.2	41%	0.411	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	126.5	178.4	-161	175	-166.9	170	6	110.4	Q1198	R1076-Q1198 PolarHBondContact O-NE2 2.82Å; R1076-Q1198 VanDerWaalsContact O-NE2 3.14Å
1077	I	69.9	Low	62.1	Low	63 Å²	63	78.5 Å²	78.5	32%	0.323	44%	0.444	S	S	.	.			trans	-88.5	119.3	176.9	-47.7	175.4	0	0	0	108.6	F1075 G1079 N1115 E1117	F1075-I1077 PolarHBondContact O-N 3.25Å; I1077-G1079 PolarHBondContact O-N 2.91Å; I1077-N1115 PolarHBondContact N-O 2.81Å; I1077-E1117 HydrophobicContact CD1-CB 4.01Å; I1077-E1117 HydrophobicContact CG1-CB 4.02Å
1078	H	62.1	Low	58.9	Low	118 Å²	118	87.2 Å²	87.2	55%	0.546	48%	0.484	S	S	.	.			trans	-76.5	115.4	162.3	-73.7	-68	0	0	0	108.7
1079	G	49.4	Very low	55.8	Low	55 Å²	55	88.7 Å²	88.7	57%	0.567	51%	0.505	S	S	*	.			trans	-67.9	132	174	0	0	0	0	0	110.4	I1077 T1081	I1077-G1079 PolarHBondContact O-N 2.91Å; G1079-T1081 PolarHBondContact O-N 3.44Å
1080	K	36	Very low	52.7	Low	209 Å²	209	94.5 Å²	94.5	91%	0.909	54%	0.54	S	S	*	.			trans	-67	100.6	165	-73.2	-175.5	174.9	-175.3	0	108	S1082	K1080-S1082 PolarHBondContact O-N 2.91Å; K1080-S1082 VanDerWaalsContact O-N 3.17Å
1081	T	32.6	Very low	49.7	Very low	125 Å²	125	99.2 Å²	99.2	77%	0.767	57%	0.566	S	S	*	*			trans	-65.1	112.6	168.1	45.2	0	0	0	0	108.6	G1079 S1083	G1079-T1081 PolarHBondContact O-N 3.44Å; T1081-S1083 PolarHBondContact O-N 3.26Å
1082	S	25.9	Very low	46.7	Very low	129 Å²	129	105.4 Å²	105.4	90%	0.902	60%	0.599	S	S	*	*			trans	-73.6	88.4	178.5	53.4	0	0	0	0	110.7	K1080	K1080-S1082 PolarHBondContact O-N 2.91Å; K1080-S1082 VanDerWaalsContact O-N 3.17Å
1083	S	30.6	Very low	44.2	Very low	99 Å²	99	106.9 Å²	106.9	69%	0.692	61%	0.61	S	S	*	*			trans	-140	113.9	166.8	56.7	0	0	0	0	109.9	T1081	T1081-S1083 PolarHBondContact O-N 3.26Å
1084	S	26.2	Very low	41.7	Very low	112 Å²	112	110.3 Å²	110.3	78%	0.783	64%	0.638	S	S	*	*			trans	-67.9	124.4	173.9	49.2	0	0	0	0	111.7
1085	L	29.7	Very low	39.5	Very low	166 Å²	166	110.5 Å²	110.5	87%	0.869	64%	0.636	S	S	*	*			trans	-176.3	144.9	143.6	-100.7	149.2	0	0	0	111.9
1086	S	27.5	Very low	37	Very low	113 Å²	113	111.8 Å²	111.8	79%	0.79	65%	0.651	S	S	*	*			trans	51.2	120.9	169.6	49.3	0	0	0	0	120
1087	K	27.1	Very low	35.1	Very low	208 Å²	208	112.9 Å²	112.9	90%	0.904	67%	0.665	S	S	*	*			trans	-77.2	115.4	158.2	-69.3	173.4	175.5	176.8	0	109.2
1088	E	27.4	Very low	33.5	Very low	185 Å²	185	113 Å²	113	86%	0.864	67%	0.666	S	S	*	*			trans	-178.7	155.6	142.5	-103.6	162.4	-167.6	0	0	109.8
1089	S	28	Very low	32.1	Very low	110 Å²	110	113 Å²	113	77%	0.769	67%	0.666	S	S	*	*			trans	51.8	87.6	-178.1	60	0	0	0	0	118.5	V1091	S1089-V1091 PolarHBondContact O-N 3.44Å
1090	T	27.2	Very low	31.2	Very low	142 Å²	142	121.8 Å²	121.8	87%	0.871	68%	0.682	S	S	*	*			trans	-77.8	100.7	159.7	47.5	0	0	0	0	111
1091	V	30	Very low	30.9	Very low	112 Å²	112	113.7 Å²	113.7	68%	0.679	65%	0.652	S	S	*	*			trans	-126.2	99.1	165.9	-167.2	0	0	0	0	108.8	S1089 S1093	S1089-V1091 PolarHBondContact O-N 3.44Å; V1091-S1093 PolarHBondContact O-N 3.05Å
1092	D	28.3	Very low	30.7	Very low	133 Å²	133	116.3 Å²	116.3	71%	0.711	66%	0.661	S	S	*	*			trans	-73.8	120.6	179.6	-80.9	-44.7	0	0	0	111.3
1093	S	37.5	Very low	30.8	Very low	32 Å²	32	115.1 Å²	115.1	22%	0.224	65%	0.648	C	S	.	*			trans	-164.2	131.1	159.4	-94.4	0	0	0	0	113.8	V1091 C1095 G1096 K1199	V1091-S1093 PolarHBondContact O-N 3.05Å; S1093-C1095 PolarHBondContact O-N 3Å; S1093-G1096 PolarHBondContact O-N 3.14Å; S1093-K1199 VanDerWaalsContact OG-CE 3.25Å; S1093-K1199 WeakPolarHBondContact OG-CE 3.44Å; S1093-K1199 PolarHBondContact OG-NZ 3.32Å
1094	A	35.6	Very low	30.7	Very low	73 Å²	73	116.6 Å²	116.6	60%	0.603	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	12.5	155.8	0	0	0	0	0	113.3
1095	C	38.2	Very low	30.8	Very low	23 Å²	23	114.9 Å²	114.9	16%	0.155	66%	0.659	C	S	.	*	T	Hydrogen-bonded Turn	trans	-110	2.6	166.4	-64.6	0	0	0	0	112.7	S1093 D1097 L1098 E1099	S1093-C1095 PolarHBondContact O-N 3Å; C1095-D1097 PolarHBondContact O-N 3.3Å; C1095-L1098 WeakPolarHBondContact O-CA 3.27Å; C1095-L1098 WeakPolarHBondContact O-CB 3.34Å; C1095-L1098 PolarHBondContact O-N 3.04Å; C1095-E1099 PolarHBondContact O-N 3Å; C1095-E1099 VanDerWaalsContact O-N 3.17Å
1096	G	33	Very low	31	Very low	31 Å²	31	110.6 Å²	110.6	32%	0.32	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.4	-30.1	179.2	0	0	0	0	0	113.4	S1093 L1098 E1099	S1093-G1096 PolarHBondContact O-N 3.14Å; G1096-L1098 VanDerWaalsContact C-N 3.32Å; G1096-L1098 PolarHBondContact O-N 3.27Å; G1096-E1099 PolarHBondContact O-N 3.27Å
1097	D	34.5	Very low	31.1	Very low	132 Å²	132	109.6 Å²	109.6	71%	0.706	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-20.9	173.4	-64.1	-38.3	0	0	0	113.4	C1095 S1101 I1106	C1095-D1097 PolarHBondContact O-N 3.3Å; D1097-S1101 PolarHBondContact O-OG 2.84Å; D1097-I1106 HydrophobicContact CB-CD1 4.42Å
1098	L	35.8	Very low	31.5	Very low	66 Å²	66	103.6 Å²	103.6	35%	0.346	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	-25.5	169.7	-76.8	90	0	0	0	112.2	N551 C1095 G1096 R1100 I1106	N551-L1098 HydrophobicContact CB-CD2 4.15Å; N551-L1098 VanDerWaalsContact CG-CD2 3.48Å; N551-L1098 VanDerWaalsContact OD1-CD2 3.27Å; N551-L1098 WeakPolarHBondContact OD1-CD2 3.39Å; C1095-L1098 WeakPolarHBondContact O-CA 3.27Å; C1095-L1098 WeakPolarHBondContact O-CB 3.34Å; C1095-L1098 PolarHBondContact O-N 3.04Å; G1096-L1098 VanDerWaalsContact C-N 3.32Å; G1096-L1098 PolarHBondContact O-N 3.27Å; L1098-R1100 PolarHBondContact O-N 2.87Å; L1098-I1106 HydrophobicContact CD1-CD1 3.9Å; L1098-I1106 HydrophobicContact CG-CD1 4Å
1099	E	33.6	Very low	31.6	Very low	117 Å²	117	99.6 Å²	99.6	55%	0.547	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.2	-11.8	179.6	-68.8	-179.2	178.8	0	0	113.4	C1095 G1096	C1095-E1099 PolarHBondContact O-N 3Å; C1095-E1099 VanDerWaalsContact O-N 3.17Å; G1096-E1099 PolarHBondContact O-N 3.27Å
1100	R	31.2	Very low	31.9	Very low	240 Å²	240	98.9 Å²	98.9	91%	0.906	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-7.2	177.6	-91.8	-175	172.1	-173.4	-1.2	115.9	L1098	L1098-R1100 PolarHBondContact O-N 2.87Å
1101	S	28.4	Very low	32.3	Very low	40 Å²	40	99.5 Å²	99.5	28%	0.28	59%	0.586	S	S	.	*			trans	-113.2	98.9	-171.7	49.2	0	0	0	0	112.9	D1097 T1103	D1097-S1101 PolarHBondContact O-OG 2.84Å; S1101-T1103 PolarHBondContact O-N 2.85Å
1102	N	29.9	Very low	32.9	Very low	179 Å²	179	98.8 Å²	98.8	96%	0.957	58%	0.582	S	S	*	*			trans	-70.4	27.3	166.2	-85.5	-10.1	0	0	0	112.8
1103	T	27.5	Very low	33.9	Very low	104 Å²	104	96.2 Å²	96.2	64%	0.638	57%	0.568	S	S	*	*	S	Bend	trans	-131.9	115.9	-170.6	52.8	0	0	0	0	110.1	S1101 G1105	S1101-T1103 PolarHBondContact O-N 2.85Å; T1103-G1105 PolarHBondContact O-N 2.82Å
1104	S	27.9	Very low	34.6	Very low	131 Å²	131	102.5 Å²	102.5	92%	0.916	59%	0.594	S	S	*	*	S	Bend	trans	-52.7	132.5	170.4	40	0	0	0	0	111.9
1105	G	29	Very low	36.1	Very low	75 Å²	75	103.8 Å²	103.8	77%	0.773	59%	0.591	S	S	*	*			trans	104.4	68.7	168.8	0	0	0	0	0	115.9	T1103 S1107	T1103-G1105 PolarHBondContact O-N 2.82Å; G1105-S1107 PolarHBondContact O-N 2.86Å
1106	I	33.1	Very low	37.8	Very low	76 Å²	76	104.4 Å²	104.4	39%	0.39	60%	0.595	S	S	.	*			trans	-81.6	104.7	155.9	-62	179.2	0	0	0	107.9	D1097 L1098 V1108	D1097-I1106 HydrophobicContact CB-CD1 4.42Å; L1098-I1106 HydrophobicContact CD1-CD1 3.9Å; L1098-I1106 HydrophobicContact CG-CD1 4Å; I1106-V1108 PolarHBondContact O-N 2.75Å
1107	S	29.8	Very low	40.3	Very low	93 Å²	93	105.7 Å²	105.7	65%	0.65	59%	0.593	S	S	*	*			trans	-69.7	119	163.9	61.9	0	0	0	0	108.8	G1105 T1109	G1105-S1107 PolarHBondContact O-N 2.86Å; S1107-T1109 PolarHBondContact O-N 3.06Å
1108	V	35	Very low	42.9	Very low	81 Å²	81	100.1 Å²	100.1	49%	0.491	56%	0.562	S	S	.	*			trans	-69.1	101.5	169.9	179.3	0	0	0	0	106.9	I1106	I1106-V1108 PolarHBondContact O-N 2.75Å
1109	T	30.2	Very low	45.6	Very low	101 Å²	101	97 Å²	97	62%	0.62	55%	0.545	S	S	*	.			trans	-60.7	140.8	-176	46.6	0	0	0	0	111.2	S1107 Q1111	S1107-T1109 PolarHBondContact O-N 3.06Å; T1109-Q1111 PolarHBondContact O-N 2.81Å
1110	S	34.6	Very low	48.4	Very low	95 Å²	95	91.6 Å²	91.6	66%	0.664	52%	0.52	S	S	*	.			trans	-75	37.8	-167	59.8	0	0	0	0	114.7	T1112	S1110-T1112 VanDerWaalsContact C-N 3.32Å; S1110-T1112 PolarHBondContact O-N 2.78Å
1111	Q	34.4	Very low	51.4	Low	155 Å²	155	80.2 Å²	80.2	72%	0.724	48%	0.477	S	S	*	.			trans	-78.8	86.1	174.3	-69.6	-166.5	-2.5	0	0	110.5	T1109	T1109-Q1111 PolarHBondContact O-N 2.81Å
1112	T	42.8	Very low	54.6	Low	98 Å²	98	78.3 Å²	78.3	60%	0.601	46%	0.464	S	S	*	.			trans	33.9	131.8	148.2	59.8	0	0	0	0	119	S1110 Q1114	S1110-T1112 VanDerWaalsContact C-N 3.32Å; S1110-T1112 PolarHBondContact O-N 2.78Å; T1112-Q1114 PolarHBondContact O-N 2.81Å
1113	N	49.6	Very low	57.7	Low	79 Å²	79	70 Å²	70	42%	0.422	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-61.8	18.8	178.9	-83.7	-44.1	0	0	0	116.6	N1115 H1174	N1113-N1115 VanDerWaalsContact C-N 3.35Å; N1113-N1115 PolarHBondContact O-N 2.79Å; N1113-H1174 PolarHBondContact ND2-CD2 3.32Å
1114	Q	52.7	Low	60.9	Low	163 Å²	163	65.1 Å²	65.1	76%	0.762	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-75.2	-12.6	-170.5	-66.7	-176.9	2.6	0	0	115.2	T1112	T1112-Q1114 PolarHBondContact O-N 2.81Å
1115	N	67	Low	63.9	Low	100 Å²	100	62.1 Å²	62.1	54%	0.535	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-115.6	34.4	-177.1	-96.6	3.7	0	0	0	114.6	I1077 N1113	I1077-N1115 PolarHBondContact N-O 2.81Å; N1113-N1115 VanDerWaalsContact C-N 3.35Å; N1113-N1115 PolarHBondContact O-N 2.79Å
1116	C	75	Confident	66.9	Low	36 Å²	36	58.9 Å²	58.9	24%	0.243	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.9	170.8	-66.5	0	0	0	0	111.7	Y1118	C1116-Y1118 HydrophobicContact CB-CE2 3.93Å
1117	E	85	Confident	69.7	Low	59 Å²	59	55.4 Å²	55.4	28%	0.276	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	117	169.3	-174.8	176.8	-176	0	0	108.7	F1075 I1077 R1195	F1075-E1117 PolarHBondContact N-O 3.4Å; F1075-E1117 PolarHBondContact O-N 3.23Å; I1077-E1117 HydrophobicContact CD1-CB 4.01Å; I1077-E1117 HydrophobicContact CG1-CB 4.02Å; E1117-R1195 IonicContact OE2-CZ 3.58Å; E1117-R1195 IonicContact OE2-NH1 3.73Å; E1117-R1195 PolarHBondContact OE2-NH1 2.71Å
1118	Y	89.2	Confident	72.8	Confident	15 Å²	15	53.4 Å²	53.4	6%	0.059	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	127.5	176.3	-69.2	-83.3	0	0	0	111	S1010 M1012 V1072 V1073 C1116 M1134 H1174	S1010-Y1118 WeakPolarHBondContact O-CD2 3.28Å; M1012-Y1118 HydrophobicContact CB-CE2 4.48Å; M1012-Y1118 HydrophobicContact CG-CD2 3.88Å; M1012-Y1118 HydrophobicContact CG-CE1 4.15Å; M1012-Y1118 HydrophobicContact CG-CE2 3.27Å; M1012-Y1118 VanDerWaalsContact CG-CZ 3.44Å; M1012-Y1118 HydrophobicContact SD-CE2 4.14Å; V1072-Y1118 HydrophobicContact CG1-CD1 4.15Å; V1073-Y1118 WeakPolarHBondContact O-CA 3.32Å; C1116-Y1118 HydrophobicContact CB-CE2 3.93Å; Y1118-M1134 VanDerWaalsContact O-CB 3.25Å; Y1118-M1134 WeakPolarHBondContact O-CB 3.23Å; Y1118-M1134 VanDerWaalsContact O-CG 3.26Å; Y1118-M1134 WeakPolarHBondContact O-CG 3.44Å; Y1118-H1174 HydrophobicContact CE1-CB 4.28Å; Y1118-H1174 VanDerWaalsContact OH-CB 3.29Å; Y1118-H1174 WeakPolarHBondContact OH-CB 3.43Å
1119	S	91.4	Very high	75.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.2	173.8	-67.4	0	0	0	0	110.6	V1073 L1132 M1140	V1073-S1119 PolarHBondContact N-O 3.28Å; V1073-S1119 PolarHBondContact O-N 3.06Å; S1119-L1132 WeakPolarHBondContact CB-O 3.37Å; S1119-M1140 PolarHBondContact OG-SD 3Å
1120	F	93	Very high	78.7	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	120.7	174.5	-158.3	-85.9	0	0	0	108.9	V1038 I1043 A1070 V1072 F1122 L1131 L1132 M1134 L1137	V1038-F1120 HydrophobicContact CG2-CE1 4.36Å; V1038-F1120 HydrophobicContact CG2-CE2 4.31Å; V1038-F1120 HydrophobicContact CG2-CZ 3.52Å; I1043-F1120 HydrophobicContact CD1-CD1 3.62Å; I1043-F1120 HydrophobicContact CD1-CE1 3.44Å; I1043-F1120 VanDerWaalsContact CD1-CE1 3.44Å; I1043-F1120 HydrophobicContact CD1-CZ 4.43Å; I1043-F1120 HydrophobicContact CG1-CD1 4.41Å; I1043-F1120 HydrophobicContact CG1-CE1 3.87Å; I1043-F1120 HydrophobicContact CG1-CZ 4.43Å; I1043-F1120 HydrophobicContact CG2-CD1 4.44Å; I1043-F1120 HydrophobicContact CG2-CE1 4.16Å; I1043-F1120 HydrophobicContact CG2-CE2 4.41Å; I1043-F1120 HydrophobicContact CG2-CZ 4.18Å; A1070-F1120 HydrophobicContact CB-CE1 3.61Å; A1070-F1120 HydrophobicContact CB-CZ 3.71Å; V1072-F1120 HydrophobicContact CG2-CD2 3.8Å; V1072-F1120 HydrophobicContact CG2-CE2 3.93Å; F1120-F1122 HydrophobicContact CD1-CD1 4.43Å; F1120-F1122 HydrophobicContact CE1-CB 4.3Å; F1120-L1131 CarbonylContact O-C 3.55Å; F1120-L1131 WeakPolarHBondContact O-CA 3.4Å; F1120-L1132 HydrophobicContact CB-CB 4.16Å; F1120-L1132 PolarHBondContact N-O 2.93Å; F1120-L1132 PolarHBondContact O-N 2.87Å; F1120-M1134 HydrophobicContact CB-SD 3.91Å; F1120-M1134 HydrophobicContact CD2-CE 4.43Å; F1120-M1134 HydrophobicContact CD2-SD 4.17Å; F1120-L1137 HydrophobicContact CB-CD2 4.43Å
1121	V	94.2	Very high	81.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.3	-179.9	-170.4	0	0	0	0	108.2	A1070 S1071 V1073 F1075 L1131 F1159 V1193	A1070-V1121 CarbonylContact C-O 3.59Å; A1070-V1121 WeakPolarHBondContact CA-O 2.98Å; S1071-V1121 PolarHBondContact N-O 2.76Å; S1071-V1121 PolarHBondContact O-N 3.14Å; V1073-V1121 HydrophobicContact CB-CG2 3.72Å; V1073-V1121 HydrophobicContact CG2-CB 3.98Å; V1073-V1121 HydrophobicContact CG2-CG2 3.55Å; F1075-V1121 HydrophobicContact CE2-CG2 4.11Å; F1075-V1121 HydrophobicContact CZ-CG2 4.02Å; V1121-L1131 HydrophobicContact CG2-CG 4.2Å; V1121-F1159 HydrophobicContact CG1-CE1 4.49Å; V1121-F1159 HydrophobicContact CG1-CZ 4.1Å; V1121-V1193 HydrophobicContact CG1-CG1 4.35Å; V1121-V1193 HydrophobicContact CG1-CG2 4.24Å
1122	F	95	Very high	84.5	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	149.6	174.7	74.5	-94.9	0	0	0	111.8	I1043 I1059 I1067 S1069 A1070 F1120 N1124 A1129 V1130 L1132	I1043-F1122 HydrophobicContact CD1-CD1 3.64Å; I1043-F1122 HydrophobicContact CD1-CE1 3.99Å; I1043-F1122 HydrophobicContact CD1-CG 4.28Å; I1059-F1122 HydrophobicContact CB-CZ 4.2Å; I1059-F1122 HydrophobicContact CD1-CE1 3.72Å; I1059-F1122 HydrophobicContact CD1-CZ 3.64Å; I1059-F1122 HydrophobicContact CG1-CE1 3.96Å; I1059-F1122 HydrophobicContact CG1-CE2 4.38Å; I1059-F1122 HydrophobicContact CG1-CZ 3.69Å; I1059-F1122 HydrophobicContact CG2-CE2 3.59Å; I1059-F1122 HydrophobicContact CG2-CZ 3.44Å; I1059-F1122 VanDerWaalsContact CG2-CZ 3.44Å; I1067-F1122 HydrophobicContact CB-CD2 4.37Å; I1067-F1122 HydrophobicContact CD1-CD2 4.42Å; I1067-F1122 HydrophobicContact CG1-CD2 3.94Å; I1067-F1122 HydrophobicContact CG1-CE2 4.05Å; I1067-F1122 HydrophobicContact CG2-CB 4.03Å; I1067-F1122 HydrophobicContact CG2-CD2 4Å; I1067-F1122 HydrophobicContact CG2-CG 4.27Å; S1069-F1122 CarbonylContact O-C 3.5Å; S1069-F1122 VanDerWaalsContact O-CA 3.24Å; S1069-F1122 WeakPolarHBondContact O-CA 3.46Å; S1069-F1122 WeakPolarHBondContact O-CB 3.27Å; A1070-F1122 HydrophobicContact CB-CB 3.82Å; F1120-F1122 HydrophobicContact CD1-CD1 4.43Å; F1120-F1122 HydrophobicContact CE1-CB 4.3Å; F1122-N1124 HydrophobicContact CE2-CB 4.26Å; F1122-A1129 WeakPolarHBondContact O-CA 3.5Å; F1122-V1130 HydrophobicContact CD1-CB 4.08Å; F1122-V1130 HydrophobicContact CD1-CG1 4.4Å; F1122-V1130 HydrophobicContact CD2-CB 4.31Å; F1122-V1130 HydrophobicContact CE1-CB 3.54Å; F1122-V1130 HydrophobicContact CE1-CG1 3.51Å; F1122-V1130 HydrophobicContact CE1-CG2 4.47Å; F1122-V1130 HydrophobicContact CE2-CB 3.77Å; F1122-V1130 HydrophobicContact CE2-CG1 4.39Å; F1122-V1130 HydrophobicContact CE2-CG2 3.91Å; F1122-V1130 HydrophobicContact CG-CB 4.45Å; F1122-V1130 HydrophobicContact CZ-CB 3.37Å; F1122-V1130 HydrophobicContact CZ-CG1 3.5Å; F1122-V1130 HydrophobicContact CZ-CG2 3.81Å; F1122-V1130 PolarHBondContact N-O 2.99Å; F1122-V1130 PolarHBondContact O-N 3.3Å; F1122-L1132 HydrophobicContact CD1-CD1 4.37Å; F1122-L1132 HydrophobicContact CD1-CG 4.36Å; F1122-L1132 HydrophobicContact CE1-CD1 4.05Å; F1122-L1132 HydrophobicContact CE1-CD2 4.07Å; F1122-L1132 HydrophobicContact CE1-CG 4Å
1123	T	95.2	Very high	86.9	Confident	4 Å²	4	29.4 Å²	29.4	3%	0.025	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	149.8	170.4	61.9	0	0	0	0	110.5	K1068 S1069 Q1128 A1129 L1145 V1157 F1159	K1068-T1123 PolarHBondContact N-O 3.04Å; S1069-T1123 PolarHBondContact O-N 3.05Å; T1123-Q1128 CarbonylContact C-O 3.42Å; T1123-Q1128 VanDerWaalsContact CA-O 3.26Å; T1123-Q1128 WeakPolarHBondContact CA-O 3.32Å; T1123-A1129 HydrophobicContact CG2-CB 4.39Å; T1123-L1145 HydrophobicContact CG2-CD2 3.54Å; T1123-V1157 HydrophobicContact CG2-CG1 3.9Å; T1123-F1159 HydrophobicContact CG2-CE2 4.36Å; T1123-F1159 HydrophobicContact CG2-CZ 4.1Å
1124	N	94.2	Very high	88.8	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.011	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	164.6	-178.6	76.3	20.2	0	0	0	112.3	R1066 F1122 G1126 G1127 Q1128	R1066-N1124 CarbonylContact O-C 3.6Å; R1066-N1124 WeakPolarHBondContact O-CA 3.16Å; R1066-N1124 VanDerWaalsContact O-CB 3.3Å; R1066-N1124 WeakPolarHBondContact O-CB 3.24Å; F1122-N1124 HydrophobicContact CE2-CB 4.26Å; N1124-G1126 PolarHBondContact O-N 3.01Å; N1124-G1126 VanDerWaalsContact O-N 3.1Å; N1124-G1126 VanDerWaalsContact OD1-CA 3.3Å; N1124-G1126 WeakPolarHBondContact OD1-CA 3.08Å; N1124-G1126 PolarHBondContact OD1-N 2.7Å; N1124-G1127 PolarHBondContact O-N 3.24Å; N1124-G1127 VanDerWaalsContact O-N 3.07Å; N1124-G1127 PolarHBondContact OD1-N 3.27Å; N1124-Q1128 PolarHBondContact N-O 2.81Å; N1124-Q1128 PolarHBondContact ND2-OE1 2.94Å; N1124-Q1128 WeakPolarHBondContact OD1-CB 3.25Å; N1124-Q1128 PolarHBondContact OD1-N 3.5Å; N1124-Q1128 VanDerWaalsContact OD1-N 3.1Å
1125	V	92.1	Very high	90.6	Very high	69 Å²	69	19.9 Å²	19.9	42%	0.418	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-1.9	178.6	-58.2	0	0	0	0	114.3	Y1065 R1066 V1154	Y1065-V1125 HydrophobicContact CD1-CG2 4.23Å; R1066-V1125 HydrophobicContact CB-CG1 4.29Å; R1066-V1125 HydrophobicContact CB-CG2 4.12Å; R1066-V1125 PolarHBondContact O-N 3.15Å; V1125-V1154 HydrophobicContact CB-CG1 4.5Å
1126	G	91.2	Very high	91.9	Very high	7 Å²	7	19 Å²	19	7%	0.072	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	10.9	170.1	0	0	0	0	0	113.2	N1124 Q1128	N1124-G1126 PolarHBondContact O-N 3.01Å; N1124-G1126 VanDerWaalsContact O-N 3.1Å; N1124-G1126 VanDerWaalsContact OD1-CA 3.3Å; N1124-G1126 WeakPolarHBondContact OD1-CA 3.08Å; N1124-G1126 PolarHBondContact OD1-N 2.7Å; G1126-Q1128 VanDerWaalsContact C-N 3.34Å; G1126-Q1128 PolarHBondContact O-N 2.83Å
1127	G	92.2	Very high	92.9	Very high	3 Å²	3	17.6 Å²	17.6	3%	0.031	9%	0.094	C	C	.	.	S	Bend	trans	75	19	178.2	0	0	0	0	0	114.8	N1124 L1145 L1146	N1124-G1127 PolarHBondContact O-N 3.24Å; N1124-G1127 VanDerWaalsContact O-N 3.07Å; N1124-G1127 PolarHBondContact OD1-N 3.27Å; G1127-L1145 WeakPolarHBondContact O-CA 3.31Å; G1127-L1145 WeakPolarHBondContact O-CB 3.4Å; G1127-L1145 PolarHBondContact O-N 3.24Å; G1127-L1146 VanDerWaalsContact CA-O 3.26Å; G1127-L1146 WeakPolarHBondContact CA-O 3.18Å; G1127-L1146 PolarHBondContact O-N 2.86Å
1128	Q	94.7	Very high	93.3	Very high	50 Å²	50	23.6 Å²	23.6	23%	0.234	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	145.7	-177.4	-53.6	171.5	-35.4	0	0	111.8	T1123 N1124 G1126 V1130 T1142 L1143	T1123-Q1128 CarbonylContact C-O 3.42Å; T1123-Q1128 VanDerWaalsContact CA-O 3.26Å; T1123-Q1128 WeakPolarHBondContact CA-O 3.32Å; N1124-Q1128 PolarHBondContact N-O 2.81Å; N1124-Q1128 PolarHBondContact ND2-OE1 2.94Å; N1124-Q1128 WeakPolarHBondContact OD1-CB 3.25Å; N1124-Q1128 PolarHBondContact OD1-N 3.5Å; N1124-Q1128 VanDerWaalsContact OD1-N 3.1Å; G1126-Q1128 VanDerWaalsContact C-N 3.34Å; G1126-Q1128 PolarHBondContact O-N 2.83Å; Q1128-V1130 HydrophobicContact CB-CG2 4.4Å; Q1128-T1142 HydrophobicContact CB-CG2 4.36Å; Q1128-L1143 CarbonylContact C-O 3.56Å; Q1128-L1143 VanDerWaalsContact CA-O 3.31Å; Q1128-L1143 WeakPolarHBondContact CA-O 3.47Å
1129	A	94.5	Very high	93.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.5	163.8	0	0	0	0	0	109.8	V35 F1122 T1123 L1143 L1145	V35-A1129 HydrophobicContact CG2-CB 4.31Å; F1122-A1129 WeakPolarHBondContact O-CA 3.5Å; T1123-A1129 HydrophobicContact CG2-CB 4.39Å; A1129-L1143 HydrophobicContact CB-CB 4.42Å; A1129-L1143 PolarHBondContact N-O 2.93Å; A1129-L1143 PolarHBondContact O-N 2.84Å; A1129-L1145 HydrophobicContact CB-CB 4.26Å; A1129-L1145 HydrophobicContact CB-CD2 4.18Å
1130	V	94.9	Very high	93.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.4	-175.2	-178.8	0	0	0	0	109.8	F1122 Q1128 L1132 R1139 T1142	F1122-V1130 HydrophobicContact CD1-CB 4.08Å; F1122-V1130 HydrophobicContact CD1-CG1 4.4Å; F1122-V1130 HydrophobicContact CD2-CB 4.31Å; F1122-V1130 HydrophobicContact CE1-CB 3.54Å; F1122-V1130 HydrophobicContact CE1-CG1 3.51Å; F1122-V1130 HydrophobicContact CE1-CG2 4.47Å; F1122-V1130 HydrophobicContact CE2-CB 3.77Å; F1122-V1130 HydrophobicContact CE2-CG1 4.39Å; F1122-V1130 HydrophobicContact CE2-CG2 3.91Å; F1122-V1130 HydrophobicContact CG-CB 4.45Å; F1122-V1130 HydrophobicContact CZ-CB 3.37Å; F1122-V1130 HydrophobicContact CZ-CG1 3.5Å; F1122-V1130 HydrophobicContact CZ-CG2 3.81Å; F1122-V1130 PolarHBondContact N-O 2.99Å; F1122-V1130 PolarHBondContact O-N 3.3Å; Q1128-V1130 HydrophobicContact CB-CG2 4.4Å; V1130-L1132 HydrophobicContact CG1-CD2 4.16Å; V1130-R1139 HydrophobicContact CG1-CG 4.25Å; V1130-T1142 HydrophobicContact CG2-CG2 4.1Å
1131	L	94.9	Very high	93.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.1	-179.6	-72.4	82.1	0	0	0	110.6	Y33 F1075 F1120 V1121 M1140 D1141 L1143 V1193	Y33-L1131 HydrophobicContact CD1-CD2 3.46Å; Y33-L1131 VanDerWaalsContact CD1-CD2 3.46Å; Y33-L1131 HydrophobicContact CD2-CD2 3.76Å; Y33-L1131 HydrophobicContact CE1-CD2 3.78Å; Y33-L1131 HydrophobicContact CE2-CD2 4.08Å; Y33-L1131 HydrophobicContact CG-CD2 3.45Å; Y33-L1131 VanDerWaalsContact CG-CD2 3.45Å; F1075-L1131 HydrophobicContact CE1-CD2 4.39Å; F1075-L1131 HydrophobicContact CE2-CD2 4.3Å; F1075-L1131 HydrophobicContact CZ-CD2 3.77Å; F1120-L1131 CarbonylContact O-C 3.55Å; F1120-L1131 WeakPolarHBondContact O-CA 3.4Å; V1121-L1131 HydrophobicContact CG2-CG 4.2Å; L1131-M1140 HydrophobicContact CB-CB 4.35Å; L1131-M1140 PolarHBondContact O-N 2.73Å; L1131-D1141 HydrophobicContact CB-CB 4.29Å; L1131-D1141 HydrophobicContact CD1-CB 4.37Å; L1131-D1141 PolarHBondContact N-O 3.31Å; L1131-D1141 VanDerWaalsContact N-O 3.15Å; L1131-D1141 PolarHBondContact O-N 2.78Å; L1131-L1143 HydrophobicContact CD1-CD1 3.76Å; L1131-L1143 HydrophobicContact CD1-CG 4.13Å; L1131-V1193 HydrophobicContact CD1-CG1 4.12Å; L1131-V1193 HydrophobicContact CD2-CG1 4.24Å
1132	L	95.2	Very high	93.6	Very high	3 Å²	3	33 Å²	33	2%	0.016	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	145.4	173.2	-42.5	176.9	0	0	0	111.4	I1043 A1057 I1059 S1119 F1120 F1122 V1130 L1137 R1138 R1139	I1043-L1132 HydrophobicContact CD1-CD1 3.62Å; A1057-L1132 HydrophobicContact CB-CD1 3.95Å; I1059-L1132 HydrophobicContact CD1-CD1 4.26Å; I1059-L1132 HydrophobicContact CD1-CD2 4.42Å; S1119-L1132 WeakPolarHBondContact CB-O 3.37Å; F1120-L1132 HydrophobicContact CB-CB 4.16Å; F1120-L1132 PolarHBondContact N-O 2.93Å; F1120-L1132 PolarHBondContact O-N 2.87Å; F1122-L1132 HydrophobicContact CD1-CD1 4.37Å; F1122-L1132 HydrophobicContact CD1-CG 4.36Å; F1122-L1132 HydrophobicContact CE1-CD1 4.05Å; F1122-L1132 HydrophobicContact CE1-CD2 4.07Å; F1122-L1132 HydrophobicContact CE1-CG 4Å; V1130-L1132 HydrophobicContact CG1-CD2 4.16Å; L1132-L1137 HydrophobicContact CD1-CB 4.23Å; L1132-L1137 HydrophobicContact CD1-CD2 4.38Å; L1132-R1138 CarbonylContact C-O 3.56Å; L1132-R1138 VanDerWaalsContact CA-O 3.23Å; L1132-R1138 WeakPolarHBondContact CA-O 3.29Å; L1132-R1139 HydrophobicContact CD2-CB 4.2Å; L1132-R1139 HydrophobicContact CD2-CG 4.42Å
1133	S	94.1	Very high	93.5	Very high	23 Å²	23	33.8 Å²	33.8	16%	0.161	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	147.9	177.3	78.1	0	0	0	0	112.2	L1137 R1138 M1140	S1133-L1137 VanDerWaalsContact O-CA 3.23Å; S1133-L1137 WeakPolarHBondContact O-CA 3.43Å; S1133-L1137 PolarHBondContact O-N 3.23Å; S1133-R1138 PolarHBondContact N-O 2.95Å; S1133-R1138 PolarHBondContact OG-N 2.82Å; S1133-M1140 WeakPolarHBondContact CA-SD 3.33Å; S1133-M1140 PolarHBondContact N-SD 3.33Å
1134	M	90	Very high	93.3	Very high	18 Å²	18	38.2 Å²	38.2	9%	0.089	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	141.5	171.6	-61.8	-75.8	-92.9	0	0	111.3	I1006 N1011 V1072 Y1118 F1120 Q1136 L1137	I1006-M1134 HydrophobicContact CD1-CE 3.56Å; I1006-M1134 HydrophobicContact CG1-CE 4.21Å; I1006-M1134 HydrophobicContact CG2-CE 4.11Å; N1011-M1134 HydrophobicContact CB-CB 3.82Å; V1072-M1134 HydrophobicContact CG1-CE 4.02Å; V1072-M1134 HydrophobicContact CG2-CE 3.87Å; Y1118-M1134 VanDerWaalsContact O-CB 3.25Å; Y1118-M1134 WeakPolarHBondContact O-CB 3.23Å; Y1118-M1134 VanDerWaalsContact O-CG 3.26Å; Y1118-M1134 WeakPolarHBondContact O-CG 3.44Å; F1120-M1134 HydrophobicContact CB-SD 3.91Å; F1120-M1134 HydrophobicContact CD2-CE 4.43Å; F1120-M1134 HydrophobicContact CD2-SD 4.17Å; M1134-Q1136 PolarHBondContact O-OE1 3.44Å; M1134-L1137 HydrophobicContact SD-CD2 4.21Å
1135	P	90.3	Very high	93.3	Very high	24 Å²	24	39 Å²	39	16%	0.156	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	cis	-84.4	-5.5	-7	34	-37.3	0	0	0	114.3	L1045 F1055 L1137	L1045-P1135 HydrophobicContact CD1-CB 4.1Å; L1045-P1135 VanDerWaalsContact CD1-O 3.29Å; L1045-P1135 WeakPolarHBondContact CD1-O 3.2Å; F1055-P1135 HydrophobicContact CD2-CB 3.95Å; F1055-P1135 HydrophobicContact CD2-CG 4.41Å; F1055-P1135 WeakPolarHBondContact CD2-O 3.25Å; F1055-P1135 HydrophobicContact CE2-CB 3.74Å; F1055-P1135 HydrophobicContact CE2-CG 3.72Å; F1055-P1135 VanDerWaalsContact CG-O 3.3Å; F1055-P1135 WeakPolarHBondContact CG-O 3.03Å; F1055-P1135 HydrophobicContact CZ-CG 4.37Å; P1135-L1137 PolarHBondContact O-N 3.4Å; P1135-L1137 VanDerWaalsContact O-N 3.15Å
1136	Q	94.1	Very high	93.3	Very high	82 Å²	82	36.4 Å²	36.4	38%	0.383	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-9.8	-164.9	-57.3	80.9	3.1	0	0	115.3	F1055 M1134 R1138	F1055-Q1136 HydrophobicContact CD1-CB 4.34Å; F1055-Q1136 HydrophobicContact CE1-CB 4.13Å; F1055-Q1136 HydrophobicContact CE1-CG 3.95Å; F1055-Q1136 HydrophobicContact CZ-CG 4Å; M1134-Q1136 PolarHBondContact O-OE1 3.44Å; Q1136-R1138 HydrophobicContact CB-CG 4.05Å; Q1136-R1138 PolarHBondContact O-N 2.83Å
1137	L	95.3	Very high	93.2	Very high	7 Å²	7	38 Å²	38	4%	0.037	18%	0.178	C	C	.	.			trans	55	32.8	-176.7	-54.5	179.5	0	0	0	114.2	I1043 L1045 F1055 A1057 F1120 L1132 S1133 M1134 P1135	I1043-L1137 HydrophobicContact CB-CD1 4.26Å; I1043-L1137 HydrophobicContact CG2-CD1 3.78Å; I1043-L1137 HydrophobicContact CG2-CD2 4.03Å; L1045-L1137 HydrophobicContact CD1-CD2 4.38Å; L1045-L1137 HydrophobicContact CD1-CG 4.39Å; L1045-L1137 HydrophobicContact CG-CD1 4.14Å; L1045-L1137 HydrophobicContact CG-CD2 4.42Å; L1045-L1137 HydrophobicContact CG-CG 4.37Å; F1055-L1137 HydrophobicContact CB-CD1 4.16Å; F1055-L1137 HydrophobicContact CB-CG 4.22Å; A1057-L1137 HydrophobicContact CB-CB 3.96Å; A1057-L1137 HydrophobicContact CB-CD1 4.36Å; F1120-L1137 HydrophobicContact CB-CD2 4.43Å; L1132-L1137 HydrophobicContact CD1-CB 4.23Å; L1132-L1137 HydrophobicContact CD1-CD2 4.38Å; S1133-L1137 VanDerWaalsContact O-CA 3.23Å; S1133-L1137 WeakPolarHBondContact O-CA 3.43Å; S1133-L1137 PolarHBondContact O-N 3.23Å; M1134-L1137 HydrophobicContact SD-CD2 4.21Å; P1135-L1137 PolarHBondContact O-N 3.4Å; P1135-L1137 VanDerWaalsContact O-N 3.15Å
1138	R	94.5	Very high	92.9	Very high	184 Å²	184	40.2 Å²	40.2	69%	0.694	19%	0.193	S	C	*	.			trans	-80.6	134.6	175.7	-64.5	-178.7	179.5	-174.9	0.4	109.6	L1132 S1133 Q1136 M1140	L1132-R1138 CarbonylContact C-O 3.56Å; L1132-R1138 VanDerWaalsContact CA-O 3.23Å; L1132-R1138 WeakPolarHBondContact CA-O 3.29Å; S1133-R1138 PolarHBondContact N-O 2.95Å; S1133-R1138 PolarHBondContact OG-N 2.82Å; Q1136-R1138 HydrophobicContact CB-CG 4.05Å; Q1136-R1138 PolarHBondContact O-N 2.83Å; R1138-M1140 PolarHBondContact O-N 3.24Å
1139	R	94	Very high	92.6	Very high	111 Å²	111	43.9 Å²	43.9	42%	0.419	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	124	175	-163	-169.5	-154.7	99.9	8.8	109.8	D1063 V1130 L1132 T1142	D1063-R1139 IonicContact OD1-CZ 3.04Å; D1063-R1139 IonicContact OD1-NH1 3.57Å; D1063-R1139 PolarHBondContact OD1-NH1 2.79Å; D1063-R1139 IonicContact OD1-NH2 3.66Å; D1063-R1139 IonicContact OD2-CZ 2.76Å; D1063-R1139 IonicContact OD2-NH1 3.55Å; D1063-R1139 PolarHBondContact OD2-NH1 3.26Å; D1063-R1139 IonicContact OD2-NH2 3.92Å; D1063-R1139 PolarHBondContact OD2-NH2 2.68Å; V1130-R1139 HydrophobicContact CG1-CG 4.25Å; L1132-R1139 HydrophobicContact CD2-CB 4.2Å; L1132-R1139 HydrophobicContact CD2-CG 4.42Å; R1139-T1142 VanDerWaalsContact CZ-OG1 3.23Å; R1139-T1142 PolarHBondContact NE-OG1 2.91Å; R1139-T1142 PolarHBondContact NH2-OG1 3.43Å
1140	M	92.5	Very high	92.2	Very high	34 Å²	34	44.9 Å²	44.9	17%	0.167	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	-40.4	176.6	-66.3	178.8	75.9	0	0	111.6	Y33 S1119 L1131 S1133 R1138	Y33-M1140 HydrophobicContact CE2-CE 4.15Å; Y33-M1140 WeakPolarHBondContact OH-CE 3.39Å; S1119-M1140 PolarHBondContact OG-SD 3Å; L1131-M1140 HydrophobicContact CB-CB 4.35Å; L1131-M1140 PolarHBondContact O-N 2.73Å; S1133-M1140 WeakPolarHBondContact CA-SD 3.33Å; S1133-M1140 PolarHBondContact N-SD 3.33Å; R1138-M1140 PolarHBondContact O-N 3.24Å
1141	D	92.9	Very high	91.9	Very high	26 Å²	26	49.8 Å²	49.8	14%	0.139	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	166.8	-173.9	-132.2	-51.9	0	0	0	112.1	S31 R32 Y33 L1131	S31-D1141 PolarHBondContact OG-OD1 2.79Å; S31-D1141 PolarHBondContact OG-OD2 2.97Å; R32-D1141 PolarHBondContact N-OD2 3.02Å; Y33-D1141 HydrophobicContact CD2-CB 3.95Å; L1131-D1141 HydrophobicContact CB-CB 4.29Å; L1131-D1141 HydrophobicContact CD1-CB 4.37Å; L1131-D1141 PolarHBondContact N-O 3.31Å; L1131-D1141 VanDerWaalsContact N-O 3.15Å; L1131-D1141 PolarHBondContact O-N 2.78Å
1142	T	93.6	Very high	91.5	Very high	47 Å²	47	53.4 Å²	53.4	29%	0.288	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	113.4	175.3	-67	0	0	0	0	110.1	Q1128 V1130 R1139	Q1128-T1142 HydrophobicContact CB-CG2 4.36Å; V1130-T1142 HydrophobicContact CG2-CG2 4.1Å; R1139-T1142 VanDerWaalsContact CZ-OG1 3.23Å; R1139-T1142 PolarHBondContact NE-OG1 2.91Å; R1139-T1142 PolarHBondContact NH2-OG1 3.43Å
1143	L	93.1	Very high	91.4	Very high	15 Å²	15	53.2 Å²	53.2	8%	0.079	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.1	-171.4	-47.5	175.7	0	0	0	108.7	S31 Y33 V35 Q1128 A1129 L1131 V1193	S31-L1143 WeakPolarHBondContact OG-CD2 3.37Å; Y33-L1143 VanDerWaalsContact O-CD2 3.3Å; Y33-L1143 WeakPolarHBondContact O-CD2 3.49Å; V35-L1143 HydrophobicContact CG2-CB 3.97Å; V35-L1143 HydrophobicContact CG2-CD1 4.05Å; Q1128-L1143 CarbonylContact C-O 3.56Å; Q1128-L1143 VanDerWaalsContact CA-O 3.31Å; Q1128-L1143 WeakPolarHBondContact CA-O 3.47Å; A1129-L1143 HydrophobicContact CB-CB 4.42Å; A1129-L1143 PolarHBondContact N-O 2.93Å; A1129-L1143 PolarHBondContact O-N 2.84Å; L1131-L1143 HydrophobicContact CD1-CD1 3.76Å; L1131-L1143 HydrophobicContact CD1-CG 4.13Å; L1143-V1193 HydrophobicContact CD1-CG1 4.24Å
1144	H	92.2	Very high	91.3	Very high	97 Å²	97	52.6 Å²	52.6	45%	0.449	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	139.8	164.1	-170.3	-128.2	0	0	0	109	E23 L1146	E23-H1144 IonicContact OE2-CE1 3.97Å; E23-H1144 PolarHBondContact OE2-CE1 3.1Å; E23-H1144 VanDerWaalsContact OE2-CE1 3.23Å; E23-H1144 IonicContact OE2-ND1 3.69Å; E23-H1144 PolarHBondContact OE2-ND1 3.3Å; H1144-L1146 PolarHBondContact NE2-O 2.91Å; H1144-L1146 VanDerWaalsContact NE2-O 3.14Å
1145	L	92.6	Very high	91.3	Very high	18 Å²	18	54.7 Å²	54.7	9%	0.094	28%	0.277	C	S	.	.			trans	-131.3	-41.4	-178.9	170.8	62.7	0	0	0	111.4	V35 T1123 G1127 A1129 Y1181 F1191	V35-L1145 HydrophobicContact CB-CD1 4.48Å; V35-L1145 HydrophobicContact CG1-CD1 3.55Å; V35-L1145 HydrophobicContact CG2-CB 4.34Å; V35-L1145 HydrophobicContact CG2-CD1 4.14Å; T1123-L1145 HydrophobicContact CG2-CD2 3.54Å; G1127-L1145 WeakPolarHBondContact O-CA 3.31Å; G1127-L1145 WeakPolarHBondContact O-CB 3.4Å; G1127-L1145 PolarHBondContact O-N 3.24Å; A1129-L1145 HydrophobicContact CB-CB 4.26Å; A1129-L1145 HydrophobicContact CB-CD2 4.18Å; L1145-Y1181 HydrophobicContact CD1-CE1 4.34Å; L1145-F1191 HydrophobicContact CD1-CB 4.4Å; L1145-F1191 HydrophobicContact CD1-CD1 4.33Å; L1145-F1191 HydrophobicContact CD1-CD2 3.86Å; L1145-F1191 HydrophobicContact CD1-CE2 4.19Å; L1145-F1191 HydrophobicContact CD1-CG 3.94Å; L1145-F1191 HydrophobicContact CD2-CE2 4.14Å; L1145-F1191 HydrophobicContact CD2-CZ 4.09Å
1146	L	92.9	Very high	91.4	Very high	15 Å²	15	54.4 Å²	54.4	8%	0.079	28%	0.276	C	S	.	.	S	Bend	trans	-147.8	155	-176.5	-75.7	168.7	0	0	0	110.5	G1127 H1144 S1148 A1153 V1154 V1157 Y1181	G1127-L1146 VanDerWaalsContact CA-O 3.26Å; G1127-L1146 WeakPolarHBondContact CA-O 3.18Å; G1127-L1146 PolarHBondContact O-N 2.86Å; H1144-L1146 PolarHBondContact NE2-O 2.91Å; H1144-L1146 VanDerWaalsContact NE2-O 3.14Å; L1146-S1148 PolarHBondContact O-N 3.48Å; L1146-A1153 HydrophobicContact CD1-CB 3.72Å; L1146-A1153 HydrophobicContact CD2-CB 3.66Å; L1146-A1153 HydrophobicContact CG-CB 4.28Å; L1146-V1154 HydrophobicContact CB-CG2 3.85Å; L1146-V1154 HydrophobicContact CD1-CG2 4.01Å; L1146-V1157 HydrophobicContact CD1-CG2 3.99Å; L1146-Y1181 HydrophobicContact CD1-CD1 4.43Å; L1146-Y1181 HydrophobicContact CD1-CD2 4.42Å; L1146-Y1181 HydrophobicContact CD1-CG 4.2Å; L1146-Y1181 HydrophobicContact CD2-CD2 3.93Å; L1146-Y1181 HydrophobicContact CD2-CE1 4.3Å; L1146-Y1181 HydrophobicContact CD2-CE2 3.61Å; L1146-Y1181 HydrophobicContact CD2-CG 4.4Å
1147	D	87.8	Confident	91.4	Very high	40 Å²	40	50.9 Å²	50.9	21%	0.214	26%	0.26	C	S	.	.			trans	-66.2	126.1	165.3	-172.4	-11.7	0	0	0	109.9	H1149 D1150 V1154	D1147-H1149 PolarHBondContact O-N 3.5Å; D1147-H1149 VanDerWaalsContact O-N 3.08Å; D1147-H1149 IonicContact OD1-CE1 3.91Å; D1147-H1149 IonicContact OD1-CG 3.63Å; D1147-H1149 PolarHBondContact OD1-N 3.32Å; D1147-H1149 IonicContact OD1-ND1 2.7Å; D1147-H1149 PolarHBondContact OD1-ND1 2.9Å; D1147-H1149 IonicContact OD2-ND1 3.02Å; D1147-D1150 PolarHBondContact O-N 3.41Å; D1147-V1154 WeakPolarHBondContact O-CG2 3.38Å
1148	S	87.5	Confident	91.4	Very high	50 Å²	50	52.2 Å²	52.2	35%	0.35	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-22	171.1	63.1	0	0	0	0	115.4	L1146	L1146-S1148 PolarHBondContact O-N 3.48Å
1149	H	88.4	Confident	91.3	Very high	127 Å²	127	44 Å²	44	59%	0.588	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-23.1	176.2	-58	85.4	0	0	0	112.8	A18 D1147 V1151	A18-H1149 HydrophobicContact CB-CB 3.64Å; A18-H1149 WeakPolarHBondContact CB-O 3.1Å; D1147-H1149 PolarHBondContact O-N 3.5Å; D1147-H1149 VanDerWaalsContact O-N 3.08Å; D1147-H1149 IonicContact OD1-CE1 3.91Å; D1147-H1149 IonicContact OD1-CG 3.63Å; D1147-H1149 PolarHBondContact OD1-N 3.32Å; D1147-H1149 IonicContact OD1-ND1 2.7Å; D1147-H1149 PolarHBondContact OD1-ND1 2.9Å; D1147-H1149 IonicContact OD2-ND1 3.02Å; H1149-V1151 VanDerWaalsContact C-N 3.28Å; H1149-V1151 PolarHBondContact O-N 2.71Å
1150	D	86	Confident	91.2	Very high	21 Å²	21	38.9 Å²	38.9	11%	0.112	22%	0.219	C	C	.	.			trans	-78.9	80.8	173.8	-170.8	-13.7	0	0	0	110.2	D1147 V1152 A1153 V1154	D1147-D1150 PolarHBondContact O-N 3.41Å; D1150-V1152 PolarHBondContact O-N 3.32Å; D1150-V1152 PolarHBondContact OD1-N 3.45Å; D1150-A1153 HydrophobicContact CB-CB 4.22Å; D1150-A1153 VanDerWaalsContact CG-CB 3.46Å; D1150-A1153 PolarHBondContact O-N 3.44Å; D1150-A1153 PolarHBondContact OD1-N 2.99Å; D1150-A1153 VanDerWaalsContact OD2-CB 3.28Å; D1150-A1153 WeakPolarHBondContact OD2-CB 3.43Å; D1150-V1154 VanDerWaalsContact O-CB 3.26Å; D1150-V1154 WeakPolarHBondContact O-CB 3.4Å; D1150-V1154 VanDerWaalsContact O-CG2 3.24Å; D1150-V1154 WeakPolarHBondContact O-CG2 3.44Å; D1150-V1154 PolarHBondContact O-N 3.29Å
1151	V	87.1	Confident	90.9	Very high	104 Å²	104	39.9 Å²	39.9	63%	0.63	22%	0.223	S	C	*	.	H	α-helix	trans	-59.8	-27.5	178.2	-176	0	0	0	0	111.5	H1149 S1155	H1149-V1151 VanDerWaalsContact C-N 3.28Å; H1149-V1151 PolarHBondContact O-N 2.71Å; V1151-S1155 WeakPolarHBondContact O-CB 3.47Å; V1151-S1155 PolarHBondContact O-N 2.74Å; V1151-S1155 PolarHBondContact O-OG 3.29Å
1152	V	88	Confident	90.5	Very high	75 Å²	75	40.9 Å²	40.9	46%	0.455	23%	0.231	S	C	.	.	H	α-helix	trans	-73.1	-55.3	-179.9	-179.7	0	0	0	0	109.7	D1150 V1154 S1155 S1156	D1150-V1152 PolarHBondContact O-N 3.32Å; D1150-V1152 PolarHBondContact OD1-N 3.45Å; V1152-V1154 PolarHBondContact O-N 3.37Å; V1152-S1155 PolarHBondContact O-N 2.84Å; V1152-S1155 PolarHBondContact O-OG 2.86Å; V1152-S1156 WeakPolarHBondContact O-CB 3.38Å; V1152-S1156 PolarHBondContact O-N 3.31Å; V1152-S1156 PolarHBondContact O-OG 3.4Å
1153	A	91.6	Very high	90.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-45.9	177.6	0	0	0	0	0	111.6	L1146 D1150 S1155 S1156 V1157 Y1181 Q1182	L1146-A1153 HydrophobicContact CD1-CB 3.72Å; L1146-A1153 HydrophobicContact CD2-CB 3.66Å; L1146-A1153 HydrophobicContact CG-CB 4.28Å; D1150-A1153 HydrophobicContact CB-CB 4.22Å; D1150-A1153 VanDerWaalsContact CG-CB 3.46Å; D1150-A1153 PolarHBondContact O-N 3.44Å; D1150-A1153 PolarHBondContact OD1-N 2.99Å; D1150-A1153 VanDerWaalsContact OD2-CB 3.28Å; D1150-A1153 WeakPolarHBondContact OD2-CB 3.43Å; A1153-S1155 VanDerWaalsContact C-N 3.33Å; A1153-S1155 PolarHBondContact O-N 2.77Å; A1153-S1156 WeakPolarHBondContact CA-OG 3.47Å; A1153-S1156 PolarHBondContact O-N 3.02Å; A1153-S1156 PolarHBondContact O-OG 3.05Å; A1153-V1157 WeakPolarHBondContact O-CG2 3.48Å; A1153-V1157 PolarHBondContact O-N 2.9Å; A1153-Y1181 HydrophobicContact CB-CD2 3.98Å; A1153-Q1182 WeakPolarHBondContact CA-O 3.35Å; A1153-Q1182 PolarHBondContact N-O 2.91Å
1154	V	92.2	Very high	89.4	Confident	10 Å²	10	38.9 Å²	38.9	6%	0.061	22%	0.221	C	C	.	.	H	α-helix	trans	-65.4	-35.2	180	173.5	0	0	0	0	111.8	K1068 V1125 L1146 D1147 D1150 V1152	K1068-V1154 WeakPolarHBondContact CG-O 3.44Å; V1125-V1154 HydrophobicContact CB-CG1 4.5Å; L1146-V1154 HydrophobicContact CB-CG2 3.85Å; L1146-V1154 HydrophobicContact CD1-CG2 4.01Å; D1147-V1154 WeakPolarHBondContact O-CG2 3.38Å; D1150-V1154 VanDerWaalsContact O-CB 3.26Å; D1150-V1154 WeakPolarHBondContact O-CB 3.4Å; D1150-V1154 VanDerWaalsContact O-CG2 3.24Å; D1150-V1154 WeakPolarHBondContact O-CG2 3.44Å; D1150-V1154 PolarHBondContact O-N 3.29Å; V1152-V1154 PolarHBondContact O-N 3.37Å
1155	S	90	Very high	88.4	Confident	61 Å²	61	36.7 Å²	36.7	43%	0.427	21%	0.214	S	C	.	.	H	α-helix	trans	-86.6	-3.9	179.7	76.5	0	0	0	0	114.8	K1068 V1151 V1152 A1153	K1068-S1155 VanDerWaalsContact CE-C 3.45Å; K1068-S1155 WeakPolarHBondContact CE-O 3.44Å; K1068-S1155 PolarHBondContact NZ-O 2.67Å; V1151-S1155 WeakPolarHBondContact O-CB 3.47Å; V1151-S1155 PolarHBondContact O-N 2.74Å; V1151-S1155 PolarHBondContact O-OG 3.29Å; V1152-S1155 PolarHBondContact O-N 2.84Å; V1152-S1155 PolarHBondContact O-OG 2.86Å; A1153-S1155 VanDerWaalsContact C-N 3.33Å; A1153-S1155 PolarHBondContact O-N 2.77Å
1156	S	93.7	Very high	87.2	Confident	19 Å²	19	40 Å²	40	13%	0.133	23%	0.232	C	C	.	.	H	α-helix	trans	-107.7	-4.2	-177.6	64.9	0	0	0	0	113.5	Y494 V1152 A1153 V1158 Q1182	Y494-S1156 VanDerWaalsContact OH-CB 3.23Å; Y494-S1156 WeakPolarHBondContact OH-CB 3.47Å; Y494-S1156 PolarHBondContact OH-O 2.89Å; V1152-S1156 WeakPolarHBondContact O-CB 3.38Å; V1152-S1156 PolarHBondContact O-N 3.31Å; V1152-S1156 PolarHBondContact O-OG 3.4Å; A1153-S1156 WeakPolarHBondContact CA-OG 3.47Å; A1153-S1156 PolarHBondContact O-N 3.02Å; A1153-S1156 PolarHBondContact O-OG 3.05Å; S1156-V1158 PolarHBondContact O-N 3.07Å; S1156-Q1182 WeakPolarHBondContact OG-CB 3.11Å; S1156-Q1182 PolarHBondContact OG-N 3.41Å
1157	V	94.6	Very high	85.7	Confident	8 Å²	8	40.9 Å²	40.9	5%	0.048	24%	0.238	C	C	.	.			trans	-57	121.3	-179.5	-171.2	0	0	0	0	113.4	S1069 T1123 L1146 A1153 L1180 F1191	S1069-V1157 VanDerWaalsContact CB-O 3.29Å; S1069-V1157 WeakPolarHBondContact CB-O 3.49Å; S1069-V1157 PolarHBondContact OG-O 3.3Å; T1123-V1157 HydrophobicContact CG2-CG1 3.9Å; L1146-V1157 HydrophobicContact CD1-CG2 3.99Å; A1153-V1157 WeakPolarHBondContact O-CG2 3.48Å; A1153-V1157 PolarHBondContact O-N 2.9Å; V1157-L1180 VanDerWaalsContact CA-O 3.32Å; V1157-L1180 WeakPolarHBondContact CA-O 3.33Å; V1157-F1191 HydrophobicContact CG1-CE1 3.99Å; V1157-F1191 HydrophobicContact CG1-CZ 3.95Å
1158	V	93.4	Very high	84.3	Confident	35 Å²	35	44.8 Å²	44.8	21%	0.212	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	143.6	173.9	67.8	0	0	0	0	110.5	Y494 S1156 G1179 L1180	Y494-V1158 HydrophobicContact CD2-CG1 4.08Å; Y494-V1158 HydrophobicContact CE2-CG1 3.62Å; S1156-V1158 PolarHBondContact O-N 3.07Å; V1158-G1179 CarbonylContact O-C 3.51Å; V1158-G1179 WeakPolarHBondContact O-CA 3.41Å; V1158-L1180 HydrophobicContact CG1-CB 3.97Å; V1158-L1180 PolarHBondContact N-O 2.96Å; V1158-L1180 PolarHBondContact O-N 3.27Å
1159	F	92.9	Very high	82.9	Confident	11 Å²	11	47 Å²	47	5%	0.048	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	143.5	171.9	-74.9	-75.3	0	0	0	110.6	S1069 V1121 T1123 F1191	S1069-F1159 WeakPolarHBondContact OG-CD2 3.49Å; V1121-F1159 HydrophobicContact CG1-CE1 4.49Å; V1121-F1159 HydrophobicContact CG1-CZ 4.1Å; T1123-F1159 HydrophobicContact CG2-CE2 4.36Å; T1123-F1159 HydrophobicContact CG2-CZ 4.1Å; F1159-F1191 HydrophobicContact CE1-CE2 4.19Å; F1159-F1191 HydrophobicContact CE1-CZ 4.12Å; F1159-F1191 HydrophobicContact CZ-CZ 4.48Å
1160	S	91.9	Very high	81.1	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.021	27%	0.27	C	S	.	.			trans	-57.6	153.7	177	55.1	0	0	0	0	113.4	L496 P1176 L1178	L496-S1160 WeakPolarHBondContact O-CA 3.17Å; L496-S1160 WeakPolarHBondContact O-CB 3.26Å; S1160-P1176 WeakPolarHBondContact OG-CB 3.5Å; S1160-P1176 WeakPolarHBondContact OG-CG 3.34Å; S1160-L1178 WeakPolarHBondContact CB-O 3.46Å; S1160-L1178 PolarHBondContact N-O 3.15Å; S1160-L1178 PolarHBondContact OG-O 3.02Å
1161	Q	87.6	Confident	79.6	Confident	55 Å²	55	48 Å²	48	26%	0.257	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	150	179.6	-60.7	-176.5	-6.9	0	0	110	N495 L496 I497 T498	N495-Q1161 VanDerWaalsContact ND2-CD 3.29Å; N495-Q1161 PolarHBondContact ND2-OE1 2.93Å; L496-Q1161 PolarHBondContact O-N 2.94Å; I497-Q1161 CarbonylContact C-O 3.5Å; I497-Q1161 WeakPolarHBondContact CA-O 3.47Å; I497-Q1161 HydrophobicContact CD1-CB 4.2Å; T498-Q1161 PolarHBondContact N-O 3.04Å; T498-Q1161 PolarHBondContact OG1-O 3.15Å; T498-Q1161 VanDerWaalsContact OG1-O 3.11Å
1162	P	84.5	Confident	78.5	Confident	47 Å²	47	44.5 Å²	44.5	31%	0.305	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	136.3	170.9	31.2	-32.6	0	0	0	110.5	T498 Y1172	T498-P1162 CarbonylContact O-C 3.58Å; T498-P1162 WeakPolarHBondContact O-CA 3.47Å; P1162-Y1172 HydrophobicContact CB-CE2 4.21Å; P1162-Y1172 WeakPolarHBondContact CB-OH 3.11Å
1163	G	83.4	Confident	77.6	Confident	2 Å²	2	42.1 Å²	42.1	2%	0.021	25%	0.25	C	C	.	.	S	Bend	trans	-84.8	-20.9	179.4	0	0	0	0	0	114.7	T498 D649	T498-G1163 PolarHBondContact O-N 3.33Å; D649-G1163 PolarHBondContact N-O 3.17Å
1164	S	78.4	Confident	76.3	Confident	19 Å²	19	43 Å²	43	13%	0.133	25%	0.254	C	S	.	.			trans	-119.7	143.2	175.4	-176.7	0	0	0	0	112.2	D649 N1166	D649-S1164 WeakPolarHBondContact OD1-CA 3.43Å; D649-S1164 VanDerWaalsContact OD1-CB 3.24Å; D649-S1164 WeakPolarHBondContact OD1-CB 3.46Å; D649-S1164 PolarHBondContact OD1-OG 2.71Å; S1164-N1166 VanDerWaalsContact C-N 3.35Å; S1164-N1166 PolarHBondContact OG-N 3.24Å
1165	T	71.6	Confident	74.9	Confident	51 Å²	51	42.9 Å²	42.9	31%	0.313	25%	0.254	S	S	.	.			trans	-87.5	-3.2	172.6	63.8	0	0	0	0	113.5	V648 D649 S1017 V1167	V648-T1165 HydrophobicContact CG1-CG2 3.69Å; D649-T1165 PolarHBondContact OD1-N 3.12Å; D649-T1165 WeakPolarHBondContact OD2-CB 3.46Å; D649-T1165 WeakPolarHBondContact OD2-CG2 3.36Å; D649-T1165 PolarHBondContact OD2-N 3.13Å; D649-T1165 PolarHBondContact OD2-OG1 3.01Å; S1017-T1165 WeakPolarHBondContact OG-CB 3.43Å; S1017-T1165 PolarHBondContact OG-O 2.84Å; T1165-V1167 PolarHBondContact O-N 3.06Å; T1165-V1167 VanDerWaalsContact O-N 3.12Å
1166	N	67.3	Low	73.8	Confident	87 Å²	87	40.4 Å²	40.4	47%	0.465	24%	0.237	S	C	.	.			trans	-84.4	86.2	-175.7	-168.2	-4.6	0	0	0	112.4	S1164 N1168 N1169	S1164-N1166 VanDerWaalsContact C-N 3.35Å; S1164-N1166 PolarHBondContact OG-N 3.24Å; N1166-N1168 PolarHBondContact O-N 3.08Å; N1166-N1168 WeakPolarHBondContact OD1-CB 3.24Å; N1166-N1168 PolarHBondContact OD1-N 3.05Å; N1166-N1169 PolarHBondContact O-N 3.15Å
1167	V	62.8	Low	72.9	Confident	34 Å²	34	39.7 Å²	39.7	21%	0.206	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.4	178.7	178.8	0	0	0	0	113.4	T1165 N1169 Y1172 H1174	T1165-V1167 PolarHBondContact O-N 3.06Å; T1165-V1167 VanDerWaalsContact O-N 3.12Å; V1167-N1169 PolarHBondContact O-N 2.87Å; V1167-Y1172 HydrophobicContact CG2-CE1 4.42Å; V1167-H1174 VanDerWaalsContact CG1-CE1 3.42Å; V1167-H1174 WeakPolarHBondContact CG1-CE1 3.23Å; V1167-H1174 WeakPolarHBondContact CG1-NE2 3.33Å
1168	N	57.9	Low	72.7	Confident	121 Å²	121	39.3 Å²	39.3	65%	0.647	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.7	-174.4	-65	-23.9	0	0	0	113.7	N1166 S1170	N1166-N1168 PolarHBondContact O-N 3.08Å; N1166-N1168 WeakPolarHBondContact OD1-CB 3.24Å; N1166-N1168 PolarHBondContact OD1-N 3.05Å; N1168-S1170 PolarHBondContact O-N 3.44Å
1169	N	58.4	Low	72.7	Confident	98 Å²	98	37.7 Å²	37.7	52%	0.524	22%	0.22	S	C	.	.	S	Bend	trans	-72.3	122.8	174.3	-166.8	-11.4	0	0	0	110.3	N1166 V1167 C1171 Y1172	N1166-N1169 PolarHBondContact O-N 3.15Å; V1167-N1169 PolarHBondContact O-N 2.87Å; N1169-C1171 PolarHBondContact O-N 2.96Å; N1169-Y1172 VanDerWaalsContact O-CB 3.25Å; N1169-Y1172 WeakPolarHBondContact O-CB 3.39Å; N1169-Y1172 PolarHBondContact O-N 3.47Å
1170	S	50	Low	72.9	Confident	94 Å²	94	37.3 Å²	37.3	66%	0.657	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.7	-173.6	58.9	0	0	0	0	114.2	N1168	N1168-S1170 PolarHBondContact O-N 3.44Å
1171	C	55.1	Low	73	Confident	74 Å²	74	37.6 Å²	37.6	50%	0.5	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-1.8	174.7	-66.1	0	0	0	0	114.2	R554 N1169 V1173	R554-C1171 VanDerWaalsContact CZ-O 3.23Å; R554-C1171 PolarHBondContact NH1-O 3.29Å; R554-C1171 PolarHBondContact NH2-O 2.91Å; N1169-C1171 PolarHBondContact O-N 2.96Å; C1171-V1173 PolarHBondContact O-N 3.01Å
1172	Y	64.2	Low	73.4	Confident	30 Å²	30	36.4 Å²	36.4	12%	0.118	21%	0.214	C	C	.	.			trans	-73.2	122.3	-173.9	-167.6	-96	0	0	0	112.9	P1162 V1167 N1169 H1174	P1162-Y1172 HydrophobicContact CB-CE2 4.21Å; P1162-Y1172 WeakPolarHBondContact CB-OH 3.11Å; V1167-Y1172 HydrophobicContact CG2-CE1 4.42Å; N1169-Y1172 VanDerWaalsContact O-CB 3.25Å; N1169-Y1172 WeakPolarHBondContact O-CB 3.39Å; N1169-Y1172 PolarHBondContact O-N 3.47Å; Y1172-H1174 AromaticContact CD1-CD2 3.79Å; Y1172-H1174 AromaticContact CD1-CE1 3.85Å; Y1172-H1174 AromaticContact CD1-NE2 3.68Å; Y1172-H1174 AromaticContact CE1-CE1 3.76Å; Y1172-H1174 AromaticContact CE1-CG 3.98Å; Y1172-H1174 AromaticContact CE1-ND1 3.72Å
1173	V	68	Low	73.7	Confident	25 Å²	25	35.3 Å²	35.3	15%	0.152	21%	0.205	C	C	.	.			trans	-99	114.4	178.2	-174.7	0	0	0	0	108.9	Q499 C1171 L1202 L1203	Q499-V1173 PolarHBondContact NE2-O 3.05Å; C1171-V1173 PolarHBondContact O-N 3.01Å; V1173-L1202 HydrophobicContact CG2-CB 4.37Å; V1173-L1203 HydrophobicContact CG2-CD2 4.27Å
1174	H	64.5	Low	74	Confident	20 Å²	20	35.4 Å²	35.4	9%	0.093	21%	0.206	C	C	.	.	S	Bend	trans	-81	138.2	177.1	-70.5	-97.5	0	0	0	112.4	M1012 N1113 Y1118 V1167 Y1172	M1012-H1174 HydrophobicContact CE-CB 3.9Å; M1012-H1174 VanDerWaalsContact CE-CD2 3.43Å; M1012-H1174 WeakPolarHBondContact CE-CD2 3.41Å; M1012-H1174 VanDerWaalsContact CE-CE1 3.41Å; M1012-H1174 WeakPolarHBondContact CE-CE1 3.4Å; M1012-H1174 VanDerWaalsContact CE-ND1 3.31Å; M1012-H1174 WeakPolarHBondContact CE-ND1 3.39Å; M1012-H1174 WeakPolarHBondContact CE-NE2 2.83Å; N1113-H1174 PolarHBondContact ND2-CD2 3.32Å; Y1118-H1174 HydrophobicContact CE1-CB 4.28Å; Y1118-H1174 VanDerWaalsContact OH-CB 3.29Å; Y1118-H1174 WeakPolarHBondContact OH-CB 3.43Å; V1167-H1174 VanDerWaalsContact CG1-CE1 3.42Å; V1167-H1174 WeakPolarHBondContact CG1-CE1 3.23Å; V1167-H1174 WeakPolarHBondContact CG1-NE2 3.33Å; Y1172-H1174 AromaticContact CD1-CD2 3.79Å; Y1172-H1174 AromaticContact CD1-CE1 3.85Å; Y1172-H1174 AromaticContact CD1-NE2 3.68Å; Y1172-H1174 AromaticContact CE1-CE1 3.76Å; Y1172-H1174 AromaticContact CE1-CG 3.98Å; Y1172-H1174 AromaticContact CE1-ND1 3.72Å
1175	G	62.8	Low	74.6	Confident	6 Å²	6	38.3 Å²	38.3	6%	0.062	22%	0.224	C	C	.	.	S	Bend	trans	66.2	67	173.9	0	0	0	0	0	112.6	V1072 V1073 G1074 A1177	V1072-G1175 WeakPolarHBondContact O-CA 3.45Å; V1073-G1175 WeakPolarHBondContact CA-O 3.5Å; G1074-G1175 PolarHBondContact N-O 2.85Å; G1175-A1177 PolarHBondContact O-N 2.78Å
1176	P	66.3	Low	75.5	Confident	9 Å²	9	36 Å²	36	6%	0.058	21%	0.21	C	C	.	.			trans	-61	136.2	-176.3	28.3	-36.5	0	0	0	111.2	S1160 L1178 L1203	S1160-P1176 WeakPolarHBondContact OG-CB 3.5Å; S1160-P1176 WeakPolarHBondContact OG-CG 3.34Å; P1176-L1178 VanDerWaalsContact C-N 3.32Å; P1176-L1203 HydrophobicContact CB-CD1 3.76Å
1177	A	75.9	Confident	76.9	Confident	5 Å²	5	31.9 Å²	31.9	4%	0.041	19%	0.188	C	C	.	.			trans	-84.1	-7.7	-177.6	0	0	0	0	0	113.7	V1073 G1175 D1192 V1193	V1073-A1177 HydrophobicContact CG1-CB 3.46Å; V1073-A1177 VanDerWaalsContact CG1-CB 3.46Å; G1175-A1177 PolarHBondContact O-N 2.78Å; A1177-D1192 WeakPolarHBondContact CB-OD1 3.08Å; A1177-V1193 PolarHBondContact O-N 2.95Å
1178	L	90.4	Very high	78.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	139	-175	-63.7	177.4	0	0	0	113	L496 S1160 P1176 L1190 F1191 D1192 L1203 Y1207	L496-L1178 HydrophobicContact CD2-CB 4.37Å; L496-L1178 HydrophobicContact CD2-CD1 4.34Å; S1160-L1178 WeakPolarHBondContact CB-O 3.46Å; S1160-L1178 PolarHBondContact N-O 3.15Å; S1160-L1178 PolarHBondContact OG-O 3.02Å; P1176-L1178 VanDerWaalsContact C-N 3.32Å; L1178-L1190 HydrophobicContact CB-CD1 4.23Å; L1178-L1190 HydrophobicContact CD2-CD1 4.41Å; L1178-L1190 HydrophobicContact CD2-CD2 4.49Å; L1178-L1190 HydrophobicContact CD2-CG 4.39Å; L1178-F1191 WeakPolarHBondContact CA-O 3.42Å; L1178-D1192 HydrophobicContact CD2-CB 3.76Å; L1178-L1203 HydrophobicContact CD1-CB 3.65Å; L1178-L1203 HydrophobicContact CG-CB 4.34Å; L1178-Y1207 HydrophobicContact CD1-CD2 3.98Å; L1178-Y1207 HydrophobicContact CD1-CE2 3.62Å
1179	G	93.5	Very high	80.3	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	161	168.9	0	0	0	0	0	112.4	V1158 F1191	V1158-G1179 CarbonylContact O-C 3.51Å; V1158-G1179 WeakPolarHBondContact O-CA 3.41Å; G1179-F1191 VanDerWaalsContact C-CD1 3.45Å; G1179-F1191 PolarHBondContact N-O 3.07Å; G1179-F1191 WeakPolarHBondContact O-CD1 3.45Å; G1179-F1191 WeakPolarHBondContact O-CE1 3.45Å; G1179-F1191 PolarHBondContact O-N 2.93Å
1180	L	95.7	Very high	82	Confident	3 Å²	3	19.8 Å²	19.8	2%	0.016	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	150.5	176.2	-72.6	171.6	0	0	0	110.3	Y494 L496 L571 V1157 V1158 L1188 T1189 L1190	Y494-L1180 HydrophobicContact CD2-CD1 4.11Å; Y494-L1180 HydrophobicContact CE2-CB 3.98Å; Y494-L1180 HydrophobicContact CE2-CD1 4.38Å; L496-L1180 HydrophobicContact CB-CD1 3.76Å; L496-L1180 HydrophobicContact CB-CG 4.34Å; L571-L1180 HydrophobicContact CD1-CD1 3.86Å; V1157-L1180 VanDerWaalsContact CA-O 3.32Å; V1157-L1180 WeakPolarHBondContact CA-O 3.33Å; V1158-L1180 HydrophobicContact CG1-CB 3.97Å; V1158-L1180 PolarHBondContact N-O 2.96Å; V1158-L1180 PolarHBondContact O-N 3.27Å; L1180-L1188 HydrophobicContact CD2-CB 4.49Å; L1180-T1189 WeakPolarHBondContact CA-O 3.47Å; L1180-L1190 HydrophobicContact CD2-CB 4.02Å; L1180-L1190 HydrophobicContact CD2-CD1 3.75Å; L1180-L1190 HydrophobicContact CG-CD1 4.19Å
1181	Y	95.7	Very high	84.1	Confident	9 Å²	9	15.3 Å²	15.3	4%	0.035	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	157.9	162	59.5	-97.5	0	0	0	110.7	L1145 L1146 A1153 L1183 L1188 T1189 F1191	L1145-Y1181 HydrophobicContact CD1-CE1 4.34Å; L1146-Y1181 HydrophobicContact CD1-CD1 4.43Å; L1146-Y1181 HydrophobicContact CD1-CD2 4.42Å; L1146-Y1181 HydrophobicContact CD1-CG 4.2Å; L1146-Y1181 HydrophobicContact CD2-CD2 3.93Å; L1146-Y1181 HydrophobicContact CD2-CE1 4.3Å; L1146-Y1181 HydrophobicContact CD2-CE2 3.61Å; L1146-Y1181 HydrophobicContact CD2-CG 4.4Å; A1153-Y1181 HydrophobicContact CB-CD2 3.98Å; Y1181-L1183 HydrophobicContact CD2-CD2 4.27Å; Y1181-L1183 HydrophobicContact CD2-CG 4.21Å; Y1181-L1183 HydrophobicContact CE2-CD1 4.48Å; Y1181-L1183 HydrophobicContact CE2-CD2 3.71Å; Y1181-L1183 HydrophobicContact CE2-CG 3.75Å; Y1181-L1188 CarbonylContact O-C 3.57Å; Y1181-L1188 WeakPolarHBondContact O-CA 3.43Å; Y1181-T1189 HydrophobicContact CE1-CG2 3.86Å; Y1181-T1189 HydrophobicContact CE2-CG2 3.99Å; Y1181-T1189 VanDerWaalsContact CZ-CG2 3.45Å; Y1181-T1189 PolarHBondContact N-O 3.1Å; Y1181-T1189 VanDerWaalsContact N-O 3.07Å; Y1181-T1189 PolarHBondContact O-N 2.83Å; Y1181-T1189 VanDerWaalsContact OH-CG2 3.29Å; Y1181-T1189 WeakPolarHBondContact OH-CG2 3.28Å; Y1181-F1191 AromaticContact CD1-CD1 3.54Å; Y1181-F1191 HydrophobicContact CD1-CD1 3.54Å; Y1181-F1191 AromaticContact CD1-CE1 3.93Å; Y1181-F1191 HydrophobicContact CD1-CE1 3.93Å; Y1181-F1191 HydrophobicContact CD1-CG 4.5Å; Y1181-F1191 HydrophobicContact CE1-CB 4.32Å; Y1181-F1191 AromaticContact CE1-CD1 3.78Å; Y1181-F1191 HydrophobicContact CE1-CD1 3.78Å; Y1181-F1191 HydrophobicContact CE1-CG 4.34Å
1182	Q	94.9	Very high	85.8	Confident	30 Å²	30	11.8 Å²	11.8	14%	0.14	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.5	-178.2	-171.6	173.3	23.3	0	0	110.5	Y494 A1153 S1156 A1184 P1185 Q1187 L1188	Y494-Q1182 HydrophobicContact CE1-CB 4.28Å; Y494-Q1182 PolarHBondContact OH-N 3.31Å; A1153-Q1182 WeakPolarHBondContact CA-O 3.35Å; A1153-Q1182 PolarHBondContact N-O 2.91Å; S1156-Q1182 WeakPolarHBondContact OG-CB 3.11Å; S1156-Q1182 PolarHBondContact OG-N 3.41Å; Q1182-A1184 WeakPolarHBondContact CG-O 3.31Å; Q1182-A1184 PolarHBondContact NE2-O 3.5Å; Q1182-P1185 PolarHBondContact NE2-O 2.77Å; Q1182-Q1187 CarbonylContact C-O 3.58Å; Q1182-Q1187 WeakPolarHBondContact CA-O 3.47Å; Q1182-L1188 HydrophobicContact CB-CD2 3.71Å; Q1182-L1188 HydrophobicContact CG-CD2 3.89Å
1183	L	90.3	Very high	87.1	Confident	24 Å²	24	10.5 Å²	10.5	13%	0.126	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-29.5	176.2	-84.6	-175.2	0	0	0	112.7	R20 Y1181 Q1187 T1189	R20-L1183 VanDerWaalsContact NH2-C 3.27Å; R20-L1183 PolarHBondContact NH2-O 3.24Å; Y1181-L1183 HydrophobicContact CD2-CD2 4.27Å; Y1181-L1183 HydrophobicContact CD2-CG 4.21Å; Y1181-L1183 HydrophobicContact CE2-CD1 4.48Å; Y1181-L1183 HydrophobicContact CE2-CD2 3.71Å; Y1181-L1183 HydrophobicContact CE2-CG 3.75Å; L1183-Q1187 HydrophobicContact CB-CB 4.33Å; L1183-Q1187 HydrophobicContact CB-CG 4.48Å; L1183-Q1187 PolarHBondContact N-O 3.04Å; L1183-T1189 WeakPolarHBondContact CD1-OG1 3.26Å; L1183-T1189 WeakPolarHBondContact CG-OG1 3.33Å
1184	A	91.4	Very high	88.1	Confident	5 Å²	5	9.3 Å²	9.3	4%	0.041	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	164.6	-179.2	0	0	0	0	0	109	Q1182 G1186 Q1187	Q1182-A1184 WeakPolarHBondContact CG-O 3.31Å; Q1182-A1184 PolarHBondContact NE2-O 3.5Å; A1184-G1186 PolarHBondContact O-N 3.31Å; A1184-G1186 VanDerWaalsContact O-N 3.11Å; A1184-Q1187 HydrophobicContact CB-CB 3.83Å; A1184-Q1187 PolarHBondContact N-O 2.92Å; A1184-Q1187 PolarHBondContact O-N 3.27Å
1185	P	90.6	Very high	89.1	Confident	79 Å²	79	11 Å²	11	51%	0.513	6%	0.061	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-46.8	176.3	-31	37.1	0	0	0	113.1	L491 Q1182	L491-P1185 WeakPolarHBondContact CD1-O 3.25Å; Q1182-P1185 PolarHBondContact NE2-O 2.77Å
1186	G	91.1	Very high	90.1	Very high	2 Å²	2	14.1 Å²	14.1	2%	0.021	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	4.7	177.2	0	0	0	0	0	118.2	G42 F43 L486 H487 A1184	G42-G1186 CarbonylContact C-O 3.52Å; G42-G1186 WeakPolarHBondContact CA-O 3.39Å; F43-G1186 PolarHBondContact N-O 2.99Å; F43-G1186 CarbonylContact O-C 3.55Å; F43-G1186 VanDerWaalsContact O-C 3.29Å; L486-G1186 WeakPolarHBondContact CB-O 3.45Å; H487-G1186 WeakPolarHBondContact ND1-CA 3.34Å; A1184-G1186 PolarHBondContact O-N 3.31Å; A1184-G1186 VanDerWaalsContact O-N 3.11Å
1187	Q	95.5	Very high	90.7	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.005	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	120.7	-169.7	-155.9	175.7	29.6	0	0	112.9	Y41 F43 Y69 Q1182 L1183 A1184	Y41-Q1187 WeakPolarHBondContact O-CA 3.33Å; F43-Q1187 WeakPolarHBondContact O-CB 3.38Å; Y69-Q1187 PolarHBondContact OH-NE2 3.37Å; Q1182-Q1187 CarbonylContact C-O 3.58Å; Q1182-Q1187 WeakPolarHBondContact CA-O 3.47Å; L1183-Q1187 HydrophobicContact CB-CB 4.33Å; L1183-Q1187 HydrophobicContact CB-CG 4.48Å; L1183-Q1187 PolarHBondContact N-O 3.04Å; A1184-Q1187 HydrophobicContact CB-CB 3.83Å; A1184-Q1187 PolarHBondContact N-O 2.92Å; A1184-Q1187 PolarHBondContact O-N 3.27Å
1188	L	96.6	Very high	90.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	130.8	175.4	-61	-178.4	0	0	0	110.7	Y41 L486 Y494 L571 L1180 Y1181 Q1182	Y41-L1188 PolarHBondContact N-O 3.12Å; Y41-L1188 PolarHBondContact O-N 2.69Å; L486-L1188 HydrophobicContact CD1-CB 4.3Å; L486-L1188 HydrophobicContact CD1-CD1 4.09Å; L486-L1188 HydrophobicContact CD1-CG 3.94Å; Y494-L1188 HydrophobicContact CD1-CD1 4.3Å; Y494-L1188 HydrophobicContact CD1-CD2 3.99Å; Y494-L1188 HydrophobicContact CD2-CD1 3.99Å; Y494-L1188 HydrophobicContact CD2-CD2 4.33Å; Y494-L1188 HydrophobicContact CE1-CD2 3.62Å; Y494-L1188 HydrophobicContact CE2-CD1 4.4Å; Y494-L1188 HydrophobicContact CE2-CD2 4.01Å; Y494-L1188 HydrophobicContact CG-CD1 3.95Å; Y494-L1188 HydrophobicContact CG-CD2 4.33Å; L571-L1188 HydrophobicContact CD1-CD1 3.95Å; L571-L1188 HydrophobicContact CD2-CD1 4.05Å; L1180-L1188 HydrophobicContact CD2-CB 4.49Å; Y1181-L1188 CarbonylContact O-C 3.57Å; Y1181-L1188 WeakPolarHBondContact O-CA 3.43Å; Q1182-L1188 HydrophobicContact CB-CD2 3.71Å; Q1182-L1188 HydrophobicContact CG-CD2 3.89Å
1189	T	95.2	Very high	89.9	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.9	174.6	-63.3	0	0	0	0	110.9	V37 D40 L1180 Y1181 L1183	V37-T1189 HydrophobicContact CG1-CG2 3.63Å; D40-T1189 WeakPolarHBondContact OD1-CB 3.46Å; D40-T1189 WeakPolarHBondContact OD1-CG2 3.14Å; D40-T1189 PolarHBondContact OD1-OG1 2.8Å; L1180-T1189 WeakPolarHBondContact CA-O 3.47Å; Y1181-T1189 HydrophobicContact CE1-CG2 3.86Å; Y1181-T1189 HydrophobicContact CE2-CG2 3.99Å; Y1181-T1189 VanDerWaalsContact CZ-CG2 3.45Å; Y1181-T1189 PolarHBondContact N-O 3.1Å; Y1181-T1189 VanDerWaalsContact N-O 3.07Å; Y1181-T1189 PolarHBondContact O-N 2.83Å; Y1181-T1189 VanDerWaalsContact OH-CG2 3.29Å; Y1181-T1189 WeakPolarHBondContact OH-CG2 3.28Å; L1183-T1189 WeakPolarHBondContact CD1-OG1 3.26Å; L1183-T1189 WeakPolarHBondContact CG-OG1 3.33Å
1190	L	94.6	Very high	89.1	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	128.9	171.1	-173.2	70.2	0	0	0	110.3	C38 S39 Y41 L496 L1178 L1180 Y1207	C38-L1190 HydrophobicContact CB-CB 4.16Å; C38-L1190 HydrophobicContact CB-CD2 3.89Å; C38-L1190 HydrophobicContact CB-CG 4.01Å; C38-L1190 PolarHBondContact N-O 3.34Å; S39-L1190 PolarHBondContact O-N 3.06Å; Y41-L1190 HydrophobicContact CD2-CB 4.35Å; Y41-L1190 HydrophobicContact CE2-CB 3.91Å; Y41-L1190 HydrophobicContact CE2-CD2 4.26Å; L496-L1190 HydrophobicContact CD2-CD1 3.56Å; L1178-L1190 HydrophobicContact CB-CD1 4.23Å; L1178-L1190 HydrophobicContact CD2-CD1 4.41Å; L1178-L1190 HydrophobicContact CD2-CD2 4.49Å; L1178-L1190 HydrophobicContact CD2-CG 4.39Å; L1180-L1190 HydrophobicContact CD2-CB 4.02Å; L1180-L1190 HydrophobicContact CD2-CD1 3.75Å; L1180-L1190 HydrophobicContact CG-CD1 4.19Å; L1190-Y1207 HydrophobicContact CD2-CD1 3.76Å; L1190-Y1207 HydrophobicContact CD2-CD2 3.51Å; L1190-Y1207 HydrophobicContact CD2-CE1 4.28Å; L1190-Y1207 HydrophobicContact CD2-CE2 4.08Å; L1190-Y1207 HydrophobicContact CD2-CG 3.31Å
1191	F	93.7	Very high	88.4	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	158.2	172.5	74.6	-85.2	0	0	0	111.5	V35 L1145 V1157 F1159 L1178 G1179 Y1181 V1193	V35-F1191 HydrophobicContact CG1-CB 4.32Å; V35-F1191 HydrophobicContact CG1-CD2 4.44Å; L1145-F1191 HydrophobicContact CD1-CB 4.4Å; L1145-F1191 HydrophobicContact CD1-CD1 4.33Å; L1145-F1191 HydrophobicContact CD1-CD2 3.86Å; L1145-F1191 HydrophobicContact CD1-CE2 4.19Å; L1145-F1191 HydrophobicContact CD1-CG 3.94Å; L1145-F1191 HydrophobicContact CD2-CE2 4.14Å; L1145-F1191 HydrophobicContact CD2-CZ 4.09Å; V1157-F1191 HydrophobicContact CG1-CE1 3.99Å; V1157-F1191 HydrophobicContact CG1-CZ 3.95Å; F1159-F1191 HydrophobicContact CE1-CE2 4.19Å; F1159-F1191 HydrophobicContact CE1-CZ 4.12Å; F1159-F1191 HydrophobicContact CZ-CZ 4.48Å; L1178-F1191 WeakPolarHBondContact CA-O 3.42Å; G1179-F1191 VanDerWaalsContact C-CD1 3.45Å; G1179-F1191 PolarHBondContact N-O 3.07Å; G1179-F1191 WeakPolarHBondContact O-CD1 3.45Å; G1179-F1191 WeakPolarHBondContact O-CE1 3.45Å; G1179-F1191 PolarHBondContact O-N 2.93Å; Y1181-F1191 AromaticContact CD1-CD1 3.54Å; Y1181-F1191 HydrophobicContact CD1-CD1 3.54Å; Y1181-F1191 AromaticContact CD1-CE1 3.93Å; Y1181-F1191 HydrophobicContact CD1-CE1 3.93Å; Y1181-F1191 HydrophobicContact CD1-CG 4.5Å; Y1181-F1191 HydrophobicContact CE1-CB 4.32Å; Y1181-F1191 AromaticContact CE1-CD1 3.78Å; Y1181-F1191 HydrophobicContact CE1-CD1 3.78Å; Y1181-F1191 HydrophobicContact CE1-CG 4.34Å; F1191-V1193 HydrophobicContact CD2-CG2 4.21Å; F1191-V1193 HydrophobicContact CE2-CG2 4.02Å
1192	D	91.5	Very high	87.4	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	148.6	179.3	-161.8	-10.1	0	0	0	109.3	V35 A36 A1177 L1178 V1194 S1201 G1204	V35-D1192 WeakPolarHBondContact CA-O 3.25Å; A36-D1192 HydrophobicContact CB-CB 4.34Å; A36-D1192 PolarHBondContact N-O 2.82Å; A36-D1192 PolarHBondContact O-N 3.3Å; A1177-D1192 WeakPolarHBondContact CB-OD1 3.08Å; L1178-D1192 HydrophobicContact CD2-CB 3.76Å; D1192-V1194 HydrophobicContact CB-CG1 4.19Å; D1192-S1201 VanDerWaalsContact CG-OG 3.29Å; D1192-S1201 WeakPolarHBondContact OD1-CB 3.26Å; D1192-S1201 PolarHBondContact OD1-OG 2.93Å; D1192-S1201 WeakPolarHBondContact OD2-CA 3.37Å; D1192-S1201 WeakPolarHBondContact OD2-CB 3.42Å; D1192-S1201 PolarHBondContact OD2-N 2.8Å; D1192-S1201 PolarHBondContact OD2-OG 2.74Å; D1192-G1204 WeakPolarHBondContact OD2-CA 3.47Å
1193	V	91.2	Very high	86.6	Confident	2 Å²	2	24 Å²	24	1%	0.012	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	112.5	174.9	-177.6	0	0	0	0	107.7	F1075 V1121 L1131 L1143 A1177 F1191	F1075-V1193 HydrophobicContact CE1-CG1 4.18Å; F1075-V1193 WeakPolarHBondContact CE1-O 3.39Å; F1075-V1193 HydrophobicContact CZ-CG1 4.04Å; V1121-V1193 HydrophobicContact CG1-CG1 4.35Å; V1121-V1193 HydrophobicContact CG1-CG2 4.24Å; L1131-V1193 HydrophobicContact CD1-CG1 4.12Å; L1131-V1193 HydrophobicContact CD2-CG1 4.24Å; L1143-V1193 HydrophobicContact CD1-CG1 4.24Å; A1177-V1193 PolarHBondContact O-N 2.95Å; F1191-V1193 HydrophobicContact CD2-CG2 4.21Å; F1191-V1193 HydrophobicContact CE2-CG2 4.02Å
1194	V	88.4	Confident	86.2	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	164.1	-167.7	-58.8	0	0	0	0	111.6	Y33 R34 A36 D1192 Q1198	Y33-V1194 CarbonylContact C-O 3.53Å; Y33-V1194 WeakPolarHBondContact CA-O 3.39Å; Y33-V1194 WeakPolarHBondContact CB-O 3.5Å; R34-V1194 HydrophobicContact CG-CG2 3.76Å; R34-V1194 PolarHBondContact N-O 3.12Å; R34-V1194 PolarHBondContact O-N 2.86Å; A36-V1194 HydrophobicContact CB-CG2 4.14Å; D1192-V1194 HydrophobicContact CB-CG1 4.19Å; V1194-Q1198 HydrophobicContact CB-CB 4.21Å
1195	R	87	Confident	85.6	Confident	56 Å²	56	24.6 Å²	24.6	21%	0.211	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	148	171.1	-64.9	177.3	72.5	128	1.5	110.2	R32 Y33 F1075 E1117 G1197 Q1198	R32-R1195 WeakPolarHBondContact O-CA 3.2Å; Y33-R1195 HydrophobicContact CD1-CG 3.95Å; Y33-R1195 HydrophobicContact CE1-CG 3.75Å; F1075-R1195 HydrophobicContact CB-CG 4.32Å; F1075-R1195 HydrophobicContact CD1-CG 4.04Å; E1117-R1195 IonicContact OE2-CZ 3.58Å; E1117-R1195 IonicContact OE2-NH1 3.73Å; E1117-R1195 PolarHBondContact OE2-NH1 2.71Å; R1195-G1197 PolarHBondContact O-N 3.44Å; R1195-Q1198 HydrophobicContact CB-CG 4.44Å; R1195-Q1198 WeakPolarHBondContact O-CB 3.43Å; R1195-Q1198 PolarHBondContact O-N 2.73Å
1196	T	83	Confident	85	Confident	70 Å²	70	21.3 Å²	21.3	43%	0.429	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	134.5	170.7	-48	0	0	0	0	109.3	S31 R32 Y33	S31-T1196 PolarHBondContact O-OG1 3.37Å; R32-T1196 PolarHBondContact O-N 2.86Å; R32-T1196 PolarHBondContact O-OG1 3.35Å; Y33-T1196 PolarHBondContact N-OG1 2.94Å; Y33-T1196 VanDerWaalsContact N-OG1 3.13Å
1197	G	78	Confident	84.6	Confident	39 Å²	39	21.2 Å²	21.2	40%	0.402	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	-20.1	-169.8	0	0	0	0	0	115.3	R1195	R1195-G1197 PolarHBondContact O-N 3.44Å
1198	Q	76.8	Confident	83.8	Confident	28 Å²	28	24.6 Å²	24.6	13%	0.131	13%	0.134	C	C	.	.			trans	-83.2	133.7	171.1	-69.7	173.1	-22.6	0	0	110.6	R34 R1076 V1194 R1195	R34-Q1198 PolarHBondContact NE-O 2.94Å; R34-Q1198 PolarHBondContact NH2-O 3.49Å; R1076-Q1198 PolarHBondContact O-NE2 2.82Å; R1076-Q1198 VanDerWaalsContact O-NE2 3.14Å; V1194-Q1198 HydrophobicContact CB-CB 4.21Å; R1195-Q1198 HydrophobicContact CB-CG 4.44Å; R1195-Q1198 WeakPolarHBondContact O-CB 3.43Å; R1195-Q1198 PolarHBondContact O-N 2.73Å
1199	K	72.8	Confident	82.4	Confident	86 Å²	86	26 Å²	26	37%	0.374	14%	0.143	S	C	.	.	S	Bend	trans	-73.8	-38.8	175.3	-77.5	179.9	176.2	167	0	112	S1093 R1208	S1093-K1199 VanDerWaalsContact OG-CE 3.25Å; S1093-K1199 WeakPolarHBondContact OG-CE 3.44Å; S1093-K1199 PolarHBondContact OG-NZ 3.32Å; K1199-R1208 PolarHBondContact O-NH1 3.31Å
1200	A	77.8	Confident	81	Confident	14 Å²	14	27.7 Å²	27.7	12%	0.116	15%	0.152	C	C	.	.	S	Bend	trans	-161.7	169.5	173.6	0	0	0	0	0	109.8	V1205	A1200-V1205 HydrophobicContact CB-CG2 3.89Å
1201	S	80	Confident	79.8	Confident	23 Å²	23	29 Å²	29	16%	0.161	16%	0.157	C	C	.	.			trans	-72.8	171.5	168.1	71.8	0	0	0	0	111.8	D1192 L1203 G1204 V1205	D1192-S1201 VanDerWaalsContact CG-OG 3.29Å; D1192-S1201 WeakPolarHBondContact OD1-CB 3.26Å; D1192-S1201 PolarHBondContact OD1-OG 2.93Å; D1192-S1201 WeakPolarHBondContact OD2-CA 3.37Å; D1192-S1201 WeakPolarHBondContact OD2-CB 3.42Å; D1192-S1201 PolarHBondContact OD2-N 2.8Å; D1192-S1201 PolarHBondContact OD2-OG 2.74Å; S1201-L1203 PolarHBondContact O-N 2.92Å; S1201-L1203 VanDerWaalsContact O-N 3.09Å; S1201-G1204 PolarHBondContact O-N 2.93Å; S1201-G1204 VanDerWaalsContact O-N 3.08Å; S1201-G1204 PolarHBondContact OG-N 3.37Å; S1201-G1204 VanDerWaalsContact OG-N 3.09Å; S1201-V1205 WeakPolarHBondContact O-CG2 3.43Å; S1201-V1205 PolarHBondContact O-N 3.36Å; S1201-V1205 VanDerWaalsContact O-N 3.08Å
1202	L	74.2	Confident	78.2	Confident	70 Å²	70	34.2 Å²	34.2	37%	0.366	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.8	178.4	-117.6	156.1	0	0	0	114.4	V1173	V1173-L1202 HydrophobicContact CG2-CB 4.37Å
1203	L	78.3	Confident	76.9	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.016	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-39.7	172.5	-60.8	175.4	0	0	0	111	T498 Q499 V1173 P1176 L1178 S1201 V1205 S1206 Y1207	T498-L1203 HydrophobicContact CG2-CD1 4.19Å; Q499-L1203 HydrophobicContact CG-CD2 4.25Å; V1173-L1203 HydrophobicContact CG2-CD2 4.27Å; P1176-L1203 HydrophobicContact CB-CD1 3.76Å; L1178-L1203 HydrophobicContact CD1-CB 3.65Å; L1178-L1203 HydrophobicContact CG-CB 4.34Å; S1201-L1203 PolarHBondContact O-N 2.92Å; S1201-L1203 VanDerWaalsContact O-N 3.09Å; L1203-V1205 VanDerWaalsContact C-N 3.27Å; L1203-V1205 PolarHBondContact O-N 3.18Å; L1203-S1206 PolarHBondContact O-N 3.23Å; L1203-S1206 PolarHBondContact O-OG 2.83Å; L1203-Y1207 VanDerWaalsContact O-CD2 3.28Å; L1203-Y1207 WeakPolarHBondContact O-CD2 3.46Å; L1203-Y1207 WeakPolarHBondContact O-CE2 3.46Å
1204	G	81.9	Confident	75.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-61.1	-25.9	-178.2	0	0	0	0	0	116	D1192 S1201 S1206 Y1207	D1192-G1204 WeakPolarHBondContact OD2-CA 3.47Å; S1201-G1204 PolarHBondContact O-N 2.93Å; S1201-G1204 VanDerWaalsContact O-N 3.08Å; S1201-G1204 PolarHBondContact OG-N 3.37Å; S1201-G1204 VanDerWaalsContact OG-N 3.09Å; G1204-S1206 VanDerWaalsContact C-N 3.31Å; G1204-S1206 PolarHBondContact O-N 2.83Å; G1204-Y1207 PolarHBondContact O-N 2.9Å
1205	V	78.5	Confident	73.9	Confident	43 Å²	43	45.9 Å²	45.9	26%	0.261	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-57	-43.9	177	168.6	0	0	0	0	111.6	A1200 S1201 L1203 Y1207 R1208	A1200-V1205 HydrophobicContact CB-CG2 3.89Å; S1201-V1205 WeakPolarHBondContact O-CG2 3.43Å; S1201-V1205 PolarHBondContact O-N 3.36Å; S1201-V1205 VanDerWaalsContact O-N 3.08Å; L1203-V1205 VanDerWaalsContact C-N 3.27Å; L1203-V1205 PolarHBondContact O-N 3.18Å; V1205-Y1207 PolarHBondContact O-N 2.78Å; V1205-R1208 PolarHBondContact O-N 3.24Å
1206	S	78.2	Confident	72.2	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.063	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-64.4	-14.2	-175.7	-37.4	0	0	0	0	114	L1203 G1204	L1203-S1206 PolarHBondContact O-N 3.23Å; L1203-S1206 PolarHBondContact O-OG 2.83Å; G1204-S1206 VanDerWaalsContact C-N 3.31Å; G1204-S1206 PolarHBondContact O-N 2.83Å
1207	Y	83.8	Confident	70.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-104.7	-8.8	-175.9	-62.1	-64.8	0	0	0	114.1	S39 Y41 T567 D569 L585 L1178 L1190 L1203 G1204 V1205	S39-Y1207 PolarHBondContact OG-O 3.4Å; Y41-Y1207 VanDerWaalsContact OH-CD1 3.31Å; Y41-Y1207 WeakPolarHBondContact OH-CD1 3.49Å; T567-Y1207 HydrophobicContact CG2-CD1 4.34Å; T567-Y1207 HydrophobicContact CG2-CE1 3.65Å; T567-Y1207 PolarHBondContact OG1-OH 3.41Å; T567-Y1207 VanDerWaalsContact OG1-OH 3.07Å; D569-Y1207 WeakPolarHBondContact CB-OH 3.25Å; D569-Y1207 PolarHBondContact OD2-OH 3.01Å; L585-Y1207 HydrophobicContact CB-CD1 4.33Å; L585-Y1207 HydrophobicContact CB-CE1 3.66Å; L585-Y1207 HydrophobicContact CD2-CE1 4.37Å; L585-Y1207 HydrophobicContact CG-CE1 4.44Å; L1178-Y1207 HydrophobicContact CD1-CD2 3.98Å; L1178-Y1207 HydrophobicContact CD1-CE2 3.62Å; L1190-Y1207 HydrophobicContact CD2-CD1 3.76Å; L1190-Y1207 HydrophobicContact CD2-CD2 3.51Å; L1190-Y1207 HydrophobicContact CD2-CE1 4.28Å; L1190-Y1207 HydrophobicContact CD2-CE2 4.08Å; L1190-Y1207 HydrophobicContact CD2-CG 3.31Å; L1203-Y1207 VanDerWaalsContact O-CD2 3.28Å; L1203-Y1207 WeakPolarHBondContact O-CD2 3.46Å; L1203-Y1207 WeakPolarHBondContact O-CE2 3.46Å; G1204-Y1207 PolarHBondContact O-N 2.9Å; V1205-Y1207 PolarHBondContact O-N 2.78Å
1208	R	77.3	Confident	67.9	Low	72 Å²	72	52.8 Å²	52.8	27%	0.272	28%	0.283	S	S	.	.	S	Bend	trans	-89.9	125.3	179	-79.3	-167.5	156.5	-149.5	-26.1	109.8	V37 C38 K1199 V1205 I1210	V37-R1208 PolarHBondContact O-NE 2.54Å; V37-R1208 PolarHBondContact O-NH2 2.84Å; C38-R1208 HydrophobicContact CB-CG 4.41Å; K1199-R1208 PolarHBondContact O-NH1 3.31Å; V1205-R1208 PolarHBondContact O-N 3.24Å; R1208-I1210 PolarHBondContact O-N 2.85Å
1209	P	69	Low	65.8	Low	29 Å²	29	57.6 Å²	57.6	19%	0.188	32%	0.315	C	S	.	.			trans	-68.5	128.9	172.6	32.8	-35.7	0	0	0	108.5	G75 Y1211	G75-P1209 WeakPolarHBondContact O-CB 3.24Å; P1209-Y1211 HydrophobicContact CB-CD1 3.84Å; P1209-Y1211 HydrophobicContact CB-CE1 3.61Å; P1209-Y1211 HydrophobicContact CG-CE1 3.84Å
1210	I	64.4	Low	63.7	Low	36 Å²	36	61.3 Å²	61.3	19%	0.185	34%	0.339	C	S	.	.			trans	-123.8	125.7	174.5	-55.4	-175.8	0	0	0	106.5	L549 N551 R1208	L549-I1210 HydrophobicContact CB-CB 4.4Å; L549-I1210 HydrophobicContact CB-CG2 3.94Å; L549-I1210 HydrophobicContact CD1-CG2 4.09Å; L549-I1210 PolarHBondContact N-O 3.25Å; N551-I1210 HydrophobicContact CB-CD1 3.95Å; N551-I1210 WeakPolarHBondContact ND2-CD1 3.24Å; R1208-I1210 PolarHBondContact O-N 2.85Å
1211	Y	70	Confident	61.4	Low	27 Å²	27	64.1 Å²	64.1	11%	0.106	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	161.8	-166	40.7	-123.7	0	0	0	114	I76 S77 F78 T120 S122 H547 P1209	I76-Y1211 VanDerWaalsContact CD1-CB 3.46Å; I76-Y1211 HydrophobicContact CD1-CD1 4.07Å; I76-Y1211 HydrophobicContact CD1-CG 4.2Å; I76-Y1211 HydrophobicContact CG2-CD1 4.44Å; S77-Y1211 VanDerWaalsContact O-CE1 3.32Å; S77-Y1211 WeakPolarHBondContact O-CE1 3.36Å; S77-Y1211 PolarHBondContact O-OH 3.24Å; F78-Y1211 HydrophobicContact CD1-CE1 4.3Å; F78-Y1211 HydrophobicContact CD1-CE2 4.03Å; F78-Y1211 AromaticContact CD1-CZ 3.64Å; F78-Y1211 VanDerWaalsContact CD1-OH 3.3Å; F78-Y1211 WeakPolarHBondContact CD1-OH 3.47Å; F78-Y1211 HydrophobicContact CE1-CD1 4.46Å; F78-Y1211 AromaticContact CE1-CD2 3.84Å; F78-Y1211 HydrophobicContact CE1-CD2 3.84Å; F78-Y1211 AromaticContact CE1-CE1 3.91Å; F78-Y1211 HydrophobicContact CE1-CE1 3.91Å; F78-Y1211 AromaticContact CE1-CE2 3.23Å; F78-Y1211 HydrophobicContact CE1-CE2 3.23Å; F78-Y1211 HydrophobicContact CE1-CG 4.44Å; F78-Y1211 AromaticContact CE1-CZ 3.25Å; F78-Y1211 WeakPolarHBondContact CE1-OH 3.44Å; F78-Y1211 HydrophobicContact CZ-CD1 4.37Å; F78-Y1211 HydrophobicContact CZ-CD2 4.02Å; F78-Y1211 HydrophobicContact CZ-CE1 4.18Å; F78-Y1211 AromaticContact CZ-CE2 3.87Å; F78-Y1211 HydrophobicContact CZ-CE2 3.87Å; F78-Y1211 HydrophobicContact CZ-CG 4.29Å; F78-Y1211 AromaticContact CZ-CZ 3.94Å; T120-Y1211 CarbonylContact C-O 3.4Å; S122-Y1211 WeakPolarHBondContact O-CE2 3.3Å; S122-Y1211 PolarHBondContact O-OH 2.92Å; H547-Y1211 CarbonylContact O-C 3.2Å; H547-Y1211 WeakPolarHBondContact O-CA 3.47Å; H547-Y1211 WeakPolarHBondContact O-CB 3.38Å; P1209-Y1211 HydrophobicContact CB-CD1 3.84Å; P1209-Y1211 HydrophobicContact CB-CE1 3.61Å; P1209-Y1211 HydrophobicContact CG-CE1 3.84Å
1212	R	60.5	Low	58.8	Low	110 Å²	110	70.5 Å²	70.5	42%	0.415	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.5	161.5	-80.1	179.6	-179.5	176.8	0.7	109.3	Q119 H547 L549	Q119-R1212 WeakPolarHBondContact O-CG 3.41Å; Q119-R1212 PolarHBondContact O-NE 3.36Å; H547-R1212 HydrophobicContact CB-CB 4.43Å; H547-R1212 PolarHBondContact N-O 3.22Å; H547-R1212 PolarHBondContact O-N 2.9Å; L549-R1212 HydrophobicContact CD1-CG 4.17Å
1213	L	63.8	Low	56.6	Low	24 Å²	24	75.8 Å²	75.8	13%	0.126	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-65.6	147.5	154.8	-56.2	173.1	0	0	0	108.3	F78 L114	F78-L1213 HydrophobicContact CZ-CD2 3.98Å; L114-L1213 HydrophobicContact CD2-CD2 3.48Å; L114-L1213 VanDerWaalsContact CD2-CD2 3.48Å; L114-L1213 HydrophobicContact CG-CD1 4.15Å; L114-L1213 HydrophobicContact CG-CD2 3.81Å; L114-L1213 WeakPolarHBondContact O-CD1 3.09Å
1214	S	62.1	Low	54.1	Low	54 Å²	54	84.5 Å²	84.5	38%	0.378	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-58.5	168.1	167.2	46.7	0	0	0	0	110.4	R98	R98-S1214 PolarHBondContact NH1-O 3.35Å; R98-S1214 VanDerWaalsContact NH2-C 3.25Å; R98-S1214 PolarHBondContact NH2-O 2.99Å; R98-S1214 PolarHBondContact NH2-OG 3.01Å
1215	L	54.2	Low	51.4	Low	170 Å²	170	90.7 Å²	90.7	89%	0.89	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-82.6	138.4	162	-77.6	158.9	0	0	0	108.4	G1217	L1215-G1217 PolarHBondContact O-N 2.98Å
1216	I	52.2	Low	48.8	Very low	112 Å²	112	97.5 Å²	97.5	57%	0.574	53%	0.529	S	S	*	.			trans	-73.5	96.4	171.4	-56.2	179.5	0	0	0	106.4	R98	R98-I1216 VanDerWaalsContact CZ-CG1 3.43Å
1217	G	40.6	Very low	46.2	Very low	53 Å²	53	101.4 Å²	101.4	55%	0.546	56%	0.556	S	S	.	*			trans	-75.9	137.1	170.4	0	0	0	0	0	110	L1215 T1219	L1215-G1217 PolarHBondContact O-N 2.98Å; G1217-T1219 PolarHBondContact O-N 3.33Å
1218	N	30.2	Very low	43.5	Very low	145 Å²	145	109.7 Å²	109.7	78%	0.775	59%	0.594	S	S	*	*			trans	-56.7	110.3	172.6	-98.7	-6.1	0	0	0	109.9	N1220 A1221	N1218-N1220 PolarHBondContact O-N 2.98Å; N1218-A1221 PolarHBondContact O-N 3.36Å
1219	T	31.3	Very low	41.1	Very low	130 Å²	130	115.2 Å²	115.2	80%	0.798	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	2.4	-177.4	39.7	0	0	0	0	114.5	G1217	G1217-T1219 PolarHBondContact O-N 3.33Å
1220	N	30.1	Very low	39	Very low	164 Å²	164	119.8 Å²	119.8	88%	0.877	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	2.8	174.4	-73.9	-13.7	0	0	0	114.8	N1218	N1218-N1220 PolarHBondContact O-N 2.98Å
1221	A	28.7	Very low	37.2	Very low	72 Å²	72	125.3 Å²	125.3	60%	0.595	68%	0.678	S	S	*	*	S	Bend	trans	-104.2	-18.4	-173.6	0	0	0	0	0	116.3	N1218	N1218-A1221 PolarHBondContact O-N 3.36Å
1222	N	26	Very low	35.4	Very low	157 Å²	157	129.4 Å²	129.4	84%	0.84	71%	0.71	S	S	*	*	S	Bend	trans	-115.5	21.3	-168.2	-84.8	-0.9	0	0	0	115.6
1223	M	28.2	Very low	33.9	Very low	182 Å²	182	132.6 Å²	132.6	90%	0.897	73%	0.734	S	S	*	*	S	Bend	trans	-110.3	22	171.2	-94.7	-162.5	170.7	0	0	114.3
1224	K	24.4	Very low	32.2	Very low	186 Å²	186	135 Å²	135	81%	0.809	77%	0.765	S	S	*	*	S	Bend	trans	-126.8	149.7	160.9	-72.8	-177.4	176.3	179.3	0	108.9
1225	T	25.4	Very low	30.6	Very low	130 Å²	130	139.8 Å²	139.8	80%	0.798	79%	0.786	S	S	*	*			trans	64	74.4	-179.3	65.3	0	0	0	0	116.9
1226	L	24.7	Very low	29.5	Very low	186 Å²	186	136.1 Å²	136.1	97%	0.974	77%	0.774	S	S	*	*			trans	-128.5	54.9	149.6	-120.2	162.5	0	0	0	109.2
1227	S	23.9	Very low	28.3	Very low	90 Å²	90	141.8 Å²	141.8	63%	0.629	79%	0.789	S	S	*	*	S	Bend	trans	-153.1	124	176.2	56.1	0	0	0	0	108
1228	E	26	Very low	27.9	Very low	174 Å²	174	146.9 Å²	146.9	81%	0.813	80%	0.802	S	S	*	*			trans	66.5	139.7	-174.5	-41.4	-176.4	169.7	0	0	114.1
1229	K	28.3	Very low	28	Very low	188 Å²	188	144.3 Å²	144.3	82%	0.817	80%	0.795	S	S	*	*			cis	-141.2	151.7	21.9	-72.3	175.5	176.8	175.6	0	113.5
1230	T	24.6	Very low	27.8	Very low	125 Å²	125	145.4 Å²	145.4	77%	0.767	80%	0.796	S	S	*	*			trans	-87	157.6	157.4	44	0	0	0	0	111.4
1231	N	26.6	Very low	27.7	Very low	153 Å²	153	149.3 Å²	149.3	82%	0.818	80%	0.799	S	S	*	*			trans	70.2	104.2	160.1	-61.2	-13	0	0	0	122
1232	S	32	Very low	27.6	Very low	112 Å²	112	151.9 Å²	151.9	78%	0.783	81%	0.812	S	S	*	*				174.8	113.4	125.5	54	0	0	0	0	108.7
1233	I	28.1	Very low	27.5	Very low	177 Å²	177	151.1 Å²	151.1	91%	0.908	81%	0.813	S	S	*	*				51.1	110.4	73.8	-54.4	-178.1	0	0	0	113.5
1234	G	29.7	Very low	27.4	Very low	75 Å²	75	150.3 Å²	150.3	77%	0.773	81%	0.811	S	S	*	*			trans	164.3	97.3	172.2	0	0	0	0	0	115.6
1235	D	27.6	Very low	27.3	Very low	155 Å²	155	146.6 Å²	146.6	83%	0.829	81%	0.808	S	S	*	*			trans	-38.6	160.3	164.6	-78.6	-61.6	0	0	0	117.1
1236	S	31.3	Very low	27.3	Very low	92 Å²	92	146.8 Å²	146.8	64%	0.643	81%	0.81	S	S	*	*			cis	-168.8	157.1	15.4	34.1	0	0	0	0	114.5
1237	R	26.6	Very low	27.3	Very low	232 Å²	232	143.4 Å²	143.4	88%	0.875	80%	0.802	S	S	*	*			trans	41.3	128.9	141.4	-53	167.8	-179	-176.1	0.3	119.3
1238	I	31.7	Very low	27.4	Very low	160 Å²	160	146.9 Å²	146.9	82%	0.821	81%	0.808	S	S	*	*				173.2	147.5	80.2	-77.1	-176.6	0	0	0	106.1
1239	S	31.7	Very low	27.3	Very low	91 Å²	91	147.2 Å²	147.2	64%	0.636	81%	0.814	S	S	*	*			cis	-168.7	150	-20.7	61.2	0	0	0	0	112.1
1240	N	27.4	Very low	27.3	Very low	152 Å²	152	145.4 Å²	145.4	81%	0.813	81%	0.809	S	S	*	*			trans	44.5	109	147.3	-59	-11.7	0	0	0	122.6
1241	R	27.9	Very low	27.3	Very low	247 Å²	247	145.6 Å²	145.6	93%	0.932	81%	0.805	S	S	*	*				169.8	102.6	97.3	-100.9	-169.6	172.2	-177.3	-0.9	113.8
1242	S	27.4	Very low	27.2	Very low	125 Å²	125	146.7 Å²	146.7	87%	0.874	81%	0.809	S	S	*	*			trans	-168.4	135.8	131.2	53.2	0	0	0	0	108.6
1243	V	24.5	Very low	26.8	Very low	142 Å²	142	145.7 Å²	145.7	86%	0.861	80%	0.802	S	S	*	*			trans	-128.7	122.8	-177	174.6	0	0	0	0	107.9
1244	L	24.6	Very low	26.7	Very low	164 Å²	164	145.5 Å²	145.5	86%	0.859	80%	0.797	S	S	*	*			trans	-160.7	124.3	165.2	-110.2	162.4	0	0	0	109.6
1245	S	23.7	Very low	26.4	Very low	108 Å²	108	147.5 Å²	147.5	76%	0.755	80%	0.795	S	S	*	*			trans	63.3	143.8	-171.4	80	0	0	0	0	114.1
1246	T	25.7	Very low	26.2	Very low	134 Å²	134	146.4 Å²	146.4	82%	0.822	80%	0.799	S	S	*	*			cis	-144.9	130.5	19.8	38.2	0	0	0	0	112.5
1247	S	24.8	Very low	26	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	80%	0.799	S	S	*	*			trans	-166.7	145.9	153.7	68.6	0	0	0	0	106.6
1248	Q	26.1	Very low	25.9	Very low	164 Å²	164	141.3 Å²	141.3	77%	0.766	79%	0.793	S	S	*	*			cis	-134	139.2	10.9	-63.5	170.1	-16.4	0	0	110.4
1249	L	22.8	Very low	25.6	Very low	180 Å²	180	142 Å²	142	94%	0.942	80%	0.798	S	S	*	*			trans	-127	99.5	150.1	-104.9	169.7	0	0	0	106
1250	H	27.6	Very low	25.2	Very low	151 Å²	151	142.2 Å²	142.2	70%	0.699	80%	0.799	S	S	*	*			trans	-86.9	132	175.3	-113.2	-49.6	0	0	0	109.7	I1252	H1250-I1252 PolarHBondContact O-N 2.99Å
1251	N	24.5	Very low	25.3	Very low	129 Å²	129	140.5 Å²	140.5	69%	0.69	80%	0.799	S	S	*	*			trans	8	107.1	152.3	-59.3	-9.1	0	0	0	117.2
1252	I	25.5	Very low	25.3	Very low	175 Å²	175	134.2 Å²	134.2	90%	0.897	79%	0.793	S	S	*	*			trans	-113.6	89.2	131.5	-61.5	-179.4	0	0	0	106.7	H1250	H1250-I1252 PolarHBondContact O-N 2.99Å
1253	S	23.1	Very low	25.4	Very low	92 Å²	92	134.9 Å²	134.9	64%	0.643	79%	0.791	S	S	*	*			trans	-89.7	111.1	165.6	51.5	0	0	0	0	108.5
1254	Q	25.6	Very low	25.4	Very low	173 Å²	173	136.7 Å²	136.7	81%	0.808	79%	0.79	S	S	*	*			trans	-154.2	114.9	153.2	-113.8	162.6	44.3	0	0	111.5
1255	T	25	Very low	25.6	Very low	117 Å²	117	136.2 Å²	136.2	72%	0.718	79%	0.789	S	S	*	*			trans	52.9	86.2	151	58.4	0	0	0	0	118.6	S1257	T1255-S1257 PolarHBondContact O-N 3.29Å
1256	S	23	Very low	25.9	Very low	132 Å²	132	139.5 Å²	139.5	92%	0.923	79%	0.792	S	S	*	*			trans	-83.6	94.2	145.5	57	0	0	0	0	109.5
1257	S	26.1	Very low	25.8	Very low	90 Å²	90	138.3 Å²	138.3	63%	0.629	79%	0.789	S	S	*	*			trans	-138	111.7	174.2	56.9	0	0	0	0	111.3	T1255	T1255-S1257 PolarHBondContact O-N 3.29Å
1258	V	24.7	Very low	26	Very low	126 Å²	126	140 Å²	140	76%	0.764	79%	0.789	S	S	*	*			trans	29.1	110.1	148.8	-170.3	0	0	0	0	117.4
1259	L	25.8	Very low	26.1	Very low	175 Å²	175	136.7 Å²	136.7	92%	0.916	79%	0.785	S	S	*	*			trans	-135.2	84.8	146.9	-93.7	175	0	0	0	110.3
1260	S	24.2	Very low	26.4	Very low	95 Å²	95	136.6 Å²	136.6	66%	0.664	78%	0.781	S	S	*	*			trans	-72.3	115.4	152.3	50.7	0	0	0	0	108.3	S1262	S1260-S1262 PolarHBondContact O-N 3.42Å
1261	S	28.8	Very low	26.6	Very low	117 Å²	117	134 Å²	134	82%	0.818	78%	0.78	S	S	*	*			trans	-72.6	104.9	176	52.9	0	0	0	0	110.6	V1263	S1261-V1263 PolarHBondContact O-N 3.42Å
1262	S	27.4	Very low	26.9	Very low	114 Å²	114	134 Å²	134	80%	0.797	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-76.1	119.3	170.4	38.9	0	0	0	0	110.5	S1260	S1260-S1262 PolarHBondContact O-N 3.42Å
1263	V	29.3	Very low	27	Very low	139 Å²	139	134.4 Å²	134.4	84%	0.842	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70.9	129.4	160.7	173.3	0	0	0	0	107.7	S1261 N1265	S1261-V1263 PolarHBondContact O-N 3.42Å; V1263-N1265 PolarHBondContact O-N 3.41Å
1264	Q	25	Very low	27.4	Very low	180 Å²	180	137.2 Å²	137.2	84%	0.841	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.5	124.2	173.3	-65.8	172.6	-32.6	0	0	109.3
1265	N	29	Very low	27.8	Very low	154 Å²	154	135.8 Å²	135.8	82%	0.824	79%	0.793	S	S	*	*			trans	-152.7	147.1	138.2	-113.9	-26	0	0	0	114	V1263	V1263-N1265 PolarHBondContact O-N 3.41Å
1266	Q	29.2	Very low	28.1	Very low	177 Å²	177	134.5 Å²	134.5	83%	0.827	79%	0.789	S	S	*	*			trans	-70.6	155.3	-161.4	-63.9	163	3.9	0	0	113.8	N1268	Q1266-N1268 PolarHBondContact O-N 3.22Å
1267	S	23.8	Very low	28.6	Very low	109 Å²	109	135 Å²	135	76%	0.762	78%	0.782	S	S	*	*			trans	-52	121.8	166.7	51.2	0	0	0	0	114
1268	N	29.3	Very low	28.9	Very low	150 Å²	150	135.7 Å²	135.7	80%	0.802	79%	0.786	S	S	*	*			trans	-158.5	112.4	143.5	-88.4	-33.4	0	0	0	105.5	Q1266	Q1266-N1268 PolarHBondContact O-N 3.22Å
1269	S	27.5	Very low	29.4	Very low	96 Å²	96	138.1 Å²	138.1	67%	0.671	79%	0.793	S	S	*	*				70.1	132.2	63.8	87.7	0	0	0	0	113
1270	M	31	Very low	29.6	Very low	177 Å²	177	140.1 Å²	140.1	87%	0.872	79%	0.788	S	S	*	*			trans	77.3	131.3	-174.4	-49.3	-158.2	76.7	0	0	116.7
1271	S	30.1	Very low	29.9	Very low	97 Å²	97	142.9 Å²	142.9	68%	0.678	80%	0.796	S	S	*	*			cis	160.4	123	-28.3	46.3	0	0	0	0	107.5
1272	S	30.9	Very low	29.9	Very low	129 Å²	129	140.5 Å²	140.5	90%	0.902	79%	0.789	S	S	*	*			trans	-149.1	84.5	156.1	48.9	0	0	0	0	110.2
1273	H	28.1	Very low	30	Very low	183 Å²	183	143 Å²	143	85%	0.847	79%	0.793	S	S	*	*			trans	-105.8	146.2	164.8	-94.9	-59.6	0	0	0	109.6
1274	N	31.9	Very low	30.1	Very low	151 Å²	151	142.9 Å²	142.9	81%	0.807	79%	0.792	S	S	*	*			trans	169.2	132.3	154.7	-90.6	-13.9	0	0	0	106.5
1275	L	33.3	Very low	30.7	Very low	144 Å²	144	139.3 Å²	139.3	75%	0.754	79%	0.787	S	S	*	*			cis	-145.4	138.4	5.8	-78.6	130.2	0	0	0	107.7
1276	S	31.4	Very low	31.3	Very low	89 Å²	89	137.5 Å²	137.5	62%	0.622	78%	0.783	S	S	*	*				55.9	135.6	93.4	95.3	0	0	0	0	114.6
1277	D	33.1	Very low	31.5	Very low	144 Å²	144	134 Å²	134	77%	0.77	78%	0.779	S	S	*	*			cis	-142.6	145.2	19.1	-78	-67.5	0	0	0	110.1
1278	S	33.1	Very low	31.8	Very low	104 Å²	104	133.8 Å²	133.8	73%	0.727	78%	0.777	S	S	*	*				88	93.8	52.1	-164.7	0	0	0	0	115.9
1279	I	35	Very low	31.8	Very low	176 Å²	176	133.7 Å²	133.7	90%	0.903	78%	0.782	S	S	*	*			trans	-142.3	146.6	136.3	-70.4	-162.7	0	0	0	108.4
1280	R	29.2	Very low	31.8	Very low	218 Å²	218	133.8 Å²	133.8	82%	0.823	78%	0.782	S	S	*	*			trans	-133.6	143.6	-168.9	-177.8	-172	-170.9	178.6	4.4	111.6
1281	N	32.4	Very low	31.7	Very low	153 Å²	153	131.7 Å²	131.7	82%	0.818	78%	0.784	S	S	*	*			trans	148.4	126	151.7	-73.8	-18.6	0	0	0	107.1
1282	G	28.5	Very low	31.7	Very low	66 Å²	66	133.3 Å²	133.3	68%	0.68	79%	0.79	S	S	*	*			cis	92	120	45.6	0	0	0	0	0	108.3
1283	L	29.7	Very low	31.7	Very low	167 Å²	167	131.9 Å²	131.9	87%	0.874	78%	0.78	S	S	*	*			cis	-154	151.3	28.1	-71.5	120.7	0	0	0	113.6
1284	V	30.8	Very low	31.9	Very low	136 Å²	136	130.8 Å²	130.8	82%	0.824	78%	0.78	S	S	*	*			trans	3.1	126.9	131.5	-177.4	0	0	0	0	118.7
1285	S	36.6	Very low	32	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	78%	0.78	S	S	*	*			trans	-73	169.3	171.3	-22.7	0	0	0	0	113.7
1286	P	42.2	Very low	31.9	Very low	116 Å²	116	133.1 Å²	133.1	75%	0.753	78%	0.778	S	S	*	*				-154.8	169.6	72.6	41.5	-20.6	0	0	0	118.7
1287	S	32.8	Very low	32	Very low	104 Å²	104	135.7 Å²	135.7	73%	0.727	78%	0.784	S	S	*	*			trans	7.5	147.6	151.9	60.5	0	0	0	0	121
1288	S	30.3	Very low	32.2	Very low	105 Å²	105	136 Å²	136	73%	0.734	78%	0.781	S	S	*	*			cis	173.7	152.3	1.3	48.6	0	0	0	0	108.5
1289	V	30.2	Very low	32.3	Very low	147 Å²	147	141 Å²	141	89%	0.891	78%	0.784	S	S	*	*			trans	-162.9	145.6	143.4	158.7	0	0	0	0	109.8
1290	S	28.1	Very low	32.6	Very low	98 Å²	98	138.8 Å²	138.8	69%	0.685	77%	0.774	S	S	*	*			trans	-84	159.9	-177	53.9	0	0	0	0	116
1291	C	27.5	Very low	33	Very low	133 Å²	133	140.6 Å²	140.6	90%	0.899	78%	0.781	S	S	*	*			trans	-128.6	120.1	152	-69.5	0	0	0	0	111.8
1292	T	30.2	Very low	33.5	Very low	132 Å²	132	140 Å²	140	81%	0.81	78%	0.782	S	S	*	*			trans	-111.2	158.6	151	57.5	0	0	0	0	105.7
1293	S	30.6	Very low	34.3	Very low	99 Å²	99	145.9 Å²	145.9	69%	0.692	81%	0.813	S	S	*	*			cis	-169.7	164.4	27.2	52.1	0	0	0	0	109
1294	D	33.4	Very low	34.5	Very low	160 Å²	160	144.8 Å²	144.8	86%	0.856	81%	0.81	S	S	*	*			trans	-156.9	172.6	132.6	-123.3	-32.3	0	0	0	115.5
1295	R	32.7	Very low	34.7	Very low	210 Å²	210	145.3 Å²	145.3	79%	0.792	81%	0.809	S	S	*	*			trans	-106.8	157.2	-152.9	-78	167.4	152.5	167.8	-6.3	117.7
1296	N	31.6	Very low	34.6	Very low	134 Å²	134	147.5 Å²	147.5	72%	0.717	81%	0.813	S	S	*	*			trans	58.7	119.9	144.4	-64.6	-9.6	0	0	0	121.3
1297	N	34	Very low	34.1	Very low	142 Å²	142	149.4 Å²	149.4	76%	0.759	82%	0.817	S	S	*	*				-170.9	148.1	102.1	-105.7	-21.2	0	0	0	117
1298	H	36.5	Very low	34.2	Very low	151 Å²	151	152.2 Å²	152.2	70%	0.699	82%	0.822	S	S	*	*			trans	53.2	102.5	154.4	-69.2	-44.4	0	0	0	125.4
1299	R	35.4	Very low	34.5	Very low	209 Å²	209	155.3 Å²	155.3	79%	0.789	83%	0.828	S	S	*	*				46.3	126.7	107.1	-83.2	-170.9	171.3	159.7	0.9	123.1
1300	D	40.9	Very low	34.8	Very low	130 Å²	130	155.9 Å²	155.9	70%	0.695	82%	0.824	S	S	*	*				64.3	112.3	129	-50.7	-21.6	0	0	0	122
1301	R	39.1	Very low	35.3	Very low	256 Å²	256	160.4 Å²	160.4	97%	0.966	83%	0.834	S	S	*	*				-154.7	155.9	108.4	-115.6	177.6	-178.3	-178.5	0.6	113.7
1302	V	42.7	Very low	35.9	Very low	140 Å²	140	162.7 Å²	162.7	85%	0.848	83%	0.829	S	S	*	*			trans	-112.2	136.6	-168.7	171	0	0	0	0	111
1303	S	44	Very low	36.5	Very low	189 Å²	189	165.5 Å²	165.5	100%	1.322	83%	0.83	S	S	*	*			trans	-164.7	0	145.3	61.9	0	0	0	0	110.1

Retrieved 1,303 of 1,303 residues in 1019.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).